data_4KQA # _entry.id 4KQA # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4KQA RCSB RCSB079659 WWPDB D_1000079659 # _pdbx_database_related.db_name PDB _pdbx_database_related.db_id 4KQB _pdbx_database_related.details . _pdbx_database_related.content_type unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 4KQA _pdbx_database_status.recvd_initial_deposition_date 2013-05-14 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # _audit_author.name 'Xiao, J.' _audit_author.pdbx_ordinal 1 # _citation.id primary _citation.title 'Crystal structure of the Golgi casein kinase.' _citation.journal_abbrev Proc.Natl.Acad.Sci.USA _citation.journal_volume 110 _citation.page_first 10574 _citation.page_last 10579 _citation.year 2013 _citation.journal_id_ASTM PNASA6 _citation.country US _citation.journal_id_ISSN 0027-8424 _citation.journal_id_CSD 0040 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 23754375 _citation.pdbx_database_id_DOI 10.1073/pnas.1309211110 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Xiao, J.' 1 primary 'Tagliabracci, V.S.' 2 primary 'Wen, J.' 3 primary 'Kim, S.A.' 4 primary 'Dixon, J.E.' 5 # _cell.entry_id 4KQA _cell.length_a 78.786 _cell.length_b 157.306 _cell.length_c 168.761 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 16 _cell.pdbx_unique_axis ? # _symmetry.entry_id 4KQA _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 19 # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man 'Protein H03A11.1' 53487.758 4 ? ? ? ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 16 ? ? ? ? 3 non-polymer man BETA-D-MANNOSE 180.156 4 ? ? ? ? 4 non-polymer syn 'NICKEL (II) ION' 58.693 2 ? ? ? ? 5 water nat water 18.015 271 ? ? ? ? # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer yes _entity_poly.pdbx_seq_one_letter_code ;SLPHQPIPPSLGEKDLSDPFNFLFSSNKITLRKLYDLTKNVDFDQLRQNECKKNITLSKFWEKSEQRNVPEDDNWERFYS NIGSCSVYSDDQ(MSE)IDNLLHDLNTSPIKHVHI(MSE)DGGTQVKFVFTFKNDKQAVFKP(MSE)RFGRDYESDPNHF YFSDFERHHAEIATFHLDRVLGFRRAIPTVGRVLN(MSE)TTELFEKAEKKLKKTFFFSPAKNFCFVSRCDYYCDTTHAI CGLPD(MSE)KEGSVQVFLPDESAVPRKHNRSPYRRTYSKKNQVAEWQSS(MSE)NYCTDKVKTKRQYAHGRRLLDLVDI HILDYLIGNQDRHHFESFNVFNDLPSYAIHLDHGRAFGRSDFDDDDIILPLRQCCILRPSTFQTL(MSE)NFYSTPKSLT KALHESLSKDPAHPILAYKHYPA(MSE)ERRLAKI(MSE)SHILECFESRGVAEVLVAEYNNPDVSDAEQNDEEQSEEHQ DKKDDKKTV ; _entity_poly.pdbx_seq_one_letter_code_can ;SLPHQPIPPSLGEKDLSDPFNFLFSSNKITLRKLYDLTKNVDFDQLRQNECKKNITLSKFWEKSEQRNVPEDDNWERFYS NIGSCSVYSDDQMIDNLLHDLNTSPIKHVHIMDGGTQVKFVFTFKNDKQAVFKPMRFGRDYESDPNHFYFSDFERHHAEI ATFHLDRVLGFRRAIPTVGRVLNMTTELFEKAEKKLKKTFFFSPAKNFCFVSRCDYYCDTTHAICGLPDMKEGSVQVFLP DESAVPRKHNRSPYRRTYSKKNQVAEWQSSMNYCTDKVKTKRQYAHGRRLLDLVDIHILDYLIGNQDRHHFESFNVFNDL PSYAIHLDHGRAFGRSDFDDDDIILPLRQCCILRPSTFQTLMNFYSTPKSLTKALHESLSKDPAHPILAYKHYPAMERRL AKIMSHILECFESRGVAEVLVAEYNNPDVSDAEQNDEEQSEEHQDKKDDKKTV ; _entity_poly.pdbx_strand_id A,B,C,D _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 SER n 1 2 LEU n 1 3 PRO n 1 4 HIS n 1 5 GLN n 1 6 PRO n 1 7 ILE n 1 8 PRO n 1 9 PRO n 1 10 SER n 1 11 LEU n 1 12 GLY n 1 13 GLU n 1 14 LYS n 1 15 ASP n 1 16 LEU n 1 17 SER n 1 18 ASP n 1 19 PRO n 1 20 PHE n 1 21 ASN n 1 22 PHE n 1 23 LEU n 1 24 PHE n 1 25 SER n 1 26 SER n 1 27 ASN n 1 28 LYS n 1 29 ILE n 1 30 THR n 1 31 LEU n 1 32 ARG n 1 33 LYS n 1 34 LEU n 1 35 TYR n 1 36 ASP n 1 37 LEU n 1 38 THR n 1 39 LYS n 1 40 ASN n 1 41 VAL n 1 42 ASP n 1 43 PHE n 1 44 ASP n 1 45 GLN n 1 46 LEU n 1 47 ARG n 1 48 GLN n 1 49 ASN n 1 50 GLU n 1 51 CYS n 1 52 LYS n 1 53 LYS n 1 54 ASN n 1 55 ILE n 1 56 THR n 1 57 LEU n 1 58 SER n 1 59 LYS n 1 60 PHE n 1 61 TRP n 1 62 GLU n 1 63 LYS n 1 64 SER n 1 65 GLU n 1 66 GLN n 1 67 ARG n 1 68 ASN n 1 69 VAL n 1 70 PRO n 1 71 GLU n 1 72 ASP n 1 73 ASP n 1 74 ASN n 1 75 TRP n 1 76 GLU n 1 77 ARG n 1 78 PHE n 1 79 TYR n 1 80 SER n 1 81 ASN n 1 82 ILE n 1 83 GLY n 1 84 SER n 1 85 CYS n 1 86 SER n 1 87 VAL n 1 88 TYR n 1 89 SER n 1 90 ASP n 1 91 ASP n 1 92 GLN n 1 93 MSE n 1 94 ILE n 1 95 ASP n 1 96 ASN n 1 97 LEU n 1 98 LEU n 1 99 HIS n 1 100 ASP n 1 101 LEU n 1 102 ASN n 1 103 THR n 1 104 SER n 1 105 PRO n 1 106 ILE n 1 107 LYS n 1 108 HIS n 1 109 VAL n 1 110 HIS n 1 111 ILE n 1 112 MSE n 1 113 ASP n 1 114 GLY n 1 115 GLY n 1 116 THR n 1 117 GLN n 1 118 VAL n 1 119 LYS n 1 120 PHE n 1 121 VAL n 1 122 PHE n 1 123 THR n 1 124 PHE n 1 125 LYS n 1 126 ASN n 1 127 ASP n 1 128 LYS n 1 129 GLN n 1 130 ALA n 1 131 VAL n 1 132 PHE n 1 133 LYS n 1 134 PRO n 1 135 MSE n 1 136 ARG n 1 137 PHE n 1 138 GLY n 1 139 ARG n 1 140 ASP n 1 141 TYR n 1 142 GLU n 1 143 SER n 1 144 ASP n 1 145 PRO n 1 146 ASN n 1 147 HIS n 1 148 PHE n 1 149 TYR n 1 150 PHE n 1 151 SER n 1 152 ASP n 1 153 PHE n 1 154 GLU n 1 155 ARG n 1 156 HIS n 1 157 HIS n 1 158 ALA n 1 159 GLU n 1 160 ILE n 1 161 ALA n 1 162 THR n 1 163 PHE n 1 164 HIS n 1 165 LEU n 1 166 ASP n 1 167 ARG n 1 168 VAL n 1 169 LEU n 1 170 GLY n 1 171 PHE n 1 172 ARG n 1 173 ARG n 1 174 ALA n 1 175 ILE n 1 176 PRO n 1 177 THR n 1 178 VAL n 1 179 GLY n 1 180 ARG n 1 181 VAL n 1 182 LEU n 1 183 ASN n 1 184 MSE n 1 185 THR n 1 186 THR n 1 187 GLU n 1 188 LEU n 1 189 PHE n 1 190 GLU n 1 191 LYS n 1 192 ALA n 1 193 GLU n 1 194 LYS n 1 195 LYS n 1 196 LEU n 1 197 LYS n 1 198 LYS n 1 199 THR n 1 200 PHE n 1 201 PHE n 1 202 PHE n 1 203 SER n 1 204 PRO n 1 205 ALA n 1 206 LYS n 1 207 ASN n 1 208 PHE n 1 209 CYS n 1 210 PHE n 1 211 VAL n 1 212 SER n 1 213 ARG n 1 214 CYS n 1 215 ASP n 1 216 TYR n 1 217 TYR n 1 218 CYS n 1 219 ASP n 1 220 THR n 1 221 THR n 1 222 HIS n 1 223 ALA n 1 224 ILE n 1 225 CYS n 1 226 GLY n 1 227 LEU n 1 228 PRO n 1 229 ASP n 1 230 MSE n 1 231 LYS n 1 232 GLU n 1 233 GLY n 1 234 SER n 1 235 VAL n 1 236 GLN n 1 237 VAL n 1 238 PHE n 1 239 LEU n 1 240 PRO n 1 241 ASP n 1 242 GLU n 1 243 SER n 1 244 ALA n 1 245 VAL n 1 246 PRO n 1 247 ARG n 1 248 LYS n 1 249 HIS n 1 250 ASN n 1 251 ARG n 1 252 SER n 1 253 PRO n 1 254 TYR n 1 255 ARG n 1 256 ARG n 1 257 THR n 1 258 TYR n 1 259 SER n 1 260 LYS n 1 261 LYS n 1 262 ASN n 1 263 GLN n 1 264 VAL n 1 265 ALA n 1 266 GLU n 1 267 TRP n 1 268 GLN n 1 269 SER n 1 270 SER n 1 271 MSE n 1 272 ASN n 1 273 TYR n 1 274 CYS n 1 275 THR n 1 276 ASP n 1 277 LYS n 1 278 VAL n 1 279 LYS n 1 280 THR n 1 281 LYS n 1 282 ARG n 1 283 GLN n 1 284 TYR n 1 285 ALA n 1 286 HIS n 1 287 GLY n 1 288 ARG n 1 289 ARG n 1 290 LEU n 1 291 LEU n 1 292 ASP n 1 293 LEU n 1 294 VAL n 1 295 ASP n 1 296 ILE n 1 297 HIS n 1 298 ILE n 1 299 LEU n 1 300 ASP n 1 301 TYR n 1 302 LEU n 1 303 ILE n 1 304 GLY n 1 305 ASN n 1 306 GLN n 1 307 ASP n 1 308 ARG n 1 309 HIS n 1 310 HIS n 1 311 PHE n 1 312 GLU n 1 313 SER n 1 314 PHE n 1 315 ASN n 1 316 VAL n 1 317 PHE n 1 318 ASN n 1 319 ASP n 1 320 LEU n 1 321 PRO n 1 322 SER n 1 323 TYR n 1 324 ALA n 1 325 ILE n 1 326 HIS n 1 327 LEU n 1 328 ASP n 1 329 HIS n 1 330 GLY n 1 331 ARG n 1 332 ALA n 1 333 PHE n 1 334 GLY n 1 335 ARG n 1 336 SER n 1 337 ASP n 1 338 PHE n 1 339 ASP n 1 340 ASP n 1 341 ASP n 1 342 ASP n 1 343 ILE n 1 344 ILE n 1 345 LEU n 1 346 PRO n 1 347 LEU n 1 348 ARG n 1 349 GLN n 1 350 CYS n 1 351 CYS n 1 352 ILE n 1 353 LEU n 1 354 ARG n 1 355 PRO n 1 356 SER n 1 357 THR n 1 358 PHE n 1 359 GLN n 1 360 THR n 1 361 LEU n 1 362 MSE n 1 363 ASN n 1 364 PHE n 1 365 TYR n 1 366 SER n 1 367 THR n 1 368 PRO n 1 369 LYS n 1 370 SER n 1 371 LEU n 1 372 THR n 1 373 LYS n 1 374 ALA n 1 375 LEU n 1 376 HIS n 1 377 GLU n 1 378 SER n 1 379 LEU n 1 380 SER n 1 381 LYS n 1 382 ASP n 1 383 PRO n 1 384 ALA n 1 385 HIS n 1 386 PRO n 1 387 ILE n 1 388 LEU n 1 389 ALA n 1 390 TYR n 1 391 LYS n 1 392 HIS n 1 393 TYR n 1 394 PRO n 1 395 ALA n 1 396 MSE n 1 397 GLU n 1 398 ARG n 1 399 ARG n 1 400 LEU n 1 401 ALA n 1 402 LYS n 1 403 ILE n 1 404 MSE n 1 405 SER n 1 406 HIS n 1 407 ILE n 1 408 LEU n 1 409 GLU n 1 410 CYS n 1 411 PHE n 1 412 GLU n 1 413 SER n 1 414 ARG n 1 415 GLY n 1 416 VAL n 1 417 ALA n 1 418 GLU n 1 419 VAL n 1 420 LEU n 1 421 VAL n 1 422 ALA n 1 423 GLU n 1 424 TYR n 1 425 ASN n 1 426 ASN n 1 427 PRO n 1 428 ASP n 1 429 VAL n 1 430 SER n 1 431 ASP n 1 432 ALA n 1 433 GLU n 1 434 GLN n 1 435 ASN n 1 436 ASP n 1 437 GLU n 1 438 GLU n 1 439 GLN n 1 440 SER n 1 441 GLU n 1 442 GLU n 1 443 HIS n 1 444 GLN n 1 445 ASP n 1 446 LYS n 1 447 LYS n 1 448 ASP n 1 449 ASP n 1 450 LYS n 1 451 LYS n 1 452 THR n 1 453 VAL n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name nematode _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene 'CELE_H03A11.1, H03A11.1' _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Caenorhabditis elegans' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 6239 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name 'Trichoplusia ni' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 7111 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code Q9XTW2_CAEEL _struct_ref.pdbx_db_accession Q9XTW2 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;SLPHQPIPPSLGEKDLSDPFNFLFSSNKITLRKLYDLTKNVDFDQLRQNECKKNITLSKFWEKSEQRNVPEDDNWERFYS NIGSCSVYSDDQMIDNLLHDLNTSPIKHVHIMDGGTQVKFVFTFKNDKQAVFKPMRFGRDYESDPNHFYFSDFERHHAEI ATFHLDRVLGFRRAIPTVGRVLNMTTELFEKAEKKLKKTFFFSPAKNFCFVSRCDYYCDTTHAICGLPDMKEGSVQVFLP DESAVPRKHNRSPYRRTYSKKNQVAEWQSSMNYCTDKVKTKRQYAHGRRLLDLVDIHILDYLIGNQDRHHFESFNVFNDL PSYAIHLDHGRAFGRSDFDDDDIILPLRQCCILRPSTFQTLMNFYSTPKSLTKALHESLSKDPAHPILAYKHYPAMERRL AKIMSHILECFESRGVAEVLVAEYNNPDVSDAEQNDEEQSEEHQDKKDDKKTV ; _struct_ref.pdbx_align_begin 60 _struct_ref.pdbx_db_isoform ? # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 4KQA A 1 ? 453 ? Q9XTW2 60 ? 512 ? 60 512 2 1 4KQA B 1 ? 453 ? Q9XTW2 60 ? 512 ? 60 512 3 1 4KQA C 1 ? 453 ? Q9XTW2 60 ? 512 ? 60 512 4 1 4KQA D 1 ? 453 ? Q9XTW2 60 ? 512 ? 60 512 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 BMA D-saccharide . BETA-D-MANNOSE ? 'C6 H12 O6' 180.156 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MSE 'L-peptide linking' n SELENOMETHIONINE ? 'C5 H11 N O2 Se' 196.106 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 NI non-polymer . 'NICKEL (II) ION' ? 'Ni 2' 58.693 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 4KQA _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 2.44 _exptl_crystal.density_percent_sol 49.67 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 7.5 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details '12% PEG4000, 200 mM imidazole-malate (4:1), 3 mM NiCl2, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K' # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'ADSC QUANTUM 315r' _diffrn_detector.pdbx_collection_date 2013-01-27 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'Double crystal, Si(111)' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.979 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'ALS BEAMLINE 8.2.1' _diffrn_source.pdbx_synchrotron_site ALS _diffrn_source.pdbx_synchrotron_beamline 8.2.1 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 0.979 # _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 4KQA _reflns.observed_criterion_sigma_I ? _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 46.464 _reflns.d_resolution_high 2.6 _reflns.number_obs 64299 _reflns.number_all ? _reflns.percent_possible_obs ? _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI ? _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy ? _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 4KQA _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.ls_number_reflns_obs ? _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.36 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 46.464 _refine.ls_d_res_high 2.603 _refine.ls_percent_reflns_obs 98.40 _refine.ls_R_factor_obs 0.2187 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.2168 _refine.ls_R_factor_R_free 0.2537 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.02 _refine.ls_number_reflns_R_free 6135 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean ? _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.11 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.90 _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct SAD _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.39 _refine.pdbx_overall_phase_error 27.27 _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 13850 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 270 _refine_hist.number_atoms_solvent 271 _refine_hist.number_atoms_total 14391 _refine_hist.d_res_high 2.603 _refine_hist.d_res_low 46.464 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function f_bond_d 0.002 ? ? 14534 'X-RAY DIFFRACTION' ? f_angle_d 0.710 ? ? 19576 'X-RAY DIFFRACTION' ? f_dihedral_angle_d 12.814 ? ? 5434 'X-RAY DIFFRACTION' ? f_chiral_restr 0.030 ? ? 2091 'X-RAY DIFFRACTION' ? f_plane_restr 0.004 ? ? 2525 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_restr_ncs.dom_id _refine_ls_restr_ncs.pdbx_auth_asym_id _refine_ls_restr_ncs.pdbx_number _refine_ls_restr_ncs.rms_dev_position _refine_ls_restr_ncs.weight_position _refine_ls_restr_ncs.pdbx_type _refine_ls_restr_ncs.pdbx_ens_id _refine_ls_restr_ncs.pdbx_ordinal _refine_ls_restr_ncs.pdbx_refine_id _refine_ls_restr_ncs.ncs_model_details _refine_ls_restr_ncs.rms_dev_B_iso _refine_ls_restr_ncs.weight_B_iso 1 D ? ? ? POSITIONAL 1 1 'X-RAY DIFFRACTION' ? ? ? 2 D ? ? ? POSITIONAL 1 2 'X-RAY DIFFRACTION' ? ? ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.number_reflns_obs 'X-RAY DIFFRACTION' . 2.6027 2.6323 3574 0.3067 91.00 0.3216 . . 203 . . . . 'X-RAY DIFFRACTION' . 2.6323 2.6633 3758 0.2946 96.00 0.3264 . . 189 . . . . 'X-RAY DIFFRACTION' . 2.6633 2.6958 3756 0.2799 97.00 0.3535 . . 208 . . . . 'X-RAY DIFFRACTION' . 2.6958 2.7299 3889 0.2794 97.00 0.3216 . . 207 . . . . 'X-RAY DIFFRACTION' . 2.7299 2.7658 3820 0.2619 98.00 0.3531 . . 189 . . . . 'X-RAY DIFFRACTION' . 2.7658 2.8037 3865 0.2482 99.00 0.2900 . . 230 . . . . 'X-RAY DIFFRACTION' . 2.8037 2.8437 3847 0.2529 98.00 0.2999 . . 201 . . . . 'X-RAY DIFFRACTION' . 2.8437 2.8862 3926 0.2514 99.00 0.3097 . . 188 . . . . 'X-RAY DIFFRACTION' . 2.8862 2.9313 3918 0.2450 98.00 0.2800 . . 208 . . . . 'X-RAY DIFFRACTION' . 2.9313 2.9793 3842 0.2527 99.00 0.3140 . . 195 . . . . 'X-RAY DIFFRACTION' . 2.9793 3.0307 3870 0.2483 98.00 0.2626 . . 232 . . . . 'X-RAY DIFFRACTION' . 3.0307 3.0858 3883 0.2439 99.00 0.3023 . . 194 . . . . 'X-RAY DIFFRACTION' . 3.0858 3.1451 3891 0.2495 99.00 0.3030 . . 215 . . . . 'X-RAY DIFFRACTION' . 3.1451 3.2093 3860 0.2518 99.00 0.2982 . . 202 . . . . 'X-RAY DIFFRACTION' . 3.2093 3.2791 3897 0.2533 99.00 0.2911 . . 204 . . . . 'X-RAY DIFFRACTION' . 3.2791 3.3553 3863 0.2437 99.00 0.3212 . . 187 . . . . 'X-RAY DIFFRACTION' . 3.3553 3.4392 3914 0.2503 99.00 0.2927 . . 225 . . . . 'X-RAY DIFFRACTION' . 3.4392 3.5322 3873 0.2387 99.00 0.3157 . . 196 . . . . 'X-RAY DIFFRACTION' . 3.5322 3.6361 3905 0.2078 99.00 0.2328 . . 193 . . . . 'X-RAY DIFFRACTION' . 3.6361 3.7534 3933 0.2205 99.00 0.2734 . . 219 . . . . 'X-RAY DIFFRACTION' . 3.7534 3.8874 3910 0.1947 100.00 0.2510 . . 187 . . . . 'X-RAY DIFFRACTION' . 3.8874 4.0430 3896 0.1900 99.00 0.1940 . . 234 . . . . 'X-RAY DIFFRACTION' . 4.0430 4.2269 3913 0.1782 99.00 0.2175 . . 194 . . . . 'X-RAY DIFFRACTION' . 4.2269 4.4496 3931 0.1838 99.00 0.2334 . . 188 . . . . 'X-RAY DIFFRACTION' . 4.4496 4.7281 3885 0.1816 100.00 0.2156 . . 207 . . . . 'X-RAY DIFFRACTION' . 4.7281 5.0928 3926 0.1922 99.00 0.2288 . . 212 . . . . 'X-RAY DIFFRACTION' . 5.0928 5.6045 3916 0.1946 99.00 0.2191 . . 199 . . . . 'X-RAY DIFFRACTION' . 5.6045 6.4137 3903 0.2074 99.00 0.2171 . . 213 . . . . 'X-RAY DIFFRACTION' . 6.4137 8.0736 3874 0.2182 99.00 0.2170 . . 210 . . . . 'X-RAY DIFFRACTION' . 8.0736 46.4714 3888 0.1982 99.00 0.2219 . . 206 . . . . # loop_ _struct_ncs_dom.id _struct_ncs_dom.details _struct_ncs_dom.pdbx_ens_id 1 ? 1 2 ? 1 # _struct_ncs_dom_lim.dom_id 2 _struct_ncs_dom_lim.beg_auth_asym_id ? _struct_ncs_dom_lim.beg_auth_seq_id ? _struct_ncs_dom_lim.end_auth_asym_id ? _struct_ncs_dom_lim.end_auth_seq_id ? _struct_ncs_dom_lim.pdbx_component_id 1 _struct_ncs_dom_lim.pdbx_refine_code ? _struct_ncs_dom_lim.beg_label_asym_id ? _struct_ncs_dom_lim.beg_label_comp_id ? _struct_ncs_dom_lim.beg_label_seq_id ? _struct_ncs_dom_lim.beg_label_alt_id ? _struct_ncs_dom_lim.end_label_asym_id ? _struct_ncs_dom_lim.end_label_comp_id ? _struct_ncs_dom_lim.end_label_seq_id ? _struct_ncs_dom_lim.end_label_alt_id ? _struct_ncs_dom_lim.pdbx_ens_id 1 _struct_ncs_dom_lim.selection_details ;chain 'D' RESTRAINED TORSIONS: 7827 Histogram of differences under limit: 0.000 - 1.500: 7246 1.500 - 3.000: 332 3.000 - 4.500: 64 4.500 - 6.000: 18 6.000 - 7.500: 7 7.500 - 9.000: 4 9.000 - 10.500: 2 10.500 - 12.000: 1 12.000 - 13.500: 3 13.500 - 15.000: 1 Histogram of differences over limit: 15.000 - 31.300: 6 31.300 - 47.600: 38 47.600 - 63.900: 20 63.900 - 80.200: 5 80.200 - 96.500: 29 96.500 - 112.800: 14 112.800 - 129.100: 9 129.100 - 145.400: 11 145.400 - 161.700: 4 161.700 - 178.000: 13 ; # _struct_ncs_ens.id 1 _struct_ncs_ens.details ? # _struct.entry_id 4KQA _struct.title 'Crystal structure of the golgi casein kinase' _struct.pdbx_descriptor 'Protein H03A11.1' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 4KQA _struct_keywords.pdbx_keywords TRANSFERASE _struct_keywords.text 'secreted kinase, transferase' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 1 ? C N N 1 ? D N N 1 ? E N N 2 ? F N N 2 ? G N N 3 ? H N N 2 ? I N N 2 ? J N N 4 ? K N N 2 ? L N N 2 ? M N N 3 ? N N N 2 ? O N N 2 ? P N N 4 ? Q N N 2 ? R N N 2 ? S N N 3 ? T N N 2 ? U N N 2 ? V N N 2 ? W N N 2 ? X N N 3 ? Y N N 2 ? Z N N 2 ? AA N N 5 ? BA N N 5 ? CA N N 5 ? DA N N 5 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 PRO A 8 ? GLY A 12 ? PRO A 67 GLY A 71 5 ? 5 HELX_P HELX_P2 2 ASN A 27 ? LEU A 37 ? ASN A 86 LEU A 96 1 ? 11 HELX_P HELX_P3 3 ASP A 42 ? GLN A 48 ? ASP A 101 GLN A 107 1 ? 7 HELX_P HELX_P4 4 THR A 56 ? GLU A 62 ? THR A 115 GLU A 121 1 ? 7 HELX_P HELX_P5 5 ASP A 73 ? ASN A 81 ? ASP A 132 ASN A 140 1 ? 9 HELX_P HELX_P6 6 ASP A 90 ? SER A 104 ? ASP A 149 SER A 163 1 ? 15 HELX_P HELX_P7 7 ARG A 155 ? LEU A 169 ? ARG A 214 LEU A 228 1 ? 15 HELX_P HELX_P8 8 GLU A 193 ? LYS A 198 ? GLU A 252 LYS A 257 1 ? 6 HELX_P HELX_P9 9 ALA A 265 ? SER A 270 ? ALA A 324 SER A 329 1 ? 6 HELX_P HELX_P10 10 ASN A 272 ? VAL A 278 ? ASN A 331 VAL A 337 1 ? 7 HELX_P HELX_P11 11 LYS A 281 ? ALA A 285 ? LYS A 340 ALA A 344 1 ? 5 HELX_P HELX_P12 12 ARG A 288 ? GLY A 304 ? ARG A 347 GLY A 363 1 ? 17 HELX_P HELX_P13 13 ILE A 344 ? CYS A 351 ? ILE A 403 CYS A 410 1 ? 8 HELX_P HELX_P14 14 ARG A 354 ? THR A 367 ? ARG A 413 THR A 426 1 ? 14 HELX_P HELX_P15 15 LYS A 369 ? SER A 380 ? LYS A 428 SER A 439 1 ? 12 HELX_P HELX_P16 16 LYS A 391 ? GLY A 415 ? LYS A 450 GLY A 474 1 ? 25 HELX_P HELX_P17 17 GLY A 415 ? LEU A 420 ? GLY A 474 LEU A 479 1 ? 6 HELX_P HELX_P18 18 PRO B 8 ? GLY B 12 ? PRO B 67 GLY B 71 5 ? 5 HELX_P HELX_P19 19 ASN B 27 ? LEU B 37 ? ASN B 86 LEU B 96 1 ? 11 HELX_P HELX_P20 20 ASP B 42 ? GLN B 48 ? ASP B 101 GLN B 107 1 ? 7 HELX_P HELX_P21 21 THR B 56 ? GLU B 62 ? THR B 115 GLU B 121 1 ? 7 HELX_P HELX_P22 22 ASP B 73 ? ASN B 81 ? ASP B 132 ASN B 140 1 ? 9 HELX_P HELX_P23 23 ASP B 90 ? SER B 104 ? ASP B 149 SER B 163 1 ? 15 HELX_P HELX_P24 24 ARG B 155 ? LEU B 169 ? ARG B 214 LEU B 228 1 ? 15 HELX_P HELX_P25 25 GLU B 193 ? LYS B 198 ? GLU B 252 LYS B 257 1 ? 6 HELX_P HELX_P26 26 ALA B 265 ? SER B 270 ? ALA B 324 SER B 329 1 ? 6 HELX_P HELX_P27 27 ASN B 272 ? VAL B 278 ? ASN B 331 VAL B 337 1 ? 7 HELX_P HELX_P28 28 LYS B 281 ? ALA B 285 ? LYS B 340 ALA B 344 1 ? 5 HELX_P HELX_P29 29 ARG B 288 ? GLY B 304 ? ARG B 347 GLY B 363 1 ? 17 HELX_P HELX_P30 30 ILE B 344 ? CYS B 351 ? ILE B 403 CYS B 410 1 ? 8 HELX_P HELX_P31 31 ARG B 354 ? THR B 367 ? ARG B 413 THR B 426 1 ? 14 HELX_P HELX_P32 32 LYS B 369 ? LYS B 381 ? LYS B 428 LYS B 440 1 ? 13 HELX_P HELX_P33 33 LYS B 391 ? ARG B 414 ? LYS B 450 ARG B 473 1 ? 24 HELX_P HELX_P34 34 GLY B 415 ? LEU B 420 ? GLY B 474 LEU B 479 1 ? 6 HELX_P HELX_P35 35 PRO C 8 ? GLY C 12 ? PRO C 67 GLY C 71 5 ? 5 HELX_P HELX_P36 36 LYS C 28 ? LEU C 37 ? LYS C 87 LEU C 96 1 ? 10 HELX_P HELX_P37 37 ASP C 42 ? CYS C 51 ? ASP C 101 CYS C 110 1 ? 10 HELX_P HELX_P38 38 THR C 56 ? TRP C 61 ? THR C 115 TRP C 120 1 ? 6 HELX_P HELX_P39 39 ASP C 73 ? ASN C 81 ? ASP C 132 ASN C 140 1 ? 9 HELX_P HELX_P40 40 ASP C 90 ? SER C 104 ? ASP C 149 SER C 163 1 ? 15 HELX_P HELX_P41 41 ARG C 155 ? LEU C 169 ? ARG C 214 LEU C 228 1 ? 15 HELX_P HELX_P42 42 GLU C 193 ? LYS C 198 ? GLU C 252 LYS C 257 1 ? 6 HELX_P HELX_P43 43 ALA C 265 ? SER C 270 ? ALA C 324 SER C 329 1 ? 6 HELX_P HELX_P44 44 ASN C 272 ? VAL C 278 ? ASN C 331 VAL C 337 1 ? 7 HELX_P HELX_P45 45 LYS C 281 ? ALA C 285 ? LYS C 340 ALA C 344 1 ? 5 HELX_P HELX_P46 46 ARG C 288 ? GLY C 304 ? ARG C 347 GLY C 363 1 ? 17 HELX_P HELX_P47 47 ILE C 344 ? CYS C 351 ? ILE C 403 CYS C 410 1 ? 8 HELX_P HELX_P48 48 ARG C 354 ? SER C 366 ? ARG C 413 SER C 425 1 ? 13 HELX_P HELX_P49 49 LYS C 369 ? SER C 380 ? LYS C 428 SER C 439 1 ? 12 HELX_P HELX_P50 50 LYS C 391 ? GLY C 415 ? LYS C 450 GLY C 474 1 ? 25 HELX_P HELX_P51 51 GLY C 415 ? LEU C 420 ? GLY C 474 LEU C 479 1 ? 6 HELX_P HELX_P52 52 PRO D 8 ? GLY D 12 ? PRO D 67 GLY D 71 5 ? 5 HELX_P HELX_P53 53 ASN D 27 ? LEU D 37 ? ASN D 86 LEU D 96 1 ? 11 HELX_P HELX_P54 54 ASP D 42 ? GLN D 48 ? ASP D 101 GLN D 107 1 ? 7 HELX_P HELX_P55 55 ASP D 73 ? ASN D 81 ? ASP D 132 ASN D 140 1 ? 9 HELX_P HELX_P56 56 ASP D 90 ? SER D 104 ? ASP D 149 SER D 163 1 ? 15 HELX_P HELX_P57 57 ARG D 155 ? LEU D 169 ? ARG D 214 LEU D 228 1 ? 15 HELX_P HELX_P58 58 GLU D 193 ? LYS D 198 ? GLU D 252 LYS D 257 1 ? 6 HELX_P HELX_P59 59 ALA D 265 ? SER D 270 ? ALA D 324 SER D 329 1 ? 6 HELX_P HELX_P60 60 ASN D 272 ? VAL D 278 ? ASN D 331 VAL D 337 1 ? 7 HELX_P HELX_P61 61 ARG D 288 ? GLY D 304 ? ARG D 347 GLY D 363 1 ? 17 HELX_P HELX_P62 62 ILE D 344 ? CYS D 351 ? ILE D 403 CYS D 410 1 ? 8 HELX_P HELX_P63 63 ARG D 354 ? SER D 366 ? ARG D 413 SER D 425 1 ? 13 HELX_P HELX_P64 64 LYS D 369 ? LYS D 381 ? LYS D 428 LYS D 440 1 ? 13 HELX_P HELX_P65 65 LYS D 391 ? GLY D 415 ? LYS D 450 GLY D 474 1 ? 25 HELX_P HELX_P66 66 GLY D 415 ? LEU D 420 ? GLY D 474 LEU D 479 1 ? 6 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 51 SG ? ? ? 1_555 A CYS 85 SG ? ? A CYS 110 A CYS 144 1_555 ? ? ? ? ? ? ? 2.031 ? disulf2 disulf ? ? A CYS 209 SG ? ? ? 1_555 A CYS 225 SG ? ? A CYS 268 A CYS 284 1_555 ? ? ? ? ? ? ? 2.030 ? disulf3 disulf ? ? A CYS 214 SG ? ? ? 1_555 A CYS 218 SG ? ? A CYS 273 A CYS 277 1_555 ? ? ? ? ? ? ? 2.029 ? disulf4 disulf ? ? A CYS 274 SG ? ? ? 1_555 A CYS 350 SG ? ? A CYS 333 A CYS 409 1_555 ? ? ? ? ? ? ? 2.032 ? disulf5 disulf ? ? A CYS 351 SG ? ? ? 1_555 A CYS 410 SG ? ? A CYS 410 A CYS 469 1_555 ? ? ? ? ? ? ? 2.033 ? disulf6 disulf ? ? B CYS 51 SG ? ? ? 1_555 B CYS 85 SG ? ? B CYS 110 B CYS 144 1_555 ? ? ? ? ? ? ? 2.031 ? disulf7 disulf ? ? B CYS 209 SG ? ? ? 1_555 B CYS 225 SG ? ? B CYS 268 B CYS 284 1_555 ? ? ? ? ? ? ? 2.033 ? disulf8 disulf ? ? B CYS 214 SG ? ? ? 1_555 B CYS 218 SG ? ? B CYS 273 B CYS 277 1_555 ? ? ? ? ? ? ? 2.027 ? disulf9 disulf ? ? B CYS 274 SG ? ? ? 1_555 B CYS 350 SG ? ? B CYS 333 B CYS 409 1_555 ? ? ? ? ? ? ? 2.031 ? disulf10 disulf ? ? B CYS 351 SG ? ? ? 1_555 B CYS 410 SG ? ? B CYS 410 B CYS 469 1_555 ? ? ? ? ? ? ? 2.033 ? disulf11 disulf ? ? C CYS 51 SG ? ? ? 1_555 C CYS 85 SG ? ? C CYS 110 C CYS 144 1_555 ? ? ? ? ? ? ? 2.031 ? disulf12 disulf ? ? C CYS 209 SG ? ? ? 1_555 C CYS 225 SG ? ? C CYS 268 C CYS 284 1_555 ? ? ? ? ? ? ? 2.031 ? disulf13 disulf ? ? C CYS 214 SG ? ? ? 1_555 C CYS 218 SG ? ? C CYS 273 C CYS 277 1_555 ? ? ? ? ? ? ? 2.031 ? disulf14 disulf ? ? C CYS 274 SG ? ? ? 1_555 C CYS 350 SG ? ? C CYS 333 C CYS 409 1_555 ? ? ? ? ? ? ? 2.031 ? disulf15 disulf ? ? C CYS 351 SG ? ? ? 1_555 C CYS 410 SG ? ? C CYS 410 C CYS 469 1_555 ? ? ? ? ? ? ? 2.034 ? disulf16 disulf ? ? D CYS 51 SG ? ? ? 1_555 D CYS 85 SG ? ? D CYS 110 D CYS 144 1_555 ? ? ? ? ? ? ? 2.031 ? disulf17 disulf ? ? D CYS 209 SG ? ? ? 1_555 D CYS 225 SG ? ? D CYS 268 D CYS 284 1_555 ? ? ? ? ? ? ? 2.031 ? disulf18 disulf ? ? D CYS 214 SG ? ? ? 1_555 D CYS 218 SG ? ? D CYS 273 D CYS 277 1_555 ? ? ? ? ? ? ? 2.028 ? disulf19 disulf ? ? D CYS 274 SG ? ? ? 1_555 D CYS 350 SG ? ? D CYS 333 D CYS 409 1_555 ? ? ? ? ? ? ? 2.029 ? disulf20 disulf ? ? D CYS 351 SG ? ? ? 1_555 D CYS 410 SG ? ? D CYS 410 D CYS 469 1_555 ? ? ? ? ? ? ? 2.032 ? covale1 covale ? ? A GLN 92 C ? ? ? 1_555 A MSE 93 N ? ? A GLN 151 A MSE 152 1_555 ? ? ? ? ? ? ? 1.330 ? covale2 covale ? ? A MSE 93 C ? ? ? 1_555 A ILE 94 N ? ? A MSE 152 A ILE 153 1_555 ? ? ? ? ? ? ? 1.328 ? covale3 covale ? ? A ILE 111 C ? ? ? 1_555 A MSE 112 N ? ? A ILE 170 A MSE 171 1_555 ? ? ? ? ? ? ? 1.330 ? covale4 covale ? ? A MSE 112 C ? ? ? 1_555 A ASP 113 N ? ? A MSE 171 A ASP 172 1_555 ? ? ? ? ? ? ? 1.330 ? covale5 covale ? ? A PRO 134 C ? ? ? 1_555 A MSE 135 N ? ? A PRO 193 A MSE 194 1_555 ? ? ? ? ? ? ? 1.329 ? covale6 covale ? ? A MSE 135 C ? ? ? 1_555 A ARG 136 N ? ? A MSE 194 A ARG 195 1_555 ? ? ? ? ? ? ? 1.328 ? covale7 covale ? ? A ASN 183 C ? ? ? 1_555 A MSE 184 N ? ? A ASN 242 A MSE 243 1_555 ? ? ? ? ? ? ? 1.330 ? covale8 covale ? ? A MSE 184 C ? ? ? 1_555 A THR 185 N ? ? A MSE 243 A THR 244 1_555 ? ? ? ? ? ? ? 1.328 ? covale9 covale ? ? A ASP 229 C ? ? ? 1_555 A MSE 230 N ? ? A ASP 288 A MSE 289 1_555 ? ? ? ? ? ? ? 1.329 ? covale10 covale ? ? A MSE 230 C ? ? ? 1_555 A LYS 231 N ? ? A MSE 289 A LYS 290 1_555 ? ? ? ? ? ? ? 1.328 ? covale11 covale ? ? A SER 270 C ? ? ? 1_555 A MSE 271 N ? ? A SER 329 A MSE 330 1_555 ? ? ? ? ? ? ? 1.328 ? covale12 covale ? ? A MSE 271 C ? ? ? 1_555 A ASN 272 N ? ? A MSE 330 A ASN 331 1_555 ? ? ? ? ? ? ? 1.330 ? covale13 covale ? ? A LEU 361 C ? ? ? 1_555 A MSE 362 N ? ? A LEU 420 A MSE 421 1_555 ? ? ? ? ? ? ? 1.331 ? covale14 covale ? ? A MSE 362 C ? ? ? 1_555 A ASN 363 N ? ? A MSE 421 A ASN 422 1_555 ? ? ? ? ? ? ? 1.329 ? covale15 covale ? ? A ALA 395 C ? ? ? 1_555 A MSE 396 N ? ? A ALA 454 A MSE 455 1_555 ? ? ? ? ? ? ? 1.330 ? covale16 covale ? ? A MSE 396 C ? ? ? 1_555 A GLU 397 N ? ? A MSE 455 A GLU 456 1_555 ? ? ? ? ? ? ? 1.329 ? covale17 covale ? ? A ILE 403 C ? ? ? 1_555 A MSE 404 N ? ? A ILE 462 A MSE 463 1_555 ? ? ? ? ? ? ? 1.330 ? covale18 covale ? ? A MSE 404 C ? ? ? 1_555 A SER 405 N ? ? A MSE 463 A SER 464 1_555 ? ? ? ? ? ? ? 1.329 ? covale19 covale ? ? B GLN 92 C ? ? ? 1_555 B MSE 93 N ? ? B GLN 151 B MSE 152 1_555 ? ? ? ? ? ? ? 1.329 ? covale20 covale ? ? B MSE 93 C ? ? ? 1_555 B ILE 94 N ? ? B MSE 152 B ILE 153 1_555 ? ? ? ? ? ? ? 1.329 ? covale21 covale ? ? B ILE 111 C ? ? ? 1_555 B MSE 112 N ? ? B ILE 170 B MSE 171 1_555 ? ? ? ? ? ? ? 1.330 ? covale22 covale ? ? B MSE 112 C ? ? ? 1_555 B ASP 113 N ? ? B MSE 171 B ASP 172 1_555 ? ? ? ? ? ? ? 1.329 ? covale23 covale ? ? B PRO 134 C ? ? ? 1_555 B MSE 135 N ? ? B PRO 193 B MSE 194 1_555 ? ? ? ? ? ? ? 1.329 ? covale24 covale ? ? B MSE 135 C ? ? ? 1_555 B ARG 136 N ? ? B MSE 194 B ARG 195 1_555 ? ? ? ? ? ? ? 1.329 ? covale25 covale ? ? B ASN 183 C ? ? ? 1_555 B MSE 184 N ? ? B ASN 242 B MSE 243 1_555 ? ? ? ? ? ? ? 1.329 ? covale26 covale ? ? B MSE 184 C ? ? ? 1_555 B THR 185 N ? ? B MSE 243 B THR 244 1_555 ? ? ? ? ? ? ? 1.328 ? covale27 covale ? ? B ASP 229 C ? ? ? 1_555 B MSE 230 N ? ? B ASP 288 B MSE 289 1_555 ? ? ? ? ? ? ? 1.328 ? covale28 covale ? ? B MSE 230 C ? ? ? 1_555 B LYS 231 N ? ? B MSE 289 B LYS 290 1_555 ? ? ? ? ? ? ? 1.327 ? covale29 covale ? ? B SER 270 C ? ? ? 1_555 B MSE 271 N ? ? B SER 329 B MSE 330 1_555 ? ? ? ? ? ? ? 1.330 ? covale30 covale ? ? B MSE 271 C ? ? ? 1_555 B ASN 272 N ? ? B MSE 330 B ASN 331 1_555 ? ? ? ? ? ? ? 1.328 ? covale31 covale ? ? B LEU 361 C ? ? ? 1_555 B MSE 362 N ? ? B LEU 420 B MSE 421 1_555 ? ? ? ? ? ? ? 1.331 ? covale32 covale ? ? B MSE 362 C ? ? ? 1_555 B ASN 363 N ? ? B MSE 421 B ASN 422 1_555 ? ? ? ? ? ? ? 1.331 ? covale33 covale ? ? B ALA 395 C ? ? ? 1_555 B MSE 396 N ? ? B ALA 454 B MSE 455 1_555 ? ? ? ? ? ? ? 1.329 ? covale34 covale ? ? B MSE 396 C ? ? ? 1_555 B GLU 397 N ? ? B MSE 455 B GLU 456 1_555 ? ? ? ? ? ? ? 1.329 ? covale35 covale ? ? B ILE 403 C ? ? ? 1_555 B MSE 404 N ? ? B ILE 462 B MSE 463 1_555 ? ? ? ? ? ? ? 1.330 ? covale36 covale ? ? B MSE 404 C ? ? ? 1_555 B SER 405 N ? ? B MSE 463 B SER 464 1_555 ? ? ? ? ? ? ? 1.330 ? covale37 covale ? ? C GLN 92 C ? ? ? 1_555 C MSE 93 N ? ? C GLN 151 C MSE 152 1_555 ? ? ? ? ? ? ? 1.330 ? covale38 covale ? ? C MSE 93 C ? ? ? 1_555 C ILE 94 N ? ? C MSE 152 C ILE 153 1_555 ? ? ? ? ? ? ? 1.330 ? covale39 covale ? ? C ILE 111 C ? ? ? 1_555 C MSE 112 N ? ? C ILE 170 C MSE 171 1_555 ? ? ? ? ? ? ? 1.329 ? covale40 covale ? ? C MSE 112 C ? ? ? 1_555 C ASP 113 N ? ? C MSE 171 C ASP 172 1_555 ? ? ? ? ? ? ? 1.330 ? covale41 covale ? ? C PRO 134 C ? ? ? 1_555 C MSE 135 N ? ? C PRO 193 C MSE 194 1_555 ? ? ? ? ? ? ? 1.330 ? covale42 covale ? ? C MSE 135 C ? ? ? 1_555 C ARG 136 N ? ? C MSE 194 C ARG 195 1_555 ? ? ? ? ? ? ? 1.329 ? covale43 covale ? ? C ASN 183 C ? ? ? 1_555 C MSE 184 N ? ? C ASN 242 C MSE 243 1_555 ? ? ? ? ? ? ? 1.329 ? covale44 covale ? ? C MSE 184 C ? ? ? 1_555 C THR 185 N ? ? C MSE 243 C THR 244 1_555 ? ? ? ? ? ? ? 1.329 ? covale45 covale ? ? C ASP 229 C ? ? ? 1_555 C MSE 230 N ? ? C ASP 288 C MSE 289 1_555 ? ? ? ? ? ? ? 1.327 ? covale46 covale ? ? C MSE 230 C ? ? ? 1_555 C LYS 231 N ? ? C MSE 289 C LYS 290 1_555 ? ? ? ? ? ? ? 1.327 ? covale47 covale ? ? C SER 270 C ? ? ? 1_555 C MSE 271 N ? ? C SER 329 C MSE 330 1_555 ? ? ? ? ? ? ? 1.330 ? covale48 covale ? ? C MSE 271 C ? ? ? 1_555 C ASN 272 N ? ? C MSE 330 C ASN 331 1_555 ? ? ? ? ? ? ? 1.328 ? covale49 covale ? ? C LEU 361 C ? ? ? 1_555 C MSE 362 N ? ? C LEU 420 C MSE 421 1_555 ? ? ? ? ? ? ? 1.329 ? covale50 covale ? ? C MSE 362 C ? ? ? 1_555 C ASN 363 N ? ? C MSE 421 C ASN 422 1_555 ? ? ? ? ? ? ? 1.328 ? covale51 covale ? ? C ALA 395 C ? ? ? 1_555 C MSE 396 N ? ? C ALA 454 C MSE 455 1_555 ? ? ? ? ? ? ? 1.330 ? covale52 covale ? ? C MSE 396 C ? ? ? 1_555 C GLU 397 N ? ? C MSE 455 C GLU 456 1_555 ? ? ? ? ? ? ? 1.330 ? covale53 covale ? ? C ILE 403 C ? ? ? 1_555 C MSE 404 N ? ? C ILE 462 C MSE 463 1_555 ? ? ? ? ? ? ? 1.330 ? covale54 covale ? ? C MSE 404 C ? ? ? 1_555 C SER 405 N ? ? C MSE 463 C SER 464 1_555 ? ? ? ? ? ? ? 1.329 ? covale55 covale ? ? D GLN 92 C ? ? ? 1_555 D MSE 93 N ? ? D GLN 151 D MSE 152 1_555 ? ? ? ? ? ? ? 1.330 ? covale56 covale ? ? D MSE 93 C ? ? ? 1_555 D ILE 94 N ? ? D MSE 152 D ILE 153 1_555 ? ? ? ? ? ? ? 1.329 ? covale57 covale ? ? D ILE 111 C ? ? ? 1_555 D MSE 112 N ? ? D ILE 170 D MSE 171 1_555 ? ? ? ? ? ? ? 1.328 ? covale58 covale ? ? D MSE 112 C ? ? ? 1_555 D ASP 113 N ? ? D MSE 171 D ASP 172 1_555 ? ? ? ? ? ? ? 1.330 ? covale59 covale ? ? D PRO 134 C ? ? ? 1_555 D MSE 135 N ? ? D PRO 193 D MSE 194 1_555 ? ? ? ? ? ? ? 1.329 ? covale60 covale ? ? D MSE 135 C ? ? ? 1_555 D ARG 136 N ? ? D MSE 194 D ARG 195 1_555 ? ? ? ? ? ? ? 1.328 ? covale61 covale ? ? D ASN 183 C ? ? ? 1_555 D MSE 184 N ? ? D ASN 242 D MSE 243 1_555 ? ? ? ? ? ? ? 1.329 ? covale62 covale ? ? D MSE 184 C ? ? ? 1_555 D THR 185 N ? ? D MSE 243 D THR 244 1_555 ? ? ? ? ? ? ? 1.327 ? covale63 covale ? ? D ASP 229 C ? ? ? 1_555 D MSE 230 N ? ? D ASP 288 D MSE 289 1_555 ? ? ? ? ? ? ? 1.329 ? covale64 covale ? ? D MSE 230 C ? ? ? 1_555 D LYS 231 N ? ? D MSE 289 D LYS 290 1_555 ? ? ? ? ? ? ? 1.328 ? covale65 covale ? ? D SER 270 C ? ? ? 1_555 D MSE 271 N ? ? D SER 329 D MSE 330 1_555 ? ? ? ? ? ? ? 1.330 ? covale66 covale ? ? D MSE 271 C ? ? ? 1_555 D ASN 272 N ? ? D MSE 330 D ASN 331 1_555 ? ? ? ? ? ? ? 1.330 ? covale67 covale ? ? D LEU 361 C ? ? ? 1_555 D MSE 362 N ? ? D LEU 420 D MSE 421 1_555 ? ? ? ? ? ? ? 1.330 ? covale68 covale ? ? D MSE 362 C ? ? ? 1_555 D ASN 363 N ? ? D MSE 421 D ASN 422 1_555 ? ? ? ? ? ? ? 1.330 ? covale69 covale ? ? D ALA 395 C ? ? ? 1_555 D MSE 396 N ? ? D ALA 454 D MSE 455 1_555 ? ? ? ? ? ? ? 1.328 ? covale70 covale ? ? D MSE 396 C ? ? ? 1_555 D GLU 397 N ? ? D MSE 455 D GLU 456 1_555 ? ? ? ? ? ? ? 1.328 ? covale71 covale ? ? D ILE 403 C ? ? ? 1_555 D MSE 404 N ? ? D ILE 462 D MSE 463 1_555 ? ? ? ? ? ? ? 1.331 ? covale72 covale ? ? D MSE 404 C ? ? ? 1_555 D SER 405 N ? ? D MSE 463 D SER 464 1_555 ? ? ? ? ? ? ? 1.329 ? covale73 covale ? ? C ASN 54 ND2 ? ? ? 1_555 Q NAG . C1 ? ? C ASN 113 C NAG 601 1_555 ? ? ? ? ? ? ? 1.374 ? covale74 covale ? ? R NAG . O4 ? ? ? 1_555 S BMA . C1 ? ? C NAG 602 C BMA 603 1_555 ? ? ? ? ? ? ? 1.382 ? covale75 covale ? ? C ASN 183 ND2 ? ? ? 1_555 T NAG . C1 ? ? C ASN 242 C NAG 604 1_555 ? ? ? ? ? ? ? 1.387 ? covale76 covale ? ? F NAG . O4 ? ? ? 1_555 G BMA . C1 ? ? A NAG 602 A BMA 603 1_555 ? ? ? ? ? ? ? 1.395 ? covale77 covale ? ? D ASN 54 ND2 ? ? ? 1_555 V NAG . C1 ? ? D ASN 113 D NAG 601 1_555 ? ? ? ? ? ? ? 1.395 ? covale78 covale ? ? A ASN 183 ND2 ? ? ? 1_555 H NAG . C1 ? ? A ASN 242 A NAG 604 1_555 ? ? ? ? ? ? ? 1.398 ? covale79 covale ? ? W NAG . O4 ? ? ? 1_555 X BMA . C1 ? ? D NAG 602 D BMA 603 1_555 ? ? ? ? ? ? ? 1.398 ? covale80 covale ? ? L NAG . O4 ? ? ? 1_555 M BMA . C1 ? ? B NAG 602 B BMA 603 1_555 ? ? ? ? ? ? ? 1.405 ? covale81 covale ? ? D ASN 183 ND2 ? ? ? 1_555 Y NAG . C1 ? ? D ASN 242 D NAG 604 1_555 ? ? ? ? ? ? ? 1.412 ? covale82 covale ? ? A ASN 54 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 113 A NAG 601 1_555 ? ? ? ? ? ? ? 1.420 ? covale83 covale ? ? B ASN 183 ND2 ? ? ? 1_555 N NAG . C1 ? ? B ASN 242 B NAG 604 1_555 ? ? ? ? ? ? ? 1.421 ? covale84 covale ? ? B ASN 54 ND2 ? ? ? 1_555 K NAG . C1 ? ? B ASN 113 B NAG 601 1_555 ? ? ? ? ? ? ? 1.431 ? metalc1 metalc ? ? A HIS 222 NE2 ? ? ? 1_555 J NI . NI ? ? A HIS 281 A NI 606 1_555 ? ? ? ? ? ? ? 2.055 ? metalc2 metalc ? ? B HIS 222 NE2 ? ? ? 1_555 P NI . NI ? ? B HIS 281 B NI 606 1_555 ? ? ? ? ? ? ? 2.143 ? metalc3 metalc ? ? J NI . NI ? ? ? 1_555 AA HOH . O ? ? A NI 606 A HOH 710 1_555 ? ? ? ? ? ? ? 2.386 ? covale85 covale ? ? Y NAG . O4 ? ? ? 1_555 Z NAG . C1 ? ? D NAG 604 D NAG 605 1_555 ? ? ? ? ? ? ? 1.389 ? covale86 covale ? ? E NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? A NAG 601 A NAG 602 1_555 ? ? ? ? ? ? ? 1.392 ? covale87 covale ? ? H NAG . O4 ? ? ? 1_555 I NAG . C1 ? ? A NAG 604 A NAG 605 1_555 ? ? ? ? ? ? ? 1.392 ? covale88 covale ? ? V NAG . O4 ? ? ? 1_555 W NAG . C1 ? ? D NAG 601 D NAG 602 1_555 ? ? ? ? ? ? ? 1.392 ? covale89 covale ? ? K NAG . O4 ? ? ? 1_555 L NAG . C1 ? ? B NAG 601 B NAG 602 1_555 ? ? ? ? ? ? ? 1.393 ? covale90 covale ? ? T NAG . O4 ? ? ? 1_555 U NAG . C1 ? ? C NAG 604 C NAG 605 1_555 ? ? ? ? ? ? ? 1.394 ? covale91 covale ? ? Q NAG . O4 ? ? ? 1_555 R NAG . C1 ? ? C NAG 601 C NAG 602 1_555 ? ? ? ? ? ? ? 1.394 ? covale92 covale ? ? N NAG . O4 ? ? ? 1_555 O NAG . C1 ? ? B NAG 604 B NAG 605 1_555 ? ? ? ? ? ? ? 1.398 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 ASP 113 A . ? ASP 172 A GLY 114 A ? GLY 173 A 1 -0.36 2 LEU 227 A . ? LEU 286 A PRO 228 A ? PRO 287 A 1 2.13 3 HIS 385 A . ? HIS 444 A PRO 386 A ? PRO 445 A 1 -0.13 4 LEU 227 B . ? LEU 286 B PRO 228 B ? PRO 287 B 1 2.58 5 HIS 385 B . ? HIS 444 B PRO 386 B ? PRO 445 B 1 -0.06 6 LEU 227 C . ? LEU 286 C PRO 228 C ? PRO 287 C 1 2.30 7 HIS 385 C . ? HIS 444 C PRO 386 C ? PRO 445 C 1 0.14 8 LEU 227 D . ? LEU 286 D PRO 228 D ? PRO 287 D 1 1.66 9 HIS 385 D . ? HIS 444 D PRO 386 D ? PRO 445 D 1 0.40 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 5 ? B ? 3 ? C ? 3 ? D ? 2 ? E ? 5 ? F ? 3 ? G ? 2 ? H ? 2 ? I ? 5 ? J ? 3 ? K ? 3 ? L ? 2 ? M ? 5 ? N ? 3 ? O ? 2 ? P ? 2 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel D 1 2 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel E 4 5 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel G 1 2 ? anti-parallel H 1 2 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel I 4 5 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel L 1 2 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel M 4 5 ? anti-parallel N 1 2 ? anti-parallel N 2 3 ? anti-parallel O 1 2 ? anti-parallel P 1 2 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 ILE A 106 ? ILE A 111 ? ILE A 165 ILE A 170 A 2 PHE A 120 ? PHE A 124 ? PHE A 179 PHE A 183 A 3 GLN A 129 ? PRO A 134 ? GLN A 188 PRO A 193 A 4 MSE A 230 ? VAL A 237 ? MSE A 289 VAL A 296 A 5 THR A 177 ? ASN A 183 ? THR A 236 ASN A 242 B 1 PHE A 200 ? PHE A 202 ? PHE A 259 PHE A 261 B 2 PHE A 208 ? PHE A 210 ? PHE A 267 PHE A 269 B 3 ILE A 224 ? CYS A 225 ? ILE A 283 CYS A 284 C 1 ARG A 247 ? ARG A 251 ? ARG A 306 ARG A 310 C 2 HIS A 310 ? PHE A 314 ? HIS A 369 PHE A 373 C 3 ALA A 324 ? ILE A 325 ? ALA A 383 ILE A 384 D 1 HIS A 286 ? GLY A 287 ? HIS A 345 GLY A 346 D 2 TYR A 424 ? ASN A 425 ? TYR A 483 ASN A 484 E 1 ILE B 106 ? ILE B 111 ? ILE B 165 ILE B 170 E 2 PHE B 120 ? PHE B 124 ? PHE B 179 PHE B 183 E 3 GLN B 129 ? PRO B 134 ? GLN B 188 PRO B 193 E 4 MSE B 230 ? VAL B 237 ? MSE B 289 VAL B 296 E 5 THR B 177 ? ASN B 183 ? THR B 236 ASN B 242 F 1 PHE B 200 ? PHE B 202 ? PHE B 259 PHE B 261 F 2 PHE B 208 ? PHE B 210 ? PHE B 267 PHE B 269 F 3 ILE B 224 ? CYS B 225 ? ILE B 283 CYS B 284 G 1 ARG B 247 ? ARG B 251 ? ARG B 306 ARG B 310 G 2 HIS B 310 ? PHE B 314 ? HIS B 369 PHE B 373 H 1 HIS B 286 ? GLY B 287 ? HIS B 345 GLY B 346 H 2 TYR B 424 ? ASN B 425 ? TYR B 483 ASN B 484 I 1 ILE C 106 ? ILE C 111 ? ILE C 165 ILE C 170 I 2 PHE C 120 ? PHE C 124 ? PHE C 179 PHE C 183 I 3 GLN C 129 ? PRO C 134 ? GLN C 188 PRO C 193 I 4 MSE C 230 ? VAL C 237 ? MSE C 289 VAL C 296 I 5 THR C 177 ? ASN C 183 ? THR C 236 ASN C 242 J 1 PHE C 200 ? PHE C 202 ? PHE C 259 PHE C 261 J 2 PHE C 208 ? PHE C 210 ? PHE C 267 PHE C 269 J 3 ILE C 224 ? CYS C 225 ? ILE C 283 CYS C 284 K 1 ARG C 247 ? ARG C 251 ? ARG C 306 ARG C 310 K 2 HIS C 310 ? PHE C 314 ? HIS C 369 PHE C 373 K 3 ALA C 324 ? ILE C 325 ? ALA C 383 ILE C 384 L 1 HIS C 286 ? GLY C 287 ? HIS C 345 GLY C 346 L 2 TYR C 424 ? ASN C 425 ? TYR C 483 ASN C 484 M 1 ILE D 106 ? ILE D 111 ? ILE D 165 ILE D 170 M 2 PHE D 120 ? PHE D 124 ? PHE D 179 PHE D 183 M 3 GLN D 129 ? PRO D 134 ? GLN D 188 PRO D 193 M 4 MSE D 230 ? VAL D 237 ? MSE D 289 VAL D 296 M 5 THR D 177 ? ASN D 183 ? THR D 236 ASN D 242 N 1 PHE D 200 ? PHE D 202 ? PHE D 259 PHE D 261 N 2 PHE D 208 ? PHE D 210 ? PHE D 267 PHE D 269 N 3 ILE D 224 ? CYS D 225 ? ILE D 283 CYS D 284 O 1 ARG D 247 ? ARG D 251 ? ARG D 306 ARG D 310 O 2 HIS D 310 ? PHE D 314 ? HIS D 369 PHE D 373 P 1 HIS D 286 ? GLY D 287 ? HIS D 345 GLY D 346 P 2 TYR D 424 ? ASN D 425 ? TYR D 483 ASN D 484 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N LYS A 107 ? N LYS A 166 O THR A 123 ? O THR A 182 A 2 3 N PHE A 120 ? N PHE A 179 O PHE A 132 ? O PHE A 191 A 3 4 N VAL A 131 ? N VAL A 190 O GLN A 236 ? O GLN A 295 A 4 5 O VAL A 235 ? O VAL A 294 N VAL A 178 ? N VAL A 237 B 1 2 N PHE A 201 ? N PHE A 260 O CYS A 209 ? O CYS A 268 B 2 3 N PHE A 210 ? N PHE A 269 O ILE A 224 ? O ILE A 283 C 1 2 N LYS A 248 ? N LYS A 307 O SER A 313 ? O SER A 372 C 2 3 N GLU A 312 ? N GLU A 371 O ILE A 325 ? O ILE A 384 D 1 2 N GLY A 287 ? N GLY A 346 O TYR A 424 ? O TYR A 483 E 1 2 N LYS B 107 ? N LYS B 166 O THR B 123 ? O THR B 182 E 2 3 N PHE B 120 ? N PHE B 179 O PHE B 132 ? O PHE B 191 E 3 4 N VAL B 131 ? N VAL B 190 O GLN B 236 ? O GLN B 295 E 4 5 O VAL B 235 ? O VAL B 294 N VAL B 178 ? N VAL B 237 F 1 2 N PHE B 201 ? N PHE B 260 O CYS B 209 ? O CYS B 268 F 2 3 N PHE B 210 ? N PHE B 269 O ILE B 224 ? O ILE B 283 G 1 2 N LYS B 248 ? N LYS B 307 O SER B 313 ? O SER B 372 H 1 2 N GLY B 287 ? N GLY B 346 O TYR B 424 ? O TYR B 483 I 1 2 N HIS C 110 ? N HIS C 169 O VAL C 121 ? O VAL C 180 I 2 3 N PHE C 120 ? N PHE C 179 O PHE C 132 ? O PHE C 191 I 3 4 N VAL C 131 ? N VAL C 190 O GLN C 236 ? O GLN C 295 I 4 5 O VAL C 235 ? O VAL C 294 N VAL C 178 ? N VAL C 237 J 1 2 N PHE C 201 ? N PHE C 260 O CYS C 209 ? O CYS C 268 J 2 3 N PHE C 210 ? N PHE C 269 O ILE C 224 ? O ILE C 283 K 1 2 N LYS C 248 ? N LYS C 307 O SER C 313 ? O SER C 372 K 2 3 N GLU C 312 ? N GLU C 371 O ILE C 325 ? O ILE C 384 L 1 2 N GLY C 287 ? N GLY C 346 O TYR C 424 ? O TYR C 483 M 1 2 N HIS D 110 ? N HIS D 169 O VAL D 121 ? O VAL D 180 M 2 3 N PHE D 120 ? N PHE D 179 O PHE D 132 ? O PHE D 191 M 3 4 N VAL D 131 ? N VAL D 190 O GLN D 236 ? O GLN D 295 M 4 5 O VAL D 235 ? O VAL D 294 N VAL D 178 ? N VAL D 237 N 1 2 N PHE D 201 ? N PHE D 260 O CYS D 209 ? O CYS D 268 N 2 3 N PHE D 210 ? N PHE D 269 O ILE D 224 ? O ILE D 283 O 1 2 N LYS D 248 ? N LYS D 307 O SER D 313 ? O SER D 372 P 1 2 N GLY D 287 ? N GLY D 346 O TYR D 424 ? O TYR D 483 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 601' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 602' AC3 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE BMA A 603' AC4 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 604' AC5 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG A 605' AC6 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NI A 606' AC7 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG B 601' AC8 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG B 602' AC9 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE BMA B 603' BC1 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG B 604' BC2 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE NAG B 605' BC3 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NI B 606' BC4 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG C 601' BC5 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG C 602' BC6 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE BMA C 603' BC7 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG C 604' BC8 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG C 605' BC9 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG D 601' CC1 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG D 602' CC2 Software ? ? ? ? 1 'BINDING SITE FOR RESIDUE BMA D 603' CC3 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NAG D 604' CC4 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE NAG D 605' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 3 ASN A 54 ? ASN A 113 . ? 1_555 ? 2 AC1 3 SER A 89 ? SER A 148 . ? 1_555 ? 3 AC1 3 NAG F . ? NAG A 602 . ? 1_555 ? 4 AC2 4 SER A 89 ? SER A 148 . ? 1_555 ? 5 AC2 4 ASP A 90 ? ASP A 149 . ? 1_555 ? 6 AC2 4 NAG E . ? NAG A 601 . ? 1_555 ? 7 AC2 4 BMA G . ? BMA A 603 . ? 1_555 ? 8 AC3 1 NAG F . ? NAG A 602 . ? 1_555 ? 9 AC4 4 ASN A 183 ? ASN A 242 . ? 1_555 ? 10 AC4 4 THR A 186 ? THR A 245 . ? 1_555 ? 11 AC4 4 ASP A 229 ? ASP A 288 . ? 1_555 ? 12 AC4 4 NAG I . ? NAG A 605 . ? 1_555 ? 13 AC5 4 NAG H . ? NAG A 604 . ? 1_555 ? 14 AC5 4 HOH AA . ? HOH A 711 . ? 1_555 ? 15 AC5 4 ASN B 40 ? ASN B 99 . ? 1_555 ? 16 AC5 4 LYS D 28 ? LYS D 87 . ? 4_556 ? 17 AC6 4 HIS A 222 ? HIS A 281 . ? 1_555 ? 18 AC6 4 HOH AA . ? HOH A 701 . ? 1_555 ? 19 AC6 4 HOH AA . ? HOH A 710 . ? 1_555 ? 20 AC6 4 HIS D 222 ? HIS D 281 . ? 1_655 ? 21 AC7 3 ASN B 54 ? ASN B 113 . ? 1_555 ? 22 AC7 3 SER B 89 ? SER B 148 . ? 1_555 ? 23 AC7 3 NAG L . ? NAG B 602 . ? 1_555 ? 24 AC8 4 SER B 89 ? SER B 148 . ? 1_555 ? 25 AC8 4 ASP B 90 ? ASP B 149 . ? 1_555 ? 26 AC8 4 NAG K . ? NAG B 601 . ? 1_555 ? 27 AC8 4 BMA M . ? BMA B 603 . ? 1_555 ? 28 AC9 1 NAG L . ? NAG B 602 . ? 1_555 ? 29 BC1 5 ASN B 183 ? ASN B 242 . ? 1_555 ? 30 BC1 5 THR B 186 ? THR B 245 . ? 1_555 ? 31 BC1 5 ASP B 229 ? ASP B 288 . ? 1_555 ? 32 BC1 5 MSE B 230 ? MSE B 289 . ? 1_555 ? 33 BC1 5 NAG O . ? NAG B 605 . ? 1_555 ? 34 BC2 1 NAG N . ? NAG B 604 . ? 1_555 ? 35 BC3 3 HIS B 222 ? HIS B 281 . ? 1_555 ? 36 BC3 3 HOH BA . ? HOH B 741 . ? 1_555 ? 37 BC3 3 HIS C 222 ? HIS C 281 . ? 3_645 ? 38 BC4 3 ASN C 54 ? ASN C 113 . ? 1_555 ? 39 BC4 3 SER C 89 ? SER C 148 . ? 1_555 ? 40 BC4 3 NAG R . ? NAG C 602 . ? 1_555 ? 41 BC5 4 SER C 89 ? SER C 148 . ? 1_555 ? 42 BC5 4 ASP C 90 ? ASP C 149 . ? 1_555 ? 43 BC5 4 NAG Q . ? NAG C 601 . ? 1_555 ? 44 BC5 4 BMA S . ? BMA C 603 . ? 1_555 ? 45 BC6 1 NAG R . ? NAG C 602 . ? 1_555 ? 46 BC7 4 ASN C 183 ? ASN C 242 . ? 1_555 ? 47 BC7 4 THR C 186 ? THR C 245 . ? 1_555 ? 48 BC7 4 ASP C 229 ? ASP C 288 . ? 1_555 ? 49 BC7 4 NAG U . ? NAG C 605 . ? 1_555 ? 50 BC8 2 NAG T . ? NAG C 604 . ? 1_555 ? 51 BC8 2 HOH CA . ? HOH C 745 . ? 1_555 ? 52 BC9 3 ASN D 54 ? ASN D 113 . ? 1_555 ? 53 BC9 3 SER D 89 ? SER D 148 . ? 1_555 ? 54 BC9 3 NAG W . ? NAG D 602 . ? 1_555 ? 55 CC1 3 SER D 89 ? SER D 148 . ? 1_555 ? 56 CC1 3 NAG V . ? NAG D 601 . ? 1_555 ? 57 CC1 3 BMA X . ? BMA D 603 . ? 1_555 ? 58 CC2 1 NAG W . ? NAG D 602 . ? 1_555 ? 59 CC3 4 ASN D 183 ? ASN D 242 . ? 1_555 ? 60 CC3 4 THR D 185 ? THR D 244 . ? 1_555 ? 61 CC3 4 ASP D 229 ? ASP D 288 . ? 1_555 ? 62 CC3 4 NAG Z . ? NAG D 605 . ? 1_555 ? 63 CC4 2 NAG Y . ? NAG D 604 . ? 1_555 ? 64 CC4 2 HOH DA . ? HOH D 737 . ? 1_555 ? # _database_PDB_matrix.entry_id 4KQA _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 4KQA _atom_sites.fract_transf_matrix[1][1] 0.012693 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.006357 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 0.005926 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N NI O S SE # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . PRO A 1 3 ? 35.126 59.361 74.307 1.00 59.57 ? 62 PRO A N 1 ATOM 2 C CA . PRO A 1 3 ? 34.677 59.440 72.912 1.00 62.96 ? 62 PRO A CA 1 ATOM 3 C C . PRO A 1 3 ? 34.860 60.834 72.319 1.00 59.69 ? 62 PRO A C 1 ATOM 4 O O . PRO A 1 3 ? 34.596 61.828 72.994 1.00 58.28 ? 62 PRO A O 1 ATOM 5 C CB . PRO A 1 3 ? 33.190 59.076 72.998 1.00 50.68 ? 62 PRO A CB 1 ATOM 6 C CG . PRO A 1 3 ? 33.057 58.306 74.266 1.00 40.60 ? 62 PRO A CG 1 ATOM 7 C CD . PRO A 1 3 ? 34.051 58.908 75.207 1.00 49.66 ? 62 PRO A CD 1 ATOM 8 N N . HIS A 1 4 ? 35.312 60.898 71.071 1.00 53.02 ? 63 HIS A N 1 ATOM 9 C CA . HIS A 1 4 ? 35.493 62.173 70.388 1.00 48.12 ? 63 HIS A CA 1 ATOM 10 C C . HIS A 1 4 ? 34.127 62.760 70.059 1.00 51.48 ? 63 HIS A C 1 ATOM 11 O O . HIS A 1 4 ? 33.922 63.972 70.137 1.00 54.11 ? 63 HIS A O 1 ATOM 12 C CB . HIS A 1 4 ? 36.330 62.003 69.118 1.00 54.31 ? 63 HIS A CB 1 ATOM 13 C CG . HIS A 1 4 ? 37.757 61.629 69.376 1.00 53.90 ? 63 HIS A CG 1 ATOM 14 N ND1 . HIS A 1 4 ? 38.132 60.759 70.377 1.00 42.88 ? 63 HIS A ND1 1 ATOM 15 C CD2 . HIS A 1 4 ? 38.903 62.006 68.759 1.00 55.58 ? 63 HIS A CD2 1 ATOM 16 C CE1 . HIS A 1 4 ? 39.445 60.617 70.367 1.00 59.02 ? 63 HIS A CE1 1 ATOM 17 N NE2 . HIS A 1 4 ? 39.937 61.363 69.394 1.00 53.60 ? 63 HIS A NE2 1 ATOM 18 N N . GLN A 1 5 ? 33.200 61.886 69.681 1.00 50.72 ? 64 GLN A N 1 ATOM 19 C CA . GLN A 1 5 ? 31.798 62.252 69.531 1.00 46.86 ? 64 GLN A CA 1 ATOM 20 C C . GLN A 1 5 ? 31.005 61.718 70.721 1.00 55.13 ? 64 GLN A C 1 ATOM 21 O O . GLN A 1 5 ? 30.599 60.555 70.729 1.00 49.06 ? 64 GLN A O 1 ATOM 22 C CB . GLN A 1 5 ? 31.228 61.707 68.221 1.00 35.47 ? 64 GLN A CB 1 ATOM 23 C CG . GLN A 1 5 ? 31.774 62.384 66.975 1.00 43.03 ? 64 GLN A CG 1 ATOM 24 C CD . GLN A 1 5 ? 31.032 61.973 65.720 1.00 48.82 ? 64 GLN A CD 1 ATOM 25 O OE1 . GLN A 1 5 ? 29.801 61.975 65.683 1.00 52.03 ? 64 GLN A OE1 1 ATOM 26 N NE2 . GLN A 1 5 ? 31.778 61.613 64.682 1.00 40.68 ? 64 GLN A NE2 1 ATOM 27 N N . PRO A 1 6 ? 30.782 62.569 71.735 1.00 55.99 ? 65 PRO A N 1 ATOM 28 C CA . PRO A 1 6 ? 30.149 62.146 72.988 1.00 53.23 ? 65 PRO A CA 1 ATOM 29 C C . PRO A 1 6 ? 28.630 62.044 72.903 1.00 35.70 ? 65 PRO A C 1 ATOM 30 O O . PRO A 1 6 ? 28.029 62.432 71.901 1.00 39.43 ? 65 PRO A O 1 ATOM 31 C CB . PRO A 1 6 ? 30.548 63.255 73.978 1.00 28.53 ? 65 PRO A CB 1 ATOM 32 C CG . PRO A 1 6 ? 31.551 64.123 73.248 1.00 49.79 ? 65 PRO A CG 1 ATOM 33 C CD . PRO A 1 6 ? 31.226 63.967 71.802 1.00 47.29 ? 65 PRO A CD 1 ATOM 34 N N . ILE A 1 7 ? 28.025 61.514 73.962 1.00 46.24 ? 66 ILE A N 1 ATOM 35 C CA . ILE A 1 7 ? 26.574 61.462 74.087 1.00 58.00 ? 66 ILE A CA 1 ATOM 36 C C . ILE A 1 7 ? 26.002 62.870 74.198 1.00 46.43 ? 66 ILE A C 1 ATOM 37 O O . ILE A 1 7 ? 26.731 63.812 74.509 1.00 44.47 ? 66 ILE A O 1 ATOM 38 C CB . ILE A 1 7 ? 26.138 60.649 75.326 1.00 57.78 ? 66 ILE A CB 1 ATOM 39 C CG1 . ILE A 1 7 ? 26.761 61.235 76.596 1.00 47.05 ? 66 ILE A CG1 1 ATOM 40 C CG2 . ILE A 1 7 ? 26.500 59.183 75.161 1.00 59.33 ? 66 ILE A CG2 1 ATOM 41 C CD1 . ILE A 1 7 ? 26.245 60.612 77.873 1.00 59.57 ? 66 ILE A CD1 1 ATOM 42 N N . PRO A 1 8 ? 24.697 63.024 73.925 1.00 52.92 ? 67 PRO A N 1 ATOM 43 C CA . PRO A 1 8 ? 24.051 64.298 74.252 1.00 41.05 ? 67 PRO A CA 1 ATOM 44 C C . PRO A 1 8 ? 24.187 64.607 75.741 1.00 52.67 ? 67 PRO A C 1 ATOM 45 O O . PRO A 1 8 ? 23.854 63.753 76.563 1.00 42.17 ? 67 PRO A O 1 ATOM 46 C CB . PRO A 1 8 ? 22.588 64.059 73.866 1.00 38.49 ? 67 PRO A CB 1 ATOM 47 C CG . PRO A 1 8 ? 22.651 63.010 72.809 1.00 44.25 ? 67 PRO A CG 1 ATOM 48 C CD . PRO A 1 8 ? 23.798 62.120 73.185 1.00 49.39 ? 67 PRO A CD 1 ATOM 49 N N . PRO A 1 9 ? 24.687 65.806 76.082 1.00 56.74 ? 68 PRO A N 1 ATOM 50 C CA . PRO A 1 9 ? 24.938 66.209 77.473 1.00 53.87 ? 68 PRO A CA 1 ATOM 51 C C . PRO A 1 9 ? 23.704 66.065 78.361 1.00 53.68 ? 68 PRO A C 1 ATOM 52 O O . PRO A 1 9 ? 23.836 65.813 79.559 1.00 57.93 ? 68 PRO A O 1 ATOM 53 C CB . PRO A 1 9 ? 25.354 67.681 77.347 1.00 52.16 ? 68 PRO A CB 1 ATOM 54 C CG . PRO A 1 9 ? 24.887 68.109 75.998 1.00 58.67 ? 68 PRO A CG 1 ATOM 55 C CD . PRO A 1 9 ? 24.989 66.893 75.138 1.00 50.05 ? 68 PRO A CD 1 ATOM 56 N N . SER A 1 10 ? 22.524 66.227 77.770 1.00 43.10 ? 69 SER A N 1 ATOM 57 C CA . SER A 1 10 ? 21.266 66.052 78.487 1.00 55.14 ? 69 SER A CA 1 ATOM 58 C C . SER A 1 10 ? 21.096 64.614 78.974 1.00 60.98 ? 69 SER A C 1 ATOM 59 O O . SER A 1 10 ? 20.419 64.364 79.971 1.00 68.06 ? 69 SER A O 1 ATOM 60 C CB . SER A 1 10 ? 20.082 66.450 77.601 1.00 36.29 ? 69 SER A CB 1 ATOM 61 O OG . SER A 1 10 ? 19.921 65.540 76.527 1.00 56.00 ? 69 SER A OG 1 ATOM 62 N N . LEU A 1 11 ? 21.716 63.675 78.266 1.00 54.33 ? 70 LEU A N 1 ATOM 63 C CA . LEU A 1 11 ? 21.641 62.263 78.629 1.00 51.13 ? 70 LEU A CA 1 ATOM 64 C C . LEU A 1 11 ? 22.784 61.860 79.555 1.00 50.77 ? 70 LEU A C 1 ATOM 65 O O . LEU A 1 11 ? 22.936 60.687 79.895 1.00 50.88 ? 70 LEU A O 1 ATOM 66 C CB . LEU A 1 11 ? 21.653 61.387 77.375 1.00 46.68 ? 70 LEU A CB 1 ATOM 67 C CG . LEU A 1 11 ? 20.439 61.512 76.453 1.00 55.17 ? 70 LEU A CG 1 ATOM 68 C CD1 . LEU A 1 11 ? 20.623 60.664 75.206 1.00 30.46 ? 70 LEU A CD1 1 ATOM 69 C CD2 . LEU A 1 11 ? 19.169 61.120 77.190 1.00 30.63 ? 70 LEU A CD2 1 ATOM 70 N N . GLY A 1 12 ? 23.588 62.838 79.959 1.00 61.37 ? 71 GLY A N 1 ATOM 71 C CA . GLY A 1 12 ? 24.707 62.582 80.846 1.00 59.99 ? 71 GLY A CA 1 ATOM 72 C C . GLY A 1 12 ? 24.432 63.085 82.249 1.00 66.50 ? 71 GLY A C 1 ATOM 73 O O . GLY A 1 12 ? 23.318 63.508 82.558 1.00 69.90 ? 71 GLY A O 1 ATOM 74 N N . GLU A 1 13 ? 25.450 63.036 83.102 1.00 57.65 ? 72 GLU A N 1 ATOM 75 C CA . GLU A 1 13 ? 25.332 63.538 84.467 1.00 75.93 ? 72 GLU A CA 1 ATOM 76 C C . GLU A 1 13 ? 25.072 65.040 84.495 1.00 74.97 ? 72 GLU A C 1 ATOM 77 O O . GLU A 1 13 ? 25.813 65.816 83.890 1.00 68.62 ? 72 GLU A O 1 ATOM 78 C CB . GLU A 1 13 ? 26.594 63.222 85.274 1.00 87.15 ? 72 GLU A CB 1 ATOM 79 C CG . GLU A 1 13 ? 26.804 61.747 85.571 1.00 102.11 ? 72 GLU A CG 1 ATOM 80 C CD . GLU A 1 13 ? 27.912 61.514 86.580 1.00 109.41 ? 72 GLU A CD 1 ATOM 81 O OE1 . GLU A 1 13 ? 28.464 62.508 87.099 1.00 110.62 ? 72 GLU A OE1 1 ATOM 82 O OE2 . GLU A 1 13 ? 28.230 60.339 86.857 1.00 110.19 ? 72 GLU A OE2 1 ATOM 83 N N . LYS A 1 14 ? 24.018 65.445 85.197 1.00 72.85 ? 73 LYS A N 1 ATOM 84 C CA . LYS A 1 14 ? 23.659 66.857 85.287 1.00 70.56 ? 73 LYS A CA 1 ATOM 85 C C . LYS A 1 14 ? 24.691 67.673 86.046 1.00 75.89 ? 73 LYS A C 1 ATOM 86 O O . LYS A 1 14 ? 25.060 67.354 87.176 1.00 84.89 ? 73 LYS A O 1 ATOM 87 C CB . LYS A 1 14 ? 22.280 67.033 85.928 1.00 66.34 ? 73 LYS A CB 1 ATOM 88 C CG . LYS A 1 14 ? 21.143 66.800 84.962 1.00 82.32 ? 73 LYS A CG 1 ATOM 89 C CD . LYS A 1 14 ? 21.223 67.859 83.873 1.00 97.72 ? 73 LYS A CD 1 ATOM 90 C CE . LYS A 1 14 ? 20.357 67.530 82.680 1.00 100.93 ? 73 LYS A CE 1 ATOM 91 N NZ . LYS A 1 14 ? 21.192 67.456 81.452 1.00 84.89 ? 73 LYS A NZ 1 ATOM 92 N N . ASP A 1 15 ? 25.144 68.737 85.395 1.00 79.99 ? 74 ASP A N 1 ATOM 93 C CA . ASP A 1 15 ? 26.118 69.653 85.963 1.00 76.56 ? 74 ASP A CA 1 ATOM 94 C C . ASP A 1 15 ? 25.462 70.489 87.052 1.00 79.38 ? 74 ASP A C 1 ATOM 95 O O . ASP A 1 15 ? 24.507 71.223 86.797 1.00 80.97 ? 74 ASP A O 1 ATOM 96 C CB . ASP A 1 15 ? 26.702 70.549 84.868 1.00 63.19 ? 74 ASP A CB 1 ATOM 97 C CG . ASP A 1 15 ? 27.845 71.410 85.362 1.00 75.47 ? 74 ASP A CG 1 ATOM 98 O OD1 . ASP A 1 15 ? 28.255 72.328 84.621 1.00 84.31 ? 74 ASP A OD1 1 ATOM 99 O OD2 . ASP A 1 15 ? 28.327 71.178 86.489 1.00 94.64 ? 74 ASP A OD2 1 ATOM 100 N N . LEU A 1 16 ? 25.978 70.370 88.270 1.00 76.70 ? 75 LEU A N 1 ATOM 101 C CA . LEU A 1 16 ? 25.389 71.040 89.420 1.00 79.56 ? 75 LEU A CA 1 ATOM 102 C C . LEU A 1 16 ? 26.103 72.356 89.698 1.00 70.30 ? 75 LEU A C 1 ATOM 103 O O . LEU A 1 16 ? 25.748 73.084 90.625 1.00 64.86 ? 75 LEU A O 1 ATOM 104 C CB . LEU A 1 16 ? 25.459 70.140 90.657 1.00 75.99 ? 75 LEU A CB 1 ATOM 105 C CG . LEU A 1 16 ? 24.785 68.767 90.582 1.00 72.85 ? 75 LEU A CG 1 ATOM 106 C CD1 . LEU A 1 16 ? 24.924 68.032 91.908 1.00 69.31 ? 75 LEU A CD1 1 ATOM 107 C CD2 . LEU A 1 16 ? 23.322 68.903 90.191 1.00 61.45 ? 75 LEU A CD2 1 ATOM 108 N N . SER A 1 17 ? 27.111 72.656 88.886 1.00 62.98 ? 76 SER A N 1 ATOM 109 C CA . SER A 1 17 ? 27.909 73.861 89.071 1.00 65.72 ? 76 SER A CA 1 ATOM 110 C C . SER A 1 17 ? 27.122 75.130 88.765 1.00 62.55 ? 76 SER A C 1 ATOM 111 O O . SER A 1 17 ? 26.178 75.115 87.976 1.00 62.90 ? 76 SER A O 1 ATOM 112 C CB . SER A 1 17 ? 29.160 73.806 88.191 1.00 56.05 ? 76 SER A CB 1 ATOM 113 O OG . SER A 1 17 ? 29.846 75.046 88.203 1.00 74.60 ? 76 SER A OG 1 ATOM 114 N N . ASP A 1 18 ? 27.522 76.224 89.404 1.00 72.24 ? 77 ASP A N 1 ATOM 115 C CA . ASP A 1 18 ? 26.913 77.526 89.170 1.00 67.37 ? 77 ASP A CA 1 ATOM 116 C C . ASP A 1 18 ? 27.495 78.125 87.895 1.00 60.02 ? 77 ASP A C 1 ATOM 117 O O . ASP A 1 18 ? 28.694 78.396 87.829 1.00 53.15 ? 77 ASP A O 1 ATOM 118 C CB . ASP A 1 18 ? 27.146 78.453 90.367 1.00 73.26 ? 77 ASP A CB 1 ATOM 119 C CG . ASP A 1 18 ? 26.441 79.790 90.222 1.00 77.35 ? 77 ASP A CG 1 ATOM 120 O OD1 . ASP A 1 18 ? 25.564 79.921 89.343 1.00 81.61 ? 77 ASP A OD1 1 ATOM 121 O OD2 . ASP A 1 18 ? 26.762 80.714 90.999 1.00 79.16 ? 77 ASP A OD2 1 ATOM 122 N N . PRO A 1 19 ? 26.651 78.333 86.874 1.00 55.62 ? 78 PRO A N 1 ATOM 123 C CA . PRO A 1 19 ? 27.117 78.867 85.587 1.00 44.77 ? 78 PRO A CA 1 ATOM 124 C C . PRO A 1 19 ? 27.619 80.308 85.673 1.00 45.03 ? 78 PRO A C 1 ATOM 125 O O . PRO A 1 19 ? 28.171 80.822 84.700 1.00 57.06 ? 78 PRO A O 1 ATOM 126 C CB . PRO A 1 19 ? 25.867 78.789 84.698 1.00 54.19 ? 78 PRO A CB 1 ATOM 127 C CG . PRO A 1 19 ? 24.946 77.833 85.388 1.00 52.74 ? 78 PRO A CG 1 ATOM 128 C CD . PRO A 1 19 ? 25.217 77.998 86.845 1.00 52.29 ? 78 PRO A CD 1 ATOM 129 N N . PHE A 1 20 ? 27.433 80.946 86.822 1.00 51.74 ? 79 PHE A N 1 ATOM 130 C CA . PHE A 1 20 ? 27.794 82.349 86.976 1.00 66.72 ? 79 PHE A CA 1 ATOM 131 C C . PHE A 1 20 ? 28.666 82.582 88.205 1.00 67.45 ? 79 PHE A C 1 ATOM 132 O O . PHE A 1 20 ? 28.600 83.636 88.837 1.00 62.41 ? 79 PHE A O 1 ATOM 133 C CB . PHE A 1 20 ? 26.528 83.202 87.035 1.00 58.20 ? 79 PHE A CB 1 ATOM 134 C CG . PHE A 1 20 ? 25.633 83.015 85.845 1.00 53.53 ? 79 PHE A CG 1 ATOM 135 C CD1 . PHE A 1 20 ? 25.830 83.750 84.688 1.00 58.99 ? 79 PHE A CD1 1 ATOM 136 C CD2 . PHE A 1 20 ? 24.614 82.077 85.873 1.00 40.30 ? 79 PHE A CD2 1 ATOM 137 C CE1 . PHE A 1 20 ? 25.016 83.565 83.588 1.00 50.79 ? 79 PHE A CE1 1 ATOM 138 C CE2 . PHE A 1 20 ? 23.798 81.889 84.778 1.00 43.24 ? 79 PHE A CE2 1 ATOM 139 C CZ . PHE A 1 20 ? 23.999 82.631 83.634 1.00 53.78 ? 79 PHE A CZ 1 ATOM 140 N N . ASN A 1 21 ? 29.481 81.585 88.538 1.00 75.16 ? 80 ASN A N 1 ATOM 141 C CA . ASN A 1 21 ? 30.436 81.697 89.636 1.00 71.31 ? 80 ASN A CA 1 ATOM 142 C C . ASN A 1 21 ? 31.749 82.338 89.174 1.00 66.77 ? 80 ASN A C 1 ATOM 143 O O . ASN A 1 21 ? 32.836 81.932 89.587 1.00 87.59 ? 80 ASN A O 1 ATOM 144 C CB . ASN A 1 21 ? 30.694 80.315 90.247 1.00 79.61 ? 80 ASN A CB 1 ATOM 145 C CG . ASN A 1 21 ? 31.453 80.383 91.561 1.00 82.10 ? 80 ASN A CG 1 ATOM 146 O OD1 . ASN A 1 21 ? 31.472 81.418 92.228 1.00 85.69 ? 80 ASN A OD1 1 ATOM 147 N ND2 . ASN A 1 21 ? 32.087 79.278 91.936 1.00 81.62 ? 80 ASN A ND2 1 ATOM 148 N N . PHE A 1 22 ? 31.645 83.336 88.301 1.00 53.90 ? 81 PHE A N 1 ATOM 149 C CA . PHE A 1 22 ? 32.822 84.067 87.841 1.00 62.51 ? 81 PHE A CA 1 ATOM 150 C C . PHE A 1 22 ? 32.753 85.546 88.219 1.00 69.28 ? 81 PHE A C 1 ATOM 151 O O . PHE A 1 22 ? 31.673 86.108 88.367 1.00 72.81 ? 81 PHE A O 1 ATOM 152 C CB . PHE A 1 22 ? 32.992 83.915 86.325 1.00 60.45 ? 81 PHE A CB 1 ATOM 153 C CG . PHE A 1 22 ? 31.842 84.459 85.520 1.00 56.86 ? 81 PHE A CG 1 ATOM 154 C CD1 . PHE A 1 22 ? 31.892 85.740 84.993 1.00 39.84 ? 81 PHE A CD1 1 ATOM 155 C CD2 . PHE A 1 22 ? 30.718 83.685 85.278 1.00 47.88 ? 81 PHE A CD2 1 ATOM 156 C CE1 . PHE A 1 22 ? 30.840 86.241 84.249 1.00 43.26 ? 81 PHE A CE1 1 ATOM 157 C CE2 . PHE A 1 22 ? 29.663 84.181 84.536 1.00 42.70 ? 81 PHE A CE2 1 ATOM 158 C CZ . PHE A 1 22 ? 29.725 85.460 84.021 1.00 42.01 ? 81 PHE A CZ 1 ATOM 159 N N . LEU A 1 23 ? 33.920 86.161 88.384 1.00 76.41 ? 82 LEU A N 1 ATOM 160 C CA . LEU A 1 23 ? 34.029 87.578 88.723 1.00 70.85 ? 82 LEU A CA 1 ATOM 161 C C . LEU A 1 23 ? 34.104 88.438 87.461 1.00 67.42 ? 82 LEU A C 1 ATOM 162 O O . LEU A 1 23 ? 34.860 88.130 86.539 1.00 79.57 ? 82 LEU A O 1 ATOM 163 C CB . LEU A 1 23 ? 35.246 87.842 89.616 1.00 82.77 ? 82 LEU A CB 1 ATOM 164 C CG . LEU A 1 23 ? 35.190 87.450 91.100 1.00 94.12 ? 82 LEU A CG 1 ATOM 165 C CD1 . LEU A 1 23 ? 35.067 85.942 91.316 1.00 93.32 ? 82 LEU A CD1 1 ATOM 166 C CD2 . LEU A 1 23 ? 36.399 88.004 91.847 1.00 94.58 ? 82 LEU A CD2 1 ATOM 167 N N . PHE A 1 24 ? 33.326 89.514 87.422 1.00 76.75 ? 83 PHE A N 1 ATOM 168 C CA . PHE A 1 24 ? 33.356 90.432 86.287 1.00 80.14 ? 83 PHE A CA 1 ATOM 169 C C . PHE A 1 24 ? 33.449 91.893 86.723 1.00 84.69 ? 83 PHE A C 1 ATOM 170 O O . PHE A 1 24 ? 34.523 92.492 86.617 1.00 85.19 ? 83 PHE A O 1 ATOM 171 C CB . PHE A 1 24 ? 32.144 90.242 85.375 1.00 73.64 ? 83 PHE A CB 1 ATOM 172 C CG . PHE A 1 24 ? 32.340 90.832 84.009 1.00 70.65 ? 83 PHE A CG 1 ATOM 173 C CD1 . PHE A 1 24 ? 33.140 90.191 83.076 1.00 56.28 ? 83 PHE A CD1 1 ATOM 174 C CD2 . PHE A 1 24 ? 31.754 92.038 83.666 1.00 58.48 ? 83 PHE A CD2 1 ATOM 175 C CE1 . PHE A 1 24 ? 33.339 90.735 81.825 1.00 58.59 ? 83 PHE A CE1 1 ATOM 176 C CE2 . PHE A 1 24 ? 31.950 92.585 82.416 1.00 59.56 ? 83 PHE A CE2 1 ATOM 177 C CZ . PHE A 1 24 ? 32.744 91.934 81.496 1.00 54.44 ? 83 PHE A CZ 1 ATOM 178 N N . SER A 1 25 ? 32.307 92.481 87.084 1.00 93.97 ? 84 SER A N 1 ATOM 179 C CA . SER A 1 25 ? 32.219 93.874 87.544 1.00 102.70 ? 84 SER A CA 1 ATOM 180 C C . SER A 1 25 ? 32.276 94.813 86.347 1.00 97.96 ? 84 SER A C 1 ATOM 181 O O . SER A 1 25 ? 32.854 94.478 85.314 1.00 99.90 ? 84 SER A O 1 ATOM 182 C CB . SER A 1 25 ? 33.320 94.214 88.560 1.00 99.77 ? 84 SER A CB 1 ATOM 183 O OG . SER A 1 25 ? 33.267 95.577 88.943 1.00 95.38 ? 84 SER A OG 1 ATOM 184 N N . SER A 1 26 ? 31.673 95.989 86.482 1.00 95.24 ? 85 SER A N 1 ATOM 185 C CA . SER A 1 26 ? 31.604 96.915 85.359 1.00 99.93 ? 85 SER A CA 1 ATOM 186 C C . SER A 1 26 ? 32.375 98.213 85.577 1.00 96.81 ? 85 SER A C 1 ATOM 187 O O . SER A 1 26 ? 32.373 98.782 86.669 1.00 94.73 ? 85 SER A O 1 ATOM 188 C CB . SER A 1 26 ? 30.141 97.239 85.043 1.00 91.21 ? 85 SER A CB 1 ATOM 189 O OG . SER A 1 26 ? 30.041 98.081 83.907 1.00 82.64 ? 85 SER A OG 1 ATOM 190 N N . ASN A 1 27 ? 33.051 98.655 84.522 1.00 87.58 ? 86 ASN A N 1 ATOM 191 C CA . ASN A 1 27 ? 33.797 99.906 84.536 1.00 80.86 ? 86 ASN A CA 1 ATOM 192 C C . ASN A 1 27 ? 32.841 101.077 84.717 1.00 80.60 ? 86 ASN A C 1 ATOM 193 O O . ASN A 1 27 ? 31.976 101.311 83.873 1.00 88.34 ? 86 ASN A O 1 ATOM 194 C CB . ASN A 1 27 ? 34.603 100.056 83.241 1.00 72.27 ? 86 ASN A CB 1 ATOM 195 C CG . ASN A 1 27 ? 35.512 101.273 83.245 1.00 78.28 ? 86 ASN A CG 1 ATOM 196 O OD1 . ASN A 1 27 ? 35.060 102.405 83.418 1.00 75.39 ? 86 ASN A OD1 1 ATOM 197 N ND2 . ASN A 1 27 ? 36.805 101.042 83.052 1.00 90.18 ? 86 ASN A ND2 1 ATOM 198 N N . LYS A 1 28 ? 32.993 101.817 85.811 1.00 72.88 ? 87 LYS A N 1 ATOM 199 C CA . LYS A 1 28 ? 32.030 102.863 86.130 1.00 71.60 ? 87 LYS A CA 1 ATOM 200 C C . LYS A 1 28 ? 32.421 104.181 85.478 1.00 70.93 ? 87 LYS A C 1 ATOM 201 O O . LYS A 1 28 ? 31.606 105.097 85.383 1.00 60.66 ? 87 LYS A O 1 ATOM 202 C CB . LYS A 1 28 ? 31.911 103.045 87.644 1.00 66.05 ? 87 LYS A CB 1 ATOM 203 C CG . LYS A 1 28 ? 31.672 101.757 88.413 1.00 74.21 ? 87 LYS A CG 1 ATOM 204 C CD . LYS A 1 28 ? 30.390 101.075 87.965 1.00 84.13 ? 87 LYS A CD 1 ATOM 205 C CE . LYS A 1 28 ? 30.162 99.780 88.730 1.00 95.07 ? 87 LYS A CE 1 ATOM 206 N NZ . LYS A 1 28 ? 28.974 99.037 88.226 1.00 91.53 ? 87 LYS A NZ 1 ATOM 207 N N . ILE A 1 29 ? 33.669 104.274 85.030 1.00 63.62 ? 88 ILE A N 1 ATOM 208 C CA . ILE A 1 29 ? 34.132 105.466 84.332 1.00 75.83 ? 88 ILE A CA 1 ATOM 209 C C . ILE A 1 29 ? 33.488 105.505 82.953 1.00 78.30 ? 88 ILE A C 1 ATOM 210 O O . ILE A 1 29 ? 32.890 106.506 82.559 1.00 72.27 ? 88 ILE A O 1 ATOM 211 C CB . ILE A 1 29 ? 35.665 105.504 84.197 1.00 66.96 ? 88 ILE A CB 1 ATOM 212 C CG1 . ILE A 1 29 ? 36.323 105.561 85.577 1.00 58.16 ? 88 ILE A CG1 1 ATOM 213 C CG2 . ILE A 1 29 ? 36.094 106.691 83.348 1.00 37.15 ? 88 ILE A CG2 1 ATOM 214 C CD1 . ILE A 1 29 ? 35.771 106.647 86.475 1.00 66.65 ? 88 ILE A CD1 1 ATOM 215 N N . THR A 1 30 ? 33.621 104.398 82.229 1.00 78.27 ? 89 THR A N 1 ATOM 216 C CA . THR A 1 30 ? 32.999 104.242 80.922 1.00 72.68 ? 89 THR A CA 1 ATOM 217 C C . THR A 1 30 ? 31.483 104.372 81.023 1.00 64.01 ? 89 THR A C 1 ATOM 218 O O . THR A 1 30 ? 30.862 105.083 80.242 1.00 50.27 ? 89 THR A O 1 ATOM 219 C CB . THR A 1 30 ? 33.359 102.880 80.294 1.00 72.01 ? 89 THR A CB 1 ATOM 220 O OG1 . THR A 1 30 ? 34.775 102.804 80.091 1.00 73.02 ? 89 THR A OG1 1 ATOM 221 C CG2 . THR A 1 30 ? 32.648 102.690 78.965 1.00 75.90 ? 89 THR A CG2 1 ATOM 222 N N . LEU A 1 31 ? 30.904 103.712 82.021 1.00 56.35 ? 90 LEU A N 1 ATOM 223 C CA . LEU A 1 31 ? 29.461 103.725 82.238 1.00 56.39 ? 90 LEU A CA 1 ATOM 224 C C . LEU A 1 31 ? 28.955 105.154 82.413 1.00 58.92 ? 90 LEU A C 1 ATOM 225 O O . LEU A 1 31 ? 27.942 105.545 81.834 1.00 51.23 ? 90 LEU A O 1 ATOM 226 C CB . LEU A 1 31 ? 29.091 102.873 83.452 1.00 55.39 ? 90 LEU A CB 1 ATOM 227 C CG . LEU A 1 31 ? 27.602 102.801 83.792 1.00 58.37 ? 90 LEU A CG 1 ATOM 228 C CD1 . LEU A 1 31 ? 26.817 102.258 82.608 1.00 39.79 ? 90 LEU A CD1 1 ATOM 229 C CD2 . LEU A 1 31 ? 27.378 101.944 85.027 1.00 63.47 ? 90 LEU A CD2 1 ATOM 230 N N . ARG A 1 32 ? 29.674 105.926 83.220 1.00 73.69 ? 91 ARG A N 1 ATOM 231 C CA . ARG A 1 32 ? 29.306 107.306 83.508 1.00 81.56 ? 91 ARG A CA 1 ATOM 232 C C . ARG A 1 32 ? 29.464 108.223 82.295 1.00 75.55 ? 91 ARG A C 1 ATOM 233 O O . ARG A 1 32 ? 28.652 109.126 82.089 1.00 65.50 ? 91 ARG A O 1 ATOM 234 C CB . ARG A 1 32 ? 30.153 107.823 84.674 1.00 81.69 ? 91 ARG A CB 1 ATOM 235 C CG . ARG A 1 32 ? 30.010 109.300 84.983 1.00 80.39 ? 91 ARG A CG 1 ATOM 236 C CD . ARG A 1 32 ? 30.986 109.701 86.078 1.00 85.34 ? 91 ARG A CD 1 ATOM 237 N NE . ARG A 1 32 ? 32.365 109.368 85.726 1.00 88.03 ? 91 ARG A NE 1 ATOM 238 C CZ . ARG A 1 32 ? 33.171 110.149 85.015 1.00 92.86 ? 91 ARG A CZ 1 ATOM 239 N NH1 . ARG A 1 32 ? 32.743 111.322 84.570 1.00 100.35 ? 91 ARG A NH1 1 ATOM 240 N NH2 . ARG A 1 32 ? 34.410 109.755 84.747 1.00 85.35 ? 91 ARG A NH2 1 ATOM 241 N N . LYS A 1 33 ? 30.500 107.993 81.494 1.00 59.69 ? 92 LYS A N 1 ATOM 242 C CA . LYS A 1 33 ? 30.686 108.756 80.262 1.00 49.92 ? 92 LYS A CA 1 ATOM 243 C C . LYS A 1 33 ? 29.550 108.525 79.263 1.00 67.00 ? 92 LYS A C 1 ATOM 244 O O . LYS A 1 33 ? 29.122 109.456 78.581 1.00 52.20 ? 92 LYS A O 1 ATOM 245 C CB . LYS A 1 33 ? 32.038 108.425 79.625 1.00 45.87 ? 92 LYS A CB 1 ATOM 246 C CG . LYS A 1 33 ? 33.223 108.892 80.459 1.00 42.47 ? 92 LYS A CG 1 ATOM 247 C CD . LYS A 1 33 ? 34.551 108.608 79.779 1.00 57.93 ? 92 LYS A CD 1 ATOM 248 C CE . LYS A 1 33 ? 35.692 109.289 80.520 1.00 68.78 ? 92 LYS A CE 1 ATOM 249 N NZ . LYS A 1 33 ? 37.026 108.852 80.027 1.00 78.00 ? 92 LYS A NZ 1 ATOM 250 N N . LEU A 1 34 ? 29.064 107.289 79.179 1.00 76.25 ? 93 LEU A N 1 ATOM 251 C CA . LEU A 1 34 ? 27.918 106.981 78.323 1.00 71.75 ? 93 LEU A CA 1 ATOM 252 C C . LEU A 1 34 ? 26.636 107.609 78.856 1.00 67.72 ? 93 LEU A C 1 ATOM 253 O O . LEU A 1 34 ? 25.805 108.084 78.082 1.00 59.46 ? 93 LEU A O 1 ATOM 254 C CB . LEU A 1 34 ? 27.722 105.469 78.165 1.00 69.05 ? 93 LEU A CB 1 ATOM 255 C CG . LEU A 1 34 ? 28.522 104.666 77.131 1.00 59.97 ? 93 LEU A CG 1 ATOM 256 C CD1 . LEU A 1 34 ? 28.283 105.219 75.739 1.00 60.48 ? 93 LEU A CD1 1 ATOM 257 C CD2 . LEU A 1 34 ? 29.998 104.617 77.423 1.00 56.19 ? 93 LEU A CD2 1 ATOM 258 N N . TYR A 1 35 ? 26.472 107.600 80.176 1.00 75.65 ? 94 TYR A N 1 ATOM 259 C CA . TYR A 1 35 ? 25.305 108.214 80.799 1.00 81.44 ? 94 TYR A CA 1 ATOM 260 C C . TYR A 1 35 ? 25.249 109.709 80.497 1.00 76.26 ? 94 TYR A C 1 ATOM 261 O O . TYR A 1 35 ? 24.219 110.228 80.067 1.00 65.11 ? 94 TYR A O 1 ATOM 262 C CB . TYR A 1 35 ? 25.320 107.997 82.315 1.00 75.17 ? 94 TYR A CB 1 ATOM 263 C CG . TYR A 1 35 ? 24.839 106.637 82.772 1.00 75.34 ? 94 TYR A CG 1 ATOM 264 C CD1 . TYR A 1 35 ? 24.278 105.735 81.878 1.00 71.88 ? 94 TYR A CD1 1 ATOM 265 C CD2 . TYR A 1 35 ? 24.935 106.263 84.106 1.00 74.43 ? 94 TYR A CD2 1 ATOM 266 C CE1 . TYR A 1 35 ? 23.834 104.494 82.301 1.00 71.19 ? 94 TYR A CE1 1 ATOM 267 C CE2 . TYR A 1 35 ? 24.494 105.028 84.537 1.00 72.46 ? 94 TYR A CE2 1 ATOM 268 C CZ . TYR A 1 35 ? 23.945 104.147 83.632 1.00 78.35 ? 94 TYR A CZ 1 ATOM 269 O OH . TYR A 1 35 ? 23.505 102.915 84.061 1.00 84.95 ? 94 TYR A OH 1 ATOM 270 N N . ASP A 1 36 ? 26.366 110.390 80.729 1.00 72.15 ? 95 ASP A N 1 ATOM 271 C CA . ASP A 1 36 ? 26.459 111.835 80.541 1.00 74.89 ? 95 ASP A CA 1 ATOM 272 C C . ASP A 1 36 ? 26.200 112.263 79.096 1.00 65.84 ? 95 ASP A C 1 ATOM 273 O O . ASP A 1 36 ? 25.529 113.264 78.849 1.00 68.69 ? 95 ASP A O 1 ATOM 274 C CB . ASP A 1 36 ? 27.833 112.334 80.994 1.00 91.11 ? 95 ASP A CB 1 ATOM 275 C CG . ASP A 1 36 ? 27.932 113.847 80.999 1.00 103.85 ? 95 ASP A CG 1 ATOM 276 O OD1 . ASP A 1 36 ? 26.881 114.515 81.099 1.00 107.45 ? 95 ASP A OD1 1 ATOM 277 O OD2 . ASP A 1 36 ? 29.063 114.369 80.908 1.00 105.13 ? 95 ASP A OD2 1 ATOM 278 N N . LEU A 1 37 ? 26.735 111.501 78.148 1.00 53.64 ? 96 LEU A N 1 ATOM 279 C CA . LEU A 1 37 ? 26.629 111.844 76.731 1.00 58.19 ? 96 LEU A CA 1 ATOM 280 C C . LEU A 1 37 ? 25.250 111.563 76.139 1.00 58.68 ? 96 LEU A C 1 ATOM 281 O O . LEU A 1 37 ? 24.988 111.898 74.985 1.00 71.07 ? 96 LEU A O 1 ATOM 282 C CB . LEU A 1 37 ? 27.687 111.086 75.926 1.00 63.96 ? 96 LEU A CB 1 ATOM 283 C CG . LEU A 1 37 ? 29.130 111.588 76.007 1.00 67.99 ? 96 LEU A CG 1 ATOM 284 C CD1 . LEU A 1 37 ? 30.100 110.492 75.593 1.00 65.05 ? 96 LEU A CD1 1 ATOM 285 C CD2 . LEU A 1 37 ? 29.319 112.830 75.149 1.00 71.59 ? 96 LEU A CD2 1 ATOM 286 N N . THR A 1 38 ? 24.371 110.953 76.927 1.00 62.93 ? 97 THR A N 1 ATOM 287 C CA . THR A 1 38 ? 23.075 110.499 76.426 1.00 67.48 ? 97 THR A CA 1 ATOM 288 C C . THR A 1 38 ? 21.911 110.886 77.334 1.00 66.26 ? 97 THR A C 1 ATOM 289 O O . THR A 1 38 ? 20.767 110.523 77.062 1.00 68.75 ? 97 THR A O 1 ATOM 290 C CB . THR A 1 38 ? 23.049 108.968 76.231 1.00 48.90 ? 97 THR A CB 1 ATOM 291 O OG1 . THR A 1 38 ? 23.478 108.322 77.436 1.00 52.44 ? 97 THR A OG1 1 ATOM 292 C CG2 . THR A 1 38 ? 23.962 108.555 75.089 1.00 48.94 ? 97 THR A CG2 1 ATOM 293 N N . LYS A 1 39 ? 22.201 111.615 78.408 1.00 59.41 ? 98 LYS A N 1 ATOM 294 C CA . LYS A 1 39 ? 21.175 111.972 79.385 1.00 74.49 ? 98 LYS A CA 1 ATOM 295 C C . LYS A 1 39 ? 20.073 112.855 78.802 1.00 71.46 ? 98 LYS A C 1 ATOM 296 O O . LYS A 1 39 ? 19.001 112.983 79.393 1.00 77.09 ? 98 LYS A O 1 ATOM 297 C CB . LYS A 1 39 ? 21.798 112.699 80.579 1.00 77.01 ? 98 LYS A CB 1 ATOM 298 C CG . LYS A 1 39 ? 22.487 114.005 80.214 1.00 84.77 ? 98 LYS A CG 1 ATOM 299 C CD . LYS A 1 39 ? 22.975 114.736 81.453 1.00 86.57 ? 98 LYS A CD 1 ATOM 300 C CE . LYS A 1 39 ? 23.711 116.018 81.091 1.00 82.55 ? 98 LYS A CE 1 ATOM 301 N NZ . LYS A 1 39 ? 24.828 115.785 80.137 1.00 76.18 ? 98 LYS A NZ 1 ATOM 302 N N . ASN A 1 40 ? 20.330 113.460 77.647 1.00 76.24 ? 99 ASN A N 1 ATOM 303 C CA . ASN A 1 40 ? 19.346 114.336 77.022 1.00 83.68 ? 99 ASN A CA 1 ATOM 304 C C . ASN A 1 40 ? 18.719 113.715 75.775 1.00 76.14 ? 99 ASN A C 1 ATOM 305 O O . ASN A 1 40 ? 17.952 114.366 75.064 1.00 74.11 ? 99 ASN A O 1 ATOM 306 C CB . ASN A 1 40 ? 19.997 115.678 76.669 1.00 87.77 ? 99 ASN A CB 1 ATOM 307 C CG . ASN A 1 40 ? 18.980 116.756 76.338 1.00 82.74 ? 99 ASN A CG 1 ATOM 308 O OD1 . ASN A 1 40 ? 17.833 116.701 76.779 1.00 71.06 ? 99 ASN A OD1 1 ATOM 309 N ND2 . ASN A 1 40 ? 19.399 117.741 75.551 1.00 93.99 ? 99 ASN A ND2 1 ATOM 310 N N . VAL A 1 41 ? 19.031 112.450 75.513 1.00 76.50 ? 100 VAL A N 1 ATOM 311 C CA . VAL A 1 41 ? 18.453 111.778 74.356 1.00 74.02 ? 100 VAL A CA 1 ATOM 312 C C . VAL A 1 41 ? 17.084 111.178 74.655 1.00 70.78 ? 100 VAL A C 1 ATOM 313 O O . VAL A 1 41 ? 16.936 110.366 75.568 1.00 64.88 ? 100 VAL A O 1 ATOM 314 C CB . VAL A 1 41 ? 19.378 110.657 73.845 1.00 59.29 ? 100 VAL A CB 1 ATOM 315 C CG1 . VAL A 1 41 ? 18.747 109.950 72.654 1.00 46.75 ? 100 VAL A CG1 1 ATOM 316 C CG2 . VAL A 1 41 ? 20.742 111.222 73.481 1.00 54.21 ? 100 VAL A CG2 1 ATOM 317 N N . ASP A 1 42 ? 16.091 111.571 73.865 1.00 79.56 ? 101 ASP A N 1 ATOM 318 C CA . ASP A 1 42 ? 14.747 111.028 73.990 1.00 78.86 ? 101 ASP A CA 1 ATOM 319 C C . ASP A 1 42 ? 14.674 109.761 73.148 1.00 77.68 ? 101 ASP A C 1 ATOM 320 O O . ASP A 1 42 ? 14.317 109.814 71.972 1.00 87.54 ? 101 ASP A O 1 ATOM 321 C CB . ASP A 1 42 ? 13.688 112.042 73.555 1.00 87.33 ? 101 ASP A CB 1 ATOM 322 C CG . ASP A 1 42 ? 12.271 111.563 73.828 1.00 89.41 ? 101 ASP A CG 1 ATOM 323 O OD1 . ASP A 1 42 ? 12.108 110.501 74.464 1.00 84.89 ? 101 ASP A OD1 1 ATOM 324 O OD2 . ASP A 1 42 ? 11.317 112.251 73.408 1.00 99.99 ? 101 ASP A OD2 1 ATOM 325 N N . PHE A 1 43 ? 15.018 108.627 73.746 1.00 75.48 ? 102 PHE A N 1 ATOM 326 C CA . PHE A 1 43 ? 15.075 107.373 73.006 1.00 72.95 ? 102 PHE A CA 1 ATOM 327 C C . PHE A 1 43 ? 13.695 106.929 72.532 1.00 71.98 ? 102 PHE A C 1 ATOM 328 O O . PHE A 1 43 ? 13.569 106.343 71.459 1.00 80.10 ? 102 PHE A O 1 ATOM 329 C CB . PHE A 1 43 ? 15.707 106.277 73.862 1.00 71.38 ? 102 PHE A CB 1 ATOM 330 C CG . PHE A 1 43 ? 17.196 106.413 74.024 1.00 73.33 ? 102 PHE A CG 1 ATOM 331 C CD1 . PHE A 1 43 ? 18.054 106.040 73.002 1.00 73.35 ? 102 PHE A CD1 1 ATOM 332 C CD2 . PHE A 1 43 ? 17.737 106.909 75.199 1.00 65.30 ? 102 PHE A CD2 1 ATOM 333 C CE1 . PHE A 1 43 ? 19.424 106.163 73.148 1.00 60.47 ? 102 PHE A CE1 1 ATOM 334 C CE2 . PHE A 1 43 ? 19.105 107.034 75.350 1.00 58.53 ? 102 PHE A CE2 1 ATOM 335 C CZ . PHE A 1 43 ? 19.949 106.661 74.324 1.00 53.32 ? 102 PHE A CZ 1 ATOM 336 N N . ASP A 1 44 ? 12.667 107.213 73.326 1.00 76.62 ? 103 ASP A N 1 ATOM 337 C CA . ASP A 1 44 ? 11.301 106.823 72.985 1.00 74.32 ? 103 ASP A CA 1 ATOM 338 C C . ASP A 1 44 ? 10.862 107.382 71.632 1.00 65.95 ? 103 ASP A C 1 ATOM 339 O O . ASP A 1 44 ? 10.299 106.659 70.809 1.00 57.66 ? 103 ASP A O 1 ATOM 340 C CB . ASP A 1 44 ? 10.330 107.274 74.076 1.00 76.97 ? 103 ASP A CB 1 ATOM 341 C CG . ASP A 1 44 ? 10.445 106.443 75.337 1.00 80.00 ? 103 ASP A CG 1 ATOM 342 O OD1 . ASP A 1 44 ? 10.976 105.316 75.261 1.00 84.78 ? 103 ASP A OD1 1 ATOM 343 O OD2 . ASP A 1 44 ? 10.002 106.916 76.404 1.00 91.65 ? 103 ASP A OD2 1 ATOM 344 N N . GLN A 1 45 ? 11.124 108.665 71.402 1.00 64.21 ? 104 GLN A N 1 ATOM 345 C CA . GLN A 1 45 ? 10.773 109.292 70.131 1.00 65.94 ? 104 GLN A CA 1 ATOM 346 C C . GLN A 1 45 ? 11.732 108.837 69.033 1.00 70.22 ? 104 GLN A C 1 ATOM 347 O O . GLN A 1 45 ? 11.368 108.783 67.861 1.00 68.39 ? 104 GLN A O 1 ATOM 348 C CB . GLN A 1 45 ? 10.770 110.820 70.252 1.00 71.15 ? 104 GLN A CB 1 ATOM 349 C CG . GLN A 1 45 ? 12.143 111.467 70.320 1.00 103.61 ? 104 GLN A CG 1 ATOM 350 C CD . GLN A 1 45 ? 12.069 112.970 70.504 1.00 111.58 ? 104 GLN A CD 1 ATOM 351 O OE1 . GLN A 1 45 ? 11.002 113.521 70.776 1.00 106.15 ? 104 GLN A OE1 1 ATOM 352 N NE2 . GLN A 1 45 ? 13.205 113.641 70.356 1.00 110.16 ? 104 GLN A NE2 1 ATOM 353 N N . LEU A 1 46 ? 12.964 108.527 69.422 1.00 71.66 ? 105 LEU A N 1 ATOM 354 C CA . LEU A 1 46 ? 13.983 108.068 68.485 1.00 59.25 ? 105 LEU A CA 1 ATOM 355 C C . LEU A 1 46 ? 13.649 106.679 67.930 1.00 65.49 ? 105 LEU A C 1 ATOM 356 O O . LEU A 1 46 ? 13.750 106.440 66.727 1.00 61.35 ? 105 LEU A O 1 ATOM 357 C CB . LEU A 1 46 ? 15.354 108.063 69.166 1.00 49.79 ? 105 LEU A CB 1 ATOM 358 C CG . LEU A 1 46 ? 16.589 108.203 68.276 1.00 44.79 ? 105 LEU A CG 1 ATOM 359 C CD1 . LEU A 1 46 ? 16.414 109.339 67.282 1.00 45.05 ? 105 LEU A CD1 1 ATOM 360 C CD2 . LEU A 1 46 ? 17.828 108.429 69.129 1.00 37.84 ? 105 LEU A CD2 1 ATOM 361 N N . ARG A 1 47 ? 13.257 105.771 68.820 1.00 71.23 ? 106 ARG A N 1 ATOM 362 C CA . ARG A 1 47 ? 12.895 104.396 68.462 1.00 67.79 ? 106 ARG A CA 1 ATOM 363 C C . ARG A 1 47 ? 11.758 104.243 67.447 1.00 70.27 ? 106 ARG A C 1 ATOM 364 O O . ARG A 1 47 ? 11.709 103.251 66.720 1.00 66.69 ? 106 ARG A O 1 ATOM 365 C CB . ARG A 1 47 ? 12.516 103.606 69.718 1.00 59.19 ? 106 ARG A CB 1 ATOM 366 C CG . ARG A 1 47 ? 13.650 103.343 70.691 1.00 70.90 ? 106 ARG A CG 1 ATOM 367 C CD . ARG A 1 47 ? 13.106 102.730 71.971 1.00 80.10 ? 106 ARG A CD 1 ATOM 368 N NE . ARG A 1 47 ? 12.478 101.434 71.726 1.00 85.54 ? 106 ARG A NE 1 ATOM 369 C CZ . ARG A 1 47 ? 13.069 100.263 71.936 1.00 76.52 ? 106 ARG A CZ 1 ATOM 370 N NH1 . ARG A 1 47 ? 14.306 100.218 72.411 1.00 66.41 ? 106 ARG A NH1 1 ATOM 371 N NH2 . ARG A 1 47 ? 12.420 99.135 71.681 1.00 73.17 ? 106 ARG A NH2 1 ATOM 372 N N . GLN A 1 48 ? 10.850 105.212 67.393 1.00 76.18 ? 107 GLN A N 1 ATOM 373 C CA . GLN A 1 48 ? 9.634 105.067 66.589 1.00 82.18 ? 107 GLN A CA 1 ATOM 374 C C . GLN A 1 48 ? 9.851 105.128 65.077 1.00 62.22 ? 107 GLN A C 1 ATOM 375 O O . GLN A 1 48 ? 8.914 104.920 64.307 1.00 66.13 ? 107 GLN A O 1 ATOM 376 C CB . GLN A 1 48 ? 8.617 106.142 66.981 1.00 94.47 ? 107 GLN A CB 1 ATOM 377 C CG . GLN A 1 48 ? 8.917 107.512 66.397 1.00 101.65 ? 107 GLN A CG 1 ATOM 378 C CD . GLN A 1 48 ? 7.797 108.505 66.630 1.00 100.93 ? 107 GLN A CD 1 ATOM 379 O OE1 . GLN A 1 48 ? 6.662 108.122 66.913 1.00 100.93 ? 107 GLN A OE1 1 ATOM 380 N NE2 . GLN A 1 48 ? 8.110 109.790 66.513 1.00 97.01 ? 107 GLN A NE2 1 ATOM 381 N N . ASN A 1 49 ? 11.077 105.409 64.652 1.00 61.38 ? 108 ASN A N 1 ATOM 382 C CA . ASN A 1 49 ? 11.384 105.493 63.228 1.00 67.15 ? 108 ASN A CA 1 ATOM 383 C C . ASN A 1 49 ? 12.226 104.320 62.737 1.00 60.80 ? 108 ASN A C 1 ATOM 384 O O . ASN A 1 49 ? 12.518 104.214 61.545 1.00 46.08 ? 108 ASN A O 1 ATOM 385 C CB . ASN A 1 49 ? 12.086 106.812 62.906 1.00 73.81 ? 108 ASN A CB 1 ATOM 386 C CG . ASN A 1 49 ? 11.125 107.984 62.860 1.00 80.86 ? 108 ASN A CG 1 ATOM 387 O OD1 . ASN A 1 49 ? 10.841 108.611 63.880 1.00 87.69 ? 108 ASN A OD1 1 ATOM 388 N ND2 . ASN A 1 49 ? 10.616 108.284 61.670 1.00 69.77 ? 108 ASN A ND2 1 ATOM 389 N N . GLU A 1 50 ? 12.618 103.442 63.656 1.00 63.03 ? 109 GLU A N 1 ATOM 390 C CA . GLU A 1 50 ? 13.459 102.305 63.301 1.00 71.98 ? 109 GLU A CA 1 ATOM 391 C C . GLU A 1 50 ? 12.703 101.351 62.385 1.00 68.32 ? 109 GLU A C 1 ATOM 392 O O . GLU A 1 50 ? 13.298 100.688 61.536 1.00 61.58 ? 109 GLU A O 1 ATOM 393 C CB . GLU A 1 50 ? 13.928 101.571 64.556 1.00 51.16 ? 109 GLU A CB 1 ATOM 394 C CG . GLU A 1 50 ? 14.740 102.428 65.506 1.00 51.08 ? 109 GLU A CG 1 ATOM 395 C CD . GLU A 1 50 ? 15.194 101.658 66.725 1.00 58.97 ? 109 GLU A CD 1 ATOM 396 O OE1 . GLU A 1 50 ? 14.978 100.429 66.758 1.00 60.12 ? 109 GLU A OE1 1 ATOM 397 O OE2 . GLU A 1 50 ? 15.767 102.278 67.645 1.00 55.09 ? 109 GLU A OE2 1 ATOM 398 N N . CYS A 1 51 ? 11.389 101.284 62.566 1.00 60.93 ? 110 CYS A N 1 ATOM 399 C CA . CYS A 1 51 ? 10.546 100.477 61.699 1.00 71.99 ? 110 CYS A CA 1 ATOM 400 C C . CYS A 1 51 ? 9.520 101.381 61.024 1.00 68.87 ? 110 CYS A C 1 ATOM 401 O O . CYS A 1 51 ? 8.661 101.962 61.690 1.00 69.63 ? 110 CYS A O 1 ATOM 402 C CB . CYS A 1 51 ? 9.855 99.365 62.489 1.00 82.32 ? 110 CYS A CB 1 ATOM 403 S SG . CYS A 1 51 ? 8.832 98.265 61.487 1.00 64.17 ? 110 CYS A SG 1 ATOM 404 N N . LYS A 1 52 ? 9.619 101.498 59.703 1.00 70.02 ? 111 LYS A N 1 ATOM 405 C CA . LYS A 1 52 ? 8.717 102.344 58.925 1.00 84.00 ? 111 LYS A CA 1 ATOM 406 C C . LYS A 1 52 ? 7.274 101.878 59.052 1.00 82.28 ? 111 LYS A C 1 ATOM 407 O O . LYS A 1 52 ? 6.449 102.537 59.685 1.00 88.65 ? 111 LYS A O 1 ATOM 408 C CB . LYS A 1 52 ? 9.134 102.374 57.455 1.00 82.83 ? 111 LYS A CB 1 ATOM 409 C CG . LYS A 1 52 ? 10.265 103.346 57.159 1.00 81.24 ? 111 LYS A CG 1 ATOM 410 C CD . LYS A 1 52 ? 10.047 104.064 55.837 1.00 82.16 ? 111 LYS A CD 1 ATOM 411 C CE . LYS A 1 52 ? 9.871 103.085 54.689 1.00 87.05 ? 111 LYS A CE 1 ATOM 412 N NZ . LYS A 1 52 ? 9.893 103.779 53.372 1.00 86.12 ? 111 LYS A NZ 1 ATOM 413 N N . LYS A 1 53 ? 6.978 100.729 58.455 1.00 79.76 ? 112 LYS A N 1 ATOM 414 C CA . LYS A 1 53 ? 5.644 100.156 58.533 1.00 73.53 ? 112 LYS A CA 1 ATOM 415 C C . LYS A 1 53 ? 5.713 98.740 59.080 1.00 72.48 ? 112 LYS A C 1 ATOM 416 O O . LYS A 1 53 ? 6.355 97.862 58.501 1.00 77.13 ? 112 LYS A O 1 ATOM 417 C CB . LYS A 1 53 ? 4.969 100.153 57.163 1.00 68.85 ? 112 LYS A CB 1 ATOM 418 C CG . LYS A 1 53 ? 3.468 99.950 57.227 1.00 77.73 ? 112 LYS A CG 1 ATOM 419 C CD . LYS A 1 53 ? 2.883 99.801 55.839 1.00 84.58 ? 112 LYS A CD 1 ATOM 420 C CE . LYS A 1 53 ? 1.367 99.815 55.868 1.00 81.42 ? 112 LYS A CE 1 ATOM 421 N NZ . LYS A 1 53 ? 0.814 99.515 54.520 1.00 74.61 ? 112 LYS A NZ 1 ATOM 422 N N . ASN A 1 54 ? 5.054 98.537 60.215 1.00 67.40 ? 113 ASN A N 1 ATOM 423 C CA . ASN A 1 54 ? 5.027 97.243 60.879 1.00 62.08 ? 113 ASN A CA 1 ATOM 424 C C . ASN A 1 54 ? 3.865 96.394 60.362 1.00 64.95 ? 113 ASN A C 1 ATOM 425 O O . ASN A 1 54 ? 2.742 96.484 60.860 1.00 65.93 ? 113 ASN A O 1 ATOM 426 C CB . ASN A 1 54 ? 4.944 97.441 62.398 1.00 48.89 ? 113 ASN A CB 1 ATOM 427 C CG . ASN A 1 54 ? 5.203 96.163 63.177 1.00 54.39 ? 113 ASN A CG 1 ATOM 428 O OD1 . ASN A 1 54 ? 5.137 95.063 62.630 1.00 37.29 ? 113 ASN A OD1 1 ATOM 429 N ND2 . ASN A 1 54 ? 5.534 96.306 64.458 1.00 52.88 ? 113 ASN A ND2 1 ATOM 430 N N . ILE A 1 55 ? 4.145 95.564 59.363 1.00 63.44 ? 114 ILE A N 1 ATOM 431 C CA . ILE A 1 55 ? 3.120 94.699 58.797 1.00 72.88 ? 114 ILE A CA 1 ATOM 432 C C . ILE A 1 55 ? 3.614 93.259 58.664 1.00 75.62 ? 114 ILE A C 1 ATOM 433 O O . ILE A 1 55 ? 4.776 93.010 58.340 1.00 74.21 ? 114 ILE A O 1 ATOM 434 C CB . ILE A 1 55 ? 2.652 95.234 57.417 1.00 58.77 ? 114 ILE A CB 1 ATOM 435 C CG1 . ILE A 1 55 ? 1.507 94.389 56.852 1.00 62.06 ? 114 ILE A CG1 1 ATOM 436 C CG2 . ILE A 1 55 ? 3.819 95.320 56.439 1.00 55.69 ? 114 ILE A CG2 1 ATOM 437 C CD1 . ILE A 1 55 ? 0.985 94.888 55.522 1.00 65.18 ? 114 ILE A CD1 1 ATOM 438 N N . THR A 1 56 ? 2.719 92.314 58.932 1.00 74.99 ? 115 THR A N 1 ATOM 439 C CA . THR A 1 56 ? 3.036 90.900 58.819 1.00 62.12 ? 115 THR A CA 1 ATOM 440 C C . THR A 1 56 ? 2.800 90.439 57.392 1.00 54.00 ? 115 THR A C 1 ATOM 441 O O . THR A 1 56 ? 2.331 91.205 56.551 1.00 57.82 ? 115 THR A O 1 ATOM 442 C CB . THR A 1 56 ? 2.195 90.043 59.782 1.00 59.55 ? 115 THR A CB 1 ATOM 443 O OG1 . THR A 1 56 ? 0.846 89.966 59.304 1.00 65.39 ? 115 THR A OG1 1 ATOM 444 C CG2 . THR A 1 56 ? 2.200 90.647 61.178 1.00 39.68 ? 115 THR A CG2 1 ATOM 445 N N . LEU A 1 57 ? 3.133 89.184 57.121 1.00 67.17 ? 116 LEU A N 1 ATOM 446 C CA . LEU A 1 57 ? 2.991 88.634 55.784 1.00 69.77 ? 116 LEU A CA 1 ATOM 447 C C . LEU A 1 57 ? 1.526 88.395 55.437 1.00 74.98 ? 116 LEU A C 1 ATOM 448 O O . LEU A 1 57 ? 1.127 88.516 54.279 1.00 84.18 ? 116 LEU A O 1 ATOM 449 C CB . LEU A 1 57 ? 3.781 87.332 55.663 1.00 59.05 ? 116 LEU A CB 1 ATOM 450 C CG . LEU A 1 57 ? 4.146 86.886 54.249 1.00 67.73 ? 116 LEU A CG 1 ATOM 451 C CD1 . LEU A 1 57 ? 4.959 87.956 53.536 1.00 60.73 ? 116 LEU A CD1 1 ATOM 452 C CD2 . LEU A 1 57 ? 4.902 85.570 54.297 1.00 70.49 ? 116 LEU A CD2 1 ATOM 453 N N . SER A 1 58 ? 0.728 88.065 56.447 1.00 77.14 ? 117 SER A N 1 ATOM 454 C CA . SER A 1 58 ? -0.688 87.776 56.240 1.00 85.17 ? 117 SER A CA 1 ATOM 455 C C . SER A 1 58 ? -1.487 89.028 55.890 1.00 80.77 ? 117 SER A C 1 ATOM 456 O O . SER A 1 58 ? -2.315 89.006 54.979 1.00 85.98 ? 117 SER A O 1 ATOM 457 C CB . SER A 1 58 ? -1.282 87.111 57.483 1.00 75.55 ? 117 SER A CB 1 ATOM 458 O OG . SER A 1 58 ? -1.348 88.021 58.568 1.00 80.34 ? 117 SER A OG 1 ATOM 459 N N . LYS A 1 59 ? -1.241 90.116 56.614 1.00 67.54 ? 118 LYS A N 1 ATOM 460 C CA . LYS A 1 59 ? -1.946 91.368 56.362 1.00 73.66 ? 118 LYS A CA 1 ATOM 461 C C . LYS A 1 59 ? -1.537 91.946 55.012 1.00 76.08 ? 118 LYS A C 1 ATOM 462 O O . LYS A 1 59 ? -2.294 92.686 54.384 1.00 93.45 ? 118 LYS A O 1 ATOM 463 C CB . LYS A 1 59 ? -1.670 92.375 57.480 1.00 75.87 ? 118 LYS A CB 1 ATOM 464 C CG . LYS A 1 59 ? -2.143 91.921 58.852 1.00 81.06 ? 118 LYS A CG 1 ATOM 465 C CD . LYS A 1 59 ? -1.755 92.917 59.934 1.00 90.06 ? 118 LYS A CD 1 ATOM 466 C CE . LYS A 1 59 ? -0.249 93.113 59.986 1.00 86.94 ? 118 LYS A CE 1 ATOM 467 N NZ . LYS A 1 59 ? 0.176 93.963 61.133 1.00 78.24 ? 118 LYS A NZ 1 ATOM 468 N N . PHE A 1 60 ? -0.332 91.597 54.576 1.00 79.67 ? 119 PHE A N 1 ATOM 469 C CA . PHE A 1 60 ? 0.181 92.024 53.281 1.00 79.59 ? 119 PHE A CA 1 ATOM 470 C C . PHE A 1 60 ? -0.474 91.249 52.143 1.00 77.60 ? 119 PHE A C 1 ATOM 471 O O . PHE A 1 60 ? -0.660 91.777 51.046 1.00 74.93 ? 119 PHE A O 1 ATOM 472 C CB . PHE A 1 60 ? 1.703 91.857 53.229 1.00 82.45 ? 119 PHE A CB 1 ATOM 473 C CG . PHE A 1 60 ? 2.308 92.209 51.900 1.00 85.02 ? 119 PHE A CG 1 ATOM 474 C CD1 . PHE A 1 60 ? 2.526 93.532 51.551 1.00 80.77 ? 119 PHE A CD1 1 ATOM 475 C CD2 . PHE A 1 60 ? 2.666 91.216 51.002 1.00 87.50 ? 119 PHE A CD2 1 ATOM 476 C CE1 . PHE A 1 60 ? 3.085 93.858 50.329 1.00 72.37 ? 119 PHE A CE1 1 ATOM 477 C CE2 . PHE A 1 60 ? 3.224 91.536 49.778 1.00 80.52 ? 119 PHE A CE2 1 ATOM 478 C CZ . PHE A 1 60 ? 3.434 92.859 49.442 1.00 70.81 ? 119 PHE A CZ 1 ATOM 479 N N . TRP A 1 61 ? -0.822 89.993 52.411 1.00 92.02 ? 120 TRP A N 1 ATOM 480 C CA . TRP A 1 61 ? -1.435 89.134 51.403 1.00 92.83 ? 120 TRP A CA 1 ATOM 481 C C . TRP A 1 61 ? -2.886 89.516 51.121 1.00 81.99 ? 120 TRP A C 1 ATOM 482 O O . TRP A 1 61 ? -3.344 89.425 49.982 1.00 69.69 ? 120 TRP A O 1 ATOM 483 C CB . TRP A 1 61 ? -1.369 87.665 51.834 1.00 94.09 ? 120 TRP A CB 1 ATOM 484 C CG . TRP A 1 61 ? -0.001 87.015 51.755 1.00 98.22 ? 120 TRP A CG 1 ATOM 485 C CD1 . TRP A 1 61 ? 0.508 86.097 52.628 1.00 96.26 ? 120 TRP A CD1 1 ATOM 486 C CD2 . TRP A 1 61 ? 1.021 87.230 50.764 1.00 86.96 ? 120 TRP A CD2 1 ATOM 487 N NE1 . TRP A 1 61 ? 1.773 85.726 52.246 1.00 78.64 ? 120 TRP A NE1 1 ATOM 488 C CE2 . TRP A 1 61 ? 2.112 86.406 51.108 1.00 84.97 ? 120 TRP A CE2 1 ATOM 489 C CE3 . TRP A 1 61 ? 1.119 88.034 49.622 1.00 78.28 ? 120 TRP A CE3 1 ATOM 490 C CZ2 . TRP A 1 61 ? 3.284 86.365 50.354 1.00 76.83 ? 120 TRP A CZ2 1 ATOM 491 C CZ3 . TRP A 1 61 ? 2.285 87.993 48.877 1.00 85.17 ? 120 TRP A CZ3 1 ATOM 492 C CH2 . TRP A 1 61 ? 3.350 87.163 49.245 1.00 82.57 ? 120 TRP A CH2 1 ATOM 493 N N . GLU A 1 62 ? -3.603 89.915 52.169 1.00 52.55 ? 121 GLU A N 1 ATOM 494 C CA . GLU A 1 62 ? -5.000 90.339 52.064 1.00 70.25 ? 121 GLU A CA 1 ATOM 495 C C . GLU A 1 62 ? -5.252 91.299 50.903 1.00 77.35 ? 121 GLU A C 1 ATOM 496 O O . GLU A 1 62 ? -5.828 90.918 49.883 1.00 69.80 ? 121 GLU A O 1 ATOM 497 C CB . GLU A 1 62 ? -5.449 90.992 53.371 1.00 72.45 ? 121 GLU A CB 1 ATOM 498 C CG . GLU A 1 62 ? -5.475 90.051 54.562 1.00 80.33 ? 121 GLU A CG 1 ATOM 499 C CD . GLU A 1 62 ? -6.329 90.578 55.697 1.00 103.61 ? 121 GLU A CD 1 ATOM 500 O OE1 . GLU A 1 62 ? -6.355 91.810 55.896 1.00 102.43 ? 121 GLU A OE1 1 ATOM 501 O OE2 . GLU A 1 62 ? -6.974 89.762 56.389 1.00 112.45 ? 121 GLU A OE2 1 ATOM 502 N N . PRO A 1 70 ? -4.543 80.462 56.977 1.00 96.46 ? 129 PRO A N 1 ATOM 503 C CA . PRO A 1 70 ? -4.042 79.102 56.750 1.00 92.46 ? 129 PRO A CA 1 ATOM 504 C C . PRO A 1 70 ? -3.748 78.367 58.055 1.00 95.47 ? 129 PRO A C 1 ATOM 505 O O . PRO A 1 70 ? -3.890 77.148 58.105 1.00 122.29 ? 129 PRO A O 1 ATOM 506 C CB . PRO A 1 70 ? -2.757 79.336 55.953 1.00 68.86 ? 129 PRO A CB 1 ATOM 507 C CG . PRO A 1 70 ? -3.016 80.602 55.215 1.00 79.33 ? 129 PRO A CG 1 ATOM 508 C CD . PRO A 1 70 ? -3.834 81.453 56.149 1.00 80.16 ? 129 PRO A CD 1 ATOM 509 N N . GLU A 1 71 ? -3.360 79.124 59.080 1.00 68.79 ? 130 GLU A N 1 ATOM 510 C CA . GLU A 1 71 ? -2.964 78.636 60.410 1.00 69.83 ? 130 GLU A CA 1 ATOM 511 C C . GLU A 1 71 ? -3.410 77.232 60.846 1.00 72.27 ? 130 GLU A C 1 ATOM 512 O O . GLU A 1 71 ? -4.023 77.084 61.903 1.00 57.27 ? 130 GLU A O 1 ATOM 513 C CB . GLU A 1 71 ? -3.469 79.625 61.468 1.00 73.21 ? 130 GLU A CB 1 ATOM 514 C CG . GLU A 1 71 ? -3.886 80.984 60.920 1.00 77.08 ? 130 GLU A CG 1 ATOM 515 C CD . GLU A 1 71 ? -2.723 81.943 60.775 1.00 82.05 ? 130 GLU A CD 1 ATOM 516 O OE1 . GLU A 1 71 ? -2.346 82.576 61.784 1.00 84.95 ? 130 GLU A OE1 1 ATOM 517 O OE2 . GLU A 1 71 ? -2.187 82.066 59.654 1.00 79.82 ? 130 GLU A OE2 1 ATOM 518 N N . ASP A 1 72 ? -3.111 76.207 60.052 1.00 75.69 ? 131 ASP A N 1 ATOM 519 C CA . ASP A 1 72 ? -3.454 74.843 60.446 1.00 72.70 ? 131 ASP A CA 1 ATOM 520 C C . ASP A 1 72 ? -2.443 74.318 61.459 1.00 69.96 ? 131 ASP A C 1 ATOM 521 O O . ASP A 1 72 ? -2.788 73.557 62.364 1.00 73.39 ? 131 ASP A O 1 ATOM 522 C CB . ASP A 1 72 ? -3.519 73.915 59.230 1.00 77.54 ? 131 ASP A CB 1 ATOM 523 C CG . ASP A 1 72 ? -4.690 74.228 58.318 1.00 84.36 ? 131 ASP A CG 1 ATOM 524 O OD1 . ASP A 1 72 ? -5.761 74.609 58.835 1.00 72.47 ? 131 ASP A OD1 1 ATOM 525 O OD2 . ASP A 1 72 ? -4.542 74.088 57.086 1.00 88.91 ? 131 ASP A OD2 1 ATOM 526 N N . ASP A 1 73 ? -1.190 74.730 61.295 1.00 74.01 ? 132 ASP A N 1 ATOM 527 C CA . ASP A 1 73 ? -0.121 74.337 62.204 1.00 69.74 ? 132 ASP A CA 1 ATOM 528 C C . ASP A 1 73 ? 0.769 75.535 62.523 1.00 64.32 ? 132 ASP A C 1 ATOM 529 O O . ASP A 1 73 ? 0.638 76.595 61.909 1.00 55.18 ? 132 ASP A O 1 ATOM 530 C CB . ASP A 1 73 ? 0.700 73.185 61.614 1.00 40.06 ? 132 ASP A CB 1 ATOM 531 C CG . ASP A 1 73 ? 1.173 73.461 60.199 1.00 46.97 ? 132 ASP A CG 1 ATOM 532 O OD1 . ASP A 1 73 ? 0.923 72.612 59.318 1.00 52.31 ? 132 ASP A OD1 1 ATOM 533 O OD2 . ASP A 1 73 ? 1.808 74.510 59.966 1.00 53.03 ? 132 ASP A OD2 1 ATOM 534 N N . ASN A 1 74 ? 1.676 75.361 63.479 1.00 50.41 ? 133 ASN A N 1 ATOM 535 C CA . ASN A 1 74 ? 2.537 76.452 63.923 1.00 46.29 ? 133 ASN A CA 1 ATOM 536 C C . ASN A 1 74 ? 3.586 76.870 62.895 1.00 54.36 ? 133 ASN A C 1 ATOM 537 O O . ASN A 1 74 ? 4.151 77.956 62.999 1.00 48.67 ? 133 ASN A O 1 ATOM 538 C CB . ASN A 1 74 ? 3.223 76.083 65.240 1.00 48.74 ? 133 ASN A CB 1 ATOM 539 C CG . ASN A 1 74 ? 2.252 76.012 66.403 1.00 49.98 ? 133 ASN A CG 1 ATOM 540 O OD1 . ASN A 1 74 ? 1.270 76.754 66.451 1.00 50.14 ? 133 ASN A OD1 1 ATOM 541 N ND2 . ASN A 1 74 ? 2.524 75.123 67.350 1.00 49.96 ? 133 ASN A ND2 1 ATOM 542 N N . TRP A 1 75 ? 3.857 76.013 61.913 1.00 52.55 ? 134 TRP A N 1 ATOM 543 C CA . TRP A 1 75 ? 4.716 76.404 60.798 1.00 53.14 ? 134 TRP A CA 1 ATOM 544 C C . TRP A 1 75 ? 4.041 77.525 60.021 1.00 62.67 ? 134 TRP A C 1 ATOM 545 O O . TRP A 1 75 ? 4.628 78.582 59.783 1.00 51.53 ? 134 TRP A O 1 ATOM 546 C CB . TRP A 1 75 ? 4.997 75.224 59.865 1.00 42.25 ? 134 TRP A CB 1 ATOM 547 C CG . TRP A 1 75 ? 6.070 74.289 60.326 1.00 52.69 ? 134 TRP A CG 1 ATOM 548 C CD1 . TRP A 1 75 ? 7.339 74.195 59.834 1.00 40.28 ? 134 TRP A CD1 1 ATOM 549 C CD2 . TRP A 1 75 ? 5.965 73.295 61.353 1.00 52.37 ? 134 TRP A CD2 1 ATOM 550 N NE1 . TRP A 1 75 ? 8.034 73.215 60.497 1.00 46.84 ? 134 TRP A NE1 1 ATOM 551 C CE2 . TRP A 1 75 ? 7.213 72.646 61.434 1.00 52.20 ? 134 TRP A CE2 1 ATOM 552 C CE3 . TRP A 1 75 ? 4.939 72.896 62.214 1.00 35.39 ? 134 TRP A CE3 1 ATOM 553 C CZ2 . TRP A 1 75 ? 7.462 71.619 62.342 1.00 52.92 ? 134 TRP A CZ2 1 ATOM 554 C CZ3 . TRP A 1 75 ? 5.189 71.876 63.115 1.00 38.66 ? 134 TRP A CZ3 1 ATOM 555 C CH2 . TRP A 1 75 ? 6.440 71.249 63.172 1.00 42.39 ? 134 TRP A CH2 1 ATOM 556 N N . GLU A 1 76 ? 2.796 77.272 59.633 1.00 67.28 ? 135 GLU A N 1 ATOM 557 C CA . GLU A 1 76 ? 1.989 78.226 58.885 1.00 69.26 ? 135 GLU A CA 1 ATOM 558 C C . GLU A 1 76 ? 1.723 79.465 59.732 1.00 59.54 ? 135 GLU A C 1 ATOM 559 O O . GLU A 1 76 ? 1.690 80.585 59.224 1.00 49.82 ? 135 GLU A O 1 ATOM 560 C CB . GLU A 1 76 ? 0.680 77.576 58.438 1.00 47.05 ? 135 GLU A CB 1 ATOM 561 C CG . GLU A 1 76 ? 0.869 76.535 57.347 1.00 71.03 ? 135 GLU A CG 1 ATOM 562 C CD . GLU A 1 76 ? -0.418 75.833 56.970 1.00 77.89 ? 135 GLU A CD 1 ATOM 563 O OE1 . GLU A 1 76 ? -1.427 76.028 57.675 1.00 83.52 ? 135 GLU A OE1 1 ATOM 564 O OE2 . GLU A 1 76 ? -0.419 75.085 55.970 1.00 76.38 ? 135 GLU A OE2 1 ATOM 565 N N . ARG A 1 77 ? 1.530 79.247 61.028 1.00 51.35 ? 136 ARG A N 1 ATOM 566 C CA . ARG A 1 77 ? 1.332 80.335 61.975 1.00 45.22 ? 136 ARG A CA 1 ATOM 567 C C . ARG A 1 77 ? 2.601 81.177 62.103 1.00 63.13 ? 136 ARG A C 1 ATOM 568 O O . ARG A 1 77 ? 2.536 82.392 62.288 1.00 64.87 ? 136 ARG A O 1 ATOM 569 C CB . ARG A 1 77 ? 0.924 79.773 63.337 1.00 46.55 ? 136 ARG A CB 1 ATOM 570 C CG . ARG A 1 77 ? -0.179 80.541 64.038 1.00 57.20 ? 136 ARG A CG 1 ATOM 571 C CD . ARG A 1 77 ? -0.839 79.672 65.095 1.00 56.58 ? 136 ARG A CD 1 ATOM 572 N NE . ARG A 1 77 ? -1.397 78.455 64.511 1.00 70.02 ? 136 ARG A NE 1 ATOM 573 C CZ . ARG A 1 77 ? -1.914 77.453 65.214 1.00 78.72 ? 136 ARG A CZ 1 ATOM 574 N NH1 . ARG A 1 77 ? -1.944 77.513 66.538 1.00 83.14 ? 136 ARG A NH1 1 ATOM 575 N NH2 . ARG A 1 77 ? -2.398 76.386 64.592 1.00 71.16 ? 136 ARG A NH2 1 ATOM 576 N N . PHE A 1 78 ? 3.754 80.520 62.003 1.00 59.78 ? 137 PHE A N 1 ATOM 577 C CA . PHE A 1 78 ? 5.042 81.208 61.989 1.00 38.63 ? 137 PHE A CA 1 ATOM 578 C C . PHE A 1 78 ? 5.230 82.016 60.708 1.00 46.64 ? 137 PHE A C 1 ATOM 579 O O . PHE A 1 78 ? 5.610 83.186 60.751 1.00 48.26 ? 137 PHE A O 1 ATOM 580 C CB . PHE A 1 78 ? 6.188 80.207 62.154 1.00 47.29 ? 137 PHE A CB 1 ATOM 581 C CG . PHE A 1 78 ? 7.527 80.737 61.726 1.00 42.80 ? 137 PHE A CG 1 ATOM 582 C CD1 . PHE A 1 78 ? 8.180 81.699 62.478 1.00 41.37 ? 137 PHE A CD1 1 ATOM 583 C CD2 . PHE A 1 78 ? 8.138 80.265 60.576 1.00 35.79 ? 137 PHE A CD2 1 ATOM 584 C CE1 . PHE A 1 78 ? 9.413 82.187 62.087 1.00 34.24 ? 137 PHE A CE1 1 ATOM 585 C CE2 . PHE A 1 78 ? 9.371 80.748 60.180 1.00 43.19 ? 137 PHE A CE2 1 ATOM 586 C CZ . PHE A 1 78 ? 10.009 81.710 60.937 1.00 41.89 ? 137 PHE A CZ 1 ATOM 587 N N . TYR A 1 79 ? 4.972 81.375 59.572 1.00 46.88 ? 138 TYR A N 1 ATOM 588 C CA . TYR A 1 79 ? 5.105 82.013 58.265 1.00 53.46 ? 138 TYR A CA 1 ATOM 589 C C . TYR A 1 79 ? 4.228 83.255 58.131 1.00 53.90 ? 138 TYR A C 1 ATOM 590 O O . TYR A 1 79 ? 4.663 84.279 57.605 1.00 60.46 ? 138 TYR A O 1 ATOM 591 C CB . TYR A 1 79 ? 4.756 81.022 57.150 1.00 40.23 ? 138 TYR A CB 1 ATOM 592 C CG . TYR A 1 79 ? 5.696 79.843 57.047 1.00 58.44 ? 138 TYR A CG 1 ATOM 593 C CD1 . TYR A 1 79 ? 7.048 79.981 57.325 1.00 56.73 ? 138 TYR A CD1 1 ATOM 594 C CD2 . TYR A 1 79 ? 5.230 78.592 56.663 1.00 59.11 ? 138 TYR A CD2 1 ATOM 595 C CE1 . TYR A 1 79 ? 7.910 78.904 57.230 1.00 51.12 ? 138 TYR A CE1 1 ATOM 596 C CE2 . TYR A 1 79 ? 6.084 77.510 56.565 1.00 50.90 ? 138 TYR A CE2 1 ATOM 597 C CZ . TYR A 1 79 ? 7.423 77.672 56.850 1.00 52.42 ? 138 TYR A CZ 1 ATOM 598 O OH . TYR A 1 79 ? 8.277 76.598 56.753 1.00 44.46 ? 138 TYR A OH 1 ATOM 599 N N . SER A 1 80 ? 2.994 83.155 58.614 1.00 46.83 ? 139 SER A N 1 ATOM 600 C CA . SER A 1 80 ? 2.027 84.243 58.506 1.00 62.51 ? 139 SER A CA 1 ATOM 601 C C . SER A 1 80 ? 2.432 85.486 59.294 1.00 59.06 ? 139 SER A C 1 ATOM 602 O O . SER A 1 80 ? 2.180 86.610 58.860 1.00 60.83 ? 139 SER A O 1 ATOM 603 C CB . SER A 1 80 ? 0.649 83.768 58.971 1.00 52.54 ? 139 SER A CB 1 ATOM 604 O OG . SER A 1 80 ? 0.059 82.907 58.013 1.00 58.12 ? 139 SER A OG 1 ATOM 605 N N . ASN A 1 81 ? 3.060 85.284 60.447 1.00 47.99 ? 140 ASN A N 1 ATOM 606 C CA . ASN A 1 81 ? 3.417 86.400 61.316 1.00 50.85 ? 140 ASN A CA 1 ATOM 607 C C . ASN A 1 81 ? 4.813 86.954 61.044 1.00 53.90 ? 140 ASN A C 1 ATOM 608 O O . ASN A 1 81 ? 5.327 87.760 61.819 1.00 54.47 ? 140 ASN A O 1 ATOM 609 C CB . ASN A 1 81 ? 3.305 85.984 62.783 1.00 57.86 ? 140 ASN A CB 1 ATOM 610 C CG . ASN A 1 81 ? 1.865 85.858 63.242 1.00 58.65 ? 140 ASN A CG 1 ATOM 611 O OD1 . ASN A 1 81 ? 0.983 85.495 62.464 1.00 55.86 ? 140 ASN A OD1 1 ATOM 612 N ND2 . ASN A 1 81 ? 1.618 86.168 64.510 1.00 53.66 ? 140 ASN A ND2 1 ATOM 613 N N . ILE A 1 82 ? 5.426 86.516 59.949 1.00 41.66 ? 141 ILE A N 1 ATOM 614 C CA . ILE A 1 82 ? 6.693 87.091 59.509 1.00 49.86 ? 141 ILE A CA 1 ATOM 615 C C . ILE A 1 82 ? 6.493 88.556 59.129 1.00 57.78 ? 141 ILE A C 1 ATOM 616 O O . ILE A 1 82 ? 5.799 88.866 58.161 1.00 58.68 ? 141 ILE A O 1 ATOM 617 C CB . ILE A 1 82 ? 7.291 86.321 58.317 1.00 53.57 ? 141 ILE A CB 1 ATOM 618 C CG1 . ILE A 1 82 ? 7.693 84.907 58.743 1.00 53.46 ? 141 ILE A CG1 1 ATOM 619 C CG2 . ILE A 1 82 ? 8.493 87.061 57.754 1.00 53.18 ? 141 ILE A CG2 1 ATOM 620 C CD1 . ILE A 1 82 ? 8.209 84.052 57.606 1.00 42.89 ? 141 ILE A CD1 1 ATOM 621 N N . GLY A 1 83 ? 7.097 89.453 59.902 1.00 58.49 ? 142 GLY A N 1 ATOM 622 C CA . GLY A 1 83 ? 6.862 90.877 59.745 1.00 57.57 ? 142 GLY A CA 1 ATOM 623 C C . GLY A 1 83 ? 7.863 91.574 58.844 1.00 59.86 ? 142 GLY A C 1 ATOM 624 O O . GLY A 1 83 ? 8.817 90.963 58.363 1.00 56.52 ? 142 GLY A O 1 ATOM 625 N N . SER A 1 84 ? 7.640 92.865 58.622 1.00 61.18 ? 143 SER A N 1 ATOM 626 C CA . SER A 1 84 ? 8.479 93.654 57.729 1.00 59.80 ? 143 SER A CA 1 ATOM 627 C C . SER A 1 84 ? 9.715 94.192 58.444 1.00 58.91 ? 143 SER A C 1 ATOM 628 O O . SER A 1 84 ? 10.661 94.650 57.804 1.00 64.85 ? 143 SER A O 1 ATOM 629 C CB . SER A 1 84 ? 7.677 94.811 57.131 1.00 49.75 ? 143 SER A CB 1 ATOM 630 O OG . SER A 1 84 ? 7.122 95.623 58.151 1.00 59.60 ? 143 SER A OG 1 ATOM 631 N N . CYS A 1 85 ? 9.700 94.138 59.771 1.00 52.22 ? 144 CYS A N 1 ATOM 632 C CA . CYS A 1 85 ? 10.815 94.634 60.568 1.00 68.42 ? 144 CYS A CA 1 ATOM 633 C C . CYS A 1 85 ? 11.278 93.590 61.579 1.00 63.10 ? 144 CYS A C 1 ATOM 634 O O . CYS A 1 85 ? 12.110 93.873 62.442 1.00 65.39 ? 144 CYS A O 1 ATOM 635 C CB . CYS A 1 85 ? 10.427 95.929 61.287 1.00 85.50 ? 144 CYS A CB 1 ATOM 636 S SG . CYS A 1 85 ? 10.071 97.320 60.185 1.00 74.88 ? 144 CYS A SG 1 ATOM 637 N N . SER A 1 86 ? 10.741 92.380 61.454 1.00 66.78 ? 145 SER A N 1 ATOM 638 C CA . SER A 1 86 ? 11.089 91.276 62.344 1.00 54.03 ? 145 SER A CA 1 ATOM 639 C C . SER A 1 86 ? 10.608 89.948 61.769 1.00 59.66 ? 145 SER A C 1 ATOM 640 O O . SER A 1 86 ? 9.605 89.899 61.058 1.00 54.85 ? 145 SER A O 1 ATOM 641 C CB . SER A 1 86 ? 10.489 91.493 63.735 1.00 50.74 ? 145 SER A CB 1 ATOM 642 O OG . SER A 1 86 ? 10.770 90.398 64.588 1.00 69.13 ? 145 SER A OG 1 ATOM 643 N N . VAL A 1 87 ? 11.325 88.873 62.078 1.00 54.92 ? 146 VAL A N 1 ATOM 644 C CA . VAL A 1 87 ? 10.939 87.544 61.619 1.00 51.71 ? 146 VAL A CA 1 ATOM 645 C C . VAL A 1 87 ? 9.738 87.032 62.417 1.00 35.20 ? 146 VAL A C 1 ATOM 646 O O . VAL A 1 87 ? 8.837 86.399 61.865 1.00 45.18 ? 146 VAL A O 1 ATOM 647 C CB . VAL A 1 87 ? 12.119 86.549 61.737 1.00 61.75 ? 146 VAL A CB 1 ATOM 648 C CG1 . VAL A 1 87 ? 11.632 85.109 61.681 1.00 53.95 ? 146 VAL A CG1 1 ATOM 649 C CG2 . VAL A 1 87 ? 13.142 86.807 60.641 1.00 51.64 ? 146 VAL A CG2 1 ATOM 650 N N . TYR A 1 88 ? 9.723 87.333 63.713 1.00 37.78 ? 147 TYR A N 1 ATOM 651 C CA . TYR A 1 88 ? 8.617 86.953 64.588 1.00 40.34 ? 147 TYR A CA 1 ATOM 652 C C . TYR A 1 88 ? 8.499 87.925 65.762 1.00 51.36 ? 147 TYR A C 1 ATOM 653 O O . TYR A 1 88 ? 9.484 88.556 66.149 1.00 47.56 ? 147 TYR A O 1 ATOM 654 C CB . TYR A 1 88 ? 8.788 85.514 65.082 1.00 28.65 ? 147 TYR A CB 1 ATOM 655 C CG . TYR A 1 88 ? 9.906 85.311 66.077 1.00 44.04 ? 147 TYR A CG 1 ATOM 656 C CD1 . TYR A 1 88 ? 11.188 84.995 65.649 1.00 50.97 ? 147 TYR A CD1 1 ATOM 657 C CD2 . TYR A 1 88 ? 9.679 85.421 67.443 1.00 28.48 ? 147 TYR A CD2 1 ATOM 658 C CE1 . TYR A 1 88 ? 12.213 84.799 66.552 1.00 40.06 ? 147 TYR A CE1 1 ATOM 659 C CE2 . TYR A 1 88 ? 10.696 85.220 68.355 1.00 48.53 ? 147 TYR A CE2 1 ATOM 660 C CZ . TYR A 1 88 ? 11.963 84.913 67.903 1.00 34.77 ? 147 TYR A CZ 1 ATOM 661 O OH . TYR A 1 88 ? 12.986 84.717 68.800 1.00 44.80 ? 147 TYR A OH 1 ATOM 662 N N . SER A 1 89 ? 7.295 88.055 66.316 1.00 63.43 ? 148 SER A N 1 ATOM 663 C CA . SER A 1 89 ? 7.084 88.914 67.483 1.00 52.00 ? 148 SER A CA 1 ATOM 664 C C . SER A 1 89 ? 6.264 88.263 68.592 1.00 62.17 ? 148 SER A C 1 ATOM 665 O O . SER A 1 89 ? 5.797 88.949 69.506 1.00 74.57 ? 148 SER A O 1 ATOM 666 C CB . SER A 1 89 ? 6.397 90.208 67.057 1.00 43.46 ? 148 SER A CB 1 ATOM 667 O OG . SER A 1 89 ? 5.385 89.932 66.106 1.00 44.54 ? 148 SER A OG 1 ATOM 668 N N . ASP A 1 90 ? 6.093 86.947 68.516 1.00 57.85 ? 149 ASP A N 1 ATOM 669 C CA . ASP A 1 90 ? 5.283 86.232 69.495 1.00 51.85 ? 149 ASP A CA 1 ATOM 670 C C . ASP A 1 90 ? 6.043 85.010 69.995 1.00 56.02 ? 149 ASP A C 1 ATOM 671 O O . ASP A 1 90 ? 6.045 83.951 69.363 1.00 54.56 ? 149 ASP A O 1 ATOM 672 C CB . ASP A 1 90 ? 3.944 85.826 68.888 1.00 61.23 ? 149 ASP A CB 1 ATOM 673 C CG . ASP A 1 90 ? 2.989 85.226 69.905 1.00 67.26 ? 149 ASP A CG 1 ATOM 674 O OD1 . ASP A 1 90 ? 3.293 85.243 71.115 1.00 59.02 ? 149 ASP A OD1 1 ATOM 675 O OD2 . ASP A 1 90 ? 1.919 84.739 69.480 1.00 52.18 ? 149 ASP A OD2 1 ATOM 676 N N . ASP A 1 91 ? 6.684 85.176 71.146 1.00 37.33 ? 150 ASP A N 1 ATOM 677 C CA . ASP A 1 91 ? 7.563 84.161 71.708 1.00 53.62 ? 150 ASP A CA 1 ATOM 678 C C . ASP A 1 91 ? 6.810 82.883 72.067 1.00 57.09 ? 150 ASP A C 1 ATOM 679 O O . ASP A 1 91 ? 7.341 81.781 71.920 1.00 50.43 ? 150 ASP A O 1 ATOM 680 C CB . ASP A 1 91 ? 8.269 84.719 72.945 1.00 42.87 ? 150 ASP A CB 1 ATOM 681 C CG . ASP A 1 91 ? 9.231 85.840 72.608 1.00 53.34 ? 150 ASP A CG 1 ATOM 682 O OD1 . ASP A 1 91 ? 9.516 86.036 71.408 1.00 52.63 ? 150 ASP A OD1 1 ATOM 683 O OD2 . ASP A 1 91 ? 9.693 86.531 73.541 1.00 54.71 ? 150 ASP A OD2 1 ATOM 684 N N . GLN A 1 92 ? 5.576 83.031 72.538 1.00 56.13 ? 151 GLN A N 1 ATOM 685 C CA . GLN A 1 92 ? 4.806 81.877 72.982 1.00 53.40 ? 151 GLN A CA 1 ATOM 686 C C . GLN A 1 92 ? 4.458 80.993 71.790 1.00 55.85 ? 151 GLN A C 1 ATOM 687 O O . GLN A 1 92 ? 4.600 79.772 71.848 1.00 52.26 ? 151 GLN A O 1 ATOM 688 C CB . GLN A 1 92 ? 3.535 82.308 73.714 1.00 45.26 ? 151 GLN A CB 1 ATOM 689 C CG . GLN A 1 92 ? 2.749 81.142 74.294 1.00 45.45 ? 151 GLN A CG 1 ATOM 690 C CD . GLN A 1 92 ? 3.616 80.218 75.135 1.00 61.22 ? 151 GLN A CD 1 ATOM 691 O OE1 . GLN A 1 92 ? 4.198 80.634 76.137 1.00 69.42 ? 151 GLN A OE1 1 ATOM 692 N NE2 . GLN A 1 92 ? 3.710 78.958 74.724 1.00 57.89 ? 151 GLN A NE2 1 HETATM 693 N N . MSE A 1 93 ? 4.007 81.623 70.709 1.00 31.22 ? 152 MSE A N 1 HETATM 694 C CA . MSE A 1 93 ? 3.697 80.917 69.471 1.00 36.26 ? 152 MSE A CA 1 HETATM 695 C C . MSE A 1 93 ? 4.945 80.241 68.913 1.00 52.06 ? 152 MSE A C 1 HETATM 696 O O . MSE A 1 93 ? 4.882 79.129 68.388 1.00 46.11 ? 152 MSE A O 1 HETATM 697 C CB . MSE A 1 93 ? 3.102 81.883 68.441 1.00 30.15 ? 152 MSE A CB 1 HETATM 698 C CG . MSE A 1 93 ? 2.754 81.259 67.095 1.00 33.13 ? 152 MSE A CG 1 HETATM 699 SE SE . MSE A 1 93 ? 4.239 81.231 65.825 1.00 91.56 ? 152 MSE A SE 1 HETATM 700 C CE . MSE A 1 93 ? 4.618 83.143 65.755 1.00 172.11 ? 152 MSE A CE 1 ATOM 701 N N . ILE A 1 94 ? 6.078 80.923 69.035 1.00 57.91 ? 153 ILE A N 1 ATOM 702 C CA . ILE A 1 94 ? 7.351 80.398 68.556 1.00 39.12 ? 153 ILE A CA 1 ATOM 703 C C . ILE A 1 94 ? 7.819 79.234 69.425 1.00 45.09 ? 153 ILE A C 1 ATOM 704 O O . ILE A 1 94 ? 8.271 78.209 68.914 1.00 32.92 ? 153 ILE A O 1 ATOM 705 C CB . ILE A 1 94 ? 8.427 81.497 68.525 1.00 43.53 ? 153 ILE A CB 1 ATOM 706 C CG1 . ILE A 1 94 ? 8.164 82.445 67.356 1.00 34.70 ? 153 ILE A CG1 1 ATOM 707 C CG2 . ILE A 1 94 ? 9.821 80.896 68.417 1.00 48.68 ? 153 ILE A CG2 1 ATOM 708 C CD1 . ILE A 1 94 ? 8.136 81.763 66.011 1.00 40.34 ? 153 ILE A CD1 1 ATOM 709 N N . ASP A 1 95 ? 7.703 79.399 70.740 1.00 35.43 ? 154 ASP A N 1 ATOM 710 C CA . ASP A 1 95 ? 7.993 78.319 71.679 1.00 50.22 ? 154 ASP A CA 1 ATOM 711 C C . ASP A 1 95 ? 7.126 77.089 71.411 1.00 42.83 ? 154 ASP A C 1 ATOM 712 O O . ASP A 1 95 ? 7.545 75.960 71.666 1.00 61.32 ? 154 ASP A O 1 ATOM 713 C CB . ASP A 1 95 ? 7.799 78.795 73.121 1.00 33.98 ? 154 ASP A CB 1 ATOM 714 C CG . ASP A 1 95 ? 8.922 79.702 73.589 1.00 57.84 ? 154 ASP A CG 1 ATOM 715 O OD1 . ASP A 1 95 ? 9.639 80.256 72.730 1.00 59.70 ? 154 ASP A OD1 1 ATOM 716 O OD2 . ASP A 1 95 ? 9.090 79.856 74.817 1.00 55.38 ? 154 ASP A OD2 1 ATOM 717 N N . ASN A 1 96 ? 5.919 77.311 70.897 1.00 32.51 ? 155 ASN A N 1 ATOM 718 C CA . ASN A 1 96 ? 5.060 76.206 70.483 1.00 55.64 ? 155 ASN A CA 1 ATOM 719 C C . ASN A 1 96 ? 5.629 75.522 69.248 1.00 50.10 ? 155 ASN A C 1 ATOM 720 O O . ASN A 1 96 ? 5.604 74.297 69.137 1.00 54.09 ? 155 ASN A O 1 ATOM 721 C CB . ASN A 1 96 ? 3.634 76.690 70.205 1.00 37.68 ? 155 ASN A CB 1 ATOM 722 C CG . ASN A 1 96 ? 2.935 77.197 71.451 1.00 46.68 ? 155 ASN A CG 1 ATOM 723 O OD1 . ASN A 1 96 ? 3.281 76.820 72.569 1.00 47.03 ? 155 ASN A OD1 1 ATOM 724 N ND2 . ASN A 1 96 ? 1.935 78.051 71.261 1.00 48.72 ? 155 ASN A ND2 1 ATOM 725 N N . LEU A 1 97 ? 6.139 76.326 68.319 1.00 46.72 ? 156 LEU A N 1 ATOM 726 C CA . LEU A 1 97 ? 6.787 75.808 67.120 1.00 50.13 ? 156 LEU A CA 1 ATOM 727 C C . LEU A 1 97 ? 8.040 75.023 67.492 1.00 53.06 ? 156 LEU A C 1 ATOM 728 O O . LEU A 1 97 ? 8.329 73.980 66.906 1.00 53.82 ? 156 LEU A O 1 ATOM 729 C CB . LEU A 1 97 ? 7.138 76.948 66.162 1.00 49.01 ? 156 LEU A CB 1 ATOM 730 C CG . LEU A 1 97 ? 7.924 76.568 64.906 1.00 39.79 ? 156 LEU A CG 1 ATOM 731 C CD1 . LEU A 1 97 ? 7.156 75.547 64.079 1.00 49.40 ? 156 LEU A CD1 1 ATOM 732 C CD2 . LEU A 1 97 ? 8.249 77.802 64.080 1.00 50.27 ? 156 LEU A CD2 1 ATOM 733 N N . LEU A 1 98 ? 8.781 75.542 68.468 1.00 34.19 ? 157 LEU A N 1 ATOM 734 C CA . LEU A 1 98 ? 9.967 74.871 68.990 1.00 31.19 ? 157 LEU A CA 1 ATOM 735 C C . LEU A 1 98 ? 9.624 73.491 69.539 1.00 38.98 ? 157 LEU A C 1 ATOM 736 O O . LEU A 1 98 ? 10.308 72.510 69.246 1.00 45.32 ? 157 LEU A O 1 ATOM 737 C CB . LEU A 1 98 ? 10.628 75.721 70.077 1.00 43.61 ? 157 LEU A CB 1 ATOM 738 C CG . LEU A 1 98 ? 11.792 76.629 69.669 1.00 38.14 ? 157 LEU A CG 1 ATOM 739 C CD1 . LEU A 1 98 ? 11.587 77.218 68.283 1.00 40.36 ? 157 LEU A CD1 1 ATOM 740 C CD2 . LEU A 1 98 ? 11.975 77.737 70.694 1.00 38.70 ? 157 LEU A CD2 1 ATOM 741 N N . HIS A 1 99 ? 8.569 73.429 70.345 1.00 47.99 ? 158 HIS A N 1 ATOM 742 C CA . HIS A 1 99 ? 8.089 72.165 70.891 1.00 37.51 ? 158 HIS A CA 1 ATOM 743 C C . HIS A 1 99 ? 7.720 71.189 69.780 1.00 40.02 ? 158 HIS A C 1 ATOM 744 O O . HIS A 1 99 ? 7.996 69.993 69.875 1.00 34.80 ? 158 HIS A O 1 ATOM 745 C CB . HIS A 1 99 ? 6.882 72.397 71.802 1.00 37.97 ? 158 HIS A CB 1 ATOM 746 C CG . HIS A 1 99 ? 6.237 71.135 72.283 1.00 55.32 ? 158 HIS A CG 1 ATOM 747 N ND1 . HIS A 1 99 ? 6.697 70.432 73.376 1.00 60.71 ? 158 HIS A ND1 1 ATOM 748 C CD2 . HIS A 1 99 ? 5.168 70.446 71.816 1.00 53.44 ? 158 HIS A CD2 1 ATOM 749 C CE1 . HIS A 1 99 ? 5.938 69.367 73.563 1.00 48.75 ? 158 HIS A CE1 1 ATOM 750 N NE2 . HIS A 1 99 ? 5.004 69.352 72.630 1.00 54.59 ? 158 HIS A NE2 1 ATOM 751 N N . ASP A 1 100 ? 7.102 71.709 68.725 1.00 31.18 ? 159 ASP A N 1 ATOM 752 C CA . ASP A 1 100 ? 6.701 70.886 67.592 1.00 38.58 ? 159 ASP A CA 1 ATOM 753 C C . ASP A 1 100 ? 7.911 70.367 66.828 1.00 37.08 ? 159 ASP A C 1 ATOM 754 O O . ASP A 1 100 ? 7.932 69.219 66.398 1.00 48.94 ? 159 ASP A O 1 ATOM 755 C CB . ASP A 1 100 ? 5.784 71.672 66.650 1.00 54.62 ? 159 ASP A CB 1 ATOM 756 C CG . ASP A 1 100 ? 4.418 71.939 67.253 1.00 63.82 ? 159 ASP A CG 1 ATOM 757 O OD1 . ASP A 1 100 ? 4.242 71.690 68.465 1.00 60.89 ? 159 ASP A OD1 1 ATOM 758 O OD2 . ASP A 1 100 ? 3.521 72.396 66.515 1.00 53.25 ? 159 ASP A OD2 1 ATOM 759 N N . LEU A 1 101 ? 8.925 71.212 66.671 1.00 54.55 ? 160 LEU A N 1 ATOM 760 C CA . LEU A 1 101 ? 10.148 70.809 65.987 1.00 45.06 ? 160 LEU A CA 1 ATOM 761 C C . LEU A 1 101 ? 10.859 69.687 66.739 1.00 49.67 ? 160 LEU A C 1 ATOM 762 O O . LEU A 1 101 ? 11.471 68.810 66.132 1.00 39.37 ? 160 LEU A O 1 ATOM 763 C CB . LEU A 1 101 ? 11.088 72.005 65.818 1.00 40.24 ? 160 LEU A CB 1 ATOM 764 C CG . LEU A 1 101 ? 10.715 73.039 64.755 1.00 43.18 ? 160 LEU A CG 1 ATOM 765 C CD1 . LEU A 1 101 ? 11.613 74.262 64.861 1.00 30.10 ? 160 LEU A CD1 1 ATOM 766 C CD2 . LEU A 1 101 ? 10.800 72.428 63.365 1.00 30.57 ? 160 LEU A CD2 1 ATOM 767 N N . ASN A 1 102 ? 10.770 69.724 68.064 1.00 30.90 ? 161 ASN A N 1 ATOM 768 C CA . ASN A 1 102 ? 11.388 68.709 68.907 1.00 44.77 ? 161 ASN A CA 1 ATOM 769 C C . ASN A 1 102 ? 10.617 67.388 68.973 1.00 47.14 ? 161 ASN A C 1 ATOM 770 O O . ASN A 1 102 ? 11.221 66.319 69.072 1.00 46.19 ? 161 ASN A O 1 ATOM 771 C CB . ASN A 1 102 ? 11.578 69.256 70.324 1.00 30.80 ? 161 ASN A CB 1 ATOM 772 C CG . ASN A 1 102 ? 12.122 68.215 71.282 1.00 41.03 ? 161 ASN A CG 1 ATOM 773 O OD1 . ASN A 1 102 ? 11.364 67.518 71.956 1.00 42.86 ? 161 ASN A OD1 1 ATOM 774 N ND2 . ASN A 1 102 ? 13.444 68.101 71.344 1.00 40.15 ? 161 ASN A ND2 1 ATOM 775 N N . THR A 1 103 ? 9.290 67.458 68.916 1.00 36.13 ? 162 THR A N 1 ATOM 776 C CA . THR A 1 103 ? 8.460 66.291 69.217 1.00 43.06 ? 162 THR A CA 1 ATOM 777 C C . THR A 1 103 ? 7.738 65.671 68.020 1.00 34.83 ? 162 THR A C 1 ATOM 778 O O . THR A 1 103 ? 7.352 64.504 68.074 1.00 35.82 ? 162 THR A O 1 ATOM 779 C CB . THR A 1 103 ? 7.394 66.635 70.278 1.00 41.69 ? 162 THR A CB 1 ATOM 780 O OG1 . THR A 1 103 ? 6.531 67.665 69.778 1.00 45.07 ? 162 THR A OG1 1 ATOM 781 C CG2 . THR A 1 103 ? 8.053 67.110 71.563 1.00 31.75 ? 162 THR A CG2 1 ATOM 782 N N . SER A 1 104 ? 7.540 66.443 66.954 1.00 33.49 ? 163 SER A N 1 ATOM 783 C CA . SER A 1 104 ? 6.802 65.949 65.791 1.00 32.31 ? 163 SER A CA 1 ATOM 784 C C . SER A 1 104 ? 7.468 64.726 65.172 1.00 53.07 ? 163 SER A C 1 ATOM 785 O O . SER A 1 104 ? 8.690 64.686 65.027 1.00 58.53 ? 163 SER A O 1 ATOM 786 C CB . SER A 1 104 ? 6.655 67.041 64.732 1.00 41.15 ? 163 SER A CB 1 ATOM 787 O OG . SER A 1 104 ? 5.975 66.553 63.589 1.00 65.13 ? 163 SER A OG 1 ATOM 788 N N . PRO A 1 105 ? 6.660 63.720 64.807 1.00 58.41 ? 164 PRO A N 1 ATOM 789 C CA . PRO A 1 105 ? 7.179 62.502 64.178 1.00 50.61 ? 164 PRO A CA 1 ATOM 790 C C . PRO A 1 105 ? 7.787 62.788 62.809 1.00 45.94 ? 164 PRO A C 1 ATOM 791 O O . PRO A 1 105 ? 7.243 63.586 62.045 1.00 43.69 ? 164 PRO A O 1 ATOM 792 C CB . PRO A 1 105 ? 5.935 61.613 64.048 1.00 40.97 ? 164 PRO A CB 1 ATOM 793 C CG . PRO A 1 105 ? 4.964 62.158 65.045 1.00 47.40 ? 164 PRO A CG 1 ATOM 794 C CD . PRO A 1 105 ? 5.213 63.633 65.063 1.00 53.24 ? 164 PRO A CD 1 ATOM 795 N N . ILE A 1 106 ? 8.910 62.143 62.512 1.00 32.63 ? 165 ILE A N 1 ATOM 796 C CA . ILE A 1 106 ? 9.608 62.366 61.254 1.00 32.48 ? 165 ILE A CA 1 ATOM 797 C C . ILE A 1 106 ? 9.187 61.347 60.201 1.00 36.08 ? 165 ILE A C 1 ATOM 798 O O . ILE A 1 106 ? 9.213 60.140 60.442 1.00 37.02 ? 165 ILE A O 1 ATOM 799 C CB . ILE A 1 106 ? 11.134 62.313 61.450 1.00 46.42 ? 165 ILE A CB 1 ATOM 800 C CG1 . ILE A 1 106 ? 11.582 63.463 62.354 1.00 36.42 ? 165 ILE A CG1 1 ATOM 801 C CG2 . ILE A 1 106 ? 11.850 62.389 60.113 1.00 49.58 ? 165 ILE A CG2 1 ATOM 802 C CD1 . ILE A 1 106 ? 12.806 63.149 63.173 1.00 47.11 ? 165 ILE A CD1 1 ATOM 803 N N . LYS A 1 107 ? 8.800 61.846 59.031 1.00 37.34 ? 166 LYS A N 1 ATOM 804 C CA . LYS A 1 107 ? 8.355 60.995 57.935 1.00 44.73 ? 166 LYS A CA 1 ATOM 805 C C . LYS A 1 107 ? 9.498 60.655 56.984 1.00 45.66 ? 166 LYS A C 1 ATOM 806 O O . LYS A 1 107 ? 9.711 59.489 56.650 1.00 55.81 ? 166 LYS A O 1 ATOM 807 C CB . LYS A 1 107 ? 7.218 61.670 57.165 1.00 59.55 ? 166 LYS A CB 1 ATOM 808 C CG . LYS A 1 107 ? 6.641 60.826 56.040 1.00 65.31 ? 166 LYS A CG 1 ATOM 809 C CD . LYS A 1 107 ? 5.715 61.645 55.155 1.00 65.04 ? 166 LYS A CD 1 ATOM 810 C CE . LYS A 1 107 ? 4.594 62.279 55.962 1.00 67.66 ? 166 LYS A CE 1 ATOM 811 N NZ . LYS A 1 107 ? 3.673 63.070 55.100 1.00 73.43 ? 166 LYS A NZ 1 ATOM 812 N N . HIS A 1 108 ? 10.236 61.675 56.559 1.00 34.63 ? 167 HIS A N 1 ATOM 813 C CA . HIS A 1 108 ? 11.336 61.482 55.621 1.00 39.06 ? 167 HIS A CA 1 ATOM 814 C C . HIS A 1 108 ? 12.602 62.213 56.056 1.00 44.89 ? 167 HIS A C 1 ATOM 815 O O . HIS A 1 108 ? 12.540 63.274 56.676 1.00 47.02 ? 167 HIS A O 1 ATOM 816 C CB . HIS A 1 108 ? 10.929 61.955 54.223 1.00 42.29 ? 167 HIS A CB 1 ATOM 817 C CG . HIS A 1 108 ? 9.793 61.184 53.628 1.00 68.90 ? 167 HIS A CG 1 ATOM 818 N ND1 . HIS A 1 108 ? 8.794 61.782 52.890 1.00 75.42 ? 167 HIS A ND1 1 ATOM 819 C CD2 . HIS A 1 108 ? 9.501 59.862 53.653 1.00 70.91 ? 167 HIS A CD2 1 ATOM 820 C CE1 . HIS A 1 108 ? 7.933 60.863 52.491 1.00 80.29 ? 167 HIS A CE1 1 ATOM 821 N NE2 . HIS A 1 108 ? 8.339 59.689 52.941 1.00 68.87 ? 167 HIS A NE2 1 ATOM 822 N N . VAL A 1 109 ? 13.752 61.634 55.723 1.00 46.70 ? 168 VAL A N 1 ATOM 823 C CA . VAL A 1 109 ? 15.035 62.301 55.906 1.00 44.07 ? 168 VAL A CA 1 ATOM 824 C C . VAL A 1 109 ? 15.786 62.365 54.581 1.00 37.33 ? 168 VAL A C 1 ATOM 825 O O . VAL A 1 109 ? 16.066 61.336 53.966 1.00 43.13 ? 168 VAL A O 1 ATOM 826 C CB . VAL A 1 109 ? 15.908 61.589 56.956 1.00 41.09 ? 168 VAL A CB 1 ATOM 827 C CG1 . VAL A 1 109 ? 17.240 62.306 57.112 1.00 35.77 ? 168 VAL A CG1 1 ATOM 828 C CG2 . VAL A 1 109 ? 15.180 61.516 58.290 1.00 38.75 ? 168 VAL A CG2 1 ATOM 829 N N . HIS A 1 110 ? 16.106 63.579 54.145 1.00 43.60 ? 169 HIS A N 1 ATOM 830 C CA . HIS A 1 110 ? 16.797 63.784 52.876 1.00 45.24 ? 169 HIS A CA 1 ATOM 831 C C . HIS A 1 110 ? 18.088 64.577 53.048 1.00 45.35 ? 169 HIS A C 1 ATOM 832 O O . HIS A 1 110 ? 18.223 65.368 53.980 1.00 35.34 ? 169 HIS A O 1 ATOM 833 C CB . HIS A 1 110 ? 15.882 64.505 51.882 1.00 46.87 ? 169 HIS A CB 1 ATOM 834 C CG . HIS A 1 110 ? 14.733 63.674 51.403 1.00 57.39 ? 169 HIS A CG 1 ATOM 835 N ND1 . HIS A 1 110 ? 14.750 63.006 50.197 1.00 60.23 ? 169 HIS A ND1 1 ATOM 836 C CD2 . HIS A 1 110 ? 13.529 63.408 51.962 1.00 53.92 ? 169 HIS A CD2 1 ATOM 837 C CE1 . HIS A 1 110 ? 13.609 62.361 50.037 1.00 69.55 ? 169 HIS A CE1 1 ATOM 838 N NE2 . HIS A 1 110 ? 12.850 62.588 51.094 1.00 66.35 ? 169 HIS A NE2 1 ATOM 839 N N . ILE A 1 111 ? 19.039 64.354 52.146 1.00 43.82 ? 170 ILE A N 1 ATOM 840 C CA . ILE A 1 111 ? 20.268 65.137 52.124 1.00 42.38 ? 170 ILE A CA 1 ATOM 841 C C . ILE A 1 111 ? 19.974 66.516 51.539 1.00 43.99 ? 170 ILE A C 1 ATOM 842 O O . ILE A 1 111 ? 19.362 66.626 50.478 1.00 50.35 ? 170 ILE A O 1 ATOM 843 C CB . ILE A 1 111 ? 21.372 64.441 51.304 1.00 39.60 ? 170 ILE A CB 1 ATOM 844 C CG1 . ILE A 1 111 ? 21.742 63.097 51.936 1.00 39.44 ? 170 ILE A CG1 1 ATOM 845 C CG2 . ILE A 1 111 ? 22.595 65.339 51.178 1.00 30.53 ? 170 ILE A CG2 1 ATOM 846 C CD1 . ILE A 1 111 ? 22.779 62.319 51.153 1.00 49.23 ? 170 ILE A CD1 1 HETATM 847 N N . MSE A 1 112 ? 20.404 67.565 52.234 1.00 51.57 ? 171 MSE A N 1 HETATM 848 C CA . MSE A 1 112 ? 20.089 68.927 51.818 1.00 66.71 ? 171 MSE A CA 1 HETATM 849 C C . MSE A 1 112 ? 21.153 69.518 50.898 1.00 89.45 ? 171 MSE A C 1 HETATM 850 O O . MSE A 1 112 ? 22.328 69.156 50.972 1.00 88.07 ? 171 MSE A O 1 HETATM 851 C CB . MSE A 1 112 ? 19.904 69.830 53.042 1.00 77.50 ? 171 MSE A CB 1 HETATM 852 C CG . MSE A 1 112 ? 19.363 71.213 52.708 1.00 72.89 ? 171 MSE A CG 1 HETATM 853 SE SE . MSE A 1 112 ? 18.802 72.241 54.258 1.00 126.98 ? 171 MSE A SE 1 HETATM 854 C CE . MSE A 1 112 ? 18.020 73.764 53.324 1.00 44.81 ? 171 MSE A CE 1 ATOM 855 N N . ASP A 1 113 ? 20.720 70.425 50.027 1.00 94.84 ? 172 ASP A N 1 ATOM 856 C CA . ASP A 1 113 ? 21.609 71.145 49.125 1.00 103.40 ? 172 ASP A CA 1 ATOM 857 C C . ASP A 1 113 ? 22.675 71.920 49.897 1.00 109.75 ? 172 ASP A C 1 ATOM 858 O O . ASP A 1 113 ? 22.356 72.689 50.804 1.00 108.78 ? 172 ASP A O 1 ATOM 859 C CB . ASP A 1 113 ? 20.803 72.102 48.245 1.00 104.83 ? 172 ASP A CB 1 ATOM 860 C CG . ASP A 1 113 ? 19.891 71.374 47.277 1.00 113.93 ? 172 ASP A CG 1 ATOM 861 O OD1 . ASP A 1 113 ? 19.004 72.029 46.690 1.00 118.83 ? 172 ASP A OD1 1 ATOM 862 O OD2 . ASP A 1 113 ? 20.047 70.145 47.120 1.00 105.78 ? 172 ASP A OD2 1 ATOM 863 N N . GLY A 1 114 ? 23.939 71.718 49.536 1.00 119.12 ? 173 GLY A N 1 ATOM 864 C CA . GLY A 1 114 ? 24.304 70.804 48.469 1.00 113.04 ? 173 GLY A CA 1 ATOM 865 C C . GLY A 1 114 ? 24.806 69.472 48.993 1.00 101.19 ? 173 GLY A C 1 ATOM 866 O O . GLY A 1 114 ? 26.011 69.225 49.036 1.00 84.33 ? 173 GLY A O 1 ATOM 867 N N . THR A 1 116 ? 28.769 72.606 51.141 1.00 66.64 ? 175 THR A N 1 ATOM 868 C CA . THR A 1 116 ? 28.532 72.878 52.554 1.00 55.58 ? 175 THR A CA 1 ATOM 869 C C . THR A 1 116 ? 28.771 71.643 53.415 1.00 50.31 ? 175 THR A C 1 ATOM 870 O O . THR A 1 116 ? 29.156 70.588 52.913 1.00 59.46 ? 175 THR A O 1 ATOM 871 C CB . THR A 1 116 ? 27.099 73.387 52.795 1.00 71.81 ? 175 THR A CB 1 ATOM 872 O OG1 . THR A 1 116 ? 26.163 72.496 52.174 1.00 85.18 ? 175 THR A OG1 1 ATOM 873 C CG2 . THR A 1 116 ? 26.928 74.780 52.216 1.00 69.81 ? 175 THR A CG2 1 ATOM 874 N N . GLN A 1 117 ? 28.537 71.786 54.715 1.00 48.83 ? 176 GLN A N 1 ATOM 875 C CA . GLN A 1 117 ? 28.735 70.691 55.655 1.00 35.03 ? 176 GLN A CA 1 ATOM 876 C C . GLN A 1 117 ? 27.466 69.856 55.797 1.00 34.49 ? 176 GLN A C 1 ATOM 877 O O . GLN A 1 117 ? 26.390 70.273 55.366 1.00 55.57 ? 176 GLN A O 1 ATOM 878 C CB . GLN A 1 117 ? 29.180 71.231 57.016 1.00 33.79 ? 176 GLN A CB 1 ATOM 879 C CG . GLN A 1 117 ? 30.589 71.800 57.003 1.00 36.51 ? 176 GLN A CG 1 ATOM 880 C CD . GLN A 1 117 ? 31.000 72.407 58.331 1.00 46.77 ? 176 GLN A CD 1 ATOM 881 O OE1 . GLN A 1 117 ? 30.991 71.738 59.364 1.00 40.97 ? 176 GLN A OE1 1 ATOM 882 N NE2 . GLN A 1 117 ? 31.378 73.681 58.305 1.00 51.17 ? 176 GLN A NE2 1 ATOM 883 N N . VAL A 1 118 ? 27.603 68.675 56.393 1.00 41.79 ? 177 VAL A N 1 ATOM 884 C CA . VAL A 1 118 ? 26.502 67.719 56.489 1.00 30.22 ? 177 VAL A CA 1 ATOM 885 C C . VAL A 1 118 ? 25.264 68.292 57.184 1.00 38.19 ? 177 VAL A C 1 ATOM 886 O O . VAL A 1 118 ? 25.326 68.773 58.316 1.00 36.32 ? 177 VAL A O 1 ATOM 887 C CB . VAL A 1 118 ? 26.949 66.435 57.226 1.00 38.59 ? 177 VAL A CB 1 ATOM 888 C CG1 . VAL A 1 118 ? 27.593 66.769 58.569 1.00 28.83 ? 177 VAL A CG1 1 ATOM 889 C CG2 . VAL A 1 118 ? 25.780 65.474 57.390 1.00 29.28 ? 177 VAL A CG2 1 ATOM 890 N N . LYS A 1 119 ? 24.141 68.249 56.476 1.00 43.59 ? 178 LYS A N 1 ATOM 891 C CA . LYS A 1 119 ? 22.864 68.680 57.026 1.00 43.53 ? 178 LYS A CA 1 ATOM 892 C C . LYS A 1 119 ? 21.705 67.970 56.327 1.00 46.26 ? 178 LYS A C 1 ATOM 893 O O . LYS A 1 119 ? 21.747 67.730 55.120 1.00 52.61 ? 178 LYS A O 1 ATOM 894 C CB . LYS A 1 119 ? 22.731 70.204 56.943 1.00 29.17 ? 178 LYS A CB 1 ATOM 895 C CG . LYS A 1 119 ? 22.777 70.794 55.549 1.00 41.07 ? 178 LYS A CG 1 ATOM 896 C CD . LYS A 1 119 ? 22.797 72.311 55.644 1.00 53.25 ? 178 LYS A CD 1 ATOM 897 C CE . LYS A 1 119 ? 22.817 72.974 54.281 1.00 73.45 ? 178 LYS A CE 1 ATOM 898 N NZ . LYS A 1 119 ? 22.866 74.456 54.419 1.00 78.00 ? 178 LYS A NZ 1 ATOM 899 N N . PHE A 1 120 ? 20.676 67.636 57.098 1.00 39.34 ? 179 PHE A N 1 ATOM 900 C CA . PHE A 1 120 ? 19.507 66.934 56.576 1.00 38.99 ? 179 PHE A CA 1 ATOM 901 C C . PHE A 1 120 ? 18.270 67.820 56.489 1.00 35.14 ? 179 PHE A C 1 ATOM 902 O O . PHE A 1 120 ? 18.147 68.807 57.214 1.00 38.43 ? 179 PHE A O 1 ATOM 903 C CB . PHE A 1 120 ? 19.186 65.719 57.451 1.00 33.19 ? 179 PHE A CB 1 ATOM 904 C CG . PHE A 1 120 ? 20.239 64.647 57.426 1.00 35.95 ? 179 PHE A CG 1 ATOM 905 C CD1 . PHE A 1 120 ? 21.160 64.577 56.394 1.00 30.17 ? 179 PHE A CD1 1 ATOM 906 C CD2 . PHE A 1 120 ? 20.307 63.709 58.444 1.00 30.38 ? 179 PHE A CD2 1 ATOM 907 C CE1 . PHE A 1 120 ? 22.126 63.588 56.377 1.00 41.18 ? 179 PHE A CE1 1 ATOM 908 C CE2 . PHE A 1 120 ? 21.270 62.719 58.433 1.00 32.32 ? 179 PHE A CE2 1 ATOM 909 C CZ . PHE A 1 120 ? 22.181 62.658 57.398 1.00 38.52 ? 179 PHE A CZ 1 ATOM 910 N N . VAL A 1 121 ? 17.358 67.462 55.589 1.00 48.93 ? 180 VAL A N 1 ATOM 911 C CA . VAL A 1 121 ? 16.017 68.037 55.590 1.00 45.10 ? 180 VAL A CA 1 ATOM 912 C C . VAL A 1 121 ? 15.028 67.058 56.209 1.00 37.94 ? 180 VAL A C 1 ATOM 913 O O . VAL A 1 121 ? 14.848 65.945 55.717 1.00 50.21 ? 180 VAL A O 1 ATOM 914 C CB . VAL A 1 121 ? 15.541 68.401 54.169 1.00 38.07 ? 180 VAL A CB 1 ATOM 915 C CG1 . VAL A 1 121 ? 14.057 68.745 54.174 1.00 30.84 ? 180 VAL A CG1 1 ATOM 916 C CG2 . VAL A 1 121 ? 16.349 69.557 53.621 1.00 41.42 ? 180 VAL A CG2 1 ATOM 917 N N . PHE A 1 122 ? 14.398 67.478 57.300 1.00 48.22 ? 181 PHE A N 1 ATOM 918 C CA . PHE A 1 122 ? 13.370 66.675 57.950 1.00 31.17 ? 181 PHE A CA 1 ATOM 919 C C . PHE A 1 122 ? 11.995 66.968 57.375 1.00 50.31 ? 181 PHE A C 1 ATOM 920 O O . PHE A 1 122 ? 11.574 68.118 57.330 1.00 41.90 ? 181 PHE A O 1 ATOM 921 C CB . PHE A 1 122 ? 13.355 66.926 59.459 1.00 39.70 ? 181 PHE A CB 1 ATOM 922 C CG . PHE A 1 122 ? 14.446 66.217 60.204 1.00 32.66 ? 181 PHE A CG 1 ATOM 923 C CD1 . PHE A 1 122 ? 15.267 65.308 59.558 1.00 35.80 ? 181 PHE A CD1 1 ATOM 924 C CD2 . PHE A 1 122 ? 14.643 66.450 61.554 1.00 31.82 ? 181 PHE A CD2 1 ATOM 925 C CE1 . PHE A 1 122 ? 16.269 64.652 60.243 1.00 50.75 ? 181 PHE A CE1 1 ATOM 926 C CE2 . PHE A 1 122 ? 15.642 65.798 62.244 1.00 30.81 ? 181 PHE A CE2 1 ATOM 927 C CZ . PHE A 1 122 ? 16.456 64.898 61.587 1.00 41.92 ? 181 PHE A CZ 1 ATOM 928 N N . THR A 1 123 ? 11.301 65.929 56.929 1.00 61.31 ? 182 THR A N 1 ATOM 929 C CA . THR A 1 123 ? 9.899 66.070 56.567 1.00 45.72 ? 182 THR A CA 1 ATOM 930 C C . THR A 1 123 ? 9.035 65.418 57.638 1.00 47.71 ? 182 THR A C 1 ATOM 931 O O . THR A 1 123 ? 9.074 64.203 57.825 1.00 49.12 ? 182 THR A O 1 ATOM 932 C CB . THR A 1 123 ? 9.588 65.441 55.197 1.00 46.13 ? 182 THR A CB 1 ATOM 933 O OG1 . THR A 1 123 ? 10.293 66.153 54.173 1.00 50.25 ? 182 THR A OG1 1 ATOM 934 C CG2 . THR A 1 123 ? 8.097 65.505 54.912 1.00 46.22 ? 182 THR A CG2 1 ATOM 935 N N . PHE A 1 124 ? 8.266 66.236 58.348 1.00 51.09 ? 183 PHE A N 1 ATOM 936 C CA . PHE A 1 124 ? 7.444 65.748 59.449 1.00 45.91 ? 183 PHE A CA 1 ATOM 937 C C . PHE A 1 124 ? 6.123 65.201 58.920 1.00 54.04 ? 183 PHE A C 1 ATOM 938 O O . PHE A 1 124 ? 5.820 65.337 57.734 1.00 58.44 ? 183 PHE A O 1 ATOM 939 C CB . PHE A 1 124 ? 7.203 66.859 60.472 1.00 35.51 ? 183 PHE A CB 1 ATOM 940 C CG . PHE A 1 124 ? 8.464 67.390 61.095 1.00 45.04 ? 183 PHE A CG 1 ATOM 941 C CD1 . PHE A 1 124 ? 9.126 66.671 62.078 1.00 38.23 ? 183 PHE A CD1 1 ATOM 942 C CD2 . PHE A 1 124 ? 8.991 68.606 60.694 1.00 47.29 ? 183 PHE A CD2 1 ATOM 943 C CE1 . PHE A 1 124 ? 10.289 67.157 62.650 1.00 42.09 ? 183 PHE A CE1 1 ATOM 944 C CE2 . PHE A 1 124 ? 10.151 69.097 61.262 1.00 39.57 ? 183 PHE A CE2 1 ATOM 945 C CZ . PHE A 1 124 ? 10.802 68.372 62.241 1.00 35.88 ? 183 PHE A CZ 1 ATOM 946 N N . LYS A 1 125 ? 5.347 64.573 59.800 1.00 50.19 ? 184 LYS A N 1 ATOM 947 C CA . LYS A 1 125 ? 4.070 63.975 59.416 1.00 49.75 ? 184 LYS A CA 1 ATOM 948 C C . LYS A 1 125 ? 3.118 64.994 58.785 1.00 53.87 ? 184 LYS A C 1 ATOM 949 O O . LYS A 1 125 ? 2.413 64.678 57.827 1.00 46.89 ? 184 LYS A O 1 ATOM 950 C CB . LYS A 1 125 ? 3.408 63.306 60.625 1.00 55.37 ? 184 LYS A CB 1 ATOM 951 C CG . LYS A 1 125 ? 1.925 63.011 60.444 1.00 62.51 ? 184 LYS A CG 1 ATOM 952 C CD . LYS A 1 125 ? 1.365 62.205 61.606 1.00 53.47 ? 184 LYS A CD 1 ATOM 953 C CE . LYS A 1 125 ? 1.581 62.905 62.934 1.00 61.95 ? 184 LYS A CE 1 ATOM 954 N NZ . LYS A 1 125 ? 1.032 62.105 64.064 1.00 53.16 ? 184 LYS A NZ 1 ATOM 955 N N . ASN A 1 126 ? 3.116 66.218 59.306 1.00 36.19 ? 185 ASN A N 1 ATOM 956 C CA . ASN A 1 126 ? 2.297 67.288 58.742 1.00 43.06 ? 185 ASN A CA 1 ATOM 957 C C . ASN A 1 126 ? 2.840 67.835 57.419 1.00 52.93 ? 185 ASN A C 1 ATOM 958 O O . ASN A 1 126 ? 2.373 68.867 56.932 1.00 62.13 ? 185 ASN A O 1 ATOM 959 C CB . ASN A 1 126 ? 2.145 68.431 59.753 1.00 32.90 ? 185 ASN A CB 1 ATOM 960 C CG . ASN A 1 126 ? 3.478 69.037 60.164 1.00 61.58 ? 185 ASN A CG 1 ATOM 961 O OD1 . ASN A 1 126 ? 4.528 68.703 59.613 1.00 48.01 ? 185 ASN A OD1 1 ATOM 962 N ND2 . ASN A 1 126 ? 3.438 69.941 61.137 1.00 43.24 ? 185 ASN A ND2 1 ATOM 963 N N . ASP A 1 127 ? 3.844 67.152 56.871 1.00 44.06 ? 186 ASP A N 1 ATOM 964 C CA . ASP A 1 127 ? 4.483 67.514 55.602 1.00 48.30 ? 186 ASP A CA 1 ATOM 965 C C . ASP A 1 127 ? 5.231 68.846 55.655 1.00 47.35 ? 186 ASP A C 1 ATOM 966 O O . ASP A 1 127 ? 5.720 69.326 54.633 1.00 47.31 ? 186 ASP A O 1 ATOM 967 C CB . ASP A 1 127 ? 3.454 67.540 54.467 1.00 47.66 ? 186 ASP A CB 1 ATOM 968 C CG . ASP A 1 127 ? 3.032 66.150 54.033 1.00 70.72 ? 186 ASP A CG 1 ATOM 969 O OD1 . ASP A 1 127 ? 3.885 65.238 54.049 1.00 51.67 ? 186 ASP A OD1 1 ATOM 970 O OD2 . ASP A 1 127 ? 1.848 65.969 53.674 1.00 82.58 ? 186 ASP A OD2 1 ATOM 971 N N . LYS A 1 128 ? 5.320 69.441 56.840 1.00 35.65 ? 187 LYS A N 1 ATOM 972 C CA . LYS A 1 128 ? 6.188 70.596 57.036 1.00 53.41 ? 187 LYS A CA 1 ATOM 973 C C . LYS A 1 128 ? 7.636 70.133 57.133 1.00 57.05 ? 187 LYS A C 1 ATOM 974 O O . LYS A 1 128 ? 7.900 68.939 57.276 1.00 41.90 ? 187 LYS A O 1 ATOM 975 C CB . LYS A 1 128 ? 5.784 71.379 58.285 1.00 47.90 ? 187 LYS A CB 1 ATOM 976 C CG . LYS A 1 128 ? 4.457 72.099 58.148 1.00 46.99 ? 187 LYS A CG 1 ATOM 977 C CD . LYS A 1 128 ? 4.484 73.063 56.974 1.00 48.46 ? 187 LYS A CD 1 ATOM 978 C CE . LYS A 1 128 ? 3.202 73.870 56.893 1.00 54.86 ? 187 LYS A CE 1 ATOM 979 N NZ . LYS A 1 128 ? 1.996 73.000 56.940 1.00 54.91 ? 187 LYS A NZ 1 ATOM 980 N N . GLN A 1 129 ? 8.576 71.068 57.052 1.00 57.59 ? 188 GLN A N 1 ATOM 981 C CA . GLN A 1 129 ? 9.980 70.687 56.954 1.00 41.30 ? 188 GLN A CA 1 ATOM 982 C C . GLN A 1 129 ? 10.902 71.483 57.872 1.00 49.69 ? 188 GLN A C 1 ATOM 983 O O . GLN A 1 129 ? 10.546 72.555 58.362 1.00 48.39 ? 188 GLN A O 1 ATOM 984 C CB . GLN A 1 129 ? 10.460 70.821 55.507 1.00 38.96 ? 188 GLN A CB 1 ATOM 985 C CG . GLN A 1 129 ? 9.796 69.845 54.548 1.00 31.39 ? 188 GLN A CG 1 ATOM 986 C CD . GLN A 1 129 ? 10.362 69.925 53.146 1.00 42.75 ? 188 GLN A CD 1 ATOM 987 O OE1 . GLN A 1 129 ? 10.433 71.002 52.553 1.00 47.39 ? 188 GLN A OE1 1 ATOM 988 N NE2 . GLN A 1 129 ? 10.766 68.781 52.606 1.00 36.21 ? 188 GLN A NE2 1 ATOM 989 N N . ALA A 1 130 ? 12.095 70.939 58.096 1.00 61.40 ? 189 ALA A N 1 ATOM 990 C CA . ALA A 1 130 ? 13.094 71.571 58.947 1.00 46.20 ? 189 ALA A CA 1 ATOM 991 C C . ALA A 1 130 ? 14.507 71.204 58.507 1.00 49.77 ? 189 ALA A C 1 ATOM 992 O O . ALA A 1 130 ? 14.712 70.211 57.809 1.00 42.37 ? 189 ALA A O 1 ATOM 993 C CB . ALA A 1 130 ? 12.876 71.181 60.399 1.00 30.50 ? 189 ALA A CB 1 ATOM 994 N N . VAL A 1 131 ? 15.477 72.010 58.927 1.00 43.72 ? 190 VAL A N 1 ATOM 995 C CA . VAL A 1 131 ? 16.882 71.734 58.652 1.00 30.69 ? 190 VAL A CA 1 ATOM 996 C C . VAL A 1 131 ? 17.535 71.051 59.848 1.00 34.50 ? 190 VAL A C 1 ATOM 997 O O . VAL A 1 131 ? 17.455 71.546 60.972 1.00 32.43 ? 190 VAL A O 1 ATOM 998 C CB . VAL A 1 131 ? 17.661 73.022 58.320 1.00 37.16 ? 190 VAL A CB 1 ATOM 999 C CG1 . VAL A 1 131 ? 19.146 72.724 58.170 1.00 29.34 ? 190 VAL A CG1 1 ATOM 1000 C CG2 . VAL A 1 131 ? 17.115 73.660 57.057 1.00 29.55 ? 190 VAL A CG2 1 ATOM 1001 N N . PHE A 1 132 ? 18.170 69.909 59.608 1.00 34.87 ? 191 PHE A N 1 ATOM 1002 C CA . PHE A 1 132 ? 18.835 69.177 60.679 1.00 40.81 ? 191 PHE A CA 1 ATOM 1003 C C . PHE A 1 132 ? 20.354 69.213 60.550 1.00 49.38 ? 191 PHE A C 1 ATOM 1004 O O . PHE A 1 132 ? 20.906 68.875 59.505 1.00 35.72 ? 191 PHE A O 1 ATOM 1005 C CB . PHE A 1 132 ? 18.357 67.725 60.713 1.00 30.11 ? 191 PHE A CB 1 ATOM 1006 C CG . PHE A 1 132 ? 19.104 66.866 61.692 1.00 30.08 ? 191 PHE A CG 1 ATOM 1007 C CD1 . PHE A 1 132 ? 18.878 66.988 63.052 1.00 33.52 ? 191 PHE A CD1 1 ATOM 1008 C CD2 . PHE A 1 132 ? 20.029 65.932 61.253 1.00 33.13 ? 191 PHE A CD2 1 ATOM 1009 C CE1 . PHE A 1 132 ? 19.563 66.201 63.954 1.00 30.05 ? 191 PHE A CE1 1 ATOM 1010 C CE2 . PHE A 1 132 ? 20.716 65.140 62.153 1.00 33.11 ? 191 PHE A CE2 1 ATOM 1011 C CZ . PHE A 1 132 ? 20.483 65.275 63.505 1.00 30.04 ? 191 PHE A CZ 1 ATOM 1012 N N . LYS A 1 133 ? 21.020 69.618 61.625 1.00 29.40 ? 192 LYS A N 1 ATOM 1013 C CA . LYS A 1 133 ? 22.475 69.583 61.694 1.00 33.36 ? 192 LYS A CA 1 ATOM 1014 C C . LYS A 1 133 ? 22.912 68.736 62.882 1.00 32.85 ? 192 LYS A C 1 ATOM 1015 O O . LYS A 1 133 ? 22.593 69.056 64.026 1.00 42.04 ? 192 LYS A O 1 ATOM 1016 C CB . LYS A 1 133 ? 23.050 70.996 61.799 1.00 28.91 ? 192 LYS A CB 1 ATOM 1017 C CG . LYS A 1 133 ? 22.889 71.821 60.533 1.00 28.85 ? 192 LYS A CG 1 ATOM 1018 C CD . LYS A 1 133 ? 23.345 73.254 60.740 1.00 28.60 ? 192 LYS A CD 1 ATOM 1019 C CE . LYS A 1 133 ? 23.329 74.028 59.431 1.00 39.00 ? 192 LYS A CE 1 ATOM 1020 N NZ . LYS A 1 133 ? 23.914 75.390 59.581 1.00 38.74 ? 192 LYS A NZ 1 ATOM 1021 N N . PRO A 1 134 ? 23.645 67.646 62.611 1.00 34.01 ? 193 PRO A N 1 ATOM 1022 C CA . PRO A 1 134 ? 24.031 66.682 63.646 1.00 30.02 ? 193 PRO A CA 1 ATOM 1023 C C . PRO A 1 134 ? 25.115 67.203 64.585 1.00 32.47 ? 193 PRO A C 1 ATOM 1024 O O . PRO A 1 134 ? 25.920 68.052 64.203 1.00 31.81 ? 193 PRO A O 1 ATOM 1025 C CB . PRO A 1 134 ? 24.552 65.495 62.835 1.00 29.36 ? 193 PRO A CB 1 ATOM 1026 C CG . PRO A 1 134 ? 25.072 66.109 61.583 1.00 37.23 ? 193 PRO A CG 1 ATOM 1027 C CD . PRO A 1 134 ? 24.165 67.271 61.284 1.00 29.23 ? 193 PRO A CD 1 HETATM 1028 N N . MSE A 1 135 ? 25.122 66.688 65.810 1.00 38.15 ? 194 MSE A N 1 HETATM 1029 C CA . MSE A 1 135 ? 26.152 67.016 66.786 1.00 28.85 ? 194 MSE A CA 1 HETATM 1030 C C . MSE A 1 135 ? 27.425 66.230 66.505 1.00 29.55 ? 194 MSE A C 1 HETATM 1031 O O . MSE A 1 135 ? 27.372 65.037 66.205 1.00 28.94 ? 194 MSE A O 1 HETATM 1032 C CB . MSE A 1 135 ? 25.658 66.724 68.204 1.00 34.37 ? 194 MSE A CB 1 HETATM 1033 C CG . MSE A 1 135 ? 26.750 66.717 69.262 1.00 40.56 ? 194 MSE A CG 1 HETATM 1034 SE SE . MSE A 1 135 ? 26.064 66.287 71.034 1.00 65.81 ? 194 MSE A SE 1 HETATM 1035 C CE . MSE A 1 135 ? 27.761 66.107 71.981 1.00 33.18 ? 194 MSE A CE 1 ATOM 1036 N N . ARG A 1 136 ? 28.569 66.899 66.596 1.00 28.51 ? 195 ARG A N 1 ATOM 1037 C CA . ARG A 1 136 ? 29.850 66.224 66.435 1.00 28.40 ? 195 ARG A CA 1 ATOM 1038 C C . ARG A 1 136 ? 30.603 66.107 67.757 1.00 35.28 ? 195 ARG A C 1 ATOM 1039 O O . ARG A 1 136 ? 30.585 65.054 68.391 1.00 55.28 ? 195 ARG A O 1 ATOM 1040 C CB . ARG A 1 136 ? 30.710 66.938 65.390 1.00 28.31 ? 195 ARG A CB 1 ATOM 1041 C CG . ARG A 1 136 ? 31.967 66.170 65.022 1.00 33.19 ? 195 ARG A CG 1 ATOM 1042 C CD . ARG A 1 136 ? 32.704 66.783 63.842 1.00 27.98 ? 195 ARG A CD 1 ATOM 1043 N NE . ARG A 1 136 ? 32.250 66.228 62.571 1.00 35.05 ? 195 ARG A NE 1 ATOM 1044 C CZ . ARG A 1 136 ? 31.497 66.878 61.691 1.00 30.10 ? 195 ARG A CZ 1 ATOM 1045 N NH1 . ARG A 1 136 ? 31.110 68.120 61.943 1.00 50.34 ? 195 ARG A NH1 1 ATOM 1046 N NH2 . ARG A 1 136 ? 31.131 66.288 60.559 1.00 34.87 ? 195 ARG A NH2 1 ATOM 1047 N N . PHE A 1 137 ? 31.255 67.186 68.177 1.00 38.34 ? 196 PHE A N 1 ATOM 1048 C CA . PHE A 1 137 ? 32.024 67.158 69.416 1.00 30.16 ? 196 PHE A CA 1 ATOM 1049 C C . PHE A 1 137 ? 31.202 67.605 70.622 1.00 36.87 ? 196 PHE A C 1 ATOM 1050 O O . PHE A 1 137 ? 30.068 68.064 70.481 1.00 42.17 ? 196 PHE A O 1 ATOM 1051 C CB . PHE A 1 137 ? 33.267 68.043 69.293 1.00 27.68 ? 196 PHE A CB 1 ATOM 1052 C CG . PHE A 1 137 ? 34.092 67.768 68.069 1.00 45.99 ? 196 PHE A CG 1 ATOM 1053 C CD1 . PHE A 1 137 ? 34.656 66.521 67.863 1.00 30.60 ? 196 PHE A CD1 1 ATOM 1054 C CD2 . PHE A 1 137 ? 34.311 68.761 67.127 1.00 27.50 ? 196 PHE A CD2 1 ATOM 1055 C CE1 . PHE A 1 137 ? 35.419 66.265 66.739 1.00 36.38 ? 196 PHE A CE1 1 ATOM 1056 C CE2 . PHE A 1 137 ? 35.073 68.512 66.000 1.00 28.69 ? 196 PHE A CE2 1 ATOM 1057 C CZ . PHE A 1 137 ? 35.628 67.262 65.806 1.00 27.50 ? 196 PHE A CZ 1 ATOM 1058 N N . GLY A 1 138 ? 31.786 67.459 71.809 1.00 30.65 ? 197 GLY A N 1 ATOM 1059 C CA . GLY A 1 138 ? 31.151 67.880 73.045 1.00 35.26 ? 197 GLY A CA 1 ATOM 1060 C C . GLY A 1 138 ? 31.097 69.388 73.210 1.00 35.53 ? 197 GLY A C 1 ATOM 1061 O O . GLY A 1 138 ? 31.667 70.130 72.410 1.00 40.82 ? 197 GLY A O 1 ATOM 1062 N N . ARG A 1 139 ? 30.409 69.838 74.255 1.00 27.79 ? 198 ARG A N 1 ATOM 1063 C CA . ARG A 1 139 ? 30.240 71.264 74.521 1.00 40.21 ? 198 ARG A CA 1 ATOM 1064 C C . ARG A 1 139 ? 31.548 71.962 74.889 1.00 37.56 ? 198 ARG A C 1 ATOM 1065 O O . ARG A 1 139 ? 31.679 73.174 74.720 1.00 31.11 ? 198 ARG A O 1 ATOM 1066 C CB . ARG A 1 139 ? 29.219 71.475 75.644 1.00 27.73 ? 198 ARG A CB 1 ATOM 1067 C CG . ARG A 1 139 ? 27.848 70.862 75.396 1.00 37.50 ? 198 ARG A CG 1 ATOM 1068 C CD . ARG A 1 139 ? 27.158 71.522 74.213 1.00 28.84 ? 198 ARG A CD 1 ATOM 1069 N NE . ARG A 1 139 ? 25.706 71.379 74.277 1.00 39.95 ? 198 ARG A NE 1 ATOM 1070 C CZ . ARG A 1 139 ? 25.008 70.486 73.584 1.00 49.48 ? 198 ARG A CZ 1 ATOM 1071 N NH1 . ARG A 1 139 ? 25.628 69.647 72.767 1.00 41.64 ? 198 ARG A NH1 1 ATOM 1072 N NH2 . ARG A 1 139 ? 23.690 70.431 73.711 1.00 35.29 ? 198 ARG A NH2 1 ATOM 1073 N N . ASP A 1 140 ? 32.511 71.196 75.391 1.00 30.32 ? 199 ASP A N 1 ATOM 1074 C CA . ASP A 1 140 ? 33.769 71.764 75.871 1.00 33.53 ? 199 ASP A CA 1 ATOM 1075 C C . ASP A 1 140 ? 34.781 71.968 74.749 1.00 34.58 ? 199 ASP A C 1 ATOM 1076 O O . ASP A 1 140 ? 35.765 72.688 74.919 1.00 42.37 ? 199 ASP A O 1 ATOM 1077 C CB . ASP A 1 140 ? 34.377 70.874 76.956 1.00 36.59 ? 199 ASP A CB 1 ATOM 1078 C CG . ASP A 1 140 ? 33.563 70.873 78.233 1.00 58.18 ? 199 ASP A CG 1 ATOM 1079 O OD1 . ASP A 1 140 ? 32.914 71.898 78.529 1.00 47.94 ? 199 ASP A OD1 1 ATOM 1080 O OD2 . ASP A 1 140 ? 33.575 69.846 78.943 1.00 78.74 ? 199 ASP A OD2 1 ATOM 1081 N N . TYR A 1 141 ? 34.540 71.328 73.608 1.00 29.61 ? 200 TYR A N 1 ATOM 1082 C CA . TYR A 1 141 ? 35.454 71.411 72.472 1.00 27.00 ? 200 TYR A CA 1 ATOM 1083 C C . TYR A 1 141 ? 35.614 72.844 71.974 1.00 38.86 ? 200 TYR A C 1 ATOM 1084 O O . TYR A 1 141 ? 34.631 73.557 71.777 1.00 54.59 ? 200 TYR A O 1 ATOM 1085 C CB . TYR A 1 141 ? 34.965 70.519 71.328 1.00 42.91 ? 200 TYR A CB 1 ATOM 1086 C CG . TYR A 1 141 ? 35.904 70.455 70.139 1.00 44.62 ? 200 TYR A CG 1 ATOM 1087 C CD1 . TYR A 1 141 ? 36.901 69.490 70.070 1.00 45.80 ? 200 TYR A CD1 1 ATOM 1088 C CD2 . TYR A 1 141 ? 35.786 71.352 69.084 1.00 46.10 ? 200 TYR A CD2 1 ATOM 1089 C CE1 . TYR A 1 141 ? 37.759 69.425 68.987 1.00 43.14 ? 200 TYR A CE1 1 ATOM 1090 C CE2 . TYR A 1 141 ? 36.640 71.294 67.997 1.00 48.97 ? 200 TYR A CE2 1 ATOM 1091 C CZ . TYR A 1 141 ? 37.623 70.329 67.954 1.00 61.58 ? 200 TYR A CZ 1 ATOM 1092 O OH . TYR A 1 141 ? 38.475 70.267 66.875 1.00 77.14 ? 200 TYR A OH 1 ATOM 1093 N N . GLU A 1 142 ? 36.861 73.255 71.772 1.00 30.20 ? 201 GLU A N 1 ATOM 1094 C CA . GLU A 1 142 ? 37.157 74.575 71.230 1.00 39.31 ? 201 GLU A CA 1 ATOM 1095 C C . GLU A 1 142 ? 37.880 74.452 69.894 1.00 37.74 ? 201 GLU A C 1 ATOM 1096 O O . GLU A 1 142 ? 38.605 73.487 69.660 1.00 44.93 ? 201 GLU A O 1 ATOM 1097 C CB . GLU A 1 142 ? 37.986 75.397 72.219 1.00 28.77 ? 201 GLU A CB 1 ATOM 1098 C CG . GLU A 1 142 ? 37.410 75.440 73.626 1.00 44.98 ? 201 GLU A CG 1 ATOM 1099 C CD . GLU A 1 142 ? 37.440 76.837 74.215 1.00 29.30 ? 201 GLU A CD 1 ATOM 1100 O OE1 . GLU A 1 142 ? 37.837 77.775 73.494 1.00 45.18 ? 201 GLU A OE1 1 ATOM 1101 O OE2 . GLU A 1 142 ? 37.058 77.001 75.392 1.00 38.47 ? 201 GLU A OE2 1 ATOM 1102 N N . SER A 1 143 ? 37.665 75.429 69.017 1.00 44.62 ? 202 SER A N 1 ATOM 1103 C CA . SER A 1 143 ? 38.257 75.417 67.683 1.00 39.39 ? 202 SER A CA 1 ATOM 1104 C C . SER A 1 143 ? 39.781 75.443 67.713 1.00 33.81 ? 202 SER A C 1 ATOM 1105 O O . SER A 1 143 ? 40.391 76.077 68.575 1.00 50.88 ? 202 SER A O 1 ATOM 1106 C CB . SER A 1 143 ? 37.743 76.596 66.856 1.00 36.23 ? 202 SER A CB 1 ATOM 1107 O OG . SER A 1 143 ? 36.333 76.548 66.717 1.00 54.94 ? 202 SER A OG 1 ATOM 1108 N N . ASP A 1 144 ? 40.386 74.727 66.772 1.00 44.97 ? 203 ASP A N 1 ATOM 1109 C CA . ASP A 1 144 ? 41.831 74.730 66.596 1.00 27.88 ? 203 ASP A CA 1 ATOM 1110 C C . ASP A 1 144 ? 42.310 76.149 66.318 1.00 37.05 ? 203 ASP A C 1 ATOM 1111 O O . ASP A 1 144 ? 41.815 76.804 65.398 1.00 27.20 ? 203 ASP A O 1 ATOM 1112 C CB . ASP A 1 144 ? 42.230 73.794 65.452 1.00 30.30 ? 203 ASP A CB 1 ATOM 1113 C CG . ASP A 1 144 ? 43.716 73.469 65.439 1.00 40.12 ? 203 ASP A CG 1 ATOM 1114 O OD1 . ASP A 1 144 ? 44.547 74.357 65.728 1.00 45.88 ? 203 ASP A OD1 1 ATOM 1115 O OD2 . ASP A 1 144 ? 44.055 72.314 65.119 1.00 46.00 ? 203 ASP A OD2 1 ATOM 1116 N N . PRO A 1 145 ? 43.279 76.629 67.113 1.00 38.41 ? 204 PRO A N 1 ATOM 1117 C CA . PRO A 1 145 ? 43.830 77.974 66.916 1.00 44.71 ? 204 PRO A CA 1 ATOM 1118 C C . PRO A 1 145 ? 44.459 78.157 65.533 1.00 42.25 ? 204 PRO A C 1 ATOM 1119 O O . PRO A 1 145 ? 44.560 79.284 65.050 1.00 39.58 ? 204 PRO A O 1 ATOM 1120 C CB . PRO A 1 145 ? 44.893 78.080 68.016 1.00 25.52 ? 204 PRO A CB 1 ATOM 1121 C CG . PRO A 1 145 ? 44.446 77.122 69.067 1.00 29.35 ? 204 PRO A CG 1 ATOM 1122 C CD . PRO A 1 145 ? 43.824 75.979 68.319 1.00 30.79 ? 204 PRO A CD 1 ATOM 1123 N N . ASN A 1 146 ? 44.862 77.057 64.905 1.00 31.80 ? 205 ASN A N 1 ATOM 1124 C CA . ASN A 1 146 ? 45.446 77.106 63.571 1.00 38.25 ? 205 ASN A CA 1 ATOM 1125 C C . ASN A 1 146 ? 44.403 77.065 62.457 1.00 29.17 ? 205 ASN A C 1 ATOM 1126 O O . ASN A 1 146 ? 44.724 77.289 61.290 1.00 35.57 ? 205 ASN A O 1 ATOM 1127 C CB . ASN A 1 146 ? 46.433 75.952 63.389 1.00 28.91 ? 205 ASN A CB 1 ATOM 1128 C CG . ASN A 1 146 ? 47.633 76.065 64.303 1.00 31.58 ? 205 ASN A CG 1 ATOM 1129 O OD1 . ASN A 1 146 ? 48.179 77.151 64.498 1.00 34.79 ? 205 ASN A OD1 1 ATOM 1130 N ND2 . ASN A 1 146 ? 48.043 74.943 64.881 1.00 34.15 ? 205 ASN A ND2 1 ATOM 1131 N N . HIS A 1 147 ? 43.156 76.783 62.820 1.00 38.57 ? 206 HIS A N 1 ATOM 1132 C CA . HIS A 1 147 ? 42.082 76.688 61.836 1.00 27.09 ? 206 HIS A CA 1 ATOM 1133 C C . HIS A 1 147 ? 41.520 78.049 61.452 1.00 32.24 ? 206 HIS A C 1 ATOM 1134 O O . HIS A 1 147 ? 41.174 78.857 62.313 1.00 31.83 ? 206 HIS A O 1 ATOM 1135 C CB . HIS A 1 147 ? 40.951 75.798 62.356 1.00 41.00 ? 206 HIS A CB 1 ATOM 1136 C CG . HIS A 1 147 ? 41.178 74.337 62.128 1.00 48.35 ? 206 HIS A CG 1 ATOM 1137 N ND1 . HIS A 1 147 ? 40.383 73.363 62.693 1.00 49.50 ? 206 HIS A ND1 1 ATOM 1138 C CD2 . HIS A 1 147 ? 42.109 73.683 61.393 1.00 31.94 ? 206 HIS A CD2 1 ATOM 1139 C CE1 . HIS A 1 147 ? 40.815 72.172 62.317 1.00 42.75 ? 206 HIS A CE1 1 ATOM 1140 N NE2 . HIS A 1 147 ? 41.861 72.339 61.528 1.00 43.07 ? 206 HIS A NE2 1 ATOM 1141 N N . PHE A 1 148 ? 41.428 78.289 60.148 1.00 39.96 ? 207 PHE A N 1 ATOM 1142 C CA . PHE A 1 148 ? 40.746 79.466 59.633 1.00 29.34 ? 207 PHE A CA 1 ATOM 1143 C C . PHE A 1 148 ? 39.239 79.302 59.789 1.00 40.96 ? 207 PHE A C 1 ATOM 1144 O O . PHE A 1 148 ? 38.751 78.203 60.057 1.00 32.94 ? 207 PHE A O 1 ATOM 1145 C CB . PHE A 1 148 ? 41.102 79.705 58.165 1.00 32.77 ? 207 PHE A CB 1 ATOM 1146 C CG . PHE A 1 148 ? 42.486 80.251 57.953 1.00 46.85 ? 207 PHE A CG 1 ATOM 1147 C CD1 . PHE A 1 148 ? 42.736 81.608 58.079 1.00 30.07 ? 207 PHE A CD1 1 ATOM 1148 C CD2 . PHE A 1 148 ? 43.535 79.409 57.619 1.00 33.11 ? 207 PHE A CD2 1 ATOM 1149 C CE1 . PHE A 1 148 ? 44.008 82.115 57.881 1.00 37.42 ? 207 PHE A CE1 1 ATOM 1150 C CE2 . PHE A 1 148 ? 44.809 79.910 57.420 1.00 32.41 ? 207 PHE A CE2 1 ATOM 1151 C CZ . PHE A 1 148 ? 45.045 81.264 57.551 1.00 36.56 ? 207 PHE A CZ 1 ATOM 1152 N N . TYR A 1 149 ? 38.509 80.399 59.624 1.00 30.41 ? 208 TYR A N 1 ATOM 1153 C CA . TYR A 1 149 ? 37.052 80.381 59.691 1.00 39.68 ? 208 TYR A CA 1 ATOM 1154 C C . TYR A 1 149 ? 36.433 79.421 58.675 1.00 44.51 ? 208 TYR A C 1 ATOM 1155 O O . TYR A 1 149 ? 35.354 78.879 58.909 1.00 53.35 ? 208 TYR A O 1 ATOM 1156 C CB . TYR A 1 149 ? 36.491 81.792 59.486 1.00 26.15 ? 208 TYR A CB 1 ATOM 1157 C CG . TYR A 1 149 ? 37.205 82.592 58.418 1.00 48.52 ? 208 TYR A CG 1 ATOM 1158 C CD1 . TYR A 1 149 ? 38.323 83.358 58.727 1.00 38.52 ? 208 TYR A CD1 1 ATOM 1159 C CD2 . TYR A 1 149 ? 36.761 82.584 57.103 1.00 26.11 ? 208 TYR A CD2 1 ATOM 1160 C CE1 . TYR A 1 149 ? 38.978 84.090 57.757 1.00 38.40 ? 208 TYR A CE1 1 ATOM 1161 C CE2 . TYR A 1 149 ? 37.410 83.314 56.126 1.00 44.70 ? 208 TYR A CE2 1 ATOM 1162 C CZ . TYR A 1 149 ? 38.517 84.064 56.458 1.00 55.43 ? 208 TYR A CZ 1 ATOM 1163 O OH . TYR A 1 149 ? 39.165 84.791 55.486 1.00 58.61 ? 208 TYR A OH 1 ATOM 1164 N N . PHE A 1 150 ? 37.114 79.212 57.550 1.00 48.67 ? 209 PHE A N 1 ATOM 1165 C CA . PHE A 1 150 ? 36.598 78.327 56.507 1.00 47.84 ? 209 PHE A CA 1 ATOM 1166 C C . PHE A 1 150 ? 37.062 76.886 56.704 1.00 37.82 ? 209 PHE A C 1 ATOM 1167 O O . PHE A 1 150 ? 36.797 76.020 55.870 1.00 36.54 ? 209 PHE A O 1 ATOM 1168 C CB . PHE A 1 150 ? 37.005 78.829 55.116 1.00 45.63 ? 209 PHE A CB 1 ATOM 1169 C CG . PHE A 1 150 ? 38.479 79.090 54.960 1.00 30.34 ? 209 PHE A CG 1 ATOM 1170 C CD1 . PHE A 1 150 ? 38.976 80.381 55.026 1.00 26.16 ? 209 PHE A CD1 1 ATOM 1171 C CD2 . PHE A 1 150 ? 39.366 78.048 54.735 1.00 26.32 ? 209 PHE A CD2 1 ATOM 1172 C CE1 . PHE A 1 150 ? 40.329 80.629 54.877 1.00 35.43 ? 209 PHE A CE1 1 ATOM 1173 C CE2 . PHE A 1 150 ? 40.720 78.289 54.587 1.00 39.70 ? 209 PHE A CE2 1 ATOM 1174 C CZ . PHE A 1 150 ? 41.202 79.581 54.658 1.00 35.92 ? 209 PHE A CZ 1 ATOM 1175 N N . SER A 1 151 ? 37.756 76.635 57.809 1.00 57.06 ? 210 SER A N 1 ATOM 1176 C CA . SER A 1 151 ? 38.204 75.289 58.144 1.00 52.11 ? 210 SER A CA 1 ATOM 1177 C C . SER A 1 151 ? 37.430 74.761 59.346 1.00 42.55 ? 210 SER A C 1 ATOM 1178 O O . SER A 1 151 ? 37.520 73.583 59.692 1.00 37.88 ? 210 SER A O 1 ATOM 1179 C CB . SER A 1 151 ? 39.707 75.271 58.429 1.00 57.43 ? 210 SER A CB 1 ATOM 1180 O OG . SER A 1 151 ? 40.452 75.614 57.274 1.00 63.53 ? 210 SER A OG 1 ATOM 1181 N N . ASP A 1 152 ? 36.666 75.647 59.973 1.00 48.78 ? 211 ASP A N 1 ATOM 1182 C CA . ASP A 1 152 ? 35.928 75.324 61.187 1.00 49.56 ? 211 ASP A CA 1 ATOM 1183 C C . ASP A 1 152 ? 34.741 74.394 60.937 1.00 57.53 ? 211 ASP A C 1 ATOM 1184 O O . ASP A 1 152 ? 33.923 74.639 60.050 1.00 61.78 ? 211 ASP A O 1 ATOM 1185 C CB . ASP A 1 152 ? 35.443 76.613 61.850 1.00 58.17 ? 211 ASP A CB 1 ATOM 1186 C CG . ASP A 1 152 ? 35.199 76.449 63.332 1.00 65.46 ? 211 ASP A CG 1 ATOM 1187 O OD1 . ASP A 1 152 ? 35.754 75.503 63.928 1.00 56.65 ? 211 ASP A OD1 1 ATOM 1188 O OD2 . ASP A 1 152 ? 34.453 77.271 63.904 1.00 76.14 ? 211 ASP A OD2 1 ATOM 1189 N N . PHE A 1 153 ? 34.659 73.324 61.723 1.00 53.23 ? 212 PHE A N 1 ATOM 1190 C CA . PHE A 1 153 ? 33.495 72.443 61.717 1.00 31.81 ? 212 PHE A CA 1 ATOM 1191 C C . PHE A 1 153 ? 32.301 73.140 62.362 1.00 31.28 ? 212 PHE A C 1 ATOM 1192 O O . PHE A 1 153 ? 32.456 73.857 63.350 1.00 39.25 ? 212 PHE A O 1 ATOM 1193 C CB . PHE A 1 153 ? 33.801 71.136 62.454 1.00 38.04 ? 212 PHE A CB 1 ATOM 1194 C CG . PHE A 1 153 ? 34.024 69.958 61.544 1.00 40.82 ? 212 PHE A CG 1 ATOM 1195 C CD1 . PHE A 1 153 ? 33.389 69.880 60.316 1.00 44.72 ? 212 PHE A CD1 1 ATOM 1196 C CD2 . PHE A 1 153 ? 34.869 68.926 61.922 1.00 46.79 ? 212 PHE A CD2 1 ATOM 1197 C CE1 . PHE A 1 153 ? 33.593 68.795 59.481 1.00 42.41 ? 212 PHE A CE1 1 ATOM 1198 C CE2 . PHE A 1 153 ? 35.077 67.839 61.092 1.00 27.60 ? 212 PHE A CE2 1 ATOM 1199 C CZ . PHE A 1 153 ? 34.438 67.774 59.871 1.00 44.73 ? 212 PHE A CZ 1 ATOM 1200 N N . GLU A 1 154 ? 31.115 72.941 61.796 1.00 27.58 ? 213 GLU A N 1 ATOM 1201 C CA . GLU A 1 154 ? 29.901 73.523 62.360 1.00 29.09 ? 213 GLU A CA 1 ATOM 1202 C C . GLU A 1 154 ? 29.585 72.944 63.734 1.00 27.73 ? 213 GLU A C 1 ATOM 1203 O O . GLU A 1 154 ? 29.875 71.780 64.013 1.00 48.03 ? 213 GLU A O 1 ATOM 1204 C CB . GLU A 1 154 ? 28.708 73.303 61.428 1.00 27.85 ? 213 GLU A CB 1 ATOM 1205 C CG . GLU A 1 154 ? 28.622 74.277 60.266 1.00 32.81 ? 213 GLU A CG 1 ATOM 1206 C CD . GLU A 1 154 ? 27.290 74.197 59.544 1.00 57.20 ? 213 GLU A CD 1 ATOM 1207 O OE1 . GLU A 1 154 ? 26.939 73.100 59.059 1.00 66.27 ? 213 GLU A OE1 1 ATOM 1208 O OE2 . GLU A 1 154 ? 26.591 75.229 59.465 1.00 59.79 ? 213 GLU A OE2 1 ATOM 1209 N N . ARG A 1 155 ? 28.994 73.771 64.589 1.00 36.87 ? 214 ARG A N 1 ATOM 1210 C CA . ARG A 1 155 ? 28.494 73.321 65.881 1.00 27.78 ? 214 ARG A CA 1 ATOM 1211 C C . ARG A 1 155 ? 26.987 73.521 65.954 1.00 28.57 ? 214 ARG A C 1 ATOM 1212 O O . ARG A 1 155 ? 26.501 74.650 65.900 1.00 37.22 ? 214 ARG A O 1 ATOM 1213 C CB . ARG A 1 155 ? 29.189 74.057 67.024 1.00 27.58 ? 214 ARG A CB 1 ATOM 1214 C CG . ARG A 1 155 ? 30.650 73.694 67.177 1.00 27.44 ? 214 ARG A CG 1 ATOM 1215 C CD . ARG A 1 155 ? 31.380 74.692 68.053 1.00 29.64 ? 214 ARG A CD 1 ATOM 1216 N NE . ARG A 1 155 ? 32.576 75.198 67.390 1.00 44.69 ? 214 ARG A NE 1 ATOM 1217 C CZ . ARG A 1 155 ? 32.584 76.244 66.573 1.00 35.18 ? 214 ARG A CZ 1 ATOM 1218 N NH1 . ARG A 1 155 ? 31.460 76.900 66.323 1.00 52.84 ? 214 ARG A NH1 1 ATOM 1219 N NH2 . ARG A 1 155 ? 33.716 76.638 66.008 1.00 49.37 ? 214 ARG A NH2 1 ATOM 1220 N N . HIS A 1 156 ? 26.254 72.417 66.062 1.00 28.18 ? 215 HIS A N 1 ATOM 1221 C CA . HIS A 1 156 ? 24.797 72.457 66.077 1.00 34.59 ? 215 HIS A CA 1 ATOM 1222 C C . HIS A 1 156 ? 24.272 73.298 67.238 1.00 46.46 ? 215 HIS A C 1 ATOM 1223 O O . HIS A 1 156 ? 23.246 73.967 67.115 1.00 37.10 ? 215 HIS A O 1 ATOM 1224 C CB . HIS A 1 156 ? 24.226 71.040 66.160 1.00 28.64 ? 215 HIS A CB 1 ATOM 1225 C CG . HIS A 1 156 ? 24.150 70.503 67.555 1.00 39.22 ? 215 HIS A CG 1 ATOM 1226 N ND1 . HIS A 1 156 ? 25.270 70.179 68.291 1.00 28.56 ? 215 HIS A ND1 1 ATOM 1227 C CD2 . HIS A 1 156 ? 23.088 70.242 68.353 1.00 33.13 ? 215 HIS A CD2 1 ATOM 1228 C CE1 . HIS A 1 156 ? 24.901 69.742 69.481 1.00 28.64 ? 215 HIS A CE1 1 ATOM 1229 N NE2 . HIS A 1 156 ? 23.582 69.767 69.544 1.00 48.57 ? 215 HIS A NE2 1 ATOM 1230 N N . HIS A 1 157 ? 24.982 73.266 68.363 1.00 28.20 ? 216 HIS A N 1 ATOM 1231 C CA . HIS A 1 157 ? 24.541 73.975 69.557 1.00 40.51 ? 216 HIS A CA 1 ATOM 1232 C C . HIS A 1 157 ? 24.783 75.476 69.426 1.00 35.33 ? 216 HIS A C 1 ATOM 1233 O O . HIS A 1 157 ? 24.253 76.266 70.203 1.00 52.28 ? 216 HIS A O 1 ATOM 1234 C CB . HIS A 1 157 ? 25.247 73.426 70.801 1.00 28.10 ? 216 HIS A CB 1 ATOM 1235 C CG . HIS A 1 157 ? 26.734 73.594 70.780 1.00 44.25 ? 216 HIS A CG 1 ATOM 1236 N ND1 . HIS A 1 157 ? 27.371 74.658 71.382 1.00 35.51 ? 216 HIS A ND1 1 ATOM 1237 C CD2 . HIS A 1 157 ? 27.710 72.832 70.232 1.00 28.81 ? 216 HIS A CD2 1 ATOM 1238 C CE1 . HIS A 1 157 ? 28.676 74.544 71.205 1.00 34.59 ? 216 HIS A CE1 1 ATOM 1239 N NE2 . HIS A 1 157 ? 28.908 73.446 70.510 1.00 41.35 ? 216 HIS A NE2 1 ATOM 1240 N N . ALA A 1 158 ? 25.579 75.864 68.435 1.00 40.97 ? 217 ALA A N 1 ATOM 1241 C CA . ALA A 1 158 ? 25.804 77.276 68.153 1.00 41.74 ? 217 ALA A CA 1 ATOM 1242 C C . ALA A 1 158 ? 24.603 77.860 67.419 1.00 38.03 ? 217 ALA A C 1 ATOM 1243 O O . ALA A 1 158 ? 24.237 79.017 67.626 1.00 47.97 ? 217 ALA A O 1 ATOM 1244 C CB . ALA A 1 158 ? 27.073 77.466 67.340 1.00 42.00 ? 217 ALA A CB 1 ATOM 1245 N N . GLU A 1 159 ? 24.000 77.046 66.557 1.00 37.79 ? 218 GLU A N 1 ATOM 1246 C CA . GLU A 1 159 ? 22.768 77.417 65.871 1.00 43.49 ? 218 GLU A CA 1 ATOM 1247 C C . GLU A 1 159 ? 21.659 77.711 66.874 1.00 32.69 ? 218 GLU A C 1 ATOM 1248 O O . GLU A 1 159 ? 20.946 78.706 66.755 1.00 41.42 ? 218 GLU A O 1 ATOM 1249 C CB . GLU A 1 159 ? 22.327 76.305 64.915 1.00 34.61 ? 218 GLU A CB 1 ATOM 1250 C CG . GLU A 1 159 ? 23.211 76.127 63.684 1.00 49.47 ? 218 GLU A CG 1 ATOM 1251 C CD . GLU A 1 159 ? 22.946 77.156 62.595 1.00 58.17 ? 218 GLU A CD 1 ATOM 1252 O OE1 . GLU A 1 159 ? 22.592 78.310 62.916 1.00 50.02 ? 218 GLU A OE1 1 ATOM 1253 O OE2 . GLU A 1 159 ? 23.091 76.804 61.406 1.00 52.07 ? 218 GLU A OE2 1 ATOM 1254 N N . ILE A 1 160 ? 21.525 76.833 67.862 1.00 28.21 ? 219 ILE A N 1 ATOM 1255 C CA . ILE A 1 160 ? 20.524 76.987 68.910 1.00 28.30 ? 219 ILE A CA 1 ATOM 1256 C C . ILE A 1 160 ? 20.803 78.207 69.784 1.00 45.39 ? 219 ILE A C 1 ATOM 1257 O O . ILE A 1 160 ? 19.932 79.054 69.982 1.00 38.82 ? 219 ILE A O 1 ATOM 1258 C CB . ILE A 1 160 ? 20.458 75.735 69.807 1.00 39.98 ? 219 ILE A CB 1 ATOM 1259 C CG1 . ILE A 1 160 ? 20.021 74.514 68.996 1.00 29.40 ? 219 ILE A CG1 1 ATOM 1260 C CG2 . ILE A 1 160 ? 19.521 75.964 70.981 1.00 28.53 ? 219 ILE A CG2 1 ATOM 1261 C CD1 . ILE A 1 160 ? 20.394 73.199 69.641 1.00 28.83 ? 219 ILE A CD1 1 ATOM 1262 N N . ALA A 1 161 ? 22.026 78.281 70.304 1.00 37.39 ? 220 ALA A N 1 ATOM 1263 C CA . ALA A 1 161 ? 22.433 79.349 71.213 1.00 34.77 ? 220 ALA A CA 1 ATOM 1264 C C . ALA A 1 161 ? 22.244 80.746 70.626 1.00 31.53 ? 220 ALA A C 1 ATOM 1265 O O . ALA A 1 161 ? 21.828 81.667 71.329 1.00 38.28 ? 220 ALA A O 1 ATOM 1266 C CB . ALA A 1 161 ? 23.882 79.155 71.624 1.00 27.51 ? 220 ALA A CB 1 ATOM 1267 N N . THR A 1 162 ? 22.548 80.902 69.341 1.00 27.49 ? 221 THR A N 1 ATOM 1268 C CA . THR A 1 162 ? 22.510 82.218 68.713 1.00 43.89 ? 221 THR A CA 1 ATOM 1269 C C . THR A 1 162 ? 21.075 82.681 68.481 1.00 39.09 ? 221 THR A C 1 ATOM 1270 O O . THR A 1 162 ? 20.771 83.867 68.620 1.00 36.93 ? 221 THR A O 1 ATOM 1271 C CB . THR A 1 162 ? 23.270 82.231 67.372 1.00 37.98 ? 221 THR A CB 1 ATOM 1272 O OG1 . THR A 1 162 ? 24.593 81.715 67.564 1.00 28.50 ? 221 THR A OG1 1 ATOM 1273 C CG2 . THR A 1 162 ? 23.362 83.649 66.824 1.00 27.10 ? 221 THR A CG2 1 ATOM 1274 N N . PHE A 1 163 ? 20.198 81.745 68.132 1.00 42.60 ? 222 PHE A N 1 ATOM 1275 C CA . PHE A 1 163 ? 18.777 82.049 67.992 1.00 43.96 ? 222 PHE A CA 1 ATOM 1276 C C . PHE A 1 163 ? 18.215 82.636 69.280 1.00 40.70 ? 222 PHE A C 1 ATOM 1277 O O . PHE A 1 163 ? 17.492 83.631 69.256 1.00 46.84 ? 222 PHE A O 1 ATOM 1278 C CB . PHE A 1 163 ? 17.984 80.802 67.601 1.00 28.12 ? 222 PHE A CB 1 ATOM 1279 C CG . PHE A 1 163 ? 16.507 80.927 67.850 1.00 42.40 ? 222 PHE A CG 1 ATOM 1280 C CD1 . PHE A 1 163 ? 15.726 81.752 67.057 1.00 44.08 ? 222 PHE A CD1 1 ATOM 1281 C CD2 . PHE A 1 163 ? 15.900 80.222 68.877 1.00 33.46 ? 222 PHE A CD2 1 ATOM 1282 C CE1 . PHE A 1 163 ? 14.369 81.877 67.287 1.00 39.85 ? 222 PHE A CE1 1 ATOM 1283 C CE2 . PHE A 1 163 ? 14.541 80.339 69.109 1.00 39.53 ? 222 PHE A CE2 1 ATOM 1284 C CZ . PHE A 1 163 ? 13.775 81.167 68.312 1.00 37.64 ? 222 PHE A CZ 1 ATOM 1285 N N . HIS A 1 164 ? 18.551 82.007 70.401 1.00 28.67 ? 223 HIS A N 1 ATOM 1286 C CA . HIS A 1 164 ? 18.128 82.490 71.708 1.00 47.90 ? 223 HIS A CA 1 ATOM 1287 C C . HIS A 1 164 ? 18.734 83.850 72.030 1.00 47.64 ? 223 HIS A C 1 ATOM 1288 O O . HIS A 1 164 ? 18.041 84.738 72.522 1.00 37.82 ? 223 HIS A O 1 ATOM 1289 C CB . HIS A 1 164 ? 18.495 81.480 72.796 1.00 27.83 ? 223 HIS A CB 1 ATOM 1290 C CG . HIS A 1 164 ? 17.586 80.293 72.843 1.00 39.63 ? 223 HIS A CG 1 ATOM 1291 N ND1 . HIS A 1 164 ? 16.701 80.074 73.876 1.00 33.88 ? 223 HIS A ND1 1 ATOM 1292 C CD2 . HIS A 1 164 ? 17.418 79.264 71.979 1.00 36.48 ? 223 HIS A CD2 1 ATOM 1293 C CE1 . HIS A 1 164 ? 16.030 78.959 73.649 1.00 37.57 ? 223 HIS A CE1 1 ATOM 1294 N NE2 . HIS A 1 164 ? 16.446 78.448 72.505 1.00 39.17 ? 223 HIS A NE2 1 ATOM 1295 N N . LEU A 1 165 ? 20.024 84.011 71.751 1.00 39.54 ? 224 LEU A N 1 ATOM 1296 C CA . LEU A 1 165 ? 20.693 85.284 71.993 1.00 44.02 ? 224 LEU A CA 1 ATOM 1297 C C . LEU A 1 165 ? 20.079 86.383 71.135 1.00 52.07 ? 224 LEU A C 1 ATOM 1298 O O . LEU A 1 165 ? 19.977 87.532 71.563 1.00 26.82 ? 224 LEU A O 1 ATOM 1299 C CB . LEU A 1 165 ? 22.195 85.177 71.718 1.00 28.61 ? 224 LEU A CB 1 ATOM 1300 C CG . LEU A 1 165 ? 22.984 86.474 71.920 1.00 41.65 ? 224 LEU A CG 1 ATOM 1301 C CD1 . LEU A 1 165 ? 22.899 86.931 73.367 1.00 35.81 ? 224 LEU A CD1 1 ATOM 1302 C CD2 . LEU A 1 165 ? 24.430 86.309 71.498 1.00 35.56 ? 224 LEU A CD2 1 ATOM 1303 N N . ASP A 1 166 ? 19.670 86.021 69.924 1.00 27.11 ? 225 ASP A N 1 ATOM 1304 C CA . ASP A 1 166 ? 19.025 86.967 69.022 1.00 41.61 ? 225 ASP A CA 1 ATOM 1305 C C . ASP A 1 166 ? 17.687 87.457 69.570 1.00 46.51 ? 225 ASP A C 1 ATOM 1306 O O . ASP A 1 166 ? 17.299 88.603 69.344 1.00 43.15 ? 225 ASP A O 1 ATOM 1307 C CB . ASP A 1 166 ? 18.822 86.328 67.646 1.00 48.53 ? 225 ASP A CB 1 ATOM 1308 C CG . ASP A 1 166 ? 18.090 87.239 66.681 1.00 43.86 ? 225 ASP A CG 1 ATOM 1309 O OD1 . ASP A 1 166 ? 16.847 87.157 66.616 1.00 39.71 ? 225 ASP A OD1 1 ATOM 1310 O OD2 . ASP A 1 166 ? 18.756 88.030 65.982 1.00 38.47 ? 225 ASP A OD2 1 ATOM 1311 N N . ARG A 1 167 ? 16.986 86.590 70.294 1.00 32.21 ? 226 ARG A N 1 ATOM 1312 C CA . ARG A 1 167 ? 15.739 86.983 70.939 1.00 33.35 ? 226 ARG A CA 1 ATOM 1313 C C . ARG A 1 167 ? 16.032 87.816 72.186 1.00 45.02 ? 226 ARG A C 1 ATOM 1314 O O . ARG A 1 167 ? 15.393 88.842 72.414 1.00 38.02 ? 226 ARG A O 1 ATOM 1315 C CB . ARG A 1 167 ? 14.864 85.763 71.250 1.00 42.90 ? 226 ARG A CB 1 ATOM 1316 C CG . ARG A 1 167 ? 13.576 86.107 71.987 1.00 37.68 ? 226 ARG A CG 1 ATOM 1317 C CD . ARG A 1 167 ? 12.570 84.959 71.967 1.00 38.82 ? 226 ARG A CD 1 ATOM 1318 N NE . ARG A 1 167 ? 12.889 83.827 72.828 1.00 41.66 ? 226 ARG A NE 1 ATOM 1319 C CZ . ARG A 1 167 ? 12.214 82.681 72.805 1.00 57.52 ? 226 ARG A CZ 1 ATOM 1320 N NH1 . ARG A 1 167 ? 11.204 82.526 71.957 1.00 41.17 ? 226 ARG A NH1 1 ATOM 1321 N NH2 . ARG A 1 167 ? 12.548 81.690 73.619 1.00 62.44 ? 226 ARG A NH2 1 ATOM 1322 N N . VAL A 1 168 ? 16.982 87.359 72.998 1.00 27.13 ? 227 VAL A N 1 ATOM 1323 C CA . VAL A 1 168 ? 17.355 88.058 74.226 1.00 32.73 ? 227 VAL A CA 1 ATOM 1324 C C . VAL A 1 168 ? 17.777 89.501 73.933 1.00 41.74 ? 227 VAL A C 1 ATOM 1325 O O . VAL A 1 168 ? 17.489 90.414 74.709 1.00 57.83 ? 227 VAL A O 1 ATOM 1326 C CB . VAL A 1 168 ? 18.501 87.324 74.965 1.00 42.06 ? 227 VAL A CB 1 ATOM 1327 C CG1 . VAL A 1 168 ? 19.022 88.151 76.132 1.00 49.40 ? 227 VAL A CG1 1 ATOM 1328 C CG2 . VAL A 1 168 ? 18.036 85.962 75.448 1.00 48.86 ? 227 VAL A CG2 1 ATOM 1329 N N . LEU A 1 169 ? 18.432 89.710 72.795 1.00 36.64 ? 228 LEU A N 1 ATOM 1330 C CA . LEU A 1 169 ? 18.865 91.048 72.401 1.00 36.56 ? 228 LEU A CA 1 ATOM 1331 C C . LEU A 1 169 ? 17.714 91.835 71.781 1.00 40.46 ? 228 LEU A C 1 ATOM 1332 O O . LEU A 1 169 ? 17.848 93.022 71.485 1.00 32.15 ? 228 LEU A O 1 ATOM 1333 C CB . LEU A 1 169 ? 20.039 90.974 71.423 1.00 28.76 ? 228 LEU A CB 1 ATOM 1334 C CG . LEU A 1 169 ? 21.366 90.455 71.980 1.00 38.64 ? 228 LEU A CG 1 ATOM 1335 C CD1 . LEU A 1 169 ? 22.390 90.294 70.867 1.00 28.39 ? 228 LEU A CD1 1 ATOM 1336 C CD2 . LEU A 1 169 ? 21.889 91.386 73.062 1.00 29.46 ? 228 LEU A CD2 1 ATOM 1337 N N . GLY A 1 170 ? 16.584 91.163 71.583 1.00 46.94 ? 229 GLY A N 1 ATOM 1338 C CA . GLY A 1 170 ? 15.377 91.814 71.110 1.00 26.68 ? 229 GLY A CA 1 ATOM 1339 C C . GLY A 1 170 ? 15.322 92.013 69.610 1.00 51.32 ? 229 GLY A C 1 ATOM 1340 O O . GLY A 1 170 ? 14.503 92.784 69.110 1.00 56.66 ? 229 GLY A O 1 ATOM 1341 N N . PHE A 1 171 ? 16.188 91.311 68.888 1.00 38.71 ? 230 PHE A N 1 ATOM 1342 C CA . PHE A 1 171 ? 16.191 91.395 67.434 1.00 41.41 ? 230 PHE A CA 1 ATOM 1343 C C . PHE A 1 171 ? 15.037 90.601 66.836 1.00 36.26 ? 230 PHE A C 1 ATOM 1344 O O . PHE A 1 171 ? 14.272 91.131 66.031 1.00 44.04 ? 230 PHE A O 1 ATOM 1345 C CB . PHE A 1 171 ? 17.518 90.892 66.858 1.00 63.64 ? 230 PHE A CB 1 ATOM 1346 C CG . PHE A 1 171 ? 18.695 91.771 67.175 1.00 60.57 ? 230 PHE A CG 1 ATOM 1347 C CD1 . PHE A 1 171 ? 18.518 93.113 67.463 1.00 38.77 ? 230 PHE A CD1 1 ATOM 1348 C CD2 . PHE A 1 171 ? 19.979 91.251 67.182 1.00 54.20 ? 230 PHE A CD2 1 ATOM 1349 C CE1 . PHE A 1 171 ? 19.601 93.922 67.754 1.00 50.44 ? 230 PHE A CE1 1 ATOM 1350 C CE2 . PHE A 1 171 ? 21.066 92.055 67.472 1.00 53.08 ? 230 PHE A CE2 1 ATOM 1351 C CZ . PHE A 1 171 ? 20.876 93.392 67.758 1.00 50.58 ? 230 PHE A CZ 1 ATOM 1352 N N . ARG A 1 172 ? 14.915 89.337 67.239 1.00 52.58 ? 231 ARG A N 1 ATOM 1353 C CA . ARG A 1 172 ? 13.911 88.433 66.679 1.00 44.95 ? 231 ARG A CA 1 ATOM 1354 C C . ARG A 1 172 ? 13.950 88.392 65.155 1.00 37.91 ? 231 ARG A C 1 ATOM 1355 O O . ARG A 1 172 ? 12.914 88.401 64.489 1.00 43.07 ? 231 ARG A O 1 ATOM 1356 C CB . ARG A 1 172 ? 12.506 88.793 67.177 1.00 42.65 ? 231 ARG A CB 1 ATOM 1357 C CG . ARG A 1 172 ? 12.210 88.243 68.563 1.00 50.48 ? 231 ARG A CG 1 ATOM 1358 C CD . ARG A 1 172 ? 10.890 88.732 69.133 1.00 36.19 ? 231 ARG A CD 1 ATOM 1359 N NE . ARG A 1 172 ? 10.861 88.615 70.590 1.00 49.19 ? 231 ARG A NE 1 ATOM 1360 C CZ . ARG A 1 172 ? 11.264 89.548 71.442 1.00 47.06 ? 231 ARG A CZ 1 ATOM 1361 N NH1 . ARG A 1 172 ? 11.743 90.699 70.997 1.00 53.39 ? 231 ARG A NH1 1 ATOM 1362 N NH2 . ARG A 1 172 ? 11.192 89.320 72.746 1.00 44.86 ? 231 ARG A NH2 1 ATOM 1363 N N . ARG A 1 173 ? 15.163 88.357 64.614 1.00 32.68 ? 232 ARG A N 1 ATOM 1364 C CA . ARG A 1 173 ? 15.369 88.253 63.176 1.00 51.74 ? 232 ARG A CA 1 ATOM 1365 C C . ARG A 1 173 ? 16.106 86.959 62.850 1.00 52.18 ? 232 ARG A C 1 ATOM 1366 O O . ARG A 1 173 ? 16.597 86.772 61.737 1.00 40.39 ? 232 ARG A O 1 ATOM 1367 C CB . ARG A 1 173 ? 16.136 89.470 62.650 1.00 38.84 ? 232 ARG A CB 1 ATOM 1368 C CG . ARG A 1 173 ? 15.449 90.792 62.959 1.00 51.77 ? 232 ARG A CG 1 ATOM 1369 C CD . ARG A 1 173 ? 15.889 91.904 62.017 1.00 45.61 ? 232 ARG A CD 1 ATOM 1370 N NE . ARG A 1 173 ? 17.255 92.351 62.271 1.00 46.81 ? 232 ARG A NE 1 ATOM 1371 C CZ . ARG A 1 173 ? 17.599 93.175 63.257 1.00 41.44 ? 232 ARG A CZ 1 ATOM 1372 N NH1 . ARG A 1 173 ? 16.674 93.643 64.084 1.00 45.70 ? 232 ARG A NH1 1 ATOM 1373 N NH2 . ARG A 1 173 ? 18.865 93.535 63.414 1.00 51.79 ? 232 ARG A NH2 1 ATOM 1374 N N . ALA A 1 174 ? 16.177 86.068 63.835 1.00 37.70 ? 233 ALA A N 1 ATOM 1375 C CA . ALA A 1 174 ? 16.765 84.748 63.641 1.00 41.75 ? 233 ALA A CA 1 ATOM 1376 C C . ALA A 1 174 ? 15.681 83.713 63.364 1.00 46.37 ? 233 ALA A C 1 ATOM 1377 O O . ALA A 1 174 ? 14.494 83.975 63.556 1.00 47.91 ? 233 ALA A O 1 ATOM 1378 C CB . ALA A 1 174 ? 17.585 84.342 64.854 1.00 34.63 ? 233 ALA A CB 1 ATOM 1379 N N . ILE A 1 175 ? 16.097 82.536 62.911 1.00 47.56 ? 234 ILE A N 1 ATOM 1380 C CA . ILE A 1 175 ? 15.161 81.474 62.564 1.00 39.07 ? 234 ILE A CA 1 ATOM 1381 C C . ILE A 1 175 ? 15.055 80.457 63.699 1.00 42.00 ? 234 ILE A C 1 ATOM 1382 O O . ILE A 1 175 ? 16.074 79.966 64.185 1.00 46.95 ? 234 ILE A O 1 ATOM 1383 C CB . ILE A 1 175 ? 15.584 80.764 61.262 1.00 41.19 ? 234 ILE A CB 1 ATOM 1384 C CG1 . ILE A 1 175 ? 15.783 81.786 60.140 1.00 45.76 ? 234 ILE A CG1 1 ATOM 1385 C CG2 . ILE A 1 175 ? 14.552 79.731 60.852 1.00 33.48 ? 234 ILE A CG2 1 ATOM 1386 C CD1 . ILE A 1 175 ? 14.623 82.749 59.980 1.00 47.19 ? 234 ILE A CD1 1 ATOM 1387 N N . PRO A 1 176 ? 13.818 80.152 64.131 1.00 50.41 ? 235 PRO A N 1 ATOM 1388 C CA . PRO A 1 176 ? 13.535 79.215 65.227 1.00 41.43 ? 235 PRO A CA 1 ATOM 1389 C C . PRO A 1 176 ? 14.306 77.898 65.128 1.00 53.93 ? 235 PRO A C 1 ATOM 1390 O O . PRO A 1 176 ? 14.195 77.175 64.138 1.00 33.81 ? 235 PRO A O 1 ATOM 1391 C CB . PRO A 1 176 ? 12.031 78.976 65.093 1.00 38.23 ? 235 PRO A CB 1 ATOM 1392 C CG . PRO A 1 176 ? 11.510 80.247 64.527 1.00 39.26 ? 235 PRO A CG 1 ATOM 1393 C CD . PRO A 1 176 ? 12.589 80.790 63.625 1.00 31.39 ? 235 PRO A CD 1 ATOM 1394 N N . THR A 1 177 ? 15.087 77.604 66.163 1.00 29.02 ? 236 THR A N 1 ATOM 1395 C CA . THR A 1 177 ? 15.930 76.417 66.192 1.00 32.33 ? 236 THR A CA 1 ATOM 1396 C C . THR A 1 177 ? 15.861 75.753 67.562 1.00 34.52 ? 236 THR A C 1 ATOM 1397 O O . THR A 1 177 ? 15.939 76.426 68.590 1.00 45.82 ? 236 THR A O 1 ATOM 1398 C CB . THR A 1 177 ? 17.400 76.757 65.861 1.00 46.16 ? 236 THR A CB 1 ATOM 1399 O OG1 . THR A 1 177 ? 17.462 77.476 64.623 1.00 40.19 ? 236 THR A OG1 1 ATOM 1400 C CG2 . THR A 1 177 ? 18.237 75.490 65.748 1.00 28.90 ? 236 THR A CG2 1 ATOM 1401 N N . VAL A 1 178 ? 15.706 74.433 67.574 1.00 29.38 ? 237 VAL A N 1 ATOM 1402 C CA . VAL A 1 178 ? 15.604 73.693 68.824 1.00 36.22 ? 237 VAL A CA 1 ATOM 1403 C C . VAL A 1 178 ? 16.528 72.476 68.811 1.00 32.09 ? 237 VAL A C 1 ATOM 1404 O O . VAL A 1 178 ? 16.866 71.950 67.748 1.00 39.87 ? 237 VAL A O 1 ATOM 1405 C CB . VAL A 1 178 ? 14.145 73.241 69.092 1.00 44.08 ? 237 VAL A CB 1 ATOM 1406 C CG1 . VAL A 1 178 ? 13.785 72.040 68.232 1.00 30.03 ? 237 VAL A CG1 1 ATOM 1407 C CG2 . VAL A 1 178 ? 13.935 72.927 70.567 1.00 29.82 ? 237 VAL A CG2 1 ATOM 1408 N N . GLY A 1 179 ? 16.953 72.048 69.994 1.00 40.86 ? 238 GLY A N 1 ATOM 1409 C CA . GLY A 1 179 ? 17.720 70.824 70.127 1.00 39.79 ? 238 GLY A CA 1 ATOM 1410 C C . GLY A 1 179 ? 16.811 69.612 70.088 1.00 47.20 ? 238 GLY A C 1 ATOM 1411 O O . GLY A 1 179 ? 15.645 69.691 70.476 1.00 39.11 ? 238 GLY A O 1 ATOM 1412 N N . ARG A 1 180 ? 17.341 68.488 69.621 1.00 41.43 ? 239 ARG A N 1 ATOM 1413 C CA . ARG A 1 180 ? 16.560 67.260 69.558 1.00 39.48 ? 239 ARG A CA 1 ATOM 1414 C C . ARG A 1 180 ? 17.467 66.036 69.543 1.00 44.87 ? 239 ARG A C 1 ATOM 1415 O O . ARG A 1 180 ? 18.387 65.943 68.730 1.00 40.29 ? 239 ARG A O 1 ATOM 1416 C CB . ARG A 1 180 ? 15.654 67.268 68.324 1.00 32.43 ? 239 ARG A CB 1 ATOM 1417 C CG . ARG A 1 180 ? 14.701 66.086 68.232 1.00 33.34 ? 239 ARG A CG 1 ATOM 1418 C CD . ARG A 1 180 ? 13.831 66.181 66.985 1.00 30.97 ? 239 ARG A CD 1 ATOM 1419 N NE . ARG A 1 180 ? 12.970 65.013 66.822 1.00 48.09 ? 239 ARG A NE 1 ATOM 1420 C CZ . ARG A 1 180 ? 11.771 65.042 66.249 1.00 39.36 ? 239 ARG A CZ 1 ATOM 1421 N NH1 . ARG A 1 180 ? 11.282 66.183 65.782 1.00 46.87 ? 239 ARG A NH1 1 ATOM 1422 N NH2 . ARG A 1 180 ? 11.056 63.930 66.143 1.00 34.54 ? 239 ARG A NH2 1 ATOM 1423 N N . VAL A 1 181 ? 17.206 65.102 70.451 1.00 35.14 ? 240 VAL A N 1 ATOM 1424 C CA . VAL A 1 181 ? 17.947 63.850 70.489 1.00 35.02 ? 240 VAL A CA 1 ATOM 1425 C C . VAL A 1 181 ? 17.208 62.795 69.679 1.00 30.84 ? 240 VAL A C 1 ATOM 1426 O O . VAL A 1 181 ? 16.091 62.407 70.020 1.00 47.01 ? 240 VAL A O 1 ATOM 1427 C CB . VAL A 1 181 ? 18.148 63.350 71.930 1.00 33.03 ? 240 VAL A CB 1 ATOM 1428 C CG1 . VAL A 1 181 ? 18.959 62.061 71.937 1.00 30.60 ? 240 VAL A CG1 1 ATOM 1429 C CG2 . VAL A 1 181 ? 18.826 64.420 72.771 1.00 30.27 ? 240 VAL A CG2 1 ATOM 1430 N N . LEU A 1 182 ? 17.837 62.334 68.604 1.00 38.72 ? 241 LEU A N 1 ATOM 1431 C CA . LEU A 1 182 ? 17.190 61.409 67.683 1.00 39.39 ? 241 LEU A CA 1 ATOM 1432 C C . LEU A 1 182 ? 17.657 59.968 67.816 1.00 41.40 ? 241 LEU A C 1 ATOM 1433 O O . LEU A 1 182 ? 18.821 59.698 68.111 1.00 59.85 ? 241 LEU A O 1 ATOM 1434 C CB . LEU A 1 182 ? 17.404 61.868 66.243 1.00 33.55 ? 241 LEU A CB 1 ATOM 1435 C CG . LEU A 1 182 ? 16.612 63.101 65.822 1.00 51.68 ? 241 LEU A CG 1 ATOM 1436 C CD1 . LEU A 1 182 ? 17.428 64.366 66.008 1.00 47.44 ? 241 LEU A CD1 1 ATOM 1437 C CD2 . LEU A 1 182 ? 16.176 62.948 64.385 1.00 62.34 ? 241 LEU A CD2 1 ATOM 1438 N N . ASN A 1 183 ? 16.726 59.048 67.591 1.00 45.46 ? 242 ASN A N 1 ATOM 1439 C CA . ASN A 1 183 ? 17.055 57.643 67.424 1.00 31.67 ? 242 ASN A CA 1 ATOM 1440 C C . ASN A 1 183 ? 17.533 57.420 65.994 1.00 31.63 ? 242 ASN A C 1 ATOM 1441 O O . ASN A 1 183 ? 16.740 57.475 65.052 1.00 47.70 ? 242 ASN A O 1 ATOM 1442 C CB . ASN A 1 183 ? 15.843 56.764 67.742 1.00 32.25 ? 242 ASN A CB 1 ATOM 1443 C CG . ASN A 1 183 ? 16.157 55.282 67.670 1.00 43.16 ? 242 ASN A CG 1 ATOM 1444 O OD1 . ASN A 1 183 ? 16.386 54.733 66.593 1.00 46.86 ? 242 ASN A OD1 1 ATOM 1445 N ND2 . ASN A 1 183 ? 16.164 54.625 68.823 1.00 48.27 ? 242 ASN A ND2 1 HETATM 1446 N N . MSE A 1 184 ? 18.832 57.185 65.836 1.00 31.42 ? 243 MSE A N 1 HETATM 1447 C CA . MSE A 1 184 ? 19.444 57.063 64.515 1.00 42.44 ? 243 MSE A CA 1 HETATM 1448 C C . MSE A 1 184 ? 18.840 55.933 63.689 1.00 44.32 ? 243 MSE A C 1 HETATM 1449 O O . MSE A 1 184 ? 18.802 56.004 62.462 1.00 49.34 ? 243 MSE A O 1 HETATM 1450 C CB . MSE A 1 184 ? 20.953 56.847 64.646 1.00 41.37 ? 243 MSE A CB 1 HETATM 1451 C CG . MSE A 1 184 ? 21.684 57.962 65.370 1.00 30.79 ? 243 MSE A CG 1 HETATM 1452 SE SE . MSE A 1 184 ? 23.612 57.666 65.415 1.00 65.21 ? 243 MSE A SE 1 HETATM 1453 C CE . MSE A 1 184 ? 23.974 57.755 63.503 1.00 40.50 ? 243 MSE A CE 1 ATOM 1454 N N . THR A 1 185 ? 18.368 54.892 64.366 1.00 37.81 ? 244 THR A N 1 ATOM 1455 C CA . THR A 1 185 ? 17.822 53.728 63.682 1.00 44.65 ? 244 THR A CA 1 ATOM 1456 C C . THR A 1 185 ? 16.426 53.994 63.125 1.00 42.73 ? 244 THR A C 1 ATOM 1457 O O . THR A 1 185 ? 16.176 53.790 61.938 1.00 37.34 ? 244 THR A O 1 ATOM 1458 C CB . THR A 1 185 ? 17.764 52.506 64.618 1.00 45.60 ? 244 THR A CB 1 ATOM 1459 O OG1 . THR A 1 185 ? 19.071 52.239 65.143 1.00 32.08 ? 244 THR A OG1 1 ATOM 1460 C CG2 . THR A 1 185 ? 17.265 51.282 63.867 1.00 45.00 ? 244 THR A CG2 1 ATOM 1461 N N . THR A 1 186 ? 15.524 54.462 63.982 1.00 39.08 ? 245 THR A N 1 ATOM 1462 C CA . THR A 1 186 ? 14.122 54.619 63.605 1.00 40.01 ? 245 THR A CA 1 ATOM 1463 C C . THR A 1 186 ? 13.811 55.955 62.939 1.00 34.04 ? 245 THR A C 1 ATOM 1464 O O . THR A 1 186 ? 13.012 56.016 62.006 1.00 58.22 ? 245 THR A O 1 ATOM 1465 C CB . THR A 1 186 ? 13.198 54.471 64.827 1.00 41.25 ? 245 THR A CB 1 ATOM 1466 O OG1 . THR A 1 186 ? 13.548 55.448 65.816 1.00 41.16 ? 245 THR A OG1 1 ATOM 1467 C CG2 . THR A 1 186 ? 13.328 53.085 65.424 1.00 33.14 ? 245 THR A CG2 1 ATOM 1468 N N . GLU A 1 187 ? 14.441 57.023 63.417 1.00 51.57 ? 246 GLU A N 1 ATOM 1469 C CA . GLU A 1 187 ? 14.105 58.365 62.952 1.00 39.67 ? 246 GLU A CA 1 ATOM 1470 C C . GLU A 1 187 ? 15.029 58.861 61.844 1.00 31.97 ? 246 GLU A C 1 ATOM 1471 O O . GLU A 1 187 ? 14.675 59.773 61.098 1.00 47.79 ? 246 GLU A O 1 ATOM 1472 C CB . GLU A 1 187 ? 14.129 59.347 64.124 1.00 35.80 ? 246 GLU A CB 1 ATOM 1473 C CG . GLU A 1 187 ? 13.089 59.048 65.190 1.00 32.26 ? 246 GLU A CG 1 ATOM 1474 C CD . GLU A 1 187 ? 13.117 60.047 66.327 1.00 50.79 ? 246 GLU A CD 1 ATOM 1475 O OE1 . GLU A 1 187 ? 12.172 60.858 66.429 1.00 46.21 ? 246 GLU A OE1 1 ATOM 1476 O OE2 . GLU A 1 187 ? 14.079 60.015 67.124 1.00 39.88 ? 246 GLU A OE2 1 ATOM 1477 N N . LEU A 1 188 ? 16.211 58.266 61.738 1.00 42.52 ? 247 LEU A N 1 ATOM 1478 C CA . LEU A 1 188 ? 17.158 58.669 60.706 1.00 42.88 ? 247 LEU A CA 1 ATOM 1479 C C . LEU A 1 188 ? 17.314 57.598 59.632 1.00 34.99 ? 247 LEU A C 1 ATOM 1480 O O . LEU A 1 188 ? 16.913 57.802 58.490 1.00 49.58 ? 247 LEU A O 1 ATOM 1481 C CB . LEU A 1 188 ? 18.518 59.002 61.324 1.00 31.30 ? 247 LEU A CB 1 ATOM 1482 C CG . LEU A 1 188 ? 18.571 60.289 62.151 1.00 41.69 ? 247 LEU A CG 1 ATOM 1483 C CD1 . LEU A 1 188 ? 20.006 60.650 62.498 1.00 30.77 ? 247 LEU A CD1 1 ATOM 1484 C CD2 . LEU A 1 188 ? 17.891 61.431 61.408 1.00 31.07 ? 247 LEU A CD2 1 ATOM 1485 N N . PHE A 1 189 ? 17.889 56.460 60.008 1.00 39.88 ? 248 PHE A N 1 ATOM 1486 C CA . PHE A 1 189 ? 18.163 55.372 59.071 1.00 46.03 ? 248 PHE A CA 1 ATOM 1487 C C . PHE A 1 189 ? 16.918 54.880 58.331 1.00 48.85 ? 248 PHE A C 1 ATOM 1488 O O . PHE A 1 189 ? 16.880 54.876 57.100 1.00 38.69 ? 248 PHE A O 1 ATOM 1489 C CB . PHE A 1 189 ? 18.820 54.202 59.808 1.00 47.88 ? 248 PHE A CB 1 ATOM 1490 C CG . PHE A 1 189 ? 19.161 53.038 58.922 1.00 39.94 ? 248 PHE A CG 1 ATOM 1491 C CD1 . PHE A 1 189 ? 20.196 53.128 58.007 1.00 35.14 ? 248 PHE A CD1 1 ATOM 1492 C CD2 . PHE A 1 189 ? 18.450 51.852 59.008 1.00 36.72 ? 248 PHE A CD2 1 ATOM 1493 C CE1 . PHE A 1 189 ? 20.517 52.058 57.194 1.00 39.88 ? 248 PHE A CE1 1 ATOM 1494 C CE2 . PHE A 1 189 ? 18.765 50.778 58.196 1.00 39.38 ? 248 PHE A CE2 1 ATOM 1495 C CZ . PHE A 1 189 ? 19.798 50.882 57.287 1.00 39.78 ? 248 PHE A CZ 1 ATOM 1496 N N . GLU A 1 190 ? 15.902 54.470 59.085 1.00 47.43 ? 249 GLU A N 1 ATOM 1497 C CA . GLU A 1 190 ? 14.695 53.890 58.497 1.00 50.13 ? 249 GLU A CA 1 ATOM 1498 C C . GLU A 1 190 ? 13.846 54.916 57.746 1.00 46.61 ? 249 GLU A C 1 ATOM 1499 O O . GLU A 1 190 ? 13.017 54.551 56.914 1.00 50.14 ? 249 GLU A O 1 ATOM 1500 C CB . GLU A 1 190 ? 13.854 53.211 59.582 1.00 49.30 ? 249 GLU A CB 1 ATOM 1501 C CG . GLU A 1 190 ? 14.431 51.889 60.071 1.00 43.67 ? 249 GLU A CG 1 ATOM 1502 C CD . GLU A 1 190 ? 13.790 51.406 61.358 1.00 53.00 ? 249 GLU A CD 1 ATOM 1503 O OE1 . GLU A 1 190 ? 12.863 52.080 61.853 1.00 59.49 ? 249 GLU A OE1 1 ATOM 1504 O OE2 . GLU A 1 190 ? 14.216 50.352 61.877 1.00 56.31 ? 249 GLU A OE2 1 ATOM 1505 N N . LYS A 1 191 ? 14.051 56.195 58.044 1.00 48.39 ? 250 LYS A N 1 ATOM 1506 C CA . LYS A 1 191 ? 13.309 57.267 57.384 1.00 48.31 ? 250 LYS A CA 1 ATOM 1507 C C . LYS A 1 191 ? 14.116 57.948 56.279 1.00 42.10 ? 250 LYS A C 1 ATOM 1508 O O . LYS A 1 191 ? 13.642 58.901 55.658 1.00 42.99 ? 250 LYS A O 1 ATOM 1509 C CB . LYS A 1 191 ? 12.860 58.313 58.408 1.00 39.64 ? 250 LYS A CB 1 ATOM 1510 C CG . LYS A 1 191 ? 11.935 57.781 59.489 1.00 39.39 ? 250 LYS A CG 1 ATOM 1511 C CD . LYS A 1 191 ? 10.657 57.215 58.889 1.00 51.94 ? 250 LYS A CD 1 ATOM 1512 C CE . LYS A 1 191 ? 9.750 56.637 59.962 1.00 44.32 ? 250 LYS A CE 1 ATOM 1513 N NZ . LYS A 1 191 ? 8.474 56.123 59.389 1.00 50.10 ? 250 LYS A NZ 1 ATOM 1514 N N . ALA A 1 192 ? 15.327 57.457 56.033 1.00 32.79 ? 251 ALA A N 1 ATOM 1515 C CA . ALA A 1 192 ? 16.246 58.120 55.111 1.00 51.76 ? 251 ALA A CA 1 ATOM 1516 C C . ALA A 1 192 ? 16.021 57.711 53.663 1.00 33.25 ? 251 ALA A C 1 ATOM 1517 O O . ALA A 1 192 ? 15.612 56.585 53.377 1.00 45.37 ? 251 ALA A O 1 ATOM 1518 C CB . ALA A 1 192 ? 17.689 57.837 55.507 1.00 44.34 ? 251 ALA A CB 1 ATOM 1519 N N . GLU A 1 193 ? 16.283 58.645 52.754 1.00 42.25 ? 252 GLU A N 1 ATOM 1520 C CA . GLU A 1 193 ? 16.265 58.356 51.329 1.00 32.03 ? 252 GLU A CA 1 ATOM 1521 C C . GLU A 1 193 ? 17.341 57.338 50.971 1.00 58.27 ? 252 GLU A C 1 ATOM 1522 O O . GLU A 1 193 ? 18.296 57.135 51.722 1.00 53.51 ? 252 GLU A O 1 ATOM 1523 C CB . GLU A 1 193 ? 16.458 59.636 50.513 1.00 44.70 ? 252 GLU A CB 1 ATOM 1524 C CG . GLU A 1 193 ? 17.804 60.309 50.722 1.00 52.47 ? 252 GLU A CG 1 ATOM 1525 C CD . GLU A 1 193 ? 18.021 61.484 49.789 1.00 59.17 ? 252 GLU A CD 1 ATOM 1526 O OE1 . GLU A 1 193 ? 17.594 61.404 48.617 1.00 61.70 ? 252 GLU A OE1 1 ATOM 1527 O OE2 . GLU A 1 193 ? 18.615 62.491 50.229 1.00 52.64 ? 252 GLU A OE2 1 ATOM 1528 N N . LYS A 1 194 ? 17.166 56.700 49.819 1.00 64.43 ? 253 LYS A N 1 ATOM 1529 C CA . LYS A 1 194 ? 18.024 55.604 49.382 1.00 58.32 ? 253 LYS A CA 1 ATOM 1530 C C . LYS A 1 194 ? 19.496 56.011 49.310 1.00 57.38 ? 253 LYS A C 1 ATOM 1531 O O . LYS A 1 194 ? 20.374 55.266 49.747 1.00 58.35 ? 253 LYS A O 1 ATOM 1532 C CB . LYS A 1 194 ? 17.515 55.059 48.044 1.00 67.85 ? 253 LYS A CB 1 ATOM 1533 C CG . LYS A 1 194 ? 18.353 53.960 47.425 1.00 83.71 ? 253 LYS A CG 1 ATOM 1534 C CD . LYS A 1 194 ? 17.909 53.685 45.992 1.00 91.10 ? 253 LYS A CD 1 ATOM 1535 C CE . LYS A 1 194 ? 18.202 54.829 45.047 1.00 93.12 ? 253 LYS A CE 1 ATOM 1536 N NZ . LYS A 1 194 ? 19.647 55.135 45.003 1.00 95.82 ? 253 LYS A NZ 1 ATOM 1537 N N . LYS A 1 195 ? 19.761 57.190 48.760 1.00 58.98 ? 254 LYS A N 1 ATOM 1538 C CA . LYS A 1 195 ? 21.128 57.671 48.597 1.00 51.73 ? 254 LYS A CA 1 ATOM 1539 C C . LYS A 1 195 ? 21.809 57.976 49.936 1.00 55.14 ? 254 LYS A C 1 ATOM 1540 O O . LYS A 1 195 ? 23.023 57.818 50.077 1.00 57.52 ? 254 LYS A O 1 ATOM 1541 C CB . LYS A 1 195 ? 21.126 58.921 47.710 1.00 50.58 ? 254 LYS A CB 1 ATOM 1542 C CG . LYS A 1 195 ? 22.436 59.686 47.674 1.00 68.67 ? 254 LYS A CG 1 ATOM 1543 C CD . LYS A 1 195 ? 22.305 60.963 46.860 1.00 67.23 ? 254 LYS A CD 1 ATOM 1544 C CE . LYS A 1 195 ? 21.181 61.843 47.386 1.00 74.05 ? 254 LYS A CE 1 ATOM 1545 N NZ . LYS A 1 195 ? 20.991 63.060 46.550 1.00 82.72 ? 254 LYS A NZ 1 ATOM 1546 N N . LEU A 1 196 ? 21.022 58.385 50.926 1.00 57.41 ? 255 LEU A N 1 ATOM 1547 C CA . LEU A 1 196 ? 21.548 58.632 52.265 1.00 46.89 ? 255 LEU A CA 1 ATOM 1548 C C . LEU A 1 196 ? 21.684 57.339 53.080 1.00 43.13 ? 255 LEU A C 1 ATOM 1549 O O . LEU A 1 196 ? 22.627 57.182 53.857 1.00 38.90 ? 255 LEU A O 1 ATOM 1550 C CB . LEU A 1 196 ? 20.659 59.639 53.010 1.00 42.93 ? 255 LEU A CB 1 ATOM 1551 C CG . LEU A 1 196 ? 20.981 59.884 54.488 1.00 36.70 ? 255 LEU A CG 1 ATOM 1552 C CD1 . LEU A 1 196 ? 22.413 60.382 54.671 1.00 30.54 ? 255 LEU A CD1 1 ATOM 1553 C CD2 . LEU A 1 196 ? 19.987 60.858 55.100 1.00 38.65 ? 255 LEU A CD2 1 ATOM 1554 N N . LYS A 1 197 ? 20.734 56.425 52.899 1.00 36.73 ? 256 LYS A N 1 ATOM 1555 C CA . LYS A 1 197 ? 20.678 55.180 53.669 1.00 34.71 ? 256 LYS A CA 1 ATOM 1556 C C . LYS A 1 197 ? 21.919 54.324 53.519 1.00 46.58 ? 256 LYS A C 1 ATOM 1557 O O . LYS A 1 197 ? 22.363 53.673 54.466 1.00 45.55 ? 256 LYS A O 1 ATOM 1558 C CB . LYS A 1 197 ? 19.459 54.352 53.260 1.00 46.75 ? 256 LYS A CB 1 ATOM 1559 C CG . LYS A 1 197 ? 19.035 53.329 54.296 1.00 54.98 ? 256 LYS A CG 1 ATOM 1560 C CD . LYS A 1 197 ? 17.715 52.686 53.913 1.00 49.03 ? 256 LYS A CD 1 ATOM 1561 C CE . LYS A 1 197 ? 16.975 52.189 55.147 1.00 58.39 ? 256 LYS A CE 1 ATOM 1562 N NZ . LYS A 1 197 ? 15.786 51.343 54.830 1.00 76.16 ? 256 LYS A NZ 1 ATOM 1563 N N . LYS A 1 198 ? 22.466 54.321 52.312 1.00 47.55 ? 257 LYS A N 1 ATOM 1564 C CA . LYS A 1 198 ? 23.586 53.456 51.992 1.00 31.25 ? 257 LYS A CA 1 ATOM 1565 C C . LYS A 1 198 ? 24.889 53.912 52.629 1.00 47.48 ? 257 LYS A C 1 ATOM 1566 O O . LYS A 1 198 ? 25.858 53.157 52.666 1.00 42.19 ? 257 LYS A O 1 ATOM 1567 C CB . LYS A 1 198 ? 23.764 53.368 50.477 1.00 40.31 ? 257 LYS A CB 1 ATOM 1568 C CG . LYS A 1 198 ? 24.050 54.701 49.813 1.00 60.84 ? 257 LYS A CG 1 ATOM 1569 C CD . LYS A 1 198 ? 24.270 54.541 48.318 1.00 83.36 ? 257 LYS A CD 1 ATOM 1570 C CE . LYS A 1 198 ? 25.088 55.697 47.771 1.00 89.29 ? 257 LYS A CE 1 ATOM 1571 N NZ . LYS A 1 198 ? 24.470 57.008 48.110 1.00 88.03 ? 257 LYS A NZ 1 ATOM 1572 N N . THR A 1 199 ? 24.911 55.141 53.134 1.00 48.61 ? 258 THR A N 1 ATOM 1573 C CA . THR A 1 199 ? 26.121 55.695 53.728 1.00 39.30 ? 258 THR A CA 1 ATOM 1574 C C . THR A 1 199 ? 26.209 55.408 55.223 1.00 41.48 ? 258 THR A C 1 ATOM 1575 O O . THR A 1 199 ? 27.073 55.943 55.914 1.00 40.66 ? 258 THR A O 1 ATOM 1576 C CB . THR A 1 199 ? 26.209 57.215 53.508 1.00 38.18 ? 258 THR A CB 1 ATOM 1577 O OG1 . THR A 1 199 ? 25.189 57.869 54.273 1.00 43.12 ? 258 THR A OG1 1 ATOM 1578 C CG2 . THR A 1 199 ? 26.025 57.550 52.035 1.00 30.30 ? 258 THR A CG2 1 ATOM 1579 N N . PHE A 1 200 ? 25.312 54.562 55.718 1.00 40.69 ? 259 PHE A N 1 ATOM 1580 C CA . PHE A 1 200 ? 25.320 54.182 57.125 1.00 36.80 ? 259 PHE A CA 1 ATOM 1581 C C . PHE A 1 200 ? 26.197 52.956 57.354 1.00 42.76 ? 259 PHE A C 1 ATOM 1582 O O . PHE A 1 200 ? 26.328 52.106 56.474 1.00 46.89 ? 259 PHE A O 1 ATOM 1583 C CB . PHE A 1 200 ? 23.896 53.911 57.614 1.00 34.15 ? 259 PHE A CB 1 ATOM 1584 C CG . PHE A 1 200 ? 23.130 55.152 57.973 1.00 31.01 ? 259 PHE A CG 1 ATOM 1585 C CD1 . PHE A 1 200 ? 22.591 55.961 56.985 1.00 37.59 ? 259 PHE A CD1 1 ATOM 1586 C CD2 . PHE A 1 200 ? 22.939 55.504 59.298 1.00 30.98 ? 259 PHE A CD2 1 ATOM 1587 C CE1 . PHE A 1 200 ? 21.882 57.102 57.314 1.00 45.44 ? 259 PHE A CE1 1 ATOM 1588 C CE2 . PHE A 1 200 ? 22.229 56.642 59.634 1.00 43.37 ? 259 PHE A CE2 1 ATOM 1589 C CZ . PHE A 1 200 ? 21.700 57.442 58.640 1.00 30.97 ? 259 PHE A CZ 1 ATOM 1590 N N . PHE A 1 201 ? 26.789 52.870 58.542 1.00 40.16 ? 260 PHE A N 1 ATOM 1591 C CA . PHE A 1 201 ? 27.655 51.748 58.893 1.00 36.22 ? 260 PHE A CA 1 ATOM 1592 C C . PHE A 1 201 ? 27.917 51.699 60.395 1.00 38.75 ? 260 PHE A C 1 ATOM 1593 O O . PHE A 1 201 ? 27.540 52.609 61.132 1.00 43.61 ? 260 PHE A O 1 ATOM 1594 C CB . PHE A 1 201 ? 28.985 51.833 58.135 1.00 30.31 ? 260 PHE A CB 1 ATOM 1595 C CG . PHE A 1 201 ? 29.847 52.997 58.545 1.00 41.34 ? 260 PHE A CG 1 ATOM 1596 C CD1 . PHE A 1 201 ? 29.640 54.255 58.005 1.00 29.92 ? 260 PHE A CD1 1 ATOM 1597 C CD2 . PHE A 1 201 ? 30.872 52.829 59.464 1.00 38.67 ? 260 PHE A CD2 1 ATOM 1598 C CE1 . PHE A 1 201 ? 30.430 55.325 58.380 1.00 31.04 ? 260 PHE A CE1 1 ATOM 1599 C CE2 . PHE A 1 201 ? 31.666 53.897 59.841 1.00 34.14 ? 260 PHE A CE2 1 ATOM 1600 C CZ . PHE A 1 201 ? 31.445 55.146 59.298 1.00 30.87 ? 260 PHE A CZ 1 ATOM 1601 N N . PHE A 1 202 ? 28.571 50.630 60.839 1.00 34.27 ? 261 PHE A N 1 ATOM 1602 C CA . PHE A 1 202 ? 28.959 50.492 62.236 1.00 35.54 ? 261 PHE A CA 1 ATOM 1603 C C . PHE A 1 202 ? 30.463 50.653 62.420 1.00 33.54 ? 261 PHE A C 1 ATOM 1604 O O . PHE A 1 202 ? 31.259 50.051 61.701 1.00 40.95 ? 261 PHE A O 1 ATOM 1605 C CB . PHE A 1 202 ? 28.505 49.141 62.793 1.00 32.41 ? 261 PHE A CB 1 ATOM 1606 C CG . PHE A 1 202 ? 27.028 49.053 63.038 1.00 30.94 ? 261 PHE A CG 1 ATOM 1607 C CD1 . PHE A 1 202 ? 26.157 48.724 62.012 1.00 44.06 ? 261 PHE A CD1 1 ATOM 1608 C CD2 . PHE A 1 202 ? 26.509 49.296 64.300 1.00 44.78 ? 261 PHE A CD2 1 ATOM 1609 C CE1 . PHE A 1 202 ? 24.796 48.641 62.241 1.00 34.85 ? 261 PHE A CE1 1 ATOM 1610 C CE2 . PHE A 1 202 ? 25.149 49.214 64.535 1.00 31.27 ? 261 PHE A CE2 1 ATOM 1611 C CZ . PHE A 1 202 ? 24.292 48.887 63.504 1.00 31.50 ? 261 PHE A CZ 1 ATOM 1612 N N . SER A 1 203 ? 30.837 51.476 63.394 1.00 33.42 ? 262 SER A N 1 ATOM 1613 C CA . SER A 1 203 ? 32.235 51.707 63.730 1.00 36.37 ? 262 SER A CA 1 ATOM 1614 C C . SER A 1 203 ? 32.833 50.458 64.379 1.00 36.50 ? 262 SER A C 1 ATOM 1615 O O . SER A 1 203 ? 32.092 49.559 64.776 1.00 34.03 ? 262 SER A O 1 ATOM 1616 C CB . SER A 1 203 ? 32.353 52.920 64.659 1.00 34.80 ? 262 SER A CB 1 ATOM 1617 O OG . SER A 1 203 ? 32.106 52.561 66.007 1.00 43.97 ? 262 SER A OG 1 ATOM 1618 N N . PRO A 1 204 ? 34.175 50.386 64.479 1.00 48.83 ? 263 PRO A N 1 ATOM 1619 C CA . PRO A 1 204 ? 34.792 49.246 65.172 1.00 43.95 ? 263 PRO A CA 1 ATOM 1620 C C . PRO A 1 204 ? 34.312 49.092 66.615 1.00 36.17 ? 263 PRO A C 1 ATOM 1621 O O . PRO A 1 204 ? 34.407 48.005 67.183 1.00 50.21 ? 263 PRO A O 1 ATOM 1622 C CB . PRO A 1 204 ? 36.287 49.579 65.131 1.00 29.12 ? 263 PRO A CB 1 ATOM 1623 C CG . PRO A 1 204 ? 36.444 50.440 63.935 1.00 42.75 ? 263 PRO A CG 1 ATOM 1624 C CD . PRO A 1 204 ? 35.183 51.247 63.832 1.00 37.74 ? 263 PRO A CD 1 ATOM 1625 N N . ALA A 1 205 ? 33.805 50.174 67.195 1.00 33.81 ? 264 ALA A N 1 ATOM 1626 C CA . ALA A 1 205 ? 33.248 50.136 68.541 1.00 32.70 ? 264 ALA A CA 1 ATOM 1627 C C . ALA A 1 205 ? 31.758 49.791 68.512 1.00 41.39 ? 264 ALA A C 1 ATOM 1628 O O . ALA A 1 205 ? 31.080 49.889 69.535 1.00 42.91 ? 264 ALA A O 1 ATOM 1629 C CB . ALA A 1 205 ? 33.471 51.470 69.245 1.00 33.84 ? 264 ALA A CB 1 ATOM 1630 N N . LYS A 1 206 ? 31.255 49.422 67.332 1.00 38.03 ? 265 LYS A N 1 ATOM 1631 C CA . LYS A 1 206 ? 29.841 49.069 67.140 1.00 47.81 ? 265 LYS A CA 1 ATOM 1632 C C . LYS A 1 206 ? 28.901 50.251 67.341 1.00 57.03 ? 265 LYS A C 1 ATOM 1633 O O . LYS A 1 206 ? 27.722 50.065 67.640 1.00 56.28 ? 265 LYS A O 1 ATOM 1634 C CB . LYS A 1 206 ? 29.393 47.901 68.037 1.00 39.20 ? 265 LYS A CB 1 ATOM 1635 C CG . LYS A 1 206 ? 29.662 46.499 67.488 1.00 42.71 ? 265 LYS A CG 1 ATOM 1636 C CD . LYS A 1 206 ? 30.794 45.759 68.166 1.00 56.04 ? 265 LYS A CD 1 ATOM 1637 C CE . LYS A 1 206 ? 31.389 44.726 67.215 1.00 73.49 ? 265 LYS A CE 1 ATOM 1638 N NZ . LYS A 1 206 ? 31.917 45.341 65.966 1.00 73.54 ? 265 LYS A NZ 1 ATOM 1639 N N . ASN A 1 207 ? 29.421 51.464 67.186 1.00 42.02 ? 266 ASN A N 1 ATOM 1640 C CA . ASN A 1 207 ? 28.572 52.647 67.198 1.00 31.52 ? 266 ASN A CA 1 ATOM 1641 C C . ASN A 1 207 ? 27.969 52.873 65.816 1.00 33.97 ? 266 ASN A C 1 ATOM 1642 O O . ASN A 1 207 ? 28.604 52.584 64.802 1.00 30.20 ? 266 ASN A O 1 ATOM 1643 C CB . ASN A 1 207 ? 29.360 53.880 67.642 1.00 29.88 ? 266 ASN A CB 1 ATOM 1644 C CG . ASN A 1 207 ? 29.833 53.785 69.078 1.00 33.74 ? 266 ASN A CG 1 ATOM 1645 O OD1 . ASN A 1 207 ? 29.102 53.328 69.955 1.00 40.42 ? 266 ASN A OD1 1 ATOM 1646 N ND2 . ASN A 1 207 ? 31.061 54.224 69.326 1.00 38.55 ? 266 ASN A ND2 1 ATOM 1647 N N . PHE A 1 208 ? 26.746 53.393 65.778 1.00 36.70 ? 267 PHE A N 1 ATOM 1648 C CA . PHE A 1 208 ? 26.059 53.630 64.513 1.00 30.55 ? 267 PHE A CA 1 ATOM 1649 C C . PHE A 1 208 ? 26.528 54.939 63.890 1.00 34.04 ? 267 PHE A C 1 ATOM 1650 O O . PHE A 1 208 ? 26.595 55.967 64.562 1.00 38.60 ? 267 PHE A O 1 ATOM 1651 C CB . PHE A 1 208 ? 24.543 53.648 64.725 1.00 36.19 ? 267 PHE A CB 1 ATOM 1652 C CG . PHE A 1 208 ? 23.750 53.319 63.492 1.00 42.17 ? 267 PHE A CG 1 ATOM 1653 C CD1 . PHE A 1 208 ? 24.282 52.505 62.506 1.00 31.05 ? 267 PHE A CD1 1 ATOM 1654 C CD2 . PHE A 1 208 ? 22.466 53.812 63.328 1.00 42.28 ? 267 PHE A CD2 1 ATOM 1655 C CE1 . PHE A 1 208 ? 23.551 52.196 61.374 1.00 40.17 ? 267 PHE A CE1 1 ATOM 1656 C CE2 . PHE A 1 208 ? 21.729 53.506 62.199 1.00 37.28 ? 267 PHE A CE2 1 ATOM 1657 C CZ . PHE A 1 208 ? 22.272 52.696 61.220 1.00 39.56 ? 267 PHE A CZ 1 ATOM 1658 N N . CYS A 1 209 ? 26.853 54.896 62.602 1.00 30.28 ? 268 CYS A N 1 ATOM 1659 C CA . CYS A 1 209 ? 27.464 56.039 61.932 1.00 45.32 ? 268 CYS A CA 1 ATOM 1660 C C . CYS A 1 209 ? 26.899 56.239 60.529 1.00 39.25 ? 268 CYS A C 1 ATOM 1661 O O . CYS A 1 209 ? 26.464 55.283 59.890 1.00 39.35 ? 268 CYS A O 1 ATOM 1662 C CB . CYS A 1 209 ? 28.982 55.860 61.852 1.00 29.79 ? 268 CYS A CB 1 ATOM 1663 S SG . CYS A 1 209 ? 29.817 55.674 63.446 1.00 33.00 ? 268 CYS A SG 1 ATOM 1664 N N . PHE A 1 210 ? 26.907 57.481 60.054 1.00 41.00 ? 269 PHE A N 1 ATOM 1665 C CA . PHE A 1 210 ? 26.565 57.760 58.663 1.00 36.84 ? 269 PHE A CA 1 ATOM 1666 C C . PHE A 1 210 ? 27.558 58.741 58.048 1.00 32.90 ? 269 PHE A C 1 ATOM 1667 O O . PHE A 1 210 ? 28.069 59.633 58.727 1.00 35.66 ? 269 PHE A O 1 ATOM 1668 C CB . PHE A 1 210 ? 25.129 58.294 58.540 1.00 38.87 ? 269 PHE A CB 1 ATOM 1669 C CG . PHE A 1 210 ? 24.889 59.606 59.242 1.00 31.65 ? 269 PHE A CG 1 ATOM 1670 C CD1 . PHE A 1 210 ? 24.334 59.635 60.510 1.00 30.18 ? 269 PHE A CD1 1 ATOM 1671 C CD2 . PHE A 1 210 ? 25.203 60.811 58.628 1.00 29.92 ? 269 PHE A CD2 1 ATOM 1672 C CE1 . PHE A 1 210 ? 24.106 60.837 61.158 1.00 34.11 ? 269 PHE A CE1 1 ATOM 1673 C CE2 . PHE A 1 210 ? 24.979 62.015 59.271 1.00 34.46 ? 269 PHE A CE2 1 ATOM 1674 C CZ . PHE A 1 210 ? 24.429 62.028 60.537 1.00 31.42 ? 269 PHE A CZ 1 ATOM 1675 N N . VAL A 1 211 ? 27.831 58.562 56.760 1.00 44.87 ? 270 VAL A N 1 ATOM 1676 C CA . VAL A 1 211 ? 28.765 59.419 56.042 1.00 29.53 ? 270 VAL A CA 1 ATOM 1677 C C . VAL A 1 211 ? 28.035 60.557 55.332 1.00 35.40 ? 270 VAL A C 1 ATOM 1678 O O . VAL A 1 211 ? 28.523 61.690 55.293 1.00 49.05 ? 270 VAL A O 1 ATOM 1679 C CB . VAL A 1 211 ? 29.580 58.609 55.010 1.00 52.21 ? 270 VAL A CB 1 ATOM 1680 C CG1 . VAL A 1 211 ? 30.433 59.526 54.147 1.00 29.28 ? 270 VAL A CG1 1 ATOM 1681 C CG2 . VAL A 1 211 ? 30.447 57.579 55.712 1.00 29.45 ? 270 VAL A CG2 1 ATOM 1682 N N . SER A 1 212 ? 26.862 60.243 54.785 1.00 35.02 ? 271 SER A N 1 ATOM 1683 C CA . SER A 1 212 ? 26.088 61.175 53.964 1.00 39.27 ? 271 SER A CA 1 ATOM 1684 C C . SER A 1 212 ? 26.885 61.634 52.746 1.00 41.72 ? 271 SER A C 1 ATOM 1685 O O . SER A 1 212 ? 27.896 61.029 52.388 1.00 51.10 ? 271 SER A O 1 ATOM 1686 C CB . SER A 1 212 ? 25.639 62.388 54.787 1.00 33.36 ? 271 SER A CB 1 ATOM 1687 O OG . SER A 1 212 ? 24.784 63.231 54.035 1.00 40.85 ? 271 SER A OG 1 ATOM 1688 N N . ARG A 1 213 ? 26.415 62.698 52.104 1.00 37.94 ? 272 ARG A N 1 ATOM 1689 C CA . ARG A 1 213 ? 27.129 63.293 50.979 1.00 41.78 ? 272 ARG A CA 1 ATOM 1690 C C . ARG A 1 213 ? 27.123 64.813 51.075 1.00 37.01 ? 272 ARG A C 1 ATOM 1691 O O . ARG A 1 213 ? 26.065 65.433 51.190 1.00 64.28 ? 272 ARG A O 1 ATOM 1692 C CB . ARG A 1 213 ? 26.524 62.857 49.641 1.00 37.14 ? 272 ARG A CB 1 ATOM 1693 C CG . ARG A 1 213 ? 26.671 61.380 49.312 1.00 62.01 ? 272 ARG A CG 1 ATOM 1694 C CD . ARG A 1 213 ? 25.880 61.031 48.060 1.00 86.72 ? 272 ARG A CD 1 ATOM 1695 N NE . ARG A 1 213 ? 26.226 59.716 47.529 1.00 94.09 ? 272 ARG A NE 1 ATOM 1696 C CZ . ARG A 1 213 ? 26.006 59.338 46.273 1.00 92.67 ? 272 ARG A CZ 1 ATOM 1697 N NH1 . ARG A 1 213 ? 25.447 60.179 45.414 1.00 98.16 ? 272 ARG A NH1 1 ATOM 1698 N NH2 . ARG A 1 213 ? 26.351 58.122 45.872 1.00 89.08 ? 272 ARG A NH2 1 ATOM 1699 N N . CYS A 1 214 ? 28.312 65.405 51.019 1.00 39.25 ? 273 CYS A N 1 ATOM 1700 C CA . CYS A 1 214 ? 28.464 66.854 51.054 1.00 39.59 ? 273 CYS A CA 1 ATOM 1701 C C . CYS A 1 214 ? 29.875 67.232 50.623 1.00 45.22 ? 273 CYS A C 1 ATOM 1702 O O . CYS A 1 214 ? 30.720 66.364 50.403 1.00 49.73 ? 273 CYS A O 1 ATOM 1703 C CB . CYS A 1 214 ? 28.174 67.416 52.448 1.00 35.83 ? 273 CYS A CB 1 ATOM 1704 S SG . CYS A 1 214 ? 29.461 67.097 53.676 1.00 40.03 ? 273 CYS A SG 1 ATOM 1705 N N . ASP A 1 215 ? 30.127 68.530 50.506 1.00 52.47 ? 274 ASP A N 1 ATOM 1706 C CA . ASP A 1 215 ? 31.414 69.014 50.027 1.00 56.35 ? 274 ASP A CA 1 ATOM 1707 C C . ASP A 1 215 ? 32.486 68.992 51.105 1.00 42.57 ? 274 ASP A C 1 ATOM 1708 O O . ASP A 1 215 ? 33.661 68.759 50.819 1.00 42.94 ? 274 ASP A O 1 ATOM 1709 C CB . ASP A 1 215 ? 31.269 70.436 49.491 1.00 69.48 ? 274 ASP A CB 1 ATOM 1710 C CG . ASP A 1 215 ? 30.391 70.503 48.270 1.00 78.46 ? 274 ASP A CG 1 ATOM 1711 O OD1 . ASP A 1 215 ? 30.295 69.481 47.559 1.00 59.04 ? 274 ASP A OD1 1 ATOM 1712 O OD2 . ASP A 1 215 ? 29.794 71.571 48.017 1.00 86.84 ? 274 ASP A OD2 1 ATOM 1713 N N . TYR A 1 216 ? 32.077 69.231 52.344 1.00 49.12 ? 275 TYR A N 1 ATOM 1714 C CA . TYR A 1 216 ? 33.037 69.427 53.417 1.00 37.34 ? 275 TYR A CA 1 ATOM 1715 C C . TYR A 1 216 ? 33.148 68.222 54.342 1.00 35.41 ? 275 TYR A C 1 ATOM 1716 O O . TYR A 1 216 ? 32.464 68.143 55.363 1.00 47.76 ? 275 TYR A O 1 ATOM 1717 C CB . TYR A 1 216 ? 32.679 70.675 54.224 1.00 50.65 ? 275 TYR A CB 1 ATOM 1718 C CG . TYR A 1 216 ? 33.804 71.150 55.110 1.00 73.87 ? 275 TYR A CG 1 ATOM 1719 C CD1 . TYR A 1 216 ? 34.836 71.921 54.593 1.00 79.65 ? 275 TYR A CD1 1 ATOM 1720 C CD2 . TYR A 1 216 ? 33.835 70.831 56.461 1.00 85.77 ? 275 TYR A CD2 1 ATOM 1721 C CE1 . TYR A 1 216 ? 35.870 72.356 55.394 1.00 81.84 ? 275 TYR A CE1 1 ATOM 1722 C CE2 . TYR A 1 216 ? 34.863 71.268 57.272 1.00 69.48 ? 275 TYR A CE2 1 ATOM 1723 C CZ . TYR A 1 216 ? 35.878 72.028 56.731 1.00 76.65 ? 275 TYR A CZ 1 ATOM 1724 O OH . TYR A 1 216 ? 36.906 72.459 57.532 1.00 82.17 ? 275 TYR A OH 1 ATOM 1725 N N . TYR A 1 217 ? 34.009 67.285 53.960 1.00 40.74 ? 276 TYR A N 1 ATOM 1726 C CA . TYR A 1 217 ? 34.406 66.172 54.816 1.00 32.29 ? 276 TYR A CA 1 ATOM 1727 C C . TYR A 1 217 ? 33.265 65.242 55.216 1.00 44.87 ? 276 TYR A C 1 ATOM 1728 O O . TYR A 1 217 ? 33.237 64.733 56.337 1.00 36.00 ? 276 TYR A O 1 ATOM 1729 C CB . TYR A 1 217 ? 35.103 66.704 56.066 1.00 38.27 ? 276 TYR A CB 1 ATOM 1730 C CG . TYR A 1 217 ? 36.416 67.381 55.757 1.00 49.14 ? 276 TYR A CG 1 ATOM 1731 C CD1 . TYR A 1 217 ? 37.486 66.658 55.250 1.00 33.96 ? 276 TYR A CD1 1 ATOM 1732 C CD2 . TYR A 1 217 ? 36.579 68.744 55.951 1.00 28.26 ? 276 TYR A CD2 1 ATOM 1733 C CE1 . TYR A 1 217 ? 38.686 67.272 54.957 1.00 50.94 ? 276 TYR A CE1 1 ATOM 1734 C CE2 . TYR A 1 217 ? 37.773 69.368 55.662 1.00 48.39 ? 276 TYR A CE2 1 ATOM 1735 C CZ . TYR A 1 217 ? 38.824 68.628 55.165 1.00 44.13 ? 276 TYR A CZ 1 ATOM 1736 O OH . TYR A 1 217 ? 40.017 69.246 54.874 1.00 45.59 ? 276 TYR A OH 1 ATOM 1737 N N . CYS A 1 218 ? 32.319 65.030 54.308 1.00 28.41 ? 277 CYS A N 1 ATOM 1738 C CA . CYS A 1 218 ? 31.413 63.896 54.434 1.00 28.66 ? 277 CYS A CA 1 ATOM 1739 C C . CYS A 1 218 ? 32.139 62.635 53.980 1.00 48.57 ? 277 CYS A C 1 ATOM 1740 O O . CYS A 1 218 ? 31.922 62.144 52.872 1.00 47.82 ? 277 CYS A O 1 ATOM 1741 C CB . CYS A 1 218 ? 30.134 64.102 53.621 1.00 31.69 ? 277 CYS A CB 1 ATOM 1742 S SG . CYS A 1 218 ? 28.954 65.253 54.353 1.00 42.10 ? 277 CYS A SG 1 ATOM 1743 N N . ASP A 1 219 ? 33.011 62.124 54.843 1.00 28.58 ? 278 ASP A N 1 ATOM 1744 C CA . ASP A 1 219 ? 33.759 60.908 54.553 1.00 28.60 ? 278 ASP A CA 1 ATOM 1745 C C . ASP A 1 219 ? 33.788 59.981 55.763 1.00 28.66 ? 278 ASP A C 1 ATOM 1746 O O . ASP A 1 219 ? 33.287 60.330 56.833 1.00 51.56 ? 278 ASP A O 1 ATOM 1747 C CB . ASP A 1 219 ? 35.183 61.249 54.101 1.00 28.35 ? 278 ASP A CB 1 ATOM 1748 C CG . ASP A 1 219 ? 35.887 62.209 55.047 1.00 46.49 ? 278 ASP A CG 1 ATOM 1749 O OD1 . ASP A 1 219 ? 36.625 63.087 54.552 1.00 41.63 ? 278 ASP A OD1 1 ATOM 1750 O OD2 . ASP A 1 219 ? 35.720 62.085 56.278 1.00 38.59 ? 278 ASP A OD2 1 ATOM 1751 N N . THR A 1 220 ? 34.370 58.800 55.582 1.00 30.50 ? 279 THR A N 1 ATOM 1752 C CA . THR A 1 220 ? 34.425 57.790 56.633 1.00 34.88 ? 279 THR A CA 1 ATOM 1753 C C . THR A 1 220 ? 35.122 58.305 57.890 1.00 47.25 ? 279 THR A C 1 ATOM 1754 O O . THR A 1 220 ? 34.641 58.102 59.005 1.00 48.86 ? 279 THR A O 1 ATOM 1755 C CB . THR A 1 220 ? 35.149 56.520 56.149 1.00 40.15 ? 279 THR A CB 1 ATOM 1756 O OG1 . THR A 1 220 ? 34.523 56.034 54.955 1.00 47.01 ? 279 THR A OG1 1 ATOM 1757 C CG2 . THR A 1 220 ? 35.108 55.438 57.220 1.00 28.86 ? 279 THR A CG2 1 ATOM 1758 N N . THR A 1 221 ? 36.258 58.970 57.697 1.00 31.89 ? 280 THR A N 1 ATOM 1759 C CA . THR A 1 221 ? 37.056 59.487 58.805 1.00 41.22 ? 280 THR A CA 1 ATOM 1760 C C . THR A 1 221 ? 36.287 60.500 59.653 1.00 39.77 ? 280 THR A C 1 ATOM 1761 O O . THR A 1 221 ? 36.413 60.518 60.878 1.00 44.89 ? 280 THR A O 1 ATOM 1762 C CB . THR A 1 221 ? 38.357 60.140 58.291 1.00 49.92 ? 280 THR A CB 1 ATOM 1763 O OG1 . THR A 1 221 ? 39.101 59.185 57.525 1.00 29.87 ? 280 THR A OG1 1 ATOM 1764 C CG2 . THR A 1 221 ? 39.215 60.631 59.449 1.00 27.72 ? 280 THR A CG2 1 ATOM 1765 N N . HIS A 1 222 ? 35.481 61.333 59.002 1.00 38.82 ? 281 HIS A N 1 ATOM 1766 C CA . HIS A 1 222 ? 34.741 62.375 59.709 1.00 32.82 ? 281 HIS A CA 1 ATOM 1767 C C . HIS A 1 222 ? 33.249 62.072 59.781 1.00 32.66 ? 281 HIS A C 1 ATOM 1768 O O . HIS A 1 222 ? 32.425 62.984 59.857 1.00 36.81 ? 281 HIS A O 1 ATOM 1769 C CB . HIS A 1 222 ? 34.959 63.733 59.039 1.00 28.05 ? 281 HIS A CB 1 ATOM 1770 C CG . HIS A 1 222 ? 36.396 64.141 58.953 1.00 45.17 ? 281 HIS A CG 1 ATOM 1771 N ND1 . HIS A 1 222 ? 37.219 63.753 57.918 1.00 43.43 ? 281 HIS A ND1 1 ATOM 1772 C CD2 . HIS A 1 222 ? 37.158 64.902 59.773 1.00 28.99 ? 281 HIS A CD2 1 ATOM 1773 C CE1 . HIS A 1 222 ? 38.425 64.259 58.103 1.00 41.98 ? 281 HIS A CE1 1 ATOM 1774 N NE2 . HIS A 1 222 ? 38.415 64.961 59.222 1.00 56.03 ? 281 HIS A NE2 1 ATOM 1775 N N . ALA A 1 223 ? 32.906 60.788 59.751 1.00 35.65 ? 282 ALA A N 1 ATOM 1776 C CA . ALA A 1 223 ? 31.515 60.366 59.865 1.00 33.67 ? 282 ALA A CA 1 ATOM 1777 C C . ALA A 1 223 ? 30.922 60.749 61.218 1.00 33.68 ? 282 ALA A C 1 ATOM 1778 O O . ALA A 1 223 ? 31.632 60.812 62.222 1.00 38.53 ? 282 ALA A O 1 ATOM 1779 C CB . ALA A 1 223 ? 31.400 58.868 59.646 1.00 29.09 ? 282 ALA A CB 1 ATOM 1780 N N . ILE A 1 224 ? 29.617 61.000 61.236 1.00 35.00 ? 283 ILE A N 1 ATOM 1781 C CA . ILE A 1 224 ? 28.898 61.279 62.474 1.00 29.18 ? 283 ILE A CA 1 ATOM 1782 C C . ILE A 1 224 ? 28.454 59.973 63.122 1.00 32.89 ? 283 ILE A C 1 ATOM 1783 O O . ILE A 1 224 ? 27.815 59.141 62.479 1.00 36.68 ? 283 ILE A O 1 ATOM 1784 C CB . ILE A 1 224 ? 27.670 62.186 62.239 1.00 33.72 ? 283 ILE A CB 1 ATOM 1785 C CG1 . ILE A 1 224 ? 28.108 63.609 61.880 1.00 29.05 ? 283 ILE A CG1 1 ATOM 1786 C CG2 . ILE A 1 224 ? 26.818 62.254 63.486 1.00 29.38 ? 283 ILE A CG2 1 ATOM 1787 C CD1 . ILE A 1 224 ? 28.477 63.811 60.428 1.00 52.21 ? 283 ILE A CD1 1 ATOM 1788 N N . CYS A 1 225 ? 28.788 59.799 64.396 1.00 41.47 ? 284 CYS A N 1 ATOM 1789 C CA . CYS A 1 225 ? 28.575 58.525 65.070 1.00 31.10 ? 284 CYS A CA 1 ATOM 1790 C C . CYS A 1 225 ? 27.843 58.699 66.396 1.00 34.45 ? 284 CYS A C 1 ATOM 1791 O O . CYS A 1 225 ? 28.098 59.648 67.136 1.00 29.48 ? 284 CYS A O 1 ATOM 1792 C CB . CYS A 1 225 ? 29.914 57.823 65.308 1.00 29.36 ? 284 CYS A CB 1 ATOM 1793 S SG . CYS A 1 225 ? 30.822 57.401 63.804 1.00 38.19 ? 284 CYS A SG 1 ATOM 1794 N N . GLY A 1 226 ? 26.935 57.775 66.691 1.00 29.86 ? 285 GLY A N 1 ATOM 1795 C CA . GLY A 1 226 ? 26.207 57.794 67.946 1.00 29.96 ? 285 GLY A CA 1 ATOM 1796 C C . GLY A 1 226 ? 26.955 57.036 69.024 1.00 47.69 ? 285 GLY A C 1 ATOM 1797 O O . GLY A 1 226 ? 28.081 56.590 68.804 1.00 37.88 ? 285 GLY A O 1 ATOM 1798 N N . LEU A 1 227 ? 26.340 56.892 70.194 1.00 30.02 ? 286 LEU A N 1 ATOM 1799 C CA . LEU A 1 227 ? 26.952 56.125 71.275 1.00 34.21 ? 286 LEU A CA 1 ATOM 1800 C C . LEU A 1 227 ? 25.951 55.230 72.013 1.00 34.15 ? 286 LEU A C 1 ATOM 1801 O O . LEU A 1 227 ? 25.652 55.465 73.183 1.00 37.09 ? 286 LEU A O 1 ATOM 1802 C CB . LEU A 1 227 ? 27.632 57.068 72.270 1.00 36.06 ? 286 LEU A CB 1 ATOM 1803 C CG . LEU A 1 227 ? 28.801 56.468 73.055 1.00 53.33 ? 286 LEU A CG 1 ATOM 1804 C CD1 . LEU A 1 227 ? 29.820 55.851 72.110 1.00 39.61 ? 286 LEU A CD1 1 ATOM 1805 C CD2 . LEU A 1 227 ? 29.456 57.516 73.939 1.00 46.62 ? 286 LEU A CD2 1 ATOM 1806 N N . PRO A 1 228 ? 25.448 54.182 71.339 1.00 35.33 ? 287 PRO A N 1 ATOM 1807 C CA . PRO A 1 228 ? 25.809 53.797 69.972 1.00 36.74 ? 287 PRO A CA 1 ATOM 1808 C C . PRO A 1 228 ? 24.828 54.291 68.906 1.00 40.20 ? 287 PRO A C 1 ATOM 1809 O O . PRO A 1 228 ? 25.229 54.461 67.756 1.00 38.31 ? 287 PRO A O 1 ATOM 1810 C CB . PRO A 1 228 ? 25.795 52.272 70.042 1.00 34.47 ? 287 PRO A CB 1 ATOM 1811 C CG . PRO A 1 228 ? 24.686 51.985 71.002 1.00 30.94 ? 287 PRO A CG 1 ATOM 1812 C CD . PRO A 1 228 ? 24.715 53.103 72.027 1.00 36.69 ? 287 PRO A CD 1 ATOM 1813 N N . ASP A 1 229 ? 23.571 54.522 69.279 1.00 33.91 ? 288 ASP A N 1 ATOM 1814 C CA . ASP A 1 229 ? 22.519 54.736 68.287 1.00 45.28 ? 288 ASP A CA 1 ATOM 1815 C C . ASP A 1 229 ? 21.672 55.993 68.502 1.00 38.99 ? 288 ASP A C 1 ATOM 1816 O O . ASP A 1 229 ? 20.637 56.158 67.857 1.00 48.10 ? 288 ASP A O 1 ATOM 1817 C CB . ASP A 1 229 ? 21.601 53.513 68.247 1.00 34.76 ? 288 ASP A CB 1 ATOM 1818 C CG . ASP A 1 229 ? 20.947 53.233 69.585 1.00 41.63 ? 288 ASP A CG 1 ATOM 1819 O OD1 . ASP A 1 229 ? 21.494 53.679 70.616 1.00 43.45 ? 288 ASP A OD1 1 ATOM 1820 O OD2 . ASP A 1 229 ? 19.892 52.564 69.608 1.00 45.98 ? 288 ASP A OD2 1 HETATM 1821 N N . MSE A 1 230 ? 22.098 56.876 69.399 1.00 30.80 ? 289 MSE A N 1 HETATM 1822 C CA . MSE A 1 230 ? 21.406 58.150 69.569 1.00 37.73 ? 289 MSE A CA 1 HETATM 1823 C C . MSE A 1 230 ? 22.302 59.297 69.111 1.00 47.80 ? 289 MSE A C 1 HETATM 1824 O O . MSE A 1 230 ? 23.527 59.218 69.206 1.00 38.59 ? 289 MSE A O 1 HETATM 1825 C CB . MSE A 1 230 ? 20.966 58.354 71.024 1.00 30.78 ? 289 MSE A CB 1 HETATM 1826 C CG . MSE A 1 230 ? 22.038 58.910 71.949 1.00 53.57 ? 289 MSE A CG 1 HETATM 1827 SE SE . MSE A 1 230 ? 23.498 57.663 72.264 1.00 81.30 ? 289 MSE A SE 1 HETATM 1828 C CE . MSE A 1 230 ? 22.461 56.171 72.972 1.00 87.26 ? 289 MSE A CE 1 ATOM 1829 N N . LYS A 1 231 ? 21.686 60.358 68.602 1.00 43.01 ? 290 LYS A N 1 ATOM 1830 C CA . LYS A 1 231 ? 22.438 61.494 68.086 1.00 30.14 ? 290 LYS A CA 1 ATOM 1831 C C . LYS A 1 231 ? 21.668 62.801 68.226 1.00 37.33 ? 290 LYS A C 1 ATOM 1832 O O . LYS A 1 231 ? 20.636 63.000 67.585 1.00 30.25 ? 290 LYS A O 1 ATOM 1833 C CB . LYS A 1 231 ? 22.813 61.263 66.620 1.00 32.71 ? 290 LYS A CB 1 ATOM 1834 C CG . LYS A 1 231 ? 23.481 62.456 65.943 1.00 30.47 ? 290 LYS A CG 1 ATOM 1835 C CD . LYS A 1 231 ? 24.722 62.928 66.696 1.00 43.87 ? 290 LYS A CD 1 ATOM 1836 C CE . LYS A 1 231 ? 25.748 61.815 66.855 1.00 29.56 ? 290 LYS A CE 1 ATOM 1837 N NZ . LYS A 1 231 ? 27.050 62.332 67.362 1.00 36.00 ? 290 LYS A NZ 1 ATOM 1838 N N . GLU A 1 232 ? 22.182 63.690 69.070 1.00 42.89 ? 291 GLU A N 1 ATOM 1839 C CA . GLU A 1 232 ? 21.606 65.018 69.229 1.00 31.09 ? 291 GLU A CA 1 ATOM 1840 C C . GLU A 1 232 ? 21.869 65.842 67.974 1.00 29.65 ? 291 GLU A C 1 ATOM 1841 O O . GLU A 1 232 ? 22.843 65.607 67.261 1.00 53.72 ? 291 GLU A O 1 ATOM 1842 C CB . GLU A 1 232 ? 22.191 65.716 70.462 1.00 31.95 ? 291 GLU A CB 1 ATOM 1843 C CG . GLU A 1 232 ? 21.655 67.121 70.714 1.00 29.46 ? 291 GLU A CG 1 ATOM 1844 C CD . GLU A 1 232 ? 22.237 67.761 71.957 1.00 36.99 ? 291 GLU A CD 1 ATOM 1845 O OE1 . GLU A 1 232 ? 22.225 67.115 73.025 1.00 44.95 ? 291 GLU A OE1 1 ATOM 1846 O OE2 . GLU A 1 232 ? 22.711 68.913 71.863 1.00 39.35 ? 291 GLU A OE2 1 ATOM 1847 N N . GLY A 1 233 ? 20.988 66.797 67.697 1.00 39.76 ? 292 GLY A N 1 ATOM 1848 C CA . GLY A 1 233 ? 21.193 67.715 66.597 1.00 46.35 ? 292 GLY A CA 1 ATOM 1849 C C . GLY A 1 233 ? 20.351 68.965 66.736 1.00 33.51 ? 292 GLY A C 1 ATOM 1850 O O . GLY A 1 233 ? 19.480 69.046 67.602 1.00 35.19 ? 292 GLY A O 1 ATOM 1851 N N . SER A 1 234 ? 20.613 69.946 65.881 1.00 33.95 ? 293 SER A N 1 ATOM 1852 C CA . SER A 1 234 ? 19.803 71.154 65.843 1.00 29.28 ? 293 SER A CA 1 ATOM 1853 C C . SER A 1 234 ? 18.689 71.002 64.818 1.00 32.12 ? 293 SER A C 1 ATOM 1854 O O . SER A 1 234 ? 18.907 70.477 63.727 1.00 37.65 ? 293 SER A O 1 ATOM 1855 C CB . SER A 1 234 ? 20.661 72.376 65.512 1.00 28.99 ? 293 SER A CB 1 ATOM 1856 O OG . SER A 1 234 ? 21.083 72.346 64.161 1.00 36.42 ? 293 SER A OG 1 ATOM 1857 N N . VAL A 1 235 ? 17.494 71.458 65.174 1.00 29.60 ? 294 VAL A N 1 ATOM 1858 C CA . VAL A 1 235 ? 16.358 71.380 64.270 1.00 29.81 ? 294 VAL A CA 1 ATOM 1859 C C . VAL A 1 235 ? 15.808 72.778 64.041 1.00 32.09 ? 294 VAL A C 1 ATOM 1860 O O . VAL A 1 235 ? 15.288 73.413 64.958 1.00 29.66 ? 294 VAL A O 1 ATOM 1861 C CB . VAL A 1 235 ? 15.246 70.465 64.816 1.00 42.86 ? 294 VAL A CB 1 ATOM 1862 C CG1 . VAL A 1 235 ? 14.041 70.488 63.889 1.00 38.50 ? 294 VAL A CG1 1 ATOM 1863 C CG2 . VAL A 1 235 ? 15.765 69.044 64.992 1.00 30.24 ? 294 VAL A CG2 1 ATOM 1864 N N . GLN A 1 236 ? 15.935 73.254 62.808 1.00 34.10 ? 295 GLN A N 1 ATOM 1865 C CA . GLN A 1 236 ? 15.578 74.624 62.473 1.00 41.73 ? 295 GLN A CA 1 ATOM 1866 C C . GLN A 1 236 ? 14.454 74.644 61.450 1.00 46.71 ? 295 GLN A C 1 ATOM 1867 O O . GLN A 1 236 ? 14.553 74.006 60.403 1.00 34.48 ? 295 GLN A O 1 ATOM 1868 C CB . GLN A 1 236 ? 16.801 75.371 61.939 1.00 29.22 ? 295 GLN A CB 1 ATOM 1869 C CG . GLN A 1 236 ? 16.517 76.782 61.463 1.00 47.30 ? 295 GLN A CG 1 ATOM 1870 C CD . GLN A 1 236 ? 17.775 77.520 61.052 1.00 42.34 ? 295 GLN A CD 1 ATOM 1871 O OE1 . GLN A 1 236 ? 18.091 77.620 59.866 1.00 37.76 ? 295 GLN A OE1 1 ATOM 1872 N NE2 . GLN A 1 236 ? 18.505 78.037 62.034 1.00 50.43 ? 295 GLN A NE2 1 ATOM 1873 N N . VAL A 1 237 ? 13.392 75.384 61.756 1.00 42.39 ? 296 VAL A N 1 ATOM 1874 C CA . VAL A 1 237 ? 12.237 75.477 60.871 1.00 39.48 ? 296 VAL A CA 1 ATOM 1875 C C . VAL A 1 237 ? 12.625 76.008 59.491 1.00 32.44 ? 296 VAL A C 1 ATOM 1876 O O . VAL A 1 237 ? 13.406 76.951 59.365 1.00 46.23 ? 296 VAL A O 1 ATOM 1877 C CB . VAL A 1 237 ? 11.126 76.366 61.485 1.00 51.54 ? 296 VAL A CB 1 ATOM 1878 C CG1 . VAL A 1 237 ? 11.627 77.781 61.728 1.00 40.77 ? 296 VAL A CG1 1 ATOM 1879 C CG2 . VAL A 1 237 ? 9.885 76.371 60.604 1.00 42.07 ? 296 VAL A CG2 1 ATOM 1880 N N . PHE A 1 238 ? 12.091 75.368 58.458 1.00 35.28 ? 297 PHE A N 1 ATOM 1881 C CA . PHE A 1 238 ? 12.322 75.778 57.080 1.00 39.45 ? 297 PHE A CA 1 ATOM 1882 C C . PHE A 1 238 ? 11.808 77.190 56.823 1.00 39.90 ? 297 PHE A C 1 ATOM 1883 O O . PHE A 1 238 ? 10.789 77.597 57.380 1.00 47.84 ? 297 PHE A O 1 ATOM 1884 C CB . PHE A 1 238 ? 11.649 74.797 56.119 1.00 36.57 ? 297 PHE A CB 1 ATOM 1885 C CG . PHE A 1 238 ? 12.611 74.041 55.250 1.00 42.12 ? 297 PHE A CG 1 ATOM 1886 C CD1 . PHE A 1 238 ? 13.575 73.220 55.810 1.00 46.97 ? 297 PHE A CD1 1 ATOM 1887 C CD2 . PHE A 1 238 ? 12.540 74.139 53.870 1.00 33.88 ? 297 PHE A CD2 1 ATOM 1888 C CE1 . PHE A 1 238 ? 14.459 72.520 55.011 1.00 42.30 ? 297 PHE A CE1 1 ATOM 1889 C CE2 . PHE A 1 238 ? 13.420 73.441 53.066 1.00 52.28 ? 297 PHE A CE2 1 ATOM 1890 C CZ . PHE A 1 238 ? 14.381 72.630 53.637 1.00 44.64 ? 297 PHE A CZ 1 ATOM 1891 N N . LEU A 1 239 ? 12.522 77.938 55.989 1.00 46.47 ? 298 LEU A N 1 ATOM 1892 C CA . LEU A 1 239 ? 12.010 79.214 55.509 1.00 48.38 ? 298 LEU A CA 1 ATOM 1893 C C . LEU A 1 239 ? 10.813 78.928 54.611 1.00 49.01 ? 298 LEU A C 1 ATOM 1894 O O . LEU A 1 239 ? 10.738 77.856 54.010 1.00 59.80 ? 298 LEU A O 1 ATOM 1895 C CB . LEU A 1 239 ? 13.085 79.997 54.745 1.00 50.65 ? 298 LEU A CB 1 ATOM 1896 C CG . LEU A 1 239 ? 14.183 80.716 55.537 1.00 53.97 ? 298 LEU A CG 1 ATOM 1897 C CD1 . LEU A 1 239 ? 13.601 81.432 56.747 1.00 42.84 ? 298 LEU A CD1 1 ATOM 1898 C CD2 . LEU A 1 239 ? 15.298 79.761 55.945 1.00 60.65 ? 298 LEU A CD2 1 ATOM 1899 N N . PRO A 1 240 ? 9.860 79.871 54.530 1.00 53.94 ? 299 PRO A N 1 ATOM 1900 C CA . PRO A 1 240 ? 8.720 79.678 53.626 1.00 44.39 ? 299 PRO A CA 1 ATOM 1901 C C . PRO A 1 240 ? 9.193 79.504 52.186 1.00 46.27 ? 299 PRO A C 1 ATOM 1902 O O . PRO A 1 240 ? 10.286 79.969 51.857 1.00 54.62 ? 299 PRO A O 1 ATOM 1903 C CB . PRO A 1 240 ? 7.902 80.964 53.799 1.00 42.01 ? 299 PRO A CB 1 ATOM 1904 C CG . PRO A 1 240 ? 8.857 81.958 54.380 1.00 57.87 ? 299 PRO A CG 1 ATOM 1905 C CD . PRO A 1 240 ? 9.793 81.163 55.234 1.00 54.63 ? 299 PRO A CD 1 ATOM 1906 N N . ASP A 1 241 ? 8.400 78.833 51.356 1.00 49.68 ? 300 ASP A N 1 ATOM 1907 C CA . ASP A 1 241 ? 8.813 78.513 49.991 1.00 48.89 ? 300 ASP A CA 1 ATOM 1908 C C . ASP A 1 241 ? 9.208 79.777 49.230 1.00 64.84 ? 300 ASP A C 1 ATOM 1909 O O . ASP A 1 241 ? 8.578 80.825 49.375 1.00 63.74 ? 300 ASP A O 1 ATOM 1910 C CB . ASP A 1 241 ? 7.692 77.776 49.254 1.00 69.15 ? 300 ASP A CB 1 ATOM 1911 C CG . ASP A 1 241 ? 8.168 77.110 47.973 1.00 89.53 ? 300 ASP A CG 1 ATOM 1912 O OD1 . ASP A 1 241 ? 9.328 77.333 47.570 1.00 97.19 ? 300 ASP A OD1 1 ATOM 1913 O OD2 . ASP A 1 241 ? 7.374 76.360 47.367 1.00 100.59 ? 300 ASP A OD2 1 ATOM 1914 N N . GLU A 1 242 ? 10.259 79.665 48.424 1.00 65.48 ? 301 GLU A N 1 ATOM 1915 C CA . GLU A 1 242 ? 10.806 80.807 47.699 1.00 66.23 ? 301 GLU A CA 1 ATOM 1916 C C . GLU A 1 242 ? 9.827 81.342 46.663 1.00 75.10 ? 301 GLU A C 1 ATOM 1917 O O . GLU A 1 242 ? 9.788 82.543 46.398 1.00 85.26 ? 301 GLU A O 1 ATOM 1918 C CB . GLU A 1 242 ? 12.127 80.428 47.028 1.00 77.81 ? 301 GLU A CB 1 ATOM 1919 C CG . GLU A 1 242 ? 13.323 80.491 47.960 1.00 79.31 ? 301 GLU A CG 1 ATOM 1920 C CD . GLU A 1 242 ? 14.614 80.812 47.237 1.00 90.09 ? 301 GLU A CD 1 ATOM 1921 O OE1 . GLU A 1 242 ? 14.961 80.081 46.287 1.00 92.47 ? 301 GLU A OE1 1 ATOM 1922 O OE2 . GLU A 1 242 ? 15.282 81.796 47.619 1.00 97.04 ? 301 GLU A OE2 1 ATOM 1923 N N . SER A 1 243 ? 9.048 80.440 46.074 1.00 85.69 ? 302 SER A N 1 ATOM 1924 C CA . SER A 1 243 ? 8.045 80.813 45.083 1.00 83.53 ? 302 SER A CA 1 ATOM 1925 C C . SER A 1 243 ? 7.013 81.769 45.676 1.00 66.29 ? 302 SER A C 1 ATOM 1926 O O . SER A 1 243 ? 6.545 82.688 45.003 1.00 73.56 ? 302 SER A O 1 ATOM 1927 C CB . SER A 1 243 ? 7.352 79.566 44.529 1.00 86.78 ? 302 SER A CB 1 ATOM 1928 O OG . SER A 1 243 ? 6.714 78.835 45.561 1.00 91.24 ? 302 SER A OG 1 ATOM 1929 N N . ALA A 1 244 ? 6.663 81.543 46.938 1.00 60.00 ? 303 ALA A N 1 ATOM 1930 C CA . ALA A 1 244 ? 5.706 82.392 47.639 1.00 53.97 ? 303 ALA A CA 1 ATOM 1931 C C . ALA A 1 244 ? 6.396 83.600 48.268 1.00 63.94 ? 303 ALA A C 1 ATOM 1932 O O . ALA A 1 244 ? 5.952 84.736 48.104 1.00 74.82 ? 303 ALA A O 1 ATOM 1933 C CB . ALA A 1 244 ? 4.967 81.593 48.700 1.00 48.51 ? 303 ALA A CB 1 ATOM 1934 N N . VAL A 1 245 ? 7.482 83.344 48.990 1.00 72.15 ? 304 VAL A N 1 ATOM 1935 C CA . VAL A 1 245 ? 8.229 84.403 49.659 1.00 65.18 ? 304 VAL A CA 1 ATOM 1936 C C . VAL A 1 245 ? 9.663 84.449 49.141 1.00 67.40 ? 304 VAL A C 1 ATOM 1937 O O . VAL A 1 245 ? 10.544 83.779 49.680 1.00 77.71 ? 304 VAL A O 1 ATOM 1938 C CB . VAL A 1 245 ? 8.244 84.208 51.187 1.00 47.89 ? 304 VAL A CB 1 ATOM 1939 C CG1 . VAL A 1 245 ? 8.864 85.416 51.872 1.00 58.72 ? 304 VAL A CG1 1 ATOM 1940 C CG2 . VAL A 1 245 ? 6.836 83.973 51.701 1.00 45.74 ? 304 VAL A CG2 1 ATOM 1941 N N . PRO A 1 246 ? 9.898 85.238 48.080 1.00 66.89 ? 305 PRO A N 1 ATOM 1942 C CA . PRO A 1 246 ? 11.227 85.340 47.465 1.00 76.21 ? 305 PRO A CA 1 ATOM 1943 C C . PRO A 1 246 ? 12.270 85.926 48.410 1.00 69.79 ? 305 PRO A C 1 ATOM 1944 O O . PRO A 1 246 ? 11.927 86.677 49.323 1.00 56.82 ? 305 PRO A O 1 ATOM 1945 C CB . PRO A 1 246 ? 10.993 86.278 46.273 1.00 64.93 ? 305 PRO A CB 1 ATOM 1946 C CG . PRO A 1 246 ? 9.519 86.234 46.024 1.00 67.35 ? 305 PRO A CG 1 ATOM 1947 C CD . PRO A 1 246 ? 8.897 86.049 47.369 1.00 67.64 ? 305 PRO A CD 1 ATOM 1948 N N . ARG A 1 247 ? 13.532 85.575 48.184 1.00 70.84 ? 306 ARG A N 1 ATOM 1949 C CA . ARG A 1 247 ? 14.619 86.003 49.056 1.00 58.53 ? 306 ARG A CA 1 ATOM 1950 C C . ARG A 1 247 ? 15.822 86.538 48.281 1.00 52.62 ? 306 ARG A C 1 ATOM 1951 O O . ARG A 1 247 ? 16.045 86.168 47.128 1.00 55.81 ? 306 ARG A O 1 ATOM 1952 C CB . ARG A 1 247 ? 15.022 84.841 49.974 1.00 61.12 ? 306 ARG A CB 1 ATOM 1953 C CG . ARG A 1 247 ? 14.190 84.804 51.253 1.00 62.62 ? 306 ARG A CG 1 ATOM 1954 C CD . ARG A 1 247 ? 14.484 83.626 52.181 1.00 54.04 ? 306 ARG A CD 1 ATOM 1955 N NE . ARG A 1 247 ? 14.388 82.328 51.510 1.00 66.26 ? 306 ARG A NE 1 ATOM 1956 C CZ . ARG A 1 247 ? 15.419 81.554 51.192 1.00 71.76 ? 306 ARG A CZ 1 ATOM 1957 N NH1 . ARG A 1 247 ? 16.656 81.927 51.479 1.00 90.23 ? 306 ARG A NH1 1 ATOM 1958 N NH2 . ARG A 1 247 ? 15.202 80.398 50.591 1.00 65.83 ? 306 ARG A NH2 1 ATOM 1959 N N . LYS A 1 248 ? 16.594 87.407 48.929 1.00 62.17 ? 307 LYS A N 1 ATOM 1960 C CA . LYS A 1 248 ? 17.756 88.040 48.310 1.00 55.58 ? 307 LYS A CA 1 ATOM 1961 C C . LYS A 1 248 ? 19.065 87.569 48.938 1.00 47.98 ? 307 LYS A C 1 ATOM 1962 O O . LYS A 1 248 ? 19.144 87.355 50.148 1.00 52.36 ? 307 LYS A O 1 ATOM 1963 C CB . LYS A 1 248 ? 17.664 89.564 48.410 1.00 66.10 ? 307 LYS A CB 1 ATOM 1964 C CG . LYS A 1 248 ? 16.704 90.206 47.424 1.00 81.22 ? 307 LYS A CG 1 ATOM 1965 C CD . LYS A 1 248 ? 16.601 91.707 47.661 1.00 84.71 ? 307 LYS A CD 1 ATOM 1966 C CE . LYS A 1 248 ? 16.237 92.024 49.104 1.00 85.02 ? 307 LYS A CE 1 ATOM 1967 N NZ . LYS A 1 248 ? 16.227 93.491 49.369 1.00 82.81 ? 307 LYS A NZ 1 ATOM 1968 N N . HIS A 1 249 ? 20.089 87.411 48.106 1.00 63.40 ? 308 HIS A N 1 ATOM 1969 C CA . HIS A 1 249 ? 21.405 86.990 48.569 1.00 71.13 ? 308 HIS A CA 1 ATOM 1970 C C . HIS A 1 249 ? 22.429 88.071 48.231 1.00 64.25 ? 308 HIS A C 1 ATOM 1971 O O . HIS A 1 249 ? 22.758 88.279 47.063 1.00 60.09 ? 308 HIS A O 1 ATOM 1972 C CB . HIS A 1 249 ? 21.796 85.651 47.943 1.00 72.17 ? 308 HIS A CB 1 ATOM 1973 C CG . HIS A 1 249 ? 22.873 84.927 48.690 1.00 101.20 ? 308 HIS A CG 1 ATOM 1974 N ND1 . HIS A 1 249 ? 22.690 84.433 49.964 1.00 110.86 ? 308 HIS A ND1 1 ATOM 1975 C CD2 . HIS A 1 249 ? 24.140 84.602 48.340 1.00 110.19 ? 308 HIS A CD2 1 ATOM 1976 C CE1 . HIS A 1 249 ? 23.800 83.842 50.370 1.00 115.86 ? 308 HIS A CE1 1 ATOM 1977 N NE2 . HIS A 1 249 ? 24.695 83.930 49.403 1.00 109.13 ? 308 HIS A NE2 1 ATOM 1978 N N . ASN A 1 250 ? 22.929 88.757 49.255 1.00 66.35 ? 309 ASN A N 1 ATOM 1979 C CA . ASN A 1 250 ? 23.817 89.897 49.046 1.00 56.95 ? 309 ASN A CA 1 ATOM 1980 C C . ASN A 1 250 ? 25.217 89.699 49.621 1.00 46.73 ? 309 ASN A C 1 ATOM 1981 O O . ASN A 1 250 ? 25.371 89.326 50.784 1.00 61.59 ? 309 ASN A O 1 ATOM 1982 C CB . ASN A 1 250 ? 23.199 91.154 49.661 1.00 54.56 ? 309 ASN A CB 1 ATOM 1983 C CG . ASN A 1 250 ? 21.902 91.557 48.991 1.00 65.72 ? 309 ASN A CG 1 ATOM 1984 O OD1 . ASN A 1 250 ? 21.898 92.062 47.869 1.00 73.51 ? 309 ASN A OD1 1 ATOM 1985 N ND2 . ASN A 1 250 ? 20.788 91.340 49.683 1.00 60.82 ? 309 ASN A ND2 1 ATOM 1986 N N . ARG A 1 251 ? 26.235 89.946 48.799 1.00 48.05 ? 310 ARG A N 1 ATOM 1987 C CA . ARG A 1 251 ? 27.620 89.897 49.260 1.00 47.47 ? 310 ARG A CA 1 ATOM 1988 C C . ARG A 1 251 ? 27.889 90.963 50.317 1.00 46.13 ? 310 ARG A C 1 ATOM 1989 O O . ARG A 1 251 ? 27.513 92.122 50.149 1.00 50.10 ? 310 ARG A O 1 ATOM 1990 C CB . ARG A 1 251 ? 28.594 90.082 48.093 1.00 51.01 ? 310 ARG A CB 1 ATOM 1991 C CG . ARG A 1 251 ? 30.057 90.000 48.513 1.00 71.82 ? 310 ARG A CG 1 ATOM 1992 C CD . ARG A 1 251 ? 31.010 90.365 47.386 1.00 79.49 ? 310 ARG A CD 1 ATOM 1993 N NE . ARG A 1 251 ? 30.876 89.495 46.222 1.00 88.05 ? 310 ARG A NE 1 ATOM 1994 C CZ . ARG A 1 251 ? 31.539 89.674 45.085 1.00 86.33 ? 310 ARG A CZ 1 ATOM 1995 N NH1 . ARG A 1 251 ? 32.379 90.693 44.962 1.00 83.41 ? 310 ARG A NH1 1 ATOM 1996 N NH2 . ARG A 1 251 ? 31.364 88.838 44.070 1.00 79.61 ? 310 ARG A NH2 1 ATOM 1997 N N . SER A 1 252 ? 28.544 90.567 51.403 1.00 42.97 ? 311 SER A N 1 ATOM 1998 C CA . SER A 1 252 ? 28.897 91.502 52.464 1.00 36.24 ? 311 SER A CA 1 ATOM 1999 C C . SER A 1 252 ? 30.110 92.344 52.076 1.00 54.72 ? 311 SER A C 1 ATOM 2000 O O . SER A 1 252 ? 31.077 91.824 51.518 1.00 49.43 ? 311 SER A O 1 ATOM 2001 C CB . SER A 1 252 ? 29.175 90.758 53.770 1.00 37.60 ? 311 SER A CB 1 ATOM 2002 O OG . SER A 1 252 ? 29.514 91.660 54.809 1.00 38.41 ? 311 SER A OG 1 ATOM 2003 N N . PRO A 1 253 ? 30.061 93.652 52.369 1.00 47.07 ? 312 PRO A N 1 ATOM 2004 C CA . PRO A 1 253 ? 31.211 94.541 52.169 1.00 35.64 ? 312 PRO A CA 1 ATOM 2005 C C . PRO A 1 253 ? 32.344 94.214 53.139 1.00 54.32 ? 312 PRO A C 1 ATOM 2006 O O . PRO A 1 253 ? 33.486 94.619 52.919 1.00 46.01 ? 312 PRO A O 1 ATOM 2007 C CB . PRO A 1 253 ? 30.634 95.933 52.442 1.00 28.23 ? 312 PRO A CB 1 ATOM 2008 C CG . PRO A 1 253 ? 29.459 95.690 53.318 1.00 45.07 ? 312 PRO A CG 1 ATOM 2009 C CD . PRO A 1 253 ? 28.886 94.375 52.882 1.00 48.18 ? 312 PRO A CD 1 ATOM 2010 N N . TYR A 1 254 ? 32.018 93.484 54.201 1.00 36.15 ? 313 TYR A N 1 ATOM 2011 C CA . TYR A 1 254 ? 33.011 93.040 55.172 1.00 40.72 ? 313 TYR A CA 1 ATOM 2012 C C . TYR A 1 254 ? 33.294 91.550 55.033 1.00 33.30 ? 313 TYR A C 1 ATOM 2013 O O . TYR A 1 254 ? 33.643 90.877 56.003 1.00 33.61 ? 313 TYR A O 1 ATOM 2014 C CB . TYR A 1 254 ? 32.557 93.370 56.595 1.00 25.43 ? 313 TYR A CB 1 ATOM 2015 C CG . TYR A 1 254 ? 32.676 94.838 56.924 1.00 59.02 ? 313 TYR A CG 1 ATOM 2016 C CD1 . TYR A 1 254 ? 31.650 95.725 56.626 1.00 50.00 ? 313 TYR A CD1 1 ATOM 2017 C CD2 . TYR A 1 254 ? 33.825 95.341 57.521 1.00 27.03 ? 313 TYR A CD2 1 ATOM 2018 C CE1 . TYR A 1 254 ? 31.763 97.070 56.920 1.00 48.90 ? 313 TYR A CE1 1 ATOM 2019 C CE2 . TYR A 1 254 ? 33.947 96.683 57.819 1.00 50.20 ? 313 TYR A CE2 1 ATOM 2020 C CZ . TYR A 1 254 ? 32.914 97.543 57.517 1.00 56.13 ? 313 TYR A CZ 1 ATOM 2021 O OH . TYR A 1 254 ? 33.034 98.881 57.813 1.00 43.07 ? 313 TYR A OH 1 ATOM 2022 N N . ARG A 1 255 ? 33.115 91.043 53.817 1.00 35.31 ? 314 ARG A N 1 ATOM 2023 C CA . ARG A 1 255 ? 33.528 89.688 53.483 1.00 33.51 ? 314 ARG A CA 1 ATOM 2024 C C . ARG A 1 255 ? 35.019 89.531 53.743 1.00 46.21 ? 314 ARG A C 1 ATOM 2025 O O . ARG A 1 255 ? 35.811 90.415 53.414 1.00 56.96 ? 314 ARG A O 1 ATOM 2026 C CB . ARG A 1 255 ? 33.212 89.367 52.020 1.00 41.41 ? 314 ARG A CB 1 ATOM 2027 C CG . ARG A 1 255 ? 33.630 87.973 51.575 1.00 61.38 ? 314 ARG A CG 1 ATOM 2028 C CD . ARG A 1 255 ? 33.339 87.759 50.098 1.00 77.55 ? 314 ARG A CD 1 ATOM 2029 N NE . ARG A 1 255 ? 33.690 86.413 49.654 1.00 75.32 ? 314 ARG A NE 1 ATOM 2030 C CZ . ARG A 1 255 ? 34.898 86.064 49.224 1.00 71.44 ? 314 ARG A CZ 1 ATOM 2031 N NH1 . ARG A 1 255 ? 35.873 86.962 49.184 1.00 64.63 ? 314 ARG A NH1 1 ATOM 2032 N NH2 . ARG A 1 255 ? 35.134 84.818 48.837 1.00 86.28 ? 314 ARG A NH2 1 ATOM 2033 N N . ARG A 1 256 ? 35.401 88.406 54.337 1.00 30.82 ? 315 ARG A N 1 ATOM 2034 C CA . ARG A 1 256 ? 36.807 88.140 54.608 1.00 49.75 ? 315 ARG A CA 1 ATOM 2035 C C . ARG A 1 256 ? 37.444 87.590 53.327 1.00 48.69 ? 315 ARG A C 1 ATOM 2036 O O . ARG A 1 256 ? 36.747 87.371 52.334 1.00 45.96 ? 315 ARG A O 1 ATOM 2037 C CB . ARG A 1 256 ? 36.949 87.177 55.791 1.00 38.71 ? 315 ARG A CB 1 ATOM 2038 C CG . ARG A 1 256 ? 36.466 87.805 57.098 1.00 37.84 ? 315 ARG A CG 1 ATOM 2039 C CD . ARG A 1 256 ? 36.334 86.810 58.237 1.00 30.18 ? 315 ARG A CD 1 ATOM 2040 N NE . ARG A 1 256 ? 36.434 87.461 59.542 1.00 35.41 ? 315 ARG A NE 1 ATOM 2041 C CZ . ARG A 1 256 ? 37.476 87.370 60.358 1.00 34.76 ? 315 ARG A CZ 1 ATOM 2042 N NH1 . ARG A 1 256 ? 38.532 86.651 60.009 1.00 53.04 ? 315 ARG A NH1 1 ATOM 2043 N NH2 . ARG A 1 256 ? 37.458 88.001 61.523 1.00 47.64 ? 315 ARG A NH2 1 ATOM 2044 N N . THR A 1 257 ? 38.755 87.374 53.333 1.00 34.76 ? 316 THR A N 1 ATOM 2045 C CA . THR A 1 257 ? 39.450 86.995 52.103 1.00 38.82 ? 316 THR A CA 1 ATOM 2046 C C . THR A 1 257 ? 39.263 85.524 51.746 1.00 44.69 ? 316 THR A C 1 ATOM 2047 O O . THR A 1 257 ? 39.239 85.168 50.565 1.00 51.54 ? 316 THR A O 1 ATOM 2048 C CB . THR A 1 257 ? 40.959 87.281 52.190 1.00 26.77 ? 316 THR A CB 1 ATOM 2049 O OG1 . THR A 1 257 ? 41.540 86.481 53.226 1.00 61.67 ? 316 THR A OG1 1 ATOM 2050 C CG2 . THR A 1 257 ? 41.209 88.748 52.488 1.00 58.52 ? 316 THR A CG2 1 ATOM 2051 N N . TYR A 1 258 ? 39.140 84.680 52.767 1.00 32.23 ? 317 TYR A N 1 ATOM 2052 C CA . TYR A 1 258 ? 39.028 83.234 52.583 1.00 50.87 ? 317 TYR A CA 1 ATOM 2053 C C . TYR A 1 258 ? 40.230 82.688 51.821 1.00 43.34 ? 317 TYR A C 1 ATOM 2054 O O . TYR A 1 258 ? 40.091 81.881 50.901 1.00 44.89 ? 317 TYR A O 1 ATOM 2055 C CB . TYR A 1 258 ? 37.721 82.873 51.869 1.00 36.86 ? 317 TYR A CB 1 ATOM 2056 C CG . TYR A 1 258 ? 36.494 83.110 52.718 1.00 46.79 ? 317 TYR A CG 1 ATOM 2057 C CD1 . TYR A 1 258 ? 35.875 82.060 53.383 1.00 40.76 ? 317 TYR A CD1 1 ATOM 2058 C CD2 . TYR A 1 258 ? 35.965 84.385 52.868 1.00 40.01 ? 317 TYR A CD2 1 ATOM 2059 C CE1 . TYR A 1 258 ? 34.759 82.273 54.168 1.00 42.21 ? 317 TYR A CE1 1 ATOM 2060 C CE2 . TYR A 1 258 ? 34.851 84.608 53.652 1.00 45.44 ? 317 TYR A CE2 1 ATOM 2061 C CZ . TYR A 1 258 ? 34.252 83.548 54.299 1.00 49.59 ? 317 TYR A CZ 1 ATOM 2062 O OH . TYR A 1 258 ? 33.142 83.762 55.082 1.00 46.18 ? 317 TYR A OH 1 ATOM 2063 N N . SER A 1 259 ? 41.412 83.150 52.214 1.00 34.90 ? 318 SER A N 1 ATOM 2064 C CA . SER A 1 259 ? 42.669 82.670 51.657 1.00 43.75 ? 318 SER A CA 1 ATOM 2065 C C . SER A 1 259 ? 43.746 82.661 52.737 1.00 52.10 ? 318 SER A C 1 ATOM 2066 O O . SER A 1 259 ? 43.772 83.540 53.598 1.00 42.11 ? 318 SER A O 1 ATOM 2067 C CB . SER A 1 259 ? 43.101 83.538 50.476 1.00 36.58 ? 318 SER A CB 1 ATOM 2068 O OG . SER A 1 259 ? 44.504 83.480 50.285 1.00 50.52 ? 318 SER A OG 1 ATOM 2069 N N . LYS A 1 260 ? 44.626 81.664 52.702 1.00 47.42 ? 319 LYS A N 1 ATOM 2070 C CA . LYS A 1 260 ? 45.703 81.585 53.684 1.00 47.06 ? 319 LYS A CA 1 ATOM 2071 C C . LYS A 1 260 ? 46.961 82.352 53.266 1.00 45.16 ? 319 LYS A C 1 ATOM 2072 O O . LYS A 1 260 ? 47.838 82.602 54.093 1.00 56.20 ? 319 LYS A O 1 ATOM 2073 C CB . LYS A 1 260 ? 46.036 80.118 53.986 1.00 33.82 ? 319 LYS A CB 1 ATOM 2074 C CG . LYS A 1 260 ? 46.274 79.235 52.775 1.00 44.07 ? 319 LYS A CG 1 ATOM 2075 C CD . LYS A 1 260 ? 46.320 77.775 53.211 1.00 46.35 ? 319 LYS A CD 1 ATOM 2076 C CE . LYS A 1 260 ? 46.575 76.829 52.051 1.00 51.20 ? 319 LYS A CE 1 ATOM 2077 N NZ . LYS A 1 260 ? 47.859 77.102 51.366 1.00 72.71 ? 319 LYS A NZ 1 ATOM 2078 N N . LYS A 1 261 ? 47.054 82.721 51.990 1.00 40.08 ? 320 LYS A N 1 ATOM 2079 C CA . LYS A 1 261 ? 48.141 83.587 51.530 1.00 55.10 ? 320 LYS A CA 1 ATOM 2080 C C . LYS A 1 261 ? 47.877 85.053 51.863 1.00 54.36 ? 320 LYS A C 1 ATOM 2081 O O . LYS A 1 261 ? 48.546 85.627 52.722 1.00 68.46 ? 320 LYS A O 1 ATOM 2082 C CB . LYS A 1 261 ? 48.379 83.422 50.026 1.00 57.49 ? 320 LYS A CB 1 ATOM 2083 C CG . LYS A 1 261 ? 49.410 82.360 49.658 1.00 82.10 ? 320 LYS A CG 1 ATOM 2084 C CD . LYS A 1 261 ? 49.095 80.970 50.177 1.00 91.52 ? 320 LYS A CD 1 ATOM 2085 C CE . LYS A 1 261 ? 50.214 80.015 49.783 1.00 82.62 ? 320 LYS A CE 1 ATOM 2086 N NZ . LYS A 1 261 ? 50.006 78.628 50.267 1.00 78.24 ? 320 LYS A NZ 1 ATOM 2087 N N . ASN A 1 262 ? 46.902 85.657 51.191 1.00 57.68 ? 321 ASN A N 1 ATOM 2088 C CA . ASN A 1 262 ? 46.516 87.027 51.510 1.00 60.22 ? 321 ASN A CA 1 ATOM 2089 C C . ASN A 1 262 ? 45.363 87.028 52.506 1.00 42.13 ? 321 ASN A C 1 ATOM 2090 O O . ASN A 1 262 ? 44.196 86.916 52.134 1.00 55.80 ? 321 ASN A O 1 ATOM 2091 C CB . ASN A 1 262 ? 46.150 87.804 50.243 1.00 63.75 ? 321 ASN A CB 1 ATOM 2092 C CG . ASN A 1 262 ? 45.488 86.937 49.191 1.00 78.76 ? 321 ASN A CG 1 ATOM 2093 O OD1 . ASN A 1 262 ? 44.728 86.025 49.508 1.00 79.50 ? 321 ASN A OD1 1 ATOM 2094 N ND2 . ASN A 1 262 ? 45.783 87.215 47.926 1.00 67.96 ? 321 ASN A ND2 1 ATOM 2095 N N . GLN A 1 263 ? 45.713 87.158 53.781 1.00 42.20 ? 322 GLN A N 1 ATOM 2096 C CA . GLN A 1 263 ? 44.767 86.974 54.872 1.00 43.76 ? 322 GLN A CA 1 ATOM 2097 C C . GLN A 1 263 ? 44.150 88.289 55.333 1.00 47.57 ? 322 GLN A C 1 ATOM 2098 O O . GLN A 1 263 ? 43.371 88.315 56.286 1.00 34.15 ? 322 GLN A O 1 ATOM 2099 C CB . GLN A 1 263 ? 45.466 86.291 56.049 1.00 32.77 ? 322 GLN A CB 1 ATOM 2100 C CG . GLN A 1 263 ? 46.040 84.925 55.715 1.00 35.19 ? 322 GLN A CG 1 ATOM 2101 C CD . GLN A 1 263 ? 46.866 84.348 56.849 1.00 33.44 ? 322 GLN A CD 1 ATOM 2102 O OE1 . GLN A 1 263 ? 46.762 84.788 57.994 1.00 32.83 ? 322 GLN A OE1 1 ATOM 2103 N NE2 . GLN A 1 263 ? 47.700 83.365 56.532 1.00 27.98 ? 322 GLN A NE2 1 ATOM 2104 N N . VAL A 1 264 ? 44.500 89.378 54.658 1.00 41.80 ? 323 VAL A N 1 ATOM 2105 C CA . VAL A 1 264 ? 44.082 90.704 55.094 1.00 34.84 ? 323 VAL A CA 1 ATOM 2106 C C . VAL A 1 264 ? 43.254 91.429 54.038 1.00 41.78 ? 323 VAL A C 1 ATOM 2107 O O . VAL A 1 264 ? 43.782 91.891 53.026 1.00 51.20 ? 323 VAL A O 1 ATOM 2108 C CB . VAL A 1 264 ? 45.297 91.581 55.460 1.00 46.05 ? 323 VAL A CB 1 ATOM 2109 C CG1 . VAL A 1 264 ? 44.841 92.969 55.886 1.00 41.14 ? 323 VAL A CG1 1 ATOM 2110 C CG2 . VAL A 1 264 ? 46.117 90.922 56.558 1.00 39.24 ? 323 VAL A CG2 1 ATOM 2111 N N . ALA A 1 265 ? 41.951 91.517 54.282 1.00 47.23 ? 324 ALA A N 1 ATOM 2112 C CA . ALA A 1 265 ? 41.058 92.283 53.424 1.00 49.06 ? 324 ALA A CA 1 ATOM 2113 C C . ALA A 1 265 ? 41.285 93.774 53.638 1.00 40.21 ? 324 ALA A C 1 ATOM 2114 O O . ALA A 1 265 ? 41.853 94.180 54.653 1.00 49.12 ? 324 ALA A O 1 ATOM 2115 C CB . ALA A 1 265 ? 39.610 91.917 53.694 1.00 25.19 ? 324 ALA A CB 1 ATOM 2116 N N . GLU A 1 266 ? 40.851 94.582 52.674 1.00 40.70 ? 325 GLU A N 1 ATOM 2117 C CA . GLU A 1 266 ? 41.004 96.032 52.747 1.00 45.42 ? 325 GLU A CA 1 ATOM 2118 C C . GLU A 1 266 ? 40.443 96.613 54.042 1.00 46.15 ? 325 GLU A C 1 ATOM 2119 O O . GLU A 1 266 ? 41.067 97.470 54.668 1.00 45.05 ? 325 GLU A O 1 ATOM 2120 C CB . GLU A 1 266 ? 40.326 96.698 51.548 1.00 53.42 ? 325 GLU A CB 1 ATOM 2121 C CG . GLU A 1 266 ? 40.394 98.216 51.568 1.00 61.08 ? 325 GLU A CG 1 ATOM 2122 C CD . GLU A 1 266 ? 39.796 98.845 50.327 1.00 64.46 ? 325 GLU A CD 1 ATOM 2123 O OE1 . GLU A 1 266 ? 39.437 98.098 49.392 1.00 69.11 ? 325 GLU A OE1 1 ATOM 2124 O OE2 . GLU A 1 266 ? 39.686 100.088 50.287 1.00 64.07 ? 325 GLU A OE2 1 ATOM 2125 N N . TRP A 1 267 ? 39.267 96.139 54.443 1.00 40.73 ? 326 TRP A N 1 ATOM 2126 C CA . TRP A 1 267 ? 38.601 96.656 55.635 1.00 37.58 ? 326 TRP A CA 1 ATOM 2127 C C . TRP A 1 267 ? 39.319 96.292 56.933 1.00 46.96 ? 326 TRP A C 1 ATOM 2128 O O . TRP A 1 267 ? 39.035 96.865 57.984 1.00 38.96 ? 326 TRP A O 1 ATOM 2129 C CB . TRP A 1 267 ? 37.147 96.174 55.684 1.00 30.40 ? 326 TRP A CB 1 ATOM 2130 C CG . TRP A 1 267 ? 36.954 94.689 55.678 1.00 45.23 ? 326 TRP A CG 1 ATOM 2131 C CD1 . TRP A 1 267 ? 36.771 93.894 54.585 1.00 45.81 ? 326 TRP A CD1 1 ATOM 2132 C CD2 . TRP A 1 267 ? 36.881 93.825 56.819 1.00 41.87 ? 326 TRP A CD2 1 ATOM 2133 N NE1 . TRP A 1 267 ? 36.607 92.587 54.972 1.00 42.34 ? 326 TRP A NE1 1 ATOM 2134 C CE2 . TRP A 1 267 ? 36.671 92.517 56.338 1.00 41.97 ? 326 TRP A CE2 1 ATOM 2135 C CE3 . TRP A 1 267 ? 36.984 94.029 58.199 1.00 35.25 ? 326 TRP A CE3 1 ATOM 2136 C CZ2 . TRP A 1 267 ? 36.560 91.418 57.188 1.00 25.32 ? 326 TRP A CZ2 1 ATOM 2137 C CZ3 . TRP A 1 267 ? 36.872 92.936 59.040 1.00 41.98 ? 326 TRP A CZ3 1 ATOM 2138 C CH2 . TRP A 1 267 ? 36.664 91.648 58.532 1.00 25.25 ? 326 TRP A CH2 1 ATOM 2139 N N . GLN A 1 268 ? 40.246 95.343 56.860 1.00 43.32 ? 327 GLN A N 1 ATOM 2140 C CA . GLN A 1 268 ? 41.005 94.937 58.037 1.00 42.83 ? 327 GLN A CA 1 ATOM 2141 C C . GLN A 1 268 ? 42.254 95.792 58.242 1.00 57.91 ? 327 GLN A C 1 ATOM 2142 O O . GLN A 1 268 ? 42.802 95.847 59.343 1.00 51.23 ? 327 GLN A O 1 ATOM 2143 C CB . GLN A 1 268 ? 41.396 93.463 57.936 1.00 25.32 ? 327 GLN A CB 1 ATOM 2144 C CG . GLN A 1 268 ? 40.284 92.505 58.321 1.00 28.38 ? 327 GLN A CG 1 ATOM 2145 C CD . GLN A 1 268 ? 40.588 91.074 57.936 1.00 35.70 ? 327 GLN A CD 1 ATOM 2146 O OE1 . GLN A 1 268 ? 41.024 90.799 56.818 1.00 44.40 ? 327 GLN A OE1 1 ATOM 2147 N NE2 . GLN A 1 268 ? 40.364 90.152 58.865 1.00 31.74 ? 327 GLN A NE2 1 ATOM 2148 N N . SER A 1 269 ? 42.697 96.461 57.182 1.00 56.83 ? 328 SER A N 1 ATOM 2149 C CA . SER A 1 269 ? 43.910 97.272 57.246 1.00 64.18 ? 328 SER A CA 1 ATOM 2150 C C . SER A 1 269 ? 43.611 98.760 57.094 1.00 66.02 ? 328 SER A C 1 ATOM 2151 O O . SER A 1 269 ? 44.363 99.604 57.580 1.00 76.25 ? 328 SER A O 1 ATOM 2152 C CB . SER A 1 269 ? 44.905 96.829 56.171 1.00 46.80 ? 328 SER A CB 1 ATOM 2153 O OG . SER A 1 269 ? 44.306 96.835 54.887 1.00 63.15 ? 328 SER A OG 1 ATOM 2154 N N . SER A 1 270 ? 42.511 99.078 56.419 1.00 66.29 ? 329 SER A N 1 ATOM 2155 C CA . SER A 1 270 ? 42.138 100.468 56.185 1.00 50.56 ? 329 SER A CA 1 ATOM 2156 C C . SER A 1 270 ? 41.012 100.885 57.124 1.00 52.72 ? 329 SER A C 1 ATOM 2157 O O . SER A 1 270 ? 39.916 100.329 57.081 1.00 66.07 ? 329 SER A O 1 ATOM 2158 C CB . SER A 1 270 ? 41.719 100.678 54.728 1.00 36.95 ? 329 SER A CB 1 ATOM 2159 O OG . SER A 1 270 ? 41.069 101.926 54.561 1.00 60.95 ? 329 SER A OG 1 HETATM 2160 N N . MSE A 1 271 ? 41.292 101.872 57.967 1.00 38.11 ? 330 MSE A N 1 HETATM 2161 C CA . MSE A 1 271 ? 40.353 102.286 59.003 1.00 59.85 ? 330 MSE A CA 1 HETATM 2162 C C . MSE A 1 271 ? 39.161 103.057 58.437 1.00 62.04 ? 330 MSE A C 1 HETATM 2163 O O . MSE A 1 271 ? 38.043 102.936 58.934 1.00 71.10 ? 330 MSE A O 1 HETATM 2164 C CB . MSE A 1 271 ? 41.073 103.136 60.052 1.00 57.47 ? 330 MSE A CB 1 HETATM 2165 C CG . MSE A 1 271 ? 40.403 103.154 61.419 1.00 69.14 ? 330 MSE A CG 1 HETATM 2166 SE SE . MSE A 1 271 ? 41.013 101.737 62.619 1.00 178.21 ? 330 MSE A SE 1 HETATM 2167 C CE . MSE A 1 271 ? 39.985 100.238 61.912 1.00 24.21 ? 330 MSE A CE 1 ATOM 2168 N N . ASN A 1 272 ? 39.403 103.847 57.395 1.00 58.02 ? 331 ASN A N 1 ATOM 2169 C CA . ASN A 1 272 ? 38.351 104.651 56.779 1.00 55.75 ? 331 ASN A CA 1 ATOM 2170 C C . ASN A 1 272 ? 37.552 103.894 55.720 1.00 48.94 ? 331 ASN A C 1 ATOM 2171 O O . ASN A 1 272 ? 36.872 104.505 54.896 1.00 53.24 ? 331 ASN A O 1 ATOM 2172 C CB . ASN A 1 272 ? 38.947 105.922 56.169 1.00 59.21 ? 331 ASN A CB 1 ATOM 2173 C CG . ASN A 1 272 ? 40.212 105.652 55.384 1.00 74.31 ? 331 ASN A CG 1 ATOM 2174 O OD1 . ASN A 1 272 ? 40.176 105.056 54.308 1.00 74.29 ? 331 ASN A OD1 1 ATOM 2175 N ND2 . ASN A 1 272 ? 41.343 106.096 55.919 1.00 83.18 ? 331 ASN A ND2 1 ATOM 2176 N N . TYR A 1 273 ? 37.656 102.567 55.738 1.00 52.52 ? 332 TYR A N 1 ATOM 2177 C CA . TYR A 1 273 ? 36.966 101.710 54.775 1.00 57.63 ? 332 TYR A CA 1 ATOM 2178 C C . TYR A 1 273 ? 35.465 101.978 54.687 1.00 57.68 ? 332 TYR A C 1 ATOM 2179 O O . TYR A 1 273 ? 34.912 102.091 53.595 1.00 54.32 ? 332 TYR A O 1 ATOM 2180 C CB . TYR A 1 273 ? 37.190 100.238 55.127 1.00 39.01 ? 332 TYR A CB 1 ATOM 2181 C CG . TYR A 1 273 ? 36.508 99.270 54.186 1.00 36.36 ? 332 TYR A CG 1 ATOM 2182 C CD1 . TYR A 1 273 ? 37.083 98.932 52.968 1.00 46.34 ? 332 TYR A CD1 1 ATOM 2183 C CD2 . TYR A 1 273 ? 35.283 98.701 54.512 1.00 33.60 ? 332 TYR A CD2 1 ATOM 2184 C CE1 . TYR A 1 273 ? 36.460 98.046 52.107 1.00 46.18 ? 332 TYR A CE1 1 ATOM 2185 C CE2 . TYR A 1 273 ? 34.656 97.814 53.660 1.00 37.48 ? 332 TYR A CE2 1 ATOM 2186 C CZ . TYR A 1 273 ? 35.247 97.492 52.458 1.00 43.97 ? 332 TYR A CZ 1 ATOM 2187 O OH . TYR A 1 273 ? 34.622 96.611 51.606 1.00 37.58 ? 332 TYR A OH 1 ATOM 2188 N N . CYS A 1 274 ? 34.812 102.076 55.840 1.00 50.46 ? 333 CYS A N 1 ATOM 2189 C CA . CYS A 1 274 ? 33.369 102.283 55.888 1.00 60.48 ? 333 CYS A CA 1 ATOM 2190 C C . CYS A 1 274 ? 32.992 103.631 55.285 1.00 67.99 ? 333 CYS A C 1 ATOM 2191 O O . CYS A 1 274 ? 32.040 103.731 54.511 1.00 53.12 ? 333 CYS A O 1 ATOM 2192 C CB . CYS A 1 274 ? 32.854 102.185 57.325 1.00 57.49 ? 333 CYS A CB 1 ATOM 2193 S SG . CYS A 1 274 ? 31.049 102.187 57.466 1.00 44.63 ? 333 CYS A SG 1 ATOM 2194 N N . THR A 1 275 ? 33.743 104.663 55.654 1.00 59.51 ? 334 THR A N 1 ATOM 2195 C CA . THR A 1 275 ? 33.503 106.015 55.163 1.00 53.15 ? 334 THR A CA 1 ATOM 2196 C C . THR A 1 275 ? 33.610 106.108 53.641 1.00 48.02 ? 334 THR A C 1 ATOM 2197 O O . THR A 1 275 ? 32.732 106.666 52.982 1.00 48.84 ? 334 THR A O 1 ATOM 2198 C CB . THR A 1 275 ? 34.494 107.015 55.795 1.00 52.72 ? 334 THR A CB 1 ATOM 2199 O OG1 . THR A 1 275 ? 34.207 107.163 57.191 1.00 55.39 ? 334 THR A OG1 1 ATOM 2200 C CG2 . THR A 1 275 ? 34.405 108.372 55.111 1.00 44.90 ? 334 THR A CG2 1 ATOM 2201 N N . ASP A 1 276 ? 34.683 105.554 53.087 1.00 34.39 ? 335 ASP A N 1 ATOM 2202 C CA . ASP A 1 276 ? 34.963 105.685 51.659 1.00 37.31 ? 335 ASP A CA 1 ATOM 2203 C C . ASP A 1 276 ? 34.305 104.617 50.786 1.00 50.03 ? 335 ASP A C 1 ATOM 2204 O O . ASP A 1 276 ? 33.931 104.891 49.646 1.00 59.21 ? 335 ASP A O 1 ATOM 2205 C CB . ASP A 1 276 ? 36.475 105.667 51.419 1.00 41.33 ? 335 ASP A CB 1 ATOM 2206 C CG . ASP A 1 276 ? 37.208 106.715 52.231 1.00 59.58 ? 335 ASP A CG 1 ATOM 2207 O OD1 . ASP A 1 276 ? 36.615 107.780 52.506 1.00 71.97 ? 335 ASP A OD1 1 ATOM 2208 O OD2 . ASP A 1 276 ? 38.378 106.476 52.596 1.00 63.85 ? 335 ASP A OD2 1 ATOM 2209 N N . LYS A 1 277 ? 34.163 103.404 51.312 1.00 53.80 ? 336 LYS A N 1 ATOM 2210 C CA . LYS A 1 277 ? 33.784 102.271 50.470 1.00 54.93 ? 336 LYS A CA 1 ATOM 2211 C C . LYS A 1 277 ? 32.407 101.675 50.768 1.00 54.38 ? 336 LYS A C 1 ATOM 2212 O O . LYS A 1 277 ? 31.859 100.946 49.941 1.00 53.02 ? 336 LYS A O 1 ATOM 2213 C CB . LYS A 1 277 ? 34.844 101.173 50.583 1.00 52.73 ? 336 LYS A CB 1 ATOM 2214 C CG . LYS A 1 277 ? 36.243 101.637 50.212 1.00 54.59 ? 336 LYS A CG 1 ATOM 2215 C CD . LYS A 1 277 ? 36.366 101.891 48.721 1.00 57.05 ? 336 LYS A CD 1 ATOM 2216 C CE . LYS A 1 277 ? 37.736 102.447 48.365 1.00 65.01 ? 336 LYS A CE 1 ATOM 2217 N NZ . LYS A 1 277 ? 38.824 101.459 48.607 1.00 60.65 ? 336 LYS A NZ 1 ATOM 2218 N N . VAL A 1 278 ? 31.846 101.971 51.936 1.00 43.81 ? 337 VAL A N 1 ATOM 2219 C CA . VAL A 1 278 ? 30.550 101.397 52.299 1.00 44.47 ? 337 VAL A CA 1 ATOM 2220 C C . VAL A 1 278 ? 29.447 102.445 52.405 1.00 48.97 ? 337 VAL A C 1 ATOM 2221 O O . VAL A 1 278 ? 28.379 102.290 51.814 1.00 44.94 ? 337 VAL A O 1 ATOM 2222 C CB . VAL A 1 278 ? 30.630 100.634 53.637 1.00 52.43 ? 337 VAL A CB 1 ATOM 2223 C CG1 . VAL A 1 278 ? 29.252 100.147 54.055 1.00 39.46 ? 337 VAL A CG1 1 ATOM 2224 C CG2 . VAL A 1 278 ? 31.594 99.470 53.524 1.00 43.45 ? 337 VAL A CG2 1 ATOM 2225 N N . LYS A 1 279 ? 29.712 103.511 53.152 1.00 45.19 ? 338 LYS A N 1 ATOM 2226 C CA . LYS A 1 279 ? 28.754 104.602 53.297 1.00 43.33 ? 338 LYS A CA 1 ATOM 2227 C C . LYS A 1 279 ? 28.448 105.296 51.970 1.00 56.68 ? 338 LYS A C 1 ATOM 2228 O O . LYS A 1 279 ? 27.411 105.944 51.826 1.00 60.65 ? 338 LYS A O 1 ATOM 2229 C CB . LYS A 1 279 ? 29.263 105.625 54.315 1.00 48.07 ? 338 LYS A CB 1 ATOM 2230 C CG . LYS A 1 279 ? 28.986 105.242 55.760 1.00 43.67 ? 338 LYS A CG 1 ATOM 2231 C CD . LYS A 1 279 ? 29.567 106.256 56.731 1.00 37.36 ? 338 LYS A CD 1 ATOM 2232 C CE . LYS A 1 279 ? 29.123 105.968 58.155 1.00 37.71 ? 338 LYS A CE 1 ATOM 2233 N NZ . LYS A 1 279 ? 29.744 106.901 59.133 1.00 44.90 ? 338 LYS A NZ 1 ATOM 2234 N N . THR A 1 280 ? 29.352 105.164 51.004 1.00 53.73 ? 339 THR A N 1 ATOM 2235 C CA . THR A 1 280 ? 29.186 105.830 49.717 1.00 47.04 ? 339 THR A CA 1 ATOM 2236 C C . THR A 1 280 ? 28.465 104.972 48.679 1.00 52.68 ? 339 THR A C 1 ATOM 2237 O O . THR A 1 280 ? 28.136 105.451 47.594 1.00 63.03 ? 339 THR A O 1 ATOM 2238 C CB . THR A 1 280 ? 30.548 106.250 49.135 1.00 45.13 ? 339 THR A CB 1 ATOM 2239 O OG1 . THR A 1 280 ? 31.370 105.090 48.958 1.00 52.07 ? 339 THR A OG1 1 ATOM 2240 C CG2 . THR A 1 280 ? 31.248 107.225 50.069 1.00 31.54 ? 339 THR A CG2 1 ATOM 2241 N N . LYS A 1 281 ? 28.217 103.708 49.006 1.00 51.94 ? 340 LYS A N 1 ATOM 2242 C CA . LYS A 1 281 ? 27.490 102.830 48.095 1.00 61.39 ? 340 LYS A CA 1 ATOM 2243 C C . LYS A 1 281 ? 25.993 103.110 48.147 1.00 67.72 ? 340 LYS A C 1 ATOM 2244 O O . LYS A 1 281 ? 25.458 103.463 49.197 1.00 64.52 ? 340 LYS A O 1 ATOM 2245 C CB . LYS A 1 281 ? 27.768 101.359 48.412 1.00 62.65 ? 340 LYS A CB 1 ATOM 2246 C CG . LYS A 1 281 ? 29.170 100.903 48.034 1.00 70.44 ? 340 LYS A CG 1 ATOM 2247 C CD . LYS A 1 281 ? 29.389 99.433 48.351 1.00 78.60 ? 340 LYS A CD 1 ATOM 2248 C CE . LYS A 1 281 ? 28.581 98.546 47.417 1.00 83.83 ? 340 LYS A CE 1 ATOM 2249 N NZ . LYS A 1 281 ? 28.857 97.101 47.641 1.00 82.69 ? 340 LYS A NZ 1 ATOM 2250 N N . ARG A 1 282 ? 25.328 102.944 47.007 1.00 71.37 ? 341 ARG A N 1 ATOM 2251 C CA . ARG A 1 282 ? 23.889 103.170 46.889 1.00 68.58 ? 341 ARG A CA 1 ATOM 2252 C C . ARG A 1 282 ? 23.084 102.368 47.906 1.00 59.00 ? 341 ARG A C 1 ATOM 2253 O O . ARG A 1 282 ? 22.190 102.901 48.562 1.00 64.69 ? 341 ARG A O 1 ATOM 2254 C CB . ARG A 1 282 ? 23.407 102.825 45.480 1.00 82.21 ? 341 ARG A CB 1 ATOM 2255 C CG . ARG A 1 282 ? 23.884 103.774 44.396 1.00 100.48 ? 341 ARG A CG 1 ATOM 2256 C CD . ARG A 1 282 ? 23.272 103.399 43.058 1.00 111.89 ? 341 ARG A CD 1 ATOM 2257 N NE . ARG A 1 282 ? 24.238 103.481 41.966 1.00 125.67 ? 341 ARG A NE 1 ATOM 2258 C CZ . ARG A 1 282 ? 23.993 103.079 40.723 1.00 127.20 ? 341 ARG A CZ 1 ATOM 2259 N NH1 . ARG A 1 282 ? 22.811 102.565 40.413 1.00 136.23 ? 341 ARG A NH1 1 ATOM 2260 N NH2 . ARG A 1 282 ? 24.930 103.188 39.791 1.00 113.20 ? 341 ARG A NH2 1 ATOM 2261 N N . GLN A 1 283 ? 23.408 101.085 48.026 1.00 73.36 ? 342 GLN A N 1 ATOM 2262 C CA . GLN A 1 283 ? 22.670 100.181 48.899 1.00 67.32 ? 342 GLN A CA 1 ATOM 2263 C C . GLN A 1 283 ? 22.780 100.572 50.373 1.00 50.81 ? 342 GLN A C 1 ATOM 2264 O O . GLN A 1 283 ? 21.914 100.231 51.178 1.00 53.67 ? 342 GLN A O 1 ATOM 2265 C CB . GLN A 1 283 ? 23.181 98.748 48.714 1.00 74.50 ? 342 GLN A CB 1 ATOM 2266 C CG . GLN A 1 283 ? 23.171 98.245 47.275 1.00 94.04 ? 342 GLN A CG 1 ATOM 2267 C CD . GLN A 1 283 ? 21.831 97.678 46.850 1.00 99.48 ? 342 GLN A CD 1 ATOM 2268 O OE1 . GLN A 1 283 ? 20.786 98.295 47.057 1.00 93.61 ? 342 GLN A OE1 1 ATOM 2269 N NE2 . GLN A 1 283 ? 21.855 96.491 46.254 1.00 97.71 ? 342 GLN A NE2 1 ATOM 2270 N N . TYR A 1 284 ? 23.844 101.288 50.722 1.00 37.97 ? 343 TYR A N 1 ATOM 2271 C CA . TYR A 1 284 ? 24.112 101.623 52.118 1.00 43.23 ? 343 TYR A CA 1 ATOM 2272 C C . TYR A 1 284 ? 24.013 103.118 52.417 1.00 45.73 ? 343 TYR A C 1 ATOM 2273 O O . TYR A 1 284 ? 24.039 103.524 53.579 1.00 48.87 ? 343 TYR A O 1 ATOM 2274 C CB . TYR A 1 284 ? 25.494 101.107 52.524 1.00 53.59 ? 343 TYR A CB 1 ATOM 2275 C CG . TYR A 1 284 ? 25.583 99.600 52.597 1.00 58.74 ? 343 TYR A CG 1 ATOM 2276 C CD1 . TYR A 1 284 ? 25.343 98.930 53.790 1.00 56.72 ? 343 TYR A CD1 1 ATOM 2277 C CD2 . TYR A 1 284 ? 25.902 98.846 51.475 1.00 51.99 ? 343 TYR A CD2 1 ATOM 2278 C CE1 . TYR A 1 284 ? 25.420 97.552 53.863 1.00 54.25 ? 343 TYR A CE1 1 ATOM 2279 C CE2 . TYR A 1 284 ? 25.980 97.467 51.539 1.00 50.84 ? 343 TYR A CE2 1 ATOM 2280 C CZ . TYR A 1 284 ? 25.739 96.826 52.735 1.00 49.06 ? 343 TYR A CZ 1 ATOM 2281 O OH . TYR A 1 284 ? 25.815 95.454 52.806 1.00 60.61 ? 343 TYR A OH 1 ATOM 2282 N N . ALA A 1 285 ? 23.906 103.934 51.373 1.00 55.38 ? 344 ALA A N 1 ATOM 2283 C CA . ALA A 1 285 ? 23.896 105.384 51.544 1.00 55.61 ? 344 ALA A CA 1 ATOM 2284 C C . ALA A 1 285 ? 22.631 105.859 52.247 1.00 55.68 ? 344 ALA A C 1 ATOM 2285 O O . ALA A 1 285 ? 22.651 106.853 52.974 1.00 41.64 ? 344 ALA A O 1 ATOM 2286 C CB . ALA A 1 285 ? 24.040 106.081 50.200 1.00 47.15 ? 344 ALA A CB 1 ATOM 2287 N N . HIS A 1 286 ? 21.533 105.145 52.032 1.00 48.62 ? 345 HIS A N 1 ATOM 2288 C CA . HIS A 1 286 ? 20.258 105.516 52.632 1.00 42.83 ? 345 HIS A CA 1 ATOM 2289 C C . HIS A 1 286 ? 19.449 104.280 53.006 1.00 54.88 ? 345 HIS A C 1 ATOM 2290 O O . HIS A 1 286 ? 19.300 103.361 52.199 1.00 55.63 ? 345 HIS A O 1 ATOM 2291 C CB . HIS A 1 286 ? 19.452 106.399 51.674 1.00 49.71 ? 345 HIS A CB 1 ATOM 2292 C CG . HIS A 1 286 ? 20.139 107.678 51.307 1.00 60.06 ? 345 HIS A CG 1 ATOM 2293 N ND1 . HIS A 1 286 ? 20.063 108.815 52.082 1.00 60.03 ? 345 HIS A ND1 1 ATOM 2294 C CD2 . HIS A 1 286 ? 20.915 107.999 50.244 1.00 51.38 ? 345 HIS A CD2 1 ATOM 2295 C CE1 . HIS A 1 286 ? 20.762 109.781 51.514 1.00 70.66 ? 345 HIS A CE1 1 ATOM 2296 N NE2 . HIS A 1 286 ? 21.290 109.312 50.397 1.00 69.18 ? 345 HIS A NE2 1 ATOM 2297 N N . GLY A 1 287 ? 18.929 104.257 54.229 1.00 40.88 ? 346 GLY A N 1 ATOM 2298 C CA . GLY A 1 287 ? 18.081 103.162 54.663 1.00 51.56 ? 346 GLY A CA 1 ATOM 2299 C C . GLY A 1 287 ? 18.463 102.529 55.988 1.00 51.57 ? 346 GLY A C 1 ATOM 2300 O O . GLY A 1 287 ? 18.951 103.199 56.898 1.00 48.11 ? 346 GLY A O 1 ATOM 2301 N N . ARG A 1 288 ? 18.234 101.222 56.089 1.00 47.36 ? 347 ARG A N 1 ATOM 2302 C CA . ARG A 1 288 ? 18.472 100.478 57.322 1.00 56.90 ? 347 ARG A CA 1 ATOM 2303 C C . ARG A 1 288 ? 19.576 99.433 57.190 1.00 58.73 ? 347 ARG A C 1 ATOM 2304 O O . ARG A 1 288 ? 20.000 98.847 58.187 1.00 55.15 ? 347 ARG A O 1 ATOM 2305 C CB . ARG A 1 288 ? 17.185 99.782 57.768 1.00 45.29 ? 347 ARG A CB 1 ATOM 2306 C CG . ARG A 1 288 ? 16.665 98.782 56.744 1.00 30.47 ? 347 ARG A CG 1 ATOM 2307 C CD . ARG A 1 288 ? 15.528 97.937 57.291 1.00 46.60 ? 347 ARG A CD 1 ATOM 2308 N NE . ARG A 1 288 ? 15.981 97.043 58.353 1.00 49.84 ? 347 ARG A NE 1 ATOM 2309 C CZ . ARG A 1 288 ? 15.356 96.882 59.514 1.00 51.35 ? 347 ARG A CZ 1 ATOM 2310 N NH1 . ARG A 1 288 ? 14.241 97.553 59.769 1.00 51.77 ? 347 ARG A NH1 1 ATOM 2311 N NH2 . ARG A 1 288 ? 15.844 96.045 60.420 1.00 42.40 ? 347 ARG A NH2 1 ATOM 2312 N N . ARG A 1 289 ? 20.023 99.198 55.960 1.00 45.61 ? 348 ARG A N 1 ATOM 2313 C CA . ARG A 1 289 ? 20.999 98.150 55.666 1.00 46.91 ? 348 ARG A CA 1 ATOM 2314 C C . ARG A 1 289 ? 22.273 98.243 56.504 1.00 49.24 ? 348 ARG A C 1 ATOM 2315 O O . ARG A 1 289 ? 22.722 97.244 57.066 1.00 50.97 ? 348 ARG A O 1 ATOM 2316 C CB . ARG A 1 289 ? 21.354 98.166 54.178 1.00 46.61 ? 348 ARG A CB 1 ATOM 2317 C CG . ARG A 1 289 ? 20.236 97.639 53.295 1.00 52.76 ? 348 ARG A CG 1 ATOM 2318 C CD . ARG A 1 289 ? 20.735 97.236 51.920 1.00 65.12 ? 348 ARG A CD 1 ATOM 2319 N NE . ARG A 1 289 ? 19.636 96.816 51.055 1.00 78.34 ? 348 ARG A NE 1 ATOM 2320 C CZ . ARG A 1 289 ? 19.797 96.263 49.858 1.00 97.77 ? 348 ARG A CZ 1 ATOM 2321 N NH1 . ARG A 1 289 ? 21.016 96.053 49.384 1.00 113.57 ? 348 ARG A NH1 1 ATOM 2322 N NH2 . ARG A 1 289 ? 18.739 95.912 49.139 1.00 97.78 ? 348 ARG A NH2 1 ATOM 2323 N N . LEU A 1 290 ? 22.852 99.436 56.582 1.00 50.77 ? 349 LEU A N 1 ATOM 2324 C CA . LEU A 1 290 ? 24.081 99.632 57.343 1.00 46.55 ? 349 LEU A CA 1 ATOM 2325 C C . LEU A 1 290 ? 23.835 99.436 58.837 1.00 48.57 ? 349 LEU A C 1 ATOM 2326 O O . LEU A 1 290 ? 24.674 98.874 59.543 1.00 65.22 ? 349 LEU A O 1 ATOM 2327 C CB . LEU A 1 290 ? 24.671 101.017 57.076 1.00 51.57 ? 349 LEU A CB 1 ATOM 2328 C CG . LEU A 1 290 ? 26.102 101.223 57.577 1.00 51.18 ? 349 LEU A CG 1 ATOM 2329 C CD1 . LEU A 1 290 ? 27.014 100.127 57.051 1.00 55.27 ? 349 LEU A CD1 1 ATOM 2330 C CD2 . LEU A 1 290 ? 26.622 102.589 57.165 1.00 56.76 ? 349 LEU A CD2 1 ATOM 2331 N N . LEU A 1 291 ? 22.686 99.902 59.315 1.00 42.92 ? 350 LEU A N 1 ATOM 2332 C CA . LEU A 1 291 ? 22.305 99.706 60.711 1.00 40.96 ? 350 LEU A CA 1 ATOM 2333 C C . LEU A 1 291 ? 22.120 98.223 61.013 1.00 55.93 ? 350 LEU A C 1 ATOM 2334 O O . LEU A 1 291 ? 22.419 97.760 62.115 1.00 43.67 ? 350 LEU A O 1 ATOM 2335 C CB . LEU A 1 291 ? 21.024 100.475 61.036 1.00 26.97 ? 350 LEU A CB 1 ATOM 2336 C CG . LEU A 1 291 ? 21.168 101.986 61.231 1.00 51.45 ? 350 LEU A CG 1 ATOM 2337 C CD1 . LEU A 1 291 ? 19.802 102.648 61.331 1.00 36.43 ? 350 LEU A CD1 1 ATOM 2338 C CD2 . LEU A 1 291 ? 22.007 102.288 62.464 1.00 35.33 ? 350 LEU A CD2 1 ATOM 2339 N N . ASP A 1 292 ? 21.622 97.484 60.027 1.00 49.26 ? 351 ASP A N 1 ATOM 2340 C CA . ASP A 1 292 ? 21.491 96.035 60.138 1.00 48.31 ? 351 ASP A CA 1 ATOM 2341 C C . ASP A 1 292 ? 22.863 95.376 60.214 1.00 40.22 ? 351 ASP A C 1 ATOM 2342 O O . ASP A 1 292 ? 23.091 94.490 61.038 1.00 43.93 ? 351 ASP A O 1 ATOM 2343 C CB . ASP A 1 292 ? 20.700 95.471 58.956 1.00 31.41 ? 351 ASP A CB 1 ATOM 2344 C CG . ASP A 1 292 ? 19.235 95.857 58.999 1.00 45.52 ? 351 ASP A CG 1 ATOM 2345 O OD1 . ASP A 1 292 ? 18.754 96.250 60.082 1.00 31.54 ? 351 ASP A OD1 1 ATOM 2346 O OD2 . ASP A 1 292 ? 18.566 95.765 57.948 1.00 50.28 ? 351 ASP A OD2 1 ATOM 2347 N N . LEU A 1 293 ? 23.766 95.812 59.341 1.00 37.35 ? 352 LEU A N 1 ATOM 2348 C CA . LEU A 1 293 ? 25.124 95.280 59.290 1.00 40.80 ? 352 LEU A CA 1 ATOM 2349 C C . LEU A 1 293 ? 25.844 95.465 60.623 1.00 41.21 ? 352 LEU A C 1 ATOM 2350 O O . LEU A 1 293 ? 26.590 94.592 61.062 1.00 35.00 ? 352 LEU A O 1 ATOM 2351 C CB . LEU A 1 293 ? 25.916 95.945 58.164 1.00 42.00 ? 352 LEU A CB 1 ATOM 2352 C CG . LEU A 1 293 ? 27.311 95.381 57.885 1.00 40.78 ? 352 LEU A CG 1 ATOM 2353 C CD1 . LEU A 1 293 ? 27.498 95.138 56.398 1.00 48.24 ? 352 LEU A CD1 1 ATOM 2354 C CD2 . LEU A 1 293 ? 28.382 96.320 58.409 1.00 36.74 ? 352 LEU A CD2 1 ATOM 2355 N N . VAL A 1 294 ? 25.622 96.610 61.258 1.00 36.39 ? 353 VAL A N 1 ATOM 2356 C CA . VAL A 1 294 ? 26.198 96.874 62.570 1.00 43.26 ? 353 VAL A CA 1 ATOM 2357 C C . VAL A 1 294 ? 25.555 95.962 63.611 1.00 41.29 ? 353 VAL A C 1 ATOM 2358 O O . VAL A 1 294 ? 26.238 95.399 64.467 1.00 42.78 ? 353 VAL A O 1 ATOM 2359 C CB . VAL A 1 294 ? 26.020 98.350 62.983 1.00 38.92 ? 353 VAL A CB 1 ATOM 2360 C CG1 . VAL A 1 294 ? 26.441 98.560 64.430 1.00 25.01 ? 353 VAL A CG1 1 ATOM 2361 C CG2 . VAL A 1 294 ? 26.821 99.254 62.059 1.00 33.29 ? 353 VAL A CG2 1 ATOM 2362 N N . ASP A 1 295 ? 24.237 95.811 63.517 1.00 41.17 ? 354 ASP A N 1 ATOM 2363 C CA . ASP A 1 295 ? 23.486 94.960 64.435 1.00 41.76 ? 354 ASP A CA 1 ATOM 2364 C C . ASP A 1 295 ? 23.941 93.504 64.372 1.00 57.02 ? 354 ASP A C 1 ATOM 2365 O O . ASP A 1 295 ? 24.158 92.866 65.403 1.00 43.50 ? 354 ASP A O 1 ATOM 2366 C CB . ASP A 1 295 ? 21.988 95.042 64.130 1.00 43.33 ? 354 ASP A CB 1 ATOM 2367 C CG . ASP A 1 295 ? 21.284 96.111 64.942 1.00 53.53 ? 354 ASP A CG 1 ATOM 2368 O OD1 . ASP A 1 295 ? 21.916 96.677 65.857 1.00 36.96 ? 354 ASP A OD1 1 ATOM 2369 O OD2 . ASP A 1 295 ? 20.095 96.379 64.669 1.00 41.14 ? 354 ASP A OD2 1 ATOM 2370 N N . ILE A 1 296 ? 24.087 92.988 63.156 1.00 37.32 ? 355 ILE A N 1 ATOM 2371 C CA . ILE A 1 296 ? 24.431 91.587 62.950 1.00 40.60 ? 355 ILE A CA 1 ATOM 2372 C C . ILE A 1 296 ? 25.893 91.303 63.312 1.00 56.21 ? 355 ILE A C 1 ATOM 2373 O O . ILE A 1 296 ? 26.227 90.199 63.745 1.00 31.64 ? 355 ILE A O 1 ATOM 2374 C CB . ILE A 1 296 ? 24.145 91.153 61.490 1.00 32.31 ? 355 ILE A CB 1 ATOM 2375 C CG1 . ILE A 1 296 ? 24.192 89.631 61.351 1.00 44.37 ? 355 ILE A CG1 1 ATOM 2376 C CG2 . ILE A 1 296 ? 25.096 91.825 60.511 1.00 42.76 ? 355 ILE A CG2 1 ATOM 2377 C CD1 . ILE A 1 296 ? 23.772 89.144 59.984 1.00 49.27 ? 355 ILE A CD1 1 ATOM 2378 N N . HIS A 1 297 ? 26.760 92.297 63.141 1.00 40.78 ? 356 HIS A N 1 ATOM 2379 C CA . HIS A 1 297 ? 28.162 92.151 63.514 1.00 35.10 ? 356 HIS A CA 1 ATOM 2380 C C . HIS A 1 297 ? 28.354 92.252 65.023 1.00 42.49 ? 356 HIS A C 1 ATOM 2381 O O . HIS A 1 297 ? 29.309 91.702 65.571 1.00 34.02 ? 356 HIS A O 1 ATOM 2382 C CB . HIS A 1 297 ? 29.026 93.194 62.802 1.00 34.32 ? 356 HIS A CB 1 ATOM 2383 C CG . HIS A 1 297 ? 29.543 92.740 61.473 1.00 46.25 ? 356 HIS A CG 1 ATOM 2384 N ND1 . HIS A 1 297 ? 30.826 92.272 61.296 1.00 30.96 ? 356 HIS A ND1 1 ATOM 2385 C CD2 . HIS A 1 297 ? 28.947 92.675 60.259 1.00 32.68 ? 356 HIS A CD2 1 ATOM 2386 C CE1 . HIS A 1 297 ? 31.001 91.941 60.029 1.00 40.25 ? 356 HIS A CE1 1 ATOM 2387 N NE2 . HIS A 1 297 ? 29.877 92.177 59.378 1.00 43.61 ? 356 HIS A NE2 1 ATOM 2388 N N . ILE A 1 298 ? 27.446 92.954 65.693 1.00 39.29 ? 357 ILE A N 1 ATOM 2389 C CA . ILE A 1 298 ? 27.445 92.988 67.149 1.00 48.23 ? 357 ILE A CA 1 ATOM 2390 C C . ILE A 1 298 ? 27.102 91.596 67.670 1.00 49.49 ? 357 ILE A C 1 ATOM 2391 O O . ILE A 1 298 ? 27.713 91.104 68.619 1.00 40.57 ? 357 ILE A O 1 ATOM 2392 C CB . ILE A 1 298 ? 26.445 94.029 67.699 1.00 39.45 ? 357 ILE A CB 1 ATOM 2393 C CG1 . ILE A 1 298 ? 27.024 95.439 67.575 1.00 36.10 ? 357 ILE A CG1 1 ATOM 2394 C CG2 . ILE A 1 298 ? 26.094 93.735 69.151 1.00 36.38 ? 357 ILE A CG2 1 ATOM 2395 C CD1 . ILE A 1 298 ? 26.085 96.525 68.048 1.00 41.91 ? 357 ILE A CD1 1 ATOM 2396 N N . LEU A 1 299 ? 26.131 90.960 67.022 1.00 34.35 ? 358 LEU A N 1 ATOM 2397 C CA . LEU A 1 299 ? 25.739 89.598 67.359 1.00 41.87 ? 358 LEU A CA 1 ATOM 2398 C C . LEU A 1 299 ? 26.885 88.628 67.087 1.00 49.36 ? 358 LEU A C 1 ATOM 2399 O O . LEU A 1 299 ? 27.231 87.804 67.934 1.00 30.05 ? 358 LEU A O 1 ATOM 2400 C CB . LEU A 1 299 ? 24.496 89.187 66.567 1.00 27.54 ? 358 LEU A CB 1 ATOM 2401 C CG . LEU A 1 299 ? 23.955 87.775 66.803 1.00 29.74 ? 358 LEU A CG 1 ATOM 2402 C CD1 . LEU A 1 299 ? 23.399 87.638 68.212 1.00 36.21 ? 358 LEU A CD1 1 ATOM 2403 C CD2 . LEU A 1 299 ? 22.897 87.424 65.770 1.00 28.76 ? 358 LEU A CD2 1 ATOM 2404 N N . ASP A 1 300 ? 27.472 88.738 65.899 1.00 32.84 ? 359 ASP A N 1 ATOM 2405 C CA . ASP A 1 300 ? 28.571 87.868 65.493 1.00 26.09 ? 359 ASP A CA 1 ATOM 2406 C C . ASP A 1 300 ? 29.803 88.033 66.381 1.00 42.16 ? 359 ASP A C 1 ATOM 2407 O O . ASP A 1 300 ? 30.525 87.069 66.635 1.00 35.97 ? 359 ASP A O 1 ATOM 2408 C CB . ASP A 1 300 ? 28.942 88.129 64.032 1.00 26.06 ? 359 ASP A CB 1 ATOM 2409 C CG . ASP A 1 300 ? 27.921 87.565 63.063 1.00 38.81 ? 359 ASP A CG 1 ATOM 2410 O OD1 . ASP A 1 300 ? 27.131 86.688 63.472 1.00 30.82 ? 359 ASP A OD1 1 ATOM 2411 O OD2 . ASP A 1 300 ? 27.910 87.997 61.891 1.00 36.21 ? 359 ASP A OD2 1 ATOM 2412 N N . TYR A 1 301 ? 30.046 89.253 66.849 1.00 33.05 ? 360 TYR A N 1 ATOM 2413 C CA . TYR A 1 301 ? 31.188 89.510 67.720 1.00 33.83 ? 360 TYR A CA 1 ATOM 2414 C C . TYR A 1 301 ? 30.967 88.913 69.105 1.00 36.09 ? 360 TYR A C 1 ATOM 2415 O O . TYR A 1 301 ? 31.900 88.401 69.725 1.00 34.75 ? 360 TYR A O 1 ATOM 2416 C CB . TYR A 1 301 ? 31.462 91.010 67.834 1.00 41.92 ? 360 TYR A CB 1 ATOM 2417 C CG . TYR A 1 301 ? 32.577 91.343 68.799 1.00 47.56 ? 360 TYR A CG 1 ATOM 2418 C CD1 . TYR A 1 301 ? 33.898 91.050 68.490 1.00 40.38 ? 360 TYR A CD1 1 ATOM 2419 C CD2 . TYR A 1 301 ? 32.308 91.945 70.020 1.00 44.42 ? 360 TYR A CD2 1 ATOM 2420 C CE1 . TYR A 1 301 ? 34.920 91.348 69.370 1.00 25.10 ? 360 TYR A CE1 1 ATOM 2421 C CE2 . TYR A 1 301 ? 33.324 92.248 70.906 1.00 40.53 ? 360 TYR A CE2 1 ATOM 2422 C CZ . TYR A 1 301 ? 34.628 91.947 70.576 1.00 44.29 ? 360 TYR A CZ 1 ATOM 2423 O OH . TYR A 1 301 ? 35.643 92.247 71.455 1.00 50.58 ? 360 TYR A OH 1 ATOM 2424 N N . LEU A 1 302 ? 29.729 88.984 69.585 1.00 44.33 ? 361 LEU A N 1 ATOM 2425 C CA . LEU A 1 302 ? 29.375 88.415 70.880 1.00 33.76 ? 361 LEU A CA 1 ATOM 2426 C C . LEU A 1 302 ? 29.544 86.900 70.880 1.00 43.11 ? 361 LEU A C 1 ATOM 2427 O O . LEU A 1 302 ? 29.897 86.305 71.898 1.00 37.64 ? 361 LEU A O 1 ATOM 2428 C CB . LEU A 1 302 ? 27.937 88.781 71.256 1.00 33.65 ? 361 LEU A CB 1 ATOM 2429 C CG . LEU A 1 302 ? 27.664 90.215 71.715 1.00 44.66 ? 361 LEU A CG 1 ATOM 2430 C CD1 . LEU A 1 302 ? 26.169 90.491 71.731 1.00 25.82 ? 361 LEU A CD1 1 ATOM 2431 C CD2 . LEU A 1 302 ? 28.273 90.469 73.087 1.00 25.61 ? 361 LEU A CD2 1 ATOM 2432 N N . ILE A 1 303 ? 29.292 86.281 69.731 1.00 31.12 ? 362 ILE A N 1 ATOM 2433 C CA . ILE A 1 303 ? 29.366 84.830 69.607 1.00 41.82 ? 362 ILE A CA 1 ATOM 2434 C C . ILE A 1 303 ? 30.661 84.365 68.945 1.00 51.14 ? 362 ILE A C 1 ATOM 2435 O O . ILE A 1 303 ? 30.921 83.165 68.853 1.00 41.60 ? 362 ILE A O 1 ATOM 2436 C CB . ILE A 1 303 ? 28.174 84.281 68.804 1.00 35.54 ? 362 ILE A CB 1 ATOM 2437 C CG1 . ILE A 1 303 ? 28.271 84.723 67.344 1.00 31.77 ? 362 ILE A CG1 1 ATOM 2438 C CG2 . ILE A 1 303 ? 26.867 84.753 69.408 1.00 28.08 ? 362 ILE A CG2 1 ATOM 2439 C CD1 . ILE A 1 303 ? 27.002 84.491 66.548 1.00 41.07 ? 362 ILE A CD1 1 ATOM 2440 N N . GLY A 1 304 ? 31.470 85.314 68.485 1.00 28.77 ? 363 GLY A N 1 ATOM 2441 C CA . GLY A 1 304 ? 32.732 84.991 67.842 1.00 25.97 ? 363 GLY A CA 1 ATOM 2442 C C . GLY A 1 304 ? 32.580 84.387 66.456 1.00 34.01 ? 363 GLY A C 1 ATOM 2443 O O . GLY A 1 304 ? 33.433 83.619 66.010 1.00 35.87 ? 363 GLY A O 1 ATOM 2444 N N . ASN A 1 305 ? 31.492 84.731 65.774 1.00 38.10 ? 364 ASN A N 1 ATOM 2445 C CA . ASN A 1 305 ? 31.243 84.244 64.421 1.00 26.27 ? 364 ASN A CA 1 ATOM 2446 C C . ASN A 1 305 ? 32.026 85.036 63.379 1.00 41.01 ? 364 ASN A C 1 ATOM 2447 O O . ASN A 1 305 ? 31.817 86.237 63.213 1.00 40.21 ? 364 ASN A O 1 ATOM 2448 C CB . ASN A 1 305 ? 29.749 84.299 64.100 1.00 37.78 ? 364 ASN A CB 1 ATOM 2449 C CG . ASN A 1 305 ? 29.441 83.868 62.678 1.00 28.45 ? 364 ASN A CG 1 ATOM 2450 O OD1 . ASN A 1 305 ? 30.138 83.031 62.104 1.00 29.95 ? 364 ASN A OD1 1 ATOM 2451 N ND2 . ASN A 1 305 ? 28.392 84.442 62.101 1.00 39.12 ? 364 ASN A ND2 1 ATOM 2452 N N . GLN A 1 306 ? 32.925 84.354 62.675 1.00 33.88 ? 365 GLN A N 1 ATOM 2453 C CA . GLN A 1 306 ? 33.771 85.000 61.678 1.00 40.22 ? 365 GLN A CA 1 ATOM 2454 C C . GLN A 1 306 ? 33.252 84.814 60.253 1.00 33.02 ? 365 GLN A C 1 ATOM 2455 O O . GLN A 1 306 ? 33.729 85.464 59.326 1.00 32.95 ? 365 GLN A O 1 ATOM 2456 C CB . GLN A 1 306 ? 35.200 84.456 61.767 1.00 25.95 ? 365 GLN A CB 1 ATOM 2457 C CG . GLN A 1 306 ? 35.867 84.626 63.122 1.00 30.26 ? 365 GLN A CG 1 ATOM 2458 C CD . GLN A 1 306 ? 37.248 83.992 63.168 1.00 38.68 ? 365 GLN A CD 1 ATOM 2459 O OE1 . GLN A 1 306 ? 37.427 82.837 62.781 1.00 29.91 ? 365 GLN A OE1 1 ATOM 2460 N NE2 . GLN A 1 306 ? 38.232 84.747 63.642 1.00 29.33 ? 365 GLN A NE2 1 ATOM 2461 N N . ASP A 1 307 ? 32.272 83.932 60.083 1.00 38.46 ? 366 ASP A N 1 ATOM 2462 C CA . ASP A 1 307 ? 31.895 83.463 58.750 1.00 38.80 ? 366 ASP A CA 1 ATOM 2463 C C . ASP A 1 307 ? 30.726 84.229 58.124 1.00 36.28 ? 366 ASP A C 1 ATOM 2464 O O . ASP A 1 307 ? 29.906 83.646 57.415 1.00 59.39 ? 366 ASP A O 1 ATOM 2465 C CB . ASP A 1 307 ? 31.557 81.970 58.809 1.00 44.63 ? 366 ASP A CB 1 ATOM 2466 C CG . ASP A 1 307 ? 31.687 81.287 57.460 1.00 44.02 ? 366 ASP A CG 1 ATOM 2467 O OD1 . ASP A 1 307 ? 32.439 81.796 56.603 1.00 49.10 ? 366 ASP A OD1 1 ATOM 2468 O OD2 . ASP A 1 307 ? 31.034 80.243 57.256 1.00 53.78 ? 366 ASP A OD2 1 ATOM 2469 N N . ARG A 1 308 ? 30.645 85.530 58.387 1.00 29.04 ? 367 ARG A N 1 ATOM 2470 C CA . ARG A 1 308 ? 29.570 86.345 57.825 1.00 30.77 ? 367 ARG A CA 1 ATOM 2471 C C . ARG A 1 308 ? 29.978 86.958 56.483 1.00 47.03 ? 367 ARG A C 1 ATOM 2472 O O . ARG A 1 308 ? 30.341 88.131 56.410 1.00 41.67 ? 367 ARG A O 1 ATOM 2473 C CB . ARG A 1 308 ? 29.158 87.440 58.810 1.00 31.62 ? 367 ARG A CB 1 ATOM 2474 C CG . ARG A 1 308 ? 27.891 88.184 58.416 1.00 34.43 ? 367 ARG A CG 1 ATOM 2475 C CD . ARG A 1 308 ? 26.670 87.289 58.560 1.00 35.77 ? 367 ARG A CD 1 ATOM 2476 N NE . ARG A 1 308 ? 26.407 86.941 59.953 1.00 42.26 ? 367 ARG A NE 1 ATOM 2477 C CZ . ARG A 1 308 ? 25.408 86.161 60.351 1.00 35.58 ? 367 ARG A CZ 1 ATOM 2478 N NH1 . ARG A 1 308 ? 24.573 85.645 59.460 1.00 38.73 ? 367 ARG A NH1 1 ATOM 2479 N NH2 . ARG A 1 308 ? 25.244 85.898 61.639 1.00 36.62 ? 367 ARG A NH2 1 ATOM 2480 N N . HIS A 1 309 ? 29.921 86.154 55.425 1.00 46.93 ? 368 HIS A N 1 ATOM 2481 C CA . HIS A 1 309 ? 30.344 86.597 54.099 1.00 46.09 ? 368 HIS A CA 1 ATOM 2482 C C . HIS A 1 309 ? 29.195 87.118 53.236 1.00 42.17 ? 368 HIS A C 1 ATOM 2483 O O . HIS A 1 309 ? 29.403 87.954 52.357 1.00 42.68 ? 368 HIS A O 1 ATOM 2484 C CB . HIS A 1 309 ? 31.059 85.458 53.369 1.00 36.46 ? 368 HIS A CB 1 ATOM 2485 C CG . HIS A 1 309 ? 30.297 84.169 53.366 1.00 42.34 ? 368 HIS A CG 1 ATOM 2486 N ND1 . HIS A 1 309 ? 29.346 83.867 52.415 1.00 44.07 ? 368 HIS A ND1 1 ATOM 2487 C CD2 . HIS A 1 309 ? 30.343 83.104 54.202 1.00 30.59 ? 368 HIS A CD2 1 ATOM 2488 C CE1 . HIS A 1 309 ? 28.842 82.671 52.662 1.00 38.85 ? 368 HIS A CE1 1 ATOM 2489 N NE2 . HIS A 1 309 ? 29.430 82.187 53.742 1.00 46.75 ? 368 HIS A NE2 1 ATOM 2490 N N . HIS A 1 310 ? 27.990 86.613 53.475 1.00 52.70 ? 369 HIS A N 1 ATOM 2491 C CA . HIS A 1 310 ? 26.821 87.046 52.716 1.00 33.95 ? 369 HIS A CA 1 ATOM 2492 C C . HIS A 1 310 ? 25.641 87.349 53.633 1.00 40.31 ? 369 HIS A C 1 ATOM 2493 O O . HIS A 1 310 ? 25.599 86.893 54.775 1.00 37.31 ? 369 HIS A O 1 ATOM 2494 C CB . HIS A 1 310 ? 26.424 85.985 51.686 1.00 48.38 ? 369 HIS A CB 1 ATOM 2495 C CG . HIS A 1 310 ? 27.238 86.024 50.429 1.00 69.96 ? 369 HIS A CG 1 ATOM 2496 N ND1 . HIS A 1 310 ? 28.607 85.870 50.423 1.00 82.78 ? 369 HIS A ND1 1 ATOM 2497 C CD2 . HIS A 1 310 ? 26.874 86.204 49.137 1.00 71.09 ? 369 HIS A CD2 1 ATOM 2498 C CE1 . HIS A 1 310 ? 29.052 85.950 49.182 1.00 77.77 ? 369 HIS A CE1 1 ATOM 2499 N NE2 . HIS A 1 310 ? 28.021 86.152 48.382 1.00 71.84 ? 369 HIS A NE2 1 ATOM 2500 N N . PHE A 1 311 ? 24.682 88.120 53.130 1.00 54.78 ? 370 PHE A N 1 ATOM 2501 C CA . PHE A 1 311 ? 23.458 88.385 53.875 1.00 45.16 ? 370 PHE A CA 1 ATOM 2502 C C . PHE A 1 311 ? 22.244 87.776 53.189 1.00 39.16 ? 370 PHE A C 1 ATOM 2503 O O . PHE A 1 311 ? 22.186 87.686 51.963 1.00 42.00 ? 370 PHE A O 1 ATOM 2504 C CB . PHE A 1 311 ? 23.246 89.889 54.059 1.00 37.87 ? 370 PHE A CB 1 ATOM 2505 C CG . PHE A 1 311 ? 24.307 90.553 54.883 1.00 44.97 ? 370 PHE A CG 1 ATOM 2506 C CD1 . PHE A 1 311 ? 24.369 90.344 56.250 1.00 46.21 ? 370 PHE A CD1 1 ATOM 2507 C CD2 . PHE A 1 311 ? 25.233 91.399 54.296 1.00 41.63 ? 370 PHE A CD2 1 ATOM 2508 C CE1 . PHE A 1 311 ? 25.342 90.954 57.015 1.00 54.04 ? 370 PHE A CE1 1 ATOM 2509 C CE2 . PHE A 1 311 ? 26.207 92.014 55.057 1.00 34.52 ? 370 PHE A CE2 1 ATOM 2510 C CZ . PHE A 1 311 ? 26.262 91.790 56.418 1.00 45.03 ? 370 PHE A CZ 1 ATOM 2511 N N . GLU A 1 312 ? 21.271 87.365 53.994 1.00 43.71 ? 371 GLU A N 1 ATOM 2512 C CA . GLU A 1 312 ? 20.049 86.772 53.476 1.00 41.18 ? 371 GLU A CA 1 ATOM 2513 C C . GLU A 1 312 ? 18.865 87.627 53.909 1.00 46.88 ? 371 GLU A C 1 ATOM 2514 O O . GLU A 1 312 ? 18.778 88.036 55.066 1.00 51.22 ? 371 GLU A O 1 ATOM 2515 C CB . GLU A 1 312 ? 19.895 85.332 53.972 1.00 50.39 ? 371 GLU A CB 1 ATOM 2516 C CG . GLU A 1 312 ? 18.789 84.550 53.291 1.00 56.28 ? 371 GLU A CG 1 ATOM 2517 C CD . GLU A 1 312 ? 19.269 83.868 52.024 1.00 64.12 ? 371 GLU A CD 1 ATOM 2518 O OE1 . GLU A 1 312 ? 18.486 83.110 51.420 1.00 63.23 ? 371 GLU A OE1 1 ATOM 2519 O OE2 . GLU A 1 312 ? 20.432 84.095 51.631 1.00 75.24 ? 371 GLU A OE2 1 ATOM 2520 N N . SER A 1 313 ? 17.954 87.896 52.982 1.00 46.39 ? 372 SER A N 1 ATOM 2521 C CA . SER A 1 313 ? 16.822 88.766 53.273 1.00 53.76 ? 372 SER A CA 1 ATOM 2522 C C . SER A 1 313 ? 15.579 88.375 52.488 1.00 56.71 ? 372 SER A C 1 ATOM 2523 O O . SER A 1 313 ? 15.673 87.907 51.355 1.00 48.17 ? 372 SER A O 1 ATOM 2524 C CB . SER A 1 313 ? 17.186 90.221 52.971 1.00 48.05 ? 372 SER A CB 1 ATOM 2525 O OG . SER A 1 313 ? 17.692 90.355 51.654 1.00 59.79 ? 372 SER A OG 1 ATOM 2526 N N . PHE A 1 314 ? 14.413 88.572 53.094 1.00 58.88 ? 373 PHE A N 1 ATOM 2527 C CA . PHE A 1 314 ? 13.157 88.380 52.383 1.00 47.46 ? 373 PHE A CA 1 ATOM 2528 C C . PHE A 1 314 ? 12.994 89.467 51.330 1.00 58.11 ? 373 PHE A C 1 ATOM 2529 O O . PHE A 1 314 ? 13.391 90.613 51.542 1.00 59.06 ? 373 PHE A O 1 ATOM 2530 C CB . PHE A 1 314 ? 11.966 88.405 53.346 1.00 38.13 ? 373 PHE A CB 1 ATOM 2531 C CG . PHE A 1 314 ? 11.961 87.284 54.347 1.00 48.50 ? 373 PHE A CG 1 ATOM 2532 C CD1 . PHE A 1 314 ? 11.852 85.966 53.933 1.00 39.16 ? 373 PHE A CD1 1 ATOM 2533 C CD2 . PHE A 1 314 ? 12.045 87.551 55.704 1.00 39.62 ? 373 PHE A CD2 1 ATOM 2534 C CE1 . PHE A 1 314 ? 11.838 84.935 54.855 1.00 35.69 ? 373 PHE A CE1 1 ATOM 2535 C CE2 . PHE A 1 314 ? 12.031 86.525 56.630 1.00 32.94 ? 373 PHE A CE2 1 ATOM 2536 C CZ . PHE A 1 314 ? 11.929 85.216 56.204 1.00 35.83 ? 373 PHE A CZ 1 ATOM 2537 N N . ASN A 1 315 ? 12.415 89.104 50.193 1.00 68.94 ? 374 ASN A N 1 ATOM 2538 C CA . ASN A 1 315 ? 12.113 90.074 49.152 1.00 69.40 ? 374 ASN A CA 1 ATOM 2539 C C . ASN A 1 315 ? 10.651 89.945 48.749 1.00 64.01 ? 374 ASN A C 1 ATOM 2540 O O . ASN A 1 315 ? 10.334 89.510 47.642 1.00 52.73 ? 374 ASN A O 1 ATOM 2541 C CB . ASN A 1 315 ? 13.029 89.873 47.943 1.00 68.91 ? 374 ASN A CB 1 ATOM 2542 C CG . ASN A 1 315 ? 12.991 91.044 46.982 1.00 64.65 ? 374 ASN A CG 1 ATOM 2543 O OD1 . ASN A 1 315 ? 12.606 92.154 47.352 1.00 67.07 ? 374 ASN A OD1 1 ATOM 2544 N ND2 . ASN A 1 315 ? 13.395 90.803 45.741 1.00 50.84 ? 374 ASN A ND2 1 ATOM 2545 N N . VAL A 1 316 ? 9.764 90.325 49.662 1.00 60.98 ? 375 VAL A N 1 ATOM 2546 C CA . VAL A 1 316 ? 8.345 90.037 49.512 1.00 79.86 ? 375 VAL A CA 1 ATOM 2547 C C . VAL A 1 316 ? 7.473 91.247 49.860 1.00 78.74 ? 375 VAL A C 1 ATOM 2548 O O . VAL A 1 316 ? 6.376 91.405 49.323 1.00 85.18 ? 375 VAL A O 1 ATOM 2549 C CB . VAL A 1 316 ? 7.939 88.824 50.391 1.00 61.20 ? 375 VAL A CB 1 ATOM 2550 C CG1 . VAL A 1 316 ? 8.152 89.122 51.872 1.00 53.03 ? 375 VAL A CG1 1 ATOM 2551 C CG2 . VAL A 1 316 ? 6.503 88.405 50.114 1.00 67.22 ? 375 VAL A CG2 1 ATOM 2552 N N . PHE A 1 317 ? 7.971 92.110 50.741 1.00 66.53 ? 376 PHE A N 1 ATOM 2553 C CA . PHE A 1 317 ? 7.246 93.321 51.101 1.00 65.02 ? 376 PHE A CA 1 ATOM 2554 C C . PHE A 1 317 ? 7.562 94.446 50.125 1.00 87.24 ? 376 PHE A C 1 ATOM 2555 O O . PHE A 1 317 ? 8.638 95.041 50.188 1.00 98.12 ? 376 PHE A O 1 ATOM 2556 C CB . PHE A 1 317 ? 7.582 93.762 52.530 1.00 66.09 ? 376 PHE A CB 1 ATOM 2557 C CG . PHE A 1 317 ? 7.163 92.781 53.587 1.00 80.69 ? 376 PHE A CG 1 ATOM 2558 C CD1 . PHE A 1 317 ? 8.094 91.953 54.191 1.00 81.14 ? 376 PHE A CD1 1 ATOM 2559 C CD2 . PHE A 1 317 ? 5.838 92.690 53.979 1.00 79.80 ? 376 PHE A CD2 1 ATOM 2560 C CE1 . PHE A 1 317 ? 7.710 91.050 55.167 1.00 77.42 ? 376 PHE A CE1 1 ATOM 2561 C CE2 . PHE A 1 317 ? 5.448 91.790 54.953 1.00 78.93 ? 376 PHE A CE2 1 ATOM 2562 C CZ . PHE A 1 317 ? 6.385 90.969 55.548 1.00 83.37 ? 376 PHE A CZ 1 ATOM 2563 N N . ASN A 1 318 ? 6.629 94.723 49.218 1.00 102.40 ? 377 ASN A N 1 ATOM 2564 C CA . ASN A 1 318 ? 6.822 95.752 48.203 1.00 112.02 ? 377 ASN A CA 1 ATOM 2565 C C . ASN A 1 318 ? 7.159 97.098 48.839 1.00 106.97 ? 377 ASN A C 1 ATOM 2566 O O . ASN A 1 318 ? 6.712 97.387 49.950 1.00 100.17 ? 377 ASN A O 1 ATOM 2567 C CB . ASN A 1 318 ? 5.577 95.875 47.325 1.00 123.20 ? 377 ASN A CB 1 ATOM 2568 C CG . ASN A 1 318 ? 5.301 94.616 46.524 1.00 132.84 ? 377 ASN A CG 1 ATOM 2569 O OD1 . ASN A 1 318 ? 6.218 93.866 46.194 1.00 134.82 ? 377 ASN A OD1 1 ATOM 2570 N ND2 . ASN A 1 318 ? 4.033 94.379 46.208 1.00 133.70 ? 377 ASN A ND2 1 ATOM 2571 N N . ASP A 1 319 ? 7.962 97.899 48.138 1.00 110.06 ? 378 ASP A N 1 ATOM 2572 C CA . ASP A 1 319 ? 8.335 99.244 48.585 1.00 111.84 ? 378 ASP A CA 1 ATOM 2573 C C . ASP A 1 319 ? 9.207 99.207 49.841 1.00 104.81 ? 378 ASP A C 1 ATOM 2574 O O . ASP A 1 319 ? 10.414 99.442 49.758 1.00 114.68 ? 378 ASP A O 1 ATOM 2575 C CB . ASP A 1 319 ? 7.093 100.111 48.818 1.00 114.03 ? 378 ASP A CB 1 ATOM 2576 C CG . ASP A 1 319 ? 6.393 100.482 47.526 1.00 115.16 ? 378 ASP A CG 1 ATOM 2577 O OD1 . ASP A 1 319 ? 7.051 100.453 46.465 1.00 101.96 ? 378 ASP A OD1 1 ATOM 2578 O OD2 . ASP A 1 319 ? 5.188 100.805 47.571 1.00 130.40 ? 378 ASP A OD2 1 ATOM 2579 N N . LEU A 1 320 ? 8.581 98.956 50.993 1.00 86.27 ? 379 LEU A N 1 ATOM 2580 C CA . LEU A 1 320 ? 9.260 98.870 52.295 1.00 84.16 ? 379 LEU A CA 1 ATOM 2581 C C . LEU A 1 320 ? 10.662 98.248 52.259 1.00 72.72 ? 379 LEU A C 1 ATOM 2582 O O . LEU A 1 320 ? 10.936 97.362 51.447 1.00 64.04 ? 379 LEU A O 1 ATOM 2583 C CB . LEU A 1 320 ? 8.391 98.072 53.273 1.00 69.24 ? 379 LEU A CB 1 ATOM 2584 C CG . LEU A 1 320 ? 6.991 98.608 53.576 1.00 72.15 ? 379 LEU A CG 1 ATOM 2585 C CD1 . LEU A 1 320 ? 6.389 97.855 54.750 1.00 67.35 ? 379 LEU A CD1 1 ATOM 2586 C CD2 . LEU A 1 320 ? 7.038 100.102 53.858 1.00 76.75 ? 379 LEU A CD2 1 ATOM 2587 N N . PRO A 1 321 ? 11.542 98.684 53.175 1.00 62.88 ? 380 PRO A N 1 ATOM 2588 C CA . PRO A 1 321 ? 12.913 98.162 53.205 1.00 64.41 ? 380 PRO A CA 1 ATOM 2589 C C . PRO A 1 321 ? 13.013 96.776 53.830 1.00 51.01 ? 380 PRO A C 1 ATOM 2590 O O . PRO A 1 321 ? 12.340 96.491 54.820 1.00 50.13 ? 380 PRO A O 1 ATOM 2591 C CB . PRO A 1 321 ? 13.657 99.193 54.058 1.00 48.34 ? 380 PRO A CB 1 ATOM 2592 C CG . PRO A 1 321 ? 12.613 99.750 54.959 1.00 44.67 ? 380 PRO A CG 1 ATOM 2593 C CD . PRO A 1 321 ? 11.343 99.770 54.152 1.00 50.04 ? 380 PRO A CD 1 ATOM 2594 N N . SER A 1 322 ? 13.852 95.926 53.247 1.00 57.87 ? 381 SER A N 1 ATOM 2595 C CA . SER A 1 322 ? 14.083 94.588 53.774 1.00 53.40 ? 381 SER A CA 1 ATOM 2596 C C . SER A 1 322 ? 15.147 94.614 54.864 1.00 64.40 ? 381 SER A C 1 ATOM 2597 O O . SER A 1 322 ? 15.876 95.595 55.011 1.00 57.83 ? 381 SER A O 1 ATOM 2598 C CB . SER A 1 322 ? 14.495 93.630 52.654 1.00 47.69 ? 381 SER A CB 1 ATOM 2599 O OG . SER A 1 322 ? 15.593 94.145 51.920 1.00 59.75 ? 381 SER A OG 1 ATOM 2600 N N . TYR A 1 323 ? 15.233 93.529 55.624 1.00 60.50 ? 382 TYR A N 1 ATOM 2601 C CA . TYR A 1 323 ? 16.239 93.407 56.669 1.00 59.75 ? 382 TYR A CA 1 ATOM 2602 C C . TYR A 1 323 ? 17.021 92.111 56.519 1.00 45.69 ? 382 TYR A C 1 ATOM 2603 O O . TYR A 1 323 ? 16.534 91.149 55.926 1.00 53.07 ? 382 TYR A O 1 ATOM 2604 C CB . TYR A 1 323 ? 15.584 93.470 58.049 1.00 52.32 ? 382 TYR A CB 1 ATOM 2605 C CG . TYR A 1 323 ? 14.492 92.444 58.249 1.00 50.74 ? 382 TYR A CG 1 ATOM 2606 C CD1 . TYR A 1 323 ? 14.783 91.174 58.729 1.00 43.26 ? 382 TYR A CD1 1 ATOM 2607 C CD2 . TYR A 1 323 ? 13.169 92.745 57.956 1.00 57.16 ? 382 TYR A CD2 1 ATOM 2608 C CE1 . TYR A 1 323 ? 13.789 90.234 58.911 1.00 62.52 ? 382 TYR A CE1 1 ATOM 2609 C CE2 . TYR A 1 323 ? 12.167 91.812 58.135 1.00 61.70 ? 382 TYR A CE2 1 ATOM 2610 C CZ . TYR A 1 323 ? 12.482 90.558 58.613 1.00 61.27 ? 382 TYR A CZ 1 ATOM 2611 O OH . TYR A 1 323 ? 11.488 89.625 58.793 1.00 53.69 ? 382 TYR A OH 1 ATOM 2612 N N . ALA A 1 324 ? 18.231 92.085 57.067 1.00 47.60 ? 383 ALA A N 1 ATOM 2613 C CA . ALA A 1 324 ? 19.069 90.895 56.996 1.00 53.62 ? 383 ALA A CA 1 ATOM 2614 C C . ALA A 1 324 ? 18.590 89.837 57.981 1.00 41.85 ? 383 ALA A C 1 ATOM 2615 O O . ALA A 1 324 ? 18.453 90.102 59.175 1.00 44.95 ? 383 ALA A O 1 ATOM 2616 C CB . ALA A 1 324 ? 20.522 91.252 57.264 1.00 43.54 ? 383 ALA A CB 1 ATOM 2617 N N . ILE A 1 325 ? 18.330 88.638 57.472 1.00 49.23 ? 384 ILE A N 1 ATOM 2618 C CA . ILE A 1 325 ? 17.944 87.514 58.316 1.00 51.90 ? 384 ILE A CA 1 ATOM 2619 C C . ILE A 1 325 ? 19.159 86.928 59.026 1.00 50.54 ? 384 ILE A C 1 ATOM 2620 O O . ILE A 1 325 ? 20.138 86.544 58.385 1.00 48.17 ? 384 ILE A O 1 ATOM 2621 C CB . ILE A 1 325 ? 17.249 86.407 57.504 1.00 55.70 ? 384 ILE A CB 1 ATOM 2622 C CG1 . ILE A 1 325 ? 16.041 86.975 56.756 1.00 39.90 ? 384 ILE A CG1 1 ATOM 2623 C CG2 . ILE A 1 325 ? 16.822 85.268 58.416 1.00 46.27 ? 384 ILE A CG2 1 ATOM 2624 C CD1 . ILE A 1 325 ? 15.458 86.026 55.733 1.00 39.56 ? 384 ILE A CD1 1 ATOM 2625 N N . HIS A 1 326 ? 19.095 86.863 60.351 1.00 45.14 ? 385 HIS A N 1 ATOM 2626 C CA . HIS A 1 326 ? 20.197 86.325 61.135 1.00 39.11 ? 385 HIS A CA 1 ATOM 2627 C C . HIS A 1 326 ? 20.238 84.809 60.981 1.00 39.12 ? 385 HIS A C 1 ATOM 2628 O O . HIS A 1 326 ? 19.579 84.074 61.716 1.00 44.07 ? 385 HIS A O 1 ATOM 2629 C CB . HIS A 1 326 ? 20.063 86.727 62.605 1.00 34.36 ? 385 HIS A CB 1 ATOM 2630 C CG . HIS A 1 326 ? 20.126 88.206 62.832 1.00 49.07 ? 385 HIS A CG 1 ATOM 2631 N ND1 . HIS A 1 326 ? 19.850 88.785 64.052 1.00 50.37 ? 385 HIS A ND1 1 ATOM 2632 C CD2 . HIS A 1 326 ? 20.441 89.223 61.996 1.00 49.16 ? 385 HIS A CD2 1 ATOM 2633 C CE1 . HIS A 1 326 ? 19.989 90.095 63.956 1.00 38.05 ? 385 HIS A CE1 1 ATOM 2634 N NE2 . HIS A 1 326 ? 20.346 90.387 62.719 1.00 43.00 ? 385 HIS A NE2 1 ATOM 2635 N N . LEU A 1 327 ? 21.021 84.359 60.004 1.00 51.58 ? 386 LEU A N 1 ATOM 2636 C CA . LEU A 1 327 ? 21.096 82.950 59.643 1.00 44.47 ? 386 LEU A CA 1 ATOM 2637 C C . LEU A 1 327 ? 22.540 82.443 59.721 1.00 43.42 ? 386 LEU A C 1 ATOM 2638 O O . LEU A 1 327 ? 23.462 83.224 59.963 1.00 40.47 ? 386 LEU A O 1 ATOM 2639 C CB . LEU A 1 327 ? 20.531 82.762 58.229 1.00 45.86 ? 386 LEU A CB 1 ATOM 2640 C CG . LEU A 1 327 ? 20.171 81.391 57.652 1.00 60.01 ? 386 LEU A CG 1 ATOM 2641 C CD1 . LEU A 1 327 ? 19.378 80.569 58.654 1.00 73.17 ? 386 LEU A CD1 1 ATOM 2642 C CD2 . LEU A 1 327 ? 19.398 81.558 56.350 1.00 54.69 ? 386 LEU A CD2 1 ATOM 2643 N N . ASP A 1 328 ? 22.722 81.138 59.520 1.00 42.98 ? 387 ASP A N 1 ATOM 2644 C CA . ASP A 1 328 ? 24.045 80.514 59.422 1.00 43.57 ? 387 ASP A CA 1 ATOM 2645 C C . ASP A 1 328 ? 24.968 80.826 60.600 1.00 36.29 ? 387 ASP A C 1 ATOM 2646 O O . ASP A 1 328 ? 25.938 81.569 60.454 1.00 37.48 ? 387 ASP A O 1 ATOM 2647 C CB . ASP A 1 328 ? 24.725 80.940 58.118 1.00 42.53 ? 387 ASP A CB 1 ATOM 2648 C CG . ASP A 1 328 ? 23.983 80.454 56.890 1.00 56.17 ? 387 ASP A CG 1 ATOM 2649 O OD1 . ASP A 1 328 ? 23.182 79.503 57.014 1.00 67.05 ? 387 ASP A OD1 1 ATOM 2650 O OD2 . ASP A 1 328 ? 24.199 81.025 55.800 1.00 73.67 ? 387 ASP A OD2 1 ATOM 2651 N N . HIS A 1 329 ? 24.669 80.252 61.761 1.00 32.56 ? 388 HIS A N 1 ATOM 2652 C CA . HIS A 1 329 ? 25.469 80.496 62.959 1.00 38.07 ? 388 HIS A CA 1 ATOM 2653 C C . HIS A 1 329 ? 26.244 79.261 63.414 1.00 46.94 ? 388 HIS A C 1 ATOM 2654 O O . HIS A 1 329 ? 26.684 79.188 64.561 1.00 31.95 ? 388 HIS A O 1 ATOM 2655 C CB . HIS A 1 329 ? 24.579 80.994 64.098 1.00 27.37 ? 388 HIS A CB 1 ATOM 2656 C CG . HIS A 1 329 ? 23.799 82.225 63.758 1.00 37.84 ? 388 HIS A CG 1 ATOM 2657 N ND1 . HIS A 1 329 ? 22.424 82.281 63.836 1.00 33.63 ? 388 HIS A ND1 1 ATOM 2658 C CD2 . HIS A 1 329 ? 24.203 83.447 63.339 1.00 33.25 ? 388 HIS A CD2 1 ATOM 2659 C CE1 . HIS A 1 329 ? 22.015 83.485 63.481 1.00 46.37 ? 388 HIS A CE1 1 ATOM 2660 N NE2 . HIS A 1 329 ? 23.074 84.212 63.174 1.00 39.52 ? 388 HIS A NE2 1 ATOM 2661 N N . GLY A 1 330 ? 26.401 78.294 62.516 1.00 38.88 ? 389 GLY A N 1 ATOM 2662 C CA . GLY A 1 330 ? 27.089 77.053 62.829 1.00 27.59 ? 389 GLY A CA 1 ATOM 2663 C C . GLY A 1 330 ? 28.526 77.210 63.297 1.00 36.56 ? 389 GLY A C 1 ATOM 2664 O O . GLY A 1 330 ? 29.034 76.378 64.049 1.00 34.08 ? 389 GLY A O 1 ATOM 2665 N N . ARG A 1 331 ? 29.182 78.279 62.856 1.00 27.19 ? 390 ARG A N 1 ATOM 2666 C CA . ARG A 1 331 ? 30.581 78.514 63.200 1.00 34.25 ? 390 ARG A CA 1 ATOM 2667 C C . ARG A 1 331 ? 30.744 79.543 64.316 1.00 40.59 ? 390 ARG A C 1 ATOM 2668 O O . ARG A 1 331 ? 31.740 80.264 64.367 1.00 42.47 ? 390 ARG A O 1 ATOM 2669 C CB . ARG A 1 331 ? 31.362 78.952 61.960 1.00 26.89 ? 390 ARG A CB 1 ATOM 2670 C CG . ARG A 1 331 ? 31.930 77.788 61.167 1.00 26.97 ? 390 ARG A CG 1 ATOM 2671 C CD . ARG A 1 331 ? 32.296 78.184 59.749 1.00 39.38 ? 390 ARG A CD 1 ATOM 2672 N NE . ARG A 1 331 ? 32.912 77.073 59.029 1.00 43.61 ? 390 ARG A NE 1 ATOM 2673 C CZ . ARG A 1 331 ? 33.151 77.065 57.722 1.00 50.11 ? 390 ARG A CZ 1 ATOM 2674 N NH1 . ARG A 1 331 ? 32.822 78.111 56.976 1.00 47.80 ? 390 ARG A NH1 1 ATOM 2675 N NH2 . ARG A 1 331 ? 33.717 76.006 57.159 1.00 54.35 ? 390 ARG A NH2 1 ATOM 2676 N N . ALA A 1 332 ? 29.759 79.608 65.206 1.00 36.15 ? 391 ALA A N 1 ATOM 2677 C CA . ALA A 1 332 ? 29.836 80.491 66.364 1.00 26.79 ? 391 ALA A CA 1 ATOM 2678 C C . ALA A 1 332 ? 30.295 79.734 67.607 1.00 37.28 ? 391 ALA A C 1 ATOM 2679 O O . ALA A 1 332 ? 30.265 78.503 67.637 1.00 30.37 ? 391 ALA A O 1 ATOM 2680 C CB . ALA A 1 332 ? 28.492 81.150 66.614 1.00 26.85 ? 391 ALA A CB 1 ATOM 2681 N N . PHE A 1 333 ? 30.721 80.483 68.623 1.00 26.64 ? 392 PHE A N 1 ATOM 2682 C CA . PHE A 1 333 ? 31.111 79.920 69.917 1.00 45.97 ? 392 PHE A CA 1 ATOM 2683 C C . PHE A 1 333 ? 32.240 78.897 69.814 1.00 35.17 ? 392 PHE A C 1 ATOM 2684 O O . PHE A 1 333 ? 32.245 77.896 70.530 1.00 45.41 ? 392 PHE A O 1 ATOM 2685 C CB . PHE A 1 333 ? 29.903 79.284 70.611 1.00 33.59 ? 392 PHE A CB 1 ATOM 2686 C CG . PHE A 1 333 ? 28.825 80.264 70.970 1.00 36.54 ? 392 PHE A CG 1 ATOM 2687 C CD1 . PHE A 1 333 ? 28.938 81.049 72.106 1.00 42.53 ? 392 PHE A CD1 1 ATOM 2688 C CD2 . PHE A 1 333 ? 27.696 80.397 70.179 1.00 41.24 ? 392 PHE A CD2 1 ATOM 2689 C CE1 . PHE A 1 333 ? 27.949 81.952 72.443 1.00 32.86 ? 392 PHE A CE1 1 ATOM 2690 C CE2 . PHE A 1 333 ? 26.702 81.298 70.512 1.00 38.70 ? 392 PHE A CE2 1 ATOM 2691 C CZ . PHE A 1 333 ? 26.829 82.075 71.647 1.00 30.70 ? 392 PHE A CZ 1 ATOM 2692 N N . GLY A 1 334 ? 33.195 79.151 68.926 1.00 41.93 ? 393 GLY A N 1 ATOM 2693 C CA . GLY A 1 334 ? 34.319 78.250 68.751 1.00 26.50 ? 393 GLY A CA 1 ATOM 2694 C C . GLY A 1 334 ? 35.411 78.431 69.789 1.00 45.83 ? 393 GLY A C 1 ATOM 2695 O O . GLY A 1 334 ? 36.141 77.489 70.101 1.00 37.70 ? 393 GLY A O 1 ATOM 2696 N N . ARG A 1 335 ? 35.528 79.644 70.320 1.00 26.20 ? 394 ARG A N 1 ATOM 2697 C CA . ARG A 1 335 ? 36.574 79.961 71.287 1.00 31.03 ? 394 ARG A CA 1 ATOM 2698 C C . ARG A 1 335 ? 36.023 80.775 72.450 1.00 38.70 ? 394 ARG A C 1 ATOM 2699 O O . ARG A 1 335 ? 35.302 81.752 72.249 1.00 46.50 ? 394 ARG A O 1 ATOM 2700 C CB . ARG A 1 335 ? 37.719 80.724 70.616 1.00 40.68 ? 394 ARG A CB 1 ATOM 2701 C CG . ARG A 1 335 ? 38.368 79.992 69.455 1.00 48.86 ? 394 ARG A CG 1 ATOM 2702 C CD . ARG A 1 335 ? 39.494 79.094 69.938 1.00 43.10 ? 394 ARG A CD 1 ATOM 2703 N NE . ARG A 1 335 ? 40.575 79.854 70.555 1.00 48.05 ? 394 ARG A NE 1 ATOM 2704 C CZ . ARG A 1 335 ? 41.528 80.486 69.878 1.00 36.94 ? 394 ARG A CZ 1 ATOM 2705 N NH1 . ARG A 1 335 ? 41.538 80.451 68.553 1.00 52.68 ? 394 ARG A NH1 1 ATOM 2706 N NH2 . ARG A 1 335 ? 42.474 81.152 70.526 1.00 53.04 ? 394 ARG A NH2 1 ATOM 2707 N N . SER A 1 336 ? 36.365 80.367 73.667 1.00 28.23 ? 395 SER A N 1 ATOM 2708 C CA . SER A 1 336 ? 35.924 81.075 74.864 1.00 40.27 ? 395 SER A CA 1 ATOM 2709 C C . SER A 1 336 ? 37.013 81.999 75.398 1.00 39.47 ? 395 SER A C 1 ATOM 2710 O O . SER A 1 336 ? 36.756 82.846 76.252 1.00 40.33 ? 395 SER A O 1 ATOM 2711 C CB . SER A 1 336 ? 35.506 80.080 75.948 1.00 46.06 ? 395 SER A CB 1 ATOM 2712 O OG . SER A 1 336 ? 36.622 79.342 76.415 1.00 33.63 ? 395 SER A OG 1 ATOM 2713 N N . ASP A 1 337 ? 38.229 81.827 74.889 1.00 42.81 ? 396 ASP A N 1 ATOM 2714 C CA . ASP A 1 337 ? 39.385 82.564 75.389 1.00 40.62 ? 396 ASP A CA 1 ATOM 2715 C C . ASP A 1 337 ? 39.927 83.547 74.356 1.00 48.72 ? 396 ASP A C 1 ATOM 2716 O O . ASP A 1 337 ? 41.012 84.103 74.526 1.00 46.87 ? 396 ASP A O 1 ATOM 2717 C CB . ASP A 1 337 ? 40.492 81.595 75.815 1.00 40.21 ? 396 ASP A CB 1 ATOM 2718 C CG . ASP A 1 337 ? 41.007 80.753 74.662 1.00 54.15 ? 396 ASP A CG 1 ATOM 2719 O OD1 . ASP A 1 337 ? 40.281 80.606 73.657 1.00 65.99 ? 396 ASP A OD1 1 ATOM 2720 O OD2 . ASP A 1 337 ? 42.142 80.240 74.760 1.00 67.41 ? 396 ASP A OD2 1 ATOM 2721 N N . PHE A 1 338 ? 39.170 83.759 73.285 1.00 36.86 ? 397 PHE A N 1 ATOM 2722 C CA . PHE A 1 338 ? 39.613 84.637 72.209 1.00 31.80 ? 397 PHE A CA 1 ATOM 2723 C C . PHE A 1 338 ? 38.485 85.519 71.685 1.00 34.17 ? 397 PHE A C 1 ATOM 2724 O O . PHE A 1 338 ? 37.420 85.031 71.307 1.00 41.80 ? 397 PHE A O 1 ATOM 2725 C CB . PHE A 1 338 ? 40.204 83.807 71.065 1.00 37.07 ? 397 PHE A CB 1 ATOM 2726 C CG . PHE A 1 338 ? 40.431 84.585 69.800 1.00 39.80 ? 397 PHE A CG 1 ATOM 2727 C CD1 . PHE A 1 338 ? 41.316 85.651 69.773 1.00 52.31 ? 397 PHE A CD1 1 ATOM 2728 C CD2 . PHE A 1 338 ? 39.763 84.244 68.635 1.00 26.67 ? 397 PHE A CD2 1 ATOM 2729 C CE1 . PHE A 1 338 ? 41.526 86.367 68.607 1.00 26.01 ? 397 PHE A CE1 1 ATOM 2730 C CE2 . PHE A 1 338 ? 39.970 84.955 67.466 1.00 32.92 ? 397 PHE A CE2 1 ATOM 2731 C CZ . PHE A 1 338 ? 40.852 86.017 67.452 1.00 35.71 ? 397 PHE A CZ 1 ATOM 2732 N N . ASP A 1 339 ? 38.732 86.824 71.671 1.00 42.27 ? 398 ASP A N 1 ATOM 2733 C CA . ASP A 1 339 ? 37.800 87.779 71.085 1.00 33.57 ? 398 ASP A CA 1 ATOM 2734 C C . ASP A 1 339 ? 38.374 88.349 69.794 1.00 42.90 ? 398 ASP A C 1 ATOM 2735 O O . ASP A 1 339 ? 39.448 88.950 69.794 1.00 57.40 ? 398 ASP A O 1 ATOM 2736 C CB . ASP A 1 339 ? 37.488 88.907 72.071 1.00 25.09 ? 398 ASP A CB 1 ATOM 2737 C CG . ASP A 1 339 ? 37.139 88.394 73.454 1.00 44.99 ? 398 ASP A CG 1 ATOM 2738 O OD1 . ASP A 1 339 ? 36.582 87.280 73.554 1.00 47.39 ? 398 ASP A OD1 1 ATOM 2739 O OD2 . ASP A 1 339 ? 37.419 89.107 74.441 1.00 38.95 ? 398 ASP A OD2 1 ATOM 2740 N N . ASP A 1 340 ? 37.654 88.158 68.694 1.00 39.97 ? 399 ASP A N 1 ATOM 2741 C CA . ASP A 1 340 ? 38.096 88.657 67.399 1.00 30.01 ? 399 ASP A CA 1 ATOM 2742 C C . ASP A 1 340 ? 37.536 90.052 67.142 1.00 37.02 ? 399 ASP A C 1 ATOM 2743 O O . ASP A 1 340 ? 36.421 90.201 66.640 1.00 30.86 ? 399 ASP A O 1 ATOM 2744 C CB . ASP A 1 340 ? 37.676 87.700 66.281 1.00 40.26 ? 399 ASP A CB 1 ATOM 2745 C CG . ASP A 1 340 ? 38.200 88.122 64.923 1.00 46.68 ? 399 ASP A CG 1 ATOM 2746 O OD1 . ASP A 1 340 ? 39.177 88.900 64.874 1.00 59.02 ? 399 ASP A OD1 1 ATOM 2747 O OD2 . ASP A 1 340 ? 37.634 87.677 63.901 1.00 43.05 ? 399 ASP A OD2 1 ATOM 2748 N N . ASP A 1 341 ? 38.318 91.071 67.489 1.00 41.58 ? 400 ASP A N 1 ATOM 2749 C CA . ASP A 1 341 ? 37.883 92.460 67.367 1.00 47.47 ? 400 ASP A CA 1 ATOM 2750 C C . ASP A 1 341 ? 37.673 92.884 65.914 1.00 41.49 ? 400 ASP A C 1 ATOM 2751 O O . ASP A 1 341 ? 37.086 93.933 65.648 1.00 47.42 ? 400 ASP A O 1 ATOM 2752 C CB . ASP A 1 341 ? 38.893 93.393 68.038 1.00 41.87 ? 400 ASP A CB 1 ATOM 2753 C CG . ASP A 1 341 ? 39.011 93.149 69.529 1.00 61.15 ? 400 ASP A CG 1 ATOM 2754 O OD1 . ASP A 1 341 ? 37.983 92.836 70.167 1.00 56.71 ? 400 ASP A OD1 1 ATOM 2755 O OD2 . ASP A 1 341 ? 40.132 93.273 70.066 1.00 71.83 ? 400 ASP A OD2 1 ATOM 2756 N N . ASP A 1 342 ? 38.158 92.073 64.978 1.00 24.93 ? 401 ASP A N 1 ATOM 2757 C CA . ASP A 1 342 ? 37.930 92.319 63.557 1.00 34.00 ? 401 ASP A CA 1 ATOM 2758 C C . ASP A 1 342 ? 36.446 92.239 63.206 1.00 36.67 ? 401 ASP A C 1 ATOM 2759 O O . ASP A 1 342 ? 35.985 92.894 62.273 1.00 38.29 ? 401 ASP A O 1 ATOM 2760 C CB . ASP A 1 342 ? 38.720 91.326 62.703 1.00 31.30 ? 401 ASP A CB 1 ATOM 2761 C CG . ASP A 1 342 ? 40.143 91.782 62.444 1.00 44.76 ? 401 ASP A CG 1 ATOM 2762 O OD1 . ASP A 1 342 ? 40.623 92.679 63.168 1.00 45.55 ? 401 ASP A OD1 1 ATOM 2763 O OD2 . ASP A 1 342 ? 40.780 91.246 61.513 1.00 40.59 ? 401 ASP A OD2 1 ATOM 2764 N N . ILE A 1 343 ? 35.706 91.424 63.950 1.00 29.99 ? 402 ILE A N 1 ATOM 2765 C CA . ILE A 1 343 ? 34.284 91.234 63.691 1.00 41.81 ? 402 ILE A CA 1 ATOM 2766 C C . ILE A 1 343 ? 33.486 92.500 64.015 1.00 44.99 ? 402 ILE A C 1 ATOM 2767 O O . ILE A 1 343 ? 32.535 92.842 63.311 1.00 36.36 ? 402 ILE A O 1 ATOM 2768 C CB . ILE A 1 343 ? 33.721 90.043 64.501 1.00 45.15 ? 402 ILE A CB 1 ATOM 2769 C CG1 . ILE A 1 343 ? 34.475 88.757 64.154 1.00 53.20 ? 402 ILE A CG1 1 ATOM 2770 C CG2 . ILE A 1 343 ? 32.234 89.864 64.240 1.00 37.48 ? 402 ILE A CG2 1 ATOM 2771 C CD1 . ILE A 1 343 ? 34.189 87.607 65.097 1.00 25.64 ? 402 ILE A CD1 1 ATOM 2772 N N . ILE A 1 344 ? 33.886 93.198 65.074 1.00 32.50 ? 403 ILE A N 1 ATOM 2773 C CA . ILE A 1 344 ? 33.180 94.397 65.517 1.00 48.59 ? 403 ILE A CA 1 ATOM 2774 C C . ILE A 1 344 ? 33.731 95.662 64.843 1.00 42.99 ? 403 ILE A C 1 ATOM 2775 O O . ILE A 1 344 ? 33.363 96.785 65.194 1.00 49.66 ? 403 ILE A O 1 ATOM 2776 C CB . ILE A 1 344 ? 33.254 94.539 67.059 1.00 33.45 ? 403 ILE A CB 1 ATOM 2777 C CG1 . ILE A 1 344 ? 32.114 95.416 67.589 1.00 47.52 ? 403 ILE A CG1 1 ATOM 2778 C CG2 . ILE A 1 344 ? 34.626 95.041 67.498 1.00 34.18 ? 403 ILE A CG2 1 ATOM 2779 C CD1 . ILE A 1 344 ? 30.743 94.968 67.141 1.00 33.53 ? 403 ILE A CD1 1 ATOM 2780 N N . LEU A 1 345 ? 34.606 95.471 63.860 1.00 42.28 ? 404 LEU A N 1 ATOM 2781 C CA . LEU A 1 345 ? 35.168 96.586 63.095 1.00 51.00 ? 404 LEU A CA 1 ATOM 2782 C C . LEU A 1 345 ? 34.137 97.503 62.414 1.00 53.74 ? 404 LEU A C 1 ATOM 2783 O O . LEU A 1 345 ? 34.350 98.715 62.364 1.00 54.84 ? 404 LEU A O 1 ATOM 2784 C CB . LEU A 1 345 ? 36.144 96.062 62.039 1.00 40.07 ? 404 LEU A CB 1 ATOM 2785 C CG . LEU A 1 345 ? 37.593 95.908 62.499 1.00 49.18 ? 404 LEU A CG 1 ATOM 2786 C CD1 . LEU A 1 345 ? 38.470 95.431 61.354 1.00 33.70 ? 404 LEU A CD1 1 ATOM 2787 C CD2 . LEU A 1 345 ? 38.108 97.221 63.068 1.00 32.43 ? 404 LEU A CD2 1 ATOM 2788 N N . PRO A 1 346 ? 33.035 96.942 61.869 1.00 48.60 ? 405 PRO A N 1 ATOM 2789 C CA . PRO A 1 346 ? 32.017 97.842 61.313 1.00 40.24 ? 405 PRO A CA 1 ATOM 2790 C C . PRO A 1 346 ? 31.487 98.876 62.308 1.00 52.02 ? 405 PRO A C 1 ATOM 2791 O O . PRO A 1 346 ? 31.252 100.018 61.919 1.00 52.13 ? 405 PRO A O 1 ATOM 2792 C CB . PRO A 1 346 ? 30.908 96.881 60.892 1.00 39.36 ? 405 PRO A CB 1 ATOM 2793 C CG . PRO A 1 346 ? 31.637 95.652 60.508 1.00 38.61 ? 405 PRO A CG 1 ATOM 2794 C CD . PRO A 1 346 ? 32.758 95.538 61.504 1.00 37.43 ? 405 PRO A CD 1 ATOM 2795 N N . LEU A 1 347 ? 31.304 98.482 63.563 1.00 43.44 ? 406 LEU A N 1 ATOM 2796 C CA . LEU A 1 347 ? 30.897 99.420 64.606 1.00 37.51 ? 406 LEU A CA 1 ATOM 2797 C C . LEU A 1 347 ? 31.926 100.532 64.770 1.00 41.95 ? 406 LEU A C 1 ATOM 2798 O O . LEU A 1 347 ? 31.578 101.706 64.893 1.00 44.61 ? 406 LEU A O 1 ATOM 2799 C CB . LEU A 1 347 ? 30.693 98.696 65.939 1.00 28.81 ? 406 LEU A CB 1 ATOM 2800 C CG . LEU A 1 347 ? 30.377 99.593 67.139 1.00 31.69 ? 406 LEU A CG 1 ATOM 2801 C CD1 . LEU A 1 347 ? 29.105 100.393 66.903 1.00 29.51 ? 406 LEU A CD1 1 ATOM 2802 C CD2 . LEU A 1 347 ? 30.267 98.769 68.413 1.00 44.77 ? 406 LEU A CD2 1 ATOM 2803 N N . ARG A 1 348 ? 33.197 100.146 64.765 1.00 58.24 ? 407 ARG A N 1 ATOM 2804 C CA . ARG A 1 348 ? 34.296 101.075 64.990 1.00 55.07 ? 407 ARG A CA 1 ATOM 2805 C C . ARG A 1 348 ? 34.542 101.977 63.784 1.00 51.41 ? 407 ARG A C 1 ATOM 2806 O O . ARG A 1 348 ? 34.937 103.133 63.937 1.00 40.75 ? 407 ARG A O 1 ATOM 2807 C CB . ARG A 1 348 ? 35.565 100.293 65.337 1.00 36.76 ? 407 ARG A CB 1 ATOM 2808 C CG . ARG A 1 348 ? 35.466 99.528 66.649 1.00 62.09 ? 407 ARG A CG 1 ATOM 2809 C CD . ARG A 1 348 ? 36.543 98.462 66.769 1.00 77.57 ? 407 ARG A CD 1 ATOM 2810 N NE . ARG A 1 348 ? 37.893 99.004 66.655 1.00 96.04 ? 407 ARG A NE 1 ATOM 2811 C CZ . ARG A 1 348 ? 38.978 98.260 66.468 1.00 97.78 ? 407 ARG A CZ 1 ATOM 2812 N NH1 . ARG A 1 348 ? 38.870 96.941 66.375 1.00 94.67 ? 407 ARG A NH1 1 ATOM 2813 N NH2 . ARG A 1 348 ? 40.170 98.832 66.374 1.00 86.89 ? 407 ARG A NH2 1 ATOM 2814 N N . GLN A 1 349 ? 34.307 101.447 62.588 1.00 52.88 ? 408 GLN A N 1 ATOM 2815 C CA . GLN A 1 349 ? 34.539 102.199 61.358 1.00 42.97 ? 408 GLN A CA 1 ATOM 2816 C C . GLN A 1 349 ? 33.355 103.082 60.963 1.00 54.26 ? 408 GLN A C 1 ATOM 2817 O O . GLN A 1 349 ? 33.537 104.244 60.598 1.00 54.38 ? 408 GLN A O 1 ATOM 2818 C CB . GLN A 1 349 ? 34.877 101.244 60.211 1.00 38.03 ? 408 GLN A CB 1 ATOM 2819 C CG . GLN A 1 349 ? 36.242 100.588 60.335 1.00 40.53 ? 408 GLN A CG 1 ATOM 2820 C CD . GLN A 1 349 ? 36.555 99.666 59.172 1.00 50.05 ? 408 GLN A CD 1 ATOM 2821 O OE1 . GLN A 1 349 ? 35.850 99.657 58.164 1.00 53.60 ? 408 GLN A OE1 1 ATOM 2822 N NE2 . GLN A 1 349 ? 37.619 98.884 59.309 1.00 41.48 ? 408 GLN A NE2 1 ATOM 2823 N N . CYS A 1 350 ? 32.147 102.532 61.037 1.00 50.84 ? 409 CYS A N 1 ATOM 2824 C CA . CYS A 1 350 ? 30.950 103.261 60.623 1.00 53.09 ? 409 CYS A CA 1 ATOM 2825 C C . CYS A 1 350 ? 30.457 104.205 61.716 1.00 51.01 ? 409 CYS A C 1 ATOM 2826 O O . CYS A 1 350 ? 30.006 105.315 61.432 1.00 45.18 ? 409 CYS A O 1 ATOM 2827 C CB . CYS A 1 350 ? 29.836 102.286 60.236 1.00 27.85 ? 409 CYS A CB 1 ATOM 2828 S SG . CYS A 1 350 ? 30.311 101.064 58.990 1.00 40.54 ? 409 CYS A SG 1 ATOM 2829 N N . CYS A 1 351 ? 30.546 103.747 62.962 1.00 40.02 ? 410 CYS A N 1 ATOM 2830 C CA . CYS A 1 351 ? 30.118 104.519 64.126 1.00 38.92 ? 410 CYS A CA 1 ATOM 2831 C C . CYS A 1 351 ? 28.676 105.014 64.032 1.00 46.91 ? 410 CYS A C 1 ATOM 2832 O O . CYS A 1 351 ? 28.369 106.129 64.449 1.00 43.16 ? 410 CYS A O 1 ATOM 2833 C CB . CYS A 1 351 ? 31.056 105.706 64.352 1.00 31.78 ? 410 CYS A CB 1 ATOM 2834 S SG . CYS A 1 351 ? 32.554 105.288 65.269 1.00 50.85 ? 410 CYS A SG 1 ATOM 2835 N N . ILE A 1 352 ? 27.798 104.185 63.478 1.00 53.28 ? 411 ILE A N 1 ATOM 2836 C CA . ILE A 1 352 ? 26.363 104.414 63.597 1.00 51.30 ? 411 ILE A CA 1 ATOM 2837 C C . ILE A 1 352 ? 25.743 103.211 64.301 1.00 45.09 ? 411 ILE A C 1 ATOM 2838 O O . ILE A 1 352 ? 26.265 102.099 64.219 1.00 44.71 ? 411 ILE A O 1 ATOM 2839 C CB . ILE A 1 352 ? 25.682 104.643 62.231 1.00 51.98 ? 411 ILE A CB 1 ATOM 2840 C CG1 . ILE A 1 352 ? 25.614 103.345 61.426 1.00 49.98 ? 411 ILE A CG1 1 ATOM 2841 C CG2 . ILE A 1 352 ? 26.400 105.737 61.451 1.00 48.67 ? 411 ILE A CG2 1 ATOM 2842 C CD1 . ILE A 1 352 ? 24.782 103.458 60.172 1.00 36.74 ? 411 ILE A CD1 1 ATOM 2843 N N . LEU A 1 353 ? 24.641 103.438 65.004 1.00 42.96 ? 412 LEU A N 1 ATOM 2844 C CA . LEU A 1 353 ? 24.068 102.403 65.854 1.00 28.42 ? 412 LEU A CA 1 ATOM 2845 C C . LEU A 1 353 ? 22.585 102.637 66.107 1.00 43.11 ? 412 LEU A C 1 ATOM 2846 O O . LEU A 1 353 ? 22.185 103.713 66.550 1.00 57.46 ? 412 LEU A O 1 ATOM 2847 C CB . LEU A 1 353 ? 24.822 102.333 67.183 1.00 24.55 ? 412 LEU A CB 1 ATOM 2848 C CG . LEU A 1 353 ? 24.293 101.344 68.222 1.00 44.71 ? 412 LEU A CG 1 ATOM 2849 C CD1 . LEU A 1 353 ? 24.417 99.915 67.718 1.00 35.72 ? 412 LEU A CD1 1 ATOM 2850 C CD2 . LEU A 1 353 ? 25.028 101.517 69.540 1.00 39.69 ? 412 LEU A CD2 1 ATOM 2851 N N . ARG A 1 354 ? 21.776 101.627 65.799 1.00 40.61 ? 413 ARG A N 1 ATOM 2852 C CA . ARG A 1 354 ? 20.336 101.687 66.022 1.00 48.98 ? 413 ARG A CA 1 ATOM 2853 C C . ARG A 1 354 ? 20.043 101.956 67.496 1.00 52.80 ? 413 ARG A C 1 ATOM 2854 O O . ARG A 1 354 ? 20.564 101.265 68.371 1.00 44.84 ? 413 ARG A O 1 ATOM 2855 C CB . ARG A 1 354 ? 19.673 100.385 65.563 1.00 48.26 ? 413 ARG A CB 1 ATOM 2856 C CG . ARG A 1 354 ? 18.157 100.389 65.614 1.00 44.39 ? 413 ARG A CG 1 ATOM 2857 C CD . ARG A 1 354 ? 17.575 99.188 64.885 1.00 32.32 ? 413 ARG A CD 1 ATOM 2858 N NE . ARG A 1 354 ? 17.522 99.389 63.438 1.00 43.70 ? 413 ARG A NE 1 ATOM 2859 C CZ . ARG A 1 354 ? 17.978 98.517 62.544 1.00 40.31 ? 413 ARG A CZ 1 ATOM 2860 N NH1 . ARG A 1 354 ? 18.531 97.381 62.945 1.00 35.75 ? 413 ARG A NH1 1 ATOM 2861 N NH2 . ARG A 1 354 ? 17.884 98.783 61.249 1.00 40.56 ? 413 ARG A NH2 1 ATOM 2862 N N . PRO A 1 355 ? 19.218 102.978 67.773 1.00 48.46 ? 414 PRO A N 1 ATOM 2863 C CA . PRO A 1 355 ? 18.944 103.459 69.133 1.00 38.41 ? 414 PRO A CA 1 ATOM 2864 C C . PRO A 1 355 ? 18.435 102.368 70.072 1.00 46.56 ? 414 PRO A C 1 ATOM 2865 O O . PRO A 1 355 ? 18.824 102.345 71.240 1.00 38.66 ? 414 PRO A O 1 ATOM 2866 C CB . PRO A 1 355 ? 17.870 104.526 68.911 1.00 48.42 ? 414 PRO A CB 1 ATOM 2867 C CG . PRO A 1 355 ? 18.122 105.016 67.530 1.00 51.91 ? 414 PRO A CG 1 ATOM 2868 C CD . PRO A 1 355 ? 18.547 103.806 66.756 1.00 57.84 ? 414 PRO A CD 1 ATOM 2869 N N . SER A 1 356 ? 17.579 101.482 69.571 1.00 27.39 ? 415 SER A N 1 ATOM 2870 C CA . SER A 1 356 ? 17.066 100.378 70.376 1.00 49.64 ? 415 SER A CA 1 ATOM 2871 C C . SER A 1 356 ? 18.183 99.410 70.746 1.00 55.56 ? 415 SER A C 1 ATOM 2872 O O . SER A 1 356 ? 18.229 98.900 71.866 1.00 40.27 ? 415 SER A O 1 ATOM 2873 C CB . SER A 1 356 ? 15.955 99.635 69.635 1.00 25.47 ? 415 SER A CB 1 ATOM 2874 O OG . SER A 1 356 ? 16.415 99.136 68.391 1.00 52.41 ? 415 SER A OG 1 ATOM 2875 N N . THR A 1 357 ? 19.076 99.156 69.794 1.00 36.24 ? 416 THR A N 1 ATOM 2876 C CA . THR A 1 357 ? 20.220 98.283 70.024 1.00 50.02 ? 416 THR A CA 1 ATOM 2877 C C . THR A 1 357 ? 21.088 98.838 71.148 1.00 55.88 ? 416 THR A C 1 ATOM 2878 O O . THR A 1 357 ? 21.548 98.093 72.012 1.00 45.76 ? 416 THR A O 1 ATOM 2879 C CB . THR A 1 357 ? 21.076 98.108 68.755 1.00 42.65 ? 416 THR A CB 1 ATOM 2880 O OG1 . THR A 1 357 ? 20.261 97.605 67.689 1.00 40.98 ? 416 THR A OG1 1 ATOM 2881 C CG2 . THR A 1 357 ? 22.220 97.140 69.014 1.00 30.36 ? 416 THR A CG2 1 ATOM 2882 N N . PHE A 1 358 ? 21.307 100.150 71.129 1.00 46.04 ? 417 PHE A N 1 ATOM 2883 C CA . PHE A 1 358 ? 22.126 100.797 72.145 1.00 43.79 ? 417 PHE A CA 1 ATOM 2884 C C . PHE A 1 358 ? 21.525 100.611 73.532 1.00 50.14 ? 417 PHE A C 1 ATOM 2885 O O . PHE A 1 358 ? 22.232 100.267 74.477 1.00 43.37 ? 417 PHE A O 1 ATOM 2886 C CB . PHE A 1 358 ? 22.295 102.289 71.844 1.00 53.61 ? 417 PHE A CB 1 ATOM 2887 C CG . PHE A 1 358 ? 22.933 103.062 72.965 1.00 48.76 ? 417 PHE A CG 1 ATOM 2888 C CD1 . PHE A 1 358 ? 24.307 103.054 73.134 1.00 36.61 ? 417 PHE A CD1 1 ATOM 2889 C CD2 . PHE A 1 358 ? 22.159 103.803 73.844 1.00 46.84 ? 417 PHE A CD2 1 ATOM 2890 C CE1 . PHE A 1 358 ? 24.897 103.760 74.164 1.00 40.00 ? 417 PHE A CE1 1 ATOM 2891 C CE2 . PHE A 1 358 ? 22.743 104.514 74.876 1.00 46.89 ? 417 PHE A CE2 1 ATOM 2892 C CZ . PHE A 1 358 ? 24.114 104.493 75.034 1.00 54.68 ? 417 PHE A CZ 1 ATOM 2893 N N . GLN A 1 359 ? 20.219 100.835 73.646 1.00 37.05 ? 418 GLN A N 1 ATOM 2894 C CA . GLN A 1 359 ? 19.523 100.672 74.919 1.00 56.09 ? 418 GLN A CA 1 ATOM 2895 C C . GLN A 1 359 ? 19.598 99.234 75.413 1.00 55.32 ? 418 GLN A C 1 ATOM 2896 O O . GLN A 1 359 ? 19.880 98.990 76.586 1.00 35.98 ? 418 GLN A O 1 ATOM 2897 C CB . GLN A 1 359 ? 18.062 101.105 74.801 1.00 61.22 ? 418 GLN A CB 1 ATOM 2898 C CG . GLN A 1 359 ? 17.852 102.607 74.773 1.00 63.32 ? 418 GLN A CG 1 ATOM 2899 C CD . GLN A 1 359 ? 16.391 102.985 74.896 1.00 63.59 ? 418 GLN A CD 1 ATOM 2900 O OE1 . GLN A 1 359 ? 15.557 102.549 74.103 1.00 61.56 ? 418 GLN A OE1 1 ATOM 2901 N NE2 . GLN A 1 359 ? 16.070 103.784 75.907 1.00 51.69 ? 418 GLN A NE2 1 ATOM 2902 N N . THR A 1 360 ? 19.334 98.289 74.515 1.00 42.73 ? 419 THR A N 1 ATOM 2903 C CA . THR A 1 360 ? 19.461 96.869 74.827 1.00 36.01 ? 419 THR A CA 1 ATOM 2904 C C . THR A 1 360 ? 20.853 96.541 75.358 1.00 44.96 ? 419 THR A C 1 ATOM 2905 O O . THR A 1 360 ? 20.994 95.907 76.403 1.00 45.62 ? 419 THR A O 1 ATOM 2906 C CB . THR A 1 360 ? 19.177 95.993 73.595 1.00 45.19 ? 419 THR A CB 1 ATOM 2907 O OG1 . THR A 1 360 ? 17.863 96.273 73.097 1.00 29.76 ? 419 THR A OG1 1 ATOM 2908 C CG2 . THR A 1 360 ? 19.273 94.522 73.962 1.00 35.59 ? 419 THR A CG2 1 ATOM 2909 N N . LEU A 1 361 ? 21.876 96.984 74.634 1.00 33.65 ? 420 LEU A N 1 ATOM 2910 C CA . LEU A 1 361 ? 23.257 96.767 75.046 1.00 37.11 ? 420 LEU A CA 1 ATOM 2911 C C . LEU A 1 361 ? 23.562 97.502 76.347 1.00 40.49 ? 420 LEU A C 1 ATOM 2912 O O . LEU A 1 361 ? 24.210 96.955 77.239 1.00 43.24 ? 420 LEU A O 1 ATOM 2913 C CB . LEU A 1 361 ? 24.221 97.216 73.946 1.00 42.52 ? 420 LEU A CB 1 ATOM 2914 C CG . LEU A 1 361 ? 24.200 96.390 72.659 1.00 41.67 ? 420 LEU A CG 1 ATOM 2915 C CD1 . LEU A 1 361 ? 25.182 96.954 71.642 1.00 33.71 ? 420 LEU A CD1 1 ATOM 2916 C CD2 . LEU A 1 361 ? 24.489 94.923 72.942 1.00 34.19 ? 420 LEU A CD2 1 HETATM 2917 N N . MSE A 1 362 ? 23.088 98.741 76.450 1.00 29.91 ? 421 MSE A N 1 HETATM 2918 C CA . MSE A 1 362 ? 23.290 99.549 77.650 1.00 29.00 ? 421 MSE A CA 1 HETATM 2919 C C . MSE A 1 362 ? 22.619 98.922 78.866 1.00 24.80 ? 421 MSE A C 1 HETATM 2920 O O . MSE A 1 362 ? 23.190 98.899 79.957 1.00 33.16 ? 421 MSE A O 1 HETATM 2921 C CB . MSE A 1 362 ? 22.758 100.969 77.440 1.00 35.12 ? 421 MSE A CB 1 HETATM 2922 C CG . MSE A 1 362 ? 22.721 101.813 78.704 1.00 33.29 ? 421 MSE A CG 1 HETATM 2923 SE SE . MSE A 1 362 ? 24.489 102.040 79.485 1.00 100.52 ? 421 MSE A SE 1 HETATM 2924 C CE . MSE A 1 362 ? 25.346 102.898 77.968 1.00 26.56 ? 421 MSE A CE 1 ATOM 2925 N N . ASN A 1 363 ? 21.405 98.418 78.671 1.00 34.31 ? 422 ASN A N 1 ATOM 2926 C CA . ASN A 1 363 ? 20.653 97.795 79.752 1.00 34.65 ? 422 ASN A CA 1 ATOM 2927 C C . ASN A 1 363 ? 21.379 96.586 80.327 1.00 37.68 ? 422 ASN A C 1 ATOM 2928 O O . ASN A 1 363 ? 21.495 96.443 81.544 1.00 47.16 ? 422 ASN A O 1 ATOM 2929 C CB . ASN A 1 363 ? 19.261 97.386 79.268 1.00 37.88 ? 422 ASN A CB 1 ATOM 2930 C CG . ASN A 1 363 ? 18.505 96.573 80.296 1.00 48.19 ? 422 ASN A CG 1 ATOM 2931 O OD1 . ASN A 1 363 ? 18.004 97.111 81.283 1.00 35.37 ? 422 ASN A OD1 1 ATOM 2932 N ND2 . ASN A 1 363 ? 18.412 95.268 80.067 1.00 57.91 ? 422 ASN A ND2 1 ATOM 2933 N N . PHE A 1 364 ? 21.868 95.720 79.446 1.00 42.58 ? 423 PHE A N 1 ATOM 2934 C CA . PHE A 1 364 ? 22.622 94.548 79.874 1.00 55.13 ? 423 PHE A CA 1 ATOM 2935 C C . PHE A 1 364 ? 23.969 94.945 80.473 1.00 49.76 ? 423 PHE A C 1 ATOM 2936 O O . PHE A 1 364 ? 24.387 94.391 81.487 1.00 55.17 ? 423 PHE A O 1 ATOM 2937 C CB . PHE A 1 364 ? 22.821 93.571 78.712 1.00 49.63 ? 423 PHE A CB 1 ATOM 2938 C CG . PHE A 1 364 ? 21.569 92.836 78.318 1.00 33.82 ? 423 PHE A CG 1 ATOM 2939 C CD1 . PHE A 1 364 ? 20.816 92.166 79.269 1.00 43.89 ? 423 PHE A CD1 1 ATOM 2940 C CD2 . PHE A 1 364 ? 21.157 92.797 76.997 1.00 33.11 ? 423 PHE A CD2 1 ATOM 2941 C CE1 . PHE A 1 364 ? 19.667 91.484 78.911 1.00 32.95 ? 423 PHE A CE1 1 ATOM 2942 C CE2 . PHE A 1 364 ? 20.009 92.115 76.632 1.00 26.03 ? 423 PHE A CE2 1 ATOM 2943 C CZ . PHE A 1 364 ? 19.264 91.458 77.592 1.00 38.15 ? 423 PHE A CZ 1 ATOM 2944 N N . TYR A 1 365 ? 24.652 95.893 79.839 1.00 40.74 ? 424 TYR A N 1 ATOM 2945 C CA . TYR A 1 365 ? 25.969 96.325 80.303 1.00 47.55 ? 424 TYR A CA 1 ATOM 2946 C C . TYR A 1 365 ? 25.936 96.964 81.690 1.00 53.07 ? 424 TYR A C 1 ATOM 2947 O O . TYR A 1 365 ? 26.832 96.741 82.504 1.00 39.25 ? 424 TYR A O 1 ATOM 2948 C CB . TYR A 1 365 ? 26.586 97.311 79.313 1.00 50.68 ? 424 TYR A CB 1 ATOM 2949 C CG . TYR A 1 365 ? 27.949 97.809 79.733 1.00 57.80 ? 424 TYR A CG 1 ATOM 2950 C CD1 . TYR A 1 365 ? 28.988 96.924 79.985 1.00 52.99 ? 424 TYR A CD1 1 ATOM 2951 C CD2 . TYR A 1 365 ? 28.193 99.168 79.888 1.00 46.69 ? 424 TYR A CD2 1 ATOM 2952 C CE1 . TYR A 1 365 ? 30.234 97.378 80.374 1.00 41.17 ? 424 TYR A CE1 1 ATOM 2953 C CE2 . TYR A 1 365 ? 29.434 99.631 80.275 1.00 57.93 ? 424 TYR A CE2 1 ATOM 2954 C CZ . TYR A 1 365 ? 30.451 98.732 80.517 1.00 61.89 ? 424 TYR A CZ 1 ATOM 2955 O OH . TYR A 1 365 ? 31.689 99.192 80.903 1.00 59.46 ? 424 TYR A OH 1 ATOM 2956 N N . SER A 1 366 ? 24.900 97.755 81.953 1.00 47.83 ? 425 SER A N 1 ATOM 2957 C CA . SER A 1 366 ? 24.790 98.480 83.215 1.00 55.40 ? 425 SER A CA 1 ATOM 2958 C C . SER A 1 366 ? 24.522 97.547 84.392 1.00 62.19 ? 425 SER A C 1 ATOM 2959 O O . SER A 1 366 ? 24.721 97.919 85.549 1.00 61.06 ? 425 SER A O 1 ATOM 2960 C CB . SER A 1 366 ? 23.693 99.538 83.118 1.00 45.03 ? 425 SER A CB 1 ATOM 2961 O OG . SER A 1 366 ? 22.494 98.968 82.630 1.00 62.92 ? 425 SER A OG 1 ATOM 2962 N N . THR A 1 367 ? 24.065 96.336 84.092 1.00 59.49 ? 426 THR A N 1 ATOM 2963 C CA . THR A 1 367 ? 23.890 95.310 85.111 1.00 60.16 ? 426 THR A CA 1 ATOM 2964 C C . THR A 1 367 ? 24.683 94.070 84.714 1.00 59.38 ? 426 THR A C 1 ATOM 2965 O O . THR A 1 367 ? 24.213 93.261 83.918 1.00 47.38 ? 426 THR A O 1 ATOM 2966 C CB . THR A 1 367 ? 22.408 94.936 85.305 1.00 61.33 ? 426 THR A CB 1 ATOM 2967 O OG1 . THR A 1 367 ? 21.654 96.110 85.632 1.00 50.83 ? 426 THR A OG1 1 ATOM 2968 C CG2 . THR A 1 367 ? 22.259 93.917 86.424 1.00 60.16 ? 426 THR A CG2 1 ATOM 2969 N N . PRO A 1 368 ? 25.892 93.918 85.274 1.00 55.97 ? 427 PRO A N 1 ATOM 2970 C CA . PRO A 1 368 ? 26.796 92.809 84.943 1.00 65.68 ? 427 PRO A CA 1 ATOM 2971 C C . PRO A 1 368 ? 26.145 91.430 85.062 1.00 56.52 ? 427 PRO A C 1 ATOM 2972 O O . PRO A 1 368 ? 25.348 91.205 85.973 1.00 62.99 ? 427 PRO A O 1 ATOM 2973 C CB . PRO A 1 368 ? 27.924 92.966 85.964 1.00 65.43 ? 427 PRO A CB 1 ATOM 2974 C CG . PRO A 1 368 ? 27.942 94.422 86.265 1.00 54.58 ? 427 PRO A CG 1 ATOM 2975 C CD . PRO A 1 368 ? 26.505 94.858 86.228 1.00 58.43 ? 427 PRO A CD 1 ATOM 2976 N N . LYS A 1 369 ? 26.478 90.549 84.119 1.00 40.13 ? 428 LYS A N 1 ATOM 2977 C CA . LYS A 1 369 ? 25.989 89.167 84.053 1.00 41.94 ? 428 LYS A CA 1 ATOM 2978 C C . LYS A 1 369 ? 24.512 89.035 83.688 1.00 56.90 ? 428 LYS A C 1 ATOM 2979 O O . LYS A 1 369 ? 23.987 87.925 83.646 1.00 54.30 ? 428 LYS A O 1 ATOM 2980 C CB . LYS A 1 369 ? 26.233 88.435 85.374 1.00 37.08 ? 428 LYS A CB 1 ATOM 2981 C CG . LYS A 1 369 ? 27.673 88.415 85.827 1.00 35.31 ? 428 LYS A CG 1 ATOM 2982 C CD . LYS A 1 369 ? 27.772 87.836 87.222 1.00 56.78 ? 428 LYS A CD 1 ATOM 2983 C CE . LYS A 1 369 ? 29.208 87.783 87.687 1.00 71.36 ? 428 LYS A CE 1 ATOM 2984 N NZ . LYS A 1 369 ? 29.320 87.233 89.066 1.00 74.11 ? 428 LYS A NZ 1 ATOM 2985 N N . SER A 1 370 ? 23.842 90.150 83.420 1.00 55.38 ? 429 SER A N 1 ATOM 2986 C CA . SER A 1 370 ? 22.414 90.100 83.127 1.00 49.73 ? 429 SER A CA 1 ATOM 2987 C C . SER A 1 370 ? 22.165 89.512 81.742 1.00 40.36 ? 429 SER A C 1 ATOM 2988 O O . SER A 1 370 ? 21.181 88.804 81.532 1.00 46.52 ? 429 SER A O 1 ATOM 2989 C CB . SER A 1 370 ? 21.785 91.490 83.234 1.00 42.48 ? 429 SER A CB 1 ATOM 2990 O OG . SER A 1 370 ? 22.254 92.341 82.205 1.00 48.34 ? 429 SER A OG 1 ATOM 2991 N N . LEU A 1 371 ? 23.056 89.810 80.800 1.00 38.03 ? 430 LEU A N 1 ATOM 2992 C CA . LEU A 1 371 ? 22.942 89.284 79.441 1.00 51.71 ? 430 LEU A CA 1 ATOM 2993 C C . LEU A 1 371 ? 23.018 87.759 79.393 1.00 49.82 ? 430 LEU A C 1 ATOM 2994 O O . LEU A 1 371 ? 22.136 87.105 78.837 1.00 38.14 ? 430 LEU A O 1 ATOM 2995 C CB . LEU A 1 371 ? 24.034 89.877 78.548 1.00 54.73 ? 430 LEU A CB 1 ATOM 2996 C CG . LEU A 1 371 ? 24.105 89.322 77.123 1.00 36.39 ? 430 LEU A CG 1 ATOM 2997 C CD1 . LEU A 1 371 ? 22.842 89.651 76.343 1.00 30.27 ? 430 LEU A CD1 1 ATOM 2998 C CD2 . LEU A 1 371 ? 25.338 89.843 76.402 1.00 36.94 ? 430 LEU A CD2 1 ATOM 2999 N N . THR A 1 372 ? 24.072 87.200 79.978 1.00 42.64 ? 431 THR A N 1 ATOM 3000 C CA . THR A 1 372 ? 24.269 85.753 79.975 1.00 57.60 ? 431 THR A CA 1 ATOM 3001 C C . THR A 1 372 ? 23.272 85.023 80.871 1.00 49.84 ? 431 THR A C 1 ATOM 3002 O O . THR A 1 372 ? 22.939 83.865 80.617 1.00 61.56 ? 431 THR A O 1 ATOM 3003 C CB . THR A 1 372 ? 25.698 85.380 80.412 1.00 54.63 ? 431 THR A CB 1 ATOM 3004 O OG1 . THR A 1 372 ? 25.985 85.981 81.680 1.00 66.28 ? 431 THR A OG1 1 ATOM 3005 C CG2 . THR A 1 372 ? 26.710 85.869 79.389 1.00 30.30 ? 431 THR A CG2 1 ATOM 3006 N N . LYS A 1 373 ? 22.801 85.694 81.918 1.00 40.66 ? 432 LYS A N 1 ATOM 3007 C CA . LYS A 1 373 ? 21.764 85.120 82.770 1.00 43.99 ? 432 LYS A CA 1 ATOM 3008 C C . LYS A 1 373 ? 20.439 85.030 82.024 1.00 42.75 ? 432 LYS A C 1 ATOM 3009 O O . LYS A 1 373 ? 19.739 84.022 82.109 1.00 37.18 ? 432 LYS A O 1 ATOM 3010 C CB . LYS A 1 373 ? 21.594 85.933 84.054 1.00 56.77 ? 432 LYS A CB 1 ATOM 3011 C CG . LYS A 1 373 ? 22.528 85.510 85.178 1.00 56.55 ? 432 LYS A CG 1 ATOM 3012 C CD . LYS A 1 373 ? 22.508 86.502 86.328 1.00 59.43 ? 432 LYS A CD 1 ATOM 3013 C CE . LYS A 1 373 ? 23.438 86.063 87.448 1.00 57.03 ? 432 LYS A CE 1 ATOM 3014 N NZ . LYS A 1 373 ? 23.387 86.988 88.614 1.00 49.03 ? 432 LYS A NZ 1 ATOM 3015 N N . ALA A 1 374 ? 20.101 86.087 81.294 1.00 45.12 ? 433 ALA A N 1 ATOM 3016 C CA . ALA A 1 374 ? 18.894 86.093 80.477 1.00 34.92 ? 433 ALA A CA 1 ATOM 3017 C C . ALA A 1 374 ? 19.009 85.090 79.332 1.00 40.82 ? 433 ALA A C 1 ATOM 3018 O O . ALA A 1 374 ? 18.006 84.557 78.860 1.00 55.04 ? 433 ALA A O 1 ATOM 3019 C CB . ALA A 1 374 ? 18.622 87.488 79.938 1.00 32.51 ? 433 ALA A CB 1 ATOM 3020 N N . LEU A 1 375 ? 20.236 84.842 78.885 1.00 57.29 ? 434 LEU A N 1 ATOM 3021 C CA . LEU A 1 375 ? 20.484 83.862 77.836 1.00 51.01 ? 434 LEU A CA 1 ATOM 3022 C C . LEU A 1 375 ? 20.381 82.447 78.391 1.00 47.07 ? 434 LEU A C 1 ATOM 3023 O O . LEU A 1 375 ? 19.777 81.569 77.767 1.00 37.16 ? 434 LEU A O 1 ATOM 3024 C CB . LEU A 1 375 ? 21.856 84.082 77.197 1.00 37.63 ? 434 LEU A CB 1 ATOM 3025 C CG . LEU A 1 375 ? 22.273 83.048 76.149 1.00 42.66 ? 434 LEU A CG 1 ATOM 3026 C CD1 . LEU A 1 375 ? 21.348 83.103 74.942 1.00 27.21 ? 434 LEU A CD1 1 ATOM 3027 C CD2 . LEU A 1 375 ? 23.716 83.261 75.728 1.00 26.90 ? 434 LEU A CD2 1 ATOM 3028 N N . HIS A 1 376 ? 20.977 82.235 79.562 1.00 31.33 ? 435 HIS A N 1 ATOM 3029 C CA . HIS A 1 376 ? 20.969 80.927 80.203 1.00 37.68 ? 435 HIS A CA 1 ATOM 3030 C C . HIS A 1 376 ? 19.545 80.463 80.439 1.00 51.87 ? 435 HIS A C 1 ATOM 3031 O O . HIS A 1 376 ? 19.198 79.309 80.181 1.00 47.68 ? 435 HIS A O 1 ATOM 3032 C CB . HIS A 1 376 ? 21.701 80.953 81.541 1.00 44.90 ? 435 HIS A CB 1 ATOM 3033 C CG . HIS A 1 376 ? 21.881 79.596 82.140 1.00 53.82 ? 435 HIS A CG 1 ATOM 3034 N ND1 . HIS A 1 376 ? 22.737 78.667 81.589 1.00 60.62 ? 435 HIS A ND1 1 ATOM 3035 C CD2 . HIS A 1 376 ? 21.301 78.991 83.203 1.00 55.44 ? 435 HIS A CD2 1 ATOM 3036 C CE1 . HIS A 1 376 ? 22.693 77.556 82.300 1.00 55.18 ? 435 HIS A CE1 1 ATOM 3037 N NE2 . HIS A 1 376 ? 21.829 77.725 83.285 1.00 56.95 ? 435 HIS A NE2 1 ATOM 3038 N N . GLU A 1 377 ? 18.732 81.391 80.933 1.00 45.95 ? 436 GLU A N 1 ATOM 3039 C CA . GLU A 1 377 ? 17.336 81.132 81.244 1.00 52.17 ? 436 GLU A CA 1 ATOM 3040 C C . GLU A 1 377 ? 16.556 80.749 79.996 1.00 40.03 ? 436 GLU A C 1 ATOM 3041 O O . GLU A 1 377 ? 15.691 79.876 80.039 1.00 53.83 ? 436 GLU A O 1 ATOM 3042 C CB . GLU A 1 377 ? 16.702 82.362 81.900 1.00 60.48 ? 436 GLU A CB 1 ATOM 3043 C CG . GLU A 1 377 ? 15.285 82.137 82.406 1.00 79.31 ? 436 GLU A CG 1 ATOM 3044 C CD . GLU A 1 377 ? 14.575 83.429 82.772 1.00 100.33 ? 436 GLU A CD 1 ATOM 3045 O OE1 . GLU A 1 377 ? 15.007 84.503 82.304 1.00 102.26 ? 436 GLU A OE1 1 ATOM 3046 O OE2 . GLU A 1 377 ? 13.581 83.368 83.526 1.00 103.09 ? 436 GLU A OE2 1 ATOM 3047 N N . SER A 1 378 ? 16.867 81.409 78.887 1.00 43.86 ? 437 SER A N 1 ATOM 3048 C CA . SER A 1 378 ? 16.226 81.107 77.615 1.00 32.73 ? 437 SER A CA 1 ATOM 3049 C C . SER A 1 378 ? 16.663 79.736 77.108 1.00 52.96 ? 437 SER A C 1 ATOM 3050 O O . SER A 1 378 ? 15.838 78.931 76.675 1.00 45.67 ? 437 SER A O 1 ATOM 3051 C CB . SER A 1 378 ? 16.548 82.185 76.579 1.00 28.01 ? 437 SER A CB 1 ATOM 3052 O OG . SER A 1 378 ? 15.801 81.992 75.391 1.00 44.52 ? 437 SER A OG 1 ATOM 3053 N N . LEU A 1 379 ? 17.967 79.481 77.170 1.00 37.72 ? 438 LEU A N 1 ATOM 3054 C CA . LEU A 1 379 ? 18.543 78.214 76.724 1.00 46.25 ? 438 LEU A CA 1 ATOM 3055 C C . LEU A 1 379 ? 18.028 77.032 77.538 1.00 49.81 ? 438 LEU A C 1 ATOM 3056 O O . LEU A 1 379 ? 17.894 75.924 77.021 1.00 53.98 ? 438 LEU A O 1 ATOM 3057 C CB . LEU A 1 379 ? 20.071 78.266 76.798 1.00 50.40 ? 438 LEU A CB 1 ATOM 3058 C CG . LEU A 1 379 ? 20.784 79.198 75.817 1.00 39.61 ? 438 LEU A CG 1 ATOM 3059 C CD1 . LEU A 1 379 ? 22.280 79.210 76.084 1.00 37.48 ? 438 LEU A CD1 1 ATOM 3060 C CD2 . LEU A 1 379 ? 20.497 78.787 74.381 1.00 38.58 ? 438 LEU A CD2 1 ATOM 3061 N N . SER A 1 380 ? 17.746 77.280 78.813 1.00 52.28 ? 439 SER A N 1 ATOM 3062 C CA . SER A 1 380 ? 17.281 76.241 79.727 1.00 43.43 ? 439 SER A CA 1 ATOM 3063 C C . SER A 1 380 ? 15.986 75.576 79.263 1.00 49.40 ? 439 SER A C 1 ATOM 3064 O O . SER A 1 380 ? 15.726 74.418 79.593 1.00 51.46 ? 439 SER A O 1 ATOM 3065 C CB . SER A 1 380 ? 17.087 76.824 81.129 1.00 46.32 ? 439 SER A CB 1 ATOM 3066 O OG . SER A 1 380 ? 18.313 77.297 81.656 1.00 67.84 ? 439 SER A OG 1 ATOM 3067 N N . LYS A 1 381 ? 15.175 76.304 78.501 1.00 33.67 ? 440 LYS A N 1 ATOM 3068 C CA . LYS A 1 381 ? 13.908 75.764 78.015 1.00 47.71 ? 440 LYS A CA 1 ATOM 3069 C C . LYS A 1 381 ? 14.105 74.779 76.866 1.00 42.62 ? 440 LYS A C 1 ATOM 3070 O O . LYS A 1 381 ? 13.206 74.001 76.550 1.00 52.71 ? 440 LYS A O 1 ATOM 3071 C CB . LYS A 1 381 ? 12.975 76.892 77.567 1.00 44.06 ? 440 LYS A CB 1 ATOM 3072 C CG . LYS A 1 381 ? 12.567 77.852 78.671 1.00 53.16 ? 440 LYS A CG 1 ATOM 3073 C CD . LYS A 1 381 ? 11.421 78.745 78.220 1.00 70.36 ? 440 LYS A CD 1 ATOM 3074 C CE . LYS A 1 381 ? 11.730 79.427 76.897 1.00 70.26 ? 440 LYS A CE 1 ATOM 3075 N NZ . LYS A 1 381 ? 12.873 80.372 77.004 1.00 68.72 ? 440 LYS A NZ 1 ATOM 3076 N N . ASP A 1 382 ? 15.278 74.811 76.242 1.00 40.87 ? 441 ASP A N 1 ATOM 3077 C CA . ASP A 1 382 ? 15.585 73.867 75.173 1.00 36.47 ? 441 ASP A CA 1 ATOM 3078 C C . ASP A 1 382 ? 15.836 72.478 75.751 1.00 45.78 ? 441 ASP A C 1 ATOM 3079 O O . ASP A 1 382 ? 16.596 72.328 76.708 1.00 43.23 ? 441 ASP A O 1 ATOM 3080 C CB . ASP A 1 382 ? 16.795 74.336 74.363 1.00 35.54 ? 441 ASP A CB 1 ATOM 3081 C CG . ASP A 1 382 ? 17.032 73.492 73.123 1.00 43.14 ? 441 ASP A CG 1 ATOM 3082 O OD1 . ASP A 1 382 ? 17.597 72.386 73.251 1.00 54.94 ? 441 ASP A OD1 1 ATOM 3083 O OD2 . ASP A 1 382 ? 16.654 73.936 72.018 1.00 34.01 ? 441 ASP A OD2 1 ATOM 3084 N N . PRO A 1 383 ? 15.191 71.455 75.169 1.00 33.58 ? 442 PRO A N 1 ATOM 3085 C CA . PRO A 1 383 ? 15.257 70.071 75.658 1.00 34.91 ? 442 PRO A CA 1 ATOM 3086 C C . PRO A 1 383 ? 16.669 69.485 75.641 1.00 44.95 ? 442 PRO A C 1 ATOM 3087 O O . PRO A 1 383 ? 16.922 68.485 76.314 1.00 50.70 ? 442 PRO A O 1 ATOM 3088 C CB . PRO A 1 383 ? 14.350 69.308 74.684 1.00 30.24 ? 442 PRO A CB 1 ATOM 3089 C CG . PRO A 1 383 ? 13.463 70.341 74.085 1.00 36.46 ? 442 PRO A CG 1 ATOM 3090 C CD . PRO A 1 383 ? 14.276 71.593 74.023 1.00 38.48 ? 442 PRO A CD 1 ATOM 3091 N N . ALA A 1 384 ? 17.572 70.099 74.882 1.00 45.18 ? 443 ALA A N 1 ATOM 3092 C CA . ALA A 1 384 ? 18.929 69.582 74.743 1.00 32.46 ? 443 ALA A CA 1 ATOM 3093 C C . ALA A 1 384 ? 19.923 70.325 75.631 1.00 36.93 ? 443 ALA A C 1 ATOM 3094 O O . ALA A 1 384 ? 21.135 70.180 75.467 1.00 47.39 ? 443 ALA A O 1 ATOM 3095 C CB . ALA A 1 384 ? 19.371 69.651 73.289 1.00 29.41 ? 443 ALA A CB 1 ATOM 3096 N N . HIS A 1 385 ? 19.410 71.125 76.563 1.00 39.12 ? 444 HIS A N 1 ATOM 3097 C CA . HIS A 1 385 ? 20.265 71.884 77.471 1.00 41.16 ? 444 HIS A CA 1 ATOM 3098 C C . HIS A 1 385 ? 21.098 70.943 78.343 1.00 40.28 ? 444 HIS A C 1 ATOM 3099 O O . HIS A 1 385 ? 20.658 69.835 78.649 1.00 50.34 ? 444 HIS A O 1 ATOM 3100 C CB . HIS A 1 385 ? 19.426 72.824 78.343 1.00 45.90 ? 444 HIS A CB 1 ATOM 3101 C CG . HIS A 1 385 ? 18.660 72.128 79.424 1.00 64.98 ? 444 HIS A CG 1 ATOM 3102 N ND1 . HIS A 1 385 ? 17.503 71.419 79.180 1.00 80.05 ? 444 HIS A ND1 1 ATOM 3103 C CD2 . HIS A 1 385 ? 18.880 72.038 80.757 1.00 62.04 ? 444 HIS A CD2 1 ATOM 3104 C CE1 . HIS A 1 385 ? 17.046 70.921 80.315 1.00 60.62 ? 444 HIS A CE1 1 ATOM 3105 N NE2 . HIS A 1 385 ? 17.864 71.282 81.288 1.00 69.11 ? 444 HIS A NE2 1 ATOM 3106 N N . PRO A 1 386 ? 22.307 71.375 78.747 1.00 38.93 ? 445 PRO A N 1 ATOM 3107 C CA . PRO A 1 386 ? 22.962 72.660 78.459 1.00 42.74 ? 445 PRO A CA 1 ATOM 3108 C C . PRO A 1 386 ? 23.386 72.821 76.999 1.00 42.00 ? 445 PRO A C 1 ATOM 3109 O O . PRO A 1 386 ? 23.957 71.904 76.409 1.00 52.71 ? 445 PRO A O 1 ATOM 3110 C CB . PRO A 1 386 ? 24.189 72.637 79.375 1.00 34.62 ? 445 PRO A CB 1 ATOM 3111 C CG . PRO A 1 386 ? 24.486 71.196 79.557 1.00 36.17 ? 445 PRO A CG 1 ATOM 3112 C CD . PRO A 1 386 ? 23.150 70.515 79.597 1.00 28.63 ? 445 PRO A CD 1 ATOM 3113 N N . ILE A 1 387 ? 23.102 73.990 76.434 1.00 45.51 ? 446 ILE A N 1 ATOM 3114 C CA . ILE A 1 387 ? 23.427 74.278 75.043 1.00 45.43 ? 446 ILE A CA 1 ATOM 3115 C C . ILE A 1 387 ? 24.868 74.768 74.908 1.00 36.38 ? 446 ILE A C 1 ATOM 3116 O O . ILE A 1 387 ? 25.583 74.378 73.985 1.00 33.86 ? 446 ILE A O 1 ATOM 3117 C CB . ILE A 1 387 ? 22.467 75.331 74.453 1.00 33.02 ? 446 ILE A CB 1 ATOM 3118 C CG1 . ILE A 1 387 ? 21.013 74.886 74.626 1.00 37.43 ? 446 ILE A CG1 1 ATOM 3119 C CG2 . ILE A 1 387 ? 22.782 75.587 72.990 1.00 28.89 ? 446 ILE A CG2 1 ATOM 3120 C CD1 . ILE A 1 387 ? 20.714 73.524 74.034 1.00 34.71 ? 446 ILE A CD1 1 ATOM 3121 N N . LEU A 1 388 ? 25.286 75.622 75.835 1.00 34.16 ? 447 LEU A N 1 ATOM 3122 C CA . LEU A 1 388 ? 26.634 76.179 75.821 1.00 42.88 ? 447 LEU A CA 1 ATOM 3123 C C . LEU A 1 388 ? 27.419 75.785 77.063 1.00 34.02 ? 447 LEU A C 1 ATOM 3124 O O . LEU A 1 388 ? 26.861 75.698 78.157 1.00 39.58 ? 447 LEU A O 1 ATOM 3125 C CB . LEU A 1 388 ? 26.589 77.705 75.719 1.00 30.03 ? 447 LEU A CB 1 ATOM 3126 C CG . LEU A 1 388 ? 26.132 78.341 74.407 1.00 46.01 ? 447 LEU A CG 1 ATOM 3127 C CD1 . LEU A 1 388 ? 26.003 79.845 74.580 1.00 31.24 ? 447 LEU A CD1 1 ATOM 3128 C CD2 . LEU A 1 388 ? 27.102 78.011 73.284 1.00 41.31 ? 447 LEU A CD2 1 ATOM 3129 N N . ALA A 1 389 ? 28.713 75.540 76.890 1.00 37.24 ? 448 ALA A N 1 ATOM 3130 C CA . ALA A 1 389 ? 29.607 75.414 78.032 1.00 39.66 ? 448 ALA A CA 1 ATOM 3131 C C . ALA A 1 389 ? 29.635 76.753 78.757 1.00 37.80 ? 448 ALA A C 1 ATOM 3132 O O . ALA A 1 389 ? 29.647 77.807 78.121 1.00 44.74 ? 448 ALA A O 1 ATOM 3133 C CB . ALA A 1 389 ? 31.001 75.001 77.594 1.00 27.07 ? 448 ALA A CB 1 ATOM 3134 N N . TYR A 1 390 ? 29.644 76.711 80.085 1.00 30.57 ? 449 TYR A N 1 ATOM 3135 C CA . TYR A 1 390 ? 29.489 77.919 80.888 1.00 42.56 ? 449 TYR A CA 1 ATOM 3136 C C . TYR A 1 390 ? 30.650 78.896 80.718 1.00 46.84 ? 449 TYR A C 1 ATOM 3137 O O . TYR A 1 390 ? 30.513 80.083 81.008 1.00 48.00 ? 449 TYR A O 1 ATOM 3138 C CB . TYR A 1 390 ? 29.323 77.556 82.365 1.00 40.12 ? 449 TYR A CB 1 ATOM 3139 C CG . TYR A 1 390 ? 28.089 76.731 82.655 1.00 49.66 ? 449 TYR A CG 1 ATOM 3140 C CD1 . TYR A 1 390 ? 26.959 76.833 81.853 1.00 43.84 ? 449 TYR A CD1 1 ATOM 3141 C CD2 . TYR A 1 390 ? 28.050 75.858 83.734 1.00 49.44 ? 449 TYR A CD2 1 ATOM 3142 C CE1 . TYR A 1 390 ? 25.828 76.083 82.113 1.00 51.33 ? 449 TYR A CE1 1 ATOM 3143 C CE2 . TYR A 1 390 ? 26.921 75.105 84.003 1.00 36.93 ? 449 TYR A CE2 1 ATOM 3144 C CZ . TYR A 1 390 ? 25.814 75.221 83.189 1.00 48.74 ? 449 TYR A CZ 1 ATOM 3145 O OH . TYR A 1 390 ? 24.688 74.474 83.452 1.00 52.36 ? 449 TYR A OH 1 ATOM 3146 N N . LYS A 1 391 ? 31.788 78.393 80.250 1.00 26.55 ? 450 LYS A N 1 ATOM 3147 C CA . LYS A 1 391 ? 32.975 79.221 80.055 1.00 32.94 ? 450 LYS A CA 1 ATOM 3148 C C . LYS A 1 391 ? 32.774 80.312 79.001 1.00 39.53 ? 450 LYS A C 1 ATOM 3149 O O . LYS A 1 391 ? 33.545 81.269 78.940 1.00 53.92 ? 450 LYS A O 1 ATOM 3150 C CB . LYS A 1 391 ? 34.170 78.347 79.668 1.00 26.31 ? 450 LYS A CB 1 ATOM 3151 C CG . LYS A 1 391 ? 33.906 77.425 78.490 1.00 46.98 ? 450 LYS A CG 1 ATOM 3152 C CD . LYS A 1 391 ? 35.139 76.607 78.142 1.00 29.44 ? 450 LYS A CD 1 ATOM 3153 C CE . LYS A 1 391 ? 34.794 75.478 77.185 1.00 36.36 ? 450 LYS A CE 1 ATOM 3154 N NZ . LYS A 1 391 ? 36.008 74.746 76.735 1.00 36.81 ? 450 LYS A NZ 1 ATOM 3155 N N . HIS A 1 392 ? 31.744 80.164 78.172 1.00 33.74 ? 451 HIS A N 1 ATOM 3156 C CA . HIS A 1 392 ? 31.431 81.163 77.153 1.00 39.06 ? 451 HIS A CA 1 ATOM 3157 C C . HIS A 1 392 ? 30.702 82.372 77.734 1.00 50.43 ? 451 HIS A C 1 ATOM 3158 O O . HIS A 1 392 ? 30.696 83.447 77.132 1.00 46.28 ? 451 HIS A O 1 ATOM 3159 C CB . HIS A 1 392 ? 30.598 80.542 76.028 1.00 28.90 ? 451 HIS A CB 1 ATOM 3160 C CG . HIS A 1 392 ? 31.367 79.595 75.161 1.00 39.39 ? 451 HIS A CG 1 ATOM 3161 N ND1 . HIS A 1 392 ? 32.146 80.020 74.106 1.00 40.72 ? 451 HIS A ND1 1 ATOM 3162 C CD2 . HIS A 1 392 ? 31.482 78.247 75.194 1.00 44.73 ? 451 HIS A CD2 1 ATOM 3163 C CE1 . HIS A 1 392 ? 32.706 78.974 73.526 1.00 34.19 ? 451 HIS A CE1 1 ATOM 3164 N NE2 . HIS A 1 392 ? 32.319 77.886 74.167 1.00 51.26 ? 451 HIS A NE2 1 ATOM 3165 N N . TYR A 1 393 ? 30.087 82.194 78.900 1.00 45.51 ? 452 TYR A N 1 ATOM 3166 C CA . TYR A 1 393 ? 29.374 83.286 79.562 1.00 36.33 ? 452 TYR A CA 1 ATOM 3167 C C . TYR A 1 393 ? 30.291 84.452 79.967 1.00 34.50 ? 452 TYR A C 1 ATOM 3168 O O . TYR A 1 393 ? 29.979 85.601 79.655 1.00 33.74 ? 452 TYR A O 1 ATOM 3169 C CB . TYR A 1 393 ? 28.605 82.774 80.786 1.00 40.18 ? 452 TYR A CB 1 ATOM 3170 C CG . TYR A 1 393 ? 27.441 81.870 80.452 1.00 39.40 ? 452 TYR A CG 1 ATOM 3171 C CD1 . TYR A 1 393 ? 26.785 81.973 79.233 1.00 42.95 ? 452 TYR A CD1 1 ATOM 3172 C CD2 . TYR A 1 393 ? 26.987 80.923 81.361 1.00 50.77 ? 452 TYR A CD2 1 ATOM 3173 C CE1 . TYR A 1 393 ? 25.717 81.153 78.924 1.00 47.92 ? 452 TYR A CE1 1 ATOM 3174 C CE2 . TYR A 1 393 ? 25.918 80.099 81.061 1.00 52.03 ? 452 TYR A CE2 1 ATOM 3175 C CZ . TYR A 1 393 ? 25.287 80.219 79.840 1.00 43.87 ? 452 TYR A CZ 1 ATOM 3176 O OH . TYR A 1 393 ? 24.224 79.401 79.536 1.00 47.16 ? 452 TYR A OH 1 ATOM 3177 N N . PRO A 1 394 ? 31.415 84.177 80.665 1.00 47.31 ? 453 PRO A N 1 ATOM 3178 C CA . PRO A 1 394 ? 32.281 85.324 80.967 1.00 53.64 ? 453 PRO A CA 1 ATOM 3179 C C . PRO A 1 394 ? 32.871 85.955 79.708 1.00 55.95 ? 453 PRO A C 1 ATOM 3180 O O . PRO A 1 394 ? 33.172 87.148 79.703 1.00 73.08 ? 453 PRO A O 1 ATOM 3181 C CB . PRO A 1 394 ? 33.385 84.722 81.844 1.00 40.09 ? 453 PRO A CB 1 ATOM 3182 C CG . PRO A 1 394 ? 33.365 83.271 81.557 1.00 34.33 ? 453 PRO A CG 1 ATOM 3183 C CD . PRO A 1 394 ? 31.949 82.926 81.235 1.00 38.84 ? 453 PRO A CD 1 ATOM 3184 N N . ALA A 1 395 ? 33.039 85.154 78.660 1.00 44.36 ? 454 ALA A N 1 ATOM 3185 C CA . ALA A 1 395 ? 33.553 85.649 77.388 1.00 25.62 ? 454 ALA A CA 1 ATOM 3186 C C . ALA A 1 395 ? 32.580 86.642 76.762 1.00 50.41 ? 454 ALA A C 1 ATOM 3187 O O . ALA A 1 395 ? 32.985 87.700 76.279 1.00 45.21 ? 454 ALA A O 1 ATOM 3188 C CB . ALA A 1 395 ? 33.819 84.495 76.436 1.00 32.08 ? 454 ALA A CB 1 HETATM 3189 N N . MSE A 1 396 ? 31.297 86.293 76.773 1.00 27.85 ? 455 MSE A N 1 HETATM 3190 C CA . MSE A 1 396 ? 30.259 87.155 76.218 1.00 40.01 ? 455 MSE A CA 1 HETATM 3191 C C . MSE A 1 396 ? 30.129 88.451 77.009 1.00 54.68 ? 455 MSE A C 1 HETATM 3192 O O . MSE A 1 396 ? 29.876 89.513 76.439 1.00 43.58 ? 455 MSE A O 1 HETATM 3193 C CB . MSE A 1 396 ? 28.917 86.424 76.182 1.00 31.21 ? 455 MSE A CB 1 HETATM 3194 C CG . MSE A 1 396 ? 28.664 85.668 74.889 1.00 42.30 ? 455 MSE A CG 1 HETATM 3195 SE SE . MSE A 1 396 ? 26.985 84.678 74.901 1.00 67.62 ? 455 MSE A SE 1 HETATM 3196 C CE . MSE A 1 396 ? 27.514 83.213 76.068 1.00 57.76 ? 455 MSE A CE 1 ATOM 3197 N N . GLU A 1 397 ? 30.297 88.359 78.324 1.00 54.35 ? 456 GLU A N 1 ATOM 3198 C CA . GLU A 1 397 ? 30.296 89.544 79.171 1.00 49.73 ? 456 GLU A CA 1 ATOM 3199 C C . GLU A 1 397 ? 31.494 90.424 78.838 1.00 46.05 ? 456 GLU A C 1 ATOM 3200 O O . GLU A 1 397 ? 31.377 91.647 78.764 1.00 42.66 ? 456 GLU A O 1 ATOM 3201 C CB . GLU A 1 397 ? 30.314 89.154 80.651 1.00 55.70 ? 456 GLU A CB 1 ATOM 3202 C CG . GLU A 1 397 ? 29.077 88.399 81.116 1.00 50.85 ? 456 GLU A CG 1 ATOM 3203 C CD . GLU A 1 397 ? 27.824 89.254 81.086 1.00 48.32 ? 456 GLU A CD 1 ATOM 3204 O OE1 . GLU A 1 397 ? 27.942 90.488 81.231 1.00 60.39 ? 456 GLU A OE1 1 ATOM 3205 O OE2 . GLU A 1 397 ? 26.721 88.693 80.917 1.00 36.06 ? 456 GLU A OE2 1 ATOM 3206 N N . ARG A 1 398 ? 32.644 89.788 78.628 1.00 53.12 ? 457 ARG A N 1 ATOM 3207 C CA . ARG A 1 398 ? 33.870 90.497 78.279 1.00 49.30 ? 457 ARG A CA 1 ATOM 3208 C C . ARG A 1 398 ? 33.744 91.205 76.935 1.00 42.63 ? 457 ARG A C 1 ATOM 3209 O O . ARG A 1 398 ? 34.221 92.326 76.766 1.00 49.14 ? 457 ARG A O 1 ATOM 3210 C CB . ARG A 1 398 ? 35.057 89.529 78.249 1.00 38.59 ? 457 ARG A CB 1 ATOM 3211 C CG . ARG A 1 398 ? 36.383 90.185 77.894 1.00 36.32 ? 457 ARG A CG 1 ATOM 3212 C CD . ARG A 1 398 ? 37.520 89.175 77.848 1.00 37.88 ? 457 ARG A CD 1 ATOM 3213 N NE . ARG A 1 398 ? 37.337 88.171 76.804 1.00 48.79 ? 457 ARG A NE 1 ATOM 3214 C CZ . ARG A 1 398 ? 37.117 86.881 77.038 1.00 50.29 ? 457 ARG A CZ 1 ATOM 3215 N NH1 . ARG A 1 398 ? 37.051 86.434 78.284 1.00 42.97 ? 457 ARG A NH1 1 ATOM 3216 N NH2 . ARG A 1 398 ? 36.965 86.037 76.026 1.00 43.02 ? 457 ARG A NH2 1 ATOM 3217 N N . ARG A 1 399 ? 33.093 90.544 75.984 1.00 38.23 ? 458 ARG A N 1 ATOM 3218 C CA . ARG A 1 399 ? 32.919 91.100 74.649 1.00 38.78 ? 458 ARG A CA 1 ATOM 3219 C C . ARG A 1 399 ? 31.907 92.240 74.652 1.00 45.70 ? 458 ARG A C 1 ATOM 3220 O O . ARG A 1 399 ? 32.065 93.217 73.922 1.00 39.40 ? 458 ARG A O 1 ATOM 3221 C CB . ARG A 1 399 ? 32.495 90.003 73.672 1.00 30.80 ? 458 ARG A CB 1 ATOM 3222 C CG . ARG A 1 399 ? 33.607 89.010 73.371 1.00 43.70 ? 458 ARG A CG 1 ATOM 3223 C CD . ARG A 1 399 ? 33.081 87.727 72.756 1.00 41.47 ? 458 ARG A CD 1 ATOM 3224 N NE . ARG A 1 399 ? 34.069 86.655 72.840 1.00 31.54 ? 458 ARG A NE 1 ATOM 3225 C CZ . ARG A 1 399 ? 33.813 85.376 72.586 1.00 27.69 ? 458 ARG A CZ 1 ATOM 3226 N NH1 . ARG A 1 399 ? 32.593 84.998 72.229 1.00 32.68 ? 458 ARG A NH1 1 ATOM 3227 N NH2 . ARG A 1 399 ? 34.778 84.473 72.690 1.00 40.01 ? 458 ARG A NH2 1 ATOM 3228 N N . LEU A 1 400 ? 30.869 92.107 75.473 1.00 49.37 ? 459 LEU A N 1 ATOM 3229 C CA . LEU A 1 400 ? 29.868 93.159 75.624 1.00 51.03 ? 459 LEU A CA 1 ATOM 3230 C C . LEU A 1 400 ? 30.501 94.449 76.132 1.00 55.18 ? 459 LEU A C 1 ATOM 3231 O O . LEU A 1 400 ? 30.231 95.531 75.611 1.00 37.67 ? 459 LEU A O 1 ATOM 3232 C CB . LEU A 1 400 ? 28.756 92.714 76.575 1.00 47.72 ? 459 LEU A CB 1 ATOM 3233 C CG . LEU A 1 400 ? 27.674 93.760 76.860 1.00 40.71 ? 459 LEU A CG 1 ATOM 3234 C CD1 . LEU A 1 400 ? 26.939 94.141 75.585 1.00 28.55 ? 459 LEU A CD1 1 ATOM 3235 C CD2 . LEU A 1 400 ? 26.703 93.261 77.917 1.00 32.62 ? 459 LEU A CD2 1 ATOM 3236 N N . ALA A 1 401 ? 31.343 94.322 77.153 1.00 52.02 ? 460 ALA A N 1 ATOM 3237 C CA . ALA A 1 401 ? 32.047 95.462 77.731 1.00 47.61 ? 460 ALA A CA 1 ATOM 3238 C C . ALA A 1 401 ? 32.927 96.166 76.701 1.00 48.30 ? 460 ALA A C 1 ATOM 3239 O O . ALA A 1 401 ? 32.993 97.394 76.666 1.00 50.07 ? 460 ALA A O 1 ATOM 3240 C CB . ALA A 1 401 ? 32.883 95.016 78.921 1.00 35.89 ? 460 ALA A CB 1 ATOM 3241 N N . LYS A 1 402 ? 33.602 95.380 75.868 1.00 27.01 ? 461 LYS A N 1 ATOM 3242 C CA . LYS A 1 402 ? 34.457 95.928 74.821 1.00 51.70 ? 461 LYS A CA 1 ATOM 3243 C C . LYS A 1 402 ? 33.642 96.675 73.769 1.00 51.71 ? 461 LYS A C 1 ATOM 3244 O O . LYS A 1 402 ? 34.092 97.683 73.224 1.00 52.27 ? 461 LYS A O 1 ATOM 3245 C CB . LYS A 1 402 ? 35.276 94.815 74.164 1.00 37.27 ? 461 LYS A CB 1 ATOM 3246 C CG . LYS A 1 402 ? 36.274 94.153 75.101 1.00 41.46 ? 461 LYS A CG 1 ATOM 3247 C CD . LYS A 1 402 ? 37.020 93.020 74.419 1.00 42.18 ? 461 LYS A CD 1 ATOM 3248 C CE . LYS A 1 402 ? 38.236 92.602 75.230 1.00 52.28 ? 461 LYS A CE 1 ATOM 3249 N NZ . LYS A 1 402 ? 39.046 91.565 74.533 1.00 59.48 ? 461 LYS A NZ 1 ATOM 3250 N N . ILE A 1 403 ? 32.445 96.170 73.484 1.00 50.65 ? 462 ILE A N 1 ATOM 3251 C CA . ILE A 1 403 ? 31.546 96.816 72.533 1.00 44.24 ? 462 ILE A CA 1 ATOM 3252 C C . ILE A 1 403 ? 31.155 98.209 73.019 1.00 52.59 ? 462 ILE A C 1 ATOM 3253 O O . ILE A 1 403 ? 31.138 99.165 72.243 1.00 39.94 ? 462 ILE A O 1 ATOM 3254 C CB . ILE A 1 403 ? 30.274 95.974 72.297 1.00 30.58 ? 462 ILE A CB 1 ATOM 3255 C CG1 . ILE A 1 403 ? 30.611 94.719 71.492 1.00 35.41 ? 462 ILE A CG1 1 ATOM 3256 C CG2 . ILE A 1 403 ? 29.216 96.783 71.566 1.00 37.22 ? 462 ILE A CG2 1 ATOM 3257 C CD1 . ILE A 1 403 ? 29.562 93.634 71.589 1.00 39.83 ? 462 ILE A CD1 1 HETATM 3258 N N . MSE A 1 404 ? 30.859 98.319 74.311 1.00 24.47 ? 463 MSE A N 1 HETATM 3259 C CA . MSE A 1 404 ? 30.467 99.591 74.905 1.00 43.67 ? 463 MSE A CA 1 HETATM 3260 C C . MSE A 1 404 ? 31.610 100.601 74.859 1.00 51.40 ? 463 MSE A C 1 HETATM 3261 O O . MSE A 1 404 ? 31.381 101.809 74.804 1.00 44.46 ? 463 MSE A O 1 HETATM 3262 C CB . MSE A 1 404 ? 30.003 99.387 76.348 1.00 25.75 ? 463 MSE A CB 1 HETATM 3263 C CG . MSE A 1 404 ? 28.906 98.346 76.502 1.00 33.47 ? 463 MSE A CG 1 HETATM 3264 SE SE . MSE A 1 404 ? 27.387 98.649 75.316 1.00 79.68 ? 463 MSE A SE 1 HETATM 3265 C CE . MSE A 1 404 ? 26.958 100.477 75.832 1.00 52.17 ? 463 MSE A CE 1 ATOM 3266 N N . SER A 1 405 ? 32.841 100.100 74.880 1.00 44.67 ? 464 SER A N 1 ATOM 3267 C CA . SER A 1 405 ? 34.014 100.957 74.771 1.00 40.70 ? 464 SER A CA 1 ATOM 3268 C C . SER A 1 405 ? 34.125 101.532 73.364 1.00 50.51 ? 464 SER A C 1 ATOM 3269 O O . SER A 1 405 ? 34.465 102.701 73.187 1.00 51.91 ? 464 SER A O 1 ATOM 3270 C CB . SER A 1 405 ? 35.283 100.183 75.133 1.00 40.16 ? 464 SER A CB 1 ATOM 3271 O OG . SER A 1 405 ? 35.157 99.570 76.404 1.00 63.15 ? 464 SER A OG 1 ATOM 3272 N N . HIS A 1 406 ? 33.838 100.701 72.366 1.00 51.38 ? 465 HIS A N 1 ATOM 3273 C CA . HIS A 1 406 ? 33.845 101.141 70.975 1.00 43.75 ? 465 HIS A CA 1 ATOM 3274 C C . HIS A 1 406 ? 32.717 102.132 70.715 1.00 45.17 ? 465 HIS A C 1 ATOM 3275 O O . HIS A 1 406 ? 32.853 103.040 69.895 1.00 58.10 ? 465 HIS A O 1 ATOM 3276 C CB . HIS A 1 406 ? 33.730 99.945 70.027 1.00 32.34 ? 465 HIS A CB 1 ATOM 3277 C CG . HIS A 1 406 ? 34.872 98.983 70.129 1.00 53.58 ? 465 HIS A CG 1 ATOM 3278 N ND1 . HIS A 1 406 ? 36.158 99.383 70.421 1.00 63.52 ? 465 HIS A ND1 1 ATOM 3279 C CD2 . HIS A 1 406 ? 34.922 97.639 69.974 1.00 60.10 ? 465 HIS A CD2 1 ATOM 3280 C CE1 . HIS A 1 406 ? 36.951 98.327 70.444 1.00 60.28 ? 465 HIS A CE1 1 ATOM 3281 N NE2 . HIS A 1 406 ? 36.226 97.256 70.176 1.00 69.24 ? 465 HIS A NE2 1 ATOM 3282 N N . ILE A 1 407 ? 31.602 101.949 71.415 1.00 40.93 ? 466 ILE A N 1 ATOM 3283 C CA . ILE A 1 407 ? 30.464 102.851 71.290 1.00 50.19 ? 466 ILE A CA 1 ATOM 3284 C C . ILE A 1 407 ? 30.809 104.207 71.900 1.00 55.72 ? 466 ILE A C 1 ATOM 3285 O O . ILE A 1 407 ? 30.487 105.253 71.335 1.00 36.53 ? 466 ILE A O 1 ATOM 3286 C CB . ILE A 1 407 ? 29.203 102.278 71.968 1.00 39.78 ? 466 ILE A CB 1 ATOM 3287 C CG1 . ILE A 1 407 ? 28.721 101.028 71.228 1.00 38.06 ? 466 ILE A CG1 1 ATOM 3288 C CG2 . ILE A 1 407 ? 28.092 103.316 72.008 1.00 45.86 ? 466 ILE A CG2 1 ATOM 3289 C CD1 . ILE A 1 407 ? 27.611 100.288 71.942 1.00 37.94 ? 466 ILE A CD1 1 ATOM 3290 N N . LEU A 1 408 ? 31.471 104.178 73.054 1.00 52.87 ? 467 LEU A N 1 ATOM 3291 C CA . LEU A 1 408 ? 31.921 105.401 73.711 1.00 51.12 ? 467 LEU A CA 1 ATOM 3292 C C . LEU A 1 408 ? 32.872 106.194 72.823 1.00 55.85 ? 467 LEU A C 1 ATOM 3293 O O . LEU A 1 408 ? 32.836 107.423 72.804 1.00 53.44 ? 467 LEU A O 1 ATOM 3294 C CB . LEU A 1 408 ? 32.602 105.076 75.041 1.00 44.56 ? 467 LEU A CB 1 ATOM 3295 C CG . LEU A 1 408 ? 33.141 106.272 75.832 1.00 45.96 ? 467 LEU A CG 1 ATOM 3296 C CD1 . LEU A 1 408 ? 32.045 107.295 76.086 1.00 45.61 ? 467 LEU A CD1 1 ATOM 3297 C CD2 . LEU A 1 408 ? 33.761 105.811 77.142 1.00 47.49 ? 467 LEU A CD2 1 ATOM 3298 N N . GLU A 1 409 ? 33.719 105.484 72.086 1.00 53.57 ? 468 GLU A N 1 ATOM 3299 C CA . GLU A 1 409 ? 34.651 106.131 71.173 1.00 54.95 ? 468 GLU A CA 1 ATOM 3300 C C . GLU A 1 409 ? 33.902 106.779 70.014 1.00 61.29 ? 468 GLU A C 1 ATOM 3301 O O . GLU A 1 409 ? 34.266 107.863 69.559 1.00 64.88 ? 468 GLU A O 1 ATOM 3302 C CB . GLU A 1 409 ? 35.682 105.127 70.652 1.00 55.53 ? 468 GLU A CB 1 ATOM 3303 C CG . GLU A 1 409 ? 36.642 104.621 71.720 1.00 78.29 ? 468 GLU A CG 1 ATOM 3304 C CD . GLU A 1 409 ? 37.500 103.465 71.240 1.00 99.88 ? 468 GLU A CD 1 ATOM 3305 O OE1 . GLU A 1 409 ? 37.271 102.979 70.112 1.00 113.40 ? 468 GLU A OE1 1 ATOM 3306 O OE2 . GLU A 1 409 ? 38.404 103.043 71.991 1.00 93.24 ? 468 GLU A OE2 1 ATOM 3307 N N . CYS A 1 410 ? 32.854 106.111 69.540 1.00 52.20 ? 469 CYS A N 1 ATOM 3308 C CA . CYS A 1 410 ? 32.015 106.662 68.481 1.00 53.48 ? 469 CYS A CA 1 ATOM 3309 C C . CYS A 1 410 ? 31.254 107.906 68.938 1.00 58.33 ? 469 CYS A C 1 ATOM 3310 O O . CYS A 1 410 ? 31.107 108.863 68.178 1.00 66.92 ? 469 CYS A O 1 ATOM 3311 C CB . CYS A 1 410 ? 31.029 105.606 67.978 1.00 42.51 ? 469 CYS A CB 1 ATOM 3312 S SG . CYS A 1 410 ? 31.759 104.360 66.894 1.00 40.58 ? 469 CYS A SG 1 ATOM 3313 N N . PHE A 1 411 ? 30.772 107.887 70.177 1.00 60.49 ? 470 PHE A N 1 ATOM 3314 C CA . PHE A 1 411 ? 30.068 109.036 70.744 1.00 58.01 ? 470 PHE A CA 1 ATOM 3315 C C . PHE A 1 411 ? 30.974 110.248 70.923 1.00 60.21 ? 470 PHE A C 1 ATOM 3316 O O . PHE A 1 411 ? 30.569 111.381 70.669 1.00 50.87 ? 470 PHE A O 1 ATOM 3317 C CB . PHE A 1 411 ? 29.437 108.676 72.092 1.00 51.11 ? 470 PHE A CB 1 ATOM 3318 C CG . PHE A 1 411 ? 28.203 107.826 71.984 1.00 45.76 ? 470 PHE A CG 1 ATOM 3319 C CD1 . PHE A 1 411 ? 27.665 107.503 70.751 1.00 41.50 ? 470 PHE A CD1 1 ATOM 3320 C CD2 . PHE A 1 411 ? 27.568 107.369 73.125 1.00 47.13 ? 470 PHE A CD2 1 ATOM 3321 C CE1 . PHE A 1 411 ? 26.526 106.726 70.661 1.00 57.39 ? 470 PHE A CE1 1 ATOM 3322 C CE2 . PHE A 1 411 ? 26.430 106.595 73.040 1.00 52.59 ? 470 PHE A CE2 1 ATOM 3323 C CZ . PHE A 1 411 ? 25.908 106.272 71.807 1.00 53.91 ? 470 PHE A CZ 1 ATOM 3324 N N . GLU A 1 412 ? 32.202 110.003 71.363 1.00 57.11 ? 471 GLU A N 1 ATOM 3325 C CA . GLU A 1 412 ? 33.137 111.081 71.660 1.00 48.29 ? 471 GLU A CA 1 ATOM 3326 C C . GLU A 1 412 ? 33.769 111.661 70.401 1.00 53.13 ? 471 GLU A C 1 ATOM 3327 O O . GLU A 1 412 ? 34.106 112.844 70.355 1.00 57.60 ? 471 GLU A O 1 ATOM 3328 C CB . GLU A 1 412 ? 34.224 110.585 72.616 1.00 33.82 ? 471 GLU A CB 1 ATOM 3329 C CG . GLU A 1 412 ? 33.710 110.262 74.010 1.00 43.72 ? 471 GLU A CG 1 ATOM 3330 C CD . GLU A 1 412 ? 34.790 109.714 74.920 1.00 57.48 ? 471 GLU A CD 1 ATOM 3331 O OE1 . GLU A 1 412 ? 35.831 109.261 74.402 1.00 66.74 ? 471 GLU A OE1 1 ATOM 3332 O OE2 . GLU A 1 412 ? 34.596 109.736 76.154 1.00 52.44 ? 471 GLU A OE2 1 ATOM 3333 N N . SER A 1 413 ? 33.930 110.826 69.382 1.00 40.47 ? 472 SER A N 1 ATOM 3334 C CA . SER A 1 413 ? 34.556 111.259 68.139 1.00 53.29 ? 472 SER A CA 1 ATOM 3335 C C . SER A 1 413 ? 33.581 111.920 67.165 1.00 60.00 ? 472 SER A C 1 ATOM 3336 O O . SER A 1 413 ? 33.890 112.960 66.585 1.00 81.35 ? 472 SER A O 1 ATOM 3337 C CB . SER A 1 413 ? 35.242 110.073 67.456 1.00 56.18 ? 472 SER A CB 1 ATOM 3338 O OG . SER A 1 413 ? 34.292 109.175 66.913 1.00 74.13 ? 472 SER A OG 1 ATOM 3339 N N . ARG A 1 414 ? 32.409 111.318 66.985 1.00 55.77 ? 473 ARG A N 1 ATOM 3340 C CA . ARG A 1 414 ? 31.454 111.807 65.994 1.00 48.41 ? 473 ARG A CA 1 ATOM 3341 C C . ARG A 1 414 ? 30.201 112.456 66.585 1.00 51.05 ? 473 ARG A C 1 ATOM 3342 O O . ARG A 1 414 ? 29.375 112.994 65.849 1.00 54.00 ? 473 ARG A O 1 ATOM 3343 C CB . ARG A 1 414 ? 31.049 110.658 65.068 1.00 51.85 ? 473 ARG A CB 1 ATOM 3344 C CG . ARG A 1 414 ? 32.241 109.887 64.525 1.00 62.71 ? 473 ARG A CG 1 ATOM 3345 C CD . ARG A 1 414 ? 31.913 109.141 63.246 1.00 64.80 ? 473 ARG A CD 1 ATOM 3346 N NE . ARG A 1 414 ? 33.128 108.721 62.554 1.00 79.33 ? 473 ARG A NE 1 ATOM 3347 C CZ . ARG A 1 414 ? 33.149 107.922 61.493 1.00 96.37 ? 473 ARG A CZ 1 ATOM 3348 N NH1 . ARG A 1 414 ? 32.015 107.446 60.997 1.00 107.07 ? 473 ARG A NH1 1 ATOM 3349 N NH2 . ARG A 1 414 ? 34.303 107.595 60.928 1.00 97.06 ? 473 ARG A NH2 1 ATOM 3350 N N . GLY A 1 415 ? 30.058 112.409 67.904 1.00 50.09 ? 474 GLY A N 1 ATOM 3351 C CA . GLY A 1 415 ? 28.874 112.949 68.550 1.00 47.98 ? 474 GLY A CA 1 ATOM 3352 C C . GLY A 1 415 ? 27.722 111.964 68.618 1.00 60.20 ? 474 GLY A C 1 ATOM 3353 O O . GLY A 1 415 ? 27.572 111.107 67.747 1.00 57.76 ? 474 GLY A O 1 ATOM 3354 N N . VAL A 1 416 ? 26.900 112.096 69.655 1.00 57.59 ? 475 VAL A N 1 ATOM 3355 C CA . VAL A 1 416 ? 25.802 111.168 69.907 1.00 56.13 ? 475 VAL A CA 1 ATOM 3356 C C . VAL A 1 416 ? 24.682 111.307 68.875 1.00 52.23 ? 475 VAL A C 1 ATOM 3357 O O . VAL A 1 416 ? 24.005 110.332 68.539 1.00 56.86 ? 475 VAL A O 1 ATOM 3358 C CB . VAL A 1 416 ? 25.235 111.378 71.339 1.00 57.65 ? 475 VAL A CB 1 ATOM 3359 C CG1 . VAL A 1 416 ? 23.711 111.432 71.349 1.00 63.97 ? 475 VAL A CG1 1 ATOM 3360 C CG2 . VAL A 1 416 ? 25.747 110.299 72.276 1.00 55.89 ? 475 VAL A CG2 1 ATOM 3361 N N . ALA A 1 417 ? 24.529 112.509 68.333 1.00 58.21 ? 476 ALA A N 1 ATOM 3362 C CA . ALA A 1 417 ? 23.453 112.792 67.392 1.00 52.28 ? 476 ALA A CA 1 ATOM 3363 C C . ALA A 1 417 ? 23.742 112.203 66.017 1.00 47.30 ? 476 ALA A C 1 ATOM 3364 O O . ALA A 1 417 ? 22.849 112.107 65.175 1.00 62.46 ? 476 ALA A O 1 ATOM 3365 C CB . ALA A 1 417 ? 23.223 114.291 67.287 1.00 50.37 ? 476 ALA A CB 1 ATOM 3366 N N . GLU A 1 418 ? 24.990 111.804 65.791 1.00 47.20 ? 477 GLU A N 1 ATOM 3367 C CA . GLU A 1 418 ? 25.376 111.248 64.500 1.00 66.44 ? 477 GLU A CA 1 ATOM 3368 C C . GLU A 1 418 ? 25.490 109.727 64.550 1.00 55.33 ? 477 GLU A C 1 ATOM 3369 O O . GLU A 1 418 ? 25.445 109.061 63.516 1.00 58.39 ? 477 GLU A O 1 ATOM 3370 C CB . GLU A 1 418 ? 26.707 111.851 64.044 1.00 59.02 ? 477 GLU A CB 1 ATOM 3371 C CG . GLU A 1 418 ? 26.727 113.372 64.011 1.00 73.14 ? 477 GLU A CG 1 ATOM 3372 C CD . GLU A 1 418 ? 25.601 113.962 63.187 1.00 98.21 ? 477 GLU A CD 1 ATOM 3373 O OE1 . GLU A 1 418 ? 25.409 113.522 62.033 1.00 104.56 ? 477 GLU A OE1 1 ATOM 3374 O OE2 . GLU A 1 418 ? 24.907 114.867 63.694 1.00 94.49 ? 477 GLU A OE2 1 ATOM 3375 N N . VAL A 1 419 ? 25.635 109.183 65.753 1.00 46.92 ? 478 VAL A N 1 ATOM 3376 C CA . VAL A 1 419 ? 25.695 107.736 65.937 1.00 60.23 ? 478 VAL A CA 1 ATOM 3377 C C . VAL A 1 419 ? 24.317 107.097 66.089 1.00 59.35 ? 478 VAL A C 1 ATOM 3378 O O . VAL A 1 419 ? 23.964 106.173 65.357 1.00 57.97 ? 478 VAL A O 1 ATOM 3379 C CB . VAL A 1 419 ? 26.538 107.360 67.168 1.00 44.15 ? 478 VAL A CB 1 ATOM 3380 C CG1 . VAL A 1 419 ? 26.620 105.848 67.305 1.00 55.86 ? 478 VAL A CG1 1 ATOM 3381 C CG2 . VAL A 1 419 ? 27.929 107.963 67.064 1.00 38.22 ? 478 VAL A CG2 1 ATOM 3382 N N . LEU A 1 420 ? 23.545 107.601 67.047 1.00 52.94 ? 479 LEU A N 1 ATOM 3383 C CA . LEU A 1 420 ? 22.244 107.029 67.379 1.00 48.91 ? 479 LEU A CA 1 ATOM 3384 C C . LEU A 1 420 ? 21.131 107.495 66.446 1.00 48.48 ? 479 LEU A C 1 ATOM 3385 O O . LEU A 1 420 ? 20.363 108.396 66.784 1.00 63.34 ? 479 LEU A O 1 ATOM 3386 C CB . LEU A 1 420 ? 21.875 107.371 68.824 1.00 30.26 ? 479 LEU A CB 1 ATOM 3387 C CG . LEU A 1 420 ? 22.835 106.867 69.903 1.00 40.87 ? 479 LEU A CG 1 ATOM 3388 C CD1 . LEU A 1 420 ? 22.401 107.350 71.278 1.00 42.48 ? 479 LEU A CD1 1 ATOM 3389 C CD2 . LEU A 1 420 ? 22.936 105.351 69.867 1.00 56.13 ? 479 LEU A CD2 1 ATOM 3390 N N . VAL A 1 421 ? 21.047 106.878 65.272 1.00 49.01 ? 480 VAL A N 1 ATOM 3391 C CA . VAL A 1 421 ? 20.023 107.235 64.299 1.00 48.68 ? 480 VAL A CA 1 ATOM 3392 C C . VAL A 1 421 ? 19.142 106.034 63.954 1.00 57.42 ? 480 VAL A C 1 ATOM 3393 O O . VAL A 1 421 ? 19.611 104.897 63.902 1.00 45.08 ? 480 VAL A O 1 ATOM 3394 C CB . VAL A 1 421 ? 20.647 107.807 63.005 1.00 47.05 ? 480 VAL A CB 1 ATOM 3395 C CG1 . VAL A 1 421 ? 21.415 109.086 63.306 1.00 50.50 ? 480 VAL A CG1 1 ATOM 3396 C CG2 . VAL A 1 421 ? 21.550 106.777 62.338 1.00 39.29 ? 480 VAL A CG2 1 ATOM 3397 N N . ALA A 1 422 ? 17.860 106.299 63.724 1.00 58.30 ? 481 ALA A N 1 ATOM 3398 C CA . ALA A 1 422 ? 16.898 105.247 63.417 1.00 40.24 ? 481 ALA A CA 1 ATOM 3399 C C . ALA A 1 422 ? 16.943 104.926 61.928 1.00 46.85 ? 481 ALA A C 1 ATOM 3400 O O . ALA A 1 422 ? 16.532 103.850 61.495 1.00 56.12 ? 481 ALA A O 1 ATOM 3401 C CB . ALA A 1 422 ? 15.499 105.660 63.838 1.00 31.58 ? 481 ALA A CB 1 ATOM 3402 N N . GLU A 1 423 ? 17.442 105.883 61.154 1.00 56.71 ? 482 GLU A N 1 ATOM 3403 C CA . GLU A 1 423 ? 17.688 105.699 59.729 1.00 57.40 ? 482 GLU A CA 1 ATOM 3404 C C . GLU A 1 423 ? 18.988 106.392 59.353 1.00 54.24 ? 482 GLU A C 1 ATOM 3405 O O . GLU A 1 423 ? 19.304 107.457 59.884 1.00 60.99 ? 482 GLU A O 1 ATOM 3406 C CB . GLU A 1 423 ? 16.532 106.265 58.902 1.00 69.30 ? 482 GLU A CB 1 ATOM 3407 C CG . GLU A 1 423 ? 16.580 105.942 57.413 1.00 90.65 ? 482 GLU A CG 1 ATOM 3408 C CD . GLU A 1 423 ? 15.672 106.847 56.600 1.00 92.58 ? 482 GLU A CD 1 ATOM 3409 O OE1 . GLU A 1 423 ? 14.745 107.438 57.192 1.00 93.89 ? 482 GLU A OE1 1 ATOM 3410 O OE2 . GLU A 1 423 ? 15.879 106.965 55.373 1.00 95.13 ? 482 GLU A OE2 1 ATOM 3411 N N . TYR A 1 424 ? 19.747 105.794 58.442 1.00 54.00 ? 483 TYR A N 1 ATOM 3412 C CA . TYR A 1 424 ? 20.984 106.423 58.008 1.00 58.95 ? 483 TYR A CA 1 ATOM 3413 C C . TYR A 1 424 ? 20.814 107.134 56.674 1.00 59.16 ? 483 TYR A C 1 ATOM 3414 O O . TYR A 1 424 ? 20.282 106.574 55.715 1.00 54.87 ? 483 TYR A O 1 ATOM 3415 C CB . TYR A 1 424 ? 22.121 105.408 57.906 1.00 49.90 ? 483 TYR A CB 1 ATOM 3416 C CG . TYR A 1 424 ? 23.392 106.030 57.380 1.00 45.83 ? 483 TYR A CG 1 ATOM 3417 C CD1 . TYR A 1 424 ? 24.143 106.889 58.172 1.00 24.34 ? 483 TYR A CD1 1 ATOM 3418 C CD2 . TYR A 1 424 ? 23.833 105.776 56.087 1.00 34.77 ? 483 TYR A CD2 1 ATOM 3419 C CE1 . TYR A 1 424 ? 25.301 107.472 57.696 1.00 30.67 ? 483 TYR A CE1 1 ATOM 3420 C CE2 . TYR A 1 424 ? 24.992 106.353 55.602 1.00 46.37 ? 483 TYR A CE2 1 ATOM 3421 C CZ . TYR A 1 424 ? 25.721 107.199 56.411 1.00 52.44 ? 483 TYR A CZ 1 ATOM 3422 O OH . TYR A 1 424 ? 26.875 107.777 55.933 1.00 52.37 ? 483 TYR A OH 1 ATOM 3423 N N . ASN A 1 425 ? 21.279 108.376 56.628 1.00 61.60 ? 484 ASN A N 1 ATOM 3424 C CA . ASN A 1 425 ? 21.260 109.171 55.411 1.00 69.14 ? 484 ASN A CA 1 ATOM 3425 C C . ASN A 1 425 ? 22.604 109.863 55.229 1.00 67.29 ? 484 ASN A C 1 ATOM 3426 O O . ASN A 1 425 ? 23.048 110.600 56.108 1.00 49.82 ? 484 ASN A O 1 ATOM 3427 C CB . ASN A 1 425 ? 20.127 110.199 55.448 1.00 59.93 ? 484 ASN A CB 1 ATOM 3428 C CG . ASN A 1 425 ? 18.758 109.554 55.544 1.00 52.34 ? 484 ASN A CG 1 ATOM 3429 O OD1 . ASN A 1 425 ? 18.112 109.592 56.592 1.00 64.01 ? 484 ASN A OD1 1 ATOM 3430 N ND2 . ASN A 1 425 ? 18.311 108.950 54.450 1.00 37.51 ? 484 ASN A ND2 1 ATOM 3431 N N . ASN A 1 426 ? 23.252 109.610 54.098 1.00 74.59 ? 485 ASN A N 1 ATOM 3432 C CA . ASN A 1 426 ? 24.549 110.208 53.804 1.00 69.70 ? 485 ASN A CA 1 ATOM 3433 C C . ASN A 1 426 ? 24.387 111.480 52.979 1.00 79.30 ? 485 ASN A C 1 ATOM 3434 O O . ASN A 1 426 ? 23.938 111.423 51.834 1.00 79.70 ? 485 ASN A O 1 ATOM 3435 C CB . ASN A 1 426 ? 25.446 109.210 53.068 1.00 64.94 ? 485 ASN A CB 1 ATOM 3436 C CG . ASN A 1 426 ? 26.862 109.721 52.881 1.00 76.75 ? 485 ASN A CG 1 ATOM 3437 O OD1 . ASN A 1 426 ? 27.282 110.676 53.534 1.00 83.72 ? 485 ASN A OD1 1 ATOM 3438 N ND2 . ASN A 1 426 ? 27.605 109.086 51.981 1.00 72.62 ? 485 ASN A ND2 1 ATOM 3439 N N . PRO A 1 427 ? 24.742 112.635 53.570 1.00 84.73 ? 486 PRO A N 1 ATOM 3440 C CA . PRO A 1 427 ? 24.672 113.950 52.918 1.00 91.64 ? 486 PRO A CA 1 ATOM 3441 C C . PRO A 1 427 ? 25.331 113.976 51.540 1.00 87.01 ? 486 PRO A C 1 ATOM 3442 O O . PRO A 1 427 ? 24.849 114.667 50.642 1.00 80.98 ? 486 PRO A O 1 ATOM 3443 C CB . PRO A 1 427 ? 25.436 114.867 53.880 1.00 82.72 ? 486 PRO A CB 1 ATOM 3444 C CG . PRO A 1 427 ? 25.508 114.144 55.184 1.00 76.16 ? 486 PRO A CG 1 ATOM 3445 C CD . PRO A 1 427 ? 25.023 112.740 55.011 1.00 72.15 ? 486 PRO A CD 1 ATOM 3446 N N . ASP A 1 428 ? 26.417 113.228 51.381 1.00 75.45 ? 487 ASP A N 1 ATOM 3447 C CA . ASP A 1 428 ? 27.199 113.267 50.151 1.00 64.86 ? 487 ASP A CA 1 ATOM 3448 C C . ASP A 1 428 ? 26.573 112.391 49.071 1.00 68.29 ? 487 ASP A C 1 ATOM 3449 O O . ASP A 1 428 ? 25.510 111.804 49.273 1.00 81.67 ? 487 ASP A O 1 ATOM 3450 C CB . ASP A 1 428 ? 28.640 112.828 50.418 1.00 79.96 ? 487 ASP A CB 1 ATOM 3451 C CG . ASP A 1 428 ? 29.339 113.713 51.431 1.00 81.73 ? 487 ASP A CG 1 ATOM 3452 O OD1 . ASP A 1 428 ? 30.213 113.206 52.165 1.00 67.71 ? 487 ASP A OD1 1 ATOM 3453 O OD2 . ASP A 1 428 ? 29.010 114.916 51.497 1.00 85.42 ? 487 ASP A OD2 1 ATOM 3454 N N . PRO B 1 3 ? 33.166 -12.941 72.057 1.00 63.01 ? 62 PRO B N 1 ATOM 3455 C CA . PRO B 1 3 ? 32.644 -13.161 70.704 1.00 63.04 ? 62 PRO B CA 1 ATOM 3456 C C . PRO B 1 3 ? 32.724 -11.902 69.844 1.00 67.55 ? 62 PRO B C 1 ATOM 3457 O O . PRO B 1 3 ? 32.434 -10.808 70.328 1.00 66.31 ? 62 PRO B O 1 ATOM 3458 C CB . PRO B 1 3 ? 31.185 -13.564 70.948 1.00 56.97 ? 62 PRO B CB 1 ATOM 3459 C CG . PRO B 1 3 ? 31.156 -14.068 72.353 1.00 46.82 ? 62 PRO B CG 1 ATOM 3460 C CD . PRO B 1 3 ? 32.164 -13.245 73.092 1.00 46.91 ? 62 PRO B CD 1 ATOM 3461 N N . HIS B 1 4 ? 33.115 -12.062 68.583 1.00 53.38 ? 63 HIS B N 1 ATOM 3462 C CA . HIS B 1 4 ? 33.211 -10.935 67.663 1.00 44.93 ? 63 HIS B CA 1 ATOM 3463 C C . HIS B 1 4 ? 31.817 -10.451 67.278 1.00 56.67 ? 63 HIS B C 1 ATOM 3464 O O . HIS B 1 4 ? 31.581 -9.250 67.144 1.00 55.11 ? 63 HIS B O 1 ATOM 3465 C CB . HIS B 1 4 ? 34.008 -11.319 66.416 1.00 51.55 ? 63 HIS B CB 1 ATOM 3466 C CG . HIS B 1 4 ? 35.457 -11.590 66.681 1.00 57.04 ? 63 HIS B CG 1 ATOM 3467 N ND1 . HIS B 1 4 ? 35.900 -12.238 67.814 1.00 46.83 ? 63 HIS B ND1 1 ATOM 3468 C CD2 . HIS B 1 4 ? 36.565 -11.303 65.956 1.00 56.88 ? 63 HIS B CD2 1 ATOM 3469 C CE1 . HIS B 1 4 ? 37.217 -12.337 67.777 1.00 54.57 ? 63 HIS B CE1 1 ATOM 3470 N NE2 . HIS B 1 4 ? 37.645 -11.778 66.660 1.00 51.66 ? 63 HIS B NE2 1 ATOM 3471 N N . GLN B 1 5 ? 30.900 -11.396 67.092 1.00 51.03 ? 64 GLN B N 1 ATOM 3472 C CA . GLN B 1 5 ? 29.486 -11.077 66.929 1.00 52.27 ? 64 GLN B CA 1 ATOM 3473 C C . GLN B 1 5 ? 28.744 -11.405 68.220 1.00 51.10 ? 64 GLN B C 1 ATOM 3474 O O . GLN B 1 5 ? 28.342 -12.549 68.436 1.00 52.74 ? 64 GLN B O 1 ATOM 3475 C CB . GLN B 1 5 ? 28.879 -11.848 65.754 1.00 37.60 ? 64 GLN B CB 1 ATOM 3476 C CG . GLN B 1 5 ? 29.359 -11.389 64.387 1.00 47.75 ? 64 GLN B CG 1 ATOM 3477 C CD . GLN B 1 5 ? 28.578 -12.026 63.254 1.00 53.13 ? 64 GLN B CD 1 ATOM 3478 O OE1 . GLN B 1 5 ? 27.347 -12.057 63.274 1.00 55.44 ? 64 GLN B OE1 1 ATOM 3479 N NE2 . GLN B 1 5 ? 29.290 -12.537 62.257 1.00 39.85 ? 64 GLN B NE2 1 ATOM 3480 N N . PRO B 1 6 ? 28.559 -10.397 69.085 1.00 55.01 ? 65 PRO B N 1 ATOM 3481 C CA . PRO B 1 6 ? 27.971 -10.598 70.412 1.00 55.82 ? 65 PRO B CA 1 ATOM 3482 C C . PRO B 1 6 ? 26.447 -10.677 70.402 1.00 44.38 ? 65 PRO B C 1 ATOM 3483 O O . PRO B 1 6 ? 25.814 -10.435 69.374 1.00 44.59 ? 65 PRO B O 1 ATOM 3484 C CB . PRO B 1 6 ? 28.438 -9.363 71.179 1.00 37.55 ? 65 PRO B CB 1 ATOM 3485 C CG . PRO B 1 6 ? 28.498 -8.305 70.137 1.00 49.70 ? 65 PRO B CG 1 ATOM 3486 C CD . PRO B 1 6 ? 28.938 -8.990 68.864 1.00 43.96 ? 65 PRO B CD 1 ATOM 3487 N N . ILE B 1 7 ? 25.875 -11.014 71.554 1.00 52.83 ? 66 ILE B N 1 ATOM 3488 C CA . ILE B 1 7 ? 24.428 -11.023 71.732 1.00 59.58 ? 66 ILE B CA 1 ATOM 3489 C C . ILE B 1 7 ? 23.856 -9.617 71.613 1.00 49.88 ? 66 ILE B C 1 ATOM 3490 O O . ILE B 1 7 ? 24.590 -8.635 71.741 1.00 54.38 ? 66 ILE B O 1 ATOM 3491 C CB . ILE B 1 7 ? 24.030 -11.598 73.109 1.00 65.29 ? 66 ILE B CB 1 ATOM 3492 C CG1 . ILE B 1 7 ? 24.713 -10.812 74.231 1.00 53.21 ? 66 ILE B CG1 1 ATOM 3493 C CG2 . ILE B 1 7 ? 24.367 -13.073 73.197 1.00 62.25 ? 66 ILE B CG2 1 ATOM 3494 C CD1 . ILE B 1 7 ? 24.244 -11.192 75.618 1.00 65.45 ? 66 ILE B CD1 1 ATOM 3495 N N . PRO B 1 8 ? 22.544 -9.514 71.351 1.00 59.53 ? 67 PRO B N 1 ATOM 3496 C CA . PRO B 1 8 ? 21.885 -8.212 71.480 1.00 46.10 ? 67 PRO B CA 1 ATOM 3497 C C . PRO B 1 8 ? 22.055 -7.679 72.900 1.00 57.61 ? 67 PRO B C 1 ATOM 3498 O O . PRO B 1 8 ? 21.770 -8.409 73.850 1.00 53.05 ? 67 PRO B O 1 ATOM 3499 C CB . PRO B 1 8 ? 20.419 -8.526 71.170 1.00 47.06 ? 67 PRO B CB 1 ATOM 3500 C CG . PRO B 1 8 ? 20.475 -9.732 70.295 1.00 55.29 ? 67 PRO B CG 1 ATOM 3501 C CD . PRO B 1 8 ? 21.645 -10.537 70.786 1.00 60.42 ? 67 PRO B CD 1 ATOM 3502 N N . PRO B 1 9 ? 22.529 -6.431 73.044 1.00 55.72 ? 68 PRO B N 1 ATOM 3503 C CA . PRO B 1 9 ? 22.812 -5.830 74.355 1.00 57.86 ? 68 PRO B CA 1 ATOM 3504 C C . PRO B 1 9 ? 21.621 -5.899 75.310 1.00 61.57 ? 68 PRO B C 1 ATOM 3505 O O . PRO B 1 9 ? 21.812 -5.968 76.524 1.00 65.29 ? 68 PRO B O 1 ATOM 3506 C CB . PRO B 1 9 ? 23.158 -4.374 74.011 1.00 45.31 ? 68 PRO B CB 1 ATOM 3507 C CG . PRO B 1 9 ? 22.627 -4.156 72.631 1.00 53.96 ? 68 PRO B CG 1 ATOM 3508 C CD . PRO B 1 9 ? 22.755 -5.477 71.946 1.00 51.67 ? 68 PRO B CD 1 ATOM 3509 N N . SER B 1 10 ? 20.411 -5.883 74.759 1.00 51.96 ? 69 SER B N 1 ATOM 3510 C CA . SER B 1 10 ? 19.194 -6.002 75.554 1.00 60.71 ? 69 SER B CA 1 ATOM 3511 C C . SER B 1 10 ? 19.107 -7.346 76.277 1.00 60.87 ? 69 SER B C 1 ATOM 3512 O O . SER B 1 10 ? 18.481 -7.450 77.331 1.00 75.56 ? 69 SER B O 1 ATOM 3513 C CB . SER B 1 10 ? 17.961 -5.808 74.667 1.00 47.16 ? 69 SER B CB 1 ATOM 3514 O OG . SER B 1 10 ? 17.817 -6.884 73.755 1.00 63.75 ? 69 SER B OG 1 ATOM 3515 N N . LEU B 1 11 ? 19.735 -8.372 75.709 1.00 44.54 ? 70 LEU B N 1 ATOM 3516 C CA . LEU B 1 11 ? 19.732 -9.702 76.312 1.00 50.45 ? 70 LEU B CA 1 ATOM 3517 C C . LEU B 1 11 ? 20.933 -9.915 77.231 1.00 58.35 ? 70 LEU B C 1 ATOM 3518 O O . LEU B 1 11 ? 21.130 -11.009 77.762 1.00 58.93 ? 70 LEU B O 1 ATOM 3519 C CB . LEU B 1 11 ? 19.720 -10.783 75.227 1.00 50.89 ? 70 LEU B CB 1 ATOM 3520 C CG . LEU B 1 11 ? 18.481 -10.891 74.337 1.00 60.59 ? 70 LEU B CG 1 ATOM 3521 C CD1 . LEU B 1 11 ? 18.693 -11.949 73.266 1.00 41.43 ? 70 LEU B CD1 1 ATOM 3522 C CD2 . LEU B 1 11 ? 17.244 -11.203 75.165 1.00 42.22 ? 70 LEU B CD2 1 ATOM 3523 N N . GLY B 1 12 ? 21.728 -8.868 77.421 1.00 64.57 ? 71 GLY B N 1 ATOM 3524 C CA . GLY B 1 12 ? 22.913 -8.955 78.255 1.00 58.39 ? 71 GLY B CA 1 ATOM 3525 C C . GLY B 1 12 ? 22.764 -8.265 79.596 1.00 64.75 ? 71 GLY B C 1 ATOM 3526 O O . GLY B 1 12 ? 21.672 -7.831 79.964 1.00 72.98 ? 71 GLY B O 1 ATOM 3527 N N . GLU B 1 13 ? 23.868 -8.174 80.332 1.00 62.54 ? 72 GLU B N 1 ATOM 3528 C CA . GLU B 1 13 ? 23.885 -7.492 81.622 1.00 77.94 ? 72 GLU B CA 1 ATOM 3529 C C . GLU B 1 13 ? 23.562 -6.015 81.441 1.00 76.13 ? 72 GLU B C 1 ATOM 3530 O O . GLU B 1 13 ? 24.228 -5.320 80.673 1.00 74.41 ? 72 GLU B O 1 ATOM 3531 C CB . GLU B 1 13 ? 25.250 -7.656 82.294 1.00 88.66 ? 72 GLU B CB 1 ATOM 3532 C CG . GLU B 1 13 ? 25.478 -6.750 83.494 1.00 99.45 ? 72 GLU B CG 1 ATOM 3533 C CD . GLU B 1 13 ? 26.702 -7.151 84.295 1.00 107.27 ? 72 GLU B CD 1 ATOM 3534 O OE1 . GLU B 1 13 ? 27.503 -7.964 83.788 1.00 107.81 ? 72 GLU B OE1 1 ATOM 3535 O OE2 . GLU B 1 13 ? 26.865 -6.651 85.427 1.00 111.85 ? 72 GLU B OE2 1 ATOM 3536 N N . LYS B 1 14 ? 22.544 -5.535 82.148 1.00 73.91 ? 73 LYS B N 1 ATOM 3537 C CA . LYS B 1 14 ? 22.122 -4.147 82.006 1.00 72.36 ? 73 LYS B CA 1 ATOM 3538 C C . LYS B 1 14 ? 23.151 -3.178 82.580 1.00 75.63 ? 73 LYS B C 1 ATOM 3539 O O . LYS B 1 14 ? 23.517 -3.268 83.752 1.00 86.84 ? 73 LYS B O 1 ATOM 3540 C CB . LYS B 1 14 ? 20.767 -3.928 82.683 1.00 72.31 ? 73 LYS B CB 1 ATOM 3541 C CG . LYS B 1 14 ? 20.175 -2.555 82.425 1.00 82.55 ? 73 LYS B CG 1 ATOM 3542 C CD . LYS B 1 14 ? 20.090 -2.282 80.932 1.00 96.28 ? 73 LYS B CD 1 ATOM 3543 C CE . LYS B 1 14 ? 19.642 -0.860 80.649 1.00 99.02 ? 73 LYS B CE 1 ATOM 3544 N NZ . LYS B 1 14 ? 19.625 -0.568 79.188 1.00 82.81 ? 73 LYS B NZ 1 ATOM 3545 N N . ASP B 1 15 ? 23.615 -2.253 81.745 1.00 77.68 ? 74 ASP B N 1 ATOM 3546 C CA . ASP B 1 15 ? 24.555 -1.232 82.188 1.00 72.86 ? 74 ASP B CA 1 ATOM 3547 C C . ASP B 1 15 ? 23.812 -0.161 82.983 1.00 81.06 ? 74 ASP B C 1 ATOM 3548 O O . ASP B 1 15 ? 22.952 0.536 82.445 1.00 91.70 ? 74 ASP B O 1 ATOM 3549 C CB . ASP B 1 15 ? 25.279 -0.613 80.990 1.00 64.77 ? 74 ASP B CB 1 ATOM 3550 C CG . ASP B 1 15 ? 26.396 0.327 81.400 1.00 75.72 ? 74 ASP B CG 1 ATOM 3551 O OD1 . ASP B 1 15 ? 26.913 1.050 80.523 1.00 84.76 ? 74 ASP B OD1 1 ATOM 3552 O OD2 . ASP B 1 15 ? 26.751 0.351 82.598 1.00 86.76 ? 74 ASP B OD2 1 ATOM 3553 N N . LEU B 1 16 ? 24.147 -0.032 84.263 1.00 82.29 ? 75 LEU B N 1 ATOM 3554 C CA . LEU B 1 16 ? 23.460 0.913 85.139 1.00 82.29 ? 75 LEU B CA 1 ATOM 3555 C C . LEU B 1 16 ? 24.257 2.201 85.316 1.00 82.40 ? 75 LEU B C 1 ATOM 3556 O O . LEU B 1 16 ? 23.833 3.111 86.030 1.00 80.64 ? 75 LEU B O 1 ATOM 3557 C CB . LEU B 1 16 ? 23.179 0.275 86.501 1.00 76.23 ? 75 LEU B CB 1 ATOM 3558 C CG . LEU B 1 16 ? 22.321 -0.993 86.478 1.00 79.79 ? 75 LEU B CG 1 ATOM 3559 C CD1 . LEU B 1 16 ? 22.074 -1.500 87.890 1.00 79.00 ? 75 LEU B CD1 1 ATOM 3560 C CD2 . LEU B 1 16 ? 21.005 -0.741 85.753 1.00 70.85 ? 75 LEU B CD2 1 ATOM 3561 N N . SER B 1 17 ? 25.410 2.272 84.660 1.00 68.20 ? 76 SER B N 1 ATOM 3562 C CA . SER B 1 17 ? 26.299 3.422 84.783 1.00 64.12 ? 76 SER B CA 1 ATOM 3563 C C . SER B 1 17 ? 25.670 4.669 84.171 1.00 66.95 ? 76 SER B C 1 ATOM 3564 O O . SER B 1 17 ? 24.801 4.575 83.306 1.00 71.59 ? 76 SER B O 1 ATOM 3565 C CB . SER B 1 17 ? 27.648 3.133 84.123 1.00 65.13 ? 76 SER B CB 1 ATOM 3566 O OG . SER B 1 17 ? 27.500 2.928 82.729 1.00 79.21 ? 76 SER B OG 1 ATOM 3567 N N . ASP B 1 18 ? 26.115 5.834 84.632 1.00 83.98 ? 77 ASP B N 1 ATOM 3568 C CA . ASP B 1 18 ? 25.608 7.107 84.132 1.00 76.96 ? 77 ASP B CA 1 ATOM 3569 C C . ASP B 1 18 ? 26.200 7.437 82.767 1.00 77.21 ? 77 ASP B C 1 ATOM 3570 O O . ASP B 1 18 ? 27.409 7.633 82.640 1.00 75.49 ? 77 ASP B O 1 ATOM 3571 C CB . ASP B 1 18 ? 25.925 8.228 85.127 1.00 81.68 ? 77 ASP B CB 1 ATOM 3572 C CG . ASP B 1 18 ? 25.342 9.572 84.713 1.00 93.43 ? 77 ASP B CG 1 ATOM 3573 O OD1 . ASP B 1 18 ? 25.763 10.600 85.285 1.00 95.93 ? 77 ASP B OD1 1 ATOM 3574 O OD2 . ASP B 1 18 ? 24.474 9.607 83.816 1.00 94.28 ? 77 ASP B OD2 1 ATOM 3575 N N . PRO B 1 19 ? 25.340 7.502 81.737 1.00 65.93 ? 78 PRO B N 1 ATOM 3576 C CA . PRO B 1 19 ? 25.746 7.793 80.357 1.00 57.04 ? 78 PRO B CA 1 ATOM 3577 C C . PRO B 1 19 ? 26.265 9.218 80.198 1.00 54.42 ? 78 PRO B C 1 ATOM 3578 O O . PRO B 1 19 ? 26.776 9.580 79.138 1.00 69.06 ? 78 PRO B O 1 ATOM 3579 C CB . PRO B 1 19 ? 24.452 7.595 79.555 1.00 64.42 ? 78 PRO B CB 1 ATOM 3580 C CG . PRO B 1 19 ? 23.551 6.800 80.444 1.00 61.74 ? 78 PRO B CG 1 ATOM 3581 C CD . PRO B 1 19 ? 23.900 7.212 81.834 1.00 64.28 ? 78 PRO B CD 1 ATOM 3582 N N . PHE B 1 20 ? 26.135 10.014 81.254 1.00 55.34 ? 79 PHE B N 1 ATOM 3583 C CA . PHE B 1 20 ? 26.518 11.416 81.207 1.00 73.71 ? 79 PHE B CA 1 ATOM 3584 C C . PHE B 1 20 ? 27.466 11.749 82.350 1.00 70.80 ? 79 PHE B C 1 ATOM 3585 O O . PHE B 1 20 ? 27.483 12.870 82.859 1.00 73.99 ? 79 PHE B O 1 ATOM 3586 C CB . PHE B 1 20 ? 25.276 12.306 81.248 1.00 60.54 ? 79 PHE B CB 1 ATOM 3587 C CG . PHE B 1 20 ? 24.301 12.019 80.144 1.00 58.21 ? 79 PHE B CG 1 ATOM 3588 C CD1 . PHE B 1 20 ? 24.445 12.620 78.905 1.00 66.03 ? 79 PHE B CD1 1 ATOM 3589 C CD2 . PHE B 1 20 ? 23.253 11.134 80.337 1.00 47.80 ? 79 PHE B CD2 1 ATOM 3590 C CE1 . PHE B 1 20 ? 23.558 12.352 77.882 1.00 56.31 ? 79 PHE B CE1 1 ATOM 3591 C CE2 . PHE B 1 20 ? 22.361 10.862 79.317 1.00 57.79 ? 79 PHE B CE2 1 ATOM 3592 C CZ . PHE B 1 20 ? 22.515 11.471 78.088 1.00 65.79 ? 79 PHE B CZ 1 ATOM 3593 N N . ASN B 1 21 ? 28.257 10.755 82.742 1.00 78.86 ? 80 ASN B N 1 ATOM 3594 C CA . ASN B 1 21 ? 29.293 10.937 83.748 1.00 73.65 ? 80 ASN B CA 1 ATOM 3595 C C . ASN B 1 21 ? 30.584 11.433 83.093 1.00 71.63 ? 80 ASN B C 1 ATOM 3596 O O . ASN B 1 21 ? 31.687 11.031 83.466 1.00 92.35 ? 80 ASN B O 1 ATOM 3597 C CB . ASN B 1 21 ? 29.530 9.626 84.505 1.00 79.18 ? 80 ASN B CB 1 ATOM 3598 C CG . ASN B 1 21 ? 30.386 9.809 85.743 1.00 83.38 ? 80 ASN B CG 1 ATOM 3599 O OD1 . ASN B 1 21 ? 30.505 10.913 86.273 1.00 87.06 ? 80 ASN B OD1 1 ATOM 3600 N ND2 . ASN B 1 21 ? 30.988 8.721 86.211 1.00 83.99 ? 80 ASN B ND2 1 ATOM 3601 N N . PHE B 1 22 ? 30.433 12.308 82.103 1.00 60.66 ? 81 PHE B N 1 ATOM 3602 C CA . PHE B 1 22 ? 31.575 12.919 81.434 1.00 65.12 ? 81 PHE B CA 1 ATOM 3603 C C . PHE B 1 22 ? 31.540 14.424 81.656 1.00 73.55 ? 81 PHE B C 1 ATOM 3604 O O . PHE B 1 22 ? 30.471 14.999 81.858 1.00 75.71 ? 81 PHE B O 1 ATOM 3605 C CB . PHE B 1 22 ? 31.576 12.592 79.935 1.00 64.12 ? 81 PHE B CB 1 ATOM 3606 C CG . PHE B 1 22 ? 30.370 13.109 79.192 1.00 62.47 ? 81 PHE B CG 1 ATOM 3607 C CD1 . PHE B 1 22 ? 30.394 14.356 78.587 1.00 50.35 ? 81 PHE B CD1 1 ATOM 3608 C CD2 . PHE B 1 22 ? 29.221 12.343 79.086 1.00 52.36 ? 81 PHE B CD2 1 ATOM 3609 C CE1 . PHE B 1 22 ? 29.292 14.834 77.900 1.00 52.73 ? 81 PHE B CE1 1 ATOM 3610 C CE2 . PHE B 1 22 ? 28.114 12.815 78.399 1.00 50.11 ? 81 PHE B CE2 1 ATOM 3611 C CZ . PHE B 1 22 ? 28.151 14.061 77.807 1.00 43.95 ? 81 PHE B CZ 1 ATOM 3612 N N . LEU B 1 23 ? 32.703 15.065 81.629 1.00 75.54 ? 82 LEU B N 1 ATOM 3613 C CA . LEU B 1 23 ? 32.750 16.506 81.832 1.00 80.45 ? 82 LEU B CA 1 ATOM 3614 C C . LEU B 1 23 ? 32.605 17.242 80.507 1.00 77.91 ? 82 LEU B C 1 ATOM 3615 O O . LEU B 1 23 ? 33.365 16.999 79.569 1.00 87.21 ? 82 LEU B O 1 ATOM 3616 C CB . LEU B 1 23 ? 34.066 16.902 82.505 1.00 89.97 ? 82 LEU B CB 1 ATOM 3617 C CG . LEU B 1 23 ? 34.237 16.570 83.989 1.00 93.24 ? 82 LEU B CG 1 ATOM 3618 C CD1 . LEU B 1 23 ? 35.687 16.758 84.410 1.00 86.30 ? 82 LEU B CD1 1 ATOM 3619 C CD2 . LEU B 1 23 ? 33.313 17.420 84.847 1.00 91.92 ? 82 LEU B CD2 1 ATOM 3620 N N . PHE B 1 24 ? 31.629 18.142 80.428 1.00 79.31 ? 83 PHE B N 1 ATOM 3621 C CA . PHE B 1 24 ? 31.480 18.985 79.249 1.00 79.35 ? 83 PHE B CA 1 ATOM 3622 C C . PHE B 1 24 ? 31.107 20.419 79.615 1.00 85.94 ? 83 PHE B C 1 ATOM 3623 O O . PHE B 1 24 ? 30.274 20.651 80.492 1.00 82.05 ? 83 PHE B O 1 ATOM 3624 C CB . PHE B 1 24 ? 30.441 18.404 78.290 1.00 82.67 ? 83 PHE B CB 1 ATOM 3625 C CG . PHE B 1 24 ? 30.547 18.946 76.892 1.00 79.41 ? 83 PHE B CG 1 ATOM 3626 C CD1 . PHE B 1 24 ? 31.337 18.307 75.950 1.00 64.74 ? 83 PHE B CD1 1 ATOM 3627 C CD2 . PHE B 1 24 ? 29.873 20.098 76.522 1.00 67.50 ? 83 PHE B CD2 1 ATOM 3628 C CE1 . PHE B 1 24 ? 31.448 18.800 74.664 1.00 67.97 ? 83 PHE B CE1 1 ATOM 3629 C CE2 . PHE B 1 24 ? 29.979 20.598 75.236 1.00 64.36 ? 83 PHE B CE2 1 ATOM 3630 C CZ . PHE B 1 24 ? 30.768 19.948 74.307 1.00 66.90 ? 83 PHE B CZ 1 ATOM 3631 N N . SER B 1 25 ? 31.722 21.376 78.930 1.00 98.11 ? 84 SER B N 1 ATOM 3632 C CA . SER B 1 25 ? 31.424 22.788 79.137 1.00 103.90 ? 84 SER B CA 1 ATOM 3633 C C . SER B 1 25 ? 31.448 23.486 77.782 1.00 100.07 ? 84 SER B C 1 ATOM 3634 O O . SER B 1 25 ? 32.168 23.066 76.877 1.00 101.33 ? 84 SER B O 1 ATOM 3635 C CB . SER B 1 25 ? 32.420 23.429 80.104 1.00 99.35 ? 84 SER B CB 1 ATOM 3636 O OG . SER B 1 25 ? 32.153 24.811 80.268 1.00 94.86 ? 84 SER B OG 1 ATOM 3637 N N . SER B 1 26 ? 30.665 24.551 77.639 1.00 93.73 ? 85 SER B N 1 ATOM 3638 C CA . SER B 1 26 ? 30.580 25.249 76.361 1.00 96.56 ? 85 SER B CA 1 ATOM 3639 C C . SER B 1 26 ? 31.097 26.683 76.429 1.00 93.92 ? 85 SER B C 1 ATOM 3640 O O . SER B 1 26 ? 30.968 27.356 77.451 1.00 92.83 ? 85 SER B O 1 ATOM 3641 C CB . SER B 1 26 ? 29.134 25.247 75.855 1.00 92.14 ? 85 SER B CB 1 ATOM 3642 O OG . SER B 1 26 ? 28.320 26.106 76.634 1.00 88.78 ? 85 SER B OG 1 ATOM 3643 N N . ASN B 1 27 ? 31.681 27.135 75.324 1.00 86.42 ? 86 ASN B N 1 ATOM 3644 C CA . ASN B 1 27 ? 32.205 28.491 75.208 1.00 80.72 ? 86 ASN B CA 1 ATOM 3645 C C . ASN B 1 27 ? 31.088 29.524 75.319 1.00 79.44 ? 86 ASN B C 1 ATOM 3646 O O . ASN B 1 27 ? 30.168 29.541 74.501 1.00 87.94 ? 86 ASN B O 1 ATOM 3647 C CB . ASN B 1 27 ? 32.958 28.649 73.882 1.00 72.77 ? 86 ASN B CB 1 ATOM 3648 C CG . ASN B 1 27 ? 33.656 29.992 73.753 1.00 81.71 ? 86 ASN B CG 1 ATOM 3649 O OD1 . ASN B 1 27 ? 33.030 31.048 73.836 1.00 75.37 ? 86 ASN B OD1 1 ATOM 3650 N ND2 . ASN B 1 27 ? 34.968 29.954 73.550 1.00 94.76 ? 86 ASN B ND2 1 ATOM 3651 N N . LYS B 1 28 ? 31.168 30.384 76.329 1.00 78.25 ? 87 LYS B N 1 ATOM 3652 C CA . LYS B 1 28 ? 30.079 31.308 76.619 1.00 75.30 ? 87 LYS B CA 1 ATOM 3653 C C . LYS B 1 28 ? 30.232 32.611 75.840 1.00 68.54 ? 87 LYS B C 1 ATOM 3654 O O . LYS B 1 28 ? 29.281 33.383 75.713 1.00 65.40 ? 87 LYS B O 1 ATOM 3655 C CB . LYS B 1 28 ? 30.028 31.599 78.118 1.00 71.06 ? 87 LYS B CB 1 ATOM 3656 C CG . LYS B 1 28 ? 30.065 30.350 78.981 1.00 73.67 ? 87 LYS B CG 1 ATOM 3657 C CD . LYS B 1 28 ? 29.729 30.659 80.428 1.00 82.22 ? 87 LYS B CD 1 ATOM 3658 C CE . LYS B 1 28 ? 30.051 29.476 81.330 1.00 95.17 ? 87 LYS B CE 1 ATOM 3659 N NZ . LYS B 1 28 ? 29.420 28.217 80.846 1.00 89.22 ? 87 LYS B NZ 1 ATOM 3660 N N . ILE B 1 29 ? 31.431 32.846 75.314 1.00 65.99 ? 88 ILE B N 1 ATOM 3661 C CA . ILE B 1 29 ? 31.696 34.028 74.499 1.00 78.95 ? 88 ILE B CA 1 ATOM 3662 C C . ILE B 1 29 ? 30.990 33.867 73.162 1.00 81.53 ? 88 ILE B C 1 ATOM 3663 O O . ILE B 1 29 ? 30.257 34.750 72.715 1.00 77.39 ? 88 ILE B O 1 ATOM 3664 C CB . ILE B 1 29 ? 33.206 34.262 74.268 1.00 68.66 ? 88 ILE B CB 1 ATOM 3665 C CG1 . ILE B 1 29 ? 33.917 34.577 75.589 1.00 64.70 ? 88 ILE B CG1 1 ATOM 3666 C CG2 . ILE B 1 29 ? 33.424 35.402 73.286 1.00 43.44 ? 88 ILE B CG2 1 ATOM 3667 C CD1 . ILE B 1 29 ? 34.379 33.358 76.363 1.00 68.02 ? 88 ILE B CD1 1 ATOM 3668 N N . THR B 1 30 ? 31.232 32.724 72.531 1.00 84.15 ? 89 THR B N 1 ATOM 3669 C CA . THR B 1 30 ? 30.573 32.357 71.287 1.00 78.85 ? 89 THR B CA 1 ATOM 3670 C C . THR B 1 30 ? 29.058 32.312 71.476 1.00 78.01 ? 89 THR B C 1 ATOM 3671 O O . THR B 1 30 ? 28.302 32.780 70.624 1.00 77.47 ? 89 THR B O 1 ATOM 3672 C CB . THR B 1 30 ? 31.070 30.988 70.772 1.00 82.28 ? 89 THR B CB 1 ATOM 3673 O OG1 . THR B 1 30 ? 32.471 31.064 70.480 1.00 88.84 ? 89 THR B OG1 1 ATOM 3674 C CG2 . THR B 1 30 ? 30.316 30.576 69.516 1.00 79.76 ? 89 THR B CG2 1 ATOM 3675 N N . LEU B 1 31 ? 28.629 31.754 72.605 1.00 59.99 ? 90 LEU B N 1 ATOM 3676 C CA . LEU B 1 31 ? 27.209 31.589 72.905 1.00 61.22 ? 90 LEU B CA 1 ATOM 3677 C C . LEU B 1 31 ? 26.417 32.899 72.892 1.00 71.14 ? 90 LEU B C 1 ATOM 3678 O O . LEU B 1 31 ? 25.393 32.998 72.214 1.00 68.98 ? 90 LEU B O 1 ATOM 3679 C CB . LEU B 1 31 ? 27.058 30.911 74.269 1.00 57.83 ? 90 LEU B CB 1 ATOM 3680 C CG . LEU B 1 31 ? 25.654 30.642 74.805 1.00 64.42 ? 90 LEU B CG 1 ATOM 3681 C CD1 . LEU B 1 31 ? 24.876 29.770 73.836 1.00 54.72 ? 90 LEU B CD1 1 ATOM 3682 C CD2 . LEU B 1 31 ? 25.737 29.982 76.173 1.00 68.58 ? 90 LEU B CD2 1 ATOM 3683 N N . ARG B 1 32 ? 26.886 33.899 73.635 1.00 75.06 ? 91 ARG B N 1 ATOM 3684 C CA . ARG B 1 32 ? 26.210 35.196 73.674 1.00 86.55 ? 91 ARG B CA 1 ATOM 3685 C C . ARG B 1 32 ? 26.410 36.024 72.407 1.00 80.05 ? 91 ARG B C 1 ATOM 3686 O O . ARG B 1 32 ? 25.529 36.797 72.029 1.00 64.70 ? 91 ARG B O 1 ATOM 3687 C CB . ARG B 1 32 ? 26.613 36.007 74.907 1.00 86.48 ? 91 ARG B CB 1 ATOM 3688 C CG . ARG B 1 32 ? 25.974 35.478 76.181 1.00 86.93 ? 91 ARG B CG 1 ATOM 3689 C CD . ARG B 1 32 ? 26.382 36.254 77.419 1.00 87.57 ? 91 ARG B CD 1 ATOM 3690 N NE . ARG B 1 32 ? 25.793 35.661 78.617 1.00 90.67 ? 91 ARG B NE 1 ATOM 3691 C CZ . ARG B 1 32 ? 25.819 36.218 79.822 1.00 92.93 ? 91 ARG B CZ 1 ATOM 3692 N NH1 . ARG B 1 32 ? 26.392 37.401 79.998 1.00 99.37 ? 91 ARG B NH1 1 ATOM 3693 N NH2 . ARG B 1 32 ? 25.253 35.600 80.850 1.00 83.36 ? 91 ARG B NH2 1 ATOM 3694 N N . LYS B 1 33 ? 27.570 35.892 71.771 1.00 68.11 ? 92 LYS B N 1 ATOM 3695 C CA . LYS B 1 33 ? 27.801 36.576 70.502 1.00 62.61 ? 92 LYS B CA 1 ATOM 3696 C C . LYS B 1 33 ? 26.755 36.093 69.501 1.00 79.17 ? 92 LYS B C 1 ATOM 3697 O O . LYS B 1 33 ? 26.261 36.863 68.677 1.00 63.66 ? 92 LYS B O 1 ATOM 3698 C CB . LYS B 1 33 ? 29.216 36.323 69.978 1.00 46.82 ? 92 LYS B CB 1 ATOM 3699 C CG . LYS B 1 33 ? 29.541 37.082 68.696 1.00 58.01 ? 92 LYS B CG 1 ATOM 3700 C CD . LYS B 1 33 ? 30.726 38.020 68.879 1.00 66.85 ? 92 LYS B CD 1 ATOM 3701 C CE . LYS B 1 33 ? 30.996 38.827 67.616 1.00 76.57 ? 92 LYS B CE 1 ATOM 3702 N NZ . LYS B 1 33 ? 29.830 39.666 67.217 1.00 75.44 ? 92 LYS B NZ 1 ATOM 3703 N N . LEU B 1 34 ? 26.424 34.809 69.591 1.00 82.63 ? 93 LEU B N 1 ATOM 3704 C CA . LEU B 1 34 ? 25.365 34.219 68.783 1.00 77.20 ? 93 LEU B CA 1 ATOM 3705 C C . LEU B 1 34 ? 24.015 34.771 69.234 1.00 70.62 ? 93 LEU B C 1 ATOM 3706 O O . LEU B 1 34 ? 23.135 35.043 68.416 1.00 63.25 ? 93 LEU B O 1 ATOM 3707 C CB . LEU B 1 34 ? 25.390 32.696 68.899 1.00 72.24 ? 93 LEU B CB 1 ATOM 3708 C CG . LEU B 1 34 ? 26.431 31.950 68.063 1.00 58.53 ? 93 LEU B CG 1 ATOM 3709 C CD1 . LEU B 1 34 ? 26.565 30.514 68.541 1.00 60.83 ? 93 LEU B CD1 1 ATOM 3710 C CD2 . LEU B 1 34 ? 26.063 31.993 66.589 1.00 51.73 ? 93 LEU B CD2 1 ATOM 3711 N N . TYR B 1 35 ? 23.864 34.925 70.547 1.00 80.49 ? 94 TYR B N 1 ATOM 3712 C CA . TYR B 1 35 ? 22.660 35.497 71.144 1.00 88.04 ? 94 TYR B CA 1 ATOM 3713 C C . TYR B 1 35 ? 22.454 36.939 70.689 1.00 84.07 ? 94 TYR B C 1 ATOM 3714 O O . TYR B 1 35 ? 21.367 37.309 70.244 1.00 75.58 ? 94 TYR B O 1 ATOM 3715 C CB . TYR B 1 35 ? 22.751 35.427 72.674 1.00 76.14 ? 94 TYR B CB 1 ATOM 3716 C CG . TYR B 1 35 ? 21.587 36.037 73.426 1.00 81.38 ? 94 TYR B CG 1 ATOM 3717 C CD1 . TYR B 1 35 ? 20.492 35.268 73.796 1.00 79.56 ? 94 TYR B CD1 1 ATOM 3718 C CD2 . TYR B 1 35 ? 21.596 37.380 73.789 1.00 82.31 ? 94 TYR B CD2 1 ATOM 3719 C CE1 . TYR B 1 35 ? 19.431 35.821 74.491 1.00 79.49 ? 94 TYR B CE1 1 ATOM 3720 C CE2 . TYR B 1 35 ? 20.540 37.942 74.482 1.00 77.20 ? 94 TYR B CE2 1 ATOM 3721 C CZ . TYR B 1 35 ? 19.461 37.158 74.831 1.00 82.70 ? 94 TYR B CZ 1 ATOM 3722 O OH . TYR B 1 35 ? 18.410 37.715 75.523 1.00 88.50 ? 94 TYR B OH 1 ATOM 3723 N N . ASP B 1 36 ? 23.507 37.744 70.806 1.00 75.23 ? 95 ASP B N 1 ATOM 3724 C CA . ASP B 1 36 ? 23.450 39.161 70.457 1.00 82.05 ? 95 ASP B CA 1 ATOM 3725 C C . ASP B 1 36 ? 23.102 39.380 68.987 1.00 75.88 ? 95 ASP B C 1 ATOM 3726 O O . ASP B 1 36 ? 22.333 40.279 68.651 1.00 73.55 ? 95 ASP B O 1 ATOM 3727 C CB . ASP B 1 36 ? 24.778 39.845 70.782 1.00 89.60 ? 95 ASP B CB 1 ATOM 3728 C CG . ASP B 1 36 ? 25.060 39.888 72.270 1.00 100.63 ? 95 ASP B CG 1 ATOM 3729 O OD1 . ASP B 1 36 ? 24.150 39.556 73.058 1.00 105.53 ? 95 ASP B OD1 1 ATOM 3730 O OD2 . ASP B 1 36 ? 26.191 40.258 72.652 1.00 99.75 ? 95 ASP B OD2 1 ATOM 3731 N N . LEU B 1 37 ? 23.674 38.555 68.116 1.00 69.51 ? 96 LEU B N 1 ATOM 3732 C CA . LEU B 1 37 ? 23.469 38.710 66.681 1.00 65.89 ? 96 LEU B CA 1 ATOM 3733 C C . LEU B 1 37 ? 22.097 38.221 66.229 1.00 71.54 ? 96 LEU B C 1 ATOM 3734 O O . LEU B 1 37 ? 21.721 38.409 65.072 1.00 81.83 ? 96 LEU B O 1 ATOM 3735 C CB . LEU B 1 37 ? 24.554 37.957 65.904 1.00 69.28 ? 96 LEU B CB 1 ATOM 3736 C CG . LEU B 1 37 ? 25.950 38.576 65.816 1.00 74.92 ? 96 LEU B CG 1 ATOM 3737 C CD1 . LEU B 1 37 ? 26.985 37.515 65.475 1.00 73.54 ? 96 LEU B CD1 1 ATOM 3738 C CD2 . LEU B 1 37 ? 25.971 39.699 64.790 1.00 73.58 ? 96 LEU B CD2 1 ATOM 3739 N N . THR B 1 38 ? 21.347 37.597 67.134 1.00 66.02 ? 97 THR B N 1 ATOM 3740 C CA . THR B 1 38 ? 20.078 36.981 66.757 1.00 73.17 ? 97 THR B CA 1 ATOM 3741 C C . THR B 1 38 ? 18.916 37.270 67.706 1.00 78.29 ? 97 THR B C 1 ATOM 3742 O O . THR B 1 38 ? 17.795 36.820 67.462 1.00 82.90 ? 97 THR B O 1 ATOM 3743 C CB . THR B 1 38 ? 20.219 35.448 66.645 1.00 65.21 ? 97 THR B CB 1 ATOM 3744 O OG1 . THR B 1 38 ? 20.812 34.933 67.844 1.00 58.57 ? 97 THR B OG1 1 ATOM 3745 C CG2 . THR B 1 38 ? 21.090 35.071 65.456 1.00 58.67 ? 97 THR B CG2 1 ATOM 3746 N N . LYS B 1 39 ? 19.172 38.004 68.785 1.00 65.22 ? 98 LYS B N 1 ATOM 3747 C CA . LYS B 1 39 ? 18.115 38.292 69.754 1.00 78.32 ? 98 LYS B CA 1 ATOM 3748 C C . LYS B 1 39 ? 17.035 39.201 69.172 1.00 78.36 ? 98 LYS B C 1 ATOM 3749 O O . LYS B 1 39 ? 15.934 39.293 69.714 1.00 80.49 ? 98 LYS B O 1 ATOM 3750 C CB . LYS B 1 39 ? 18.684 38.931 71.025 1.00 83.46 ? 98 LYS B CB 1 ATOM 3751 C CG . LYS B 1 39 ? 19.396 40.255 70.813 1.00 89.94 ? 98 LYS B CG 1 ATOM 3752 C CD . LYS B 1 39 ? 19.800 40.859 72.151 1.00 87.77 ? 98 LYS B CD 1 ATOM 3753 C CE . LYS B 1 39 ? 20.574 42.153 71.975 1.00 82.28 ? 98 LYS B CE 1 ATOM 3754 N NZ . LYS B 1 39 ? 20.797 42.839 73.280 1.00 74.55 ? 98 LYS B NZ 1 ATOM 3755 N N . ASN B 1 40 ? 17.353 39.867 68.066 1.00 83.91 ? 99 ASN B N 1 ATOM 3756 C CA . ASN B 1 40 ? 16.416 40.791 67.436 1.00 89.94 ? 99 ASN B CA 1 ATOM 3757 C C . ASN B 1 40 ? 15.846 40.247 66.131 1.00 79.66 ? 99 ASN B C 1 ATOM 3758 O O . ASN B 1 40 ? 15.152 40.954 65.400 1.00 79.01 ? 99 ASN B O 1 ATOM 3759 C CB . ASN B 1 40 ? 17.101 42.135 67.182 1.00 91.85 ? 99 ASN B CB 1 ATOM 3760 C CG . ASN B 1 40 ? 17.511 42.829 68.466 1.00 86.58 ? 99 ASN B CG 1 ATOM 3761 O OD1 . ASN B 1 40 ? 16.793 42.786 69.465 1.00 76.84 ? 99 ASN B OD1 1 ATOM 3762 N ND2 . ASN B 1 40 ? 18.671 43.475 68.446 1.00 92.33 ? 99 ASN B ND2 1 ATOM 3763 N N . VAL B 1 41 ? 16.144 38.985 65.847 1.00 78.89 ? 100 VAL B N 1 ATOM 3764 C CA . VAL B 1 41 ? 15.637 38.320 64.653 1.00 76.33 ? 100 VAL B CA 1 ATOM 3765 C C . VAL B 1 41 ? 14.235 37.766 64.889 1.00 77.54 ? 100 VAL B C 1 ATOM 3766 O O . VAL B 1 41 ? 13.994 37.067 65.873 1.00 81.43 ? 100 VAL B O 1 ATOM 3767 C CB . VAL B 1 41 ? 16.571 37.181 64.204 1.00 67.06 ? 100 VAL B CB 1 ATOM 3768 C CG1 . VAL B 1 41 ? 16.008 36.482 62.979 1.00 66.86 ? 100 VAL B CG1 1 ATOM 3769 C CG2 . VAL B 1 41 ? 17.964 37.722 63.921 1.00 59.32 ? 100 VAL B CG2 1 ATOM 3770 N N . ASP B 1 42 ? 13.315 38.082 63.983 1.00 78.83 ? 101 ASP B N 1 ATOM 3771 C CA . ASP B 1 42 ? 11.944 37.602 64.096 1.00 82.96 ? 101 ASP B CA 1 ATOM 3772 C C . ASP B 1 42 ? 11.843 36.185 63.542 1.00 85.15 ? 101 ASP B C 1 ATOM 3773 O O . ASP B 1 42 ? 11.524 35.984 62.369 1.00 93.49 ? 101 ASP B O 1 ATOM 3774 C CB . ASP B 1 42 ? 10.981 38.533 63.356 1.00 87.71 ? 101 ASP B CB 1 ATOM 3775 C CG . ASP B 1 42 ? 9.522 38.162 63.569 1.00 95.73 ? 101 ASP B CG 1 ATOM 3776 O OD1 . ASP B 1 42 ? 9.239 37.265 64.391 1.00 86.21 ? 101 ASP B OD1 1 ATOM 3777 O OD2 . ASP B 1 42 ? 8.654 38.768 62.904 1.00 104.74 ? 101 ASP B OD2 1 ATOM 3778 N N . PHE B 1 43 ? 12.117 35.208 64.399 1.00 76.11 ? 102 PHE B N 1 ATOM 3779 C CA . PHE B 1 43 ? 12.114 33.806 64.003 1.00 80.36 ? 102 PHE B CA 1 ATOM 3780 C C . PHE B 1 43 ? 10.705 33.321 63.687 1.00 81.07 ? 102 PHE B C 1 ATOM 3781 O O . PHE B 1 43 ? 10.514 32.482 62.808 1.00 89.12 ? 102 PHE B O 1 ATOM 3782 C CB . PHE B 1 43 ? 12.728 32.934 65.100 1.00 79.18 ? 102 PHE B CB 1 ATOM 3783 C CG . PHE B 1 43 ? 14.225 33.041 65.199 1.00 78.65 ? 102 PHE B CG 1 ATOM 3784 C CD1 . PHE B 1 43 ? 15.040 32.385 64.290 1.00 72.81 ? 102 PHE B CD1 1 ATOM 3785 C CD2 . PHE B 1 43 ? 14.816 33.790 66.203 1.00 76.15 ? 102 PHE B CD2 1 ATOM 3786 C CE1 . PHE B 1 43 ? 16.417 32.479 64.378 1.00 71.19 ? 102 PHE B CE1 1 ATOM 3787 C CE2 . PHE B 1 43 ? 16.192 33.888 66.296 1.00 73.96 ? 102 PHE B CE2 1 ATOM 3788 C CZ . PHE B 1 43 ? 16.993 33.232 65.383 1.00 69.70 ? 102 PHE B CZ 1 ATOM 3789 N N . ASP B 1 44 ? 9.724 33.856 64.409 1.00 81.79 ? 103 ASP B N 1 ATOM 3790 C CA . ASP B 1 44 ? 8.330 33.456 64.246 1.00 80.50 ? 103 ASP B CA 1 ATOM 3791 C C . ASP B 1 44 ? 7.839 33.621 62.810 1.00 70.23 ? 103 ASP B C 1 ATOM 3792 O O . ASP B 1 44 ? 7.200 32.724 62.262 1.00 66.51 ? 103 ASP B O 1 ATOM 3793 C CB . ASP B 1 44 ? 7.437 34.258 65.195 1.00 80.71 ? 103 ASP B CB 1 ATOM 3794 C CG . ASP B 1 44 ? 7.592 33.829 66.641 1.00 90.63 ? 103 ASP B CG 1 ATOM 3795 O OD1 . ASP B 1 44 ? 7.246 34.625 67.540 1.00 94.29 ? 103 ASP B OD1 1 ATOM 3796 O OD2 . ASP B 1 44 ? 8.073 32.701 66.880 1.00 97.46 ? 103 ASP B OD2 1 ATOM 3797 N N . GLN B 1 45 ? 8.140 34.764 62.203 1.00 70.14 ? 104 GLN B N 1 ATOM 3798 C CA . GLN B 1 45 ? 7.742 35.017 60.822 1.00 69.93 ? 104 GLN B CA 1 ATOM 3799 C C . GLN B 1 45 ? 8.597 34.234 59.828 1.00 73.08 ? 104 GLN B C 1 ATOM 3800 O O . GLN B 1 45 ? 8.120 33.837 58.764 1.00 65.31 ? 104 GLN B O 1 ATOM 3801 C CB . GLN B 1 45 ? 7.819 36.513 60.509 1.00 77.80 ? 104 GLN B CB 1 ATOM 3802 C CG . GLN B 1 45 ? 7.157 36.906 59.198 1.00 101.96 ? 104 GLN B CG 1 ATOM 3803 C CD . GLN B 1 45 ? 5.704 36.479 59.129 1.00 113.65 ? 104 GLN B CD 1 ATOM 3804 O OE1 . GLN B 1 45 ? 5.350 35.560 58.391 1.00 111.99 ? 104 GLN B OE1 1 ATOM 3805 N NE2 . GLN B 1 45 ? 4.854 37.146 59.901 1.00 111.38 ? 104 GLN B NE2 1 ATOM 3806 N N . LEU B 1 46 ? 9.859 34.013 60.182 1.00 74.22 ? 105 LEU B N 1 ATOM 3807 C CA . LEU B 1 46 ? 10.784 33.284 59.319 1.00 64.26 ? 105 LEU B CA 1 ATOM 3808 C C . LEU B 1 46 ? 10.427 31.807 59.180 1.00 68.80 ? 105 LEU B C 1 ATOM 3809 O O . LEU B 1 46 ? 10.418 31.266 58.074 1.00 68.58 ? 105 LEU B O 1 ATOM 3810 C CB . LEU B 1 46 ? 12.215 33.414 59.845 1.00 51.90 ? 105 LEU B CB 1 ATOM 3811 C CG . LEU B 1 46 ? 12.958 34.713 59.528 1.00 51.33 ? 105 LEU B CG 1 ATOM 3812 C CD1 . LEU B 1 46 ? 14.250 34.787 60.321 1.00 51.08 ? 105 LEU B CD1 1 ATOM 3813 C CD2 . LEU B 1 46 ? 13.234 34.831 58.036 1.00 43.27 ? 105 LEU B CD2 1 ATOM 3814 N N . ARG B 1 47 ? 10.141 31.162 60.306 1.00 64.02 ? 106 ARG B N 1 ATOM 3815 C CA . ARG B 1 47 ? 9.804 29.741 60.326 1.00 71.29 ? 106 ARG B CA 1 ATOM 3816 C C . ARG B 1 47 ? 8.586 29.400 59.466 1.00 76.39 ? 106 ARG B C 1 ATOM 3817 O O . ARG B 1 47 ? 8.496 28.302 58.918 1.00 73.85 ? 106 ARG B O 1 ATOM 3818 C CB . ARG B 1 47 ? 9.567 29.289 61.769 1.00 67.79 ? 106 ARG B CB 1 ATOM 3819 C CG . ARG B 1 47 ? 10.814 29.366 62.638 1.00 76.36 ? 106 ARG B CG 1 ATOM 3820 C CD . ARG B 1 47 ? 10.501 29.113 64.104 1.00 82.51 ? 106 ARG B CD 1 ATOM 3821 N NE . ARG B 1 47 ? 10.006 27.762 64.346 1.00 92.12 ? 106 ARG B NE 1 ATOM 3822 C CZ . ARG B 1 47 ? 10.761 26.765 64.794 1.00 83.33 ? 106 ARG B CZ 1 ATOM 3823 N NH1 . ARG B 1 47 ? 12.046 26.968 65.051 1.00 65.54 ? 106 ARG B NH1 1 ATOM 3824 N NH2 . ARG B 1 47 ? 10.231 25.564 64.988 1.00 75.48 ? 106 ARG B NH2 1 ATOM 3825 N N . GLN B 1 48 ? 7.651 30.339 59.353 1.00 82.71 ? 107 GLN B N 1 ATOM 3826 C CA . GLN B 1 48 ? 6.410 30.101 58.618 1.00 85.23 ? 107 GLN B CA 1 ATOM 3827 C C . GLN B 1 48 ? 6.591 30.153 57.101 1.00 69.02 ? 107 GLN B C 1 ATOM 3828 O O . GLN B 1 48 ? 5.652 29.885 56.351 1.00 76.53 ? 107 GLN B O 1 ATOM 3829 C CB . GLN B 1 48 ? 5.334 31.102 59.047 1.00 92.14 ? 107 GLN B CB 1 ATOM 3830 C CG . GLN B 1 48 ? 5.074 31.119 60.543 1.00 98.36 ? 107 GLN B CG 1 ATOM 3831 C CD . GLN B 1 48 ? 3.718 31.699 60.893 1.00 98.32 ? 107 GLN B CD 1 ATOM 3832 O OE1 . GLN B 1 48 ? 3.381 32.811 60.487 1.00 97.43 ? 107 GLN B OE1 1 ATOM 3833 N NE2 . GLN B 1 48 ? 2.928 30.941 61.644 1.00 96.43 ? 107 GLN B NE2 1 ATOM 3834 N N . ASN B 1 49 ? 7.791 30.502 56.651 1.00 68.20 ? 108 ASN B N 1 ATOM 3835 C CA . ASN B 1 49 ? 8.063 30.594 55.221 1.00 68.83 ? 108 ASN B CA 1 ATOM 3836 C C . ASN B 1 49 ? 8.955 29.447 54.754 1.00 69.49 ? 108 ASN B C 1 ATOM 3837 O O . ASN B 1 49 ? 9.209 29.285 53.560 1.00 69.39 ? 108 ASN B O 1 ATOM 3838 C CB . ASN B 1 49 ? 8.709 31.940 54.887 1.00 74.31 ? 108 ASN B CB 1 ATOM 3839 C CG . ASN B 1 49 ? 8.318 32.451 53.513 1.00 83.51 ? 108 ASN B CG 1 ATOM 3840 O OD1 . ASN B 1 49 ? 7.961 31.675 52.627 1.00 90.68 ? 108 ASN B OD1 1 ATOM 3841 N ND2 . ASN B 1 49 ? 8.381 33.765 53.331 1.00 73.86 ? 108 ASN B ND2 1 ATOM 3842 N N . GLU B 1 50 ? 9.422 28.651 55.711 1.00 64.91 ? 109 GLU B N 1 ATOM 3843 C CA . GLU B 1 50 ? 10.306 27.523 55.432 1.00 73.66 ? 109 GLU B CA 1 ATOM 3844 C C . GLU B 1 50 ? 9.584 26.421 54.662 1.00 72.41 ? 109 GLU B C 1 ATOM 3845 O O . GLU B 1 50 ? 10.196 25.686 53.886 1.00 61.99 ? 109 GLU B O 1 ATOM 3846 C CB . GLU B 1 50 ? 10.875 26.960 56.734 1.00 58.43 ? 109 GLU B CB 1 ATOM 3847 C CG . GLU B 1 50 ? 11.682 27.961 57.539 1.00 50.82 ? 109 GLU B CG 1 ATOM 3848 C CD . GLU B 1 50 ? 12.236 27.364 58.814 1.00 65.66 ? 109 GLU B CD 1 ATOM 3849 O OE1 . GLU B 1 50 ? 12.813 28.118 59.625 1.00 68.05 ? 109 GLU B OE1 1 ATOM 3850 O OE2 . GLU B 1 50 ? 12.094 26.139 59.002 1.00 61.04 ? 109 GLU B OE2 1 ATOM 3851 N N . CYS B 1 51 ? 8.279 26.317 54.885 1.00 70.08 ? 110 CYS B N 1 ATOM 3852 C CA . CYS B 1 51 ? 7.451 25.322 54.213 1.00 75.49 ? 110 CYS B CA 1 ATOM 3853 C C . CYS B 1 51 ? 6.393 25.998 53.352 1.00 71.11 ? 110 CYS B C 1 ATOM 3854 O O . CYS B 1 51 ? 5.556 26.747 53.858 1.00 69.57 ? 110 CYS B O 1 ATOM 3855 C CB . CYS B 1 51 ? 6.787 24.394 55.233 1.00 86.82 ? 110 CYS B CB 1 ATOM 3856 S SG . CYS B 1 51 ? 5.777 23.083 54.504 1.00 80.44 ? 110 CYS B SG 1 ATOM 3857 N N . LYS B 1 52 ? 6.449 25.741 52.048 1.00 73.52 ? 111 LYS B N 1 ATOM 3858 C CA . LYS B 1 52 ? 5.524 26.353 51.100 1.00 82.69 ? 111 LYS B CA 1 ATOM 3859 C C . LYS B 1 52 ? 4.073 26.008 51.426 1.00 79.64 ? 111 LYS B C 1 ATOM 3860 O O . LYS B 1 52 ? 3.322 26.853 51.915 1.00 79.12 ? 111 LYS B O 1 ATOM 3861 C CB . LYS B 1 52 ? 5.854 25.903 49.674 1.00 80.70 ? 111 LYS B CB 1 ATOM 3862 C CG . LYS B 1 52 ? 7.001 26.654 49.012 1.00 78.99 ? 111 LYS B CG 1 ATOM 3863 C CD . LYS B 1 52 ? 6.589 28.045 48.560 1.00 84.37 ? 111 LYS B CD 1 ATOM 3864 C CE . LYS B 1 52 ? 7.712 28.717 47.784 1.00 86.50 ? 111 LYS B CE 1 ATOM 3865 N NZ . LYS B 1 52 ? 7.313 30.047 47.249 1.00 85.99 ? 111 LYS B NZ 1 ATOM 3866 N N . LYS B 1 53 ? 3.681 24.768 51.149 1.00 81.92 ? 112 LYS B N 1 ATOM 3867 C CA . LYS B 1 53 ? 2.333 24.305 51.458 1.00 80.17 ? 112 LYS B CA 1 ATOM 3868 C C . LYS B 1 53 ? 2.380 22.973 52.208 1.00 82.86 ? 112 LYS B C 1 ATOM 3869 O O . LYS B 1 53 ? 2.915 21.989 51.695 1.00 83.10 ? 112 LYS B O 1 ATOM 3870 C CB . LYS B 1 53 ? 1.507 24.177 50.175 1.00 71.63 ? 112 LYS B CB 1 ATOM 3871 C CG . LYS B 1 53 ? 0.003 24.169 50.394 1.00 78.96 ? 112 LYS B CG 1 ATOM 3872 C CD . LYS B 1 53 ? -0.738 23.907 49.092 1.00 84.25 ? 112 LYS B CD 1 ATOM 3873 C CE . LYS B 1 53 ? -2.233 24.158 49.236 1.00 77.96 ? 112 LYS B CE 1 ATOM 3874 N NZ . LYS B 1 53 ? -2.869 23.330 50.295 1.00 69.16 ? 112 LYS B NZ 1 ATOM 3875 N N . ASN B 1 54 ? 1.825 22.939 53.416 1.00 75.35 ? 113 ASN B N 1 ATOM 3876 C CA . ASN B 1 54 ? 1.822 21.715 54.213 1.00 66.95 ? 113 ASN B CA 1 ATOM 3877 C C . ASN B 1 54 ? 0.624 20.828 53.886 1.00 72.13 ? 113 ASN B C 1 ATOM 3878 O O . ASN B 1 54 ? -0.455 20.997 54.454 1.00 79.36 ? 113 ASN B O 1 ATOM 3879 C CB . ASN B 1 54 ? 1.824 22.047 55.713 1.00 52.21 ? 113 ASN B CB 1 ATOM 3880 C CG . ASN B 1 54 ? 2.083 20.825 56.593 1.00 55.40 ? 113 ASN B CG 1 ATOM 3881 O OD1 . ASN B 1 54 ? 1.985 19.684 56.141 1.00 50.48 ? 113 ASN B OD1 1 ATOM 3882 N ND2 . ASN B 1 54 ? 2.393 21.065 57.865 1.00 49.32 ? 113 ASN B ND2 1 ATOM 3883 N N . ILE B 1 55 ? 0.818 19.885 52.967 1.00 70.52 ? 114 ILE B N 1 ATOM 3884 C CA . ILE B 1 55 ? -0.233 18.934 52.615 1.00 77.75 ? 114 ILE B CA 1 ATOM 3885 C C . ILE B 1 55 ? 0.330 17.517 52.623 1.00 75.58 ? 114 ILE B C 1 ATOM 3886 O O . ILE B 1 55 ? 1.496 17.292 52.291 1.00 77.61 ? 114 ILE B O 1 ATOM 3887 C CB . ILE B 1 55 ? -0.884 19.231 51.229 1.00 64.86 ? 114 ILE B CB 1 ATOM 3888 C CG1 . ILE B 1 55 ? -0.060 18.656 50.072 1.00 65.48 ? 114 ILE B CG1 1 ATOM 3889 C CG2 . ILE B 1 55 ? -1.131 20.720 51.049 1.00 69.42 ? 114 ILE B CG2 1 ATOM 3890 C CD1 . ILE B 1 55 ? 1.020 19.579 49.564 1.00 58.15 ? 114 ILE B CD1 1 ATOM 3891 N N . THR B 1 56 ? -0.496 16.568 53.046 1.00 75.86 ? 115 THR B N 1 ATOM 3892 C CA . THR B 1 56 ? -0.098 15.168 53.081 1.00 69.03 ? 115 THR B CA 1 ATOM 3893 C C . THR B 1 56 ? -0.360 14.510 51.733 1.00 61.31 ? 115 THR B C 1 ATOM 3894 O O . THR B 1 56 ? -0.906 15.135 50.824 1.00 58.25 ? 115 THR B O 1 ATOM 3895 C CB . THR B 1 56 ? -0.846 14.394 54.180 1.00 66.04 ? 115 THR B CB 1 ATOM 3896 O OG1 . THR B 1 56 ? -2.208 14.191 53.781 1.00 70.31 ? 115 THR B OG1 1 ATOM 3897 C CG2 . THR B 1 56 ? -0.817 15.168 55.489 1.00 43.73 ? 115 THR B CG2 1 ATOM 3898 N N . LEU B 1 57 ? 0.034 13.247 51.607 1.00 72.69 ? 116 LEU B N 1 ATOM 3899 C CA . LEU B 1 57 ? -0.152 12.517 50.360 1.00 75.28 ? 116 LEU B CA 1 ATOM 3900 C C . LEU B 1 57 ? -1.631 12.209 50.177 1.00 79.92 ? 116 LEU B C 1 ATOM 3901 O O . LEU B 1 57 ? -2.127 12.130 49.053 1.00 85.50 ? 116 LEU B O 1 ATOM 3902 C CB . LEU B 1 57 ? 0.674 11.228 50.346 1.00 65.80 ? 116 LEU B CB 1 ATOM 3903 C CG . LEU B 1 57 ? 1.983 11.276 49.555 1.00 73.95 ? 116 LEU B CG 1 ATOM 3904 C CD1 . LEU B 1 57 ? 2.735 9.959 49.665 1.00 63.31 ? 116 LEU B CD1 1 ATOM 3905 C CD2 . LEU B 1 57 ? 1.709 11.615 48.099 1.00 73.28 ? 116 LEU B CD2 1 ATOM 3906 N N . SER B 1 58 ? -2.331 12.036 51.293 1.00 74.83 ? 117 SER B N 1 ATOM 3907 C CA . SER B 1 58 ? -3.753 11.733 51.260 1.00 81.85 ? 117 SER B CA 1 ATOM 3908 C C . SER B 1 58 ? -4.562 12.936 50.791 1.00 82.19 ? 117 SER B C 1 ATOM 3909 O O . SER B 1 58 ? -5.450 12.803 49.949 1.00 83.89 ? 117 SER B O 1 ATOM 3910 C CB . SER B 1 58 ? -4.232 11.288 52.643 1.00 77.44 ? 117 SER B CB 1 ATOM 3911 O OG . SER B 1 58 ? -5.608 11.575 52.825 1.00 78.80 ? 117 SER B OG 1 ATOM 3912 N N . LYS B 1 59 ? -4.251 14.110 51.333 1.00 76.90 ? 118 LYS B N 1 ATOM 3913 C CA . LYS B 1 59 ? -4.954 15.330 50.954 1.00 78.53 ? 118 LYS B CA 1 ATOM 3914 C C . LYS B 1 59 ? -4.618 15.734 49.520 1.00 79.16 ? 118 LYS B C 1 ATOM 3915 O O . LYS B 1 59 ? -5.425 16.362 48.835 1.00 93.99 ? 118 LYS B O 1 ATOM 3916 C CB . LYS B 1 59 ? -4.610 16.465 51.925 1.00 75.71 ? 118 LYS B CB 1 ATOM 3917 C CG . LYS B 1 59 ? -5.295 17.792 51.622 1.00 79.09 ? 118 LYS B CG 1 ATOM 3918 C CD . LYS B 1 59 ? -6.816 17.666 51.609 1.00 87.54 ? 118 LYS B CD 1 ATOM 3919 C CE . LYS B 1 59 ? -7.415 17.740 53.010 1.00 84.19 ? 118 LYS B CE 1 ATOM 3920 N NZ . LYS B 1 59 ? -7.198 16.505 53.813 1.00 79.29 ? 118 LYS B NZ 1 ATOM 3921 N N . PHE B 1 60 ? -3.428 15.353 49.068 1.00 80.15 ? 119 PHE B N 1 ATOM 3922 C CA . PHE B 1 60 ? -3.003 15.642 47.703 1.00 81.05 ? 119 PHE B CA 1 ATOM 3923 C C . PHE B 1 60 ? -3.680 14.726 46.690 1.00 75.28 ? 119 PHE B C 1 ATOM 3924 O O . PHE B 1 60 ? -3.964 15.134 45.565 1.00 70.12 ? 119 PHE B O 1 ATOM 3925 C CB . PHE B 1 60 ? -1.482 15.522 47.578 1.00 84.56 ? 119 PHE B CB 1 ATOM 3926 C CG . PHE B 1 60 ? -0.970 15.741 46.182 1.00 85.75 ? 119 PHE B CG 1 ATOM 3927 C CD1 . PHE B 1 60 ? -0.828 17.023 45.676 1.00 77.63 ? 119 PHE B CD1 1 ATOM 3928 C CD2 . PHE B 1 60 ? -0.629 14.666 45.377 1.00 88.46 ? 119 PHE B CD2 1 ATOM 3929 C CE1 . PHE B 1 60 ? -0.359 17.228 44.392 1.00 72.58 ? 119 PHE B CE1 1 ATOM 3930 C CE2 . PHE B 1 60 ? -0.160 14.865 44.092 1.00 82.26 ? 119 PHE B CE2 1 ATOM 3931 C CZ . PHE B 1 60 ? -0.024 16.149 43.599 1.00 74.36 ? 119 PHE B CZ 1 ATOM 3932 N N . TRP B 1 61 ? -3.941 13.487 47.097 1.00 77.45 ? 120 TRP B N 1 ATOM 3933 C CA . TRP B 1 61 ? -4.572 12.512 46.213 1.00 105.70 ? 120 TRP B CA 1 ATOM 3934 C C . TRP B 1 61 ? -6.058 12.771 45.996 1.00 112.59 ? 120 TRP B C 1 ATOM 3935 O O . TRP B 1 61 ? -6.566 12.547 44.898 1.00 119.41 ? 120 TRP B O 1 ATOM 3936 C CB . TRP B 1 61 ? -4.361 11.094 46.748 1.00 111.46 ? 120 TRP B CB 1 ATOM 3937 C CG . TRP B 1 61 ? -2.976 10.572 46.512 1.00 95.81 ? 120 TRP B CG 1 ATOM 3938 C CD1 . TRP B 1 61 ? -1.990 11.165 45.777 1.00 81.42 ? 120 TRP B CD1 1 ATOM 3939 C CD2 . TRP B 1 61 ? -2.427 9.343 47.001 1.00 104.96 ? 120 TRP B CD2 1 ATOM 3940 N NE1 . TRP B 1 61 ? -0.860 10.384 45.783 1.00 88.36 ? 120 TRP B NE1 1 ATOM 3941 C CE2 . TRP B 1 61 ? -1.103 9.260 46.527 1.00 107.04 ? 120 TRP B CE2 1 ATOM 3942 C CE3 . TRP B 1 61 ? -2.926 8.307 47.795 1.00 125.10 ? 120 TRP B CE3 1 ATOM 3943 C CZ2 . TRP B 1 61 ? -0.272 8.182 46.823 1.00 118.94 ? 120 TRP B CZ2 1 ATOM 3944 C CZ3 . TRP B 1 61 ? -2.099 7.238 48.088 1.00 133.77 ? 120 TRP B CZ3 1 ATOM 3945 C CH2 . TRP B 1 61 ? -0.787 7.183 47.603 1.00 128.22 ? 120 TRP B CH2 1 ATOM 3946 N N . GLU B 1 62 ? -6.754 13.211 47.043 1.00 101.13 ? 121 GLU B N 1 ATOM 3947 C CA . GLU B 1 62 ? -8.181 13.545 46.966 1.00 100.39 ? 121 GLU B CA 1 ATOM 3948 C C . GLU B 1 62 ? -8.566 14.423 45.769 1.00 109.99 ? 121 GLU B C 1 ATOM 3949 O O . GLU B 1 62 ? -9.106 15.516 45.945 1.00 104.79 ? 121 GLU B O 1 ATOM 3950 C CB . GLU B 1 62 ? -8.629 14.231 48.259 1.00 95.86 ? 121 GLU B CB 1 ATOM 3951 C CG . GLU B 1 62 ? -8.573 13.337 49.486 1.00 99.02 ? 121 GLU B CG 1 ATOM 3952 C CD . GLU B 1 62 ? -9.423 13.857 50.628 1.00 107.53 ? 121 GLU B CD 1 ATOM 3953 O OE1 . GLU B 1 62 ? -9.997 13.030 51.367 1.00 107.16 ? 121 GLU B OE1 1 ATOM 3954 O OE2 . GLU B 1 62 ? -9.510 15.092 50.790 1.00 93.16 ? 121 GLU B OE2 1 ATOM 3955 N N . LYS B 1 63 ? -8.293 13.926 44.564 1.00 129.50 ? 122 LYS B N 1 ATOM 3956 C CA . LYS B 1 63 ? -8.615 14.613 43.317 1.00 133.91 ? 122 LYS B CA 1 ATOM 3957 C C . LYS B 1 63 ? -8.262 13.732 42.122 1.00 145.30 ? 122 LYS B C 1 ATOM 3958 O O . LYS B 1 63 ? -9.011 13.663 41.148 1.00 138.09 ? 122 LYS B O 1 ATOM 3959 C CB . LYS B 1 63 ? -7.880 15.956 43.209 1.00 120.33 ? 122 LYS B CB 1 ATOM 3960 C CG . LYS B 1 63 ? -6.375 15.879 43.417 1.00 110.54 ? 122 LYS B CG 1 ATOM 3961 C CD . LYS B 1 63 ? -5.668 17.058 42.768 1.00 109.86 ? 122 LYS B CD 1 ATOM 3962 C CE . LYS B 1 63 ? -4.168 17.002 43.007 1.00 108.67 ? 122 LYS B CE 1 ATOM 3963 N NZ . LYS B 1 63 ? -3.591 15.684 42.620 1.00 97.87 ? 122 LYS B NZ 1 ATOM 3964 N N . SER B 1 64 ? -7.123 13.050 42.206 1.00 159.08 ? 123 SER B N 1 ATOM 3965 C CA . SER B 1 64 ? -6.606 12.293 41.073 1.00 161.53 ? 123 SER B CA 1 ATOM 3966 C C . SER B 1 64 ? -6.229 10.860 41.435 1.00 170.03 ? 123 SER B C 1 ATOM 3967 O O . SER B 1 64 ? -5.731 10.594 42.529 1.00 183.36 ? 123 SER B O 1 ATOM 3968 C CB . SER B 1 64 ? -5.393 13.007 40.474 1.00 151.97 ? 123 SER B CB 1 ATOM 3969 O OG . SER B 1 64 ? -4.374 13.185 41.443 1.00 155.94 ? 123 SER B OG 1 ATOM 3970 N N . GLU B 1 65 ? -6.505 9.951 40.503 1.00 156.26 ? 124 GLU B N 1 ATOM 3971 C CA . GLU B 1 65 ? -6.093 8.543 40.547 1.00 133.53 ? 124 GLU B CA 1 ATOM 3972 C C . GLU B 1 65 ? -6.630 7.733 41.737 1.00 122.84 ? 124 GLU B C 1 ATOM 3973 O O . GLU B 1 65 ? -6.721 6.508 41.648 1.00 117.20 ? 124 GLU B O 1 ATOM 3974 C CB . GLU B 1 65 ? -4.560 8.443 40.496 1.00 134.32 ? 124 GLU B CB 1 ATOM 3975 C CG . GLU B 1 65 ? -3.864 8.294 41.835 1.00 137.82 ? 124 GLU B CG 1 ATOM 3976 C CD . GLU B 1 65 ? -2.798 9.349 42.052 1.00 133.56 ? 124 GLU B CD 1 ATOM 3977 O OE1 . GLU B 1 65 ? -2.708 10.281 41.225 1.00 121.11 ? 124 GLU B OE1 1 ATOM 3978 O OE2 . GLU B 1 65 ? -2.050 9.246 43.046 1.00 140.46 ? 124 GLU B OE2 1 ATOM 3979 N N . GLN B 1 66 ? -6.987 8.401 42.833 1.00 125.96 ? 125 GLN B N 1 ATOM 3980 C CA . GLN B 1 66 ? -7.627 7.731 43.967 1.00 132.74 ? 125 GLN B CA 1 ATOM 3981 C C . GLN B 1 66 ? -8.231 8.713 44.970 1.00 126.71 ? 125 GLN B C 1 ATOM 3982 O O . GLN B 1 66 ? -7.555 9.615 45.465 1.00 101.55 ? 125 GLN B O 1 ATOM 3983 C CB . GLN B 1 66 ? -6.637 6.803 44.682 1.00 144.21 ? 125 GLN B CB 1 ATOM 3984 C CG . GLN B 1 66 ? -5.266 7.399 44.941 1.00 148.11 ? 125 GLN B CG 1 ATOM 3985 C CD . GLN B 1 66 ? -4.200 6.332 45.100 1.00 142.65 ? 125 GLN B CD 1 ATOM 3986 O OE1 . GLN B 1 66 ? -3.384 6.114 44.204 1.00 136.24 ? 125 GLN B OE1 1 ATOM 3987 N NE2 . GLN B 1 66 ? -4.206 5.656 46.243 1.00 140.97 ? 125 GLN B NE2 1 ATOM 3988 N N . ARG B 1 67 ? -9.516 8.522 45.258 1.00 143.65 ? 126 ARG B N 1 ATOM 3989 C CA . ARG B 1 67 ? -10.218 9.313 46.263 1.00 139.77 ? 126 ARG B CA 1 ATOM 3990 C C . ARG B 1 67 ? -9.847 8.870 47.670 1.00 125.82 ? 126 ARG B C 1 ATOM 3991 O O . ARG B 1 67 ? -9.804 9.679 48.597 1.00 113.72 ? 126 ARG B O 1 ATOM 3992 C CB . ARG B 1 67 ? -11.736 9.198 46.082 1.00 132.29 ? 126 ARG B CB 1 ATOM 3993 C CG . ARG B 1 67 ? -12.392 10.358 45.352 1.00 122.75 ? 126 ARG B CG 1 ATOM 3994 C CD . ARG B 1 67 ? -12.548 10.076 43.868 1.00 121.76 ? 126 ARG B CD 1 ATOM 3995 N NE . ARG B 1 67 ? -11.260 9.872 43.214 1.00 129.61 ? 126 ARG B NE 1 ATOM 3996 C CZ . ARG B 1 67 ? -10.453 10.858 42.839 1.00 120.01 ? 126 ARG B CZ 1 ATOM 3997 N NH1 . ARG B 1 67 ? -10.800 12.119 43.054 1.00 106.65 ? 126 ARG B NH1 1 ATOM 3998 N NH2 . ARG B 1 67 ? -9.297 10.583 42.251 1.00 112.86 ? 126 ARG B NH2 1 ATOM 3999 N N . ASN B 1 68 ? -9.582 7.577 47.821 1.00 119.10 ? 127 ASN B N 1 ATOM 4000 C CA . ASN B 1 68 ? -9.414 6.988 49.141 1.00 115.21 ? 127 ASN B CA 1 ATOM 4001 C C . ASN B 1 68 ? -8.004 6.498 49.434 1.00 120.66 ? 127 ASN B C 1 ATOM 4002 O O . ASN B 1 68 ? -7.407 5.766 48.644 1.00 108.53 ? 127 ASN B O 1 ATOM 4003 C CB . ASN B 1 68 ? -10.389 5.823 49.319 1.00 111.27 ? 127 ASN B CB 1 ATOM 4004 C CG . ASN B 1 68 ? -11.836 6.245 49.173 1.00 116.00 ? 127 ASN B CG 1 ATOM 4005 O OD1 . ASN B 1 68 ? -12.512 6.536 50.160 1.00 118.60 ? 127 ASN B OD1 1 ATOM 4006 N ND2 . ASN B 1 68 ? -12.321 6.278 47.938 1.00 102.96 ? 127 ASN B ND2 1 ATOM 4007 N N . VAL B 1 69 ? -7.477 6.913 50.580 1.00 125.60 ? 128 VAL B N 1 ATOM 4008 C CA . VAL B 1 69 ? -6.300 6.277 51.148 1.00 122.18 ? 128 VAL B CA 1 ATOM 4009 C C . VAL B 1 69 ? -6.793 5.169 52.073 1.00 120.99 ? 128 VAL B C 1 ATOM 4010 O O . VAL B 1 69 ? -7.378 5.446 53.121 1.00 136.01 ? 128 VAL B O 1 ATOM 4011 C CB . VAL B 1 69 ? -5.406 7.276 51.909 1.00 107.47 ? 128 VAL B CB 1 ATOM 4012 C CG1 . VAL B 1 69 ? -4.479 7.994 50.943 1.00 120.90 ? 128 VAL B CG1 1 ATOM 4013 C CG2 . VAL B 1 69 ? -6.253 8.278 52.685 1.00 70.01 ? 128 VAL B CG2 1 ATOM 4014 N N . PRO B 1 70 ? -6.578 3.905 51.671 1.00 94.11 ? 129 PRO B N 1 ATOM 4015 C CA . PRO B 1 70 ? -7.151 2.730 52.341 1.00 96.19 ? 129 PRO B CA 1 ATOM 4016 C C . PRO B 1 70 ? -6.955 2.732 53.855 1.00 86.12 ? 129 PRO B C 1 ATOM 4017 O O . PRO B 1 70 ? -7.833 2.251 54.573 1.00 97.28 ? 129 PRO B O 1 ATOM 4018 C CB . PRO B 1 70 ? -6.393 1.566 51.700 1.00 101.24 ? 129 PRO B CB 1 ATOM 4019 C CG . PRO B 1 70 ? -6.055 2.060 50.338 1.00 84.31 ? 129 PRO B CG 1 ATOM 4020 C CD . PRO B 1 70 ? -5.766 3.527 50.501 1.00 86.41 ? 129 PRO B CD 1 ATOM 4021 N N . GLU B 1 71 ? -5.839 3.303 54.307 1.00 56.75 ? 130 GLU B N 1 ATOM 4022 C CA . GLU B 1 71 ? -5.450 3.372 55.719 1.00 73.00 ? 130 GLU B CA 1 ATOM 4023 C C . GLU B 1 71 ? -5.930 2.185 56.556 1.00 73.78 ? 130 GLU B C 1 ATOM 4024 O O . GLU B 1 71 ? -6.543 2.365 57.608 1.00 56.66 ? 130 GLU B O 1 ATOM 4025 C CB . GLU B 1 71 ? -5.978 4.672 56.330 1.00 70.16 ? 130 GLU B CB 1 ATOM 4026 C CG . GLU B 1 71 ? -5.250 5.920 55.854 1.00 75.54 ? 130 GLU B CG 1 ATOM 4027 C CD . GLU B 1 71 ? -5.582 7.146 56.684 1.00 86.93 ? 130 GLU B CD 1 ATOM 4028 O OE1 . GLU B 1 71 ? -6.395 7.027 57.625 1.00 95.72 ? 130 GLU B OE1 1 ATOM 4029 O OE2 . GLU B 1 71 ? -5.033 8.229 56.392 1.00 81.94 ? 130 GLU B OE2 1 ATOM 4030 N N . ASP B 1 72 ? -5.640 0.977 56.084 1.00 73.91 ? 131 ASP B N 1 ATOM 4031 C CA . ASP B 1 72 ? -6.025 -0.237 56.793 1.00 77.09 ? 131 ASP B CA 1 ATOM 4032 C C . ASP B 1 72 ? -5.065 -0.551 57.933 1.00 74.66 ? 131 ASP B C 1 ATOM 4033 O O . ASP B 1 72 ? -5.461 -1.076 58.974 1.00 76.21 ? 131 ASP B O 1 ATOM 4034 C CB . ASP B 1 72 ? -6.091 -1.416 55.820 1.00 86.06 ? 131 ASP B CB 1 ATOM 4035 C CG . ASP B 1 72 ? -7.212 -1.273 54.810 1.00 89.49 ? 131 ASP B CG 1 ATOM 4036 O OD1 . ASP B 1 72 ? -8.280 -0.742 55.177 1.00 78.21 ? 131 ASP B OD1 1 ATOM 4037 O OD2 . ASP B 1 72 ? -7.023 -1.687 53.646 1.00 91.96 ? 131 ASP B OD2 1 ATOM 4038 N N . ASP B 1 73 ? -3.797 -0.216 57.721 1.00 70.16 ? 132 ASP B N 1 ATOM 4039 C CA . ASP B 1 73 ? -2.746 -0.465 58.699 1.00 73.42 ? 132 ASP B CA 1 ATOM 4040 C C . ASP B 1 73 ? -1.831 0.746 58.845 1.00 67.53 ? 132 ASP B C 1 ATOM 4041 O O . ASP B 1 73 ? -1.951 1.718 58.097 1.00 60.02 ? 132 ASP B O 1 ATOM 4042 C CB . ASP B 1 73 ? -1.944 -1.710 58.309 1.00 52.84 ? 132 ASP B CB 1 ATOM 4043 C CG . ASP B 1 73 ? -1.473 -1.676 56.867 1.00 58.52 ? 132 ASP B CG 1 ATOM 4044 O OD1 . ASP B 1 73 ? -1.735 -2.655 56.137 1.00 56.08 ? 132 ASP B OD1 1 ATOM 4045 O OD2 . ASP B 1 73 ? -0.829 -0.686 56.465 1.00 52.02 ? 132 ASP B OD2 1 ATOM 4046 N N . ASN B 1 74 ? -0.916 0.681 59.807 1.00 58.81 ? 133 ASN B N 1 ATOM 4047 C CA . ASN B 1 74 ? -0.048 1.813 60.108 1.00 57.13 ? 133 ASN B CA 1 ATOM 4048 C C . ASN B 1 74 ? 0.949 2.123 58.997 1.00 60.33 ? 133 ASN B C 1 ATOM 4049 O O . ASN B 1 74 ? 1.517 3.213 58.958 1.00 56.22 ? 133 ASN B O 1 ATOM 4050 C CB . ASN B 1 74 ? 0.696 1.578 61.423 1.00 53.51 ? 133 ASN B CB 1 ATOM 4051 C CG . ASN B 1 74 ? -0.227 1.600 62.624 1.00 53.08 ? 133 ASN B CG 1 ATOM 4052 O OD1 . ASN B 1 74 ? -0.550 2.665 63.153 1.00 55.44 ? 133 ASN B OD1 1 ATOM 4053 N ND2 . ASN B 1 74 ? -0.656 0.424 63.063 1.00 53.04 ? 133 ASN B ND2 1 ATOM 4054 N N . TRP B 1 75 ? 1.168 1.165 58.103 1.00 54.54 ? 134 TRP B N 1 ATOM 4055 C CA . TRP B 1 75 ? 1.953 1.425 56.903 1.00 52.66 ? 134 TRP B CA 1 ATOM 4056 C C . TRP B 1 75 ? 1.239 2.439 56.018 1.00 61.45 ? 134 TRP B C 1 ATOM 4057 O O . TRP B 1 75 ? 1.815 3.454 55.623 1.00 50.42 ? 134 TRP B O 1 ATOM 4058 C CB . TRP B 1 75 ? 2.195 0.137 56.112 1.00 54.07 ? 134 TRP B CB 1 ATOM 4059 C CG . TRP B 1 75 ? 3.301 -0.724 56.627 1.00 50.93 ? 134 TRP B CG 1 ATOM 4060 C CD1 . TRP B 1 75 ? 4.538 -0.880 56.075 1.00 44.76 ? 134 TRP B CD1 1 ATOM 4061 C CD2 . TRP B 1 75 ? 3.271 -1.558 57.789 1.00 51.07 ? 134 TRP B CD2 1 ATOM 4062 N NE1 . TRP B 1 75 ? 5.283 -1.757 56.824 1.00 57.53 ? 134 TRP B NE1 1 ATOM 4063 C CE2 . TRP B 1 75 ? 4.527 -2.188 57.883 1.00 53.74 ? 134 TRP B CE2 1 ATOM 4064 C CE3 . TRP B 1 75 ? 2.304 -1.833 58.761 1.00 48.32 ? 134 TRP B CE3 1 ATOM 4065 C CZ2 . TRP B 1 75 ? 4.843 -3.075 58.910 1.00 54.21 ? 134 TRP B CZ2 1 ATOM 4066 C CZ3 . TRP B 1 75 ? 2.619 -2.714 59.780 1.00 47.52 ? 134 TRP B CZ3 1 ATOM 4067 C CH2 . TRP B 1 75 ? 3.878 -3.324 59.846 1.00 50.28 ? 134 TRP B CH2 1 ATOM 4068 N N . GLU B 1 76 ? -0.026 2.152 55.722 1.00 69.26 ? 135 GLU B N 1 ATOM 4069 C CA . GLU B 1 76 ? -0.833 2.991 54.842 1.00 74.58 ? 135 GLU B CA 1 ATOM 4070 C C . GLU B 1 76 ? -1.107 4.393 55.384 1.00 63.64 ? 135 GLU B C 1 ATOM 4071 O O . GLU B 1 76 ? -1.068 5.363 54.629 1.00 53.89 ? 135 GLU B O 1 ATOM 4072 C CB . GLU B 1 76 ? -2.162 2.294 54.543 1.00 46.68 ? 135 GLU B CB 1 ATOM 4073 C CG . GLU B 1 76 ? -2.026 1.078 53.644 1.00 79.81 ? 135 GLU B CG 1 ATOM 4074 C CD . GLU B 1 76 ? -3.343 0.368 53.416 1.00 86.80 ? 135 GLU B CD 1 ATOM 4075 O OE1 . GLU B 1 76 ? -4.333 0.720 54.089 1.00 90.00 ? 135 GLU B OE1 1 ATOM 4076 O OE2 . GLU B 1 76 ? -3.388 -0.541 52.560 1.00 87.74 ? 135 GLU B OE2 1 ATOM 4077 N N . ARG B 1 77 ? -1.381 4.507 56.680 1.00 61.29 ? 136 ARG B N 1 ATOM 4078 C CA . ARG B 1 77 ? -1.586 5.823 57.278 1.00 51.99 ? 136 ARG B CA 1 ATOM 4079 C C . ARG B 1 77 ? -0.276 6.604 57.288 1.00 65.19 ? 136 ARG B C 1 ATOM 4080 O O . ARG B 1 77 ? -0.278 7.830 57.188 1.00 68.43 ? 136 ARG B O 1 ATOM 4081 C CB . ARG B 1 77 ? -2.180 5.720 58.686 1.00 60.14 ? 136 ARG B CB 1 ATOM 4082 C CG . ARG B 1 77 ? -1.332 5.006 59.709 1.00 62.49 ? 136 ARG B CG 1 ATOM 4083 C CD . ARG B 1 77 ? -2.084 4.910 61.027 1.00 66.43 ? 136 ARG B CD 1 ATOM 4084 N NE . ARG B 1 77 ? -3.505 4.640 60.813 1.00 70.89 ? 136 ARG B NE 1 ATOM 4085 C CZ . ARG B 1 77 ? -4.050 3.428 60.830 1.00 81.80 ? 136 ARG B CZ 1 ATOM 4086 N NH1 . ARG B 1 77 ? -3.297 2.362 61.060 1.00 83.26 ? 136 ARG B NH1 1 ATOM 4087 N NH2 . ARG B 1 77 ? -5.352 3.282 60.623 1.00 70.69 ? 136 ARG B NH2 1 ATOM 4088 N N . PHE B 1 78 ? 0.841 5.893 57.415 1.00 66.39 ? 137 PHE B N 1 ATOM 4089 C CA . PHE B 1 78 ? 2.149 6.526 57.302 1.00 51.22 ? 137 PHE B CA 1 ATOM 4090 C C . PHE B 1 78 ? 2.364 7.029 55.882 1.00 53.90 ? 137 PHE B C 1 ATOM 4091 O O . PHE B 1 78 ? 2.745 8.180 55.676 1.00 58.34 ? 137 PHE B O 1 ATOM 4092 C CB . PHE B 1 78 ? 3.267 5.556 57.692 1.00 55.99 ? 137 PHE B CB 1 ATOM 4093 C CG . PHE B 1 78 ? 4.622 5.950 57.170 1.00 48.74 ? 137 PHE B CG 1 ATOM 4094 C CD1 . PHE B 1 78 ? 5.295 7.040 57.694 1.00 46.31 ? 137 PHE B CD1 1 ATOM 4095 C CD2 . PHE B 1 78 ? 5.224 5.223 56.156 1.00 43.44 ? 137 PHE B CD2 1 ATOM 4096 C CE1 . PHE B 1 78 ? 6.539 7.402 57.212 1.00 42.60 ? 137 PHE B CE1 1 ATOM 4097 C CE2 . PHE B 1 78 ? 6.468 5.580 55.670 1.00 48.67 ? 137 PHE B CE2 1 ATOM 4098 C CZ . PHE B 1 78 ? 7.127 6.670 56.200 1.00 45.29 ? 137 PHE B CZ 1 ATOM 4099 N N . TYR B 1 79 ? 2.120 6.157 54.908 1.00 46.47 ? 138 TYR B N 1 ATOM 4100 C CA . TYR B 1 79 ? 2.254 6.521 53.502 1.00 56.86 ? 138 TYR B CA 1 ATOM 4101 C C . TYR B 1 79 ? 1.332 7.680 53.137 1.00 65.16 ? 138 TYR B C 1 ATOM 4102 O O . TYR B 1 79 ? 1.735 8.605 52.434 1.00 64.17 ? 138 TYR B O 1 ATOM 4103 C CB . TYR B 1 79 ? 1.968 5.314 52.604 1.00 47.03 ? 138 TYR B CB 1 ATOM 4104 C CG . TYR B 1 79 ? 2.978 4.197 52.741 1.00 64.15 ? 138 TYR B CG 1 ATOM 4105 C CD1 . TYR B 1 79 ? 4.317 4.475 52.981 1.00 63.77 ? 138 TYR B CD1 1 ATOM 4106 C CD2 . TYR B 1 79 ? 2.595 2.866 52.629 1.00 55.22 ? 138 TYR B CD2 1 ATOM 4107 C CE1 . TYR B 1 79 ? 5.246 3.461 53.109 1.00 55.54 ? 138 TYR B CE1 1 ATOM 4108 C CE2 . TYR B 1 79 ? 3.518 1.844 52.755 1.00 53.91 ? 138 TYR B CE2 1 ATOM 4109 C CZ . TYR B 1 79 ? 4.843 2.148 52.994 1.00 62.59 ? 138 TYR B CZ 1 ATOM 4110 O OH . TYR B 1 79 ? 5.767 1.137 53.121 1.00 54.57 ? 138 TYR B OH 1 ATOM 4111 N N . SER B 1 80 ? 0.094 7.622 53.619 1.00 56.77 ? 139 SER B N 1 ATOM 4112 C CA . SER B 1 80 ? -0.895 8.653 53.321 1.00 61.79 ? 139 SER B CA 1 ATOM 4113 C C . SER B 1 80 ? -0.515 9.997 53.933 1.00 57.68 ? 139 SER B C 1 ATOM 4114 O O . SER B 1 80 ? -0.756 11.048 53.340 1.00 63.77 ? 139 SER B O 1 ATOM 4115 C CB . SER B 1 80 ? -2.278 8.230 53.820 1.00 54.19 ? 139 SER B CB 1 ATOM 4116 O OG . SER B 1 80 ? -2.334 8.239 55.235 1.00 66.66 ? 139 SER B OG 1 ATOM 4117 N N . ASN B 1 81 ? 0.081 9.958 55.121 1.00 53.15 ? 140 ASN B N 1 ATOM 4118 C CA . ASN B 1 81 ? 0.421 11.179 55.844 1.00 58.60 ? 140 ASN B CA 1 ATOM 4119 C C . ASN B 1 81 ? 1.828 11.682 55.538 1.00 57.53 ? 140 ASN B C 1 ATOM 4120 O O . ASN B 1 81 ? 2.334 12.576 56.216 1.00 58.02 ? 140 ASN B O 1 ATOM 4121 C CB . ASN B 1 81 ? 0.265 10.965 57.350 1.00 60.67 ? 140 ASN B CB 1 ATOM 4122 C CG . ASN B 1 81 ? -1.188 10.907 57.782 1.00 59.66 ? 140 ASN B CG 1 ATOM 4123 O OD1 . ASN B 1 81 ? -1.782 11.924 58.143 1.00 53.54 ? 140 ASN B OD1 1 ATOM 4124 N ND2 . ASN B 1 81 ? -1.770 9.715 57.743 1.00 54.05 ? 140 ASN B ND2 1 ATOM 4125 N N . ILE B 1 82 ? 2.463 11.099 54.525 1.00 48.48 ? 141 ILE B N 1 ATOM 4126 C CA . ILE B 1 82 ? 3.737 11.615 54.037 1.00 58.20 ? 141 ILE B CA 1 ATOM 4127 C C . ILE B 1 82 ? 3.510 13.014 53.474 1.00 61.08 ? 141 ILE B C 1 ATOM 4128 O O . ILE B 1 82 ? 2.809 13.180 52.475 1.00 63.16 ? 141 ILE B O 1 ATOM 4129 C CB . ILE B 1 82 ? 4.361 10.712 52.957 1.00 60.20 ? 141 ILE B CB 1 ATOM 4130 C CG1 . ILE B 1 82 ? 4.777 9.366 53.555 1.00 56.01 ? 141 ILE B CG1 1 ATOM 4131 C CG2 . ILE B 1 82 ? 5.567 11.391 52.328 1.00 58.20 ? 141 ILE B CG2 1 ATOM 4132 C CD1 . ILE B 1 82 ? 5.320 8.389 52.534 1.00 43.39 ? 141 ILE B CD1 1 ATOM 4133 N N . GLY B 1 83 ? 4.095 14.018 54.118 1.00 62.54 ? 142 GLY B N 1 ATOM 4134 C CA . GLY B 1 83 ? 3.806 15.397 53.774 1.00 64.84 ? 142 GLY B CA 1 ATOM 4135 C C . GLY B 1 83 ? 4.754 15.992 52.752 1.00 62.42 ? 142 GLY B C 1 ATOM 4136 O O . GLY B 1 83 ? 5.722 15.356 52.337 1.00 61.46 ? 142 GLY B O 1 ATOM 4137 N N . SER B 1 84 ? 4.467 17.226 52.352 1.00 59.19 ? 143 SER B N 1 ATOM 4138 C CA . SER B 1 84 ? 5.235 17.910 51.318 1.00 63.27 ? 143 SER B CA 1 ATOM 4139 C C . SER B 1 84 ? 6.473 18.610 51.864 1.00 59.65 ? 143 SER B C 1 ATOM 4140 O O . SER B 1 84 ? 7.360 19.001 51.105 1.00 65.72 ? 143 SER B O 1 ATOM 4141 C CB . SER B 1 84 ? 4.349 18.923 50.593 1.00 58.54 ? 143 SER B CB 1 ATOM 4142 O OG . SER B 1 84 ? 3.784 19.847 51.507 1.00 65.16 ? 143 SER B OG 1 ATOM 4143 N N . CYS B 1 85 ? 6.529 18.769 53.182 1.00 55.50 ? 144 CYS B N 1 ATOM 4144 C CA . CYS B 1 85 ? 7.648 19.451 53.818 1.00 67.56 ? 144 CYS B CA 1 ATOM 4145 C C . CYS B 1 85 ? 8.234 18.606 54.942 1.00 65.58 ? 144 CYS B C 1 ATOM 4146 O O . CYS B 1 85 ? 9.080 19.068 55.707 1.00 63.30 ? 144 CYS B O 1 ATOM 4147 C CB . CYS B 1 85 ? 7.207 20.814 54.353 1.00 82.07 ? 144 CYS B CB 1 ATOM 4148 S SG . CYS B 1 85 ? 6.689 21.975 53.067 1.00 77.87 ? 144 CYS B SG 1 ATOM 4149 N N . SER B 1 86 ? 7.779 17.360 55.025 1.00 71.23 ? 145 SER B N 1 ATOM 4150 C CA . SER B 1 86 ? 8.244 16.427 56.042 1.00 60.02 ? 145 SER B CA 1 ATOM 4151 C C . SER B 1 86 ? 7.832 15.007 55.679 1.00 64.55 ? 145 SER B C 1 ATOM 4152 O O . SER B 1 86 ? 6.806 14.798 55.031 1.00 67.84 ? 145 SER B O 1 ATOM 4153 C CB . SER B 1 86 ? 7.688 16.803 57.418 1.00 56.00 ? 145 SER B CB 1 ATOM 4154 O OG . SER B 1 86 ? 8.084 15.864 58.403 1.00 75.46 ? 145 SER B OG 1 ATOM 4155 N N . VAL B 1 87 ? 8.635 14.033 56.094 1.00 54.43 ? 146 VAL B N 1 ATOM 4156 C CA . VAL B 1 87 ? 8.312 12.636 55.843 1.00 54.37 ? 146 VAL B CA 1 ATOM 4157 C C . VAL B 1 87 ? 7.183 12.191 56.765 1.00 42.46 ? 146 VAL B C 1 ATOM 4158 O O . VAL B 1 87 ? 6.293 11.445 56.354 1.00 50.40 ? 146 VAL B O 1 ATOM 4159 C CB . VAL B 1 87 ? 9.548 11.724 56.030 1.00 56.49 ? 146 VAL B CB 1 ATOM 4160 C CG1 . VAL B 1 87 ? 9.135 10.271 56.214 1.00 48.95 ? 146 VAL B CG1 1 ATOM 4161 C CG2 . VAL B 1 87 ? 10.489 11.864 54.845 1.00 50.89 ? 146 VAL B CG2 1 ATOM 4162 N N . TYR B 1 88 ? 7.197 12.678 58.002 1.00 42.38 ? 147 TYR B N 1 ATOM 4163 C CA . TYR B 1 88 ? 6.133 12.332 58.931 1.00 41.89 ? 147 TYR B CA 1 ATOM 4164 C C . TYR B 1 88 ? 5.885 13.399 59.987 1.00 60.37 ? 147 TYR B C 1 ATOM 4165 O O . TYR B 1 88 ? 6.776 14.168 60.349 1.00 54.81 ? 147 TYR B O 1 ATOM 4166 C CB . TYR B 1 88 ? 6.440 11.006 59.636 1.00 42.01 ? 147 TYR B CB 1 ATOM 4167 C CG . TYR B 1 88 ? 7.519 11.089 60.699 1.00 52.62 ? 147 TYR B CG 1 ATOM 4168 C CD1 . TYR B 1 88 ? 7.192 11.347 62.027 1.00 51.88 ? 147 TYR B CD1 1 ATOM 4169 C CD2 . TYR B 1 88 ? 8.858 10.901 60.381 1.00 41.22 ? 147 TYR B CD2 1 ATOM 4170 C CE1 . TYR B 1 88 ? 8.163 11.422 63.004 1.00 44.01 ? 147 TYR B CE1 1 ATOM 4171 C CE2 . TYR B 1 88 ? 9.839 10.974 61.357 1.00 52.29 ? 147 TYR B CE2 1 ATOM 4172 C CZ . TYR B 1 88 ? 9.484 11.235 62.665 1.00 40.96 ? 147 TYR B CZ 1 ATOM 4173 O OH . TYR B 1 88 ? 10.450 11.309 63.640 1.00 58.88 ? 147 TYR B OH 1 ATOM 4174 N N . SER B 1 89 ? 4.651 13.420 60.474 1.00 64.70 ? 148 SER B N 1 ATOM 4175 C CA . SER B 1 89 ? 4.257 14.238 61.608 1.00 53.67 ? 148 SER B CA 1 ATOM 4176 C C . SER B 1 89 ? 3.484 13.293 62.517 1.00 69.73 ? 148 SER B C 1 ATOM 4177 O O . SER B 1 89 ? 3.242 12.147 62.133 1.00 75.13 ? 148 SER B O 1 ATOM 4178 C CB . SER B 1 89 ? 3.421 15.446 61.180 1.00 42.23 ? 148 SER B CB 1 ATOM 4179 O OG . SER B 1 89 ? 2.507 15.104 60.154 1.00 62.35 ? 148 SER B OG 1 ATOM 4180 N N . ASP B 1 90 ? 3.121 13.756 63.710 1.00 63.98 ? 149 ASP B N 1 ATOM 4181 C CA . ASP B 1 90 ? 2.435 12.923 64.701 1.00 66.14 ? 149 ASP B CA 1 ATOM 4182 C C . ASP B 1 90 ? 3.312 11.748 65.142 1.00 60.45 ? 149 ASP B C 1 ATOM 4183 O O . ASP B 1 90 ? 3.362 10.709 64.483 1.00 55.89 ? 149 ASP B O 1 ATOM 4184 C CB . ASP B 1 90 ? 1.096 12.409 64.150 1.00 57.93 ? 149 ASP B CB 1 ATOM 4185 C CG . ASP B 1 90 ? 0.275 11.661 65.188 1.00 68.13 ? 149 ASP B CG 1 ATOM 4186 O OD1 . ASP B 1 90 ? 0.662 11.650 66.374 1.00 61.30 ? 149 ASP B OD1 1 ATOM 4187 O OD2 . ASP B 1 90 ? -0.761 11.074 64.808 1.00 68.60 ? 149 ASP B OD2 1 ATOM 4188 N N . ASP B 1 91 ? 3.997 11.930 66.266 1.00 43.02 ? 150 ASP B N 1 ATOM 4189 C CA . ASP B 1 91 ? 4.933 10.938 66.790 1.00 52.85 ? 150 ASP B CA 1 ATOM 4190 C C . ASP B 1 91 ? 4.240 9.649 67.212 1.00 57.11 ? 150 ASP B C 1 ATOM 4191 O O . ASP B 1 91 ? 4.807 8.563 67.097 1.00 61.12 ? 150 ASP B O 1 ATOM 4192 C CB . ASP B 1 91 ? 5.711 11.513 67.974 1.00 46.50 ? 150 ASP B CB 1 ATOM 4193 C CG . ASP B 1 91 ? 6.674 12.600 67.559 1.00 53.80 ? 150 ASP B CG 1 ATOM 4194 O OD1 . ASP B 1 91 ? 6.900 12.742 66.342 1.00 44.39 ? 150 ASP B OD1 1 ATOM 4195 O OD2 . ASP B 1 91 ? 7.203 13.309 68.441 1.00 60.43 ? 150 ASP B OD2 1 ATOM 4196 N N . GLN B 1 92 ? 3.013 9.779 67.705 1.00 61.00 ? 151 GLN B N 1 ATOM 4197 C CA . GLN B 1 92 ? 2.291 8.651 68.280 1.00 49.76 ? 151 GLN B CA 1 ATOM 4198 C C . GLN B 1 92 ? 1.952 7.563 67.264 1.00 63.26 ? 151 GLN B C 1 ATOM 4199 O O . GLN B 1 92 ? 2.036 6.377 67.579 1.00 62.33 ? 151 GLN B O 1 ATOM 4200 C CB . GLN B 1 92 ? 1.006 9.143 68.952 1.00 44.22 ? 151 GLN B CB 1 ATOM 4201 C CG . GLN B 1 92 ? 0.226 8.054 69.670 1.00 54.36 ? 151 GLN B CG 1 ATOM 4202 C CD . GLN B 1 92 ? 1.093 7.251 70.621 1.00 70.40 ? 151 GLN B CD 1 ATOM 4203 O OE1 . GLN B 1 92 ? 1.149 6.024 70.541 1.00 81.55 ? 151 GLN B OE1 1 ATOM 4204 N NE2 . GLN B 1 92 ? 1.775 7.941 71.528 1.00 67.65 ? 151 GLN B NE2 1 HETATM 4205 N N . MSE B 1 93 ? 1.579 7.954 66.050 1.00 44.23 ? 152 MSE B N 1 HETATM 4206 C CA . MSE B 1 93 ? 1.204 6.969 65.039 1.00 62.33 ? 152 MSE B CA 1 HETATM 4207 C C . MSE B 1 93 ? 2.441 6.347 64.392 1.00 71.05 ? 152 MSE B C 1 HETATM 4208 O O . MSE B 1 93 ? 2.395 5.214 63.913 1.00 77.53 ? 152 MSE B O 1 HETATM 4209 C CB . MSE B 1 93 ? 0.296 7.600 63.978 1.00 44.75 ? 152 MSE B CB 1 HETATM 4210 C CG . MSE B 1 93 ? 1.013 8.378 62.887 1.00 92.20 ? 152 MSE B CG 1 HETATM 4211 SE SE . MSE B 1 93 ? 1.476 7.276 61.343 1.00 98.89 ? 152 MSE B SE 1 HETATM 4212 C CE . MSE B 1 93 ? 2.210 8.679 60.206 1.00 156.60 ? 152 MSE B CE 1 ATOM 4213 N N . ILE B 1 94 ? 3.542 7.091 64.380 1.00 69.82 ? 153 ILE B N 1 ATOM 4214 C CA . ILE B 1 94 ? 4.811 6.570 63.881 1.00 46.24 ? 153 ILE B CA 1 ATOM 4215 C C . ILE B 1 94 ? 5.380 5.564 64.870 1.00 52.64 ? 153 ILE B C 1 ATOM 4216 O O . ILE B 1 94 ? 5.840 4.489 64.482 1.00 56.07 ? 153 ILE B O 1 ATOM 4217 C CB . ILE B 1 94 ? 5.830 7.695 63.630 1.00 56.90 ? 153 ILE B CB 1 ATOM 4218 C CG1 . ILE B 1 94 ? 5.503 8.408 62.321 1.00 47.58 ? 153 ILE B CG1 1 ATOM 4219 C CG2 . ILE B 1 94 ? 7.238 7.134 63.531 1.00 49.37 ? 153 ILE B CG2 1 ATOM 4220 C CD1 . ILE B 1 94 ? 5.505 7.488 61.125 1.00 48.62 ? 153 ILE B CD1 1 ATOM 4221 N N . ASP B 1 95 ? 5.328 5.915 66.151 1.00 43.29 ? 154 ASP B N 1 ATOM 4222 C CA . ASP B 1 95 ? 5.719 5.003 67.219 1.00 62.70 ? 154 ASP B CA 1 ATOM 4223 C C . ASP B 1 95 ? 4.896 3.715 67.172 1.00 56.84 ? 154 ASP B C 1 ATOM 4224 O O . ASP B 1 95 ? 5.376 2.648 67.555 1.00 67.72 ? 154 ASP B O 1 ATOM 4225 C CB . ASP B 1 95 ? 5.566 5.681 68.582 1.00 43.26 ? 154 ASP B CB 1 ATOM 4226 C CG . ASP B 1 95 ? 6.647 6.712 68.843 1.00 68.74 ? 154 ASP B CG 1 ATOM 4227 O OD1 . ASP B 1 95 ? 7.281 7.170 67.868 1.00 72.21 ? 154 ASP B OD1 1 ATOM 4228 O OD2 . ASP B 1 95 ? 6.864 7.066 70.021 1.00 71.64 ? 154 ASP B OD2 1 ATOM 4229 N N . ASN B 1 96 ? 3.657 3.820 66.700 1.00 44.27 ? 155 ASN B N 1 ATOM 4230 C CA . ASN B 1 96 ? 2.816 2.646 66.487 1.00 59.76 ? 155 ASN B CA 1 ATOM 4231 C C . ASN B 1 96 ? 3.322 1.806 65.320 1.00 59.60 ? 155 ASN B C 1 ATOM 4232 O O . ASN B 1 96 ? 3.320 0.576 65.383 1.00 56.76 ? 155 ASN B O 1 ATOM 4233 C CB . ASN B 1 96 ? 1.362 3.056 66.244 1.00 45.24 ? 155 ASN B CB 1 ATOM 4234 C CG . ASN B 1 96 ? 0.727 3.700 67.459 1.00 58.19 ? 155 ASN B CG 1 ATOM 4235 O OD1 . ASN B 1 96 ? 1.155 3.473 68.591 1.00 49.26 ? 155 ASN B OD1 1 ATOM 4236 N ND2 . ASN B 1 96 ? -0.299 4.512 67.231 1.00 62.23 ? 155 ASN B ND2 1 ATOM 4237 N N . LEU B 1 97 ? 3.749 2.477 64.254 1.00 54.45 ? 156 LEU B N 1 ATOM 4238 C CA . LEU B 1 97 ? 4.323 1.800 63.097 1.00 56.64 ? 156 LEU B CA 1 ATOM 4239 C C . LEU B 1 97 ? 5.611 1.081 63.484 1.00 58.02 ? 156 LEU B C 1 ATOM 4240 O O . LEU B 1 97 ? 5.873 -0.033 63.030 1.00 50.62 ? 156 LEU B O 1 ATOM 4241 C CB . LEU B 1 97 ? 4.588 2.794 61.963 1.00 53.14 ? 156 LEU B CB 1 ATOM 4242 C CG . LEU B 1 97 ? 5.298 2.238 60.726 1.00 48.57 ? 156 LEU B CG 1 ATOM 4243 C CD1 . LEU B 1 97 ? 4.502 1.094 60.111 1.00 49.04 ? 156 LEU B CD1 1 ATOM 4244 C CD2 . LEU B 1 97 ? 5.541 3.338 59.705 1.00 53.38 ? 156 LEU B CD2 1 ATOM 4245 N N . LEU B 1 98 ? 6.410 1.733 64.325 1.00 43.64 ? 157 LEU B N 1 ATOM 4246 C CA . LEU B 1 98 ? 7.639 1.142 64.843 1.00 43.30 ? 157 LEU B CA 1 ATOM 4247 C C . LEU B 1 98 ? 7.335 -0.151 65.590 1.00 49.77 ? 157 LEU B C 1 ATOM 4248 O O . LEU B 1 98 ? 7.988 -1.173 65.377 1.00 53.10 ? 157 LEU B O 1 ATOM 4249 C CB . LEU B 1 98 ? 8.362 2.123 65.768 1.00 42.88 ? 157 LEU B CB 1 ATOM 4250 C CG . LEU B 1 98 ? 8.857 3.431 65.148 1.00 42.48 ? 157 LEU B CG 1 ATOM 4251 C CD1 . LEU B 1 98 ? 9.729 4.194 66.136 1.00 44.51 ? 157 LEU B CD1 1 ATOM 4252 C CD2 . LEU B 1 98 ? 9.606 3.170 63.849 1.00 46.63 ? 157 LEU B CD2 1 ATOM 4253 N N . HIS B 1 99 ? 6.338 -0.088 66.468 1.00 58.26 ? 158 HIS B N 1 ATOM 4254 C CA . HIS B 1 99 ? 5.885 -1.253 67.218 1.00 44.37 ? 158 HIS B CA 1 ATOM 4255 C C . HIS B 1 99 ? 5.425 -2.369 66.287 1.00 55.33 ? 158 HIS B C 1 ATOM 4256 O O . HIS B 1 99 ? 5.678 -3.546 66.544 1.00 53.40 ? 158 HIS B O 1 ATOM 4257 C CB . HIS B 1 99 ? 4.756 -0.865 68.175 1.00 46.68 ? 158 HIS B CB 1 ATOM 4258 C CG . HIS B 1 99 ? 4.139 -2.029 68.885 1.00 58.25 ? 158 HIS B CG 1 ATOM 4259 N ND1 . HIS B 1 99 ? 3.016 -2.677 68.417 1.00 53.66 ? 158 HIS B ND1 1 ATOM 4260 C CD2 . HIS B 1 99 ? 4.490 -2.664 70.028 1.00 63.48 ? 158 HIS B CD2 1 ATOM 4261 C CE1 . HIS B 1 99 ? 2.701 -3.660 69.242 1.00 60.96 ? 158 HIS B CE1 1 ATOM 4262 N NE2 . HIS B 1 99 ? 3.580 -3.673 70.228 1.00 66.65 ? 158 HIS B NE2 1 ATOM 4263 N N . ASP B 1 100 ? 4.747 -1.994 65.206 1.00 44.91 ? 159 ASP B N 1 ATOM 4264 C CA . ASP B 1 100 ? 4.269 -2.970 64.235 1.00 49.22 ? 159 ASP B CA 1 ATOM 4265 C C . ASP B 1 100 ? 5.435 -3.615 63.495 1.00 53.01 ? 159 ASP B C 1 ATOM 4266 O O . ASP B 1 100 ? 5.427 -4.816 63.239 1.00 53.41 ? 159 ASP B O 1 ATOM 4267 C CB . ASP B 1 100 ? 3.307 -2.319 63.238 1.00 56.24 ? 159 ASP B CB 1 ATOM 4268 C CG . ASP B 1 100 ? 1.980 -1.942 63.869 1.00 65.45 ? 159 ASP B CG 1 ATOM 4269 O OD1 . ASP B 1 100 ? 1.869 -2.005 65.112 1.00 67.80 ? 159 ASP B OD1 1 ATOM 4270 O OD2 . ASP B 1 100 ? 1.047 -1.585 63.120 1.00 57.18 ? 159 ASP B OD2 1 ATOM 4271 N N . LEU B 1 101 ? 6.441 -2.812 63.163 1.00 62.26 ? 160 LEU B N 1 ATOM 4272 C CA . LEU B 1 101 ? 7.639 -3.318 62.500 1.00 44.05 ? 160 LEU B CA 1 ATOM 4273 C C . LEU B 1 101 ? 8.376 -4.304 63.403 1.00 60.46 ? 160 LEU B C 1 ATOM 4274 O O . LEU B 1 101 ? 8.993 -5.257 62.928 1.00 50.49 ? 160 LEU B O 1 ATOM 4275 C CB . LEU B 1 101 ? 8.565 -2.167 62.102 1.00 43.51 ? 160 LEU B CB 1 ATOM 4276 C CG . LEU B 1 101 ? 8.145 -1.320 60.900 1.00 43.62 ? 160 LEU B CG 1 ATOM 4277 C CD1 . LEU B 1 101 ? 9.038 -0.096 60.770 1.00 42.99 ? 160 LEU B CD1 1 ATOM 4278 C CD2 . LEU B 1 101 ? 8.184 -2.147 59.624 1.00 43.64 ? 160 LEU B CD2 1 ATOM 4279 N N . ASN B 1 102 ? 8.305 -4.058 64.707 1.00 47.94 ? 161 ASN B N 1 ATOM 4280 C CA . ASN B 1 102 ? 8.948 -4.909 65.701 1.00 43.86 ? 161 ASN B CA 1 ATOM 4281 C C . ASN B 1 102 ? 8.211 -6.222 65.978 1.00 45.86 ? 161 ASN B C 1 ATOM 4282 O O . ASN B 1 102 ? 8.841 -7.244 66.256 1.00 46.04 ? 161 ASN B O 1 ATOM 4283 C CB . ASN B 1 102 ? 9.114 -4.132 67.011 1.00 43.68 ? 161 ASN B CB 1 ATOM 4284 C CG . ASN B 1 102 ? 9.690 -4.983 68.126 1.00 47.71 ? 161 ASN B CG 1 ATOM 4285 O OD1 . ASN B 1 102 ? 8.954 -5.589 68.905 1.00 51.05 ? 161 ASN B OD1 1 ATOM 4286 N ND2 . ASN B 1 102 ? 11.015 -5.030 68.209 1.00 45.68 ? 161 ASN B ND2 1 ATOM 4287 N N . THR B 1 103 ? 6.883 -6.196 65.903 1.00 44.86 ? 162 THR B N 1 ATOM 4288 C CA . THR B 1 103 ? 6.073 -7.315 66.385 1.00 49.41 ? 162 THR B CA 1 ATOM 4289 C C . THR B 1 103 ? 5.376 -8.140 65.300 1.00 45.77 ? 162 THR B C 1 ATOM 4290 O O . THR B 1 103 ? 5.014 -9.292 65.539 1.00 49.09 ? 162 THR B O 1 ATOM 4291 C CB . THR B 1 103 ? 4.988 -6.820 67.362 1.00 49.94 ? 162 THR B CB 1 ATOM 4292 O OG1 . THR B 1 103 ? 4.117 -5.904 66.686 1.00 54.43 ? 162 THR B OG1 1 ATOM 4293 C CG2 . THR B 1 103 ? 5.622 -6.121 68.556 1.00 45.35 ? 162 THR B CG2 1 ATOM 4294 N N . SER B 1 104 ? 5.179 -7.557 64.121 1.00 45.74 ? 163 SER B N 1 ATOM 4295 C CA . SER B 1 104 ? 4.458 -8.234 63.042 1.00 46.13 ? 163 SER B CA 1 ATOM 4296 C C . SER B 1 104 ? 5.121 -9.543 62.616 1.00 50.77 ? 163 SER B C 1 ATOM 4297 O O . SER B 1 104 ? 6.342 -9.614 62.485 1.00 67.84 ? 163 SER B O 1 ATOM 4298 C CB . SER B 1 104 ? 4.323 -7.315 61.826 1.00 46.01 ? 163 SER B CB 1 ATOM 4299 O OG . SER B 1 104 ? 3.707 -6.089 62.176 1.00 64.36 ? 163 SER B OG 1 ATOM 4300 N N . PRO B 1 105 ? 4.306 -10.587 62.399 1.00 53.43 ? 164 PRO B N 1 ATOM 4301 C CA . PRO B 1 105 ? 4.773 -11.905 61.953 1.00 52.87 ? 164 PRO B CA 1 ATOM 4302 C C . PRO B 1 105 ? 5.381 -11.852 60.552 1.00 50.88 ? 164 PRO B C 1 ATOM 4303 O O . PRO B 1 105 ? 4.883 -11.123 59.693 1.00 51.78 ? 164 PRO B O 1 ATOM 4304 C CB . PRO B 1 105 ? 3.499 -12.757 61.972 1.00 50.41 ? 164 PRO B CB 1 ATOM 4305 C CG . PRO B 1 105 ? 2.383 -11.779 61.862 1.00 55.35 ? 164 PRO B CG 1 ATOM 4306 C CD . PRO B 1 105 ? 2.846 -10.558 62.593 1.00 56.66 ? 164 PRO B CD 1 ATOM 4307 N N . ILE B 1 106 ? 6.447 -12.613 60.330 1.00 48.70 ? 165 ILE B N 1 ATOM 4308 C CA . ILE B 1 106 ? 7.149 -12.582 59.053 1.00 45.80 ? 165 ILE B CA 1 ATOM 4309 C C . ILE B 1 106 ? 6.602 -13.639 58.096 1.00 46.19 ? 165 ILE B C 1 ATOM 4310 O O . ILE B 1 106 ? 6.505 -14.815 58.448 1.00 46.44 ? 165 ILE B O 1 ATOM 4311 C CB . ILE B 1 106 ? 8.662 -12.822 59.244 1.00 56.54 ? 165 ILE B CB 1 ATOM 4312 C CG1 . ILE B 1 106 ? 9.278 -11.741 60.137 1.00 44.83 ? 165 ILE B CG1 1 ATOM 4313 C CG2 . ILE B 1 106 ? 9.368 -12.909 57.897 1.00 54.15 ? 165 ILE B CG2 1 ATOM 4314 C CD1 . ILE B 1 106 ? 9.383 -10.393 59.479 1.00 52.41 ? 165 ILE B CD1 1 ATOM 4315 N N . LYS B 1 107 ? 6.239 -13.216 56.889 1.00 46.26 ? 166 LYS B N 1 ATOM 4316 C CA . LYS B 1 107 ? 5.712 -14.137 55.887 1.00 56.16 ? 166 LYS B CA 1 ATOM 4317 C C . LYS B 1 107 ? 6.823 -14.630 54.967 1.00 46.25 ? 166 LYS B C 1 ATOM 4318 O O . LYS B 1 107 ? 6.988 -15.833 54.766 1.00 46.38 ? 166 LYS B O 1 ATOM 4319 C CB . LYS B 1 107 ? 4.605 -13.472 55.062 1.00 60.19 ? 166 LYS B CB 1 ATOM 4320 C CG . LYS B 1 107 ? 3.958 -14.395 54.040 1.00 60.00 ? 166 LYS B CG 1 ATOM 4321 C CD . LYS B 1 107 ? 3.077 -13.624 53.068 1.00 70.37 ? 166 LYS B CD 1 ATOM 4322 C CE . LYS B 1 107 ? 2.005 -12.827 53.791 1.00 72.72 ? 166 LYS B CE 1 ATOM 4323 N NZ . LYS B 1 107 ? 1.002 -13.706 54.451 1.00 77.22 ? 166 LYS B NZ 1 ATOM 4324 N N . HIS B 1 108 ? 7.588 -13.693 54.417 1.00 45.78 ? 167 HIS B N 1 ATOM 4325 C CA . HIS B 1 108 ? 8.682 -14.034 53.514 1.00 49.41 ? 167 HIS B CA 1 ATOM 4326 C C . HIS B 1 108 ? 9.951 -13.258 53.838 1.00 46.74 ? 167 HIS B C 1 ATOM 4327 O O . HIS B 1 108 ? 9.895 -12.113 54.288 1.00 51.24 ? 167 HIS B O 1 ATOM 4328 C CB . HIS B 1 108 ? 8.284 -13.764 52.061 1.00 45.50 ? 167 HIS B CB 1 ATOM 4329 C CG . HIS B 1 108 ? 7.139 -14.597 51.577 1.00 73.90 ? 167 HIS B CG 1 ATOM 4330 N ND1 . HIS B 1 108 ? 7.147 -15.975 51.625 1.00 80.64 ? 167 HIS B ND1 1 ATOM 4331 C CD2 . HIS B 1 108 ? 5.951 -14.246 51.031 1.00 66.74 ? 167 HIS B CD2 1 ATOM 4332 C CE1 . HIS B 1 108 ? 6.012 -16.436 51.131 1.00 80.33 ? 167 HIS B CE1 1 ATOM 4333 N NE2 . HIS B 1 108 ? 5.269 -15.408 50.763 1.00 73.57 ? 167 HIS B NE2 1 ATOM 4334 N N . VAL B 1 109 ? 11.096 -13.890 53.607 1.00 50.91 ? 168 VAL B N 1 ATOM 4335 C CA . VAL B 1 109 ? 12.377 -13.198 53.662 1.00 46.27 ? 168 VAL B CA 1 ATOM 4336 C C . VAL B 1 109 ? 13.103 -13.400 52.338 1.00 43.54 ? 168 VAL B C 1 ATOM 4337 O O . VAL B 1 109 ? 13.391 -14.531 51.946 1.00 43.59 ? 168 VAL B O 1 ATOM 4338 C CB . VAL B 1 109 ? 13.260 -13.694 54.821 1.00 44.36 ? 168 VAL B CB 1 ATOM 4339 C CG1 . VAL B 1 109 ? 14.590 -12.955 54.825 1.00 42.91 ? 168 VAL B CG1 1 ATOM 4340 C CG2 . VAL B 1 109 ? 12.543 -13.515 56.150 1.00 43.80 ? 168 VAL B CG2 1 ATOM 4341 N N . HIS B 1 110 ? 13.398 -12.301 51.653 1.00 43.25 ? 169 HIS B N 1 ATOM 4342 C CA . HIS B 1 110 ? 14.068 -12.368 50.360 1.00 48.93 ? 169 HIS B CA 1 ATOM 4343 C C . HIS B 1 110 ? 15.346 -11.535 50.349 1.00 48.75 ? 169 HIS B C 1 ATOM 4344 O O . HIS B 1 110 ? 15.473 -10.565 51.095 1.00 42.20 ? 169 HIS B O 1 ATOM 4345 C CB . HIS B 1 110 ? 13.129 -11.901 49.244 1.00 49.48 ? 169 HIS B CB 1 ATOM 4346 C CG . HIS B 1 110 ? 11.995 -12.839 48.975 1.00 62.56 ? 169 HIS B CG 1 ATOM 4347 N ND1 . HIS B 1 110 ? 12.016 -13.757 47.946 1.00 69.11 ? 169 HIS B ND1 1 ATOM 4348 C CD2 . HIS B 1 110 ? 10.802 -12.999 49.596 1.00 61.98 ? 169 HIS B CD2 1 ATOM 4349 C CE1 . HIS B 1 110 ? 10.887 -14.444 47.948 1.00 74.10 ? 169 HIS B CE1 1 ATOM 4350 N NE2 . HIS B 1 110 ? 10.133 -14.004 48.940 1.00 72.35 ? 169 HIS B NE2 1 ATOM 4351 N N . ILE B 1 111 ? 16.293 -11.925 49.504 1.00 45.63 ? 170 ILE B N 1 ATOM 4352 C CA . ILE B 1 111 ? 17.510 -11.148 49.321 1.00 48.44 ? 170 ILE B CA 1 ATOM 4353 C C . ILE B 1 111 ? 17.191 -9.910 48.488 1.00 55.09 ? 170 ILE B C 1 ATOM 4354 O O . ILE B 1 111 ? 16.633 -10.015 47.396 1.00 55.50 ? 170 ILE B O 1 ATOM 4355 C CB . ILE B 1 111 ? 18.615 -11.975 48.642 1.00 41.20 ? 170 ILE B CB 1 ATOM 4356 C CG1 . ILE B 1 111 ? 19.003 -13.165 49.524 1.00 41.21 ? 170 ILE B CG1 1 ATOM 4357 C CG2 . ILE B 1 111 ? 19.824 -11.105 48.337 1.00 40.62 ? 170 ILE B CG2 1 ATOM 4358 C CD1 . ILE B 1 111 ? 20.040 -14.073 48.904 1.00 53.80 ? 170 ILE B CD1 1 HETATM 4359 N N . MSE B 1 112 ? 17.543 -8.740 49.014 1.00 53.30 ? 171 MSE B N 1 HETATM 4360 C CA . MSE B 1 112 ? 17.119 -7.472 48.428 1.00 65.49 ? 171 MSE B CA 1 HETATM 4361 C C . MSE B 1 112 ? 17.764 -7.151 47.085 1.00 86.34 ? 171 MSE B C 1 HETATM 4362 O O . MSE B 1 112 ? 18.863 -7.611 46.775 1.00 88.06 ? 171 MSE B O 1 HETATM 4363 C CB . MSE B 1 112 ? 17.394 -6.325 49.400 1.00 73.34 ? 171 MSE B CB 1 HETATM 4364 C CG . MSE B 1 112 ? 16.248 -6.034 50.347 1.00 83.15 ? 171 MSE B CG 1 HETATM 4365 SE SE . MSE B 1 112 ? 16.046 -4.126 50.683 1.00 164.00 ? 171 MSE B SE 1 HETATM 4366 C CE . MSE B 1 112 ? 15.943 -3.509 48.836 1.00 41.00 ? 171 MSE B CE 1 ATOM 4367 N N . ASP B 1 113 ? 17.057 -6.347 46.297 1.00 91.94 ? 172 ASP B N 1 ATOM 4368 C CA . ASP B 1 113 ? 17.551 -5.878 45.012 1.00 100.07 ? 172 ASP B CA 1 ATOM 4369 C C . ASP B 1 113 ? 18.022 -4.432 45.134 1.00 108.46 ? 172 ASP B C 1 ATOM 4370 O O . ASP B 1 113 ? 17.932 -3.659 44.181 1.00 113.01 ? 172 ASP B O 1 ATOM 4371 C CB . ASP B 1 113 ? 16.457 -5.991 43.946 1.00 103.81 ? 172 ASP B CB 1 ATOM 4372 C CG . ASP B 1 113 ? 16.967 -6.566 42.641 1.00 112.05 ? 172 ASP B CG 1 ATOM 4373 O OD1 . ASP B 1 113 ? 18.200 -6.661 42.472 1.00 122.65 ? 172 ASP B OD1 1 ATOM 4374 O OD2 . ASP B 1 113 ? 16.131 -6.920 41.783 1.00 107.21 ? 172 ASP B OD2 1 ATOM 4375 N N . GLY B 1 114 ? 18.520 -4.074 46.314 1.00 115.27 ? 173 GLY B N 1 ATOM 4376 C CA . GLY B 1 114 ? 18.906 -2.703 46.597 1.00 115.16 ? 173 GLY B CA 1 ATOM 4377 C C . GLY B 1 114 ? 20.395 -2.413 46.541 1.00 116.30 ? 173 GLY B C 1 ATOM 4378 O O . GLY B 1 114 ? 21.011 -2.446 45.476 1.00 103.29 ? 173 GLY B O 1 ATOM 4379 N N . GLY B 1 115 ? 20.967 -2.119 47.706 1.00 118.93 ? 174 GLY B N 1 ATOM 4380 C CA . GLY B 1 115 ? 22.388 -1.855 47.850 1.00 112.01 ? 174 GLY B CA 1 ATOM 4381 C C . GLY B 1 115 ? 23.294 -3.044 47.589 1.00 111.19 ? 174 GLY B C 1 ATOM 4382 O O . GLY B 1 115 ? 22.956 -3.947 46.824 1.00 132.16 ? 174 GLY B O 1 ATOM 4383 N N . THR B 1 116 ? 24.456 -3.045 48.235 1.00 69.96 ? 175 THR B N 1 ATOM 4384 C CA . THR B 1 116 ? 25.468 -4.059 47.969 1.00 61.14 ? 175 THR B CA 1 ATOM 4385 C C . THR B 1 116 ? 25.861 -4.851 49.213 1.00 56.68 ? 175 THR B C 1 ATOM 4386 O O . THR B 1 116 ? 26.431 -5.933 49.099 1.00 54.82 ? 175 THR B O 1 ATOM 4387 C CB . THR B 1 116 ? 26.736 -3.435 47.361 1.00 75.61 ? 175 THR B CB 1 ATOM 4388 O OG1 . THR B 1 116 ? 27.168 -2.337 48.174 1.00 81.73 ? 175 THR B OG1 1 ATOM 4389 C CG2 . THR B 1 116 ? 26.456 -2.937 45.952 1.00 69.48 ? 175 THR B CG2 1 ATOM 4390 N N . GLN B 1 117 ? 25.599 -4.309 50.398 1.00 49.52 ? 176 GLN B N 1 ATOM 4391 C CA . GLN B 1 117 ? 25.901 -5.051 51.616 1.00 37.70 ? 176 GLN B CA 1 ATOM 4392 C C . GLN B 1 117 ? 24.678 -5.869 52.016 1.00 38.23 ? 176 GLN B C 1 ATOM 4393 O O . GLN B 1 117 ? 23.573 -5.610 51.539 1.00 49.84 ? 176 GLN B O 1 ATOM 4394 C CB . GLN B 1 117 ? 26.332 -4.121 52.752 1.00 37.45 ? 176 GLN B CB 1 ATOM 4395 C CG . GLN B 1 117 ? 27.703 -3.498 52.544 1.00 45.75 ? 176 GLN B CG 1 ATOM 4396 C CD . GLN B 1 117 ? 28.095 -2.541 53.655 1.00 54.68 ? 176 GLN B CD 1 ATOM 4397 O OE1 . GLN B 1 117 ? 28.145 -2.919 54.826 1.00 49.67 ? 176 GLN B OE1 1 ATOM 4398 N NE2 . GLN B 1 117 ? 28.390 -1.298 53.291 1.00 43.90 ? 176 GLN B NE2 1 ATOM 4399 N N . VAL B 1 118 ? 24.879 -6.856 52.886 1.00 44.19 ? 177 VAL B N 1 ATOM 4400 C CA . VAL B 1 118 ? 23.810 -7.780 53.255 1.00 38.77 ? 177 VAL B CA 1 ATOM 4401 C C . VAL B 1 118 ? 22.595 -7.093 53.885 1.00 39.12 ? 177 VAL B C 1 ATOM 4402 O O . VAL B 1 118 ? 22.704 -6.404 54.899 1.00 39.00 ? 177 VAL B O 1 ATOM 4403 C CB . VAL B 1 118 ? 24.331 -8.877 54.219 1.00 38.73 ? 177 VAL B CB 1 ATOM 4404 C CG1 . VAL B 1 118 ? 25.056 -8.268 55.417 1.00 38.41 ? 177 VAL B CG1 1 ATOM 4405 C CG2 . VAL B 1 118 ? 23.192 -9.791 54.658 1.00 39.26 ? 177 VAL B CG2 1 ATOM 4406 N N . LYS B 1 119 ? 21.437 -7.279 53.261 1.00 39.56 ? 178 LYS B N 1 ATOM 4407 C CA . LYS B 1 119 ? 20.181 -6.787 53.811 1.00 45.76 ? 178 LYS B CA 1 ATOM 4408 C C . LYS B 1 119 ? 19.030 -7.629 53.273 1.00 43.06 ? 178 LYS B C 1 ATOM 4409 O O . LYS B 1 119 ? 19.054 -8.063 52.122 1.00 59.53 ? 178 LYS B O 1 ATOM 4410 C CB . LYS B 1 119 ? 19.957 -5.303 53.505 1.00 41.66 ? 178 LYS B CB 1 ATOM 4411 C CG . LYS B 1 119 ? 19.825 -4.936 52.042 1.00 50.84 ? 178 LYS B CG 1 ATOM 4412 C CD . LYS B 1 119 ? 19.715 -3.426 51.903 1.00 57.99 ? 178 LYS B CD 1 ATOM 4413 C CE . LYS B 1 119 ? 19.523 -3.000 50.462 1.00 76.04 ? 178 LYS B CE 1 ATOM 4414 N NZ . LYS B 1 119 ? 19.432 -1.518 50.345 1.00 82.37 ? 178 LYS B NZ 1 ATOM 4415 N N . PHE B 1 120 ? 18.025 -7.861 54.108 1.00 40.88 ? 179 PHE B N 1 ATOM 4416 C CA . PHE B 1 120 ? 16.866 -8.641 53.696 1.00 41.41 ? 179 PHE B CA 1 ATOM 4417 C C . PHE B 1 120 ? 15.657 -7.738 53.501 1.00 41.73 ? 179 PHE B C 1 ATOM 4418 O O . PHE B 1 120 ? 15.562 -6.674 54.113 1.00 43.62 ? 179 PHE B O 1 ATOM 4419 C CB . PHE B 1 120 ? 16.540 -9.715 54.736 1.00 41.69 ? 179 PHE B CB 1 ATOM 4420 C CG . PHE B 1 120 ? 17.599 -10.772 54.882 1.00 41.71 ? 179 PHE B CG 1 ATOM 4421 C CD1 . PHE B 1 120 ? 18.529 -10.991 53.880 1.00 41.13 ? 179 PHE B CD1 1 ATOM 4422 C CD2 . PHE B 1 120 ? 17.667 -11.543 56.032 1.00 41.54 ? 179 PHE B CD2 1 ATOM 4423 C CE1 . PHE B 1 120 ? 19.503 -11.964 54.020 1.00 47.40 ? 179 PHE B CE1 1 ATOM 4424 C CE2 . PHE B 1 120 ? 18.637 -12.515 56.178 1.00 41.31 ? 179 PHE B CE2 1 ATOM 4425 C CZ . PHE B 1 120 ? 19.556 -12.726 55.171 1.00 40.99 ? 179 PHE B CZ 1 ATOM 4426 N N . VAL B 1 121 ? 14.735 -8.160 52.642 1.00 52.37 ? 180 VAL B N 1 ATOM 4427 C CA . VAL B 1 121 ? 13.423 -7.528 52.585 1.00 50.82 ? 180 VAL B CA 1 ATOM 4428 C C . VAL B 1 121 ? 12.410 -8.406 53.311 1.00 48.90 ? 180 VAL B C 1 ATOM 4429 O O . VAL B 1 121 ? 12.192 -9.564 52.953 1.00 50.97 ? 180 VAL B O 1 ATOM 4430 C CB . VAL B 1 121 ? 12.957 -7.264 51.132 1.00 45.67 ? 180 VAL B CB 1 ATOM 4431 C CG1 . VAL B 1 121 ? 13.251 -8.454 50.235 1.00 52.55 ? 180 VAL B CG1 1 ATOM 4432 C CG2 . VAL B 1 121 ? 11.476 -6.904 51.101 1.00 48.81 ? 180 VAL B CG2 1 ATOM 4433 N N . PHE B 1 122 ? 11.802 -7.844 54.347 1.00 54.53 ? 181 PHE B N 1 ATOM 4434 C CA . PHE B 1 122 ? 10.771 -8.544 55.096 1.00 43.70 ? 181 PHE B CA 1 ATOM 4435 C C . PHE B 1 122 ? 9.408 -8.316 54.466 1.00 53.53 ? 181 PHE B C 1 ATOM 4436 O O . PHE B 1 122 ? 8.995 -7.178 54.272 1.00 45.34 ? 181 PHE B O 1 ATOM 4437 C CB . PHE B 1 122 ? 10.751 -8.077 56.554 1.00 46.69 ? 181 PHE B CB 1 ATOM 4438 C CG . PHE B 1 122 ? 11.843 -8.665 57.401 1.00 43.32 ? 181 PHE B CG 1 ATOM 4439 C CD1 . PHE B 1 122 ? 12.666 -9.664 56.906 1.00 43.16 ? 181 PHE B CD1 1 ATOM 4440 C CD2 . PHE B 1 122 ? 12.048 -8.216 58.696 1.00 44.70 ? 181 PHE B CD2 1 ATOM 4441 C CE1 . PHE B 1 122 ? 13.669 -10.205 57.688 1.00 56.38 ? 181 PHE B CE1 1 ATOM 4442 C CE2 . PHE B 1 122 ? 13.049 -8.753 59.482 1.00 45.37 ? 181 PHE B CE2 1 ATOM 4443 C CZ . PHE B 1 122 ? 13.860 -9.750 58.978 1.00 42.74 ? 181 PHE B CZ 1 ATOM 4444 N N . THR B 1 123 ? 8.715 -9.399 54.138 1.00 66.44 ? 182 THR B N 1 ATOM 4445 C CA . THR B 1 123 ? 7.320 -9.300 53.740 1.00 45.15 ? 182 THR B CA 1 ATOM 4446 C C . THR B 1 123 ? 6.478 -9.818 54.892 1.00 48.54 ? 182 THR B C 1 ATOM 4447 O O . THR B 1 123 ? 6.548 -10.996 55.240 1.00 54.35 ? 182 THR B O 1 ATOM 4448 C CB . THR B 1 123 ? 7.012 -10.093 52.456 1.00 45.39 ? 182 THR B CB 1 ATOM 4449 O OG1 . THR B 1 123 ? 7.740 -9.529 51.359 1.00 55.96 ? 182 THR B OG1 1 ATOM 4450 C CG2 . THR B 1 123 ? 5.524 -10.044 52.146 1.00 45.97 ? 182 THR B CG2 1 ATOM 4451 N N . PHE B 1 124 ? 5.696 -8.931 55.495 1.00 48.94 ? 183 PHE B N 1 ATOM 4452 C CA . PHE B 1 124 ? 4.913 -9.291 56.668 1.00 48.87 ? 183 PHE B CA 1 ATOM 4453 C C . PHE B 1 124 ? 3.609 -9.974 56.286 1.00 56.95 ? 183 PHE B C 1 ATOM 4454 O O . PHE B 1 124 ? 3.251 -10.055 55.111 1.00 63.43 ? 183 PHE B O 1 ATOM 4455 C CB . PHE B 1 124 ? 4.627 -8.058 57.526 1.00 46.00 ? 183 PHE B CB 1 ATOM 4456 C CG . PHE B 1 124 ? 5.861 -7.391 58.057 1.00 48.72 ? 183 PHE B CG 1 ATOM 4457 C CD1 . PHE B 1 124 ? 6.554 -7.938 59.125 1.00 45.24 ? 183 PHE B CD1 1 ATOM 4458 C CD2 . PHE B 1 124 ? 6.327 -6.217 57.492 1.00 46.21 ? 183 PHE B CD2 1 ATOM 4459 C CE1 . PHE B 1 124 ? 7.690 -7.326 59.618 1.00 48.36 ? 183 PHE B CE1 1 ATOM 4460 C CE2 . PHE B 1 124 ? 7.462 -5.601 57.980 1.00 44.48 ? 183 PHE B CE2 1 ATOM 4461 C CZ . PHE B 1 124 ? 8.146 -6.156 59.045 1.00 44.32 ? 183 PHE B CZ 1 ATOM 4462 N N . LYS B 1 125 ? 2.915 -10.474 57.301 1.00 51.54 ? 184 LYS B N 1 ATOM 4463 C CA . LYS B 1 125 ? 1.656 -11.185 57.126 1.00 53.38 ? 184 LYS B CA 1 ATOM 4464 C C . LYS B 1 125 ? 0.616 -10.337 56.394 1.00 56.07 ? 184 LYS B C 1 ATOM 4465 O O . LYS B 1 125 ? -0.122 -10.838 55.546 1.00 57.28 ? 184 LYS B O 1 ATOM 4466 C CB . LYS B 1 125 ? 1.135 -11.617 58.495 1.00 56.10 ? 184 LYS B CB 1 ATOM 4467 C CG . LYS B 1 125 ? -0.320 -12.007 58.545 1.00 65.72 ? 184 LYS B CG 1 ATOM 4468 C CD . LYS B 1 125 ? -0.659 -12.524 59.929 1.00 64.53 ? 184 LYS B CD 1 ATOM 4469 C CE . LYS B 1 125 ? -2.058 -13.085 59.978 1.00 60.43 ? 184 LYS B CE 1 ATOM 4470 N NZ . LYS B 1 125 ? -2.543 -13.249 61.376 1.00 63.65 ? 184 LYS B NZ 1 ATOM 4471 N N . ASN B 1 126 ? 0.575 -9.050 56.720 1.00 51.08 ? 185 ASN B N 1 ATOM 4472 C CA . ASN B 1 126 ? -0.306 -8.100 56.047 1.00 47.95 ? 185 ASN B CA 1 ATOM 4473 C C . ASN B 1 126 ? 0.181 -7.695 54.653 1.00 59.92 ? 185 ASN B C 1 ATOM 4474 O O . ASN B 1 126 ? -0.343 -6.751 54.060 1.00 68.85 ? 185 ASN B O 1 ATOM 4475 C CB . ASN B 1 126 ? -0.494 -6.856 56.921 1.00 47.79 ? 185 ASN B CB 1 ATOM 4476 C CG . ASN B 1 126 ? 0.816 -6.159 57.238 1.00 60.13 ? 185 ASN B CG 1 ATOM 4477 O OD1 . ASN B 1 126 ? 1.871 -6.516 56.711 1.00 56.34 ? 185 ASN B OD1 1 ATOM 4478 N ND2 . ASN B 1 126 ? 0.755 -5.159 58.109 1.00 55.15 ? 185 ASN B ND2 1 ATOM 4479 N N . ASP B 1 127 ? 1.204 -8.395 54.161 1.00 51.57 ? 186 ASP B N 1 ATOM 4480 C CA . ASP B 1 127 ? 1.803 -8.147 52.845 1.00 51.47 ? 186 ASP B CA 1 ATOM 4481 C C . ASP B 1 127 ? 2.505 -6.794 52.736 1.00 56.05 ? 186 ASP B C 1 ATOM 4482 O O . ASP B 1 127 ? 2.947 -6.406 51.654 1.00 46.35 ? 186 ASP B O 1 ATOM 4483 C CB . ASP B 1 127 ? 0.755 -8.273 51.735 1.00 50.39 ? 186 ASP B CB 1 ATOM 4484 C CG . ASP B 1 127 ? 0.382 -9.712 51.449 1.00 69.04 ? 186 ASP B CG 1 ATOM 4485 O OD1 . ASP B 1 127 ? 1.273 -10.584 51.533 1.00 48.70 ? 186 ASP B OD1 1 ATOM 4486 O OD2 . ASP B 1 127 ? -0.799 -9.971 51.137 1.00 80.23 ? 186 ASP B OD2 1 ATOM 4487 N N . LYS B 1 128 ? 2.604 -6.073 53.848 1.00 46.42 ? 187 LYS B N 1 ATOM 4488 C CA . LYS B 1 128 ? 3.441 -4.881 53.887 1.00 53.66 ? 187 LYS B CA 1 ATOM 4489 C C . LYS B 1 128 ? 4.899 -5.310 53.983 1.00 59.89 ? 187 LYS B C 1 ATOM 4490 O O . LYS B 1 128 ? 5.188 -6.475 54.259 1.00 51.14 ? 187 LYS B O 1 ATOM 4491 C CB . LYS B 1 128 ? 3.060 -3.979 55.061 1.00 51.22 ? 187 LYS B CB 1 ATOM 4492 C CG . LYS B 1 128 ? 1.706 -3.307 54.909 1.00 52.99 ? 187 LYS B CG 1 ATOM 4493 C CD . LYS B 1 128 ? 1.649 -2.469 53.640 1.00 50.75 ? 187 LYS B CD 1 ATOM 4494 C CE . LYS B 1 128 ? 0.341 -1.700 53.538 1.00 62.21 ? 187 LYS B CE 1 ATOM 4495 N NZ . LYS B 1 128 ? -0.847 -2.575 53.734 1.00 54.03 ? 187 LYS B NZ 1 ATOM 4496 N N . GLN B 1 129 ? 5.821 -4.380 53.757 1.00 48.79 ? 188 GLN B N 1 ATOM 4497 C CA . GLN B 1 129 ? 7.227 -4.753 53.655 1.00 44.42 ? 188 GLN B CA 1 ATOM 4498 C C . GLN B 1 129 ? 8.167 -3.837 54.435 1.00 49.93 ? 188 GLN B C 1 ATOM 4499 O O . GLN B 1 129 ? 7.807 -2.722 54.810 1.00 43.86 ? 188 GLN B O 1 ATOM 4500 C CB . GLN B 1 129 ? 7.655 -4.792 52.187 1.00 44.26 ? 188 GLN B CB 1 ATOM 4501 C CG . GLN B 1 129 ? 6.984 -5.890 51.372 1.00 44.70 ? 188 GLN B CG 1 ATOM 4502 C CD . GLN B 1 129 ? 7.507 -5.965 49.952 1.00 49.84 ? 188 GLN B CD 1 ATOM 4503 O OE1 . GLN B 1 129 ? 7.531 -4.966 49.233 1.00 47.60 ? 188 GLN B OE1 1 ATOM 4504 N NE2 . GLN B 1 129 ? 7.936 -7.154 49.542 1.00 44.54 ? 188 GLN B NE2 1 ATOM 4505 N N . ALA B 1 130 ? 9.374 -4.335 54.686 1.00 62.44 ? 189 ALA B N 1 ATOM 4506 C CA . ALA B 1 130 ? 10.392 -3.581 55.405 1.00 51.66 ? 189 ALA B CA 1 ATOM 4507 C C . ALA B 1 130 ? 11.797 -4.007 54.989 1.00 56.06 ? 189 ALA B C 1 ATOM 4508 O O . ALA B 1 130 ? 11.992 -5.096 54.448 1.00 47.83 ? 189 ALA B O 1 ATOM 4509 C CB . ALA B 1 130 ? 10.213 -3.749 56.904 1.00 43.15 ? 189 ALA B CB 1 ATOM 4510 N N . VAL B 1 131 ? 12.772 -3.141 55.248 1.00 46.14 ? 190 VAL B N 1 ATOM 4511 C CA . VAL B 1 131 ? 14.173 -3.457 54.993 1.00 41.65 ? 190 VAL B CA 1 ATOM 4512 C C . VAL B 1 131 ? 14.858 -3.913 56.278 1.00 46.36 ? 190 VAL B C 1 ATOM 4513 O O . VAL B 1 131 ? 14.815 -3.218 57.293 1.00 46.61 ? 190 VAL B O 1 ATOM 4514 C CB . VAL B 1 131 ? 14.931 -2.249 54.410 1.00 41.19 ? 190 VAL B CB 1 ATOM 4515 C CG1 . VAL B 1 131 ? 16.417 -2.555 54.293 1.00 40.71 ? 190 VAL B CG1 1 ATOM 4516 C CG2 . VAL B 1 131 ? 14.356 -1.868 53.056 1.00 41.34 ? 190 VAL B CG2 1 ATOM 4517 N N . PHE B 1 132 ? 15.489 -5.081 56.233 1.00 41.42 ? 191 PHE B N 1 ATOM 4518 C CA . PHE B 1 132 ? 16.181 -5.610 57.402 1.00 41.25 ? 191 PHE B CA 1 ATOM 4519 C C . PHE B 1 132 ? 17.692 -5.591 57.215 1.00 52.87 ? 191 PHE B C 1 ATOM 4520 O O . PHE B 1 132 ? 18.209 -6.093 56.220 1.00 40.58 ? 191 PHE B O 1 ATOM 4521 C CB . PHE B 1 132 ? 15.716 -7.034 57.705 1.00 41.63 ? 191 PHE B CB 1 ATOM 4522 C CG . PHE B 1 132 ? 16.479 -7.697 58.816 1.00 41.45 ? 191 PHE B CG 1 ATOM 4523 C CD1 . PHE B 1 132 ? 16.256 -7.338 60.134 1.00 43.02 ? 191 PHE B CD1 1 ATOM 4524 C CD2 . PHE B 1 132 ? 17.415 -8.682 58.543 1.00 41.25 ? 191 PHE B CD2 1 ATOM 4525 C CE1 . PHE B 1 132 ? 16.953 -7.946 61.160 1.00 41.34 ? 191 PHE B CE1 1 ATOM 4526 C CE2 . PHE B 1 132 ? 18.116 -9.293 59.566 1.00 41.09 ? 191 PHE B CE2 1 ATOM 4527 C CZ . PHE B 1 132 ? 17.884 -8.924 60.876 1.00 41.13 ? 191 PHE B CZ 1 ATOM 4528 N N . LYS B 1 133 ? 18.394 -5.007 58.180 1.00 40.37 ? 192 LYS B N 1 ATOM 4529 C CA . LYS B 1 133 ? 19.851 -5.030 58.187 1.00 39.86 ? 192 LYS B CA 1 ATOM 4530 C C . LYS B 1 133 ? 20.343 -5.671 59.478 1.00 39.78 ? 192 LYS B C 1 ATOM 4531 O O . LYS B 1 133 ? 20.080 -5.163 60.567 1.00 45.04 ? 192 LYS B O 1 ATOM 4532 C CB . LYS B 1 133 ? 20.417 -3.617 58.033 1.00 39.46 ? 192 LYS B CB 1 ATOM 4533 C CG . LYS B 1 133 ? 20.184 -3.010 56.658 1.00 39.45 ? 192 LYS B CG 1 ATOM 4534 C CD . LYS B 1 133 ? 20.637 -1.562 56.602 1.00 39.10 ? 192 LYS B CD 1 ATOM 4535 C CE . LYS B 1 133 ? 20.545 -1.011 55.188 1.00 39.05 ? 192 LYS B CE 1 ATOM 4536 N NZ . LYS B 1 133 ? 21.129 0.355 55.088 1.00 38.67 ? 192 LYS B NZ 1 ATOM 4537 N N . PRO B 1 134 ? 21.064 -6.795 59.357 1.00 39.67 ? 193 PRO B N 1 ATOM 4538 C CA . PRO B 1 134 ? 21.497 -7.578 60.519 1.00 39.63 ? 193 PRO B CA 1 ATOM 4539 C C . PRO B 1 134 ? 22.624 -6.922 61.313 1.00 39.15 ? 193 PRO B C 1 ATOM 4540 O O . PRO B 1 134 ? 23.458 -6.212 60.749 1.00 38.76 ? 193 PRO B O 1 ATOM 4541 C CB . PRO B 1 134 ? 21.974 -8.889 59.890 1.00 39.63 ? 193 PRO B CB 1 ATOM 4542 C CG . PRO B 1 134 ? 22.430 -8.499 58.529 1.00 39.40 ? 193 PRO B CG 1 ATOM 4543 C CD . PRO B 1 134 ? 21.511 -7.394 58.087 1.00 39.58 ? 193 PRO B CD 1 HETATM 4544 N N . MSE B 1 135 ? 22.632 -7.164 62.620 1.00 78.89 ? 194 MSE B N 1 HETATM 4545 C CA . MSE B 1 135 ? 23.702 -6.702 63.495 1.00 38.77 ? 194 MSE B CA 1 HETATM 4546 C C . MSE B 1 135 ? 24.980 -7.482 63.218 1.00 38.41 ? 194 MSE B C 1 HETATM 4547 O O . MSE B 1 135 ? 24.927 -8.666 62.888 1.00 38.58 ? 194 MSE B O 1 HETATM 4548 C CB . MSE B 1 135 ? 23.297 -6.855 64.964 1.00 67.27 ? 194 MSE B CB 1 HETATM 4549 C CG . MSE B 1 135 ? 24.414 -6.587 65.961 1.00 38.53 ? 194 MSE B CG 1 HETATM 4550 SE SE . MSE B 1 135 ? 23.850 -6.825 67.809 1.00 84.20 ? 194 MSE B SE 1 HETATM 4551 C CE . MSE B 1 135 ? 25.571 -6.590 68.691 1.00 61.24 ? 194 MSE B CE 1 ATOM 4552 N N . ARG B 1 136 ? 26.126 -6.821 63.348 1.00 37.93 ? 195 ARG B N 1 ATOM 4553 C CA . ARG B 1 136 ? 27.397 -7.492 63.133 1.00 37.57 ? 195 ARG B CA 1 ATOM 4554 C C . ARG B 1 136 ? 28.212 -7.456 64.421 1.00 37.30 ? 195 ARG B C 1 ATOM 4555 O O . ARG B 1 136 ? 28.250 -8.429 65.173 1.00 53.02 ? 195 ARG B O 1 ATOM 4556 C CB . ARG B 1 136 ? 28.174 -6.830 62.000 1.00 37.21 ? 195 ARG B CB 1 ATOM 4557 C CG . ARG B 1 136 ? 29.320 -7.660 61.464 1.00 36.91 ? 195 ARG B CG 1 ATOM 4558 C CD . ARG B 1 136 ? 29.920 -6.975 60.261 1.00 36.61 ? 195 ARG B CD 1 ATOM 4559 N NE . ARG B 1 136 ? 29.050 -7.108 59.095 1.00 36.91 ? 195 ARG B NE 1 ATOM 4560 C CZ . ARG B 1 136 ? 29.047 -8.133 58.251 1.00 37.02 ? 195 ARG B CZ 1 ATOM 4561 N NH1 . ARG B 1 136 ? 29.864 -9.161 58.433 1.00 36.85 ? 195 ARG B NH1 1 ATOM 4562 N NH2 . ARG B 1 136 ? 28.204 -8.132 57.229 1.00 47.70 ? 195 ARG B NH2 1 ATOM 4563 N N . PHE B 1 137 ? 28.858 -6.320 64.669 1.00 40.73 ? 196 PHE B N 1 ATOM 4564 C CA . PHE B 1 137 ? 29.674 -6.143 65.864 1.00 38.66 ? 196 PHE B CA 1 ATOM 4565 C C . PHE B 1 137 ? 28.880 -5.503 67.000 1.00 42.27 ? 196 PHE B C 1 ATOM 4566 O O . PHE B 1 137 ? 27.742 -5.072 66.811 1.00 46.20 ? 196 PHE B O 1 ATOM 4567 C CB . PHE B 1 137 ? 30.902 -5.286 65.553 1.00 36.16 ? 196 PHE B CB 1 ATOM 4568 C CG . PHE B 1 137 ? 31.673 -5.743 64.350 1.00 45.48 ? 196 PHE B CG 1 ATOM 4569 C CD1 . PHE B 1 137 ? 32.234 -7.008 64.308 1.00 35.88 ? 196 PHE B CD1 1 ATOM 4570 C CD2 . PHE B 1 137 ? 31.844 -4.902 63.263 1.00 35.78 ? 196 PHE B CD2 1 ATOM 4571 C CE1 . PHE B 1 137 ? 32.946 -7.428 63.201 1.00 42.60 ? 196 PHE B CE1 1 ATOM 4572 C CE2 . PHE B 1 137 ? 32.555 -5.316 62.153 1.00 37.68 ? 196 PHE B CE2 1 ATOM 4573 C CZ . PHE B 1 137 ? 33.107 -6.580 62.122 1.00 35.52 ? 196 PHE B CZ 1 ATOM 4574 N N . GLY B 1 138 ? 29.496 -5.437 68.176 1.00 36.68 ? 197 GLY B N 1 ATOM 4575 C CA . GLY B 1 138 ? 28.886 -4.810 69.335 1.00 36.83 ? 197 GLY B CA 1 ATOM 4576 C C . GLY B 1 138 ? 28.821 -3.299 69.220 1.00 40.47 ? 197 GLY B C 1 ATOM 4577 O O . GLY B 1 138 ? 29.350 -2.716 68.274 1.00 49.86 ? 197 GLY B O 1 ATOM 4578 N N . ARG B 1 139 ? 28.165 -2.664 70.186 1.00 36.83 ? 198 ARG B N 1 ATOM 4579 C CA . ARG B 1 139 ? 27.995 -1.214 70.179 1.00 45.53 ? 198 ARG B CA 1 ATOM 4580 C C . ARG B 1 139 ? 29.320 -0.471 70.353 1.00 42.91 ? 198 ARG B C 1 ATOM 4581 O O . ARG B 1 139 ? 29.448 0.686 69.952 1.00 43.24 ? 198 ARG B O 1 ATOM 4582 C CB . ARG B 1 139 ? 27.026 -0.786 71.287 1.00 36.99 ? 198 ARG B CB 1 ATOM 4583 C CG . ARG B 1 139 ? 25.655 -1.446 71.244 1.00 37.52 ? 198 ARG B CG 1 ATOM 4584 C CD . ARG B 1 139 ? 24.888 -1.063 69.991 1.00 38.29 ? 198 ARG B CD 1 ATOM 4585 N NE . ARG B 1 139 ? 23.447 -1.209 70.175 1.00 41.71 ? 198 ARG B NE 1 ATOM 4586 C CZ . ARG B 1 139 ? 22.737 -2.243 69.740 1.00 48.80 ? 198 ARG B CZ 1 ATOM 4587 N NH1 . ARG B 1 139 ? 23.332 -3.233 69.091 1.00 42.60 ? 198 ARG B NH1 1 ATOM 4588 N NH2 . ARG B 1 139 ? 21.430 -2.288 69.956 1.00 41.87 ? 198 ARG B NH2 1 ATOM 4589 N N . ASP B 1 140 ? 30.302 -1.140 70.949 1.00 35.96 ? 199 ASP B N 1 ATOM 4590 C CA . ASP B 1 140 ? 31.579 -0.509 71.276 1.00 47.87 ? 199 ASP B CA 1 ATOM 4591 C C . ASP B 1 140 ? 32.577 -0.512 70.120 1.00 39.09 ? 199 ASP B C 1 ATOM 4592 O O . ASP B 1 140 ? 33.573 0.212 70.153 1.00 47.99 ? 199 ASP B O 1 ATOM 4593 C CB . ASP B 1 140 ? 32.206 -1.193 72.493 1.00 44.22 ? 199 ASP B CB 1 ATOM 4594 C CG . ASP B 1 140 ? 31.424 -0.941 73.769 1.00 66.18 ? 199 ASP B CG 1 ATOM 4595 O OD1 . ASP B 1 140 ? 30.798 0.133 73.880 1.00 53.65 ? 199 ASP B OD1 1 ATOM 4596 O OD2 . ASP B 1 140 ? 31.441 -1.813 74.664 1.00 84.28 ? 199 ASP B OD2 1 ATOM 4597 N N . TYR B 1 141 ? 32.312 -1.333 69.109 1.00 35.31 ? 200 TYR B N 1 ATOM 4598 C CA . TYR B 1 141 ? 33.215 -1.462 67.970 1.00 35.02 ? 200 TYR B CA 1 ATOM 4599 C C . TYR B 1 141 ? 33.381 -0.129 67.249 1.00 34.82 ? 200 TYR B C 1 ATOM 4600 O O . TYR B 1 141 ? 32.405 0.573 66.980 1.00 65.94 ? 200 TYR B O 1 ATOM 4601 C CB . TYR B 1 141 ? 32.710 -2.531 67.001 1.00 46.13 ? 200 TYR B CB 1 ATOM 4602 C CG . TYR B 1 141 ? 33.655 -2.833 65.855 1.00 40.79 ? 200 TYR B CG 1 ATOM 4603 C CD1 . TYR B 1 141 ? 33.587 -2.125 64.662 1.00 46.05 ? 200 TYR B CD1 1 ATOM 4604 C CD2 . TYR B 1 141 ? 34.610 -3.836 65.966 1.00 48.99 ? 200 TYR B CD2 1 ATOM 4605 C CE1 . TYR B 1 141 ? 34.447 -2.402 63.616 1.00 39.91 ? 200 TYR B CE1 1 ATOM 4606 C CE2 . TYR B 1 141 ? 35.474 -4.121 64.925 1.00 52.09 ? 200 TYR B CE2 1 ATOM 4607 C CZ . TYR B 1 141 ? 35.387 -3.401 63.752 1.00 61.12 ? 200 TYR B CZ 1 ATOM 4608 O OH . TYR B 1 141 ? 36.244 -3.682 62.713 1.00 75.41 ? 200 TYR B OH 1 ATOM 4609 N N . GLU B 1 142 ? 34.629 0.213 66.947 1.00 34.39 ? 201 GLU B N 1 ATOM 4610 C CA . GLU B 1 142 ? 34.938 1.434 66.219 1.00 39.37 ? 201 GLU B CA 1 ATOM 4611 C C . GLU B 1 142 ? 35.564 1.097 64.875 1.00 41.27 ? 201 GLU B C 1 ATOM 4612 O O . GLU B 1 142 ? 36.286 0.109 64.747 1.00 36.99 ? 201 GLU B O 1 ATOM 4613 C CB . GLU B 1 142 ? 35.890 2.316 67.027 1.00 33.80 ? 201 GLU B CB 1 ATOM 4614 C CG . GLU B 1 142 ? 35.469 2.544 68.468 1.00 48.88 ? 201 GLU B CG 1 ATOM 4615 C CD . GLU B 1 142 ? 34.949 3.945 68.713 1.00 44.31 ? 201 GLU B CD 1 ATOM 4616 O OE1 . GLU B 1 142 ? 34.828 4.718 67.741 1.00 57.95 ? 201 GLU B OE1 1 ATOM 4617 O OE2 . GLU B 1 142 ? 34.665 4.274 69.882 1.00 47.66 ? 201 GLU B OE2 1 ATOM 4618 N N . SER B 1 143 ? 35.293 1.937 63.882 1.00 46.35 ? 202 SER B N 1 ATOM 4619 C CA . SER B 1 143 ? 35.785 1.730 62.529 1.00 33.89 ? 202 SER B CA 1 ATOM 4620 C C . SER B 1 143 ? 37.312 1.780 62.511 1.00 37.77 ? 202 SER B C 1 ATOM 4621 O O . SER B 1 143 ? 37.918 2.593 63.213 1.00 43.49 ? 202 SER B O 1 ATOM 4622 C CB . SER B 1 143 ? 35.221 2.797 61.591 1.00 33.90 ? 202 SER B CB 1 ATOM 4623 O OG . SER B 1 143 ? 33.802 2.830 61.622 1.00 62.81 ? 202 SER B OG 1 ATOM 4624 N N . ASP B 1 144 ? 37.927 0.923 61.701 1.00 41.88 ? 203 ASP B N 1 ATOM 4625 C CA . ASP B 1 144 ? 39.369 0.950 61.498 1.00 32.81 ? 203 ASP B CA 1 ATOM 4626 C C . ASP B 1 144 ? 39.750 2.331 60.965 1.00 39.12 ? 203 ASP B C 1 ATOM 4627 O O . ASP B 1 144 ? 39.182 2.790 59.974 1.00 32.70 ? 203 ASP B O 1 ATOM 4628 C CB . ASP B 1 144 ? 39.790 -0.160 60.524 1.00 36.90 ? 203 ASP B CB 1 ATOM 4629 C CG . ASP B 1 144 ? 41.286 -0.422 60.531 1.00 45.62 ? 203 ASP B CG 1 ATOM 4630 O OD1 . ASP B 1 144 ? 42.070 0.545 60.634 1.00 44.38 ? 203 ASP B OD1 1 ATOM 4631 O OD2 . ASP B 1 144 ? 41.679 -1.603 60.422 1.00 46.72 ? 203 ASP B OD2 1 ATOM 4632 N N . PRO B 1 145 ? 40.695 3.010 61.636 1.00 36.16 ? 204 PRO B N 1 ATOM 4633 C CA . PRO B 1 145 ? 41.152 4.334 61.194 1.00 31.99 ? 204 PRO B CA 1 ATOM 4634 C C . PRO B 1 145 ? 41.745 4.302 59.789 1.00 39.60 ? 204 PRO B C 1 ATOM 4635 O O . PRO B 1 145 ? 41.799 5.331 59.115 1.00 31.71 ? 204 PRO B O 1 ATOM 4636 C CB . PRO B 1 145 ? 42.220 4.701 62.229 1.00 31.66 ? 204 PRO B CB 1 ATOM 4637 C CG . PRO B 1 145 ? 41.847 3.924 63.441 1.00 31.85 ? 204 PRO B CG 1 ATOM 4638 C CD . PRO B 1 145 ? 41.289 2.627 62.929 1.00 32.11 ? 204 PRO B CD 1 ATOM 4639 N N . ASN B 1 146 ? 42.182 3.122 59.361 1.00 31.77 ? 205 ASN B N 1 ATOM 4640 C CA . ASN B 1 146 ? 42.744 2.941 58.031 1.00 38.70 ? 205 ASN B CA 1 ATOM 4641 C C . ASN B 1 146 ? 41.676 2.683 56.973 1.00 34.23 ? 205 ASN B C 1 ATOM 4642 O O . ASN B 1 146 ? 41.968 2.675 55.776 1.00 32.31 ? 205 ASN B O 1 ATOM 4643 C CB . ASN B 1 146 ? 43.752 1.790 58.038 1.00 31.40 ? 205 ASN B CB 1 ATOM 4644 C CG . ASN B 1 146 ? 44.966 2.085 58.893 1.00 31.88 ? 205 ASN B CG 1 ATOM 4645 O OD1 . ASN B 1 146 ? 45.492 3.199 58.882 1.00 34.82 ? 205 ASN B OD1 1 ATOM 4646 N ND2 . ASN B 1 146 ? 45.418 1.087 59.644 1.00 30.98 ? 205 ASN B ND2 1 ATOM 4647 N N . HIS B 1 147 ? 40.441 2.470 57.415 1.00 34.61 ? 206 HIS B N 1 ATOM 4648 C CA . HIS B 1 147 ? 39.342 2.194 56.495 1.00 32.66 ? 206 HIS B CA 1 ATOM 4649 C C . HIS B 1 147 ? 38.771 3.467 55.881 1.00 42.02 ? 206 HIS B C 1 ATOM 4650 O O . HIS B 1 147 ? 38.462 4.426 56.589 1.00 32.85 ? 206 HIS B O 1 ATOM 4651 C CB . HIS B 1 147 ? 38.223 1.424 57.201 1.00 36.87 ? 206 HIS B CB 1 ATOM 4652 C CG . HIS B 1 147 ? 38.441 -0.056 57.250 1.00 47.38 ? 206 HIS B CG 1 ATOM 4653 N ND1 . HIS B 1 147 ? 37.657 -0.898 58.009 1.00 42.00 ? 206 HIS B ND1 1 ATOM 4654 C CD2 . HIS B 1 147 ? 39.349 -0.846 56.629 1.00 32.92 ? 206 HIS B CD2 1 ATOM 4655 C CE1 . HIS B 1 147 ? 38.074 -2.142 57.857 1.00 33.44 ? 206 HIS B CE1 1 ATOM 4656 N NE2 . HIS B 1 147 ? 39.100 -2.138 57.025 1.00 42.04 ? 206 HIS B NE2 1 ATOM 4657 N N . PHE B 1 148 ? 38.641 3.467 54.559 1.00 43.20 ? 207 PHE B N 1 ATOM 4658 C CA . PHE B 1 148 ? 37.942 4.533 53.854 1.00 34.25 ? 207 PHE B CA 1 ATOM 4659 C C . PHE B 1 148 ? 36.438 4.412 54.073 1.00 47.75 ? 207 PHE B C 1 ATOM 4660 O O . PHE B 1 148 ? 35.953 3.388 54.558 1.00 33.57 ? 207 PHE B O 1 ATOM 4661 C CB . PHE B 1 148 ? 38.261 4.499 52.358 1.00 32.77 ? 207 PHE B CB 1 ATOM 4662 C CG . PHE B 1 148 ? 39.634 5.003 52.015 1.00 45.50 ? 207 PHE B CG 1 ATOM 4663 C CD1 . PHE B 1 148 ? 39.874 6.360 51.878 1.00 32.14 ? 207 PHE B CD1 1 ATOM 4664 C CD2 . PHE B 1 148 ? 40.684 4.119 51.824 1.00 32.08 ? 207 PHE B CD2 1 ATOM 4665 C CE1 . PHE B 1 148 ? 41.136 6.827 51.559 1.00 38.10 ? 207 PHE B CE1 1 ATOM 4666 C CE2 . PHE B 1 148 ? 41.947 4.580 51.506 1.00 34.98 ? 207 PHE B CE2 1 ATOM 4667 C CZ . PHE B 1 148 ? 42.174 5.936 51.373 1.00 35.35 ? 207 PHE B CZ 1 ATOM 4668 N N . TYR B 1 149 ? 35.707 5.464 53.718 1.00 33.75 ? 208 TYR B N 1 ATOM 4669 C CA . TYR B 1 149 ? 34.250 5.473 53.823 1.00 38.80 ? 208 TYR B CA 1 ATOM 4670 C C . TYR B 1 149 ? 33.586 4.344 53.032 1.00 42.85 ? 208 TYR B C 1 ATOM 4671 O O . TYR B 1 149 ? 32.509 3.877 53.400 1.00 50.18 ? 208 TYR B O 1 ATOM 4672 C CB . TYR B 1 149 ? 33.693 6.826 53.364 1.00 33.92 ? 208 TYR B CB 1 ATOM 4673 C CG . TYR B 1 149 ? 34.390 7.416 52.157 1.00 43.70 ? 208 TYR B CG 1 ATOM 4674 C CD1 . TYR B 1 149 ? 35.510 8.227 52.306 1.00 42.66 ? 208 TYR B CD1 1 ATOM 4675 C CD2 . TYR B 1 149 ? 33.930 7.168 50.870 1.00 33.81 ? 208 TYR B CD2 1 ATOM 4676 C CE1 . TYR B 1 149 ? 36.151 8.770 51.210 1.00 42.86 ? 208 TYR B CE1 1 ATOM 4677 C CE2 . TYR B 1 149 ? 34.566 7.709 49.767 1.00 45.01 ? 208 TYR B CE2 1 ATOM 4678 C CZ . TYR B 1 149 ? 35.676 8.509 49.944 1.00 54.31 ? 208 TYR B CZ 1 ATOM 4679 O OH . TYR B 1 149 ? 36.313 9.051 48.853 1.00 57.33 ? 208 TYR B OH 1 ATOM 4680 N N . PHE B 1 150 ? 34.226 3.906 51.951 1.00 43.80 ? 209 PHE B N 1 ATOM 4681 C CA . PHE B 1 150 ? 33.664 2.845 51.119 1.00 43.59 ? 209 PHE B CA 1 ATOM 4682 C C . PHE B 1 150 ? 34.107 1.453 51.571 1.00 43.46 ? 209 PHE B C 1 ATOM 4683 O O . PHE B 1 150 ? 33.801 0.456 50.919 1.00 46.01 ? 209 PHE B O 1 ATOM 4684 C CB . PHE B 1 150 ? 34.030 3.065 49.646 1.00 34.17 ? 209 PHE B CB 1 ATOM 4685 C CG . PHE B 1 150 ? 35.499 3.276 49.402 1.00 36.74 ? 209 PHE B CG 1 ATOM 4686 C CD1 . PHE B 1 150 ? 36.375 2.202 49.359 1.00 33.53 ? 209 PHE B CD1 1 ATOM 4687 C CD2 . PHE B 1 150 ? 36.001 4.551 49.198 1.00 33.43 ? 209 PHE B CD2 1 ATOM 4688 C CE1 . PHE B 1 150 ? 37.724 2.397 49.128 1.00 33.10 ? 209 PHE B CE1 1 ATOM 4689 C CE2 . PHE B 1 150 ? 37.349 4.754 48.964 1.00 39.76 ? 209 PHE B CE2 1 ATOM 4690 C CZ . PHE B 1 150 ? 38.212 3.675 48.930 1.00 32.84 ? 209 PHE B CZ 1 ATOM 4691 N N . SER B 1 151 ? 34.830 1.391 52.686 1.00 55.41 ? 210 SER B N 1 ATOM 4692 C CA . SER B 1 151 ? 35.264 0.114 53.244 1.00 47.74 ? 210 SER B CA 1 ATOM 4693 C C . SER B 1 151 ? 34.540 -0.205 54.549 1.00 43.94 ? 210 SER B C 1 ATOM 4694 O O . SER B 1 151 ? 34.636 -1.316 55.068 1.00 38.85 ? 210 SER B O 1 ATOM 4695 C CB . SER B 1 151 ? 36.776 0.115 53.477 1.00 55.40 ? 210 SER B CB 1 ATOM 4696 O OG . SER B 1 151 ? 37.482 0.229 52.256 1.00 64.35 ? 210 SER B OG 1 ATOM 4697 N N . ASP B 1 152 ? 33.814 0.778 55.069 1.00 54.96 ? 211 ASP B N 1 ATOM 4698 C CA . ASP B 1 152 ? 33.135 0.639 56.351 1.00 53.27 ? 211 ASP B CA 1 ATOM 4699 C C . ASP B 1 152 ? 31.940 -0.308 56.276 1.00 50.57 ? 211 ASP B C 1 ATOM 4700 O O . ASP B 1 152 ? 31.084 -0.178 55.401 1.00 59.69 ? 211 ASP B O 1 ATOM 4701 C CB . ASP B 1 152 ? 32.680 2.010 56.853 1.00 57.29 ? 211 ASP B CB 1 ATOM 4702 C CG . ASP B 1 152 ? 32.504 2.052 58.356 1.00 60.19 ? 211 ASP B CG 1 ATOM 4703 O OD1 . ASP B 1 152 ? 33.085 1.192 59.049 1.00 56.84 ? 211 ASP B OD1 1 ATOM 4704 O OD2 . ASP B 1 152 ? 31.789 2.952 58.844 1.00 66.01 ? 211 ASP B OD2 1 ATOM 4705 N N . PHE B 1 153 ? 31.891 -1.262 57.201 1.00 52.11 ? 212 PHE B N 1 ATOM 4706 C CA . PHE B 1 153 ? 30.731 -2.133 57.354 1.00 35.79 ? 212 PHE B CA 1 ATOM 4707 C C . PHE B 1 153 ? 29.563 -1.343 57.932 1.00 36.35 ? 212 PHE B C 1 ATOM 4708 O O . PHE B 1 153 ? 29.754 -0.496 58.804 1.00 49.93 ? 212 PHE B O 1 ATOM 4709 C CB . PHE B 1 153 ? 31.062 -3.327 58.252 1.00 39.29 ? 212 PHE B CB 1 ATOM 4710 C CG . PHE B 1 153 ? 31.235 -4.621 57.506 1.00 35.89 ? 212 PHE B CG 1 ATOM 4711 C CD1 . PHE B 1 153 ? 30.476 -4.895 56.381 1.00 54.64 ? 212 PHE B CD1 1 ATOM 4712 C CD2 . PHE B 1 153 ? 32.158 -5.563 57.931 1.00 35.68 ? 212 PHE B CD2 1 ATOM 4713 C CE1 . PHE B 1 153 ? 30.633 -6.086 55.694 1.00 42.42 ? 212 PHE B CE1 1 ATOM 4714 C CE2 . PHE B 1 153 ? 32.320 -6.754 57.249 1.00 35.74 ? 212 PHE B CE2 1 ATOM 4715 C CZ . PHE B 1 153 ? 31.557 -7.016 56.128 1.00 52.04 ? 212 PHE B CZ 1 ATOM 4716 N N . GLU B 1 154 ? 28.357 -1.617 57.445 1.00 36.51 ? 213 GLU B N 1 ATOM 4717 C CA . GLU B 1 154 ? 27.168 -0.938 57.949 1.00 36.83 ? 213 GLU B CA 1 ATOM 4718 C C . GLU B 1 154 ? 26.917 -1.269 59.415 1.00 36.96 ? 213 GLU B C 1 ATOM 4719 O O . GLU B 1 154 ? 27.223 -2.369 59.875 1.00 52.59 ? 213 GLU B O 1 ATOM 4720 C CB . GLU B 1 154 ? 25.937 -1.311 57.120 1.00 37.28 ? 213 GLU B CB 1 ATOM 4721 C CG . GLU B 1 154 ? 25.804 -0.556 55.810 1.00 37.22 ? 213 GLU B CG 1 ATOM 4722 C CD . GLU B 1 154 ? 24.442 -0.748 55.170 1.00 58.34 ? 213 GLU B CD 1 ATOM 4723 O OE1 . GLU B 1 154 ? 23.746 0.261 54.932 1.00 59.94 ? 213 GLU B OE1 1 ATOM 4724 O OE2 . GLU B 1 154 ? 24.068 -1.910 54.901 1.00 66.27 ? 213 GLU B OE2 1 ATOM 4725 N N . ARG B 1 155 ? 26.357 -0.309 60.141 1.00 37.04 ? 214 ARG B N 1 ATOM 4726 C CA . ARG B 1 155 ? 25.938 -0.536 61.517 1.00 37.21 ? 214 ARG B CA 1 ATOM 4727 C C . ARG B 1 155 ? 24.428 -0.368 61.619 1.00 37.69 ? 214 ARG B C 1 ATOM 4728 O O . ARG B 1 155 ? 23.902 0.725 61.402 1.00 41.09 ? 214 ARG B O 1 ATOM 4729 C CB . ARG B 1 155 ? 26.653 0.421 62.474 1.00 36.87 ? 214 ARG B CB 1 ATOM 4730 C CG . ARG B 1 155 ? 28.149 0.164 62.612 1.00 36.41 ? 214 ARG B CG 1 ATOM 4731 C CD . ARG B 1 155 ? 28.858 1.339 63.268 1.00 36.06 ? 214 ARG B CD 1 ATOM 4732 N NE . ARG B 1 155 ? 29.053 2.446 62.336 1.00 42.85 ? 214 ARG B NE 1 ATOM 4733 C CZ . ARG B 1 155 ? 30.022 2.500 61.427 1.00 38.29 ? 214 ARG B CZ 1 ATOM 4734 N NH1 . ARG B 1 155 ? 30.901 1.511 61.328 1.00 41.02 ? 214 ARG B NH1 1 ATOM 4735 N NH2 . ARG B 1 155 ? 30.116 3.548 60.620 1.00 41.52 ? 214 ARG B NH2 1 ATOM 4736 N N . HIS B 1 156 ? 23.734 -1.459 61.932 1.00 38.64 ? 215 HIS B N 1 ATOM 4737 C CA . HIS B 1 156 ? 22.277 -1.453 61.999 1.00 38.56 ? 215 HIS B CA 1 ATOM 4738 C C . HIS B 1 156 ? 21.767 -0.464 63.044 1.00 47.61 ? 215 HIS B C 1 ATOM 4739 O O . HIS B 1 156 ? 20.727 0.166 62.858 1.00 41.55 ? 215 HIS B O 1 ATOM 4740 C CB . HIS B 1 156 ? 21.746 -2.857 62.306 1.00 38.93 ? 215 HIS B CB 1 ATOM 4741 C CG . HIS B 1 156 ? 21.730 -3.190 63.766 1.00 50.61 ? 215 HIS B CG 1 ATOM 4742 N ND1 . HIS B 1 156 ? 22.880 -3.395 64.497 1.00 38.63 ? 215 HIS B ND1 1 ATOM 4743 C CD2 . HIS B 1 156 ? 20.702 -3.339 64.634 1.00 39.38 ? 215 HIS B CD2 1 ATOM 4744 C CE1 . HIS B 1 156 ? 22.561 -3.659 65.751 1.00 38.79 ? 215 HIS B CE1 1 ATOM 4745 N NE2 . HIS B 1 156 ? 21.245 -3.634 65.860 1.00 50.12 ? 215 HIS B NE2 1 ATOM 4746 N N . HIS B 1 157 ? 22.511 -0.324 64.138 1.00 38.35 ? 216 HIS B N 1 ATOM 4747 C CA . HIS B 1 157 ? 22.095 0.543 65.232 1.00 39.39 ? 216 HIS B CA 1 ATOM 4748 C C . HIS B 1 157 ? 22.310 2.012 64.883 1.00 46.54 ? 216 HIS B C 1 ATOM 4749 O O . HIS B 1 157 ? 21.793 2.899 65.560 1.00 57.00 ? 216 HIS B O 1 ATOM 4750 C CB . HIS B 1 157 ? 22.843 0.185 66.520 1.00 38.19 ? 216 HIS B CB 1 ATOM 4751 C CG . HIS B 1 157 ? 24.326 0.363 66.430 1.00 45.54 ? 216 HIS B CG 1 ATOM 4752 N ND1 . HIS B 1 157 ? 25.176 -0.652 66.045 1.00 45.20 ? 216 HIS B ND1 1 ATOM 4753 C CD2 . HIS B 1 157 ? 25.112 1.438 66.677 1.00 37.28 ? 216 HIS B CD2 1 ATOM 4754 C CE1 . HIS B 1 157 ? 26.421 -0.210 66.059 1.00 47.54 ? 216 HIS B CE1 1 ATOM 4755 N NE2 . HIS B 1 157 ? 26.410 1.055 66.438 1.00 39.76 ? 216 HIS B NE2 1 ATOM 4756 N N . ALA B 1 158 ? 23.068 2.266 63.822 1.00 37.82 ? 217 ALA B N 1 ATOM 4757 C CA . ALA B 1 158 ? 23.268 3.626 63.340 1.00 37.58 ? 217 ALA B CA 1 ATOM 4758 C C . ALA B 1 158 ? 22.034 4.098 62.580 1.00 37.91 ? 217 ALA B C 1 ATOM 4759 O O . ALA B 1 158 ? 21.669 5.272 62.639 1.00 53.23 ? 217 ALA B O 1 ATOM 4760 C CB . ALA B 1 158 ? 24.503 3.708 62.459 1.00 41.73 ? 217 ALA B CB 1 ATOM 4761 N N . GLU B 1 159 ? 21.401 3.172 61.866 1.00 39.66 ? 218 GLU B N 1 ATOM 4762 C CA . GLU B 1 159 ? 20.140 3.442 61.184 1.00 44.22 ? 218 GLU B CA 1 ATOM 4763 C C . GLU B 1 159 ? 19.071 3.881 62.178 1.00 38.91 ? 218 GLU B C 1 ATOM 4764 O O . GLU B 1 159 ? 18.348 4.849 61.942 1.00 43.64 ? 218 GLU B O 1 ATOM 4765 C CB . GLU B 1 159 ? 19.665 2.204 60.417 1.00 38.94 ? 218 GLU B CB 1 ATOM 4766 C CG . GLU B 1 159 ? 20.494 1.854 59.185 1.00 44.84 ? 218 GLU B CG 1 ATOM 4767 C CD . GLU B 1 159 ? 20.164 2.710 57.971 1.00 55.03 ? 218 GLU B CD 1 ATOM 4768 O OE1 . GLU B 1 159 ? 19.804 3.894 58.136 1.00 49.49 ? 218 GLU B OE1 1 ATOM 4769 O OE2 . GLU B 1 159 ? 20.268 2.190 56.840 1.00 48.17 ? 218 GLU B OE2 1 ATOM 4770 N N . ILE B 1 160 ? 18.979 3.158 63.289 1.00 41.58 ? 219 ILE B N 1 ATOM 4771 C CA . ILE B 1 160 ? 18.023 3.472 64.344 1.00 39.33 ? 219 ILE B CA 1 ATOM 4772 C C . ILE B 1 160 ? 18.348 4.804 65.015 1.00 49.74 ? 219 ILE B C 1 ATOM 4773 O O . ILE B 1 160 ? 17.490 5.681 65.124 1.00 49.54 ? 219 ILE B O 1 ATOM 4774 C CB . ILE B 1 160 ? 17.988 2.366 65.415 1.00 47.58 ? 219 ILE B CB 1 ATOM 4775 C CG1 . ILE B 1 160 ? 17.509 1.046 64.806 1.00 39.86 ? 219 ILE B CG1 1 ATOM 4776 C CG2 . ILE B 1 160 ? 17.101 2.776 66.582 1.00 39.76 ? 219 ILE B CG2 1 ATOM 4777 C CD1 . ILE B 1 160 ? 17.897 -0.168 65.617 1.00 39.91 ? 219 ILE B CD1 1 ATOM 4778 N N . ALA B 1 161 ? 19.593 4.940 65.464 1.00 38.61 ? 220 ALA B N 1 ATOM 4779 C CA . ALA B 1 161 ? 20.044 6.129 66.183 1.00 41.80 ? 220 ALA B CA 1 ATOM 4780 C C . ALA B 1 161 ? 19.836 7.417 65.390 1.00 38.60 ? 220 ALA B C 1 ATOM 4781 O O . ALA B 1 161 ? 19.447 8.442 65.952 1.00 50.50 ? 220 ALA B O 1 ATOM 4782 C CB . ALA B 1 161 ? 21.507 5.984 66.560 1.00 37.85 ? 220 ALA B CB 1 ATOM 4783 N N . THR B 1 162 ? 20.092 7.364 64.087 1.00 38.10 ? 221 THR B N 1 ATOM 4784 C CA . THR B 1 162 ? 20.026 8.563 63.260 1.00 37.96 ? 221 THR B CA 1 ATOM 4785 C C . THR B 1 162 ? 18.579 8.974 63.020 1.00 44.22 ? 221 THR B C 1 ATOM 4786 O O . THR B 1 162 ? 18.263 10.164 62.973 1.00 57.01 ? 221 THR B O 1 ATOM 4787 C CB . THR B 1 162 ? 20.730 8.361 61.905 1.00 37.76 ? 221 THR B CB 1 ATOM 4788 O OG1 . THR B 1 162 ? 22.061 7.877 62.122 1.00 37.40 ? 221 THR B OG1 1 ATOM 4789 C CG2 . THR B 1 162 ? 20.793 9.675 61.139 1.00 37.56 ? 221 THR B CG2 1 ATOM 4790 N N . PHE B 1 163 ? 17.704 7.984 62.869 1.00 41.53 ? 222 PHE B N 1 ATOM 4791 C CA . PHE B 1 163 ? 16.274 8.241 62.741 1.00 51.68 ? 222 PHE B CA 1 ATOM 4792 C C . PHE B 1 163 ? 15.755 9.029 63.940 1.00 44.64 ? 222 PHE B C 1 ATOM 4793 O O . PHE B 1 163 ? 15.006 9.993 63.786 1.00 53.60 ? 222 PHE B O 1 ATOM 4794 C CB . PHE B 1 163 ? 15.499 6.930 62.597 1.00 39.65 ? 222 PHE B CB 1 ATOM 4795 C CG . PHE B 1 163 ? 14.028 7.066 62.865 1.00 44.29 ? 222 PHE B CG 1 ATOM 4796 C CD1 . PHE B 1 163 ? 13.204 7.721 61.965 1.00 40.29 ? 222 PHE B CD1 1 ATOM 4797 C CD2 . PHE B 1 163 ? 13.467 6.538 64.017 1.00 46.62 ? 222 PHE B CD2 1 ATOM 4798 C CE1 . PHE B 1 163 ? 11.850 7.852 62.210 1.00 40.80 ? 222 PHE B CE1 1 ATOM 4799 C CE2 . PHE B 1 163 ? 12.114 6.662 64.267 1.00 45.10 ? 222 PHE B CE2 1 ATOM 4800 C CZ . PHE B 1 163 ? 11.304 7.320 63.361 1.00 47.98 ? 222 PHE B CZ 1 ATOM 4801 N N . HIS B 1 164 ? 16.157 8.604 65.133 1.00 39.20 ? 223 HIS B N 1 ATOM 4802 C CA . HIS B 1 164 ? 15.787 9.291 66.365 1.00 53.41 ? 223 HIS B CA 1 ATOM 4803 C C . HIS B 1 164 ? 16.377 10.697 66.438 1.00 56.01 ? 223 HIS B C 1 ATOM 4804 O O . HIS B 1 164 ? 15.697 11.638 66.846 1.00 56.83 ? 223 HIS B O 1 ATOM 4805 C CB . HIS B 1 164 ? 16.217 8.472 67.581 1.00 39.21 ? 223 HIS B CB 1 ATOM 4806 C CG . HIS B 1 164 ? 15.330 7.298 67.855 1.00 50.38 ? 223 HIS B CG 1 ATOM 4807 N ND1 . HIS B 1 164 ? 14.488 7.239 68.945 1.00 49.34 ? 223 HIS B ND1 1 ATOM 4808 C CD2 . HIS B 1 164 ? 15.147 6.142 67.176 1.00 52.54 ? 223 HIS B CD2 1 ATOM 4809 C CE1 . HIS B 1 164 ? 13.827 6.096 68.926 1.00 48.77 ? 223 HIS B CE1 1 ATOM 4810 N NE2 . HIS B 1 164 ? 14.210 5.410 67.863 1.00 48.37 ? 223 HIS B NE2 1 ATOM 4811 N N . LEU B 1 165 ? 17.645 10.836 66.060 1.00 46.61 ? 224 LEU B N 1 ATOM 4812 C CA . LEU B 1 165 ? 18.291 12.146 66.053 1.00 49.33 ? 224 LEU B CA 1 ATOM 4813 C C . LEU B 1 165 ? 17.591 13.080 65.073 1.00 53.37 ? 224 LEU B C 1 ATOM 4814 O O . LEU B 1 165 ? 17.472 14.281 65.318 1.00 39.31 ? 224 LEU B O 1 ATOM 4815 C CB . LEU B 1 165 ? 19.773 12.025 65.696 1.00 37.56 ? 224 LEU B CB 1 ATOM 4816 C CG . LEU B 1 165 ? 20.526 13.357 65.626 1.00 52.33 ? 224 LEU B CG 1 ATOM 4817 C CD1 . LEU B 1 165 ? 20.521 14.052 66.979 1.00 37.06 ? 224 LEU B CD1 1 ATOM 4818 C CD2 . LEU B 1 165 ? 21.945 13.161 65.124 1.00 36.74 ? 224 LEU B CD2 1 ATOM 4819 N N . ASP B 1 166 ? 17.120 12.514 63.967 1.00 38.31 ? 225 ASP B N 1 ATOM 4820 C CA . ASP B 1 166 ? 16.388 13.276 62.963 1.00 39.00 ? 225 ASP B CA 1 ATOM 4821 C C . ASP B 1 166 ? 15.090 13.811 63.563 1.00 49.50 ? 225 ASP B C 1 ATOM 4822 O O . ASP B 1 166 ? 14.597 14.867 63.166 1.00 51.76 ? 225 ASP B O 1 ATOM 4823 C CB . ASP B 1 166 ? 16.107 12.409 61.735 1.00 44.48 ? 225 ASP B CB 1 ATOM 4824 C CG . ASP B 1 166 ? 15.307 13.136 60.676 1.00 48.86 ? 225 ASP B CG 1 ATOM 4825 O OD1 . ASP B 1 166 ? 14.064 13.072 60.727 1.00 51.55 ? 225 ASP B OD1 1 ATOM 4826 O OD2 . ASP B 1 166 ? 15.921 13.764 59.788 1.00 39.88 ? 225 ASP B OD2 1 ATOM 4827 N N . ARG B 1 167 ? 14.541 13.068 64.521 1.00 43.10 ? 226 ARG B N 1 ATOM 4828 C CA . ARG B 1 167 ? 13.363 13.505 65.263 1.00 39.94 ? 226 ARG B CA 1 ATOM 4829 C C . ARG B 1 167 ? 13.720 14.601 66.258 1.00 55.29 ? 226 ARG B C 1 ATOM 4830 O O . ARG B 1 167 ? 13.064 15.641 66.317 1.00 54.83 ? 226 ARG B O 1 ATOM 4831 C CB . ARG B 1 167 ? 12.730 12.334 66.014 1.00 45.40 ? 226 ARG B CB 1 ATOM 4832 C CG . ARG B 1 167 ? 11.567 12.738 66.905 1.00 40.04 ? 226 ARG B CG 1 ATOM 4833 C CD . ARG B 1 167 ? 10.877 11.528 67.511 1.00 49.63 ? 226 ARG B CD 1 ATOM 4834 N NE . ARG B 1 167 ? 10.105 10.763 66.537 1.00 54.04 ? 226 ARG B NE 1 ATOM 4835 C CZ . ARG B 1 167 ? 9.469 9.631 66.822 1.00 62.82 ? 226 ARG B CZ 1 ATOM 4836 N NH1 . ARG B 1 167 ? 9.518 9.136 68.050 1.00 53.45 ? 226 ARG B NH1 1 ATOM 4837 N NH2 . ARG B 1 167 ? 8.787 8.992 65.882 1.00 65.19 ? 226 ARG B NH2 1 ATOM 4838 N N . VAL B 1 168 ? 14.763 14.345 67.044 1.00 38.77 ? 227 VAL B N 1 ATOM 4839 C CA . VAL B 1 168 ? 15.217 15.265 68.082 1.00 38.50 ? 227 VAL B CA 1 ATOM 4840 C C . VAL B 1 168 ? 15.578 16.632 67.506 1.00 44.37 ? 227 VAL B C 1 ATOM 4841 O O . VAL B 1 168 ? 15.323 17.666 68.125 1.00 64.39 ? 227 VAL B O 1 ATOM 4842 C CB . VAL B 1 168 ? 16.436 14.684 68.840 1.00 58.51 ? 227 VAL B CB 1 ATOM 4843 C CG1 . VAL B 1 168 ? 17.022 15.708 69.801 1.00 60.37 ? 227 VAL B CG1 1 ATOM 4844 C CG2 . VAL B 1 168 ? 16.039 13.421 69.591 1.00 38.53 ? 227 VAL B CG2 1 ATOM 4845 N N . LEU B 1 169 ? 16.144 16.633 66.304 1.00 39.74 ? 228 LEU B N 1 ATOM 4846 C CA . LEU B 1 169 ? 16.536 17.876 65.652 1.00 45.33 ? 228 LEU B CA 1 ATOM 4847 C C . LEU B 1 169 ? 15.344 18.548 64.978 1.00 41.63 ? 228 LEU B C 1 ATOM 4848 O O . LEU B 1 169 ? 15.449 19.673 64.490 1.00 51.00 ? 228 LEU B O 1 ATOM 4849 C CB . LEU B 1 169 ? 17.645 17.614 64.631 1.00 38.95 ? 228 LEU B CB 1 ATOM 4850 C CG . LEU B 1 169 ? 18.993 17.181 65.216 1.00 44.70 ? 228 LEU B CG 1 ATOM 4851 C CD1 . LEU B 1 169 ? 19.966 16.804 64.110 1.00 43.74 ? 228 LEU B CD1 1 ATOM 4852 C CD2 . LEU B 1 169 ? 19.573 18.274 66.103 1.00 37.59 ? 228 LEU B CD2 1 ATOM 4853 N N . GLY B 1 170 ? 14.210 17.856 64.954 1.00 44.56 ? 229 GLY B N 1 ATOM 4854 C CA . GLY B 1 170 ? 12.984 18.436 64.441 1.00 38.68 ? 229 GLY B CA 1 ATOM 4855 C C . GLY B 1 170 ? 12.897 18.396 62.929 1.00 54.39 ? 229 GLY B C 1 ATOM 4856 O O . GLY B 1 170 ? 12.078 19.091 62.329 1.00 58.82 ? 229 GLY B O 1 ATOM 4857 N N . PHE B 1 171 ? 13.735 17.572 62.310 1.00 52.29 ? 230 PHE B N 1 ATOM 4858 C CA . PHE B 1 171 ? 13.740 17.443 60.857 1.00 53.31 ? 230 PHE B CA 1 ATOM 4859 C C . PHE B 1 171 ? 12.543 16.628 60.374 1.00 48.69 ? 230 PHE B C 1 ATOM 4860 O O . PHE B 1 171 ? 11.807 17.064 59.487 1.00 54.97 ? 230 PHE B O 1 ATOM 4861 C CB . PHE B 1 171 ? 15.046 16.803 60.383 1.00 66.06 ? 230 PHE B CB 1 ATOM 4862 C CG . PHE B 1 171 ? 16.260 17.661 60.608 1.00 63.35 ? 230 PHE B CG 1 ATOM 4863 C CD1 . PHE B 1 171 ? 16.144 19.038 60.713 1.00 47.89 ? 230 PHE B CD1 1 ATOM 4864 C CD2 . PHE B 1 171 ? 17.517 17.088 60.717 1.00 53.98 ? 230 PHE B CD2 1 ATOM 4865 C CE1 . PHE B 1 171 ? 17.260 19.827 60.921 1.00 54.99 ? 230 PHE B CE1 1 ATOM 4866 C CE2 . PHE B 1 171 ? 18.636 17.874 60.925 1.00 51.09 ? 230 PHE B CE2 1 ATOM 4867 C CZ . PHE B 1 171 ? 18.507 19.244 61.027 1.00 53.12 ? 230 PHE B CZ 1 ATOM 4868 N N . ARG B 1 172 ? 12.360 15.454 60.971 1.00 61.88 ? 231 ARG B N 1 ATOM 4869 C CA . ARG B 1 172 ? 11.292 14.530 60.600 1.00 50.51 ? 231 ARG B CA 1 ATOM 4870 C C . ARG B 1 172 ? 11.281 14.205 59.111 1.00 51.68 ? 231 ARG B C 1 ATOM 4871 O O . ARG B 1 172 ? 10.220 14.121 58.490 1.00 41.85 ? 231 ARG B O 1 ATOM 4872 C CB . ARG B 1 172 ? 9.940 15.111 61.017 1.00 54.62 ? 231 ARG B CB 1 ATOM 4873 C CG . ARG B 1 172 ? 9.665 15.010 62.498 1.00 59.96 ? 231 ARG B CG 1 ATOM 4874 C CD . ARG B 1 172 ? 8.418 15.778 62.878 1.00 53.11 ? 231 ARG B CD 1 ATOM 4875 N NE . ARG B 1 172 ? 8.496 16.244 64.256 1.00 58.32 ? 231 ARG B NE 1 ATOM 4876 C CZ . ARG B 1 172 ? 8.178 15.491 65.303 1.00 57.05 ? 231 ARG B CZ 1 ATOM 4877 N NH1 . ARG B 1 172 ? 7.751 14.248 65.115 1.00 56.60 ? 231 ARG B NH1 1 ATOM 4878 N NH2 . ARG B 1 172 ? 8.283 15.976 66.534 1.00 63.20 ? 231 ARG B NH2 1 ATOM 4879 N N . ARG B 1 173 ? 12.468 14.029 58.541 1.00 43.26 ? 232 ARG B N 1 ATOM 4880 C CA . ARG B 1 173 ? 12.588 13.671 57.134 1.00 47.29 ? 232 ARG B CA 1 ATOM 4881 C C . ARG B 1 173 ? 13.293 12.331 56.968 1.00 55.66 ? 232 ARG B C 1 ATOM 4882 O O . ARG B 1 173 ? 13.714 11.972 55.869 1.00 39.47 ? 232 ARG B O 1 ATOM 4883 C CB . ARG B 1 173 ? 13.325 14.764 56.356 1.00 54.92 ? 232 ARG B CB 1 ATOM 4884 C CG . ARG B 1 173 ? 12.686 16.140 56.477 1.00 54.38 ? 232 ARG B CG 1 ATOM 4885 C CD . ARG B 1 173 ? 13.057 17.039 55.308 1.00 45.00 ? 232 ARG B CD 1 ATOM 4886 N NE . ARG B 1 173 ? 14.459 17.441 55.332 1.00 51.05 ? 232 ARG B NE 1 ATOM 4887 C CZ . ARG B 1 173 ? 14.955 18.394 56.114 1.00 54.51 ? 232 ARG B CZ 1 ATOM 4888 N NH1 . ARG B 1 173 ? 14.163 19.054 56.949 1.00 52.38 ? 232 ARG B NH1 1 ATOM 4889 N NH2 . ARG B 1 173 ? 16.247 18.689 56.061 1.00 65.80 ? 232 ARG B NH2 1 ATOM 4890 N N . ALA B 1 174 ? 13.418 11.595 58.068 1.00 39.62 ? 233 ALA B N 1 ATOM 4891 C CA . ALA B 1 174 ? 14.004 10.262 58.025 1.00 48.41 ? 233 ALA B CA 1 ATOM 4892 C C . ALA B 1 174 ? 12.922 9.193 57.927 1.00 46.36 ? 233 ALA B C 1 ATOM 4893 O O . ALA B 1 174 ? 11.740 9.468 58.133 1.00 57.80 ? 233 ALA B O 1 ATOM 4894 C CB . ALA B 1 174 ? 14.876 10.023 59.247 1.00 39.39 ? 233 ALA B CB 1 ATOM 4895 N N . ILE B 1 175 ? 13.338 7.972 57.615 1.00 48.61 ? 234 ILE B N 1 ATOM 4896 C CA . ILE B 1 175 ? 12.411 6.863 57.438 1.00 40.69 ? 234 ILE B CA 1 ATOM 4897 C C . ILE B 1 175 ? 12.349 6.014 58.702 1.00 45.53 ? 234 ILE B C 1 ATOM 4898 O O . ILE B 1 175 ? 13.387 5.609 59.226 1.00 47.48 ? 234 ILE B O 1 ATOM 4899 C CB . ILE B 1 175 ? 12.819 5.990 56.237 1.00 40.68 ? 234 ILE B CB 1 ATOM 4900 C CG1 . ILE B 1 175 ? 12.986 6.863 54.992 1.00 44.22 ? 234 ILE B CG1 1 ATOM 4901 C CG2 . ILE B 1 175 ? 11.797 4.892 55.991 1.00 41.20 ? 234 ILE B CG2 1 ATOM 4902 C CD1 . ILE B 1 175 ? 13.348 6.090 53.754 1.00 51.32 ? 234 ILE B CD1 1 ATOM 4903 N N . PRO B 1 176 ? 11.127 5.755 59.200 1.00 57.35 ? 235 PRO B N 1 ATOM 4904 C CA . PRO B 1 176 ? 10.883 4.987 60.428 1.00 45.48 ? 235 PRO B CA 1 ATOM 4905 C C . PRO B 1 176 ? 11.685 3.691 60.512 1.00 62.60 ? 235 PRO B C 1 ATOM 4906 O O . PRO B 1 176 ? 11.577 2.825 59.643 1.00 58.75 ? 235 PRO B O 1 ATOM 4907 C CB . PRO B 1 176 ? 9.385 4.692 60.357 1.00 42.07 ? 235 PRO B CB 1 ATOM 4908 C CG . PRO B 1 176 ? 8.823 5.849 59.615 1.00 45.82 ? 235 PRO B CG 1 ATOM 4909 C CD . PRO B 1 176 ? 9.874 6.278 58.624 1.00 41.64 ? 235 PRO B CD 1 ATOM 4910 N N . THR B 1 177 ? 12.487 3.577 61.564 1.00 41.18 ? 236 THR B N 1 ATOM 4911 C CA . THR B 1 177 ? 13.355 2.426 61.759 1.00 41.06 ? 236 THR B CA 1 ATOM 4912 C C . THR B 1 177 ? 13.307 1.989 63.217 1.00 50.16 ? 236 THR B C 1 ATOM 4913 O O . THR B 1 177 ? 13.387 2.818 64.124 1.00 52.26 ? 236 THR B O 1 ATOM 4914 C CB . THR B 1 177 ? 14.813 2.742 61.361 1.00 46.71 ? 236 THR B CB 1 ATOM 4915 O OG1 . THR B 1 177 ? 14.844 3.267 60.028 1.00 45.99 ? 236 THR B OG1 1 ATOM 4916 C CG2 . THR B 1 177 ? 15.676 1.490 61.428 1.00 40.40 ? 236 THR B CG2 1 ATOM 4917 N N . VAL B 1 178 ? 13.163 0.687 63.438 1.00 41.41 ? 237 VAL B N 1 ATOM 4918 C CA . VAL B 1 178 ? 13.081 0.153 64.789 1.00 41.53 ? 237 VAL B CA 1 ATOM 4919 C C . VAL B 1 178 ? 14.009 -1.050 64.946 1.00 41.39 ? 237 VAL B C 1 ATOM 4920 O O . VAL B 1 178 ? 14.328 -1.732 63.970 1.00 43.75 ? 237 VAL B O 1 ATOM 4921 C CB . VAL B 1 178 ? 11.628 -0.249 65.147 1.00 49.96 ? 237 VAL B CB 1 ATOM 4922 C CG1 . VAL B 1 178 ? 11.251 -1.570 64.488 1.00 42.45 ? 237 VAL B CG1 1 ATOM 4923 C CG2 . VAL B 1 178 ? 11.443 -0.328 66.657 1.00 42.20 ? 237 VAL B CG2 1 ATOM 4924 N N . GLY B 1 179 ? 14.457 -1.295 66.172 1.00 43.54 ? 238 GLY B N 1 ATOM 4925 C CA . GLY B 1 179 ? 15.233 -2.484 66.463 1.00 41.19 ? 238 GLY B CA 1 ATOM 4926 C C . GLY B 1 179 ? 14.332 -3.691 66.616 1.00 49.79 ? 238 GLY B C 1 ATOM 4927 O O . GLY B 1 179 ? 13.176 -3.568 67.023 1.00 42.10 ? 238 GLY B O 1 ATOM 4928 N N . ARG B 1 180 ? 14.862 -4.864 66.289 1.00 44.82 ? 239 ARG B N 1 ATOM 4929 C CA . ARG B 1 180 ? 14.105 -6.102 66.412 1.00 44.56 ? 239 ARG B CA 1 ATOM 4930 C C . ARG B 1 180 ? 15.037 -7.303 66.522 1.00 52.21 ? 239 ARG B C 1 ATOM 4931 O O . ARG B 1 180 ? 15.936 -7.483 65.700 1.00 44.47 ? 239 ARG B O 1 ATOM 4932 C CB . ARG B 1 180 ? 13.159 -6.278 65.223 1.00 42.52 ? 239 ARG B CB 1 ATOM 4933 C CG . ARG B 1 180 ? 12.247 -7.491 65.330 1.00 43.05 ? 239 ARG B CG 1 ATOM 4934 C CD . ARG B 1 180 ? 11.331 -7.612 64.120 1.00 43.40 ? 239 ARG B CD 1 ATOM 4935 N NE . ARG B 1 180 ? 10.528 -8.831 64.169 1.00 53.36 ? 239 ARG B NE 1 ATOM 4936 C CZ . ARG B 1 180 ? 9.309 -8.947 63.650 1.00 44.38 ? 239 ARG B CZ 1 ATOM 4937 N NH1 . ARG B 1 180 ? 8.744 -7.915 63.039 1.00 49.24 ? 239 ARG B NH1 1 ATOM 4938 N NH2 . ARG B 1 180 ? 8.655 -10.096 63.742 1.00 44.83 ? 239 ARG B NH2 1 ATOM 4939 N N . VAL B 1 181 ? 14.820 -8.117 67.548 1.00 42.21 ? 240 VAL B N 1 ATOM 4940 C CA . VAL B 1 181 ? 15.580 -9.346 67.728 1.00 42.12 ? 240 VAL B CA 1 ATOM 4941 C C . VAL B 1 181 ? 14.832 -10.509 67.090 1.00 42.57 ? 240 VAL B C 1 ATOM 4942 O O . VAL B 1 181 ? 13.720 -10.840 67.500 1.00 54.29 ? 240 VAL B O 1 ATOM 4943 C CB . VAL B 1 181 ? 15.835 -9.646 69.215 1.00 42.09 ? 240 VAL B CB 1 ATOM 4944 C CG1 . VAL B 1 181 ? 16.665 -10.910 69.365 1.00 41.98 ? 240 VAL B CG1 1 ATOM 4945 C CG2 . VAL B 1 181 ? 16.526 -8.466 69.882 1.00 41.67 ? 240 VAL B CG2 1 ATOM 4946 N N . LEU B 1 182 ? 15.445 -11.128 66.087 1.00 49.08 ? 241 LEU B N 1 ATOM 4947 C CA . LEU B 1 182 ? 14.779 -12.180 65.328 1.00 42.83 ? 241 LEU B CA 1 ATOM 4948 C C . LEU B 1 182 ? 15.242 -13.569 65.741 1.00 42.87 ? 241 LEU B C 1 ATOM 4949 O O . LEU B 1 182 ? 16.407 -13.777 66.079 1.00 64.47 ? 241 LEU B O 1 ATOM 4950 C CB . LEU B 1 182 ? 15.019 -12.000 63.821 1.00 42.69 ? 241 LEU B CB 1 ATOM 4951 C CG . LEU B 1 182 ? 14.338 -10.893 63.005 1.00 42.77 ? 241 LEU B CG 1 ATOM 4952 C CD1 . LEU B 1 182 ? 12.824 -11.067 63.009 1.00 55.23 ? 241 LEU B CD1 1 ATOM 4953 C CD2 . LEU B 1 182 ? 14.725 -9.494 63.465 1.00 52.38 ? 241 LEU B CD2 1 ATOM 4954 N N . ASN B 1 183 ? 14.312 -14.517 65.710 1.00 43.78 ? 242 ASN B N 1 ATOM 4955 C CA . ASN B 1 183 ? 14.647 -15.927 65.819 1.00 43.46 ? 242 ASN B CA 1 ATOM 4956 C C . ASN B 1 183 ? 15.113 -16.412 64.455 1.00 43.33 ? 242 ASN B C 1 ATOM 4957 O O . ASN B 1 183 ? 14.308 -16.554 63.533 1.00 49.21 ? 242 ASN B O 1 ATOM 4958 C CB . ASN B 1 183 ? 13.447 -16.740 66.312 1.00 44.06 ? 242 ASN B CB 1 ATOM 4959 C CG . ASN B 1 183 ? 13.771 -18.213 66.507 1.00 55.00 ? 242 ASN B CG 1 ATOM 4960 O OD1 . ASN B 1 183 ? 13.989 -18.943 65.542 1.00 62.92 ? 242 ASN B OD1 1 ATOM 4961 N ND2 . ASN B 1 183 ? 13.791 -18.659 67.760 1.00 50.68 ? 242 ASN B ND2 1 HETATM 4962 N N . MSE B 1 184 ? 16.415 -16.646 64.325 1.00 42.86 ? 243 MSE B N 1 HETATM 4963 C CA . MSE B 1 184 ? 17.007 -17.013 63.042 1.00 67.14 ? 243 MSE B CA 1 HETATM 4964 C C . MSE B 1 184 ? 16.415 -18.301 62.483 1.00 62.87 ? 243 MSE B C 1 HETATM 4965 O O . MSE B 1 184 ? 16.362 -18.490 61.269 1.00 48.50 ? 243 MSE B O 1 HETATM 4966 C CB . MSE B 1 184 ? 18.524 -17.154 63.177 1.00 42.09 ? 243 MSE B CB 1 HETATM 4967 C CG . MSE B 1 184 ? 19.228 -15.879 63.604 1.00 54.98 ? 243 MSE B CG 1 HETATM 4968 SE SE . MSE B 1 184 ? 21.161 -16.098 63.724 1.00 71.21 ? 243 MSE B SE 1 HETATM 4969 C CE . MSE B 1 184 ? 21.532 -16.495 61.853 1.00 50.14 ? 243 MSE B CE 1 ATOM 4970 N N . THR B 1 185 ? 15.964 -19.182 63.369 1.00 43.40 ? 244 THR B N 1 ATOM 4971 C CA . THR B 1 185 ? 15.394 -20.452 62.943 1.00 44.61 ? 244 THR B CA 1 ATOM 4972 C C . THR B 1 185 ? 13.990 -20.276 62.365 1.00 48.45 ? 244 THR B C 1 ATOM 4973 O O . THR B 1 185 ? 13.719 -20.698 61.242 1.00 51.47 ? 244 THR B O 1 ATOM 4974 C CB . THR B 1 185 ? 15.337 -21.461 64.108 1.00 44.00 ? 244 THR B CB 1 ATOM 4975 O OG1 . THR B 1 185 ? 16.648 -21.632 64.662 1.00 43.51 ? 244 THR B OG1 1 ATOM 4976 C CG2 . THR B 1 185 ? 14.813 -22.804 63.627 1.00 44.41 ? 244 THR B CG2 1 ATOM 4977 N N . THR B 1 186 ? 13.106 -19.643 63.130 1.00 44.61 ? 245 THR B N 1 ATOM 4978 C CA . THR B 1 186 ? 11.700 -19.539 62.743 1.00 53.21 ? 245 THR B CA 1 ATOM 4979 C C . THR B 1 186 ? 11.389 -18.336 61.853 1.00 45.08 ? 245 THR B C 1 ATOM 4980 O O . THR B 1 186 ? 10.580 -18.436 60.930 1.00 54.77 ? 245 THR B O 1 ATOM 4981 C CB . THR B 1 186 ? 10.785 -19.468 63.982 1.00 45.54 ? 245 THR B CB 1 ATOM 4982 O OG1 . THR B 1 186 ? 11.141 -18.334 64.781 1.00 45.25 ? 245 THR B OG1 1 ATOM 4983 C CG2 . THR B 1 186 ? 10.912 -20.735 64.813 1.00 45.70 ? 245 THR B CG2 1 ATOM 4984 N N . GLU B 1 187 ? 12.027 -17.202 62.126 1.00 50.45 ? 246 GLU B N 1 ATOM 4985 C CA . GLU B 1 187 ? 11.688 -15.963 61.429 1.00 44.58 ? 246 GLU B CA 1 ATOM 4986 C C . GLU B 1 187 ? 12.593 -15.666 60.237 1.00 44.16 ? 246 GLU B C 1 ATOM 4987 O O . GLU B 1 187 ? 12.219 -14.900 59.349 1.00 63.50 ? 246 GLU B O 1 ATOM 4988 C CB . GLU B 1 187 ? 11.727 -14.780 62.400 1.00 44.38 ? 246 GLU B CB 1 ATOM 4989 C CG . GLU B 1 187 ? 10.698 -14.849 63.513 1.00 44.81 ? 246 GLU B CG 1 ATOM 4990 C CD . GLU B 1 187 ? 10.758 -13.644 64.432 1.00 52.40 ? 246 GLU B CD 1 ATOM 4991 O OE1 . GLU B 1 187 ? 9.835 -12.803 64.373 1.00 46.58 ? 246 GLU B OE1 1 ATOM 4992 O OE2 . GLU B 1 187 ? 11.726 -13.537 65.212 1.00 44.22 ? 246 GLU B OE2 1 ATOM 4993 N N . LEU B 1 188 ? 13.778 -16.263 60.214 1.00 45.13 ? 247 LEU B N 1 ATOM 4994 C CA . LEU B 1 188 ? 14.706 -16.027 59.114 1.00 43.37 ? 247 LEU B CA 1 ATOM 4995 C C . LEU B 1 188 ? 14.854 -17.252 58.220 1.00 45.28 ? 247 LEU B C 1 ATOM 4996 O O . LEU B 1 188 ? 14.439 -17.228 57.063 1.00 46.52 ? 247 LEU B O 1 ATOM 4997 C CB . LEU B 1 188 ? 16.073 -15.594 59.650 1.00 42.77 ? 247 LEU B CB 1 ATOM 4998 C CG . LEU B 1 188 ? 16.128 -14.191 60.261 1.00 42.55 ? 247 LEU B CG 1 ATOM 4999 C CD1 . LEU B 1 188 ? 17.564 -13.769 60.524 1.00 41.94 ? 247 LEU B CD1 1 ATOM 5000 C CD2 . LEU B 1 188 ? 15.428 -13.185 59.358 1.00 42.66 ? 247 LEU B CD2 1 ATOM 5001 N N . PHE B 1 189 ? 15.440 -18.317 58.760 1.00 46.59 ? 248 PHE B N 1 ATOM 5002 C CA . PHE B 1 189 ? 15.700 -19.535 57.994 1.00 46.78 ? 248 PHE B CA 1 ATOM 5003 C C . PHE B 1 189 ? 14.446 -20.133 57.358 1.00 49.87 ? 248 PHE B C 1 ATOM 5004 O O . PHE B 1 189 ? 14.390 -20.320 56.144 1.00 46.82 ? 248 PHE B O 1 ATOM 5005 C CB . PHE B 1 189 ? 16.367 -20.587 58.881 1.00 44.34 ? 248 PHE B CB 1 ATOM 5006 C CG . PHE B 1 189 ? 16.674 -21.873 58.168 1.00 43.43 ? 248 PHE B CG 1 ATOM 5007 C CD1 . PHE B 1 189 ? 17.685 -21.933 57.222 1.00 43.42 ? 248 PHE B CD1 1 ATOM 5008 C CD2 . PHE B 1 189 ? 15.949 -23.021 58.441 1.00 43.90 ? 248 PHE B CD2 1 ATOM 5009 C CE1 . PHE B 1 189 ? 17.969 -23.115 56.564 1.00 43.06 ? 248 PHE B CE1 1 ATOM 5010 C CE2 . PHE B 1 189 ? 16.228 -24.206 57.785 1.00 43.95 ? 248 PHE B CE2 1 ATOM 5011 C CZ . PHE B 1 189 ? 17.238 -24.253 56.846 1.00 43.53 ? 248 PHE B CZ 1 ATOM 5012 N N . GLU B 1 190 ? 13.445 -20.425 58.182 1.00 48.43 ? 249 GLU B N 1 ATOM 5013 C CA . GLU B 1 190 ? 12.233 -21.092 57.714 1.00 48.59 ? 249 GLU B CA 1 ATOM 5014 C C . GLU B 1 190 ? 11.365 -20.201 56.826 1.00 54.38 ? 249 GLU B C 1 ATOM 5015 O O . GLU B 1 190 ? 10.526 -20.695 56.074 1.00 50.12 ? 249 GLU B O 1 ATOM 5016 C CB . GLU B 1 190 ? 11.416 -21.593 58.907 1.00 51.37 ? 249 GLU B CB 1 ATOM 5017 C CG . GLU B 1 190 ? 12.010 -22.818 59.587 1.00 48.91 ? 249 GLU B CG 1 ATOM 5018 C CD . GLU B 1 190 ? 11.401 -23.087 60.948 1.00 56.73 ? 249 GLU B CD 1 ATOM 5019 O OE1 . GLU B 1 190 ? 10.485 -22.339 61.349 1.00 63.95 ? 249 GLU B OE1 1 ATOM 5020 O OE2 . GLU B 1 190 ? 11.841 -24.044 61.619 1.00 56.80 ? 249 GLU B OE2 1 ATOM 5021 N N . LYS B 1 191 ? 11.570 -18.890 56.914 1.00 45.04 ? 250 LYS B N 1 ATOM 5022 C CA . LYS B 1 191 ? 10.804 -17.942 56.110 1.00 45.19 ? 250 LYS B CA 1 ATOM 5023 C C . LYS B 1 191 ? 11.578 -17.455 54.888 1.00 44.79 ? 250 LYS B C 1 ATOM 5024 O O . LYS B 1 191 ? 11.087 -16.617 54.130 1.00 48.09 ? 250 LYS B O 1 ATOM 5025 C CB . LYS B 1 191 ? 10.378 -16.744 56.963 1.00 45.18 ? 250 LYS B CB 1 ATOM 5026 C CG . LYS B 1 191 ? 9.489 -17.103 58.141 1.00 45.61 ? 250 LYS B CG 1 ATOM 5027 C CD . LYS B 1 191 ? 8.203 -17.768 57.672 1.00 57.07 ? 250 LYS B CD 1 ATOM 5028 C CE . LYS B 1 191 ? 7.327 -18.180 58.843 1.00 49.51 ? 250 LYS B CE 1 ATOM 5029 N NZ . LYS B 1 191 ? 6.048 -18.791 58.387 1.00 54.65 ? 250 LYS B NZ 1 ATOM 5030 N N . ALA B 1 192 ? 12.783 -17.983 54.696 1.00 44.38 ? 251 ALA B N 1 ATOM 5031 C CA . ALA B 1 192 ? 13.673 -17.492 53.648 1.00 58.53 ? 251 ALA B CA 1 ATOM 5032 C C . ALA B 1 192 ? 13.408 -18.153 52.301 1.00 44.14 ? 251 ALA B C 1 ATOM 5033 O O . ALA B 1 192 ? 13.005 -19.314 52.233 1.00 44.48 ? 251 ALA B O 1 ATOM 5034 C CB . ALA B 1 192 ? 15.128 -17.702 54.049 1.00 43.40 ? 251 ALA B CB 1 ATOM 5035 N N . GLU B 1 193 ? 13.632 -17.397 51.230 1.00 55.05 ? 252 GLU B N 1 ATOM 5036 C CA . GLU B 1 193 ? 13.579 -17.941 49.880 1.00 44.02 ? 252 GLU B CA 1 ATOM 5037 C C . GLU B 1 193 ? 14.665 -18.999 49.699 1.00 56.46 ? 252 GLU B C 1 ATOM 5038 O O . GLU B 1 193 ? 15.632 -19.039 50.461 1.00 54.49 ? 252 GLU B O 1 ATOM 5039 C CB . GLU B 1 193 ? 13.725 -16.823 48.846 1.00 43.79 ? 252 GLU B CB 1 ATOM 5040 C CG . GLU B 1 193 ? 15.058 -16.098 48.893 1.00 49.96 ? 252 GLU B CG 1 ATOM 5041 C CD . GLU B 1 193 ? 15.213 -15.097 47.765 1.00 58.35 ? 252 GLU B CD 1 ATOM 5042 O OE1 . GLU B 1 193 ? 14.747 -15.386 46.642 1.00 57.49 ? 252 GLU B OE1 1 ATOM 5043 O OE2 . GLU B 1 193 ? 15.798 -14.019 48.002 1.00 49.84 ? 252 GLU B OE2 1 ATOM 5044 N N . LYS B 1 194 ? 14.497 -19.849 48.689 1.00 63.93 ? 253 LYS B N 1 ATOM 5045 C CA . LYS B 1 194 ? 15.364 -21.011 48.490 1.00 54.76 ? 253 LYS B CA 1 ATOM 5046 C C . LYS B 1 194 ? 16.849 -20.659 48.365 1.00 59.55 ? 253 LYS B C 1 ATOM 5047 O O . LYS B 1 194 ? 17.692 -21.297 48.996 1.00 58.27 ? 253 LYS B O 1 ATOM 5048 C CB . LYS B 1 194 ? 14.906 -21.794 47.256 1.00 68.40 ? 253 LYS B CB 1 ATOM 5049 C CG . LYS B 1 194 ? 15.766 -23.002 46.920 1.00 86.91 ? 253 LYS B CG 1 ATOM 5050 C CD . LYS B 1 194 ? 15.511 -23.487 45.500 1.00 94.47 ? 253 LYS B CD 1 ATOM 5051 C CE . LYS B 1 194 ? 16.019 -22.496 44.464 1.00 97.86 ? 253 LYS B CE 1 ATOM 5052 N NZ . LYS B 1 194 ? 17.479 -22.240 44.589 1.00 92.29 ? 253 LYS B NZ 1 ATOM 5053 N N . LYS B 1 195 ? 17.172 -19.652 47.558 1.00 60.56 ? 254 LYS B N 1 ATOM 5054 C CA . LYS B 1 195 ? 18.572 -19.291 47.343 1.00 56.22 ? 254 LYS B CA 1 ATOM 5055 C C . LYS B 1 195 ? 19.204 -18.693 48.601 1.00 57.53 ? 254 LYS B C 1 ATOM 5056 O O . LYS B 1 195 ? 20.410 -18.814 48.812 1.00 56.77 ? 254 LYS B O 1 ATOM 5057 C CB . LYS B 1 195 ? 18.716 -18.314 46.169 1.00 54.68 ? 254 LYS B CB 1 ATOM 5058 C CG . LYS B 1 195 ? 18.044 -16.965 46.367 1.00 73.68 ? 254 LYS B CG 1 ATOM 5059 C CD . LYS B 1 195 ? 18.480 -15.985 45.286 1.00 69.60 ? 254 LYS B CD 1 ATOM 5060 C CE . LYS B 1 195 ? 17.704 -14.681 45.364 1.00 79.28 ? 254 LYS B CE 1 ATOM 5061 N NZ . LYS B 1 195 ? 18.186 -13.688 44.364 1.00 88.15 ? 254 LYS B NZ 1 ATOM 5062 N N . LEU B 1 196 ? 18.387 -18.054 49.433 1.00 51.88 ? 255 LEU B N 1 ATOM 5063 C CA . LEU B 1 196 ? 18.855 -17.512 50.706 1.00 46.13 ? 255 LEU B CA 1 ATOM 5064 C C . LEU B 1 196 ? 18.938 -18.604 51.769 1.00 42.00 ? 255 LEU B C 1 ATOM 5065 O O . LEU B 1 196 ? 19.848 -18.607 52.599 1.00 43.27 ? 255 LEU B O 1 ATOM 5066 C CB . LEU B 1 196 ? 17.937 -16.384 51.184 1.00 50.90 ? 255 LEU B CB 1 ATOM 5067 C CG . LEU B 1 196 ? 18.214 -15.844 52.589 1.00 41.91 ? 255 LEU B CG 1 ATOM 5068 C CD1 . LEU B 1 196 ? 19.635 -15.313 52.694 1.00 41.29 ? 255 LEU B CD1 1 ATOM 5069 C CD2 . LEU B 1 196 ? 17.205 -14.775 52.970 1.00 43.30 ? 255 LEU B CD2 1 ATOM 5070 N N . LYS B 1 197 ? 17.983 -19.528 51.728 1.00 42.50 ? 256 LYS B N 1 ATOM 5071 C CA . LYS B 1 197 ? 17.893 -20.611 52.703 1.00 42.70 ? 256 LYS B CA 1 ATOM 5072 C C . LYS B 1 197 ? 19.158 -21.461 52.723 1.00 47.47 ? 256 LYS B C 1 ATOM 5073 O O . LYS B 1 197 ? 19.610 -21.900 53.780 1.00 50.70 ? 256 LYS B O 1 ATOM 5074 C CB . LYS B 1 197 ? 16.686 -21.503 52.389 1.00 43.46 ? 256 LYS B CB 1 ATOM 5075 C CG . LYS B 1 197 ? 16.180 -22.345 53.553 1.00 54.34 ? 256 LYS B CG 1 ATOM 5076 C CD . LYS B 1 197 ? 14.880 -23.061 53.192 1.00 61.53 ? 256 LYS B CD 1 ATOM 5077 C CE . LYS B 1 197 ? 13.714 -22.624 54.067 1.00 59.54 ? 256 LYS B CE 1 ATOM 5078 N NZ . LYS B 1 197 ? 13.210 -21.268 53.707 1.00 77.97 ? 256 LYS B NZ 1 ATOM 5079 N N . LYS B 1 198 ? 19.719 -21.688 51.540 1.00 47.40 ? 257 LYS B N 1 ATOM 5080 C CA . LYS B 1 198 ? 20.879 -22.560 51.379 1.00 46.62 ? 257 LYS B CA 1 ATOM 5081 C C . LYS B 1 198 ? 22.189 -21.941 51.858 1.00 42.35 ? 257 LYS B C 1 ATOM 5082 O O . LYS B 1 198 ? 23.195 -22.638 51.983 1.00 43.36 ? 257 LYS B O 1 ATOM 5083 C CB . LYS B 1 198 ? 21.009 -22.986 49.917 1.00 41.74 ? 257 LYS B CB 1 ATOM 5084 C CG . LYS B 1 198 ? 19.844 -23.838 49.450 1.00 66.50 ? 257 LYS B CG 1 ATOM 5085 C CD . LYS B 1 198 ? 19.663 -25.046 50.355 1.00 83.74 ? 257 LYS B CD 1 ATOM 5086 C CE . LYS B 1 198 ? 18.264 -25.625 50.228 1.00 87.50 ? 257 LYS B CE 1 ATOM 5087 N NZ . LYS B 1 198 ? 18.038 -26.731 51.197 1.00 89.51 ? 257 LYS B NZ 1 ATOM 5088 N N . THR B 1 199 ? 22.184 -20.638 52.117 1.00 48.45 ? 258 THR B N 1 ATOM 5089 C CA . THR B 1 199 ? 23.397 -19.955 52.554 1.00 42.25 ? 258 THR B CA 1 ATOM 5090 C C . THR B 1 199 ? 23.520 -19.981 54.074 1.00 41.75 ? 258 THR B C 1 ATOM 5091 O O . THR B 1 199 ? 24.381 -19.316 54.648 1.00 46.75 ? 258 THR B O 1 ATOM 5092 C CB . THR B 1 199 ? 23.438 -18.492 52.069 1.00 40.23 ? 258 THR B CB 1 ATOM 5093 O OG1 . THR B 1 199 ? 22.430 -17.732 52.746 1.00 56.13 ? 258 THR B OG1 1 ATOM 5094 C CG2 . THR B 1 199 ? 23.200 -18.419 50.569 1.00 40.30 ? 258 THR B CG2 1 ATOM 5095 N N . PHE B 1 200 ? 22.650 -20.752 54.719 1.00 44.70 ? 259 PHE B N 1 ATOM 5096 C CA . PHE B 1 200 ? 22.692 -20.915 56.167 1.00 40.88 ? 259 PHE B CA 1 ATOM 5097 C C . PHE B 1 200 ? 23.587 -22.088 56.553 1.00 48.53 ? 259 PHE B C 1 ATOM 5098 O O . PHE B 1 200 ? 23.708 -23.059 55.805 1.00 47.52 ? 259 PHE B O 1 ATOM 5099 C CB . PHE B 1 200 ? 21.282 -21.121 56.728 1.00 41.47 ? 259 PHE B CB 1 ATOM 5100 C CG . PHE B 1 200 ? 20.514 -19.844 56.931 1.00 41.60 ? 259 PHE B CG 1 ATOM 5101 C CD1 . PHE B 1 200 ? 19.943 -19.181 55.857 1.00 41.89 ? 259 PHE B CD1 1 ATOM 5102 C CD2 . PHE B 1 200 ? 20.348 -19.318 58.202 1.00 41.61 ? 259 PHE B CD2 1 ATOM 5103 C CE1 . PHE B 1 200 ? 19.231 -18.009 56.046 1.00 41.84 ? 259 PHE B CE1 1 ATOM 5104 C CE2 . PHE B 1 200 ? 19.636 -18.149 58.397 1.00 47.90 ? 259 PHE B CE2 1 ATOM 5105 C CZ . PHE B 1 200 ? 19.077 -17.494 57.318 1.00 41.85 ? 259 PHE B CZ 1 ATOM 5106 N N . PHE B 1 201 ? 24.209 -21.994 57.725 1.00 46.27 ? 260 PHE B N 1 ATOM 5107 C CA . PHE B 1 201 ? 25.092 -23.047 58.218 1.00 40.23 ? 260 PHE B CA 1 ATOM 5108 C C . PHE B 1 201 ? 25.393 -22.855 59.701 1.00 42.59 ? 260 PHE B C 1 ATOM 5109 O O . PHE B 1 201 ? 25.021 -21.841 60.292 1.00 40.46 ? 260 PHE B O 1 ATOM 5110 C CB . PHE B 1 201 ? 26.398 -23.074 57.418 1.00 39.71 ? 260 PHE B CB 1 ATOM 5111 C CG . PHE B 1 201 ? 27.265 -21.864 57.629 1.00 43.08 ? 260 PHE B CG 1 ATOM 5112 C CD1 . PHE B 1 201 ? 27.033 -20.696 56.921 1.00 39.18 ? 260 PHE B CD1 1 ATOM 5113 C CD2 . PHE B 1 201 ? 28.321 -21.898 58.526 1.00 40.28 ? 260 PHE B CD2 1 ATOM 5114 C CE1 . PHE B 1 201 ? 27.830 -19.584 57.113 1.00 39.91 ? 260 PHE B CE1 1 ATOM 5115 C CE2 . PHE B 1 201 ? 29.122 -20.789 58.721 1.00 42.62 ? 260 PHE B CE2 1 ATOM 5116 C CZ . PHE B 1 201 ? 28.876 -19.630 58.013 1.00 41.95 ? 260 PHE B CZ 1 ATOM 5117 N N . PHE B 1 202 ? 26.072 -23.831 60.296 1.00 43.04 ? 261 PHE B N 1 ATOM 5118 C CA . PHE B 1 202 ? 26.497 -23.722 61.687 1.00 39.82 ? 261 PHE B CA 1 ATOM 5119 C C . PHE B 1 202 ? 28.003 -23.517 61.795 1.00 39.21 ? 261 PHE B C 1 ATOM 5120 O O . PHE B 1 202 ? 28.788 -24.239 61.179 1.00 44.66 ? 261 PHE B O 1 ATOM 5121 C CB . PHE B 1 202 ? 26.082 -24.965 62.478 1.00 40.15 ? 261 PHE B CB 1 ATOM 5122 C CG . PHE B 1 202 ? 24.611 -25.035 62.770 1.00 40.75 ? 261 PHE B CG 1 ATOM 5123 C CD1 . PHE B 1 202 ? 24.100 -24.500 63.941 1.00 41.88 ? 261 PHE B CD1 1 ATOM 5124 C CD2 . PHE B 1 202 ? 23.740 -25.637 61.877 1.00 41.16 ? 261 PHE B CD2 1 ATOM 5125 C CE1 . PHE B 1 202 ? 22.748 -24.562 64.216 1.00 41.46 ? 261 PHE B CE1 1 ATOM 5126 C CE2 . PHE B 1 202 ? 22.386 -25.702 62.147 1.00 41.72 ? 261 PHE B CE2 1 ATOM 5127 C CZ . PHE B 1 202 ? 21.890 -25.163 63.318 1.00 41.87 ? 261 PHE B CZ 1 ATOM 5128 N N . SER B 1 203 ? 28.396 -22.522 62.583 1.00 38.96 ? 262 SER B N 1 ATOM 5129 C CA . SER B 1 203 ? 29.803 -22.236 62.833 1.00 38.39 ? 262 SER B CA 1 ATOM 5130 C C . SER B 1 203 ? 30.411 -23.324 63.720 1.00 38.30 ? 262 SER B C 1 ATOM 5131 O O . SER B 1 203 ? 29.676 -24.105 64.327 1.00 44.59 ? 262 SER B O 1 ATOM 5132 C CB . SER B 1 203 ? 29.950 -20.855 63.481 1.00 38.20 ? 262 SER B CB 1 ATOM 5133 O OG . SER B 1 203 ? 29.733 -20.916 64.879 1.00 40.79 ? 262 SER B OG 1 ATOM 5134 N N . PRO B 1 204 ? 31.753 -23.395 63.789 1.00 45.93 ? 263 PRO B N 1 ATOM 5135 C CA . PRO B 1 204 ? 32.397 -24.348 64.702 1.00 41.60 ? 263 PRO B CA 1 ATOM 5136 C C . PRO B 1 204 ? 31.994 -24.139 66.164 1.00 43.09 ? 263 PRO B C 1 ATOM 5137 O O . PRO B 1 204 ? 32.109 -25.063 66.971 1.00 51.85 ? 263 PRO B O 1 ATOM 5138 C CB . PRO B 1 204 ? 33.891 -24.066 64.508 1.00 37.07 ? 263 PRO B CB 1 ATOM 5139 C CG . PRO B 1 204 ? 33.992 -23.511 63.139 1.00 44.32 ? 263 PRO B CG 1 ATOM 5140 C CD . PRO B 1 204 ? 32.733 -22.727 62.912 1.00 42.15 ? 263 PRO B CD 1 ATOM 5141 N N . ALA B 1 205 ? 31.521 -22.939 66.488 1.00 37.89 ? 264 ALA B N 1 ATOM 5142 C CA . ALA B 1 205 ? 31.074 -22.609 67.839 1.00 38.05 ? 264 ALA B CA 1 ATOM 5143 C C . ALA B 1 205 ? 29.604 -22.965 68.048 1.00 38.66 ? 264 ALA B C 1 ATOM 5144 O O . ALA B 1 205 ? 29.006 -22.600 69.062 1.00 47.01 ? 264 ALA B O 1 ATOM 5145 C CB . ALA B 1 205 ? 31.305 -21.134 68.125 1.00 37.81 ? 264 ALA B CB 1 ATOM 5146 N N . LYS B 1 206 ? 29.035 -23.651 67.059 1.00 38.93 ? 265 LYS B N 1 ATOM 5147 C CA . LYS B 1 206 ? 27.661 -24.153 67.085 1.00 46.97 ? 265 LYS B CA 1 ATOM 5148 C C . LYS B 1 206 ? 26.649 -23.009 67.034 1.00 57.59 ? 265 LYS B C 1 ATOM 5149 O O . LYS B 1 206 ? 25.492 -23.165 67.422 1.00 50.93 ? 265 LYS B O 1 ATOM 5150 C CB . LYS B 1 206 ? 27.454 -25.036 68.318 1.00 39.74 ? 265 LYS B CB 1 ATOM 5151 C CG . LYS B 1 206 ? 28.215 -26.344 68.166 1.00 41.67 ? 265 LYS B CG 1 ATOM 5152 C CD . LYS B 1 206 ? 27.537 -27.303 67.205 1.00 56.26 ? 265 LYS B CD 1 ATOM 5153 C CE . LYS B 1 206 ? 27.944 -28.749 67.489 1.00 73.89 ? 265 LYS B CE 1 ATOM 5154 N NZ . LYS B 1 206 ? 27.653 -29.249 68.859 1.00 71.99 ? 265 LYS B NZ 1 ATOM 5155 N N . ASN B 1 207 ? 27.099 -21.859 66.539 1.00 46.06 ? 266 ASN B N 1 ATOM 5156 C CA . ASN B 1 207 ? 26.218 -20.725 66.286 1.00 39.65 ? 266 ASN B CA 1 ATOM 5157 C C . ASN B 1 207 ? 25.550 -20.809 64.916 1.00 41.44 ? 266 ASN B C 1 ATOM 5158 O O . ASN B 1 207 ? 26.140 -21.312 63.959 1.00 43.33 ? 266 ASN B O 1 ATOM 5159 C CB . ASN B 1 207 ? 26.997 -19.414 66.400 1.00 39.20 ? 266 ASN B CB 1 ATOM 5160 C CG . ASN B 1 207 ? 27.511 -19.163 67.801 1.00 40.73 ? 266 ASN B CG 1 ATOM 5161 O OD1 . ASN B 1 207 ? 26.812 -19.406 68.784 1.00 44.98 ? 266 ASN B OD1 1 ATOM 5162 N ND2 . ASN B 1 207 ? 28.741 -18.671 67.901 1.00 38.48 ? 266 ASN B ND2 1 ATOM 5163 N N . PHE B 1 208 ? 24.319 -20.314 64.824 1.00 42.83 ? 267 PHE B N 1 ATOM 5164 C CA . PHE B 1 208 ? 23.592 -20.322 63.559 1.00 40.56 ? 267 PHE B CA 1 ATOM 5165 C C . PHE B 1 208 ? 24.020 -19.124 62.718 1.00 41.05 ? 267 PHE B C 1 ATOM 5166 O O . PHE B 1 208 ? 24.079 -17.998 63.214 1.00 41.97 ? 267 PHE B O 1 ATOM 5167 C CB . PHE B 1 208 ? 22.081 -20.303 63.796 1.00 41.15 ? 267 PHE B CB 1 ATOM 5168 C CG . PHE B 1 208 ? 21.282 -20.859 62.652 1.00 44.12 ? 267 PHE B CG 1 ATOM 5169 C CD1 . PHE B 1 208 ? 21.823 -21.822 61.816 1.00 41.42 ? 267 PHE B CD1 1 ATOM 5170 C CD2 . PHE B 1 208 ? 19.989 -20.421 62.412 1.00 48.04 ? 267 PHE B CD2 1 ATOM 5171 C CE1 . PHE B 1 208 ? 21.093 -22.337 60.762 1.00 41.76 ? 267 PHE B CE1 1 ATOM 5172 C CE2 . PHE B 1 208 ? 19.253 -20.933 61.359 1.00 42.31 ? 267 PHE B CE2 1 ATOM 5173 C CZ . PHE B 1 208 ? 19.806 -21.892 60.533 1.00 42.21 ? 267 PHE B CZ 1 ATOM 5174 N N . CYS B 1 209 ? 24.322 -19.368 61.447 1.00 40.13 ? 268 CYS B N 1 ATOM 5175 C CA . CYS B 1 209 ? 24.894 -18.332 60.590 1.00 49.82 ? 268 CYS B CA 1 ATOM 5176 C C . CYS B 1 209 ? 24.312 -18.361 59.183 1.00 39.97 ? 268 CYS B C 1 ATOM 5177 O O . CYS B 1 209 ? 23.868 -19.406 58.711 1.00 40.28 ? 268 CYS B O 1 ATOM 5178 C CB . CYS B 1 209 ? 26.416 -18.482 60.512 1.00 39.20 ? 268 CYS B CB 1 ATOM 5179 S SG . CYS B 1 209 ? 27.277 -18.371 62.097 1.00 40.25 ? 268 CYS B SG 1 ATOM 5180 N N . PHE B 1 210 ? 24.306 -17.208 58.519 1.00 39.82 ? 269 PHE B N 1 ATOM 5181 C CA . PHE B 1 210 ? 23.951 -17.154 57.106 1.00 39.93 ? 269 PHE B CA 1 ATOM 5182 C C . PHE B 1 210 ? 24.934 -16.282 56.330 1.00 39.44 ? 269 PHE B C 1 ATOM 5183 O O . PHE B 1 210 ? 25.455 -15.295 56.848 1.00 39.13 ? 269 PHE B O 1 ATOM 5184 C CB . PHE B 1 210 ? 22.511 -16.651 56.909 1.00 40.41 ? 269 PHE B CB 1 ATOM 5185 C CG . PHE B 1 210 ? 22.266 -15.245 57.398 1.00 40.33 ? 269 PHE B CG 1 ATOM 5186 C CD1 . PHE B 1 210 ? 22.577 -14.149 56.606 1.00 40.06 ? 269 PHE B CD1 1 ATOM 5187 C CD2 . PHE B 1 210 ? 21.691 -15.022 58.638 1.00 42.32 ? 269 PHE B CD2 1 ATOM 5188 C CE1 . PHE B 1 210 ? 22.343 -12.862 57.054 1.00 39.98 ? 269 PHE B CE1 1 ATOM 5189 C CE2 . PHE B 1 210 ? 21.451 -13.736 59.089 1.00 40.45 ? 269 PHE B CE2 1 ATOM 5190 C CZ . PHE B 1 210 ? 21.775 -12.656 58.294 1.00 40.18 ? 269 PHE B CZ 1 ATOM 5191 N N . VAL B 1 211 ? 25.182 -16.666 55.083 1.00 49.04 ? 270 VAL B N 1 ATOM 5192 C CA . VAL B 1 211 ? 26.096 -15.942 54.212 1.00 38.94 ? 270 VAL B CA 1 ATOM 5193 C C . VAL B 1 211 ? 25.323 -14.934 53.371 1.00 39.10 ? 270 VAL B C 1 ATOM 5194 O O . VAL B 1 211 ? 25.800 -13.826 53.111 1.00 45.99 ? 270 VAL B O 1 ATOM 5195 C CB . VAL B 1 211 ? 26.872 -16.905 53.286 1.00 52.37 ? 270 VAL B CB 1 ATOM 5196 C CG1 . VAL B 1 211 ? 27.687 -16.136 52.258 1.00 38.35 ? 270 VAL B CG1 1 ATOM 5197 C CG2 . VAL B 1 211 ? 27.765 -17.822 54.104 1.00 38.53 ? 270 VAL B CG2 1 ATOM 5198 N N . SER B 1 212 ? 24.121 -15.335 52.962 1.00 42.96 ? 271 SER B N 1 ATOM 5199 C CA . SER B 1 212 ? 23.283 -14.566 52.044 1.00 39.80 ? 271 SER B CA 1 ATOM 5200 C C . SER B 1 212 ? 24.000 -14.353 50.714 1.00 44.66 ? 271 SER B C 1 ATOM 5201 O O . SER B 1 212 ? 24.994 -15.016 50.420 1.00 47.72 ? 271 SER B O 1 ATOM 5202 C CB . SER B 1 212 ? 22.882 -13.221 52.659 1.00 39.79 ? 271 SER B CB 1 ATOM 5203 O OG . SER B 1 212 ? 21.964 -12.531 51.830 1.00 43.19 ? 271 SER B OG 1 ATOM 5204 N N . ARG B 1 213 ? 23.488 -13.431 49.909 1.00 48.10 ? 272 ARG B N 1 ATOM 5205 C CA . ARG B 1 213 ? 24.124 -13.095 48.641 1.00 39.28 ? 272 ARG B CA 1 ATOM 5206 C C . ARG B 1 213 ? 24.142 -11.593 48.413 1.00 39.09 ? 272 ARG B C 1 ATOM 5207 O O . ARG B 1 213 ? 23.102 -10.935 48.459 1.00 59.22 ? 272 ARG B O 1 ATOM 5208 C CB . ARG B 1 213 ? 23.411 -13.785 47.475 1.00 39.62 ? 272 ARG B CB 1 ATOM 5209 C CG . ARG B 1 213 ? 23.522 -15.299 47.467 1.00 70.09 ? 272 ARG B CG 1 ATOM 5210 C CD . ARG B 1 213 ? 22.622 -15.902 46.403 1.00 91.67 ? 272 ARG B CD 1 ATOM 5211 N NE . ARG B 1 213 ? 23.035 -15.509 45.058 1.00 97.03 ? 272 ARG B NE 1 ATOM 5212 C CZ . ARG B 1 213 ? 23.837 -16.230 44.281 1.00 92.52 ? 272 ARG B CZ 1 ATOM 5213 N NH1 . ARG B 1 213 ? 24.321 -17.386 44.713 1.00 97.20 ? 272 ARG B NH1 1 ATOM 5214 N NH2 . ARG B 1 213 ? 24.158 -15.791 43.071 1.00 82.52 ? 272 ARG B NH2 1 ATOM 5215 N N . CYS B 1 214 ? 25.332 -11.059 48.165 1.00 41.35 ? 273 CYS B N 1 ATOM 5216 C CA . CYS B 1 214 ? 25.498 -9.642 47.883 1.00 38.36 ? 273 CYS B CA 1 ATOM 5217 C C . CYS B 1 214 ? 26.890 -9.383 47.322 1.00 48.11 ? 273 CYS B C 1 ATOM 5218 O O . CYS B 1 214 ? 27.726 -10.286 47.269 1.00 57.41 ? 273 CYS B O 1 ATOM 5219 C CB . CYS B 1 214 ? 25.270 -8.802 49.140 1.00 38.35 ? 273 CYS B CB 1 ATOM 5220 S SG . CYS B 1 214 ? 26.601 -8.891 50.356 1.00 42.64 ? 273 CYS B SG 1 ATOM 5221 N N . ASP B 1 215 ? 27.135 -8.145 46.909 1.00 47.31 ? 274 ASP B N 1 ATOM 5222 C CA . ASP B 1 215 ? 28.405 -7.782 46.297 1.00 55.58 ? 274 ASP B CA 1 ATOM 5223 C C . ASP B 1 215 ? 29.502 -7.557 47.333 1.00 36.72 ? 274 ASP B C 1 ATOM 5224 O O . ASP B 1 215 ? 30.675 -7.816 47.070 1.00 46.14 ? 274 ASP B O 1 ATOM 5225 C CB . ASP B 1 215 ? 28.237 -6.530 45.435 1.00 70.99 ? 274 ASP B CB 1 ATOM 5226 C CG . ASP B 1 215 ? 27.350 -6.770 44.228 1.00 78.40 ? 274 ASP B CG 1 ATOM 5227 O OD1 . ASP B 1 215 ? 27.269 -7.930 43.772 1.00 60.29 ? 274 ASP B OD1 1 ATOM 5228 O OD2 . ASP B 1 215 ? 26.732 -5.801 43.740 1.00 83.36 ? 274 ASP B OD2 1 ATOM 5229 N N . TYR B 1 216 ? 29.119 -7.072 48.509 1.00 45.02 ? 275 TYR B N 1 ATOM 5230 C CA . TYR B 1 216 ? 30.099 -6.650 49.503 1.00 38.24 ? 275 TYR B CA 1 ATOM 5231 C C . TYR B 1 216 ? 30.257 -7.649 50.649 1.00 39.19 ? 275 TYR B C 1 ATOM 5232 O O . TYR B 1 216 ? 29.597 -7.537 51.682 1.00 39.35 ? 275 TYR B O 1 ATOM 5233 C CB . TYR B 1 216 ? 29.723 -5.276 50.059 1.00 46.97 ? 275 TYR B CB 1 ATOM 5234 C CG . TYR B 1 216 ? 30.839 -4.600 50.822 1.00 74.28 ? 275 TYR B CG 1 ATOM 5235 C CD1 . TYR B 1 216 ? 30.920 -4.700 52.204 1.00 82.33 ? 275 TYR B CD1 1 ATOM 5236 C CD2 . TYR B 1 216 ? 31.821 -3.875 50.159 1.00 82.83 ? 275 TYR B CD2 1 ATOM 5237 C CE1 . TYR B 1 216 ? 31.937 -4.088 52.907 1.00 77.46 ? 275 TYR B CE1 1 ATOM 5238 C CE2 . TYR B 1 216 ? 32.845 -3.258 50.855 1.00 73.67 ? 275 TYR B CE2 1 ATOM 5239 C CZ . TYR B 1 216 ? 32.896 -3.371 52.230 1.00 76.64 ? 275 TYR B CZ 1 ATOM 5240 O OH . TYR B 1 216 ? 33.911 -2.765 52.932 1.00 79.28 ? 275 TYR B OH 1 ATOM 5241 N N . TYR B 1 217 ? 31.132 -8.629 50.439 1.00 44.96 ? 276 TYR B N 1 ATOM 5242 C CA . TYR B 1 217 ? 31.562 -9.559 51.485 1.00 36.24 ? 276 TYR B CA 1 ATOM 5243 C C . TYR B 1 217 ? 30.441 -10.407 52.078 1.00 55.10 ? 276 TYR B C 1 ATOM 5244 O O . TYR B 1 217 ? 30.460 -10.727 53.267 1.00 36.76 ? 276 TYR B O 1 ATOM 5245 C CB . TYR B 1 217 ? 32.283 -8.801 52.603 1.00 35.92 ? 276 TYR B CB 1 ATOM 5246 C CG . TYR B 1 217 ? 33.599 -8.208 52.161 1.00 54.81 ? 276 TYR B CG 1 ATOM 5247 C CD1 . TYR B 1 217 ? 34.659 -9.027 51.796 1.00 35.13 ? 276 TYR B CD1 1 ATOM 5248 C CD2 . TYR B 1 217 ? 33.783 -6.833 52.106 1.00 35.22 ? 276 TYR B CD2 1 ATOM 5249 C CE1 . TYR B 1 217 ? 35.865 -8.495 51.388 1.00 52.53 ? 276 TYR B CE1 1 ATOM 5250 C CE2 . TYR B 1 217 ? 34.986 -6.291 51.701 1.00 43.07 ? 276 TYR B CE2 1 ATOM 5251 C CZ . TYR B 1 217 ? 36.024 -7.127 51.343 1.00 45.20 ? 276 TYR B CZ 1 ATOM 5252 O OH . TYR B 1 217 ? 37.224 -6.592 50.938 1.00 47.84 ? 276 TYR B OH 1 ATOM 5253 N N . CYS B 1 218 ? 29.471 -10.775 51.250 1.00 37.10 ? 277 CYS B N 1 ATOM 5254 C CA . CYS B 1 218 ? 28.584 -11.872 51.601 1.00 37.54 ? 277 CYS B CA 1 ATOM 5255 C C . CYS B 1 218 ? 29.322 -13.177 51.340 1.00 45.67 ? 277 CYS B C 1 ATOM 5256 O O . CYS B 1 218 ? 29.088 -13.851 50.336 1.00 49.76 ? 277 CYS B O 1 ATOM 5257 C CB . CYS B 1 218 ? 27.275 -11.820 50.813 1.00 38.00 ? 277 CYS B CB 1 ATOM 5258 S SG . CYS B 1 218 ? 26.111 -10.566 51.388 1.00 38.27 ? 277 CYS B SG 1 ATOM 5259 N N . ASP B 1 219 ? 30.231 -13.514 52.250 1.00 37.13 ? 278 ASP B N 1 ATOM 5260 C CA . ASP B 1 219 ? 31.002 -14.745 52.159 1.00 36.98 ? 278 ASP B CA 1 ATOM 5261 C C . ASP B 1 219 ? 31.070 -15.429 53.520 1.00 37.04 ? 278 ASP B C 1 ATOM 5262 O O . ASP B 1 219 ? 30.581 -14.893 54.515 1.00 66.98 ? 278 ASP B O 1 ATOM 5263 C CB . ASP B 1 219 ? 32.409 -14.463 51.619 1.00 36.44 ? 278 ASP B CB 1 ATOM 5264 C CG . ASP B 1 219 ? 33.116 -13.340 52.363 1.00 42.18 ? 278 ASP B CG 1 ATOM 5265 O OD1 . ASP B 1 219 ? 32.981 -13.250 53.601 1.00 46.45 ? 278 ASP B OD1 1 ATOM 5266 O OD2 . ASP B 1 219 ? 33.817 -12.545 51.703 1.00 42.19 ? 278 ASP B OD2 1 ATOM 5267 N N . THR B 1 220 ? 31.671 -16.612 53.551 1.00 42.50 ? 279 THR B N 1 ATOM 5268 C CA . THR B 1 220 ? 31.757 -17.414 54.767 1.00 37.02 ? 279 THR B CA 1 ATOM 5269 C C . THR B 1 220 ? 32.449 -16.668 55.907 1.00 52.39 ? 279 THR B C 1 ATOM 5270 O O . THR B 1 220 ? 31.985 -16.691 57.048 1.00 49.59 ? 279 THR B O 1 ATOM 5271 C CB . THR B 1 220 ? 32.502 -18.737 54.509 1.00 42.23 ? 279 THR B CB 1 ATOM 5272 O OG1 . THR B 1 220 ? 31.867 -19.444 53.436 1.00 37.17 ? 279 THR B OG1 1 ATOM 5273 C CG2 . THR B 1 220 ? 32.496 -19.609 55.756 1.00 36.98 ? 279 THR B CG2 1 ATOM 5274 N N . THR B 1 221 ? 33.558 -16.009 55.587 1.00 36.23 ? 280 THR B N 1 ATOM 5275 C CA . THR B 1 221 ? 34.352 -15.289 56.578 1.00 38.04 ? 280 THR B CA 1 ATOM 5276 C C . THR B 1 221 ? 33.559 -14.184 57.278 1.00 39.76 ? 280 THR B C 1 ATOM 5277 O O . THR B 1 221 ? 33.711 -13.967 58.481 1.00 42.23 ? 280 THR B O 1 ATOM 5278 C CB . THR B 1 221 ? 35.611 -14.670 55.932 1.00 48.41 ? 280 THR B CB 1 ATOM 5279 O OG1 . THR B 1 221 ? 36.383 -15.701 55.306 1.00 38.83 ? 280 THR B OG1 1 ATOM 5280 C CG2 . THR B 1 221 ? 36.468 -13.964 56.974 1.00 35.03 ? 280 THR B CG2 1 ATOM 5281 N N . HIS B 1 222 ? 32.702 -13.499 56.529 1.00 37.72 ? 281 HIS B N 1 ATOM 5282 C CA . HIS B 1 222 ? 31.936 -12.383 57.079 1.00 36.46 ? 281 HIS B CA 1 ATOM 5283 C C . HIS B 1 222 ? 30.461 -12.721 57.254 1.00 37.02 ? 281 HIS B C 1 ATOM 5284 O O . HIS B 1 222 ? 29.604 -11.840 57.190 1.00 38.76 ? 281 HIS B O 1 ATOM 5285 C CB . HIS B 1 222 ? 32.079 -11.146 56.191 1.00 36.27 ? 281 HIS B CB 1 ATOM 5286 C CG . HIS B 1 222 ? 33.495 -10.696 56.006 1.00 39.17 ? 281 HIS B CG 1 ATOM 5287 N ND1 . HIS B 1 222 ? 34.318 -11.211 55.028 1.00 35.49 ? 281 HIS B ND1 1 ATOM 5288 C CD2 . HIS B 1 222 ? 34.234 -9.782 56.676 1.00 35.39 ? 281 HIS B CD2 1 ATOM 5289 C CE1 . HIS B 1 222 ? 35.503 -10.631 55.102 1.00 41.59 ? 281 HIS B CE1 1 ATOM 5290 N NE2 . HIS B 1 222 ? 35.478 -9.760 56.095 1.00 52.42 ? 281 HIS B NE2 1 ATOM 5291 N N . ALA B 1 223 ? 30.170 -13.999 57.475 1.00 37.26 ? 282 ALA B N 1 ATOM 5292 C CA . ALA B 1 223 ? 28.799 -14.442 57.701 1.00 37.81 ? 282 ALA B CA 1 ATOM 5293 C C . ALA B 1 223 ? 28.210 -13.805 58.956 1.00 37.97 ? 282 ALA B C 1 ATOM 5294 O O . ALA B 1 223 ? 28.930 -13.500 59.905 1.00 40.09 ? 282 ALA B O 1 ATOM 5295 C CB . ALA B 1 223 ? 28.744 -15.958 57.804 1.00 38.00 ? 282 ALA B CB 1 ATOM 5296 N N . ILE B 1 224 ? 26.897 -13.606 58.950 1.00 40.20 ? 283 ILE B N 1 ATOM 5297 C CA . ILE B 1 224 ? 26.193 -13.087 60.116 1.00 38.63 ? 283 ILE B CA 1 ATOM 5298 C C . ILE B 1 224 ? 25.815 -14.238 61.041 1.00 38.92 ? 283 ILE B C 1 ATOM 5299 O O . ILE B 1 224 ? 25.188 -15.201 60.609 1.00 43.19 ? 283 ILE B O 1 ATOM 5300 C CB . ILE B 1 224 ? 24.928 -12.312 59.707 1.00 38.99 ? 283 ILE B CB 1 ATOM 5301 C CG1 . ILE B 1 224 ? 25.300 -11.068 58.896 1.00 38.70 ? 283 ILE B CG1 1 ATOM 5302 C CG2 . ILE B 1 224 ? 24.108 -11.942 60.928 1.00 39.26 ? 283 ILE B CG2 1 ATOM 5303 C CD1 . ILE B 1 224 ? 26.125 -10.060 59.664 1.00 39.91 ? 283 ILE B CD1 1 ATOM 5304 N N . CYS B 1 225 ? 26.189 -14.135 62.313 1.00 40.10 ? 284 CYS B N 1 ATOM 5305 C CA . CYS B 1 225 ? 26.030 -15.254 63.237 1.00 39.00 ? 284 CYS B CA 1 ATOM 5306 C C . CYS B 1 225 ? 25.340 -14.852 64.535 1.00 39.22 ? 284 CYS B C 1 ATOM 5307 O O . CYS B 1 225 ? 25.601 -13.782 65.086 1.00 39.00 ? 284 CYS B O 1 ATOM 5308 C CB . CYS B 1 225 ? 27.393 -15.872 63.558 1.00 38.57 ? 284 CYS B CB 1 ATOM 5309 S SG . CYS B 1 225 ? 28.251 -16.587 62.138 1.00 38.32 ? 284 CYS B SG 1 ATOM 5310 N N . GLY B 1 226 ? 24.464 -15.725 65.021 1.00 39.67 ? 285 GLY B N 1 ATOM 5311 C CA . GLY B 1 226 ? 23.781 -15.500 66.280 1.00 39.91 ? 285 GLY B CA 1 ATOM 5312 C C . GLY B 1 226 ? 24.583 -16.061 67.435 1.00 49.04 ? 285 GLY B C 1 ATOM 5313 O O . GLY B 1 226 ? 25.702 -16.539 67.245 1.00 41.28 ? 285 GLY B O 1 ATOM 5314 N N . LEU B 1 227 ? 24.019 -16.002 68.637 1.00 39.93 ? 286 LEU B N 1 ATOM 5315 C CA . LEU B 1 227 ? 24.678 -16.567 69.811 1.00 41.96 ? 286 LEU B CA 1 ATOM 5316 C C . LEU B 1 227 ? 23.704 -17.306 70.732 1.00 42.71 ? 286 LEU B C 1 ATOM 5317 O O . LEU B 1 227 ? 23.438 -16.852 71.844 1.00 50.89 ? 286 LEU B O 1 ATOM 5318 C CB . LEU B 1 227 ? 25.406 -15.469 70.588 1.00 46.46 ? 286 LEU B CB 1 ATOM 5319 C CG . LEU B 1 227 ? 26.605 -15.930 71.420 1.00 48.28 ? 286 LEU B CG 1 ATOM 5320 C CD1 . LEU B 1 227 ? 27.572 -16.729 70.563 1.00 38.74 ? 286 LEU B CD1 1 ATOM 5321 C CD2 . LEU B 1 227 ? 27.313 -14.741 72.046 1.00 46.35 ? 286 LEU B CD2 1 ATOM 5322 N N . PRO B 1 228 ? 23.184 -18.459 70.280 1.00 40.60 ? 287 PRO B N 1 ATOM 5323 C CA . PRO B 1 228 ? 23.515 -19.092 69.000 1.00 40.53 ? 287 PRO B CA 1 ATOM 5324 C C . PRO B 1 228 ? 22.514 -18.816 67.876 1.00 49.06 ? 287 PRO B C 1 ATOM 5325 O O . PRO B 1 228 ? 22.900 -18.870 66.708 1.00 47.39 ? 287 PRO B O 1 ATOM 5326 C CB . PRO B 1 228 ? 23.512 -20.577 69.356 1.00 40.73 ? 287 PRO B CB 1 ATOM 5327 C CG . PRO B 1 228 ? 22.430 -20.681 70.379 1.00 41.19 ? 287 PRO B CG 1 ATOM 5328 C CD . PRO B 1 228 ? 22.474 -19.391 71.175 1.00 41.01 ? 287 PRO B CD 1 ATOM 5329 N N . ASP B 1 229 ? 21.260 -18.522 68.213 1.00 41.30 ? 288 ASP B N 1 ATOM 5330 C CA . ASP B 1 229 ? 20.196 -18.515 67.211 1.00 41.70 ? 288 ASP B CA 1 ATOM 5331 C C . ASP B 1 229 ? 19.349 -17.244 67.182 1.00 41.85 ? 288 ASP B C 1 ATOM 5332 O O . ASP B 1 229 ? 18.364 -17.174 66.447 1.00 51.52 ? 288 ASP B O 1 ATOM 5333 C CB . ASP B 1 229 ? 19.279 -19.721 67.428 1.00 42.23 ? 288 ASP B CB 1 ATOM 5334 C CG . ASP B 1 229 ? 18.627 -19.717 68.797 1.00 46.57 ? 288 ASP B CG 1 ATOM 5335 O OD1 . ASP B 1 229 ? 19.174 -19.069 69.714 1.00 51.24 ? 288 ASP B OD1 1 ATOM 5336 O OD2 . ASP B 1 229 ? 17.568 -20.361 68.958 1.00 59.71 ? 288 ASP B OD2 1 HETATM 5337 N N . MSE B 1 230 ? 19.714 -16.245 67.978 1.00 45.50 ? 289 MSE B N 1 HETATM 5338 C CA . MSE B 1 230 ? 19.011 -14.968 67.925 1.00 41.66 ? 289 MSE B CA 1 HETATM 5339 C C . MSE B 1 230 ? 19.871 -13.935 67.210 1.00 61.85 ? 289 MSE B C 1 HETATM 5340 O O . MSE B 1 230 ? 21.100 -14.013 67.234 1.00 53.38 ? 289 MSE B O 1 HETATM 5341 C CB . MSE B 1 230 ? 18.636 -14.479 69.328 1.00 41.76 ? 289 MSE B CB 1 HETATM 5342 C CG . MSE B 1 230 ? 19.746 -13.758 70.077 1.00 41.25 ? 289 MSE B CG 1 HETATM 5343 SE SE . MSE B 1 230 ? 21.246 -14.917 70.510 1.00 83.39 ? 289 MSE B SE 1 HETATM 5344 C CE . MSE B 1 230 ? 20.257 -16.357 71.379 1.00 41.45 ? 289 MSE B CE 1 ATOM 5345 N N . LYS B 1 231 ? 19.223 -12.975 66.562 1.00 47.69 ? 290 LYS B N 1 ATOM 5346 C CA . LYS B 1 231 ? 19.943 -11.946 65.827 1.00 40.86 ? 290 LYS B CA 1 ATOM 5347 C C . LYS B 1 231 ? 19.188 -10.626 65.804 1.00 40.95 ? 290 LYS B C 1 ATOM 5348 O O . LYS B 1 231 ? 18.125 -10.514 65.193 1.00 42.46 ? 290 LYS B O 1 ATOM 5349 C CB . LYS B 1 231 ? 20.222 -12.411 64.396 1.00 40.80 ? 290 LYS B CB 1 ATOM 5350 C CG . LYS B 1 231 ? 20.843 -11.350 63.496 1.00 40.41 ? 290 LYS B CG 1 ATOM 5351 C CD . LYS B 1 231 ? 22.130 -10.778 64.081 1.00 46.66 ? 290 LYS B CD 1 ATOM 5352 C CE . LYS B 1 231 ? 23.161 -11.861 64.348 1.00 39.64 ? 290 LYS B CE 1 ATOM 5353 N NZ . LYS B 1 231 ? 24.492 -11.282 64.677 1.00 39.09 ? 290 LYS B NZ 1 ATOM 5354 N N . GLU B 1 232 ? 19.748 -9.628 66.479 1.00 45.95 ? 291 GLU B N 1 ATOM 5355 C CA . GLU B 1 232 ? 19.195 -8.283 66.452 1.00 40.62 ? 291 GLU B CA 1 ATOM 5356 C C . GLU B 1 232 ? 19.440 -7.676 65.077 1.00 40.43 ? 291 GLU B C 1 ATOM 5357 O O . GLU B 1 232 ? 20.397 -8.036 64.395 1.00 57.31 ? 291 GLU B O 1 ATOM 5358 C CB . GLU B 1 232 ? 19.822 -7.415 67.548 1.00 40.29 ? 291 GLU B CB 1 ATOM 5359 C CG . GLU B 1 232 ? 19.307 -5.982 67.598 1.00 40.27 ? 291 GLU B CG 1 ATOM 5360 C CD . GLU B 1 232 ? 19.929 -5.170 68.715 1.00 41.18 ? 291 GLU B CD 1 ATOM 5361 O OE1 . GLU B 1 232 ? 19.941 -5.648 69.868 1.00 54.53 ? 291 GLU B OE1 1 ATOM 5362 O OE2 . GLU B 1 232 ? 20.411 -4.051 68.438 1.00 40.91 ? 291 GLU B OE2 1 ATOM 5363 N N . GLY B 1 233 ? 18.568 -6.765 64.667 1.00 40.61 ? 292 GLY B N 1 ATOM 5364 C CA . GLY B 1 233 ? 18.767 -6.038 63.431 1.00 41.39 ? 292 GLY B CA 1 ATOM 5365 C C . GLY B 1 233 ? 17.935 -4.777 63.404 1.00 40.60 ? 292 GLY B C 1 ATOM 5366 O O . GLY B 1 233 ? 17.083 -4.567 64.267 1.00 45.55 ? 292 GLY B O 1 ATOM 5367 N N . SER B 1 234 ? 18.180 -3.931 62.412 1.00 40.33 ? 293 SER B N 1 ATOM 5368 C CA . SER B 1 234 ? 17.357 -2.748 62.226 1.00 40.44 ? 293 SER B CA 1 ATOM 5369 C C . SER B 1 234 ? 16.231 -3.077 61.259 1.00 40.88 ? 293 SER B C 1 ATOM 5370 O O . SER B 1 234 ? 16.445 -3.744 60.247 1.00 47.55 ? 293 SER B O 1 ATOM 5371 C CB . SER B 1 234 ? 18.193 -1.574 61.710 1.00 39.98 ? 293 SER B CB 1 ATOM 5372 O OG . SER B 1 234 ? 18.599 -1.785 60.370 1.00 50.13 ? 293 SER B OG 1 ATOM 5373 N N . VAL B 1 235 ? 15.030 -2.613 61.577 1.00 41.25 ? 294 VAL B N 1 ATOM 5374 C CA . VAL B 1 235 ? 13.878 -2.868 60.728 1.00 41.69 ? 294 VAL B CA 1 ATOM 5375 C C . VAL B 1 235 ? 13.260 -1.546 60.307 1.00 41.71 ? 294 VAL B C 1 ATOM 5376 O O . VAL B 1 235 ? 12.730 -0.800 61.130 1.00 44.76 ? 294 VAL B O 1 ATOM 5377 C CB . VAL B 1 235 ? 12.822 -3.740 61.436 1.00 53.68 ? 294 VAL B CB 1 ATOM 5378 C CG1 . VAL B 1 235 ? 11.595 -3.908 60.552 1.00 42.68 ? 294 VAL B CG1 1 ATOM 5379 C CG2 . VAL B 1 235 ? 13.413 -5.094 61.798 1.00 42.21 ? 294 VAL B CG2 1 ATOM 5380 N N . GLN B 1 236 ? 13.338 -1.266 59.013 1.00 41.63 ? 295 GLN B N 1 ATOM 5381 C CA . GLN B 1 236 ? 12.916 0.016 58.474 1.00 47.59 ? 295 GLN B CA 1 ATOM 5382 C C . GLN B 1 236 ? 11.765 -0.177 57.503 1.00 51.29 ? 295 GLN B C 1 ATOM 5383 O O . GLN B 1 236 ? 11.852 -0.994 56.588 1.00 43.60 ? 295 GLN B O 1 ATOM 5384 C CB . GLN B 1 236 ? 14.086 0.715 57.780 1.00 41.06 ? 295 GLN B CB 1 ATOM 5385 C CG . GLN B 1 236 ? 13.710 2.013 57.094 1.00 40.99 ? 295 GLN B CG 1 ATOM 5386 C CD . GLN B 1 236 ? 14.911 2.735 56.518 1.00 44.63 ? 295 GLN B CD 1 ATOM 5387 O OE1 . GLN B 1 236 ? 15.183 2.653 55.320 1.00 48.70 ? 295 GLN B OE1 1 ATOM 5388 N NE2 . GLN B 1 236 ? 15.638 3.449 57.371 1.00 50.95 ? 295 GLN B NE2 1 ATOM 5389 N N . VAL B 1 237 ? 10.693 0.581 57.708 1.00 49.07 ? 296 VAL B N 1 ATOM 5390 C CA . VAL B 1 237 ? 9.511 0.486 56.861 1.00 44.97 ? 296 VAL B CA 1 ATOM 5391 C C . VAL B 1 237 ? 9.866 0.741 55.398 1.00 42.54 ? 296 VAL B C 1 ATOM 5392 O O . VAL B 1 237 ? 10.648 1.638 55.078 1.00 47.73 ? 296 VAL B O 1 ATOM 5393 C CB . VAL B 1 237 ? 8.408 1.474 57.317 1.00 49.27 ? 296 VAL B CB 1 ATOM 5394 C CG1 . VAL B 1 237 ? 8.901 2.914 57.257 1.00 42.53 ? 296 VAL B CG1 1 ATOM 5395 C CG2 . VAL B 1 237 ? 7.146 1.295 56.488 1.00 50.81 ? 296 VAL B CG2 1 ATOM 5396 N N . PHE B 1 238 ? 9.317 -0.090 54.519 1.00 49.45 ? 297 PHE B N 1 ATOM 5397 C CA . PHE B 1 238 ? 9.529 0.057 53.087 1.00 47.14 ? 297 PHE B CA 1 ATOM 5398 C C . PHE B 1 238 ? 9.002 1.405 52.620 1.00 50.32 ? 297 PHE B C 1 ATOM 5399 O O . PHE B 1 238 ? 7.989 1.892 53.124 1.00 54.92 ? 297 PHE B O 1 ATOM 5400 C CB . PHE B 1 238 ? 8.841 -1.077 52.323 1.00 43.21 ? 297 PHE B CB 1 ATOM 5401 C CG . PHE B 1 238 ? 9.742 -1.801 51.364 1.00 55.08 ? 297 PHE B CG 1 ATOM 5402 C CD1 . PHE B 1 238 ? 10.716 -2.670 51.829 1.00 54.57 ? 297 PHE B CD1 1 ATOM 5403 C CD2 . PHE B 1 238 ? 9.608 -1.622 49.997 1.00 43.01 ? 297 PHE B CD2 1 ATOM 5404 C CE1 . PHE B 1 238 ? 11.546 -3.340 50.948 1.00 44.34 ? 297 PHE B CE1 1 ATOM 5405 C CE2 . PHE B 1 238 ? 10.433 -2.289 49.112 1.00 53.45 ? 297 PHE B CE2 1 ATOM 5406 C CZ . PHE B 1 238 ? 11.404 -3.150 49.588 1.00 47.06 ? 297 PHE B CZ 1 ATOM 5407 N N . LEU B 1 239 ? 9.695 2.014 51.666 1.00 53.06 ? 298 LEU B N 1 ATOM 5408 C CA . LEU B 1 239 ? 9.170 3.202 51.012 1.00 53.70 ? 298 LEU B CA 1 ATOM 5409 C C . LEU B 1 239 ? 7.946 2.801 50.205 1.00 55.30 ? 298 LEU B C 1 ATOM 5410 O O . LEU B 1 239 ? 7.847 1.654 49.767 1.00 63.07 ? 298 LEU B O 1 ATOM 5411 C CB . LEU B 1 239 ? 10.231 3.850 50.118 1.00 50.32 ? 298 LEU B CB 1 ATOM 5412 C CG . LEU B 1 239 ? 11.293 4.674 50.845 1.00 54.80 ? 298 LEU B CG 1 ATOM 5413 C CD1 . LEU B 1 239 ? 12.396 5.103 49.893 1.00 49.91 ? 298 LEU B CD1 1 ATOM 5414 C CD2 . LEU B 1 239 ? 10.636 5.887 51.481 1.00 53.80 ? 298 LEU B CD2 1 ATOM 5415 N N . PRO B 1 240 ? 6.999 3.734 50.021 1.00 53.53 ? 299 PRO B N 1 ATOM 5416 C CA . PRO B 1 240 ? 5.821 3.415 49.209 1.00 46.87 ? 299 PRO B CA 1 ATOM 5417 C C . PRO B 1 240 ? 6.227 3.010 47.797 1.00 43.49 ? 299 PRO B C 1 ATOM 5418 O O . PRO B 1 240 ? 7.289 3.421 47.330 1.00 56.47 ? 299 PRO B O 1 ATOM 5419 C CB . PRO B 1 240 ? 5.020 4.722 49.210 1.00 54.79 ? 299 PRO B CB 1 ATOM 5420 C CG . PRO B 1 240 ? 6.005 5.784 49.585 1.00 61.00 ? 299 PRO B CG 1 ATOM 5421 C CD . PRO B 1 240 ? 6.970 5.121 50.516 1.00 54.53 ? 299 PRO B CD 1 ATOM 5422 N N . ASP B 1 241 ? 5.396 2.207 47.140 1.00 54.18 ? 300 ASP B N 1 ATOM 5423 C CA . ASP B 1 241 ? 5.729 1.660 45.830 1.00 46.69 ? 300 ASP B CA 1 ATOM 5424 C C . ASP B 1 241 ? 6.055 2.768 44.835 1.00 60.62 ? 300 ASP B C 1 ATOM 5425 O O . ASP B 1 241 ? 5.455 3.843 44.869 1.00 68.34 ? 300 ASP B O 1 ATOM 5426 C CB . ASP B 1 241 ? 4.588 0.792 45.300 1.00 70.38 ? 300 ASP B CB 1 ATOM 5427 C CG . ASP B 1 241 ? 5.014 -0.073 44.129 1.00 91.47 ? 300 ASP B CG 1 ATOM 5428 O OD1 . ASP B 1 241 ? 5.370 -1.249 44.356 1.00 96.10 ? 300 ASP B OD1 1 ATOM 5429 O OD2 . ASP B 1 241 ? 5.002 0.423 42.984 1.00 99.86 ? 300 ASP B OD2 1 ATOM 5430 N N . GLU B 1 242 ? 7.018 2.500 43.961 1.00 68.95 ? 301 GLU B N 1 ATOM 5431 C CA . GLU B 1 242 ? 7.502 3.493 43.010 1.00 65.71 ? 301 GLU B CA 1 ATOM 5432 C C . GLU B 1 242 ? 6.411 3.913 42.029 1.00 77.31 ? 301 GLU B C 1 ATOM 5433 O O . GLU B 1 242 ? 6.366 5.063 41.593 1.00 80.05 ? 301 GLU B O 1 ATOM 5434 C CB . GLU B 1 242 ? 8.710 2.946 42.246 1.00 73.85 ? 301 GLU B CB 1 ATOM 5435 C CG . GLU B 1 242 ? 9.437 3.975 41.395 1.00 84.39 ? 301 GLU B CG 1 ATOM 5436 C CD . GLU B 1 242 ? 10.299 4.910 42.220 1.00 91.80 ? 301 GLU B CD 1 ATOM 5437 O OE1 . GLU B 1 242 ? 10.641 4.550 43.367 1.00 91.39 ? 301 GLU B OE1 1 ATOM 5438 O OE2 . GLU B 1 242 ? 10.637 6.004 41.722 1.00 99.37 ? 301 GLU B OE2 1 ATOM 5439 N N . SER B 1 243 ? 5.538 2.971 41.684 1.00 90.58 ? 302 SER B N 1 ATOM 5440 C CA . SER B 1 243 ? 4.432 3.235 40.768 1.00 81.10 ? 302 SER B CA 1 ATOM 5441 C C . SER B 1 243 ? 3.477 4.310 41.286 1.00 64.55 ? 302 SER B C 1 ATOM 5442 O O . SER B 1 243 ? 2.976 5.127 40.514 1.00 71.31 ? 302 SER B O 1 ATOM 5443 C CB . SER B 1 243 ? 3.654 1.945 40.497 1.00 83.16 ? 302 SER B CB 1 ATOM 5444 O OG . SER B 1 243 ? 3.131 1.407 41.699 1.00 91.96 ? 302 SER B OG 1 ATOM 5445 N N . ALA B 1 244 ? 3.229 4.307 42.592 1.00 57.94 ? 303 ALA B N 1 ATOM 5446 C CA . ALA B 1 244 ? 2.342 5.295 43.198 1.00 47.58 ? 303 ALA B CA 1 ATOM 5447 C C . ALA B 1 244 ? 3.090 6.572 43.559 1.00 57.12 ? 303 ALA B C 1 ATOM 5448 O O . ALA B 1 244 ? 2.664 7.673 43.209 1.00 68.74 ? 303 ALA B O 1 ATOM 5449 C CB . ALA B 1 244 ? 1.666 4.714 44.431 1.00 48.20 ? 303 ALA B CB 1 ATOM 5450 N N . VAL B 1 245 ? 4.209 6.420 44.259 1.00 74.30 ? 304 VAL B N 1 ATOM 5451 C CA . VAL B 1 245 ? 5.011 7.565 44.671 1.00 66.80 ? 304 VAL B CA 1 ATOM 5452 C C . VAL B 1 245 ? 6.420 7.470 44.099 1.00 67.51 ? 304 VAL B C 1 ATOM 5453 O O . VAL B 1 245 ? 7.316 6.910 44.732 1.00 76.27 ? 304 VAL B O 1 ATOM 5454 C CB . VAL B 1 245 ? 5.091 7.680 46.208 1.00 52.71 ? 304 VAL B CB 1 ATOM 5455 C CG1 . VAL B 1 245 ? 5.788 8.971 46.610 1.00 61.94 ? 304 VAL B CG1 1 ATOM 5456 C CG2 . VAL B 1 245 ? 3.701 7.614 46.822 1.00 51.90 ? 304 VAL B CG2 1 ATOM 5457 N N . PRO B 1 246 ? 6.617 8.008 42.885 1.00 73.21 ? 305 PRO B N 1 ATOM 5458 C CA . PRO B 1 246 ? 7.930 7.978 42.233 1.00 78.13 ? 305 PRO B CA 1 ATOM 5459 C C . PRO B 1 246 ? 8.961 8.786 43.014 1.00 68.25 ? 305 PRO B C 1 ATOM 5460 O O . PRO B 1 246 ? 8.598 9.703 43.752 1.00 54.26 ? 305 PRO B O 1 ATOM 5461 C CB . PRO B 1 246 ? 7.661 8.602 40.859 1.00 70.17 ? 305 PRO B CB 1 ATOM 5462 C CG . PRO B 1 246 ? 6.394 9.373 41.025 1.00 71.01 ? 305 PRO B CG 1 ATOM 5463 C CD . PRO B 1 246 ? 5.586 8.612 42.025 1.00 65.17 ? 305 PRO B CD 1 ATOM 5464 N N . ARG B 1 247 ? 10.232 8.438 42.851 1.00 76.60 ? 306 ARG B N 1 ATOM 5465 C CA . ARG B 1 247 ? 11.309 9.062 43.611 1.00 64.76 ? 306 ARG B CA 1 ATOM 5466 C C . ARG B 1 247 ? 12.478 9.488 42.730 1.00 49.58 ? 306 ARG B C 1 ATOM 5467 O O . ARG B 1 247 ? 12.693 8.927 41.656 1.00 58.28 ? 306 ARG B O 1 ATOM 5468 C CB . ARG B 1 247 ? 11.768 8.098 44.711 1.00 64.78 ? 306 ARG B CB 1 ATOM 5469 C CG . ARG B 1 247 ? 10.957 8.247 45.994 1.00 67.85 ? 306 ARG B CG 1 ATOM 5470 C CD . ARG B 1 247 ? 11.313 7.235 47.076 1.00 56.16 ? 306 ARG B CD 1 ATOM 5471 N NE . ARG B 1 247 ? 11.234 5.858 46.584 1.00 70.05 ? 306 ARG B NE 1 ATOM 5472 C CZ . ARG B 1 247 ? 12.274 5.072 46.335 1.00 70.35 ? 306 ARG B CZ 1 ATOM 5473 N NH1 . ARG B 1 247 ? 13.509 5.502 46.536 1.00 85.09 ? 306 ARG B NH1 1 ATOM 5474 N NH2 . ARG B 1 247 ? 12.067 3.844 45.892 1.00 71.25 ? 306 ARG B NH2 1 ATOM 5475 N N . LYS B 1 248 ? 13.235 10.477 43.197 1.00 59.73 ? 307 LYS B N 1 ATOM 5476 C CA . LYS B 1 248 ? 14.361 11.010 42.437 1.00 59.47 ? 307 LYS B CA 1 ATOM 5477 C C . LYS B 1 248 ? 15.694 10.654 43.081 1.00 57.55 ? 307 LYS B C 1 ATOM 5478 O O . LYS B 1 248 ? 15.828 10.642 44.306 1.00 55.75 ? 307 LYS B O 1 ATOM 5479 C CB . LYS B 1 248 ? 14.258 12.530 42.291 1.00 65.79 ? 307 LYS B CB 1 ATOM 5480 C CG . LYS B 1 248 ? 13.262 12.996 41.245 1.00 81.95 ? 307 LYS B CG 1 ATOM 5481 C CD . LYS B 1 248 ? 13.159 14.513 41.232 1.00 85.93 ? 307 LYS B CD 1 ATOM 5482 C CE . LYS B 1 248 ? 14.501 15.146 40.887 1.00 87.09 ? 307 LYS B CE 1 ATOM 5483 N NZ . LYS B 1 248 ? 14.499 16.625 41.070 1.00 82.72 ? 307 LYS B NZ 1 ATOM 5484 N N . HIS B 1 249 ? 16.681 10.372 42.238 1.00 61.32 ? 308 HIS B N 1 ATOM 5485 C CA . HIS B 1 249 ? 18.015 10.021 42.697 1.00 63.88 ? 308 HIS B CA 1 ATOM 5486 C C . HIS B 1 249 ? 19.001 11.056 42.171 1.00 67.66 ? 308 HIS B C 1 ATOM 5487 O O . HIS B 1 249 ? 19.297 11.080 40.977 1.00 69.21 ? 308 HIS B O 1 ATOM 5488 C CB . HIS B 1 249 ? 18.403 8.624 42.206 1.00 73.57 ? 308 HIS B CB 1 ATOM 5489 C CG . HIS B 1 249 ? 17.517 7.530 42.718 1.00 103.24 ? 308 HIS B CG 1 ATOM 5490 N ND1 . HIS B 1 249 ? 17.773 6.845 43.886 1.00 113.39 ? 308 HIS B ND1 1 ATOM 5491 C CD2 . HIS B 1 249 ? 16.377 7.000 42.213 1.00 107.96 ? 308 HIS B CD2 1 ATOM 5492 C CE1 . HIS B 1 249 ? 16.830 5.939 44.078 1.00 118.59 ? 308 HIS B CE1 1 ATOM 5493 N NE2 . HIS B 1 249 ? 15.969 6.015 43.079 1.00 110.95 ? 308 HIS B NE2 1 ATOM 5494 N N . ASN B 1 250 ? 19.511 11.909 43.054 1.00 65.28 ? 309 ASN B N 1 ATOM 5495 C CA . ASN B 1 250 ? 20.383 12.998 42.624 1.00 62.67 ? 309 ASN B CA 1 ATOM 5496 C C . ASN B 1 250 ? 21.790 12.923 43.204 1.00 56.91 ? 309 ASN B C 1 ATOM 5497 O O . ASN B 1 250 ? 21.975 12.801 44.415 1.00 65.37 ? 309 ASN B O 1 ATOM 5498 C CB . ASN B 1 250 ? 19.753 14.346 42.978 1.00 58.60 ? 309 ASN B CB 1 ATOM 5499 C CG . ASN B 1 250 ? 18.468 14.604 42.216 1.00 70.64 ? 309 ASN B CG 1 ATOM 5500 O OD1 . ASN B 1 250 ? 17.397 14.738 42.808 1.00 77.30 ? 309 ASN B OD1 1 ATOM 5501 N ND2 . ASN B 1 250 ? 18.569 14.671 40.894 1.00 62.81 ? 309 ASN B ND2 1 ATOM 5502 N N . ARG B 1 251 ? 22.776 13.006 42.317 1.00 53.59 ? 310 ARG B N 1 ATOM 5503 C CA . ARG B 1 251 ? 24.182 13.032 42.697 1.00 52.53 ? 310 ARG B CA 1 ATOM 5504 C C . ARG B 1 251 ? 24.514 14.270 43.525 1.00 55.31 ? 310 ARG B C 1 ATOM 5505 O O . ARG B 1 251 ? 24.110 15.382 43.184 1.00 59.52 ? 310 ARG B O 1 ATOM 5506 C CB . ARG B 1 251 ? 25.062 12.978 41.447 1.00 53.00 ? 310 ARG B CB 1 ATOM 5507 C CG . ARG B 1 251 ? 26.553 12.941 41.723 1.00 75.45 ? 310 ARG B CG 1 ATOM 5508 C CD . ARG B 1 251 ? 27.342 13.049 40.429 1.00 79.97 ? 310 ARG B CD 1 ATOM 5509 N NE . ARG B 1 251 ? 28.740 12.668 40.602 1.00 86.81 ? 310 ARG B NE 1 ATOM 5510 C CZ . ARG B 1 251 ? 29.694 13.491 41.020 1.00 82.73 ? 310 ARG B CZ 1 ATOM 5511 N NH1 . ARG B 1 251 ? 29.405 14.751 41.316 1.00 81.55 ? 310 ARG B NH1 1 ATOM 5512 N NH2 . ARG B 1 251 ? 30.940 13.055 41.146 1.00 76.36 ? 310 ARG B NH2 1 ATOM 5513 N N . SER B 1 252 ? 25.249 14.071 44.615 1.00 55.30 ? 311 SER B N 1 ATOM 5514 C CA . SER B 1 252 ? 25.654 15.173 45.480 1.00 49.87 ? 311 SER B CA 1 ATOM 5515 C C . SER B 1 252 ? 26.810 15.970 44.885 1.00 52.94 ? 311 SER B C 1 ATOM 5516 O O . SER B 1 252 ? 27.760 15.394 44.357 1.00 48.29 ? 311 SER B O 1 ATOM 5517 C CB . SER B 1 252 ? 26.048 14.647 46.863 1.00 50.91 ? 311 SER B CB 1 ATOM 5518 O OG . SER B 1 252 ? 26.445 15.704 47.719 1.00 42.35 ? 311 SER B OG 1 ATOM 5519 N N . PRO B 1 253 ? 26.729 17.307 44.970 1.00 52.12 ? 312 PRO B N 1 ATOM 5520 C CA . PRO B 1 253 ? 27.835 18.180 44.565 1.00 48.72 ? 312 PRO B CA 1 ATOM 5521 C C . PRO B 1 253 ? 29.023 18.042 45.513 1.00 59.86 ? 312 PRO B C 1 ATOM 5522 O O . PRO B 1 253 ? 30.140 18.432 45.173 1.00 42.88 ? 312 PRO B O 1 ATOM 5523 C CB . PRO B 1 253 ? 27.227 19.584 44.640 1.00 34.48 ? 312 PRO B CB 1 ATOM 5524 C CG . PRO B 1 253 ? 26.104 19.457 45.609 1.00 56.38 ? 312 PRO B CG 1 ATOM 5525 C CD . PRO B 1 253 ? 25.556 18.073 45.423 1.00 52.19 ? 312 PRO B CD 1 ATOM 5526 N N . TYR B 1 254 ? 28.771 17.487 46.695 1.00 41.45 ? 313 TYR B N 1 ATOM 5527 C CA . TYR B 1 254 ? 29.824 17.230 47.669 1.00 46.18 ? 313 TYR B CA 1 ATOM 5528 C C . TYR B 1 254 ? 30.130 15.739 47.758 1.00 42.64 ? 313 TYR B C 1 ATOM 5529 O O . TYR B 1 254 ? 30.579 15.252 48.796 1.00 45.48 ? 313 TYR B O 1 ATOM 5530 C CB . TYR B 1 254 ? 29.425 17.762 49.047 1.00 34.04 ? 313 TYR B CB 1 ATOM 5531 C CG . TYR B 1 254 ? 29.467 19.268 49.166 1.00 64.48 ? 313 TYR B CG 1 ATOM 5532 C CD1 . TYR B 1 254 ? 28.371 20.043 48.810 1.00 47.53 ? 313 TYR B CD1 1 ATOM 5533 C CD2 . TYR B 1 254 ? 30.602 19.915 49.637 1.00 45.60 ? 313 TYR B CD2 1 ATOM 5534 C CE1 . TYR B 1 254 ? 28.405 21.421 48.918 1.00 48.84 ? 313 TYR B CE1 1 ATOM 5535 C CE2 . TYR B 1 254 ? 30.646 21.292 49.748 1.00 58.23 ? 313 TYR B CE2 1 ATOM 5536 C CZ . TYR B 1 254 ? 29.545 22.039 49.388 1.00 57.68 ? 313 TYR B CZ 1 ATOM 5537 O OH . TYR B 1 254 ? 29.586 23.410 49.498 1.00 50.81 ? 313 TYR B OH 1 ATOM 5538 N N . ARG B 1 255 ? 29.873 15.018 46.670 1.00 49.51 ? 314 ARG B N 1 ATOM 5539 C CA . ARG B 1 255 ? 30.266 13.617 46.565 1.00 44.02 ? 314 ARG B CA 1 ATOM 5540 C C . ARG B 1 255 ? 31.776 13.485 46.727 1.00 42.95 ? 314 ARG B C 1 ATOM 5541 O O . ARG B 1 255 ? 32.538 14.290 46.192 1.00 51.30 ? 314 ARG B O 1 ATOM 5542 C CB . ARG B 1 255 ? 29.816 13.021 45.230 1.00 48.44 ? 314 ARG B CB 1 ATOM 5543 C CG . ARG B 1 255 ? 30.167 11.551 45.058 1.00 56.95 ? 314 ARG B CG 1 ATOM 5544 C CD . ARG B 1 255 ? 29.740 11.032 43.696 1.00 76.18 ? 314 ARG B CD 1 ATOM 5545 N NE . ARG B 1 255 ? 30.005 9.603 43.548 1.00 74.94 ? 314 ARG B NE 1 ATOM 5546 C CZ . ARG B 1 255 ? 31.156 9.095 43.120 1.00 75.24 ? 314 ARG B CZ 1 ATOM 5547 N NH1 . ARG B 1 255 ? 32.160 9.898 42.797 1.00 63.07 ? 314 ARG B NH1 1 ATOM 5548 N NH2 . ARG B 1 255 ? 31.304 7.781 43.018 1.00 90.38 ? 314 ARG B NH2 1 ATOM 5549 N N . ARG B 1 256 ? 32.204 12.472 47.472 1.00 46.58 ? 315 ARG B N 1 ATOM 5550 C CA . ARG B 1 256 ? 33.625 12.238 47.691 1.00 48.97 ? 315 ARG B CA 1 ATOM 5551 C C . ARG B 1 256 ? 34.180 11.473 46.487 1.00 43.58 ? 315 ARG B C 1 ATOM 5552 O O . ARG B 1 256 ? 33.420 11.086 45.600 1.00 43.56 ? 315 ARG B O 1 ATOM 5553 C CB . ARG B 1 256 ? 33.829 11.477 49.002 1.00 43.23 ? 315 ARG B CB 1 ATOM 5554 C CG . ARG B 1 256 ? 33.363 12.301 50.200 1.00 35.65 ? 315 ARG B CG 1 ATOM 5555 C CD . ARG B 1 256 ? 33.288 11.506 51.492 1.00 40.45 ? 315 ARG B CD 1 ATOM 5556 N NE . ARG B 1 256 ? 33.363 12.373 52.668 1.00 40.29 ? 315 ARG B NE 1 ATOM 5557 C CZ . ARG B 1 256 ? 34.409 12.481 53.478 1.00 40.24 ? 315 ARG B CZ 1 ATOM 5558 N NH1 . ARG B 1 256 ? 35.510 11.780 53.252 1.00 46.81 ? 315 ARG B NH1 1 ATOM 5559 N NH2 . ARG B 1 256 ? 34.350 13.302 54.518 1.00 57.67 ? 315 ARG B NH2 1 ATOM 5560 N N . THR B 1 257 ? 35.490 11.254 46.446 1.00 40.79 ? 316 THR B N 1 ATOM 5561 C CA . THR B 1 257 ? 36.118 10.664 45.263 1.00 41.44 ? 316 THR B CA 1 ATOM 5562 C C . THR B 1 257 ? 35.957 9.143 45.172 1.00 46.02 ? 316 THR B C 1 ATOM 5563 O O . THR B 1 257 ? 35.846 8.593 44.073 1.00 50.78 ? 316 THR B O 1 ATOM 5564 C CB . THR B 1 257 ? 37.620 11.003 45.207 1.00 38.46 ? 316 THR B CB 1 ATOM 5565 O OG1 . THR B 1 257 ? 37.791 12.425 45.262 1.00 59.65 ? 316 THR B OG1 1 ATOM 5566 C CG2 . THR B 1 257 ? 38.245 10.477 43.920 1.00 64.48 ? 316 THR B CG2 1 ATOM 5567 N N . TYR B 1 258 ? 35.926 8.478 46.325 1.00 41.70 ? 317 TYR B N 1 ATOM 5568 C CA . TYR B 1 258 ? 35.865 7.017 46.390 1.00 41.99 ? 317 TYR B CA 1 ATOM 5569 C C . TYR B 1 258 ? 37.062 6.376 45.686 1.00 39.18 ? 317 TYR B C 1 ATOM 5570 O O . TYR B 1 258 ? 36.913 5.427 44.916 1.00 50.19 ? 317 TYR B O 1 ATOM 5571 C CB . TYR B 1 258 ? 34.553 6.499 45.789 1.00 33.69 ? 317 TYR B CB 1 ATOM 5572 C CG . TYR B 1 258 ? 33.334 6.852 46.610 1.00 48.00 ? 317 TYR B CG 1 ATOM 5573 C CD1 . TYR B 1 258 ? 32.766 5.930 47.477 1.00 35.13 ? 317 TYR B CD1 1 ATOM 5574 C CD2 . TYR B 1 258 ? 32.763 8.116 46.530 1.00 42.90 ? 317 TYR B CD2 1 ATOM 5575 C CE1 . TYR B 1 258 ? 31.658 6.252 48.234 1.00 43.75 ? 317 TYR B CE1 1 ATOM 5576 C CE2 . TYR B 1 258 ? 31.654 8.448 47.284 1.00 39.74 ? 317 TYR B CE2 1 ATOM 5577 C CZ . TYR B 1 258 ? 31.107 7.511 48.134 1.00 46.00 ? 317 TYR B CZ 1 ATOM 5578 O OH . TYR B 1 258 ? 30.005 7.832 48.890 1.00 47.13 ? 317 TYR B OH 1 ATOM 5579 N N . SER B 1 259 ? 38.249 6.911 45.962 1.00 37.16 ? 318 SER B N 1 ATOM 5580 C CA . SER B 1 259 ? 39.502 6.370 45.442 1.00 49.65 ? 318 SER B CA 1 ATOM 5581 C C . SER B 1 259 ? 40.612 6.519 46.481 1.00 50.82 ? 318 SER B C 1 ATOM 5582 O O . SER B 1 259 ? 40.647 7.504 47.216 1.00 43.32 ? 318 SER B O 1 ATOM 5583 C CB . SER B 1 259 ? 39.894 7.070 44.139 1.00 52.95 ? 318 SER B CB 1 ATOM 5584 O OG . SER B 1 259 ? 41.293 6.994 43.921 1.00 49.13 ? 318 SER B OG 1 ATOM 5585 N N . LYS B 1 260 ? 41.511 5.540 46.550 1.00 45.78 ? 319 LYS B N 1 ATOM 5586 C CA . LYS B 1 260 ? 42.613 5.592 47.511 1.00 41.59 ? 319 LYS B CA 1 ATOM 5587 C C . LYS B 1 260 ? 43.859 6.325 47.001 1.00 41.70 ? 319 LYS B C 1 ATOM 5588 O O . LYS B 1 260 ? 44.726 6.699 47.792 1.00 56.41 ? 319 LYS B O 1 ATOM 5589 C CB . LYS B 1 260 ? 42.983 4.172 47.948 1.00 38.76 ? 319 LYS B CB 1 ATOM 5590 C CG . LYS B 1 260 ? 43.205 3.194 46.805 1.00 50.72 ? 319 LYS B CG 1 ATOM 5591 C CD . LYS B 1 260 ? 43.311 1.771 47.334 1.00 46.39 ? 319 LYS B CD 1 ATOM 5592 C CE . LYS B 1 260 ? 43.543 0.765 46.219 1.00 58.35 ? 319 LYS B CE 1 ATOM 5593 N NZ . LYS B 1 260 ? 44.784 1.038 45.453 1.00 65.90 ? 319 LYS B NZ 1 ATOM 5594 N N . LYS B 1 261 ? 43.951 6.524 45.689 1.00 49.22 ? 320 LYS B N 1 ATOM 5595 C CA . LYS B 1 261 ? 45.014 7.346 45.108 1.00 61.38 ? 320 LYS B CA 1 ATOM 5596 C C . LYS B 1 261 ? 44.714 8.838 45.211 1.00 56.56 ? 320 LYS B C 1 ATOM 5597 O O . LYS B 1 261 ? 45.380 9.562 45.950 1.00 66.73 ? 320 LYS B O 1 ATOM 5598 C CB . LYS B 1 261 ? 45.276 6.955 43.651 1.00 61.59 ? 320 LYS B CB 1 ATOM 5599 C CG . LYS B 1 261 ? 46.374 5.911 43.468 1.00 79.84 ? 320 LYS B CG 1 ATOM 5600 C CD . LYS B 1 261 ? 46.147 4.615 44.221 1.00 85.05 ? 320 LYS B CD 1 ATOM 5601 C CE . LYS B 1 261 ? 47.334 3.687 43.995 1.00 79.82 ? 320 LYS B CE 1 ATOM 5602 N NZ . LYS B 1 261 ? 47.226 2.393 44.715 1.00 80.54 ? 320 LYS B NZ 1 ATOM 5603 N N . ASN B 1 262 ? 43.706 9.295 44.476 1.00 52.29 ? 321 ASN B N 1 ATOM 5604 C CA . ASN B 1 262 ? 43.293 10.689 44.555 1.00 54.68 ? 321 ASN B CA 1 ATOM 5605 C C . ASN B 1 262 ? 42.192 10.868 45.591 1.00 39.13 ? 321 ASN B C 1 ATOM 5606 O O . ASN B 1 262 ? 41.016 10.675 45.301 1.00 56.93 ? 321 ASN B O 1 ATOM 5607 C CB . ASN B 1 262 ? 42.819 11.187 43.190 1.00 61.08 ? 321 ASN B CB 1 ATOM 5608 C CG . ASN B 1 262 ? 43.796 10.859 42.079 1.00 78.00 ? 321 ASN B CG 1 ATOM 5609 O OD1 . ASN B 1 262 ? 43.641 9.861 41.375 1.00 83.80 ? 321 ASN B OD1 1 ATOM 5610 N ND2 . ASN B 1 262 ? 44.812 11.699 41.918 1.00 62.21 ? 321 ASN B ND2 1 ATOM 5611 N N . GLN B 1 263 ? 42.587 11.244 46.802 1.00 33.89 ? 322 GLN B N 1 ATOM 5612 C CA . GLN B 1 263 ? 41.671 11.262 47.936 1.00 40.25 ? 322 GLN B CA 1 ATOM 5613 C C . GLN B 1 263 ? 41.045 12.633 48.178 1.00 48.74 ? 322 GLN B C 1 ATOM 5614 O O . GLN B 1 263 ? 40.292 12.815 49.134 1.00 40.58 ? 322 GLN B O 1 ATOM 5615 C CB . GLN B 1 263 ? 42.398 10.801 49.199 1.00 31.95 ? 322 GLN B CB 1 ATOM 5616 C CG . GLN B 1 263 ? 42.955 9.392 49.106 1.00 42.31 ? 322 GLN B CG 1 ATOM 5617 C CD . GLN B 1 263 ? 43.795 9.018 50.310 1.00 34.67 ? 322 GLN B CD 1 ATOM 5618 O OE1 . GLN B 1 263 ? 43.715 9.656 51.359 1.00 30.81 ? 322 GLN B OE1 1 ATOM 5619 N NE2 . GLN B 1 263 ? 44.608 7.978 50.164 1.00 38.32 ? 322 GLN B NE2 1 ATOM 5620 N N . VAL B 1 264 ? 41.355 13.596 47.316 1.00 47.91 ? 323 VAL B N 1 ATOM 5621 C CA . VAL B 1 264 ? 40.917 14.968 47.540 1.00 34.10 ? 323 VAL B CA 1 ATOM 5622 C C . VAL B 1 264 ? 40.045 15.498 46.405 1.00 43.91 ? 323 VAL B C 1 ATOM 5623 O O . VAL B 1 264 ? 40.536 15.799 45.316 1.00 58.38 ? 323 VAL B O 1 ATOM 5624 C CB . VAL B 1 264 ? 42.119 15.916 47.724 1.00 46.50 ? 323 VAL B CB 1 ATOM 5625 C CG1 . VAL B 1 264 ? 41.637 17.344 47.940 1.00 35.74 ? 323 VAL B CG1 1 ATOM 5626 C CG2 . VAL B 1 264 ? 42.982 15.458 48.889 1.00 30.59 ? 323 VAL B CG2 1 ATOM 5627 N N . ALA B 1 265 ? 38.747 15.602 46.668 1.00 41.49 ? 324 ALA B N 1 ATOM 5628 C CA . ALA B 1 265 ? 37.816 16.208 45.725 1.00 45.36 ? 324 ALA B CA 1 ATOM 5629 C C . ALA B 1 265 ? 38.008 17.723 45.698 1.00 41.10 ? 324 ALA B C 1 ATOM 5630 O O . ALA B 1 265 ? 38.589 18.295 46.622 1.00 47.75 ? 324 ALA B O 1 ATOM 5631 C CB . ALA B 1 265 ? 36.386 15.854 46.085 1.00 32.32 ? 324 ALA B CB 1 ATOM 5632 N N . GLU B 1 266 ? 37.531 18.361 44.633 1.00 34.82 ? 325 GLU B N 1 ATOM 5633 C CA . GLU B 1 266 ? 37.648 19.809 44.472 1.00 41.99 ? 325 GLU B CA 1 ATOM 5634 C C . GLU B 1 266 ? 37.095 20.584 45.668 1.00 47.38 ? 325 GLU B C 1 ATOM 5635 O O . GLU B 1 266 ? 37.703 21.555 46.119 1.00 47.62 ? 325 GLU B O 1 ATOM 5636 C CB . GLU B 1 266 ? 36.941 20.263 43.193 1.00 48.26 ? 325 GLU B CB 1 ATOM 5637 C CG . GLU B 1 266 ? 36.981 21.767 42.975 1.00 56.41 ? 325 GLU B CG 1 ATOM 5638 C CD . GLU B 1 266 ? 36.365 22.185 41.656 1.00 67.37 ? 325 GLU B CD 1 ATOM 5639 O OE1 . GLU B 1 266 ? 36.014 21.296 40.852 1.00 71.22 ? 325 GLU B OE1 1 ATOM 5640 O OE2 . GLU B 1 266 ? 36.238 23.405 41.421 1.00 68.59 ? 325 GLU B OE2 1 ATOM 5641 N N . TRP B 1 267 ? 35.947 20.153 46.181 1.00 38.04 ? 326 TRP B N 1 ATOM 5642 C CA . TRP B 1 267 ? 35.298 20.854 47.287 1.00 35.66 ? 326 TRP B CA 1 ATOM 5643 C C . TRP B 1 267 ? 36.095 20.743 48.583 1.00 45.40 ? 326 TRP B C 1 ATOM 5644 O O . TRP B 1 267 ? 35.841 21.470 49.542 1.00 34.80 ? 326 TRP B O 1 ATOM 5645 C CB . TRP B 1 267 ? 33.874 20.327 47.499 1.00 33.38 ? 326 TRP B CB 1 ATOM 5646 C CG . TRP B 1 267 ? 33.772 18.861 47.809 1.00 48.63 ? 326 TRP B CG 1 ATOM 5647 C CD1 . TRP B 1 267 ? 33.605 17.844 46.914 1.00 46.35 ? 326 TRP B CD1 1 ATOM 5648 C CD2 . TRP B 1 267 ? 33.791 18.252 49.107 1.00 38.42 ? 326 TRP B CD2 1 ATOM 5649 N NE1 . TRP B 1 267 ? 33.536 16.640 47.571 1.00 42.93 ? 326 TRP B NE1 1 ATOM 5650 C CE2 . TRP B 1 267 ? 33.647 16.862 48.918 1.00 40.56 ? 326 TRP B CE2 1 ATOM 5651 C CE3 . TRP B 1 267 ? 33.924 18.745 50.409 1.00 38.96 ? 326 TRP B CE3 1 ATOM 5652 C CZ2 . TRP B 1 267 ? 33.633 15.961 49.981 1.00 33.05 ? 326 TRP B CZ2 1 ATOM 5653 C CZ3 . TRP B 1 267 ? 33.909 17.849 51.463 1.00 37.61 ? 326 TRP B CZ3 1 ATOM 5654 C CH2 . TRP B 1 267 ? 33.765 16.473 51.243 1.00 36.61 ? 326 TRP B CH2 1 ATOM 5655 N N . GLN B 1 268 ? 37.056 19.827 48.607 1.00 40.06 ? 327 GLN B N 1 ATOM 5656 C CA . GLN B 1 268 ? 37.895 19.636 49.782 1.00 49.35 ? 327 GLN B CA 1 ATOM 5657 C C . GLN B 1 268 ? 39.120 20.551 49.781 1.00 55.48 ? 327 GLN B C 1 ATOM 5658 O O . GLN B 1 268 ? 39.727 20.780 50.827 1.00 39.30 ? 327 GLN B O 1 ATOM 5659 C CB . GLN B 1 268 ? 38.331 18.174 49.883 1.00 32.26 ? 327 GLN B CB 1 ATOM 5660 C CG . GLN B 1 268 ? 37.270 17.262 50.477 1.00 32.78 ? 327 GLN B CG 1 ATOM 5661 C CD . GLN B 1 268 ? 37.589 15.793 50.290 1.00 37.42 ? 327 GLN B CD 1 ATOM 5662 O OE1 . GLN B 1 268 ? 37.965 15.361 49.201 1.00 32.42 ? 327 GLN B OE1 1 ATOM 5663 N NE2 . GLN B 1 268 ? 37.440 15.016 51.357 1.00 33.65 ? 327 GLN B NE2 1 ATOM 5664 N N . SER B 1 269 ? 39.479 21.079 48.614 1.00 57.95 ? 328 SER B N 1 ATOM 5665 C CA . SER B 1 269 ? 40.669 21.920 48.504 1.00 56.51 ? 328 SER B CA 1 ATOM 5666 C C . SER B 1 269 ? 40.356 23.380 48.171 1.00 61.08 ? 328 SER B C 1 ATOM 5667 O O . SER B 1 269 ? 41.124 24.277 48.520 1.00 79.03 ? 328 SER B O 1 ATOM 5668 C CB . SER B 1 269 ? 41.619 21.348 47.449 1.00 37.55 ? 328 SER B CB 1 ATOM 5669 O OG . SER B 1 269 ? 40.954 21.157 46.213 1.00 57.36 ? 328 SER B OG 1 ATOM 5670 N N . SER B 1 270 ? 39.236 23.619 47.495 1.00 60.27 ? 329 SER B N 1 ATOM 5671 C CA . SER B 1 270 ? 38.858 24.976 47.106 1.00 47.77 ? 329 SER B CA 1 ATOM 5672 C C . SER B 1 270 ? 37.743 25.512 48.000 1.00 54.93 ? 329 SER B C 1 ATOM 5673 O O . SER B 1 270 ? 36.640 24.967 48.027 1.00 70.58 ? 329 SER B O 1 ATOM 5674 C CB . SER B 1 270 ? 38.430 25.018 45.638 1.00 44.71 ? 329 SER B CB 1 ATOM 5675 O OG . SER B 1 270 ? 37.296 24.202 45.410 1.00 73.14 ? 329 SER B OG 1 HETATM 5676 N N . MSE B 1 271 ? 38.038 26.589 48.722 1.00 54.71 ? 330 MSE B N 1 HETATM 5677 C CA . MSE B 1 271 ? 37.114 27.143 49.708 1.00 60.81 ? 330 MSE B CA 1 HETATM 5678 C C . MSE B 1 271 ? 35.855 27.749 49.091 1.00 67.70 ? 330 MSE B C 1 HETATM 5679 O O . MSE B 1 271 ? 34.799 27.775 49.724 1.00 88.11 ? 330 MSE B O 1 HETATM 5680 C CB . MSE B 1 271 ? 37.831 28.199 50.552 1.00 72.32 ? 330 MSE B CB 1 HETATM 5681 C CG . MSE B 1 271 ? 38.683 29.162 49.739 1.00 83.78 ? 330 MSE B CG 1 HETATM 5682 SE SE . MSE B 1 271 ? 39.705 30.400 50.847 1.00 134.13 ? 330 MSE B SE 1 HETATM 5683 C CE . MSE B 1 271 ? 38.276 31.635 51.328 1.00 77.46 ? 330 MSE B CE 1 ATOM 5684 N N . ASN B 1 272 ? 35.969 28.234 47.860 1.00 51.78 ? 331 ASN B N 1 ATOM 5685 C CA . ASN B 1 272 ? 34.862 28.915 47.195 1.00 52.20 ? 331 ASN B CA 1 ATOM 5686 C C . ASN B 1 272 ? 34.024 27.994 46.310 1.00 54.88 ? 331 ASN B C 1 ATOM 5687 O O . ASN B 1 272 ? 33.271 28.465 45.457 1.00 57.69 ? 331 ASN B O 1 ATOM 5688 C CB . ASN B 1 272 ? 35.387 30.087 46.363 1.00 62.06 ? 331 ASN B CB 1 ATOM 5689 C CG . ASN B 1 272 ? 36.250 31.037 47.172 1.00 73.40 ? 331 ASN B CG 1 ATOM 5690 O OD1 . ASN B 1 272 ? 35.772 31.689 48.100 1.00 65.03 ? 331 ASN B OD1 1 ATOM 5691 N ND2 . ASN B 1 272 ? 37.527 31.125 46.818 1.00 80.20 ? 331 ASN B ND2 1 ATOM 5692 N N . TYR B 1 273 ? 34.170 26.687 46.511 1.00 55.40 ? 332 TYR B N 1 ATOM 5693 C CA . TYR B 1 273 ? 33.464 25.682 45.718 1.00 66.44 ? 332 TYR B CA 1 ATOM 5694 C C . TYR B 1 273 ? 31.951 25.910 45.679 1.00 60.18 ? 332 TYR B C 1 ATOM 5695 O O . TYR B 1 273 ? 31.333 25.833 44.617 1.00 49.34 ? 332 TYR B O 1 ATOM 5696 C CB . TYR B 1 273 ? 33.757 24.280 46.257 1.00 53.34 ? 332 TYR B CB 1 ATOM 5697 C CG . TYR B 1 273 ? 33.094 23.172 45.470 1.00 40.83 ? 332 TYR B CG 1 ATOM 5698 C CD1 . TYR B 1 273 ? 33.653 22.707 44.287 1.00 38.13 ? 332 TYR B CD1 1 ATOM 5699 C CD2 . TYR B 1 273 ? 31.910 22.592 45.907 1.00 43.07 ? 332 TYR B CD2 1 ATOM 5700 C CE1 . TYR B 1 273 ? 33.055 21.695 43.563 1.00 40.36 ? 332 TYR B CE1 1 ATOM 5701 C CE2 . TYR B 1 273 ? 31.306 21.576 45.190 1.00 42.30 ? 332 TYR B CE2 1 ATOM 5702 C CZ . TYR B 1 273 ? 31.881 21.134 44.018 1.00 39.00 ? 332 TYR B CZ 1 ATOM 5703 O OH . TYR B 1 273 ? 31.282 20.125 43.299 1.00 37.78 ? 332 TYR B OH 1 ATOM 5704 N N . CYS B 1 274 ? 31.362 26.185 46.839 1.00 53.43 ? 333 CYS B N 1 ATOM 5705 C CA . CYS B 1 274 ? 29.920 26.385 46.943 1.00 58.64 ? 333 CYS B CA 1 ATOM 5706 C C . CYS B 1 274 ? 29.473 27.604 46.149 1.00 70.60 ? 333 CYS B C 1 ATOM 5707 O O . CYS B 1 274 ? 28.492 27.550 45.407 1.00 65.29 ? 333 CYS B O 1 ATOM 5708 C CB . CYS B 1 274 ? 29.507 26.541 48.408 1.00 62.28 ? 333 CYS B CB 1 ATOM 5709 S SG . CYS B 1 274 ? 27.722 26.583 48.700 1.00 55.53 ? 333 CYS B SG 1 ATOM 5710 N N . THR B 1 275 ? 30.201 28.703 46.317 1.00 71.66 ? 334 THR B N 1 ATOM 5711 C CA . THR B 1 275 ? 29.907 29.947 45.616 1.00 56.89 ? 334 THR B CA 1 ATOM 5712 C C . THR B 1 275 ? 29.999 29.788 44.101 1.00 53.98 ? 334 THR B C 1 ATOM 5713 O O . THR B 1 275 ? 29.103 30.205 43.366 1.00 58.86 ? 334 THR B O 1 ATOM 5714 C CB . THR B 1 275 ? 30.861 31.073 46.059 1.00 54.11 ? 334 THR B CB 1 ATOM 5715 O OG1 . THR B 1 275 ? 30.570 31.445 47.412 1.00 63.91 ? 334 THR B OG1 1 ATOM 5716 C CG2 . THR B 1 275 ? 30.712 32.293 45.159 1.00 52.77 ? 334 THR B CG2 1 ATOM 5717 N N . ASP B 1 276 ? 31.082 29.172 43.640 1.00 47.02 ? 335 ASP B N 1 ATOM 5718 C CA . ASP B 1 276 ? 31.364 29.086 42.212 1.00 42.52 ? 335 ASP B CA 1 ATOM 5719 C C . ASP B 1 276 ? 30.709 27.901 41.504 1.00 54.68 ? 335 ASP B C 1 ATOM 5720 O O . ASP B 1 276 ? 30.336 28.011 40.336 1.00 69.23 ? 335 ASP B O 1 ATOM 5721 C CB . ASP B 1 276 ? 32.878 29.029 41.985 1.00 41.37 ? 335 ASP B CB 1 ATOM 5722 C CG . ASP B 1 276 ? 33.609 30.182 42.643 1.00 57.54 ? 335 ASP B CG 1 ATOM 5723 O OD1 . ASP B 1 276 ? 33.017 31.276 42.757 1.00 70.66 ? 335 ASP B OD1 1 ATOM 5724 O OD2 . ASP B 1 276 ? 34.777 29.995 43.046 1.00 67.72 ? 335 ASP B OD2 1 ATOM 5725 N N . LYS B 1 277 ? 30.565 26.772 42.193 1.00 59.91 ? 336 LYS B N 1 ATOM 5726 C CA . LYS B 1 277 ? 30.174 25.542 41.506 1.00 55.37 ? 336 LYS B CA 1 ATOM 5727 C C . LYS B 1 277 ? 28.801 24.964 41.862 1.00 52.71 ? 336 LYS B C 1 ATOM 5728 O O . LYS B 1 277 ? 28.276 24.147 41.110 1.00 53.85 ? 336 LYS B O 1 ATOM 5729 C CB . LYS B 1 277 ? 31.237 24.464 41.743 1.00 57.67 ? 336 LYS B CB 1 ATOM 5730 C CG . LYS B 1 277 ? 32.627 24.845 41.262 1.00 60.86 ? 336 LYS B CG 1 ATOM 5731 C CD . LYS B 1 277 ? 32.682 24.857 39.741 1.00 63.20 ? 336 LYS B CD 1 ATOM 5732 C CE . LYS B 1 277 ? 34.039 25.308 39.225 1.00 64.36 ? 336 LYS B CE 1 ATOM 5733 N NZ . LYS B 1 277 ? 35.117 24.334 39.558 1.00 57.99 ? 336 LYS B NZ 1 ATOM 5734 N N . VAL B 1 278 ? 28.220 25.354 42.994 1.00 33.59 ? 337 VAL B N 1 ATOM 5735 C CA . VAL B 1 278 ? 26.918 24.794 43.367 1.00 52.63 ? 337 VAL B CA 1 ATOM 5736 C C . VAL B 1 278 ? 25.820 25.870 43.392 1.00 57.66 ? 337 VAL B C 1 ATOM 5737 O O . VAL B 1 278 ? 24.734 25.645 42.859 1.00 59.76 ? 337 VAL B O 1 ATOM 5738 C CB . VAL B 1 278 ? 26.980 24.008 44.724 1.00 57.11 ? 337 VAL B CB 1 ATOM 5739 C CG1 . VAL B 1 278 ? 28.330 23.335 44.885 1.00 43.63 ? 337 VAL B CG1 1 ATOM 5740 C CG2 . VAL B 1 278 ? 26.677 24.874 45.931 1.00 49.42 ? 337 VAL B CG2 1 ATOM 5741 N N . LYS B 1 279 ? 26.086 27.021 44.010 1.00 45.40 ? 338 LYS B N 1 ATOM 5742 C CA . LYS B 1 279 ? 25.116 28.111 44.040 1.00 48.82 ? 338 LYS B CA 1 ATOM 5743 C C . LYS B 1 279 ? 24.800 28.628 42.641 1.00 59.27 ? 338 LYS B C 1 ATOM 5744 O O . LYS B 1 279 ? 23.746 29.221 42.410 1.00 62.47 ? 338 LYS B O 1 ATOM 5745 C CB . LYS B 1 279 ? 25.613 29.265 44.915 1.00 50.89 ? 338 LYS B CB 1 ATOM 5746 C CG . LYS B 1 279 ? 25.347 29.089 46.404 1.00 50.79 ? 338 LYS B CG 1 ATOM 5747 C CD . LYS B 1 279 ? 25.912 30.253 47.207 1.00 33.59 ? 338 LYS B CD 1 ATOM 5748 C CE . LYS B 1 279 ? 25.480 30.188 48.665 1.00 41.17 ? 338 LYS B CE 1 ATOM 5749 N NZ . LYS B 1 279 ? 26.087 31.280 49.475 1.00 41.88 ? 338 LYS B NZ 1 ATOM 5750 N N . THR B 1 280 ? 25.717 28.393 41.708 1.00 50.38 ? 339 THR B N 1 ATOM 5751 C CA . THR B 1 280 ? 25.552 28.870 40.342 1.00 48.21 ? 339 THR B CA 1 ATOM 5752 C C . THR B 1 280 ? 24.861 27.831 39.466 1.00 53.87 ? 339 THR B C 1 ATOM 5753 O O . THR B 1 280 ? 24.541 28.099 38.308 1.00 74.21 ? 339 THR B O 1 ATOM 5754 C CB . THR B 1 280 ? 26.905 29.242 39.713 1.00 57.65 ? 339 THR B CB 1 ATOM 5755 O OG1 . THR B 1 280 ? 27.765 28.095 39.716 1.00 57.76 ? 339 THR B OG1 1 ATOM 5756 C CG2 . THR B 1 280 ? 27.564 30.363 40.501 1.00 38.02 ? 339 THR B CG2 1 ATOM 5757 N N . LYS B 1 281 ? 24.635 26.645 40.021 1.00 57.15 ? 340 LYS B N 1 ATOM 5758 C CA . LYS B 1 281 ? 23.923 25.598 39.298 1.00 63.80 ? 340 LYS B CA 1 ATOM 5759 C C . LYS B 1 281 ? 22.428 25.901 39.313 1.00 74.29 ? 340 LYS B C 1 ATOM 5760 O O . LYS B 1 281 ? 21.914 26.473 40.275 1.00 67.93 ? 340 LYS B O 1 ATOM 5761 C CB . LYS B 1 281 ? 24.201 24.220 39.902 1.00 69.09 ? 340 LYS B CB 1 ATOM 5762 C CG . LYS B 1 281 ? 25.606 23.700 39.643 1.00 71.63 ? 340 LYS B CG 1 ATOM 5763 C CD . LYS B 1 281 ? 25.918 23.581 38.157 1.00 80.29 ? 340 LYS B CD 1 ATOM 5764 C CE . LYS B 1 281 ? 25.235 22.373 37.536 1.00 87.12 ? 340 LYS B CE 1 ATOM 5765 N NZ . LYS B 1 281 ? 25.639 22.178 36.115 1.00 88.12 ? 340 LYS B NZ 1 ATOM 5766 N N . ARG B 1 282 ? 21.743 25.520 38.241 1.00 78.78 ? 341 ARG B N 1 ATOM 5767 C CA . ARG B 1 282 ? 20.309 25.758 38.098 1.00 70.89 ? 341 ARG B CA 1 ATOM 5768 C C . ARG B 1 282 ? 19.470 25.211 39.256 1.00 67.24 ? 341 ARG B C 1 ATOM 5769 O O . ARG B 1 282 ? 18.626 25.920 39.804 1.00 65.24 ? 341 ARG B O 1 ATOM 5770 C CB . ARG B 1 282 ? 19.821 25.164 36.772 1.00 80.40 ? 341 ARG B CB 1 ATOM 5771 C CG . ARG B 1 282 ? 20.669 24.006 36.263 1.00 101.76 ? 341 ARG B CG 1 ATOM 5772 C CD . ARG B 1 282 ? 20.343 23.672 34.816 1.00 112.98 ? 341 ARG B CD 1 ATOM 5773 N NE . ARG B 1 282 ? 21.229 22.644 34.276 1.00 125.93 ? 341 ARG B NE 1 ATOM 5774 C CZ . ARG B 1 282 ? 20.934 21.348 34.236 1.00 127.11 ? 341 ARG B CZ 1 ATOM 5775 N NH1 . ARG B 1 282 ? 19.770 20.917 34.701 1.00 135.13 ? 341 ARG B NH1 1 ATOM 5776 N NH2 . ARG B 1 282 ? 21.802 20.484 33.727 1.00 111.27 ? 341 ARG B NH2 1 ATOM 5777 N N . GLN B 1 283 ? 19.705 23.956 39.624 1.00 76.70 ? 342 GLN B N 1 ATOM 5778 C CA . GLN B 1 283 ? 18.924 23.295 40.671 1.00 67.45 ? 342 GLN B CA 1 ATOM 5779 C C . GLN B 1 283 ? 19.084 23.892 42.074 1.00 59.07 ? 342 GLN B C 1 ATOM 5780 O O . GLN B 1 283 ? 18.223 23.695 42.932 1.00 50.71 ? 342 GLN B O 1 ATOM 5781 C CB . GLN B 1 283 ? 19.266 21.802 40.715 1.00 79.33 ? 342 GLN B CB 1 ATOM 5782 C CG . GLN B 1 283 ? 19.061 21.075 39.393 1.00 97.20 ? 342 GLN B CG 1 ATOM 5783 C CD . GLN B 1 283 ? 20.314 21.028 38.542 1.00 99.46 ? 342 GLN B CD 1 ATOM 5784 O OE1 . GLN B 1 283 ? 21.176 21.901 38.635 1.00 94.26 ? 342 GLN B OE1 1 ATOM 5785 N NE2 . GLN B 1 283 ? 20.417 20.007 37.699 1.00 100.68 ? 342 GLN B NE2 1 ATOM 5786 N N . TYR B 1 284 ? 20.173 24.617 42.313 1.00 50.48 ? 343 TYR B N 1 ATOM 5787 C CA . TYR B 1 284 ? 20.468 25.106 43.660 1.00 51.69 ? 343 TYR B CA 1 ATOM 5788 C C . TYR B 1 284 ? 20.332 26.619 43.821 1.00 51.63 ? 343 TYR B C 1 ATOM 5789 O O . TYR B 1 284 ? 20.403 27.133 44.937 1.00 56.24 ? 343 TYR B O 1 ATOM 5790 C CB . TYR B 1 284 ? 21.879 24.683 44.079 1.00 61.37 ? 343 TYR B CB 1 ATOM 5791 C CG . TYR B 1 284 ? 22.035 23.201 44.330 1.00 60.60 ? 343 TYR B CG 1 ATOM 5792 C CD1 . TYR B 1 284 ? 22.372 22.331 43.302 1.00 58.65 ? 343 TYR B CD1 1 ATOM 5793 C CD2 . TYR B 1 284 ? 21.849 22.673 45.601 1.00 49.69 ? 343 TYR B CD2 1 ATOM 5794 C CE1 . TYR B 1 284 ? 22.517 20.974 43.532 1.00 56.71 ? 343 TYR B CE1 1 ATOM 5795 C CE2 . TYR B 1 284 ? 21.991 21.320 45.842 1.00 62.34 ? 343 TYR B CE2 1 ATOM 5796 C CZ . TYR B 1 284 ? 22.325 20.475 44.804 1.00 60.95 ? 343 TYR B CZ 1 ATOM 5797 O OH . TYR B 1 284 ? 22.467 19.126 45.040 1.00 64.13 ? 343 TYR B OH 1 ATOM 5798 N N . ALA B 1 285 ? 20.145 27.330 42.714 1.00 57.38 ? 344 ALA B N 1 ATOM 5799 C CA . ALA B 1 285 ? 20.087 28.789 42.753 1.00 62.43 ? 344 ALA B CA 1 ATOM 5800 C C . ALA B 1 285 ? 18.841 29.302 43.476 1.00 63.48 ? 344 ALA B C 1 ATOM 5801 O O . ALA B 1 285 ? 18.870 30.363 44.101 1.00 49.69 ? 344 ALA B O 1 ATOM 5802 C CB . ALA B 1 285 ? 20.144 29.353 41.342 1.00 56.85 ? 344 ALA B CB 1 ATOM 5803 N N . HIS B 1 286 ? 17.752 28.544 43.395 1.00 57.45 ? 345 HIS B N 1 ATOM 5804 C CA . HIS B 1 286 ? 16.493 28.940 44.021 1.00 45.00 ? 345 HIS B CA 1 ATOM 5805 C C . HIS B 1 286 ? 15.713 27.751 44.572 1.00 55.21 ? 345 HIS B C 1 ATOM 5806 O O . HIS B 1 286 ? 15.547 26.735 43.895 1.00 51.36 ? 345 HIS B O 1 ATOM 5807 C CB . HIS B 1 286 ? 15.617 29.710 43.029 1.00 51.48 ? 345 HIS B CB 1 ATOM 5808 C CG . HIS B 1 286 ? 16.231 30.985 42.539 1.00 61.92 ? 345 HIS B CG 1 ATOM 5809 N ND1 . HIS B 1 286 ? 16.121 32.174 43.227 1.00 60.55 ? 345 HIS B ND1 1 ATOM 5810 C CD2 . HIS B 1 286 ? 16.958 31.257 41.430 1.00 58.13 ? 345 HIS B CD2 1 ATOM 5811 C CE1 . HIS B 1 286 ? 16.755 33.124 42.563 1.00 69.09 ? 345 HIS B CE1 1 ATOM 5812 N NE2 . HIS B 1 286 ? 17.272 32.594 41.470 1.00 71.07 ? 345 HIS B NE2 1 ATOM 5813 N N . GLY B 1 287 ? 15.238 27.885 45.806 1.00 37.82 ? 346 GLY B N 1 ATOM 5814 C CA . GLY B 1 287 ? 14.415 26.861 46.421 1.00 57.96 ? 346 GLY B CA 1 ATOM 5815 C C . GLY B 1 287 ? 14.874 26.450 47.806 1.00 59.97 ? 346 GLY B C 1 ATOM 5816 O O . GLY B 1 287 ? 15.390 27.265 48.571 1.00 47.43 ? 346 GLY B O 1 ATOM 5817 N N . ARG B 1 288 ? 14.678 25.175 48.126 1.00 48.41 ? 347 ARG B N 1 ATOM 5818 C CA . ARG B 1 288 ? 15.008 24.649 49.445 1.00 60.40 ? 347 ARG B CA 1 ATOM 5819 C C . ARG B 1 288 ? 16.129 23.619 49.357 1.00 67.47 ? 347 ARG B C 1 ATOM 5820 O O . ARG B 1 288 ? 16.650 23.171 50.378 1.00 69.80 ? 347 ARG B O 1 ATOM 5821 C CB . ARG B 1 288 ? 13.773 24.025 50.099 1.00 52.61 ? 347 ARG B CB 1 ATOM 5822 C CG . ARG B 1 288 ? 13.200 22.840 49.333 1.00 51.08 ? 347 ARG B CG 1 ATOM 5823 C CD . ARG B 1 288 ? 12.101 22.140 50.121 1.00 38.46 ? 347 ARG B CD 1 ATOM 5824 N NE . ARG B 1 288 ? 12.608 21.502 51.332 1.00 51.20 ? 347 ARG B NE 1 ATOM 5825 C CZ . ARG B 1 288 ? 12.042 21.616 52.530 1.00 61.50 ? 347 ARG B CZ 1 ATOM 5826 N NH1 . ARG B 1 288 ? 10.944 22.345 52.682 1.00 50.10 ? 347 ARG B NH1 1 ATOM 5827 N NH2 . ARG B 1 288 ? 12.573 21.000 53.577 1.00 54.93 ? 347 ARG B NH2 1 ATOM 5828 N N . ARG B 1 289 ? 16.481 23.247 48.129 1.00 52.36 ? 348 ARG B N 1 ATOM 5829 C CA . ARG B 1 289 ? 17.462 22.197 47.867 1.00 49.36 ? 348 ARG B CA 1 ATOM 5830 C C . ARG B 1 289 ? 18.792 22.421 48.590 1.00 47.61 ? 348 ARG B C 1 ATOM 5831 O O . ARG B 1 289 ? 19.314 21.510 49.233 1.00 49.65 ? 348 ARG B O 1 ATOM 5832 C CB . ARG B 1 289 ? 17.705 22.074 46.358 1.00 40.00 ? 348 ARG B CB 1 ATOM 5833 C CG . ARG B 1 289 ? 18.285 20.733 45.931 1.00 61.19 ? 348 ARG B CG 1 ATOM 5834 C CD . ARG B 1 289 ? 18.636 20.712 44.448 1.00 66.13 ? 348 ARG B CD 1 ATOM 5835 N NE . ARG B 1 289 ? 17.469 20.526 43.587 1.00 76.07 ? 348 ARG B NE 1 ATOM 5836 C CZ . ARG B 1 289 ? 17.095 19.355 43.079 1.00 96.96 ? 348 ARG B CZ 1 ATOM 5837 N NH1 . ARG B 1 289 ? 17.795 18.261 43.346 1.00 113.06 ? 348 ARG B NH1 1 ATOM 5838 N NH2 . ARG B 1 289 ? 16.023 19.278 42.303 1.00 96.85 ? 348 ARG B NH2 1 ATOM 5839 N N . LEU B 1 290 ? 19.339 23.628 48.480 1.00 54.31 ? 349 LEU B N 1 ATOM 5840 C CA . LEU B 1 290 ? 20.614 23.948 49.118 1.00 46.13 ? 349 LEU B CA 1 ATOM 5841 C C . LEU B 1 290 ? 20.494 23.968 50.641 1.00 57.96 ? 349 LEU B C 1 ATOM 5842 O O . LEU B 1 290 ? 21.395 23.516 51.348 1.00 72.89 ? 349 LEU B O 1 ATOM 5843 C CB . LEU B 1 290 ? 21.147 25.290 48.614 1.00 52.57 ? 349 LEU B CB 1 ATOM 5844 C CG . LEU B 1 290 ? 22.605 25.588 48.970 1.00 52.44 ? 349 LEU B CG 1 ATOM 5845 C CD1 . LEU B 1 290 ? 23.506 24.446 48.527 1.00 58.14 ? 349 LEU B CD1 1 ATOM 5846 C CD2 . LEU B 1 290 ? 23.054 26.896 48.342 1.00 55.88 ? 349 LEU B CD2 1 ATOM 5847 N N . LEU B 1 291 ? 19.380 24.498 51.140 1.00 59.62 ? 350 LEU B N 1 ATOM 5848 C CA . LEU B 1 291 ? 19.109 24.513 52.576 1.00 48.27 ? 350 LEU B CA 1 ATOM 5849 C C . LEU B 1 291 ? 18.976 23.095 53.114 1.00 59.73 ? 350 LEU B C 1 ATOM 5850 O O . LEU B 1 291 ? 19.341 22.815 54.257 1.00 54.63 ? 350 LEU B O 1 ATOM 5851 C CB . LEU B 1 291 ? 17.843 25.315 52.884 1.00 40.94 ? 350 LEU B CB 1 ATOM 5852 C CG . LEU B 1 291 ? 17.961 26.840 52.866 1.00 56.77 ? 350 LEU B CG 1 ATOM 5853 C CD1 . LEU B 1 291 ? 16.587 27.485 52.966 1.00 42.68 ? 350 LEU B CD1 1 ATOM 5854 C CD2 . LEU B 1 291 ? 18.857 27.311 54.002 1.00 38.50 ? 350 LEU B CD2 1 ATOM 5855 N N . ASP B 1 292 ? 18.443 22.206 52.283 1.00 54.02 ? 351 ASP B N 1 ATOM 5856 C CA . ASP B 1 292 ? 18.340 20.794 52.625 1.00 49.98 ? 351 ASP B CA 1 ATOM 5857 C C . ASP B 1 292 ? 19.730 20.183 52.761 1.00 53.31 ? 351 ASP B C 1 ATOM 5858 O O . ASP B 1 292 ? 20.006 19.442 53.705 1.00 51.28 ? 351 ASP B O 1 ATOM 5859 C CB . ASP B 1 292 ? 17.534 20.041 51.566 1.00 37.14 ? 351 ASP B CB 1 ATOM 5860 C CG . ASP B 1 292 ? 16.068 20.420 51.569 1.00 52.04 ? 351 ASP B CG 1 ATOM 5861 O OD1 . ASP B 1 292 ? 15.601 20.985 52.580 1.00 41.46 ? 351 ASP B OD1 1 ATOM 5862 O OD2 . ASP B 1 292 ? 15.384 20.155 50.558 1.00 59.56 ? 351 ASP B OD2 1 ATOM 5863 N N . LEU B 1 293 ? 20.596 20.503 51.803 1.00 47.31 ? 352 LEU B N 1 ATOM 5864 C CA . LEU B 1 293 ? 21.966 20.003 51.780 1.00 43.46 ? 352 LEU B CA 1 ATOM 5865 C C . LEU B 1 293 ? 22.739 20.393 53.039 1.00 47.31 ? 352 LEU B C 1 ATOM 5866 O O . LEU B 1 293 ? 23.528 19.606 53.561 1.00 49.57 ? 352 LEU B O 1 ATOM 5867 C CB . LEU B 1 293 ? 22.689 20.514 50.532 1.00 40.24 ? 352 LEU B CB 1 ATOM 5868 C CG . LEU B 1 293 ? 24.089 19.963 50.260 1.00 42.15 ? 352 LEU B CG 1 ATOM 5869 C CD1 . LEU B 1 293 ? 24.203 19.509 48.816 1.00 48.52 ? 352 LEU B CD1 1 ATOM 5870 C CD2 . LEU B 1 293 ? 25.134 21.015 50.563 1.00 40.87 ? 352 LEU B CD2 1 ATOM 5871 N N . VAL B 1 294 ? 22.519 21.612 53.520 1.00 37.42 ? 353 VAL B N 1 ATOM 5872 C CA . VAL B 1 294 ? 23.151 22.063 54.755 1.00 49.26 ? 353 VAL B CA 1 ATOM 5873 C C . VAL B 1 294 ? 22.583 21.305 55.953 1.00 48.37 ? 353 VAL B C 1 ATOM 5874 O O . VAL B 1 294 ? 23.325 20.876 56.838 1.00 51.48 ? 353 VAL B O 1 ATOM 5875 C CB . VAL B 1 294 ? 22.965 23.580 54.966 1.00 44.71 ? 353 VAL B CB 1 ATOM 5876 C CG1 . VAL B 1 294 ? 23.446 23.993 56.348 1.00 42.00 ? 353 VAL B CG1 1 ATOM 5877 C CG2 . VAL B 1 294 ? 23.707 24.355 53.890 1.00 34.81 ? 353 VAL B CG2 1 ATOM 5878 N N . ASP B 1 295 ? 21.265 21.128 55.964 1.00 46.73 ? 354 ASP B N 1 ATOM 5879 C CA . ASP B 1 295 ? 20.590 20.404 57.038 1.00 49.43 ? 354 ASP B CA 1 ATOM 5880 C C . ASP B 1 295 ? 21.076 18.963 57.146 1.00 55.33 ? 354 ASP B C 1 ATOM 5881 O O . ASP B 1 295 ? 21.356 18.472 58.240 1.00 44.85 ? 354 ASP B O 1 ATOM 5882 C CB . ASP B 1 295 ? 19.074 20.420 56.828 1.00 47.52 ? 354 ASP B CB 1 ATOM 5883 C CG . ASP B 1 295 ? 18.396 21.571 57.543 1.00 60.07 ? 354 ASP B CG 1 ATOM 5884 O OD1 . ASP B 1 295 ? 19.069 22.259 58.338 1.00 53.78 ? 354 ASP B OD1 1 ATOM 5885 O OD2 . ASP B 1 295 ? 17.186 21.782 57.317 1.00 63.71 ? 354 ASP B OD2 1 ATOM 5886 N N . ILE B 1 296 ? 21.169 18.291 56.004 1.00 36.29 ? 355 ILE B N 1 ATOM 5887 C CA . ILE B 1 296 ? 21.538 16.882 55.973 1.00 49.16 ? 355 ILE B CA 1 ATOM 5888 C C . ILE B 1 296 ? 23.025 16.695 56.291 1.00 52.36 ? 355 ILE B C 1 ATOM 5889 O O . ILE B 1 296 ? 23.419 15.674 56.855 1.00 42.78 ? 355 ILE B O 1 ATOM 5890 C CB . ILE B 1 296 ? 21.189 16.245 54.603 1.00 36.56 ? 355 ILE B CB 1 ATOM 5891 C CG1 . ILE B 1 296 ? 21.250 14.719 54.673 1.00 48.92 ? 355 ILE B CG1 1 ATOM 5892 C CG2 . ILE B 1 296 ? 22.075 16.788 53.492 1.00 40.55 ? 355 ILE B CG2 1 ATOM 5893 C CD1 . ILE B 1 296 ? 20.768 14.049 53.407 1.00 44.82 ? 355 ILE B CD1 1 ATOM 5894 N N . HIS B 1 297 ? 23.845 17.680 55.935 1.00 44.02 ? 356 HIS B N 1 ATOM 5895 C CA . HIS B 1 297 ? 25.270 17.633 56.249 1.00 41.03 ? 356 HIS B CA 1 ATOM 5896 C C . HIS B 1 297 ? 25.531 17.964 57.715 1.00 44.29 ? 356 HIS B C 1 ATOM 5897 O O . HIS B 1 297 ? 26.534 17.535 58.285 1.00 45.33 ? 356 HIS B O 1 ATOM 5898 C CB . HIS B 1 297 ? 26.056 18.585 55.347 1.00 34.86 ? 356 HIS B CB 1 ATOM 5899 C CG . HIS B 1 297 ? 26.517 17.960 54.068 1.00 41.11 ? 356 HIS B CG 1 ATOM 5900 N ND1 . HIS B 1 297 ? 27.806 17.509 53.884 1.00 41.64 ? 356 HIS B ND1 1 ATOM 5901 C CD2 . HIS B 1 297 ? 25.860 17.705 52.912 1.00 35.03 ? 356 HIS B CD2 1 ATOM 5902 C CE1 . HIS B 1 297 ? 27.924 17.006 52.668 1.00 52.79 ? 356 HIS B CE1 1 ATOM 5903 N NE2 . HIS B 1 297 ? 26.758 17.113 52.058 1.00 45.90 ? 356 HIS B NE2 1 ATOM 5904 N N . ILE B 1 298 ? 24.632 18.735 58.319 1.00 41.63 ? 357 ILE B N 1 ATOM 5905 C CA . ILE B 1 298 ? 24.692 18.986 59.754 1.00 44.78 ? 357 ILE B CA 1 ATOM 5906 C C . ILE B 1 298 ? 24.404 17.683 60.489 1.00 54.08 ? 357 ILE B C 1 ATOM 5907 O O . ILE B 1 298 ? 25.066 17.345 61.472 1.00 50.78 ? 357 ILE B O 1 ATOM 5908 C CB . ILE B 1 298 ? 23.689 20.078 60.189 1.00 41.56 ? 357 ILE B CB 1 ATOM 5909 C CG1 . ILE B 1 298 ? 24.226 21.467 59.837 1.00 45.69 ? 357 ILE B CG1 1 ATOM 5910 C CG2 . ILE B 1 298 ? 23.407 19.995 61.682 1.00 47.81 ? 357 ILE B CG2 1 ATOM 5911 C CD1 . ILE B 1 298 ? 23.278 22.591 60.191 1.00 47.43 ? 357 ILE B CD1 1 ATOM 5912 N N . LEU B 1 299 ? 23.419 16.949 59.983 1.00 37.91 ? 358 LEU B N 1 ATOM 5913 C CA . LEU B 1 299 ? 23.057 15.647 60.525 1.00 45.41 ? 358 LEU B CA 1 ATOM 5914 C C . LEU B 1 299 ? 24.200 14.653 60.354 1.00 50.03 ? 358 LEU B C 1 ATOM 5915 O O . LEU B 1 299 ? 24.580 13.958 61.296 1.00 35.85 ? 358 LEU B O 1 ATOM 5916 C CB . LEU B 1 299 ? 21.791 15.121 59.845 1.00 36.52 ? 358 LEU B CB 1 ATOM 5917 C CG . LEU B 1 299 ? 21.274 13.753 60.294 1.00 38.87 ? 358 LEU B CG 1 ATOM 5918 C CD1 . LEU B 1 299 ? 20.771 13.812 61.726 1.00 46.09 ? 358 LEU B CD1 1 ATOM 5919 C CD2 . LEU B 1 299 ? 20.181 13.262 59.359 1.00 40.25 ? 358 LEU B CD2 1 ATOM 5920 N N . ASP B 1 300 ? 24.744 14.598 59.142 1.00 35.72 ? 359 ASP B N 1 ATOM 5921 C CA . ASP B 1 300 ? 25.833 13.682 58.817 1.00 37.23 ? 359 ASP B CA 1 ATOM 5922 C C . ASP B 1 300 ? 27.095 13.964 59.629 1.00 51.01 ? 359 ASP B C 1 ATOM 5923 O O . ASP B 1 300 ? 27.831 13.043 59.978 1.00 40.53 ? 359 ASP B O 1 ATOM 5924 C CB . ASP B 1 300 ? 26.153 13.746 57.322 1.00 35.41 ? 359 ASP B CB 1 ATOM 5925 C CG . ASP B 1 300 ? 25.102 13.060 56.470 1.00 50.29 ? 359 ASP B CG 1 ATOM 5926 O OD1 . ASP B 1 300 ? 24.325 12.249 57.017 1.00 43.04 ? 359 ASP B OD1 1 ATOM 5927 O OD2 . ASP B 1 300 ? 25.055 13.330 55.250 1.00 50.95 ? 359 ASP B OD2 1 ATOM 5928 N N . TYR B 1 301 ? 27.346 15.236 59.923 1.00 34.88 ? 360 TYR B N 1 ATOM 5929 C CA . TYR B 1 301 ? 28.520 15.608 60.705 1.00 35.05 ? 360 TYR B CA 1 ATOM 5930 C C . TYR B 1 301 ? 28.361 15.198 62.166 1.00 40.25 ? 360 TYR B C 1 ATOM 5931 O O . TYR B 1 301 ? 29.320 14.766 62.807 1.00 34.38 ? 360 TYR B O 1 ATOM 5932 C CB . TYR B 1 301 ? 28.780 17.113 60.607 1.00 43.70 ? 360 TYR B CB 1 ATOM 5933 C CG . TYR B 1 301 ? 29.935 17.585 61.461 1.00 48.80 ? 360 TYR B CG 1 ATOM 5934 C CD1 . TYR B 1 301 ? 31.245 17.270 61.123 1.00 51.61 ? 360 TYR B CD1 1 ATOM 5935 C CD2 . TYR B 1 301 ? 29.716 18.341 62.605 1.00 46.20 ? 360 TYR B CD2 1 ATOM 5936 C CE1 . TYR B 1 301 ? 32.305 17.696 61.899 1.00 46.78 ? 360 TYR B CE1 1 ATOM 5937 C CE2 . TYR B 1 301 ? 30.771 18.772 63.388 1.00 48.36 ? 360 TYR B CE2 1 ATOM 5938 C CZ . TYR B 1 301 ? 32.063 18.446 63.030 1.00 63.33 ? 360 TYR B CZ 1 ATOM 5939 O OH . TYR B 1 301 ? 33.117 18.871 63.804 1.00 57.29 ? 360 TYR B OH 1 ATOM 5940 N N . LEU B 1 302 ? 27.146 15.338 62.687 1.00 50.40 ? 361 LEU B N 1 ATOM 5941 C CA . LEU B 1 302 ? 26.843 14.943 64.060 1.00 35.07 ? 361 LEU B CA 1 ATOM 5942 C C . LEU B 1 302 ? 26.984 13.438 64.257 1.00 46.79 ? 361 LEU B C 1 ATOM 5943 O O . LEU B 1 302 ? 27.370 12.976 65.331 1.00 50.51 ? 361 LEU B O 1 ATOM 5944 C CB . LEU B 1 302 ? 25.432 15.389 64.447 1.00 36.85 ? 361 LEU B CB 1 ATOM 5945 C CG . LEU B 1 302 ? 25.236 16.879 64.729 1.00 52.17 ? 361 LEU B CG 1 ATOM 5946 C CD1 . LEU B 1 302 ? 23.754 17.222 64.779 1.00 35.68 ? 361 LEU B CD1 1 ATOM 5947 C CD2 . LEU B 1 302 ? 25.923 17.268 66.030 1.00 35.06 ? 361 LEU B CD2 1 ATOM 5948 N N . ILE B 1 303 ? 26.670 12.678 63.213 1.00 41.23 ? 362 ILE B N 1 ATOM 5949 C CA . ILE B 1 303 ? 26.711 11.222 63.282 1.00 46.74 ? 362 ILE B CA 1 ATOM 5950 C C . ILE B 1 303 ? 27.977 10.661 62.643 1.00 44.04 ? 362 ILE B C 1 ATOM 5951 O O . ILE B 1 303 ? 28.227 9.457 62.697 1.00 43.18 ? 362 ILE B O 1 ATOM 5952 C CB . ILE B 1 303 ? 25.487 10.598 62.593 1.00 41.35 ? 362 ILE B CB 1 ATOM 5953 C CG1 . ILE B 1 303 ? 25.548 10.849 61.086 1.00 35.94 ? 362 ILE B CG1 1 ATOM 5954 C CG2 . ILE B 1 303 ? 24.207 11.172 63.168 1.00 38.13 ? 362 ILE B CG2 1 ATOM 5955 C CD1 . ILE B 1 303 ? 24.257 10.545 60.357 1.00 37.01 ? 362 ILE B CD1 1 ATOM 5956 N N . GLY B 1 304 ? 28.771 11.539 62.040 1.00 34.90 ? 363 GLY B N 1 ATOM 5957 C CA . GLY B 1 304 ? 30.010 11.135 61.400 1.00 34.58 ? 363 GLY B CA 1 ATOM 5958 C C . GLY B 1 304 ? 29.812 10.360 60.111 1.00 34.72 ? 363 GLY B C 1 ATOM 5959 O O . GLY B 1 304 ? 30.657 9.550 59.732 1.00 43.54 ? 363 GLY B O 1 ATOM 5960 N N . ASN B 1 305 ? 28.695 10.606 59.432 1.00 48.82 ? 364 ASN B N 1 ATOM 5961 C CA . ASN B 1 305 ? 28.417 9.945 58.162 1.00 35.18 ? 364 ASN B CA 1 ATOM 5962 C C . ASN B 1 305 ? 29.149 10.615 57.005 1.00 44.27 ? 364 ASN B C 1 ATOM 5963 O O . ASN B 1 305 ? 28.897 11.777 56.688 1.00 43.95 ? 364 ASN B O 1 ATOM 5964 C CB . ASN B 1 305 ? 26.914 9.924 57.883 1.00 38.37 ? 364 ASN B CB 1 ATOM 5965 C CG . ASN B 1 305 ? 26.582 9.315 56.535 1.00 37.82 ? 364 ASN B CG 1 ATOM 5966 O OD1 . ASN B 1 305 ? 27.293 8.435 56.046 1.00 35.69 ? 364 ASN B OD1 1 ATOM 5967 N ND2 . ASN B 1 305 ? 25.497 9.779 55.926 1.00 41.54 ? 364 ASN B ND2 1 ATOM 5968 N N . GLN B 1 306 ? 30.051 9.871 56.377 1.00 37.10 ? 365 GLN B N 1 ATOM 5969 C CA . GLN B 1 306 ? 30.851 10.398 55.278 1.00 52.64 ? 365 GLN B CA 1 ATOM 5970 C C . GLN B 1 306 ? 30.301 9.985 53.917 1.00 34.61 ? 365 GLN B C 1 ATOM 5971 O O . GLN B 1 306 ? 30.710 10.515 52.888 1.00 47.81 ? 365 GLN B O 1 ATOM 5972 C CB . GLN B 1 306 ? 32.300 9.922 55.406 1.00 34.03 ? 365 GLN B CB 1 ATOM 5973 C CG . GLN B 1 306 ? 32.984 10.305 56.706 1.00 33.79 ? 365 GLN B CG 1 ATOM 5974 C CD . GLN B 1 306 ? 34.384 9.731 56.810 1.00 42.86 ? 365 GLN B CD 1 ATOM 5975 O OE1 . GLN B 1 306 ? 34.595 8.539 56.588 1.00 35.33 ? 365 GLN B OE1 1 ATOM 5976 N NE2 . GLN B 1 306 ? 35.351 10.577 57.145 1.00 33.08 ? 365 GLN B NE2 1 ATOM 5977 N N . ASP B 1 307 ? 29.361 9.046 53.917 1.00 41.79 ? 366 ASP B N 1 ATOM 5978 C CA . ASP B 1 307 ? 28.971 8.363 52.687 1.00 35.28 ? 366 ASP B CA 1 ATOM 5979 C C . ASP B 1 307 ? 27.753 8.984 52.000 1.00 38.59 ? 366 ASP B C 1 ATOM 5980 O O . ASP B 1 307 ? 26.930 8.273 51.424 1.00 59.92 ? 366 ASP B O 1 ATOM 5981 C CB . ASP B 1 307 ? 28.704 6.886 52.981 1.00 39.38 ? 366 ASP B CB 1 ATOM 5982 C CG . ASP B 1 307 ? 28.839 6.011 51.749 1.00 41.01 ? 366 ASP B CG 1 ATOM 5983 O OD1 . ASP B 1 307 ? 29.549 6.415 50.806 1.00 50.25 ? 366 ASP B OD1 1 ATOM 5984 O OD2 . ASP B 1 307 ? 28.233 4.919 51.726 1.00 48.11 ? 366 ASP B OD2 1 ATOM 5985 N N . ARG B 1 308 ? 27.637 10.306 52.062 1.00 38.74 ? 367 ARG B N 1 ATOM 5986 C CA . ARG B 1 308 ? 26.515 10.996 51.430 1.00 38.74 ? 367 ARG B CA 1 ATOM 5987 C C . ARG B 1 308 ? 26.859 11.372 49.988 1.00 53.59 ? 367 ARG B C 1 ATOM 5988 O O . ARG B 1 308 ? 27.205 12.518 49.696 1.00 50.57 ? 367 ARG B O 1 ATOM 5989 C CB . ARG B 1 308 ? 26.124 12.240 52.231 1.00 47.50 ? 367 ARG B CB 1 ATOM 5990 C CG . ARG B 1 308 ? 24.820 12.881 51.780 1.00 35.91 ? 367 ARG B CG 1 ATOM 5991 C CD . ARG B 1 308 ? 23.628 12.014 52.150 1.00 36.38 ? 367 ARG B CD 1 ATOM 5992 N NE . ARG B 1 308 ? 23.436 11.931 53.595 1.00 38.67 ? 367 ARG B NE 1 ATOM 5993 C CZ . ARG B 1 308 ? 22.473 11.226 54.180 1.00 49.40 ? 367 ARG B CZ 1 ATOM 5994 N NH1 . ARG B 1 308 ? 21.611 10.540 53.444 1.00 37.18 ? 367 ARG B NH1 1 ATOM 5995 N NH2 . ARG B 1 308 ? 22.372 11.209 55.502 1.00 39.00 ? 367 ARG B NH2 1 ATOM 5996 N N . HIS B 1 309 ? 26.768 10.393 49.092 1.00 48.04 ? 368 HIS B N 1 ATOM 5997 C CA . HIS B 1 309 ? 27.130 10.586 47.691 1.00 42.62 ? 368 HIS B CA 1 ATOM 5998 C C . HIS B 1 309 ? 25.930 10.958 46.826 1.00 44.97 ? 368 HIS B C 1 ATOM 5999 O O . HIS B 1 309 ? 26.075 11.626 45.803 1.00 43.45 ? 368 HIS B O 1 ATOM 6000 C CB . HIS B 1 309 ? 27.791 9.321 47.140 1.00 35.44 ? 368 HIS B CB 1 ATOM 6001 C CG . HIS B 1 309 ? 27.009 8.070 47.399 1.00 45.50 ? 368 HIS B CG 1 ATOM 6002 N ND1 . HIS B 1 309 ? 26.006 7.631 46.562 1.00 50.91 ? 368 HIS B ND1 1 ATOM 6003 C CD2 . HIS B 1 309 ? 27.080 7.167 48.406 1.00 40.06 ? 368 HIS B CD2 1 ATOM 6004 C CE1 . HIS B 1 309 ? 25.495 6.510 47.039 1.00 38.36 ? 368 HIS B CE1 1 ATOM 6005 N NE2 . HIS B 1 309 ? 26.129 6.207 48.157 1.00 50.95 ? 368 HIS B NE2 1 ATOM 6006 N N . HIS B 1 310 ? 24.748 10.513 47.237 1.00 59.01 ? 369 HIS B N 1 ATOM 6007 C CA . HIS B 1 310 ? 23.521 10.814 46.508 1.00 36.58 ? 369 HIS B CA 1 ATOM 6008 C C . HIS B 1 310 ? 22.425 11.289 47.452 1.00 45.15 ? 369 HIS B C 1 ATOM 6009 O O . HIS B 1 310 ? 22.476 11.040 48.656 1.00 45.81 ? 369 HIS B O 1 ATOM 6010 C CB . HIS B 1 310 ? 23.038 9.589 45.726 1.00 47.15 ? 369 HIS B CB 1 ATOM 6011 C CG . HIS B 1 310 ? 23.732 9.391 44.414 1.00 69.73 ? 369 HIS B CG 1 ATOM 6012 N ND1 . HIS B 1 310 ? 25.096 9.229 44.307 1.00 81.64 ? 369 HIS B ND1 1 ATOM 6013 C CD2 . HIS B 1 310 ? 23.246 9.322 43.152 1.00 72.07 ? 369 HIS B CD2 1 ATOM 6014 C CE1 . HIS B 1 310 ? 25.422 9.072 43.037 1.00 75.84 ? 369 HIS B CE1 1 ATOM 6015 N NE2 . HIS B 1 310 ? 24.317 9.125 42.314 1.00 68.96 ? 369 HIS B NE2 1 ATOM 6016 N N . PHE B 1 311 ? 21.433 11.975 46.897 1.00 59.63 ? 370 PHE B N 1 ATOM 6017 C CA . PHE B 1 311 ? 20.268 12.384 47.667 1.00 39.23 ? 370 PHE B CA 1 ATOM 6018 C C . PHE B 1 311 ? 19.022 11.677 47.165 1.00 46.65 ? 370 PHE B C 1 ATOM 6019 O O . PHE B 1 311 ? 18.904 11.363 45.981 1.00 55.28 ? 370 PHE B O 1 ATOM 6020 C CB . PHE B 1 311 ? 20.073 13.899 47.604 1.00 37.24 ? 370 PHE B CB 1 ATOM 6021 C CG . PHE B 1 311 ? 21.190 14.678 48.227 1.00 45.47 ? 370 PHE B CG 1 ATOM 6022 C CD1 . PHE B 1 311 ? 21.341 14.711 49.604 1.00 47.73 ? 370 PHE B CD1 1 ATOM 6023 C CD2 . PHE B 1 311 ? 22.086 15.382 47.442 1.00 43.16 ? 370 PHE B CD2 1 ATOM 6024 C CE1 . PHE B 1 311 ? 22.367 15.427 50.185 1.00 54.56 ? 370 PHE B CE1 1 ATOM 6025 C CE2 . PHE B 1 311 ? 23.114 16.102 48.018 1.00 40.70 ? 370 PHE B CE2 1 ATOM 6026 C CZ . PHE B 1 311 ? 23.255 16.123 49.391 1.00 46.22 ? 370 PHE B CZ 1 ATOM 6027 N N . GLU B 1 312 ? 18.094 11.426 48.078 1.00 55.14 ? 371 GLU B N 1 ATOM 6028 C CA . GLU B 1 312 ? 16.851 10.762 47.727 1.00 43.73 ? 371 GLU B CA 1 ATOM 6029 C C . GLU B 1 312 ? 15.675 11.670 48.038 1.00 51.20 ? 371 GLU B C 1 ATOM 6030 O O . GLU B 1 312 ? 15.630 12.300 49.092 1.00 51.40 ? 371 GLU B O 1 ATOM 6031 C CB . GLU B 1 312 ? 16.714 9.435 48.473 1.00 50.63 ? 371 GLU B CB 1 ATOM 6032 C CG . GLU B 1 312 ? 15.563 8.586 47.982 1.00 60.83 ? 371 GLU B CG 1 ATOM 6033 C CD . GLU B 1 312 ? 15.964 7.712 46.815 1.00 71.14 ? 371 GLU B CD 1 ATOM 6034 O OE1 . GLU B 1 312 ? 17.111 7.849 46.341 1.00 70.76 ? 371 GLU B OE1 1 ATOM 6035 O OE2 . GLU B 1 312 ? 15.133 6.900 46.366 1.00 80.73 ? 371 GLU B OE2 1 ATOM 6036 N N . SER B 1 313 ? 14.732 11.746 47.109 1.00 55.81 ? 372 SER B N 1 ATOM 6037 C CA . SER B 1 313 ? 13.585 12.623 47.276 1.00 52.44 ? 372 SER B CA 1 ATOM 6038 C C . SER B 1 313 ? 12.347 12.052 46.608 1.00 61.38 ? 372 SER B C 1 ATOM 6039 O O . SER B 1 313 ? 12.436 11.404 45.566 1.00 54.56 ? 372 SER B O 1 ATOM 6040 C CB . SER B 1 313 ? 13.888 14.010 46.705 1.00 46.68 ? 372 SER B CB 1 ATOM 6041 O OG . SER B 1 313 ? 14.857 14.685 47.488 1.00 65.00 ? 372 SER B OG 1 ATOM 6042 N N . PHE B 1 314 ? 11.191 12.296 47.213 1.00 66.22 ? 373 PHE B N 1 ATOM 6043 C CA . PHE B 1 314 ? 9.932 11.950 46.577 1.00 58.12 ? 373 PHE B CA 1 ATOM 6044 C C . PHE B 1 314 ? 9.706 12.876 45.392 1.00 67.94 ? 373 PHE B C 1 ATOM 6045 O O . PHE B 1 314 ? 10.075 14.050 45.431 1.00 65.41 ? 373 PHE B O 1 ATOM 6046 C CB . PHE B 1 314 ? 8.762 12.048 47.559 1.00 41.12 ? 373 PHE B CB 1 ATOM 6047 C CG . PHE B 1 314 ? 8.827 11.059 48.689 1.00 48.96 ? 373 PHE B CG 1 ATOM 6048 C CD1 . PHE B 1 314 ? 8.767 9.697 48.438 1.00 43.82 ? 373 PHE B CD1 1 ATOM 6049 C CD2 . PHE B 1 314 ? 8.929 11.489 50.001 1.00 48.12 ? 373 PHE B CD2 1 ATOM 6050 C CE1 . PHE B 1 314 ? 8.818 8.783 49.474 1.00 43.90 ? 373 PHE B CE1 1 ATOM 6051 C CE2 . PHE B 1 314 ? 8.980 10.580 51.042 1.00 45.64 ? 373 PHE B CE2 1 ATOM 6052 C CZ . PHE B 1 314 ? 8.925 9.225 50.777 1.00 49.69 ? 373 PHE B CZ 1 ATOM 6053 N N . ASN B 1 315 ? 9.106 12.344 44.336 1.00 74.62 ? 374 ASN B N 1 ATOM 6054 C CA . ASN B 1 315 ? 8.752 13.154 43.184 1.00 77.78 ? 374 ASN B CA 1 ATOM 6055 C C . ASN B 1 315 ? 7.277 12.953 42.893 1.00 71.06 ? 374 ASN B C 1 ATOM 6056 O O . ASN B 1 315 ? 6.900 12.383 41.870 1.00 68.42 ? 374 ASN B O 1 ATOM 6057 C CB . ASN B 1 315 ? 9.604 12.776 41.970 1.00 69.72 ? 374 ASN B CB 1 ATOM 6058 C CG . ASN B 1 315 ? 9.514 13.796 40.854 1.00 70.73 ? 374 ASN B CG 1 ATOM 6059 O OD1 . ASN B 1 315 ? 9.150 14.951 41.080 1.00 63.12 ? 374 ASN B OD1 1 ATOM 6060 N ND2 . ASN B 1 315 ? 9.845 13.374 39.640 1.00 65.85 ? 374 ASN B ND2 1 ATOM 6061 N N . VAL B 1 316 ? 6.445 13.445 43.805 1.00 61.58 ? 375 VAL B N 1 ATOM 6062 C CA . VAL B 1 316 ? 5.028 13.121 43.799 1.00 78.23 ? 375 VAL B CA 1 ATOM 6063 C C . VAL B 1 316 ? 4.164 14.359 44.031 1.00 82.24 ? 375 VAL B C 1 ATOM 6064 O O . VAL B 1 316 ? 3.027 14.424 43.561 1.00 82.95 ? 375 VAL B O 1 ATOM 6065 C CB . VAL B 1 316 ? 4.702 12.048 44.871 1.00 67.82 ? 375 VAL B CB 1 ATOM 6066 C CG1 . VAL B 1 316 ? 4.991 12.571 46.276 1.00 56.50 ? 375 VAL B CG1 1 ATOM 6067 C CG2 . VAL B 1 316 ? 3.259 11.572 44.749 1.00 71.49 ? 375 VAL B CG2 1 ATOM 6068 N N . PHE B 1 317 ? 4.701 15.352 44.734 1.00 71.63 ? 376 PHE B N 1 ATOM 6069 C CA . PHE B 1 317 ? 3.940 16.574 44.934 1.00 69.25 ? 376 PHE B CA 1 ATOM 6070 C C . PHE B 1 317 ? 4.177 17.481 43.739 1.00 84.52 ? 376 PHE B C 1 ATOM 6071 O O . PHE B 1 317 ? 5.180 18.191 43.672 1.00 94.56 ? 376 PHE B O 1 ATOM 6072 C CB . PHE B 1 317 ? 4.352 17.272 46.232 1.00 67.49 ? 376 PHE B CB 1 ATOM 6073 C CG . PHE B 1 317 ? 4.084 16.463 47.469 1.00 85.14 ? 376 PHE B CG 1 ATOM 6074 C CD1 . PHE B 1 317 ? 5.112 15.782 48.100 1.00 83.93 ? 376 PHE B CD1 1 ATOM 6075 C CD2 . PHE B 1 317 ? 2.805 16.371 47.992 1.00 81.45 ? 376 PHE B CD2 1 ATOM 6076 C CE1 . PHE B 1 317 ? 4.872 15.031 49.234 1.00 79.42 ? 376 PHE B CE1 1 ATOM 6077 C CE2 . PHE B 1 317 ? 2.558 15.622 49.128 1.00 84.54 ? 376 PHE B CE2 1 ATOM 6078 C CZ . PHE B 1 317 ? 3.593 14.950 49.749 1.00 87.60 ? 376 PHE B CZ 1 ATOM 6079 N N . ASN B 1 318 ? 3.243 17.440 42.795 1.00 99.65 ? 377 ASN B N 1 ATOM 6080 C CA . ASN B 1 318 ? 3.352 18.208 41.563 1.00 110.74 ? 377 ASN B CA 1 ATOM 6081 C C . ASN B 1 318 ? 3.438 19.708 41.831 1.00 106.95 ? 377 ASN B C 1 ATOM 6082 O O . ASN B 1 318 ? 2.786 20.217 42.745 1.00 99.42 ? 377 ASN B O 1 ATOM 6083 C CB . ASN B 1 318 ? 2.179 17.893 40.634 1.00 122.97 ? 377 ASN B CB 1 ATOM 6084 C CG . ASN B 1 318 ? 2.479 18.230 39.186 1.00 134.12 ? 377 ASN B CG 1 ATOM 6085 O OD1 . ASN B 1 318 ? 3.641 18.302 38.784 1.00 137.40 ? 377 ASN B OD1 1 ATOM 6086 N ND2 . ASN B 1 318 ? 1.433 18.417 38.389 1.00 133.19 ? 377 ASN B ND2 1 ATOM 6087 N N . ASP B 1 319 ? 4.259 20.398 41.043 1.00 111.28 ? 378 ASP B N 1 ATOM 6088 C CA . ASP B 1 319 ? 4.395 21.858 41.096 1.00 111.65 ? 378 ASP B CA 1 ATOM 6089 C C . ASP B 1 319 ? 4.940 22.398 42.422 1.00 102.82 ? 378 ASP B C 1 ATOM 6090 O O . ASP B 1 319 ? 4.963 23.610 42.639 1.00 111.82 ? 378 ASP B O 1 ATOM 6091 C CB . ASP B 1 319 ? 3.047 22.518 40.789 1.00 114.40 ? 378 ASP B CB 1 ATOM 6092 C CG . ASP B 1 319 ? 2.628 22.341 39.344 1.00 116.29 ? 378 ASP B CG 1 ATOM 6093 O OD1 . ASP B 1 319 ? 3.511 22.107 38.493 1.00 100.92 ? 378 ASP B OD1 1 ATOM 6094 O OD2 . ASP B 1 319 ? 1.415 22.435 39.059 1.00 131.61 ? 378 ASP B OD2 1 ATOM 6095 N N . LEU B 1 320 ? 5.371 21.504 43.305 1.00 88.31 ? 379 LEU B N 1 ATOM 6096 C CA . LEU B 1 320 ? 5.966 21.904 44.578 1.00 82.69 ? 379 LEU B CA 1 ATOM 6097 C C . LEU B 1 320 ? 7.398 21.387 44.663 1.00 73.07 ? 379 LEU B C 1 ATOM 6098 O O . LEU B 1 320 ? 7.725 20.363 44.061 1.00 69.58 ? 379 LEU B O 1 ATOM 6099 C CB . LEU B 1 320 ? 5.139 21.392 45.761 1.00 73.28 ? 379 LEU B CB 1 ATOM 6100 C CG . LEU B 1 320 ? 3.689 21.869 45.867 1.00 75.00 ? 379 LEU B CG 1 ATOM 6101 C CD1 . LEU B 1 320 ? 3.117 21.499 47.224 1.00 68.76 ? 379 LEU B CD1 1 ATOM 6102 C CD2 . LEU B 1 320 ? 3.606 23.370 45.643 1.00 71.98 ? 379 LEU B CD2 1 ATOM 6103 N N . PRO B 1 321 ? 8.259 22.090 45.415 1.00 68.28 ? 380 PRO B N 1 ATOM 6104 C CA . PRO B 1 321 ? 9.651 21.641 45.522 1.00 67.63 ? 380 PRO B CA 1 ATOM 6105 C C . PRO B 1 321 ? 9.808 20.444 46.452 1.00 62.85 ? 380 PRO B C 1 ATOM 6106 O O . PRO B 1 321 ? 9.163 20.377 47.499 1.00 64.15 ? 380 PRO B O 1 ATOM 6107 C CB . PRO B 1 321 ? 10.368 22.869 46.087 1.00 57.62 ? 380 PRO B CB 1 ATOM 6108 C CG . PRO B 1 321 ? 9.317 23.586 46.865 1.00 52.97 ? 380 PRO B CG 1 ATOM 6109 C CD . PRO B 1 321 ? 8.032 23.369 46.111 1.00 52.13 ? 380 PRO B CD 1 ATOM 6110 N N . SER B 1 322 ? 10.664 19.508 46.058 1.00 63.36 ? 381 SER B N 1 ATOM 6111 C CA . SER B 1 322 ? 10.943 18.323 46.860 1.00 55.84 ? 381 SER B CA 1 ATOM 6112 C C . SER B 1 322 ? 12.013 18.593 47.910 1.00 68.69 ? 381 SER B C 1 ATOM 6113 O O . SER B 1 322 ? 12.706 19.609 47.861 1.00 66.82 ? 381 SER B O 1 ATOM 6114 C CB . SER B 1 322 ? 11.374 17.161 45.961 1.00 48.34 ? 381 SER B CB 1 ATOM 6115 O OG . SER B 1 322 ? 12.444 17.543 45.115 1.00 61.65 ? 381 SER B OG 1 ATOM 6116 N N . TYR B 1 323 ? 12.137 17.674 48.860 1.00 59.48 ? 382 TYR B N 1 ATOM 6117 C CA . TYR B 1 323 ? 13.159 17.767 49.892 1.00 58.27 ? 382 TYR B CA 1 ATOM 6118 C C . TYR B 1 323 ? 13.956 16.471 49.926 1.00 58.08 ? 382 TYR B C 1 ATOM 6119 O O . TYR B 1 323 ? 13.468 15.427 49.497 1.00 61.03 ? 382 TYR B O 1 ATOM 6120 C CB . TYR B 1 323 ? 12.535 18.044 51.262 1.00 50.32 ? 382 TYR B CB 1 ATOM 6121 C CG . TYR B 1 323 ? 11.489 17.032 51.680 1.00 56.65 ? 382 TYR B CG 1 ATOM 6122 C CD1 . TYR B 1 323 ? 11.854 15.832 52.278 1.00 46.05 ? 382 TYR B CD1 1 ATOM 6123 C CD2 . TYR B 1 323 ? 10.137 17.279 51.483 1.00 66.26 ? 382 TYR B CD2 1 ATOM 6124 C CE1 . TYR B 1 323 ? 10.906 14.905 52.662 1.00 61.17 ? 382 TYR B CE1 1 ATOM 6125 C CE2 . TYR B 1 323 ? 9.179 16.357 51.866 1.00 69.10 ? 382 TYR B CE2 1 ATOM 6126 C CZ . TYR B 1 323 ? 9.570 15.173 52.454 1.00 63.79 ? 382 TYR B CZ 1 ATOM 6127 O OH . TYR B 1 323 ? 8.625 14.250 52.837 1.00 52.73 ? 382 TYR B OH 1 ATOM 6128 N N . ALA B 1 324 ? 15.176 16.535 50.445 1.00 55.77 ? 383 ALA B N 1 ATOM 6129 C CA . ALA B 1 324 ? 16.020 15.351 50.518 1.00 53.54 ? 383 ALA B CA 1 ATOM 6130 C C . ALA B 1 324 ? 15.564 14.428 51.640 1.00 50.20 ? 383 ALA B C 1 ATOM 6131 O O . ALA B 1 324 ? 15.445 14.847 52.791 1.00 49.48 ? 383 ALA B O 1 ATOM 6132 C CB . ALA B 1 324 ? 17.475 15.748 50.715 1.00 50.03 ? 383 ALA B CB 1 ATOM 6133 N N . ILE B 1 325 ? 15.301 13.171 51.298 1.00 51.63 ? 384 ILE B N 1 ATOM 6134 C CA . ILE B 1 325 ? 14.946 12.174 52.298 1.00 43.93 ? 384 ILE B CA 1 ATOM 6135 C C . ILE B 1 325 ? 16.205 11.726 53.028 1.00 48.10 ? 384 ILE B C 1 ATOM 6136 O O . ILE B 1 325 ? 17.162 11.263 52.408 1.00 51.50 ? 384 ILE B O 1 ATOM 6137 C CB . ILE B 1 325 ? 14.247 10.950 51.675 1.00 58.61 ? 384 ILE B CB 1 ATOM 6138 C CG1 . ILE B 1 325 ? 13.021 11.384 50.868 1.00 56.25 ? 384 ILE B CG1 1 ATOM 6139 C CG2 . ILE B 1 325 ? 13.850 9.956 52.756 1.00 50.63 ? 384 ILE B CG2 1 ATOM 6140 C CD1 . ILE B 1 325 ? 12.433 10.281 50.014 1.00 43.94 ? 384 ILE B CD1 1 ATOM 6141 N N . HIS B 1 326 ? 16.200 11.866 54.348 1.00 46.28 ? 385 HIS B N 1 ATOM 6142 C CA . HIS B 1 326 ? 17.351 11.491 55.156 1.00 38.39 ? 385 HIS B CA 1 ATOM 6143 C C . HIS B 1 326 ? 17.449 9.974 55.255 1.00 41.73 ? 385 HIS B C 1 ATOM 6144 O O . HIS B 1 326 ? 16.850 9.353 56.132 1.00 41.15 ? 385 HIS B O 1 ATOM 6145 C CB . HIS B 1 326 ? 17.263 12.132 56.541 1.00 45.04 ? 385 HIS B CB 1 ATOM 6146 C CG . HIS B 1 326 ? 17.286 13.629 56.512 1.00 52.65 ? 385 HIS B CG 1 ATOM 6147 N ND1 . HIS B 1 326 ? 17.036 14.401 57.625 1.00 57.72 ? 385 HIS B ND1 1 ATOM 6148 C CD2 . HIS B 1 326 ? 17.538 14.496 55.502 1.00 52.03 ? 385 HIS B CD2 1 ATOM 6149 C CE1 . HIS B 1 326 ? 17.129 15.679 57.302 1.00 48.18 ? 385 HIS B CE1 1 ATOM 6150 N NE2 . HIS B 1 326 ? 17.433 15.764 56.020 1.00 56.83 ? 385 HIS B NE2 1 ATOM 6151 N N . LEU B 1 327 ? 18.210 9.394 54.331 1.00 53.97 ? 386 LEU B N 1 ATOM 6152 C CA . LEU B 1 327 ? 18.341 7.947 54.205 1.00 53.22 ? 386 LEU B CA 1 ATOM 6153 C C . LEU B 1 327 ? 19.805 7.503 54.293 1.00 45.24 ? 386 LEU B C 1 ATOM 6154 O O . LEU B 1 327 ? 20.708 8.338 54.364 1.00 44.09 ? 386 LEU B O 1 ATOM 6155 C CB . LEU B 1 327 ? 17.715 7.496 52.877 1.00 49.62 ? 386 LEU B CB 1 ATOM 6156 C CG . LEU B 1 327 ? 17.436 6.021 52.579 1.00 61.32 ? 386 LEU B CG 1 ATOM 6157 C CD1 . LEU B 1 327 ? 16.799 5.334 53.773 1.00 71.78 ? 386 LEU B CD1 1 ATOM 6158 C CD2 . LEU B 1 327 ? 16.551 5.895 51.346 1.00 57.64 ? 386 LEU B CD2 1 ATOM 6159 N N . ASP B 1 328 ? 20.021 6.188 54.289 1.00 43.83 ? 387 ASP B N 1 ATOM 6160 C CA . ASP B 1 328 ? 21.353 5.584 54.247 1.00 43.35 ? 387 ASP B CA 1 ATOM 6161 C C . ASP B 1 328 ? 22.283 6.082 55.349 1.00 37.55 ? 387 ASP B C 1 ATOM 6162 O O . ASP B 1 328 ? 23.230 6.823 55.086 1.00 37.63 ? 387 ASP B O 1 ATOM 6163 C CB . ASP B 1 328 ? 22.000 5.832 52.882 1.00 39.74 ? 387 ASP B CB 1 ATOM 6164 C CG . ASP B 1 328 ? 21.253 5.153 51.752 1.00 57.14 ? 387 ASP B CG 1 ATOM 6165 O OD1 . ASP B 1 328 ? 20.478 4.215 52.030 1.00 64.56 ? 387 ASP B OD1 1 ATOM 6166 O OD2 . ASP B 1 328 ? 21.441 5.559 50.586 1.00 71.75 ? 387 ASP B OD2 1 ATOM 6167 N N . HIS B 1 329 ? 22.007 5.671 56.582 1.00 37.69 ? 388 HIS B N 1 ATOM 6168 C CA . HIS B 1 329 ? 22.820 6.082 57.720 1.00 46.53 ? 388 HIS B CA 1 ATOM 6169 C C . HIS B 1 329 ? 23.593 4.910 58.317 1.00 54.41 ? 388 HIS B C 1 ATOM 6170 O O . HIS B 1 329 ? 24.074 4.987 59.446 1.00 37.12 ? 388 HIS B O 1 ATOM 6171 C CB . HIS B 1 329 ? 21.943 6.729 58.790 1.00 37.58 ? 388 HIS B CB 1 ATOM 6172 C CG . HIS B 1 329 ? 21.148 7.894 58.291 1.00 45.28 ? 388 HIS B CG 1 ATOM 6173 N ND1 . HIS B 1 329 ? 19.774 7.949 58.376 1.00 40.55 ? 388 HIS B ND1 1 ATOM 6174 C CD2 . HIS B 1 329 ? 21.535 9.049 57.702 1.00 37.40 ? 388 HIS B CD2 1 ATOM 6175 C CE1 . HIS B 1 329 ? 19.349 9.088 57.861 1.00 52.48 ? 388 HIS B CE1 1 ATOM 6176 N NE2 . HIS B 1 329 ? 20.398 9.774 57.444 1.00 44.46 ? 388 HIS B NE2 1 ATOM 6177 N N . GLY B 1 330 ? 23.705 3.827 57.552 1.00 37.38 ? 389 GLY B N 1 ATOM 6178 C CA . GLY B 1 330 ? 24.393 2.631 58.006 1.00 37.31 ? 389 GLY B CA 1 ATOM 6179 C C . GLY B 1 330 ? 25.849 2.850 58.374 1.00 37.31 ? 389 GLY B C 1 ATOM 6180 O O . GLY B 1 330 ? 26.399 2.141 59.218 1.00 38.82 ? 389 GLY B O 1 ATOM 6181 N N . ARG B 1 331 ? 26.475 3.836 57.740 1.00 36.49 ? 390 ARG B N 1 ATOM 6182 C CA . ARG B 1 331 ? 27.886 4.120 57.973 1.00 39.76 ? 390 ARG B CA 1 ATOM 6183 C C . ARG B 1 331 ? 28.082 5.312 58.906 1.00 37.65 ? 390 ARG B C 1 ATOM 6184 O O . ARG B 1 331 ? 29.071 6.037 58.804 1.00 45.06 ? 390 ARG B O 1 ATOM 6185 C CB . ARG B 1 331 ? 28.603 4.358 56.643 1.00 35.75 ? 390 ARG B CB 1 ATOM 6186 C CG . ARG B 1 331 ? 29.136 3.083 56.013 1.00 35.72 ? 390 ARG B CG 1 ATOM 6187 C CD . ARG B 1 331 ? 29.441 3.253 54.536 1.00 43.78 ? 390 ARG B CD 1 ATOM 6188 N NE . ARG B 1 331 ? 30.027 2.039 53.973 1.00 39.95 ? 390 ARG B NE 1 ATOM 6189 C CZ . ARG B 1 331 ? 30.215 1.826 52.675 1.00 47.75 ? 390 ARG B CZ 1 ATOM 6190 N NH1 . ARG B 1 331 ? 29.863 2.748 51.790 1.00 48.80 ? 390 ARG B NH1 1 ATOM 6191 N NH2 . ARG B 1 331 ? 30.758 0.690 52.262 1.00 50.96 ? 390 ARG B NH2 1 ATOM 6192 N N . ALA B 1 332 ? 27.129 5.512 59.810 1.00 38.11 ? 391 ALA B N 1 ATOM 6193 C CA . ALA B 1 332 ? 27.231 6.561 60.818 1.00 35.94 ? 391 ALA B CA 1 ATOM 6194 C C . ALA B 1 332 ? 27.727 6.001 62.149 1.00 41.11 ? 391 ALA B C 1 ATOM 6195 O O . ALA B 1 332 ? 27.712 4.788 62.363 1.00 38.90 ? 391 ALA B O 1 ATOM 6196 C CB . ALA B 1 332 ? 25.891 7.248 61.003 1.00 36.28 ? 391 ALA B CB 1 ATOM 6197 N N . PHE B 1 333 ? 28.170 6.897 63.030 1.00 35.63 ? 392 PHE B N 1 ATOM 6198 C CA . PHE B 1 333 ? 28.599 6.541 64.384 1.00 48.41 ? 392 PHE B CA 1 ATOM 6199 C C . PHE B 1 333 ? 29.735 5.523 64.398 1.00 37.12 ? 392 PHE B C 1 ATOM 6200 O O . PHE B 1 333 ? 29.776 4.643 65.258 1.00 35.72 ? 392 PHE B O 1 ATOM 6201 C CB . PHE B 1 333 ? 27.418 6.005 65.197 1.00 35.98 ? 392 PHE B CB 1 ATOM 6202 C CG . PHE B 1 333 ? 26.330 7.012 65.421 1.00 37.32 ? 392 PHE B CG 1 ATOM 6203 C CD1 . PHE B 1 333 ? 26.451 7.971 66.412 1.00 49.70 ? 392 PHE B CD1 1 ATOM 6204 C CD2 . PHE B 1 333 ? 25.184 6.998 64.645 1.00 47.12 ? 392 PHE B CD2 1 ATOM 6205 C CE1 . PHE B 1 333 ? 25.452 8.901 66.623 1.00 43.52 ? 392 PHE B CE1 1 ATOM 6206 C CE2 . PHE B 1 333 ? 24.180 7.924 64.851 1.00 46.01 ? 392 PHE B CE2 1 ATOM 6207 C CZ . PHE B 1 333 ? 24.314 8.876 65.842 1.00 37.78 ? 392 PHE B CZ 1 ATOM 6208 N N . GLY B 1 334 ? 30.653 5.643 63.446 1.00 41.76 ? 393 GLY B N 1 ATOM 6209 C CA . GLY B 1 334 ? 31.781 4.735 63.368 1.00 34.76 ? 393 GLY B CA 1 ATOM 6210 C C . GLY B 1 334 ? 32.918 5.082 64.311 1.00 49.28 ? 393 GLY B C 1 ATOM 6211 O O . GLY B 1 334 ? 33.665 4.203 64.741 1.00 47.32 ? 393 GLY B O 1 ATOM 6212 N N . ARG B 1 335 ? 33.051 6.366 64.634 1.00 34.22 ? 394 ARG B N 1 ATOM 6213 C CA . ARG B 1 335 ? 34.144 6.833 65.482 1.00 41.02 ? 394 ARG B CA 1 ATOM 6214 C C . ARG B 1 335 ? 33.650 7.819 66.533 1.00 40.50 ? 394 ARG B C 1 ATOM 6215 O O . ARG B 1 335 ? 32.914 8.754 66.223 1.00 51.56 ? 394 ARG B O 1 ATOM 6216 C CB . ARG B 1 335 ? 35.246 7.479 64.639 1.00 38.10 ? 394 ARG B CB 1 ATOM 6217 C CG . ARG B 1 335 ? 35.832 6.568 63.574 1.00 47.75 ? 394 ARG B CG 1 ATOM 6218 C CD . ARG B 1 335 ? 36.986 5.746 64.128 1.00 46.32 ? 394 ARG B CD 1 ATOM 6219 N NE . ARG B 1 335 ? 38.106 6.577 64.554 1.00 47.49 ? 394 ARG B NE 1 ATOM 6220 C CZ . ARG B 1 335 ? 39.021 7.079 63.730 1.00 42.16 ? 394 ARG B CZ 1 ATOM 6221 N NH1 . ARG B 1 335 ? 38.951 6.833 62.430 1.00 59.09 ? 394 ARG B NH1 1 ATOM 6222 N NH2 . ARG B 1 335 ? 40.008 7.824 64.208 1.00 48.62 ? 394 ARG B NH2 1 ATOM 6223 N N . SER B 1 336 ? 34.063 7.603 67.778 1.00 37.49 ? 395 SER B N 1 ATOM 6224 C CA . SER B 1 336 ? 33.679 8.479 68.880 1.00 40.04 ? 395 SER B CA 1 ATOM 6225 C C . SER B 1 336 ? 34.779 9.483 69.206 1.00 42.60 ? 395 SER B C 1 ATOM 6226 O O . SER B 1 336 ? 34.555 10.443 69.943 1.00 54.75 ? 395 SER B O 1 ATOM 6227 C CB . SER B 1 336 ? 33.342 7.655 70.123 1.00 48.69 ? 395 SER B CB 1 ATOM 6228 O OG . SER B 1 336 ? 34.494 7.001 70.627 1.00 46.16 ? 395 SER B OG 1 ATOM 6229 N N . ASP B 1 337 ? 35.968 9.253 68.659 1.00 43.86 ? 396 ASP B N 1 ATOM 6230 C CA . ASP B 1 337 ? 37.127 10.079 68.974 1.00 44.30 ? 396 ASP B CA 1 ATOM 6231 C C . ASP B 1 337 ? 37.576 10.896 67.768 1.00 53.79 ? 396 ASP B C 1 ATOM 6232 O O . ASP B 1 337 ? 38.644 11.508 67.786 1.00 51.48 ? 396 ASP B O 1 ATOM 6233 C CB . ASP B 1 337 ? 38.286 9.211 69.469 1.00 39.99 ? 396 ASP B CB 1 ATOM 6234 C CG . ASP B 1 337 ? 38.762 8.221 68.421 1.00 55.53 ? 396 ASP B CG 1 ATOM 6235 O OD1 . ASP B 1 337 ? 37.983 7.909 67.496 1.00 68.72 ? 396 ASP B OD1 1 ATOM 6236 O OD2 . ASP B 1 337 ? 39.919 7.760 68.518 1.00 70.26 ? 396 ASP B OD2 1 ATOM 6237 N N . PHE B 1 338 ? 36.758 10.906 66.722 1.00 39.58 ? 397 PHE B N 1 ATOM 6238 C CA . PHE B 1 338 ? 37.117 11.604 65.494 1.00 41.57 ? 397 PHE B CA 1 ATOM 6239 C C . PHE B 1 338 ? 35.944 12.348 64.867 1.00 37.61 ? 397 PHE B C 1 ATOM 6240 O O . PHE B 1 338 ? 34.882 11.773 64.628 1.00 52.62 ? 397 PHE B O 1 ATOM 6241 C CB . PHE B 1 338 ? 37.698 10.614 64.482 1.00 47.94 ? 397 PHE B CB 1 ATOM 6242 C CG . PHE B 1 338 ? 37.845 11.178 63.098 1.00 48.89 ? 397 PHE B CG 1 ATOM 6243 C CD1 . PHE B 1 338 ? 38.687 12.251 62.856 1.00 51.85 ? 397 PHE B CD1 1 ATOM 6244 C CD2 . PHE B 1 338 ? 37.141 10.633 62.037 1.00 37.56 ? 397 PHE B CD2 1 ATOM 6245 C CE1 . PHE B 1 338 ? 38.822 12.771 61.583 1.00 31.94 ? 397 PHE B CE1 1 ATOM 6246 C CE2 . PHE B 1 338 ? 37.273 11.147 60.761 1.00 32.51 ? 397 PHE B CE2 1 ATOM 6247 C CZ . PHE B 1 338 ? 38.115 12.218 60.534 1.00 37.09 ? 397 PHE B CZ 1 ATOM 6248 N N . ASP B 1 339 ? 36.149 13.635 64.605 1.00 40.49 ? 398 ASP B N 1 ATOM 6249 C CA . ASP B 1 339 ? 35.171 14.440 63.886 1.00 41.49 ? 398 ASP B CA 1 ATOM 6250 C C . ASP B 1 339 ? 35.698 14.764 62.493 1.00 41.46 ? 398 ASP B C 1 ATOM 6251 O O . ASP B 1 339 ? 36.765 15.361 62.349 1.00 61.79 ? 398 ASP B O 1 ATOM 6252 C CB . ASP B 1 339 ? 34.856 15.731 64.647 1.00 32.75 ? 398 ASP B CB 1 ATOM 6253 C CG . ASP B 1 339 ? 34.569 15.489 66.115 1.00 49.89 ? 398 ASP B CG 1 ATOM 6254 O OD1 . ASP B 1 339 ? 34.054 14.403 66.453 1.00 45.69 ? 398 ASP B OD1 1 ATOM 6255 O OD2 . ASP B 1 339 ? 34.855 16.389 66.932 1.00 44.98 ? 398 ASP B OD2 1 ATOM 6256 N N . ASP B 1 340 ? 34.954 14.364 61.468 1.00 51.70 ? 399 ASP B N 1 ATOM 6257 C CA . ASP B 1 340 ? 35.359 14.631 60.094 1.00 32.70 ? 399 ASP B CA 1 ATOM 6258 C C . ASP B 1 340 ? 34.769 15.959 59.637 1.00 32.73 ? 399 ASP B C 1 ATOM 6259 O O . ASP B 1 340 ? 33.644 16.015 59.141 1.00 38.39 ? 399 ASP B O 1 ATOM 6260 C CB . ASP B 1 340 ? 34.921 13.494 59.168 1.00 39.97 ? 399 ASP B CB 1 ATOM 6261 C CG . ASP B 1 340 ? 35.405 13.683 57.742 1.00 42.29 ? 399 ASP B CG 1 ATOM 6262 O OD1 . ASP B 1 340 ? 36.365 14.451 57.532 1.00 44.79 ? 399 ASP B OD1 1 ATOM 6263 O OD2 . ASP B 1 340 ? 34.825 13.057 56.830 1.00 47.91 ? 399 ASP B OD2 1 ATOM 6264 N N . ASP B 1 341 ? 35.546 17.024 59.808 1.00 37.31 ? 400 ASP B N 1 ATOM 6265 C CA . ASP B 1 341 ? 35.103 18.382 59.506 1.00 49.54 ? 400 ASP B CA 1 ATOM 6266 C C . ASP B 1 341 ? 34.848 18.620 58.020 1.00 43.94 ? 400 ASP B C 1 ATOM 6267 O O . ASP B 1 341 ? 34.260 19.633 57.642 1.00 49.65 ? 400 ASP B O 1 ATOM 6268 C CB . ASP B 1 341 ? 36.128 19.389 60.024 1.00 44.53 ? 400 ASP B CB 1 ATOM 6269 C CG . ASP B 1 341 ? 36.280 19.339 61.530 1.00 64.25 ? 400 ASP B CG 1 ATOM 6270 O OD1 . ASP B 1 341 ? 37.415 19.509 62.022 1.00 65.79 ? 400 ASP B OD1 1 ATOM 6271 O OD2 . ASP B 1 341 ? 35.263 19.123 62.224 1.00 67.30 ? 400 ASP B OD2 1 ATOM 6272 N N . ASP B 1 342 ? 35.297 17.692 57.182 1.00 32.42 ? 401 ASP B N 1 ATOM 6273 C CA . ASP B 1 342 ? 35.019 17.760 55.751 1.00 40.69 ? 401 ASP B CA 1 ATOM 6274 C C . ASP B 1 342 ? 33.519 17.665 55.481 1.00 45.45 ? 401 ASP B C 1 ATOM 6275 O O . ASP B 1 342 ? 33.020 18.208 54.496 1.00 45.56 ? 401 ASP B O 1 ATOM 6276 C CB . ASP B 1 342 ? 35.755 16.647 55.003 1.00 39.27 ? 401 ASP B CB 1 ATOM 6277 C CG . ASP B 1 342 ? 37.175 17.029 54.637 1.00 41.86 ? 401 ASP B CG 1 ATOM 6278 O OD1 . ASP B 1 342 ? 37.703 17.999 55.221 1.00 44.95 ? 401 ASP B OD1 1 ATOM 6279 O OD2 . ASP B 1 342 ? 37.762 16.360 53.761 1.00 42.82 ? 401 ASP B OD2 1 ATOM 6280 N N . ILE B 1 343 ? 32.809 16.965 56.361 1.00 33.17 ? 402 ILE B N 1 ATOM 6281 C CA . ILE B 1 343 ? 31.374 16.754 56.209 1.00 45.10 ? 402 ILE B CA 1 ATOM 6282 C C . ILE B 1 343 ? 30.568 18.042 56.398 1.00 47.11 ? 402 ILE B C 1 ATOM 6283 O O . ILE B 1 343 ? 29.580 18.273 55.699 1.00 42.67 ? 402 ILE B O 1 ATOM 6284 C CB . ILE B 1 343 ? 30.867 15.690 57.208 1.00 45.71 ? 402 ILE B CB 1 ATOM 6285 C CG1 . ILE B 1 343 ? 31.614 14.371 57.005 1.00 51.35 ? 402 ILE B CG1 1 ATOM 6286 C CG2 . ILE B 1 343 ? 29.368 15.480 57.067 1.00 38.59 ? 402 ILE B CG2 1 ATOM 6287 C CD1 . ILE B 1 343 ? 31.392 13.371 58.117 1.00 33.93 ? 402 ILE B CD1 1 ATOM 6288 N N . ILE B 1 344 ? 30.999 18.885 57.332 1.00 43.67 ? 403 ILE B N 1 ATOM 6289 C CA . ILE B 1 344 ? 30.278 20.116 57.644 1.00 45.62 ? 403 ILE B CA 1 ATOM 6290 C C . ILE B 1 344 ? 30.749 21.292 56.778 1.00 44.11 ? 403 ILE B C 1 ATOM 6291 O O . ILE B 1 344 ? 30.349 22.440 56.987 1.00 62.83 ? 403 ILE B O 1 ATOM 6292 C CB . ILE B 1 344 ? 30.429 20.470 59.146 1.00 38.82 ? 403 ILE B CB 1 ATOM 6293 C CG1 . ILE B 1 344 ? 29.292 21.385 59.619 1.00 57.48 ? 403 ILE B CG1 1 ATOM 6294 C CG2 . ILE B 1 344 ? 31.808 21.057 59.430 1.00 42.06 ? 403 ILE B CG2 1 ATOM 6295 C CD1 . ILE B 1 344 ? 27.908 20.850 59.316 1.00 35.00 ? 403 ILE B CD1 1 ATOM 6296 N N . LEU B 1 345 ? 31.588 20.995 55.791 1.00 47.62 ? 404 LEU B N 1 ATOM 6297 C CA . LEU B 1 345 ? 32.066 22.009 54.848 1.00 52.34 ? 404 LEU B CA 1 ATOM 6298 C C . LEU B 1 345 ? 30.965 22.773 54.090 1.00 50.06 ? 404 LEU B C 1 ATOM 6299 O O . LEU B 1 345 ? 31.114 23.974 53.861 1.00 58.20 ? 404 LEU B O 1 ATOM 6300 C CB . LEU B 1 345 ? 33.023 21.375 53.834 1.00 36.74 ? 404 LEU B CB 1 ATOM 6301 C CG . LEU B 1 345 ? 34.496 21.345 54.238 1.00 53.50 ? 404 LEU B CG 1 ATOM 6302 C CD1 . LEU B 1 345 ? 35.339 20.743 53.128 1.00 37.78 ? 404 LEU B CD1 1 ATOM 6303 C CD2 . LEU B 1 345 ? 34.982 22.743 54.589 1.00 35.03 ? 404 LEU B CD2 1 ATOM 6304 N N . PRO B 1 346 ? 29.872 22.092 53.683 1.00 47.97 ? 405 PRO B N 1 ATOM 6305 C CA . PRO B 1 346 ? 28.789 22.848 53.041 1.00 47.70 ? 405 PRO B CA 1 ATOM 6306 C C . PRO B 1 346 ? 28.240 24.002 53.878 1.00 56.29 ? 405 PRO B C 1 ATOM 6307 O O . PRO B 1 346 ? 27.918 25.048 53.318 1.00 33.61 ? 405 PRO B O 1 ATOM 6308 C CB . PRO B 1 346 ? 27.716 21.784 52.827 1.00 39.44 ? 405 PRO B CB 1 ATOM 6309 C CG . PRO B 1 346 ? 28.488 20.548 52.603 1.00 42.41 ? 405 PRO B CG 1 ATOM 6310 C CD . PRO B 1 346 ? 29.653 20.638 53.548 1.00 39.43 ? 405 PRO B CD 1 ATOM 6311 N N . LEU B 1 347 ? 28.130 23.813 55.189 1.00 48.43 ? 406 LEU B N 1 ATOM 6312 C CA . LEU B 1 347 ? 27.704 24.890 56.076 1.00 40.92 ? 406 LEU B CA 1 ATOM 6313 C C . LEU B 1 347 ? 28.664 26.072 55.998 1.00 43.16 ? 406 LEU B C 1 ATOM 6314 O O . LEU B 1 347 ? 28.242 27.226 55.928 1.00 53.29 ? 406 LEU B O 1 ATOM 6315 C CB . LEU B 1 347 ? 27.600 24.396 57.520 1.00 43.46 ? 406 LEU B CB 1 ATOM 6316 C CG . LEU B 1 347 ? 27.268 25.462 58.567 1.00 39.61 ? 406 LEU B CG 1 ATOM 6317 C CD1 . LEU B 1 347 ? 25.934 26.125 58.258 1.00 33.98 ? 406 LEU B CD1 1 ATOM 6318 C CD2 . LEU B 1 347 ? 27.261 24.865 59.966 1.00 46.82 ? 406 LEU B CD2 1 ATOM 6319 N N . ARG B 1 348 ? 29.958 25.774 56.011 1.00 66.93 ? 407 ARG B N 1 ATOM 6320 C CA . ARG B 1 348 ? 30.986 26.808 56.016 1.00 57.41 ? 407 ARG B CA 1 ATOM 6321 C C . ARG B 1 348 ? 31.169 27.476 54.654 1.00 53.51 ? 407 ARG B C 1 ATOM 6322 O O . ARG B 1 348 ? 31.480 28.665 54.576 1.00 54.27 ? 407 ARG B O 1 ATOM 6323 C CB . ARG B 1 348 ? 32.320 26.223 56.485 1.00 41.86 ? 407 ARG B CB 1 ATOM 6324 C CG . ARG B 1 348 ? 33.376 27.280 56.726 1.00 73.48 ? 407 ARG B CG 1 ATOM 6325 C CD . ARG B 1 348 ? 32.833 28.358 57.646 1.00 80.19 ? 407 ARG B CD 1 ATOM 6326 N NE . ARG B 1 348 ? 33.534 29.628 57.487 1.00 98.75 ? 407 ARG B NE 1 ATOM 6327 C CZ . ARG B 1 348 ? 33.117 30.615 56.701 1.00 99.02 ? 407 ARG B CZ 1 ATOM 6328 N NH1 . ARG B 1 348 ? 31.999 30.480 56.001 1.00 92.87 ? 407 ARG B NH1 1 ATOM 6329 N NH2 . ARG B 1 348 ? 33.817 31.738 56.616 1.00 89.52 ? 407 ARG B NH2 1 ATOM 6330 N N . GLN B 1 349 ? 30.969 26.717 53.582 1.00 46.85 ? 408 GLN B N 1 ATOM 6331 C CA . GLN B 1 349 ? 31.171 27.245 52.236 1.00 48.31 ? 408 GLN B CA 1 ATOM 6332 C C . GLN B 1 349 ? 29.952 28.005 51.717 1.00 56.80 ? 408 GLN B C 1 ATOM 6333 O O . GLN B 1 349 ? 30.089 29.081 51.136 1.00 71.53 ? 408 GLN B O 1 ATOM 6334 C CB . GLN B 1 349 ? 31.531 26.117 51.267 1.00 47.83 ? 408 GLN B CB 1 ATOM 6335 C CG . GLN B 1 349 ? 32.916 25.529 51.476 1.00 50.03 ? 408 GLN B CG 1 ATOM 6336 C CD . GLN B 1 349 ? 33.242 24.439 50.473 1.00 52.69 ? 408 GLN B CD 1 ATOM 6337 O OE1 . GLN B 1 349 ? 32.526 24.249 49.490 1.00 55.66 ? 408 GLN B OE1 1 ATOM 6338 N NE2 . GLN B 1 349 ? 34.330 23.717 50.716 1.00 34.31 ? 408 GLN B NE2 1 ATOM 6339 N N . CYS B 1 350 ? 28.764 27.447 51.928 1.00 47.82 ? 409 CYS B N 1 ATOM 6340 C CA . CYS B 1 350 ? 27.533 28.054 51.428 1.00 49.77 ? 409 CYS B CA 1 ATOM 6341 C C . CYS B 1 350 ? 27.050 29.176 52.345 1.00 56.00 ? 409 CYS B C 1 ATOM 6342 O O . CYS B 1 350 ? 26.542 30.197 51.878 1.00 44.46 ? 409 CYS B O 1 ATOM 6343 C CB . CYS B 1 350 ? 26.439 26.995 51.273 1.00 42.93 ? 409 CYS B CB 1 ATOM 6344 S SG . CYS B 1 350 ? 26.915 25.570 50.264 1.00 49.77 ? 409 CYS B SG 1 ATOM 6345 N N . CYS B 1 351 ? 27.213 28.970 53.649 1.00 49.21 ? 410 CYS B N 1 ATOM 6346 C CA . CYS B 1 351 ? 26.808 29.937 54.670 1.00 39.53 ? 410 CYS B CA 1 ATOM 6347 C C . CYS B 1 351 ? 25.344 30.364 54.585 1.00 49.46 ? 410 CYS B C 1 ATOM 6348 O O . CYS B 1 351 ? 25.017 31.530 54.804 1.00 54.27 ? 410 CYS B O 1 ATOM 6349 C CB . CYS B 1 351 ? 27.702 31.178 54.610 1.00 34.27 ? 410 CYS B CB 1 ATOM 6350 S SG . CYS B 1 351 ? 29.261 30.999 55.501 1.00 56.38 ? 410 CYS B SG 1 ATOM 6351 N N . ILE B 1 352 ? 24.466 29.420 54.263 1.00 58.51 ? 411 ILE B N 1 ATOM 6352 C CA . ILE B 1 352 ? 23.035 29.630 54.447 1.00 52.03 ? 411 ILE B CA 1 ATOM 6353 C C . ILE B 1 352 ? 22.516 28.567 55.410 1.00 47.36 ? 411 ILE B C 1 ATOM 6354 O O . ILE B 1 352 ? 23.067 27.468 55.486 1.00 53.15 ? 411 ILE B O 1 ATOM 6355 C CB . ILE B 1 352 ? 22.256 29.581 53.116 1.00 53.91 ? 411 ILE B CB 1 ATOM 6356 C CG1 . ILE B 1 352 ? 22.213 28.158 52.560 1.00 51.18 ? 411 ILE B CG1 1 ATOM 6357 C CG2 . ILE B 1 352 ? 22.872 30.534 52.100 1.00 53.44 ? 411 ILE B CG2 1 ATOM 6358 C CD1 . ILE B 1 352 ? 21.301 28.008 51.367 1.00 52.12 ? 411 ILE B CD1 1 ATOM 6359 N N . LEU B 1 353 ? 21.468 28.897 56.157 1.00 48.70 ? 412 LEU B N 1 ATOM 6360 C CA . LEU B 1 353 ? 21.004 28.020 57.224 1.00 40.20 ? 412 LEU B CA 1 ATOM 6361 C C . LEU B 1 353 ? 19.542 28.274 57.574 1.00 52.39 ? 412 LEU B C 1 ATOM 6362 O O . LEU B 1 353 ? 19.155 29.400 57.886 1.00 60.97 ? 412 LEU B O 1 ATOM 6363 C CB . LEU B 1 353 ? 21.878 28.194 58.468 1.00 36.32 ? 412 LEU B CB 1 ATOM 6364 C CG . LEU B 1 353 ? 21.482 27.394 59.709 1.00 44.38 ? 412 LEU B CG 1 ATOM 6365 C CD1 . LEU B 1 353 ? 21.615 25.901 59.456 1.00 40.63 ? 412 LEU B CD1 1 ATOM 6366 C CD2 . LEU B 1 353 ? 22.317 27.818 60.906 1.00 43.44 ? 412 LEU B CD2 1 ATOM 6367 N N . ARG B 1 354 ? 18.736 27.220 57.501 1.00 50.62 ? 413 ARG B N 1 ATOM 6368 C CA . ARG B 1 354 ? 17.319 27.293 57.839 1.00 55.15 ? 413 ARG B CA 1 ATOM 6369 C C . ARG B 1 354 ? 17.130 27.759 59.283 1.00 60.46 ? 413 ARG B C 1 ATOM 6370 O O . ARG B 1 354 ? 17.726 27.198 60.202 1.00 53.58 ? 413 ARG B O 1 ATOM 6371 C CB . ARG B 1 354 ? 16.657 25.931 57.611 1.00 56.29 ? 413 ARG B CB 1 ATOM 6372 C CG . ARG B 1 354 ? 15.149 25.916 57.768 1.00 52.46 ? 413 ARG B CG 1 ATOM 6373 C CD . ARG B 1 354 ? 14.566 24.615 57.237 1.00 51.39 ? 413 ARG B CD 1 ATOM 6374 N NE . ARG B 1 354 ? 14.429 24.629 55.782 1.00 50.83 ? 413 ARG B NE 1 ATOM 6375 C CZ . ARG B 1 354 ? 14.867 23.663 54.980 1.00 47.34 ? 413 ARG B CZ 1 ATOM 6376 N NH1 . ARG B 1 354 ? 15.478 22.602 55.490 1.00 47.94 ? 413 ARG B NH1 1 ATOM 6377 N NH2 . ARG B 1 354 ? 14.698 23.759 53.668 1.00 41.69 ? 413 ARG B NH2 1 ATOM 6378 N N . PRO B 1 355 ? 16.306 28.802 59.480 1.00 55.31 ? 414 PRO B N 1 ATOM 6379 C CA . PRO B 1 355 ? 16.108 29.468 60.774 1.00 44.38 ? 414 PRO B CA 1 ATOM 6380 C C . PRO B 1 355 ? 15.668 28.521 61.889 1.00 51.47 ? 414 PRO B C 1 ATOM 6381 O O . PRO B 1 355 ? 16.122 28.665 63.025 1.00 43.29 ? 414 PRO B O 1 ATOM 6382 C CB . PRO B 1 355 ? 15.008 30.489 60.473 1.00 54.65 ? 414 PRO B CB 1 ATOM 6383 C CG . PRO B 1 355 ? 15.164 30.781 59.026 1.00 53.82 ? 414 PRO B CG 1 ATOM 6384 C CD . PRO B 1 355 ? 15.556 29.472 58.404 1.00 58.93 ? 414 PRO B CD 1 ATOM 6385 N N . SER B 1 356 ? 14.802 27.567 61.564 1.00 41.44 ? 415 SER B N 1 ATOM 6386 C CA . SER B 1 356 ? 14.329 26.597 62.546 1.00 53.31 ? 415 SER B CA 1 ATOM 6387 C C . SER B 1 356 ? 15.475 25.722 63.032 1.00 60.64 ? 415 SER B C 1 ATOM 6388 O O . SER B 1 356 ? 15.554 25.386 64.214 1.00 57.53 ? 415 SER B O 1 ATOM 6389 C CB . SER B 1 356 ? 13.218 25.728 61.957 1.00 37.48 ? 415 SER B CB 1 ATOM 6390 O OG . SER B 1 356 ? 13.664 25.050 60.795 1.00 60.67 ? 415 SER B OG 1 ATOM 6391 N N . THR B 1 357 ? 16.355 25.348 62.109 1.00 53.26 ? 416 THR B N 1 ATOM 6392 C CA . THR B 1 357 ? 17.527 24.551 62.441 1.00 55.44 ? 416 THR B CA 1 ATOM 6393 C C . THR B 1 357 ? 18.406 25.295 63.442 1.00 53.85 ? 416 THR B C 1 ATOM 6394 O O . THR B 1 357 ? 18.883 24.711 64.413 1.00 42.54 ? 416 THR B O 1 ATOM 6395 C CB . THR B 1 357 ? 18.353 24.203 61.186 1.00 45.87 ? 416 THR B CB 1 ATOM 6396 O OG1 . THR B 1 357 ? 17.522 23.527 60.235 1.00 53.58 ? 416 THR B OG1 1 ATOM 6397 C CG2 . THR B 1 357 ? 19.531 23.312 61.547 1.00 43.61 ? 416 THR B CG2 1 ATOM 6398 N N . PHE B 1 358 ? 18.597 26.591 63.209 1.00 55.36 ? 417 PHE B N 1 ATOM 6399 C CA . PHE B 1 358 ? 19.441 27.412 64.073 1.00 40.75 ? 417 PHE B CA 1 ATOM 6400 C C . PHE B 1 358 ? 18.917 27.461 65.505 1.00 58.10 ? 417 PHE B C 1 ATOM 6401 O O . PHE B 1 358 ? 19.684 27.297 66.453 1.00 49.74 ? 417 PHE B O 1 ATOM 6402 C CB . PHE B 1 358 ? 19.560 28.831 63.512 1.00 48.85 ? 417 PHE B CB 1 ATOM 6403 C CG . PHE B 1 358 ? 20.234 29.799 64.447 1.00 61.17 ? 417 PHE B CG 1 ATOM 6404 C CD1 . PHE B 1 358 ? 21.615 29.846 64.537 1.00 55.87 ? 417 PHE B CD1 1 ATOM 6405 C CD2 . PHE B 1 358 ? 19.486 30.669 65.225 1.00 53.64 ? 417 PHE B CD2 1 ATOM 6406 C CE1 . PHE B 1 358 ? 22.237 30.735 65.393 1.00 60.01 ? 417 PHE B CE1 1 ATOM 6407 C CE2 . PHE B 1 358 ? 20.104 31.560 66.083 1.00 52.03 ? 417 PHE B CE2 1 ATOM 6408 C CZ . PHE B 1 358 ? 21.481 31.593 66.165 1.00 58.90 ? 417 PHE B CZ 1 ATOM 6409 N N . GLN B 1 359 ? 17.615 27.689 65.658 1.00 56.33 ? 418 GLN B N 1 ATOM 6410 C CA . GLN B 1 359 ? 17.001 27.736 66.981 1.00 59.14 ? 418 GLN B CA 1 ATOM 6411 C C . GLN B 1 359 ? 17.143 26.392 67.678 1.00 60.33 ? 418 GLN B C 1 ATOM 6412 O O . GLN B 1 359 ? 17.507 26.327 68.854 1.00 46.27 ? 418 GLN B O 1 ATOM 6413 C CB . GLN B 1 359 ? 15.526 28.125 66.890 1.00 65.23 ? 418 GLN B CB 1 ATOM 6414 C CG . GLN B 1 359 ? 15.285 29.595 66.615 1.00 70.42 ? 418 GLN B CG 1 ATOM 6415 C CD . GLN B 1 359 ? 13.829 29.977 66.770 1.00 73.73 ? 418 GLN B CD 1 ATOM 6416 O OE1 . GLN B 1 359 ? 12.953 29.397 66.130 1.00 72.45 ? 418 GLN B OE1 1 ATOM 6417 N NE2 . GLN B 1 359 ? 13.560 30.953 67.630 1.00 66.96 ? 418 GLN B NE2 1 ATOM 6418 N N . THR B 1 360 ? 16.832 25.325 66.947 1.00 54.84 ? 419 THR B N 1 ATOM 6419 C CA . THR B 1 360 ? 17.036 23.970 67.441 1.00 47.36 ? 419 THR B CA 1 ATOM 6420 C C . THR B 1 360 ? 18.492 23.777 67.849 1.00 44.00 ? 419 THR B C 1 ATOM 6421 O O . THR B 1 360 ? 18.767 23.275 68.932 1.00 56.32 ? 419 THR B O 1 ATOM 6422 C CB . THR B 1 360 ? 16.646 22.910 66.397 1.00 56.24 ? 419 THR B CB 1 ATOM 6423 O OG1 . THR B 1 360 ? 15.274 23.087 66.022 1.00 40.23 ? 419 THR B OG1 1 ATOM 6424 C CG2 . THR B 1 360 ? 16.827 21.511 66.970 1.00 39.41 ? 419 THR B CG2 1 ATOM 6425 N N . LEU B 1 361 ? 19.416 24.150 66.965 1.00 35.96 ? 420 LEU B N 1 ATOM 6426 C CA . LEU B 1 361 ? 20.850 24.075 67.254 1.00 44.79 ? 420 LEU B CA 1 ATOM 6427 C C . LEU B 1 361 ? 21.313 25.045 68.345 1.00 49.04 ? 420 LEU B C 1 ATOM 6428 O O . LEU B 1 361 ? 22.404 24.891 68.891 1.00 71.21 ? 420 LEU B O 1 ATOM 6429 C CB . LEU B 1 361 ? 21.668 24.319 65.984 1.00 44.86 ? 420 LEU B CB 1 ATOM 6430 C CG . LEU B 1 361 ? 21.598 23.241 64.903 1.00 43.81 ? 420 LEU B CG 1 ATOM 6431 C CD1 . LEU B 1 361 ? 22.446 23.638 63.707 1.00 48.76 ? 420 LEU B CD1 1 ATOM 6432 C CD2 . LEU B 1 361 ? 22.029 21.890 65.454 1.00 37.48 ? 420 LEU B CD2 1 HETATM 6433 N N . MSE B 1 362 ? 20.481 26.031 68.673 1.00 56.87 ? 421 MSE B N 1 HETATM 6434 C CA . MSE B 1 362 ? 20.827 27.010 69.703 1.00 60.72 ? 421 MSE B CA 1 HETATM 6435 C C . MSE B 1 362 ? 20.387 26.574 71.102 1.00 73.07 ? 421 MSE B C 1 HETATM 6436 O O . MSE B 1 362 ? 21.130 26.730 72.072 1.00 60.12 ? 421 MSE B O 1 HETATM 6437 C CB . MSE B 1 362 ? 20.211 28.372 69.372 1.00 62.71 ? 421 MSE B CB 1 HETATM 6438 C CG . MSE B 1 362 ? 20.401 29.423 70.455 1.00 81.05 ? 421 MSE B CG 1 HETATM 6439 SE SE . MSE B 1 362 ? 22.279 29.740 70.864 1.00 166.15 ? 421 MSE B SE 1 HETATM 6440 C CE . MSE B 1 362 ? 22.882 30.200 69.073 1.00 34.21 ? 421 MSE B CE 1 ATOM 6441 N N . ASN B 1 363 ? 19.180 26.022 71.196 1.00 45.09 ? 422 ASN B N 1 ATOM 6442 C CA . ASN B 1 363 ? 18.592 25.638 72.480 1.00 45.32 ? 422 ASN B CA 1 ATOM 6443 C C . ASN B 1 363 ? 19.377 24.542 73.210 1.00 60.46 ? 422 ASN B C 1 ATOM 6444 O O . ASN B 1 363 ? 19.623 24.642 74.411 1.00 74.38 ? 422 ASN B O 1 ATOM 6445 C CB . ASN B 1 363 ? 17.144 25.192 72.274 1.00 50.55 ? 422 ASN B CB 1 ATOM 6446 C CG . ASN B 1 363 ? 16.216 26.353 71.967 1.00 59.88 ? 422 ASN B CG 1 ATOM 6447 O OD1 . ASN B 1 363 ? 16.529 27.506 72.260 1.00 61.28 ? 422 ASN B OD1 1 ATOM 6448 N ND2 . ASN B 1 363 ? 15.069 26.052 71.369 1.00 62.10 ? 422 ASN B ND2 1 ATOM 6449 N N . PHE B 1 364 ? 19.761 23.501 72.475 1.00 53.48 ? 423 PHE B N 1 ATOM 6450 C CA . PHE B 1 364 ? 20.550 22.400 73.024 1.00 50.99 ? 423 PHE B CA 1 ATOM 6451 C C . PHE B 1 364 ? 21.936 22.896 73.405 1.00 54.36 ? 423 PHE B C 1 ATOM 6452 O O . PHE B 1 364 ? 22.478 22.517 74.438 1.00 60.34 ? 423 PHE B O 1 ATOM 6453 C CB . PHE B 1 364 ? 20.676 21.255 72.015 1.00 47.62 ? 423 PHE B CB 1 ATOM 6454 C CG . PHE B 1 364 ? 19.401 20.497 71.784 1.00 49.66 ? 423 PHE B CG 1 ATOM 6455 C CD1 . PHE B 1 364 ? 18.686 19.966 72.844 1.00 54.04 ? 423 PHE B CD1 1 ATOM 6456 C CD2 . PHE B 1 364 ? 18.919 20.314 70.498 1.00 42.47 ? 423 PHE B CD2 1 ATOM 6457 C CE1 . PHE B 1 364 ? 17.513 19.265 72.625 1.00 48.79 ? 423 PHE B CE1 1 ATOM 6458 C CE2 . PHE B 1 364 ? 17.748 19.615 70.272 1.00 41.17 ? 423 PHE B CE2 1 ATOM 6459 C CZ . PHE B 1 364 ? 17.044 19.090 71.336 1.00 42.24 ? 423 PHE B CZ 1 ATOM 6460 N N . TYR B 1 365 ? 22.512 23.735 72.550 1.00 57.92 ? 424 TYR B N 1 ATOM 6461 C CA . TYR B 1 365 ? 23.860 24.250 72.760 1.00 56.41 ? 424 TYR B CA 1 ATOM 6462 C C . TYR B 1 365 ? 23.949 25.072 74.042 1.00 62.78 ? 424 TYR B C 1 ATOM 6463 O O . TYR B 1 365 ? 24.952 25.016 74.754 1.00 59.94 ? 424 TYR B O 1 ATOM 6464 C CB . TYR B 1 365 ? 24.301 25.096 71.565 1.00 42.39 ? 424 TYR B CB 1 ATOM 6465 C CG . TYR B 1 365 ? 25.702 25.650 71.693 1.00 59.17 ? 424 TYR B CG 1 ATOM 6466 C CD1 . TYR B 1 365 ? 26.786 24.807 71.896 1.00 59.71 ? 424 TYR B CD1 1 ATOM 6467 C CD2 . TYR B 1 365 ? 25.940 27.016 71.611 1.00 57.23 ? 424 TYR B CD2 1 ATOM 6468 C CE1 . TYR B 1 365 ? 28.069 25.308 72.014 1.00 44.57 ? 424 TYR B CE1 1 ATOM 6469 C CE2 . TYR B 1 365 ? 27.218 27.526 71.727 1.00 65.07 ? 424 TYR B CE2 1 ATOM 6470 C CZ . TYR B 1 365 ? 28.279 26.668 71.929 1.00 64.45 ? 424 TYR B CZ 1 ATOM 6471 O OH . TYR B 1 365 ? 29.554 27.174 72.045 1.00 60.12 ? 424 TYR B OH 1 ATOM 6472 N N . SER B 1 366 ? 22.896 25.831 74.336 1.00 64.19 ? 425 SER B N 1 ATOM 6473 C CA . SER B 1 366 ? 22.892 26.704 75.505 1.00 64.79 ? 425 SER B CA 1 ATOM 6474 C C . SER B 1 366 ? 22.851 25.897 76.799 1.00 66.74 ? 425 SER B C 1 ATOM 6475 O O . SER B 1 366 ? 23.180 26.406 77.870 1.00 70.59 ? 425 SER B O 1 ATOM 6476 C CB . SER B 1 366 ? 21.701 27.663 75.450 1.00 62.32 ? 425 SER B CB 1 ATOM 6477 O OG . SER B 1 366 ? 21.645 28.336 74.204 1.00 75.37 ? 425 SER B OG 1 ATOM 6478 N N . THR B 1 367 ? 22.445 24.636 76.693 1.00 61.78 ? 426 THR B N 1 ATOM 6479 C CA . THR B 1 367 ? 22.466 23.729 77.832 1.00 59.81 ? 426 THR B CA 1 ATOM 6480 C C . THR B 1 367 ? 23.264 22.471 77.511 1.00 65.29 ? 426 THR B C 1 ATOM 6481 O O . THR B 1 367 ? 22.747 21.555 76.877 1.00 59.33 ? 426 THR B O 1 ATOM 6482 C CB . THR B 1 367 ? 21.046 23.325 78.268 1.00 60.03 ? 426 THR B CB 1 ATOM 6483 O OG1 . THR B 1 367 ? 20.283 24.500 78.566 1.00 67.19 ? 426 THR B OG1 1 ATOM 6484 C CG2 . THR B 1 367 ? 21.104 22.435 79.502 1.00 62.72 ? 426 THR B CG2 1 ATOM 6485 N N . PRO B 1 368 ? 24.531 22.425 77.948 1.00 64.35 ? 427 PRO B N 1 ATOM 6486 C CA . PRO B 1 368 ? 25.411 21.283 77.679 1.00 67.01 ? 427 PRO B CA 1 ATOM 6487 C C . PRO B 1 368 ? 24.771 19.954 78.073 1.00 63.00 ? 427 PRO B C 1 ATOM 6488 O O . PRO B 1 368 ? 24.040 19.902 79.065 1.00 62.04 ? 427 PRO B O 1 ATOM 6489 C CB . PRO B 1 368 ? 26.641 21.582 78.538 1.00 71.15 ? 427 PRO B CB 1 ATOM 6490 C CG . PRO B 1 368 ? 26.669 23.067 78.628 1.00 67.84 ? 427 PRO B CG 1 ATOM 6491 C CD . PRO B 1 368 ? 25.226 23.493 78.686 1.00 67.58 ? 427 PRO B CD 1 ATOM 6492 N N . LYS B 1 369 ? 25.024 18.923 77.267 1.00 57.82 ? 428 LYS B N 1 ATOM 6493 C CA . LYS B 1 369 ? 24.517 17.559 77.453 1.00 49.98 ? 428 LYS B CA 1 ATOM 6494 C C . LYS B 1 369 ? 23.024 17.390 77.166 1.00 63.80 ? 428 LYS B C 1 ATOM 6495 O O . LYS B 1 369 ? 22.508 16.281 77.270 1.00 60.64 ? 428 LYS B O 1 ATOM 6496 C CB . LYS B 1 369 ? 24.774 17.075 78.886 1.00 49.86 ? 428 LYS B CB 1 ATOM 6497 C CG . LYS B 1 369 ? 26.212 17.120 79.365 1.00 48.26 ? 428 LYS B CG 1 ATOM 6498 C CD . LYS B 1 369 ? 26.250 16.828 80.862 1.00 66.21 ? 428 LYS B CD 1 ATOM 6499 C CE . LYS B 1 369 ? 27.663 16.830 81.416 1.00 73.02 ? 428 LYS B CE 1 ATOM 6500 N NZ . LYS B 1 369 ? 28.416 15.620 80.997 1.00 80.16 ? 428 LYS B NZ 1 ATOM 6501 N N . SER B 1 370 ? 22.333 18.459 76.785 1.00 59.47 ? 429 SER B N 1 ATOM 6502 C CA . SER B 1 370 ? 20.885 18.372 76.583 1.00 53.31 ? 429 SER B CA 1 ATOM 6503 C C . SER B 1 370 ? 20.496 17.645 75.298 1.00 46.23 ? 429 SER B C 1 ATOM 6504 O O . SER B 1 370 ? 19.507 16.913 75.275 1.00 47.84 ? 429 SER B O 1 ATOM 6505 C CB . SER B 1 370 ? 20.258 19.765 76.591 1.00 43.68 ? 429 SER B CB 1 ATOM 6506 O OG . SER B 1 370 ? 20.665 20.501 75.455 1.00 50.50 ? 429 SER B OG 1 ATOM 6507 N N . LEU B 1 371 ? 21.271 17.847 74.235 1.00 44.40 ? 430 LEU B N 1 ATOM 6508 C CA . LEU B 1 371 ? 21.005 17.186 72.958 1.00 59.72 ? 430 LEU B CA 1 ATOM 6509 C C . LEU B 1 371 ? 21.086 15.671 73.097 1.00 56.16 ? 430 LEU B C 1 ATOM 6510 O O . LEU B 1 371 ? 20.170 14.951 72.697 1.00 40.33 ? 430 LEU B O 1 ATOM 6511 C CB . LEU B 1 371 ? 21.981 17.667 71.882 1.00 62.53 ? 430 LEU B CB 1 ATOM 6512 C CG . LEU B 1 371 ? 21.874 16.968 70.524 1.00 54.91 ? 430 LEU B CG 1 ATOM 6513 C CD1 . LEU B 1 371 ? 20.524 17.228 69.875 1.00 36.62 ? 430 LEU B CD1 1 ATOM 6514 C CD2 . LEU B 1 371 ? 23.005 17.404 69.604 1.00 52.11 ? 430 LEU B CD2 1 ATOM 6515 N N . THR B 1 372 ? 22.187 15.194 73.667 1.00 49.00 ? 431 THR B N 1 ATOM 6516 C CA . THR B 1 372 ? 22.396 13.763 73.846 1.00 60.38 ? 431 THR B CA 1 ATOM 6517 C C . THR B 1 372 ? 21.443 13.199 74.895 1.00 52.30 ? 431 THR B C 1 ATOM 6518 O O . THR B 1 372 ? 21.084 12.022 74.850 1.00 64.16 ? 431 THR B O 1 ATOM 6519 C CB . THR B 1 372 ? 23.845 13.460 74.247 1.00 61.67 ? 431 THR B CB 1 ATOM 6520 O OG1 . THR B 1 372 ? 24.191 14.227 75.406 1.00 70.46 ? 431 THR B OG1 1 ATOM 6521 C CG2 . THR B 1 372 ? 24.779 13.828 73.111 1.00 44.13 ? 431 THR B CG2 1 ATOM 6522 N N . LYS B 1 373 ? 21.041 14.041 75.843 1.00 56.59 ? 432 LYS B N 1 ATOM 6523 C CA . LYS B 1 373 ? 20.016 13.659 76.808 1.00 56.91 ? 432 LYS B CA 1 ATOM 6524 C C . LYS B 1 373 ? 18.683 13.534 76.085 1.00 51.07 ? 432 LYS B C 1 ATOM 6525 O O . LYS B 1 373 ? 17.918 12.607 76.336 1.00 45.83 ? 432 LYS B O 1 ATOM 6526 C CB . LYS B 1 373 ? 19.923 14.668 77.955 1.00 62.88 ? 432 LYS B CB 1 ATOM 6527 C CG . LYS B 1 373 ? 20.882 14.380 79.103 1.00 65.17 ? 432 LYS B CG 1 ATOM 6528 C CD . LYS B 1 373 ? 20.963 15.541 80.080 1.00 73.30 ? 432 LYS B CD 1 ATOM 6529 C CE . LYS B 1 373 ? 21.931 15.233 81.214 1.00 69.08 ? 432 LYS B CE 1 ATOM 6530 N NZ . LYS B 1 373 ? 21.996 16.330 82.220 1.00 56.79 ? 432 LYS B NZ 1 ATOM 6531 N N . ALA B 1 374 ? 18.415 14.478 75.186 1.00 51.46 ? 433 ALA B N 1 ATOM 6532 C CA . ALA B 1 374 ? 17.212 14.452 74.359 1.00 41.45 ? 433 ALA B CA 1 ATOM 6533 C C . ALA B 1 374 ? 17.227 13.265 73.397 1.00 47.71 ? 433 ALA B C 1 ATOM 6534 O O . ALA B 1 374 ? 16.179 12.801 72.950 1.00 60.03 ? 433 ALA B O 1 ATOM 6535 C CB . ALA B 1 374 ? 17.065 15.756 73.588 1.00 39.03 ? 433 ALA B CB 1 ATOM 6536 N N . LEU B 1 375 ? 18.421 12.810 73.039 1.00 62.51 ? 434 LEU B N 1 ATOM 6537 C CA . LEU B 1 375 ? 18.568 11.637 72.188 1.00 58.20 ? 434 LEU B CA 1 ATOM 6538 C C . LEU B 1 375 ? 18.350 10.333 72.961 1.00 55.71 ? 434 LEU B C 1 ATOM 6539 O O . LEU B 1 375 ? 17.677 9.417 72.478 1.00 45.98 ? 434 LEU B O 1 ATOM 6540 C CB . LEU B 1 375 ? 19.949 11.630 71.526 1.00 50.35 ? 434 LEU B CB 1 ATOM 6541 C CG . LEU B 1 375 ? 20.283 10.408 70.668 1.00 57.55 ? 434 LEU B CG 1 ATOM 6542 C CD1 . LEU B 1 375 ? 19.355 10.337 69.462 1.00 37.95 ? 434 LEU B CD1 1 ATOM 6543 C CD2 . LEU B 1 375 ? 21.738 10.433 70.226 1.00 37.20 ? 434 LEU B CD2 1 ATOM 6544 N N . HIS B 1 376 ? 18.924 10.263 74.161 1.00 50.26 ? 435 HIS B N 1 ATOM 6545 C CA . HIS B 1 376 ? 18.900 9.043 74.967 1.00 44.71 ? 435 HIS B CA 1 ATOM 6546 C C . HIS B 1 376 ? 17.535 8.478 75.327 1.00 58.47 ? 435 HIS B C 1 ATOM 6547 O O . HIS B 1 376 ? 17.292 7.280 75.155 1.00 58.80 ? 435 HIS B O 1 ATOM 6548 C CB . HIS B 1 376 ? 19.645 9.274 76.279 1.00 56.87 ? 435 HIS B CB 1 ATOM 6549 C CG . HIS B 1 376 ? 19.807 8.030 77.091 1.00 62.67 ? 435 HIS B CG 1 ATOM 6550 N ND1 . HIS B 1 376 ? 20.621 6.996 76.680 1.00 67.88 ? 435 HIS B ND1 1 ATOM 6551 C CD2 . HIS B 1 376 ? 19.268 7.641 78.271 1.00 56.31 ? 435 HIS B CD2 1 ATOM 6552 C CE1 . HIS B 1 376 ? 20.577 6.024 77.571 1.00 59.21 ? 435 HIS B CE1 1 ATOM 6553 N NE2 . HIS B 1 376 ? 19.765 6.389 78.548 1.00 58.14 ? 435 HIS B NE2 1 ATOM 6554 N N . GLU B 1 377 ? 16.653 9.339 75.825 1.00 52.31 ? 436 GLU B N 1 ATOM 6555 C CA . GLU B 1 377 ? 15.321 8.917 76.240 1.00 56.86 ? 436 GLU B CA 1 ATOM 6556 C C . GLU B 1 377 ? 14.526 8.412 75.042 1.00 45.95 ? 436 GLU B C 1 ATOM 6557 O O . GLU B 1 377 ? 13.727 7.485 75.166 1.00 60.29 ? 436 GLU B O 1 ATOM 6558 C CB . GLU B 1 377 ? 14.582 10.050 76.969 1.00 60.17 ? 436 GLU B CB 1 ATOM 6559 C CG . GLU B 1 377 ? 13.599 10.851 76.130 1.00 76.87 ? 436 GLU B CG 1 ATOM 6560 C CD . GLU B 1 377 ? 14.298 11.844 75.241 1.00 100.76 ? 436 GLU B CD 1 ATOM 6561 O OE1 . GLU B 1 377 ? 15.528 11.959 75.377 1.00 105.08 ? 436 GLU B OE1 1 ATOM 6562 O OE2 . GLU B 1 377 ? 13.629 12.505 74.419 1.00 102.22 ? 436 GLU B OE2 1 ATOM 6563 N N . SER B 1 378 ? 14.741 9.033 73.887 1.00 55.02 ? 437 SER B N 1 ATOM 6564 C CA . SER B 1 378 ? 14.068 8.614 72.668 1.00 39.91 ? 437 SER B CA 1 ATOM 6565 C C . SER B 1 378 ? 14.562 7.233 72.257 1.00 59.51 ? 437 SER B C 1 ATOM 6566 O O . SER B 1 378 ? 13.770 6.365 71.903 1.00 57.03 ? 437 SER B O 1 ATOM 6567 C CB . SER B 1 378 ? 14.299 9.622 71.542 1.00 43.01 ? 437 SER B CB 1 ATOM 6568 O OG . SER B 1 378 ? 13.512 9.300 70.408 1.00 51.11 ? 437 SER B OG 1 ATOM 6569 N N . LEU B 1 379 ? 15.875 7.035 72.305 1.00 41.26 ? 438 LEU B N 1 ATOM 6570 C CA . LEU B 1 379 ? 16.463 5.748 71.952 1.00 50.30 ? 438 LEU B CA 1 ATOM 6571 C C . LEU B 1 379 ? 15.993 4.645 72.897 1.00 51.04 ? 438 LEU B C 1 ATOM 6572 O O . LEU B 1 379 ? 15.838 3.495 72.492 1.00 65.09 ? 438 LEU B O 1 ATOM 6573 C CB . LEU B 1 379 ? 17.991 5.830 71.969 1.00 57.06 ? 438 LEU B CB 1 ATOM 6574 C CG . LEU B 1 379 ? 18.670 6.687 70.899 1.00 44.97 ? 438 LEU B CG 1 ATOM 6575 C CD1 . LEU B 1 379 ? 20.174 6.731 71.128 1.00 38.21 ? 438 LEU B CD1 1 ATOM 6576 C CD2 . LEU B 1 379 ? 18.353 6.164 69.508 1.00 44.58 ? 438 LEU B CD2 1 ATOM 6577 N N . SER B 1 380 ? 15.779 5.006 74.159 1.00 51.68 ? 439 SER B N 1 ATOM 6578 C CA . SER B 1 380 ? 15.361 4.052 75.183 1.00 54.22 ? 439 SER B CA 1 ATOM 6579 C C . SER B 1 380 ? 14.021 3.375 74.895 1.00 61.82 ? 439 SER B C 1 ATOM 6580 O O . SER B 1 380 ? 13.795 2.240 75.318 1.00 67.67 ? 439 SER B O 1 ATOM 6581 C CB . SER B 1 380 ? 15.292 4.744 76.547 1.00 57.27 ? 439 SER B CB 1 ATOM 6582 O OG . SER B 1 380 ? 14.269 5.723 76.567 1.00 70.43 ? 439 SER B OG 1 ATOM 6583 N N . LYS B 1 381 ? 13.135 4.060 74.178 1.00 40.96 ? 440 LYS B N 1 ATOM 6584 C CA . LYS B 1 381 ? 11.824 3.488 73.877 1.00 54.28 ? 440 LYS B CA 1 ATOM 6585 C C . LYS B 1 381 ? 11.931 2.437 72.778 1.00 51.17 ? 440 LYS B C 1 ATOM 6586 O O . LYS B 1 381 ? 11.012 1.644 72.574 1.00 62.49 ? 440 LYS B O 1 ATOM 6587 C CB . LYS B 1 381 ? 10.814 4.576 73.496 1.00 57.88 ? 440 LYS B CB 1 ATOM 6588 C CG . LYS B 1 381 ? 10.961 5.159 72.105 1.00 59.48 ? 440 LYS B CG 1 ATOM 6589 C CD . LYS B 1 381 ? 9.921 6.246 71.891 1.00 68.77 ? 440 LYS B CD 1 ATOM 6590 C CE . LYS B 1 381 ? 10.403 7.314 70.928 1.00 75.49 ? 440 LYS B CE 1 ATOM 6591 N NZ . LYS B 1 381 ? 9.485 8.486 70.931 1.00 72.39 ? 440 LYS B NZ 1 ATOM 6592 N N . ASP B 1 382 ? 13.053 2.439 72.066 1.00 48.50 ? 441 ASP B N 1 ATOM 6593 C CA . ASP B 1 382 ? 13.306 1.414 71.062 1.00 46.85 ? 441 ASP B CA 1 ATOM 6594 C C . ASP B 1 382 ? 13.608 0.112 71.797 1.00 52.07 ? 441 ASP B C 1 ATOM 6595 O O . ASP B 1 382 ? 14.412 0.095 72.729 1.00 54.31 ? 441 ASP B O 1 ATOM 6596 C CB . ASP B 1 382 ? 14.464 1.811 70.143 1.00 40.83 ? 441 ASP B CB 1 ATOM 6597 C CG . ASP B 1 382 ? 14.634 0.861 68.972 1.00 49.80 ? 441 ASP B CG 1 ATOM 6598 O OD1 . ASP B 1 382 ? 15.217 -0.228 69.165 1.00 52.81 ? 441 ASP B OD1 1 ATOM 6599 O OD2 . ASP B 1 382 ? 14.184 1.203 67.858 1.00 44.99 ? 441 ASP B OD2 1 ATOM 6600 N N . PRO B 1 383 ? 12.958 -0.985 71.381 1.00 41.81 ? 442 PRO B N 1 ATOM 6601 C CA . PRO B 1 383 ? 13.060 -2.280 72.068 1.00 46.93 ? 442 PRO B CA 1 ATOM 6602 C C . PRO B 1 383 ? 14.479 -2.847 72.128 1.00 45.94 ? 442 PRO B C 1 ATOM 6603 O O . PRO B 1 383 ? 14.743 -3.733 72.942 1.00 59.99 ? 442 PRO B O 1 ATOM 6604 C CB . PRO B 1 383 ? 12.158 -3.196 71.230 1.00 42.45 ? 442 PRO B CB 1 ATOM 6605 C CG . PRO B 1 383 ? 11.238 -2.278 70.502 1.00 46.99 ? 442 PRO B CG 1 ATOM 6606 C CD . PRO B 1 383 ? 12.022 -1.031 70.245 1.00 42.14 ? 442 PRO B CD 1 ATOM 6607 N N . ALA B 1 384 ? 15.374 -2.345 71.285 1.00 51.95 ? 443 ALA B N 1 ATOM 6608 C CA . ALA B 1 384 ? 16.735 -2.869 71.213 1.00 40.77 ? 443 ALA B CA 1 ATOM 6609 C C . ALA B 1 384 ? 17.754 -2.012 71.964 1.00 47.27 ? 443 ALA B C 1 ATOM 6610 O O . ALA B 1 384 ? 18.959 -2.192 71.785 1.00 52.68 ? 443 ALA B O 1 ATOM 6611 C CB . ALA B 1 384 ? 17.155 -3.020 69.759 1.00 40.63 ? 443 ALA B CB 1 ATOM 6612 N N . HIS B 1 385 ? 17.281 -1.083 72.792 1.00 43.74 ? 444 HIS B N 1 ATOM 6613 C CA . HIS B 1 385 ? 18.183 -0.209 73.541 1.00 39.90 ? 444 HIS B CA 1 ATOM 6614 C C . HIS B 1 385 ? 19.056 -1.031 74.491 1.00 47.33 ? 444 HIS B C 1 ATOM 6615 O O . HIS B 1 385 ? 18.631 -2.088 74.960 1.00 49.63 ? 444 HIS B O 1 ATOM 6616 C CB . HIS B 1 385 ? 17.402 0.849 74.328 1.00 44.41 ? 444 HIS B CB 1 ATOM 6617 C CG . HIS B 1 385 ? 16.745 0.323 75.567 1.00 65.01 ? 444 HIS B CG 1 ATOM 6618 N ND1 . HIS B 1 385 ? 15.588 -0.425 75.541 1.00 86.83 ? 444 HIS B ND1 1 ATOM 6619 C CD2 . HIS B 1 385 ? 17.087 0.442 76.872 1.00 61.76 ? 444 HIS B CD2 1 ATOM 6620 C CE1 . HIS B 1 385 ? 15.246 -0.745 76.776 1.00 73.71 ? 444 HIS B CE1 1 ATOM 6621 N NE2 . HIS B 1 385 ? 16.139 -0.231 77.603 1.00 73.42 ? 444 HIS B NE2 1 ATOM 6622 N N . PRO B 1 386 ? 20.282 -0.556 74.780 1.00 41.40 ? 445 PRO B N 1 ATOM 6623 C CA . PRO B 1 386 ? 20.921 0.677 74.297 1.00 52.22 ? 445 PRO B CA 1 ATOM 6624 C C . PRO B 1 386 ? 21.275 0.644 72.811 1.00 52.73 ? 445 PRO B C 1 ATOM 6625 O O . PRO B 1 386 ? 21.816 -0.347 72.319 1.00 53.02 ? 445 PRO B O 1 ATOM 6626 C CB . PRO B 1 386 ? 22.188 0.767 75.152 1.00 38.43 ? 445 PRO B CB 1 ATOM 6627 C CG . PRO B 1 386 ? 22.495 -0.638 75.507 1.00 38.53 ? 445 PRO B CG 1 ATOM 6628 C CD . PRO B 1 386 ? 21.163 -1.301 75.697 1.00 39.07 ? 445 PRO B CD 1 ATOM 6629 N N . ILE B 1 387 ? 20.963 1.731 72.113 1.00 51.80 ? 446 ILE B N 1 ATOM 6630 C CA . ILE B 1 387 ? 21.222 1.831 70.682 1.00 52.95 ? 446 ILE B CA 1 ATOM 6631 C C . ILE B 1 387 ? 22.652 2.290 70.413 1.00 44.96 ? 446 ILE B C 1 ATOM 6632 O O . ILE B 1 387 ? 23.328 1.767 69.527 1.00 46.99 ? 446 ILE B O 1 ATOM 6633 C CB . ILE B 1 387 ? 20.239 2.806 70.004 1.00 44.53 ? 446 ILE B CB 1 ATOM 6634 C CG1 . ILE B 1 387 ? 18.794 2.395 70.293 1.00 41.73 ? 446 ILE B CG1 1 ATOM 6635 C CG2 . ILE B 1 387 ? 20.490 2.868 68.508 1.00 43.66 ? 446 ILE B CG2 1 ATOM 6636 C CD1 . ILE B 1 387 ? 18.471 0.972 69.891 1.00 42.75 ? 446 ILE B CD1 1 ATOM 6637 N N . LEU B 1 388 ? 23.110 3.265 71.191 1.00 41.34 ? 447 LEU B N 1 ATOM 6638 C CA . LEU B 1 388 ? 24.452 3.809 71.028 1.00 44.65 ? 447 LEU B CA 1 ATOM 6639 C C . LEU B 1 388 ? 25.301 3.591 72.272 1.00 37.01 ? 447 LEU B C 1 ATOM 6640 O O . LEU B 1 388 ? 24.802 3.663 73.394 1.00 59.57 ? 447 LEU B O 1 ATOM 6641 C CB . LEU B 1 388 ? 24.391 5.305 70.713 1.00 37.06 ? 447 LEU B CB 1 ATOM 6642 C CG . LEU B 1 388 ? 23.854 5.732 69.347 1.00 44.93 ? 447 LEU B CG 1 ATOM 6643 C CD1 . LEU B 1 388 ? 23.716 7.244 69.290 1.00 37.01 ? 447 LEU B CD1 1 ATOM 6644 C CD2 . LEU B 1 388 ? 24.757 5.231 68.233 1.00 46.08 ? 447 LEU B CD2 1 ATOM 6645 N N . ALA B 1 389 ? 26.585 3.317 72.067 1.00 46.32 ? 448 ALA B N 1 ATOM 6646 C CA . ALA B 1 389 ? 27.540 3.346 73.165 1.00 47.72 ? 448 ALA B CA 1 ATOM 6647 C C . ALA B 1 389 ? 27.599 4.773 73.695 1.00 48.80 ? 448 ALA B C 1 ATOM 6648 O O . ALA B 1 389 ? 27.566 5.728 72.918 1.00 57.63 ? 448 ALA B O 1 ATOM 6649 C CB . ALA B 1 389 ? 28.910 2.873 72.712 1.00 35.96 ? 448 ALA B CB 1 ATOM 6650 N N . TYR B 1 390 ? 27.684 4.916 75.013 1.00 50.12 ? 449 TYR B N 1 ATOM 6651 C CA . TYR B 1 390 ? 27.557 6.222 75.651 1.00 58.89 ? 449 TYR B CA 1 ATOM 6652 C C . TYR B 1 390 ? 28.689 7.175 75.275 1.00 50.57 ? 449 TYR B C 1 ATOM 6653 O O . TYR B 1 390 ? 28.545 8.391 75.388 1.00 52.67 ? 449 TYR B O 1 ATOM 6654 C CB . TYR B 1 390 ? 27.495 6.062 77.171 1.00 49.72 ? 449 TYR B CB 1 ATOM 6655 C CG . TYR B 1 390 ? 26.308 5.258 77.652 1.00 54.67 ? 449 TYR B CG 1 ATOM 6656 C CD1 . TYR B 1 390 ? 25.123 5.231 76.927 1.00 46.33 ? 449 TYR B CD1 1 ATOM 6657 C CD2 . TYR B 1 390 ? 26.374 4.524 78.828 1.00 53.81 ? 449 TYR B CD2 1 ATOM 6658 C CE1 . TYR B 1 390 ? 24.036 4.495 77.363 1.00 57.07 ? 449 TYR B CE1 1 ATOM 6659 C CE2 . TYR B 1 390 ? 25.293 3.785 79.271 1.00 46.42 ? 449 TYR B CE2 1 ATOM 6660 C CZ . TYR B 1 390 ? 24.127 3.774 78.535 1.00 57.67 ? 449 TYR B CZ 1 ATOM 6661 O OH . TYR B 1 390 ? 23.050 3.040 78.975 1.00 64.22 ? 449 TYR B OH 1 ATOM 6662 N N . LYS B 1 391 ? 29.810 6.616 74.829 1.00 35.27 ? 450 LYS B N 1 ATOM 6663 C CA . LYS B 1 391 ? 30.973 7.413 74.444 1.00 37.78 ? 450 LYS B CA 1 ATOM 6664 C C . LYS B 1 391 ? 30.704 8.314 73.238 1.00 41.67 ? 450 LYS B C 1 ATOM 6665 O O . LYS B 1 391 ? 31.460 9.248 72.975 1.00 54.23 ? 450 LYS B O 1 ATOM 6666 C CB . LYS B 1 391 ? 32.165 6.499 74.150 1.00 34.57 ? 450 LYS B CB 1 ATOM 6667 C CG . LYS B 1 391 ? 31.866 5.387 73.160 1.00 50.18 ? 450 LYS B CG 1 ATOM 6668 C CD . LYS B 1 391 ? 33.099 4.540 72.900 1.00 34.48 ? 450 LYS B CD 1 ATOM 6669 C CE . LYS B 1 391 ? 32.741 3.255 72.174 1.00 47.40 ? 450 LYS B CE 1 ATOM 6670 N NZ . LYS B 1 391 ? 33.955 2.479 71.800 1.00 34.43 ? 450 LYS B NZ 1 ATOM 6671 N N . HIS B 1 392 ? 29.632 8.030 72.506 1.00 44.68 ? 451 HIS B N 1 ATOM 6672 C CA . HIS B 1 392 ? 29.260 8.840 71.351 1.00 43.91 ? 451 HIS B CA 1 ATOM 6673 C C . HIS B 1 392 ? 28.573 10.137 71.767 1.00 49.36 ? 451 HIS B C 1 ATOM 6674 O O . HIS B 1 392 ? 28.531 11.098 71.000 1.00 60.17 ? 451 HIS B O 1 ATOM 6675 C CB . HIS B 1 392 ? 28.348 8.047 70.409 1.00 37.80 ? 451 HIS B CB 1 ATOM 6676 C CG . HIS B 1 392 ? 29.046 6.936 69.687 1.00 43.15 ? 451 HIS B CG 1 ATOM 6677 N ND1 . HIS B 1 392 ? 29.769 7.139 68.532 1.00 35.15 ? 451 HIS B ND1 1 ATOM 6678 C CD2 . HIS B 1 392 ? 29.129 5.612 69.957 1.00 47.25 ? 451 HIS B CD2 1 ATOM 6679 C CE1 . HIS B 1 392 ? 30.270 5.987 68.122 1.00 40.10 ? 451 HIS B CE1 1 ATOM 6680 N NE2 . HIS B 1 392 ? 29.896 5.045 68.969 1.00 55.04 ? 451 HIS B NE2 1 ATOM 6681 N N . TYR B 1 393 ? 28.038 10.159 72.984 1.00 51.50 ? 452 TYR B N 1 ATOM 6682 C CA . TYR B 1 393 ? 27.355 11.344 73.504 1.00 49.11 ? 452 TYR B CA 1 ATOM 6683 C C . TYR B 1 393 ? 28.270 12.572 73.652 1.00 40.51 ? 452 TYR B C 1 ATOM 6684 O O . TYR B 1 393 ? 27.916 13.653 73.179 1.00 34.97 ? 452 TYR B O 1 ATOM 6685 C CB . TYR B 1 393 ? 26.682 11.028 74.846 1.00 53.40 ? 452 TYR B CB 1 ATOM 6686 C CG . TYR B 1 393 ? 25.526 10.059 74.740 1.00 46.58 ? 452 TYR B CG 1 ATOM 6687 C CD1 . TYR B 1 393 ? 24.788 9.952 73.568 1.00 53.04 ? 452 TYR B CD1 1 ATOM 6688 C CD2 . TYR B 1 393 ? 25.172 9.250 75.813 1.00 56.06 ? 452 TYR B CD2 1 ATOM 6689 C CE1 . TYR B 1 393 ? 23.731 9.067 73.468 1.00 54.02 ? 452 TYR B CE1 1 ATOM 6690 C CE2 . TYR B 1 393 ? 24.117 8.362 75.721 1.00 56.93 ? 452 TYR B CE2 1 ATOM 6691 C CZ . TYR B 1 393 ? 23.399 8.276 74.546 1.00 51.27 ? 452 TYR B CZ 1 ATOM 6692 O OH . TYR B 1 393 ? 22.347 7.393 74.451 1.00 52.96 ? 452 TYR B OH 1 ATOM 6693 N N . PRO B 1 394 ? 29.443 12.427 74.305 1.00 49.34 ? 453 PRO B N 1 ATOM 6694 C CA . PRO B 1 394 ? 30.302 13.619 74.362 1.00 57.24 ? 453 PRO B CA 1 ATOM 6695 C C . PRO B 1 394 ? 30.796 14.057 72.985 1.00 66.38 ? 453 PRO B C 1 ATOM 6696 O O . PRO B 1 394 ? 31.072 15.240 72.781 1.00 72.88 ? 453 PRO B O 1 ATOM 6697 C CB . PRO B 1 394 ? 31.476 13.174 75.243 1.00 44.04 ? 453 PRO B CB 1 ATOM 6698 C CG . PRO B 1 394 ? 31.467 11.693 75.192 1.00 43.55 ? 453 PRO B CG 1 ATOM 6699 C CD . PRO B 1 394 ? 30.038 11.289 75.029 1.00 40.49 ? 453 PRO B CD 1 ATOM 6700 N N . ALA B 1 395 ? 30.907 13.111 72.058 1.00 67.51 ? 454 ALA B N 1 ATOM 6701 C CA . ALA B 1 395 ? 31.338 13.412 70.697 1.00 48.85 ? 454 ALA B CA 1 ATOM 6702 C C . ALA B 1 395 ? 30.332 14.312 69.984 1.00 57.38 ? 454 ALA B C 1 ATOM 6703 O O . ALA B 1 395 ? 30.712 15.262 69.302 1.00 45.58 ? 454 ALA B O 1 ATOM 6704 C CB . ALA B 1 395 ? 31.547 12.128 69.911 1.00 47.74 ? 454 ALA B CB 1 HETATM 6705 N N . MSE B 1 396 ? 29.049 14.007 70.150 1.00 70.64 ? 455 MSE B N 1 HETATM 6706 C CA . MSE B 1 396 ? 27.989 14.780 69.510 1.00 62.52 ? 455 MSE B CA 1 HETATM 6707 C C . MSE B 1 396 ? 27.877 16.174 70.116 1.00 72.73 ? 455 MSE B C 1 HETATM 6708 O O . MSE B 1 396 ? 27.501 17.127 69.434 1.00 56.69 ? 455 MSE B O 1 HETATM 6709 C CB . MSE B 1 396 ? 26.654 14.046 69.622 1.00 43.31 ? 455 MSE B CB 1 HETATM 6710 C CG . MSE B 1 396 ? 26.655 12.679 68.961 1.00 63.98 ? 455 MSE B CG 1 HETATM 6711 SE SE . MSE B 1 396 ? 24.947 11.759 69.127 1.00 100.36 ? 455 MSE B SE 1 HETATM 6712 C CE . MSE B 1 396 ? 23.836 13.042 68.177 1.00 40.14 ? 455 MSE B CE 1 ATOM 6713 N N . GLU B 1 397 ? 28.200 16.286 71.400 1.00 59.36 ? 456 GLU B N 1 ATOM 6714 C CA . GLU B 1 397 ? 28.241 17.582 72.063 1.00 56.60 ? 456 GLU B CA 1 ATOM 6715 C C . GLU B 1 397 ? 29.417 18.396 71.536 1.00 52.62 ? 456 GLU B C 1 ATOM 6716 O O . GLU B 1 397 ? 29.300 19.599 71.301 1.00 60.65 ? 456 GLU B O 1 ATOM 6717 C CB . GLU B 1 397 ? 28.343 17.413 73.581 1.00 59.31 ? 456 GLU B CB 1 ATOM 6718 C CG . GLU B 1 397 ? 27.137 16.736 74.216 1.00 50.29 ? 456 GLU B CG 1 ATOM 6719 C CD . GLU B 1 397 ? 25.879 17.580 74.126 1.00 53.51 ? 456 GLU B CD 1 ATOM 6720 O OE1 . GLU B 1 397 ? 25.994 18.823 74.077 1.00 62.22 ? 456 GLU B OE1 1 ATOM 6721 O OE2 . GLU B 1 397 ? 24.773 16.999 74.103 1.00 55.16 ? 456 GLU B OE2 1 ATOM 6722 N N . ARG B 1 398 ? 30.550 17.724 71.356 1.00 54.61 ? 457 ARG B N 1 ATOM 6723 C CA . ARG B 1 398 ? 31.753 18.352 70.822 1.00 48.09 ? 457 ARG B CA 1 ATOM 6724 C C . ARG B 1 398 ? 31.531 18.825 69.390 1.00 45.22 ? 457 ARG B C 1 ATOM 6725 O O . ARG B 1 398 ? 31.993 19.898 68.998 1.00 52.73 ? 457 ARG B O 1 ATOM 6726 C CB . ARG B 1 398 ? 32.930 17.378 70.879 1.00 43.72 ? 457 ARG B CB 1 ATOM 6727 C CG . ARG B 1 398 ? 34.237 17.942 70.351 1.00 39.76 ? 457 ARG B CG 1 ATOM 6728 C CD . ARG B 1 398 ? 35.339 16.899 70.406 1.00 48.05 ? 457 ARG B CD 1 ATOM 6729 N NE . ARG B 1 398 ? 35.051 15.757 69.542 1.00 50.87 ? 457 ARG B NE 1 ATOM 6730 C CZ . ARG B 1 398 ? 34.795 14.531 69.985 1.00 48.60 ? 457 ARG B CZ 1 ATOM 6731 N NH1 . ARG B 1 398 ? 34.789 14.282 71.287 1.00 48.10 ? 457 ARG B NH1 1 ATOM 6732 N NH2 . ARG B 1 398 ? 34.543 13.553 69.125 1.00 53.78 ? 457 ARG B NH2 1 ATOM 6733 N N . ARG B 1 399 ? 30.819 18.014 68.615 1.00 47.61 ? 458 ARG B N 1 ATOM 6734 C CA . ARG B 1 399 ? 30.540 18.331 67.220 1.00 50.83 ? 458 ARG B CA 1 ATOM 6735 C C . ARG B 1 399 ? 29.518 19.455 67.113 1.00 46.42 ? 458 ARG B C 1 ATOM 6736 O O . ARG B 1 399 ? 29.601 20.296 66.218 1.00 46.74 ? 458 ARG B O 1 ATOM 6737 C CB . ARG B 1 399 ? 30.047 17.088 66.477 1.00 40.48 ? 458 ARG B CB 1 ATOM 6738 C CG . ARG B 1 399 ? 31.126 16.042 66.256 1.00 43.13 ? 458 ARG B CG 1 ATOM 6739 C CD . ARG B 1 399 ? 30.537 14.686 65.901 1.00 40.16 ? 458 ARG B CD 1 ATOM 6740 N NE . ARG B 1 399 ? 31.514 13.614 66.074 1.00 41.28 ? 458 ARG B NE 1 ATOM 6741 C CZ . ARG B 1 399 ? 31.218 12.319 66.047 1.00 34.13 ? 458 ARG B CZ 1 ATOM 6742 N NH1 . ARG B 1 399 ? 29.967 11.925 65.849 1.00 39.62 ? 458 ARG B NH1 1 ATOM 6743 N NH2 . ARG B 1 399 ? 32.174 11.415 66.214 1.00 41.98 ? 458 ARG B NH2 1 ATOM 6744 N N . LEU B 1 400 ? 28.554 19.459 68.029 1.00 52.22 ? 459 LEU B N 1 ATOM 6745 C CA . LEU B 1 400 ? 27.546 20.512 68.087 1.00 61.79 ? 459 LEU B CA 1 ATOM 6746 C C . LEU B 1 400 ? 28.197 21.874 68.309 1.00 63.25 ? 459 LEU B C 1 ATOM 6747 O O . LEU B 1 400 ? 27.853 22.851 67.646 1.00 44.54 ? 459 LEU B O 1 ATOM 6748 C CB . LEU B 1 400 ? 26.529 20.226 69.195 1.00 52.68 ? 459 LEU B CB 1 ATOM 6749 C CG . LEU B 1 400 ? 25.435 21.277 69.399 1.00 47.69 ? 459 LEU B CG 1 ATOM 6750 C CD1 . LEU B 1 400 ? 24.578 21.412 68.150 1.00 34.91 ? 459 LEU B CD1 1 ATOM 6751 C CD2 . LEU B 1 400 ? 24.576 20.935 70.606 1.00 41.20 ? 459 LEU B CD2 1 ATOM 6752 N N . ALA B 1 401 ? 29.136 21.926 69.249 1.00 55.03 ? 460 ALA B N 1 ATOM 6753 C CA . ALA B 1 401 ? 29.860 23.155 69.555 1.00 47.99 ? 460 ALA B CA 1 ATOM 6754 C C . ALA B 1 401 ? 30.612 23.693 68.340 1.00 56.60 ? 460 ALA B C 1 ATOM 6755 O O . ALA B 1 401 ? 30.625 24.899 68.096 1.00 63.52 ? 460 ALA B O 1 ATOM 6756 C CB . ALA B 1 401 ? 30.822 22.924 70.710 1.00 41.48 ? 460 ALA B CB 1 ATOM 6757 N N . LYS B 1 402 ? 31.239 22.796 67.584 1.00 49.72 ? 461 LYS B N 1 ATOM 6758 C CA . LYS B 1 402 ? 31.963 23.188 66.379 1.00 53.82 ? 461 LYS B CA 1 ATOM 6759 C C . LYS B 1 402 ? 31.023 23.718 65.301 1.00 52.88 ? 461 LYS B C 1 ATOM 6760 O O . LYS B 1 402 ? 31.382 24.623 64.546 1.00 54.30 ? 461 LYS B O 1 ATOM 6761 C CB . LYS B 1 402 ? 32.779 22.015 65.831 1.00 37.61 ? 461 LYS B CB 1 ATOM 6762 C CG . LYS B 1 402 ? 33.908 21.566 66.744 1.00 55.37 ? 461 LYS B CG 1 ATOM 6763 C CD . LYS B 1 402 ? 34.653 20.377 66.160 1.00 59.84 ? 461 LYS B CD 1 ATOM 6764 C CE . LYS B 1 402 ? 35.978 20.152 66.869 1.00 60.25 ? 461 LYS B CE 1 ATOM 6765 N NZ . LYS B 1 402 ? 36.771 19.063 66.232 1.00 60.73 ? 461 LYS B NZ 1 ATOM 6766 N N . ILE B 1 403 ? 29.826 23.145 65.227 1.00 48.77 ? 462 ILE B N 1 ATOM 6767 C CA . ILE B 1 403 ? 28.824 23.592 64.265 1.00 43.97 ? 462 ILE B CA 1 ATOM 6768 C C . ILE B 1 403 ? 28.435 25.046 64.520 1.00 55.35 ? 462 ILE B C 1 ATOM 6769 O O . ILE B 1 403 ? 28.335 25.842 63.585 1.00 38.58 ? 462 ILE B O 1 ATOM 6770 C CB . ILE B 1 403 ? 27.560 22.706 64.311 1.00 42.07 ? 462 ILE B CB 1 ATOM 6771 C CG1 . ILE B 1 403 ? 27.856 21.324 63.727 1.00 41.72 ? 462 ILE B CG1 1 ATOM 6772 C CG2 . ILE B 1 403 ? 26.416 23.355 63.545 1.00 38.16 ? 462 ILE B CG2 1 ATOM 6773 C CD1 . ILE B 1 403 ? 26.849 20.269 64.121 1.00 43.66 ? 462 ILE B CD1 1 HETATM 6774 N N . MSE B 1 404 ? 28.236 25.389 65.789 1.00 36.30 ? 463 MSE B N 1 HETATM 6775 C CA . MSE B 1 404 ? 27.838 26.742 66.165 1.00 60.32 ? 463 MSE B CA 1 HETATM 6776 C C . MSE B 1 404 ? 28.906 27.766 65.796 1.00 68.32 ? 463 MSE B C 1 HETATM 6777 O O . MSE B 1 404 ? 28.589 28.885 65.388 1.00 54.40 ? 463 MSE B O 1 HETATM 6778 C CB . MSE B 1 404 ? 27.538 26.817 67.664 1.00 61.34 ? 463 MSE B CB 1 HETATM 6779 C CG . MSE B 1 404 ? 26.490 25.824 68.137 1.00 74.23 ? 463 MSE B CG 1 HETATM 6780 SE SE . MSE B 1 404 ? 24.926 25.764 66.971 1.00 88.16 ? 463 MSE B SE 1 HETATM 6781 C CE . MSE B 1 404 ? 24.417 27.645 67.032 1.00 135.82 ? 463 MSE B CE 1 ATOM 6782 N N . SER B 1 405 ? 30.170 27.379 65.940 1.00 47.27 ? 464 SER B N 1 ATOM 6783 C CA . SER B 1 405 ? 31.280 28.254 65.587 1.00 47.57 ? 464 SER B CA 1 ATOM 6784 C C . SER B 1 405 ? 31.263 28.569 64.096 1.00 56.99 ? 464 SER B C 1 ATOM 6785 O O . SER B 1 405 ? 31.499 29.706 63.696 1.00 64.55 ? 464 SER B O 1 ATOM 6786 C CB . SER B 1 405 ? 32.616 27.619 65.979 1.00 47.87 ? 464 SER B CB 1 ATOM 6787 O OG . SER B 1 405 ? 32.621 27.245 67.345 1.00 67.13 ? 464 SER B OG 1 ATOM 6788 N N . HIS B 1 406 ? 30.965 27.561 63.282 1.00 54.49 ? 465 HIS B N 1 ATOM 6789 C CA . HIS B 1 406 ? 30.863 27.746 61.839 1.00 49.53 ? 465 HIS B CA 1 ATOM 6790 C C . HIS B 1 406 ? 29.671 28.631 61.494 1.00 55.67 ? 465 HIS B C 1 ATOM 6791 O O . HIS B 1 406 ? 29.705 29.381 60.517 1.00 59.94 ? 465 HIS B O 1 ATOM 6792 C CB . HIS B 1 406 ? 30.745 26.398 61.126 1.00 39.00 ? 465 HIS B CB 1 ATOM 6793 C CG . HIS B 1 406 ? 31.935 25.509 61.314 1.00 58.96 ? 465 HIS B CG 1 ATOM 6794 N ND1 . HIS B 1 406 ? 33.217 26.000 61.439 1.00 62.31 ? 465 HIS B ND1 1 ATOM 6795 C CD2 . HIS B 1 406 ? 32.038 24.162 61.396 1.00 54.78 ? 465 HIS B CD2 1 ATOM 6796 C CE1 . HIS B 1 406 ? 34.059 24.993 61.591 1.00 62.03 ? 465 HIS B CE1 1 ATOM 6797 N NE2 . HIS B 1 406 ? 33.369 23.866 61.569 1.00 66.55 ? 465 HIS B NE2 1 ATOM 6798 N N . ILE B 1 407 ? 28.617 28.533 62.298 1.00 41.40 ? 466 ILE B N 1 ATOM 6799 C CA . ILE B 1 407 ? 27.429 29.355 62.108 1.00 51.53 ? 466 ILE B CA 1 ATOM 6800 C C . ILE B 1 407 ? 27.753 30.806 62.454 1.00 66.55 ? 466 ILE B C 1 ATOM 6801 O O . ILE B 1 407 ? 27.358 31.731 61.743 1.00 49.69 ? 466 ILE B O 1 ATOM 6802 C CB . ILE B 1 407 ? 26.250 28.858 62.972 1.00 49.56 ? 466 ILE B CB 1 ATOM 6803 C CG1 . ILE B 1 407 ? 25.795 27.471 62.511 1.00 42.35 ? 466 ILE B CG1 1 ATOM 6804 C CG2 . ILE B 1 407 ? 25.088 29.839 62.917 1.00 39.96 ? 466 ILE B CG2 1 ATOM 6805 C CD1 . ILE B 1 407 ? 24.783 26.822 63.431 1.00 42.24 ? 466 ILE B CD1 1 ATOM 6806 N N . LEU B 1 408 ? 28.486 30.990 63.548 1.00 59.22 ? 467 LEU B N 1 ATOM 6807 C CA . LEU B 1 408 ? 28.933 32.311 63.973 1.00 48.77 ? 467 LEU B CA 1 ATOM 6808 C C . LEU B 1 408 ? 29.809 32.971 62.912 1.00 52.19 ? 467 LEU B C 1 ATOM 6809 O O . LEU B 1 408 ? 29.749 34.184 62.711 1.00 53.47 ? 467 LEU B O 1 ATOM 6810 C CB . LEU B 1 408 ? 29.698 32.216 65.295 1.00 53.70 ? 467 LEU B CB 1 ATOM 6811 C CG . LEU B 1 408 ? 30.232 33.532 65.868 1.00 54.27 ? 467 LEU B CG 1 ATOM 6812 C CD1 . LEU B 1 408 ? 29.099 34.529 66.042 1.00 51.72 ? 467 LEU B CD1 1 ATOM 6813 C CD2 . LEU B 1 408 ? 30.955 33.302 67.184 1.00 52.27 ? 467 LEU B CD2 1 ATOM 6814 N N . GLU B 1 409 ? 30.616 32.162 62.231 1.00 55.70 ? 468 GLU B N 1 ATOM 6815 C CA . GLU B 1 409 ? 31.504 32.659 61.185 1.00 55.46 ? 468 GLU B CA 1 ATOM 6816 C C . GLU B 1 409 ? 30.731 33.174 59.978 1.00 57.31 ? 468 GLU B C 1 ATOM 6817 O O . GLU B 1 409 ? 31.102 34.182 59.378 1.00 66.19 ? 468 GLU B O 1 ATOM 6818 C CB . GLU B 1 409 ? 32.471 31.559 60.748 1.00 63.43 ? 468 GLU B CB 1 ATOM 6819 C CG . GLU B 1 409 ? 33.465 31.158 61.818 1.00 79.11 ? 468 GLU B CG 1 ATOM 6820 C CD . GLU B 1 409 ? 34.249 29.915 61.455 1.00 99.82 ? 468 GLU B CD 1 ATOM 6821 O OE1 . GLU B 1 409 ? 33.944 29.302 60.413 1.00 114.59 ? 468 GLU B OE1 1 ATOM 6822 O OE2 . GLU B 1 409 ? 35.162 29.539 62.219 1.00 97.35 ? 468 GLU B OE2 1 ATOM 6823 N N . CYS B 1 410 ? 29.656 32.476 59.628 1.00 59.38 ? 469 CYS B N 1 ATOM 6824 C CA . CYS B 1 410 ? 28.786 32.907 58.540 1.00 60.71 ? 469 CYS B CA 1 ATOM 6825 C C . CYS B 1 410 ? 28.095 34.217 58.903 1.00 67.66 ? 469 CYS B C 1 ATOM 6826 O O . CYS B 1 410 ? 27.896 35.085 58.052 1.00 68.93 ? 469 CYS B O 1 ATOM 6827 C CB . CYS B 1 410 ? 27.757 31.825 58.210 1.00 58.30 ? 469 CYS B CB 1 ATOM 6828 S SG . CYS B 1 410 ? 28.430 30.431 57.267 1.00 54.78 ? 469 CYS B SG 1 ATOM 6829 N N . PHE B 1 411 ? 27.730 34.348 60.174 1.00 67.14 ? 470 PHE B N 1 ATOM 6830 C CA . PHE B 1 411 ? 27.108 35.564 60.685 1.00 60.07 ? 470 PHE B CA 1 ATOM 6831 C C . PHE B 1 411 ? 28.074 36.742 60.606 1.00 65.31 ? 470 PHE B C 1 ATOM 6832 O O . PHE B 1 411 ? 27.675 37.870 60.320 1.00 59.14 ? 470 PHE B O 1 ATOM 6833 C CB . PHE B 1 411 ? 26.641 35.367 62.130 1.00 56.23 ? 470 PHE B CB 1 ATOM 6834 C CG . PHE B 1 411 ? 25.410 34.513 62.265 1.00 50.83 ? 470 PHE B CG 1 ATOM 6835 C CD1 . PHE B 1 411 ? 24.729 34.065 61.145 1.00 47.42 ? 470 PHE B CD1 1 ATOM 6836 C CD2 . PHE B 1 411 ? 24.937 34.156 63.517 1.00 52.20 ? 470 PHE B CD2 1 ATOM 6837 C CE1 . PHE B 1 411 ? 23.599 33.279 61.272 1.00 51.53 ? 470 PHE B CE1 1 ATOM 6838 C CE2 . PHE B 1 411 ? 23.807 33.371 63.650 1.00 62.12 ? 470 PHE B CE2 1 ATOM 6839 C CZ . PHE B 1 411 ? 23.138 32.931 62.526 1.00 58.03 ? 470 PHE B CZ 1 ATOM 6840 N N . GLU B 1 412 ? 29.342 36.479 60.901 1.00 64.52 ? 471 GLU B N 1 ATOM 6841 C CA . GLU B 1 412 ? 30.358 37.525 60.915 1.00 40.45 ? 471 GLU B CA 1 ATOM 6842 C C . GLU B 1 412 ? 30.884 37.878 59.523 1.00 44.05 ? 471 GLU B C 1 ATOM 6843 O O . GLU B 1 412 ? 31.245 39.027 59.273 1.00 61.41 ? 471 GLU B O 1 ATOM 6844 C CB . GLU B 1 412 ? 31.519 37.118 61.823 1.00 39.44 ? 471 GLU B CB 1 ATOM 6845 C CG . GLU B 1 412 ? 31.146 37.065 63.296 1.00 34.60 ? 471 GLU B CG 1 ATOM 6846 C CD . GLU B 1 412 ? 32.292 36.606 64.174 1.00 69.00 ? 471 GLU B CD 1 ATOM 6847 O OE1 . GLU B 1 412 ? 33.249 36.008 63.641 1.00 81.84 ? 471 GLU B OE1 1 ATOM 6848 O OE2 . GLU B 1 412 ? 32.234 36.841 65.399 1.00 61.50 ? 471 GLU B OE2 1 ATOM 6849 N N . SER B 1 413 ? 30.920 36.906 58.615 1.00 48.89 ? 472 SER B N 1 ATOM 6850 C CA . SER B 1 413 ? 31.449 37.168 57.279 1.00 58.12 ? 472 SER B CA 1 ATOM 6851 C C . SER B 1 413 ? 30.376 37.771 56.380 1.00 59.41 ? 472 SER B C 1 ATOM 6852 O O . SER B 1 413 ? 30.606 38.780 55.714 1.00 80.63 ? 472 SER B O 1 ATOM 6853 C CB . SER B 1 413 ? 31.997 35.882 56.657 1.00 55.91 ? 472 SER B CB 1 ATOM 6854 O OG . SER B 1 413 ? 32.522 36.124 55.363 1.00 79.51 ? 472 SER B OG 1 ATOM 6855 N N . ARG B 1 414 ? 29.206 37.145 56.365 1.00 61.10 ? 473 ARG B N 1 ATOM 6856 C CA . ARG B 1 414 ? 28.084 37.634 55.574 1.00 57.58 ? 473 ARG B CA 1 ATOM 6857 C C . ARG B 1 414 ? 27.016 38.111 56.545 1.00 59.02 ? 473 ARG B C 1 ATOM 6858 O O . ARG B 1 414 ? 27.103 37.832 57.736 1.00 56.74 ? 473 ARG B O 1 ATOM 6859 C CB . ARG B 1 414 ? 27.551 36.559 54.623 1.00 62.16 ? 473 ARG B CB 1 ATOM 6860 C CG . ARG B 1 414 ? 28.631 35.902 53.777 1.00 62.86 ? 473 ARG B CG 1 ATOM 6861 C CD . ARG B 1 414 ? 28.047 35.300 52.507 1.00 70.23 ? 473 ARG B CD 1 ATOM 6862 N NE . ARG B 1 414 ? 29.080 35.010 51.515 1.00 81.64 ? 473 ARG B NE 1 ATOM 6863 C CZ . ARG B 1 414 ? 28.865 34.356 50.378 1.00 96.58 ? 473 ARG B CZ 1 ATOM 6864 N NH1 . ARG B 1 414 ? 27.648 33.921 50.080 1.00 103.53 ? 473 ARG B NH1 1 ATOM 6865 N NH2 . ARG B 1 414 ? 29.865 34.140 49.536 1.00 97.18 ? 473 ARG B NH2 1 ATOM 6866 N N . GLY B 1 415 ? 26.013 38.828 56.052 1.00 53.18 ? 474 GLY B N 1 ATOM 6867 C CA . GLY B 1 415 ? 24.994 39.371 56.932 1.00 59.06 ? 474 GLY B CA 1 ATOM 6868 C C . GLY B 1 415 ? 24.182 38.293 57.625 1.00 68.06 ? 474 GLY B C 1 ATOM 6869 O O . GLY B 1 415 ? 23.989 37.207 57.079 1.00 66.15 ? 474 GLY B O 1 ATOM 6870 N N . VAL B 1 416 ? 23.709 38.590 58.833 1.00 67.81 ? 475 VAL B N 1 ATOM 6871 C CA . VAL B 1 416 ? 22.962 37.615 59.620 1.00 59.23 ? 475 VAL B CA 1 ATOM 6872 C C . VAL B 1 416 ? 21.614 37.404 58.936 1.00 50.94 ? 475 VAL B C 1 ATOM 6873 O O . VAL B 1 416 ? 21.010 36.334 59.020 1.00 62.68 ? 475 VAL B O 1 ATOM 6874 C CB . VAL B 1 416 ? 22.779 38.075 61.088 1.00 69.84 ? 475 VAL B CB 1 ATOM 6875 C CG1 . VAL B 1 416 ? 22.083 39.429 61.154 1.00 72.60 ? 475 VAL B CG1 1 ATOM 6876 C CG2 . VAL B 1 416 ? 22.023 37.029 61.898 1.00 60.21 ? 475 VAL B CG2 1 ATOM 6877 N N . ALA B 1 417 ? 21.165 38.442 58.240 1.00 62.96 ? 476 ALA B N 1 ATOM 6878 C CA . ALA B 1 417 ? 19.901 38.429 57.519 1.00 57.58 ? 476 ALA B CA 1 ATOM 6879 C C . ALA B 1 417 ? 20.064 37.642 56.224 1.00 49.37 ? 476 ALA B C 1 ATOM 6880 O O . ALA B 1 417 ? 19.085 37.296 55.563 1.00 71.45 ? 476 ALA B O 1 ATOM 6881 C CB . ALA B 1 417 ? 19.429 39.847 57.234 1.00 52.06 ? 476 ALA B CB 1 ATOM 6882 N N . GLU B 1 418 ? 21.316 37.366 55.871 1.00 50.31 ? 477 GLU B N 1 ATOM 6883 C CA . GLU B 1 418 ? 21.640 36.661 54.637 1.00 68.38 ? 477 GLU B CA 1 ATOM 6884 C C . GLU B 1 418 ? 21.947 35.184 54.893 1.00 61.58 ? 477 GLU B C 1 ATOM 6885 O O . GLU B 1 418 ? 21.879 34.361 53.979 1.00 58.93 ? 477 GLU B O 1 ATOM 6886 C CB . GLU B 1 418 ? 22.833 37.344 53.957 1.00 62.58 ? 477 GLU B CB 1 ATOM 6887 C CG . GLU B 1 418 ? 23.180 36.838 52.563 1.00 80.29 ? 477 GLU B CG 1 ATOM 6888 C CD . GLU B 1 418 ? 22.328 37.464 51.474 1.00 98.70 ? 477 GLU B CD 1 ATOM 6889 O OE1 . GLU B 1 418 ? 21.124 37.696 51.707 1.00 104.17 ? 477 GLU B OE1 1 ATOM 6890 O OE2 . GLU B 1 418 ? 22.868 37.730 50.379 1.00 98.01 ? 477 GLU B OE2 1 ATOM 6891 N N . VAL B 1 419 ? 22.270 34.848 56.138 1.00 51.07 ? 478 VAL B N 1 ATOM 6892 C CA . VAL B 1 419 ? 22.497 33.456 56.514 1.00 62.44 ? 478 VAL B CA 1 ATOM 6893 C C . VAL B 1 419 ? 21.183 32.772 56.885 1.00 69.09 ? 478 VAL B C 1 ATOM 6894 O O . VAL B 1 419 ? 20.835 31.728 56.334 1.00 61.71 ? 478 VAL B O 1 ATOM 6895 C CB . VAL B 1 419 ? 23.478 33.331 57.693 1.00 52.68 ? 478 VAL B CB 1 ATOM 6896 C CG1 . VAL B 1 419 ? 23.716 31.866 58.027 1.00 58.87 ? 478 VAL B CG1 1 ATOM 6897 C CG2 . VAL B 1 419 ? 24.790 34.026 57.368 1.00 45.61 ? 478 VAL B CG2 1 ATOM 6898 N N . LEU B 1 420 ? 20.460 33.376 57.823 1.00 57.10 ? 479 LEU B N 1 ATOM 6899 C CA . LEU B 1 420 ? 19.217 32.808 58.334 1.00 51.32 ? 479 LEU B CA 1 ATOM 6900 C C . LEU B 1 420 ? 18.033 33.107 57.421 1.00 59.04 ? 479 LEU B C 1 ATOM 6901 O O . LEU B 1 420 ? 17.260 34.031 57.674 1.00 69.47 ? 479 LEU B O 1 ATOM 6902 C CB . LEU B 1 420 ? 18.929 33.335 59.742 1.00 39.73 ? 479 LEU B CB 1 ATOM 6903 C CG . LEU B 1 420 ? 19.976 33.026 60.812 1.00 51.30 ? 479 LEU B CG 1 ATOM 6904 C CD1 . LEU B 1 420 ? 19.602 33.683 62.131 1.00 51.79 ? 479 LEU B CD1 1 ATOM 6905 C CD2 . LEU B 1 420 ? 20.143 31.524 60.982 1.00 66.05 ? 479 LEU B CD2 1 ATOM 6906 N N . VAL B 1 421 ? 17.898 32.321 56.358 1.00 57.59 ? 480 VAL B N 1 ATOM 6907 C CA . VAL B 1 421 ? 16.812 32.507 55.405 1.00 54.95 ? 480 VAL B CA 1 ATOM 6908 C C . VAL B 1 421 ? 15.943 31.254 55.311 1.00 60.73 ? 480 VAL B C 1 ATOM 6909 O O . VAL B 1 421 ? 16.433 30.131 55.432 1.00 56.55 ? 480 VAL B O 1 ATOM 6910 C CB . VAL B 1 421 ? 17.345 32.871 54.000 1.00 48.49 ? 480 VAL B CB 1 ATOM 6911 C CG1 . VAL B 1 421 ? 18.105 34.189 54.046 1.00 46.69 ? 480 VAL B CG1 1 ATOM 6912 C CG2 . VAL B 1 421 ? 18.226 31.756 53.449 1.00 45.11 ? 480 VAL B CG2 1 ATOM 6913 N N . ALA B 1 422 ? 14.646 31.456 55.101 1.00 56.80 ? 481 ALA B N 1 ATOM 6914 C CA . ALA B 1 422 ? 13.702 30.348 55.038 1.00 50.55 ? 481 ALA B CA 1 ATOM 6915 C C . ALA B 1 422 ? 13.699 29.741 53.641 1.00 53.65 ? 481 ALA B C 1 ATOM 6916 O O . ALA B 1 422 ? 13.317 28.587 53.449 1.00 66.18 ? 481 ALA B O 1 ATOM 6917 C CB . ALA B 1 422 ? 12.308 30.814 55.422 1.00 53.17 ? 481 ALA B CB 1 ATOM 6918 N N . GLU B 1 423 ? 14.126 30.539 52.668 1.00 59.81 ? 482 GLU B N 1 ATOM 6919 C CA . GLU B 1 423 ? 14.327 30.076 51.300 1.00 58.67 ? 482 GLU B CA 1 ATOM 6920 C C . GLU B 1 423 ? 15.565 30.744 50.720 1.00 55.67 ? 482 GLU B C 1 ATOM 6921 O O . GLU B 1 423 ? 15.870 31.891 51.048 1.00 63.89 ? 482 GLU B O 1 ATOM 6922 C CB . GLU B 1 423 ? 13.108 30.372 50.425 1.00 70.33 ? 482 GLU B CB 1 ATOM 6923 C CG . GLU B 1 423 ? 13.156 29.707 49.051 1.00 91.15 ? 482 GLU B CG 1 ATOM 6924 C CD . GLU B 1 423 ? 12.176 30.318 48.069 1.00 94.43 ? 482 GLU B CD 1 ATOM 6925 O OE1 . GLU B 1 423 ? 11.211 30.967 48.523 1.00 95.69 ? 482 GLU B OE1 1 ATOM 6926 O OE2 . GLU B 1 423 ? 12.366 30.146 46.846 1.00 92.65 ? 482 GLU B OE2 1 ATOM 6927 N N . TYR B 1 424 ? 16.280 30.030 49.859 1.00 67.88 ? 483 TYR B N 1 ATOM 6928 C CA . TYR B 1 424 ? 17.464 30.601 49.240 1.00 61.40 ? 483 TYR B CA 1 ATOM 6929 C C . TYR B 1 424 ? 17.158 31.155 47.859 1.00 56.66 ? 483 TYR B C 1 ATOM 6930 O O . TYR B 1 424 ? 16.527 30.502 47.028 1.00 62.49 ? 483 TYR B O 1 ATOM 6931 C CB . TYR B 1 424 ? 18.587 29.569 49.137 1.00 49.07 ? 483 TYR B CB 1 ATOM 6932 C CG . TYR B 1 424 ? 19.795 30.097 48.398 1.00 49.60 ? 483 TYR B CG 1 ATOM 6933 C CD1 . TYR B 1 424 ? 20.639 31.031 48.985 1.00 37.85 ? 483 TYR B CD1 1 ATOM 6934 C CD2 . TYR B 1 424 ? 20.079 29.679 47.104 1.00 36.47 ? 483 TYR B CD2 1 ATOM 6935 C CE1 . TYR B 1 424 ? 21.740 31.525 48.308 1.00 35.87 ? 483 TYR B CE1 1 ATOM 6936 C CE2 . TYR B 1 424 ? 21.176 30.166 46.420 1.00 53.16 ? 483 TYR B CE2 1 ATOM 6937 C CZ . TYR B 1 424 ? 22.003 31.088 47.026 1.00 55.66 ? 483 TYR B CZ 1 ATOM 6938 O OH . TYR B 1 424 ? 23.095 31.575 46.347 1.00 62.04 ? 483 TYR B OH 1 ATOM 6939 N N . ASN B 1 425 ? 17.623 32.377 47.633 1.00 59.05 ? 484 ASN B N 1 ATOM 6940 C CA . ASN B 1 425 ? 17.476 33.050 46.355 1.00 72.56 ? 484 ASN B CA 1 ATOM 6941 C C . ASN B 1 425 ? 18.809 33.656 45.958 1.00 71.84 ? 484 ASN B C 1 ATOM 6942 O O . ASN B 1 425 ? 19.380 34.444 46.710 1.00 45.56 ? 484 ASN B O 1 ATOM 6943 C CB . ASN B 1 425 ? 16.399 34.133 46.425 1.00 53.32 ? 484 ASN B CB 1 ATOM 6944 C CG . ASN B 1 425 ? 15.033 33.574 46.759 1.00 57.24 ? 484 ASN B CG 1 ATOM 6945 O OD1 . ASN B 1 425 ? 14.534 33.747 47.871 1.00 70.07 ? 484 ASN B OD1 1 ATOM 6946 N ND2 . ASN B 1 425 ? 14.420 32.896 45.796 1.00 52.11 ? 484 ASN B ND2 1 ATOM 6947 N N . ASN B 1 426 ? 19.312 33.266 44.792 1.00 76.77 ? 485 ASN B N 1 ATOM 6948 C CA . ASN B 1 426 ? 20.582 33.778 44.296 1.00 71.10 ? 485 ASN B CA 1 ATOM 6949 C C . ASN B 1 426 ? 20.373 34.957 43.344 1.00 81.40 ? 485 ASN B C 1 ATOM 6950 O O . ASN B 1 426 ? 19.882 34.775 42.229 1.00 81.33 ? 485 ASN B O 1 ATOM 6951 C CB . ASN B 1 426 ? 21.355 32.671 43.582 1.00 59.65 ? 485 ASN B CB 1 ATOM 6952 C CG . ASN B 1 426 ? 22.755 33.094 43.189 1.00 78.50 ? 485 ASN B CG 1 ATOM 6953 O OD1 . ASN B 1 426 ? 22.937 33.958 42.334 1.00 86.71 ? 485 ASN B OD1 1 ATOM 6954 N ND2 . ASN B 1 426 ? 23.756 32.447 43.777 1.00 75.87 ? 485 ASN B ND2 1 ATOM 6955 N N . PRO B 1 427 ? 20.768 36.168 43.778 1.00 85.70 ? 486 PRO B N 1 ATOM 6956 C CA . PRO B 1 427 ? 20.686 37.413 43.001 1.00 92.25 ? 486 PRO B CA 1 ATOM 6957 C C . PRO B 1 427 ? 21.316 37.305 41.617 1.00 89.28 ? 486 PRO B C 1 ATOM 6958 O O . PRO B 1 427 ? 20.831 37.908 40.658 1.00 79.06 ? 486 PRO B O 1 ATOM 6959 C CB . PRO B 1 427 ? 21.477 38.418 43.845 1.00 80.06 ? 486 PRO B CB 1 ATOM 6960 C CG . PRO B 1 427 ? 21.593 37.829 45.202 1.00 74.12 ? 486 PRO B CG 1 ATOM 6961 C CD . PRO B 1 427 ? 21.108 36.418 45.188 1.00 76.29 ? 486 PRO B CD 1 ATOM 6962 N N . ASP B 1 428 ? 22.399 36.540 41.529 1.00 68.17 ? 487 ASP B N 1 ATOM 6963 C CA . ASP B 1 428 ? 23.193 36.463 40.311 1.00 56.65 ? 487 ASP B CA 1 ATOM 6964 C C . ASP B 1 428 ? 22.573 35.503 39.302 1.00 50.86 ? 487 ASP B C 1 ATOM 6965 O O . ASP B 1 428 ? 21.735 34.674 39.655 1.00 58.77 ? 487 ASP B O 1 ATOM 6966 C CB . ASP B 1 428 ? 24.625 36.033 40.640 1.00 99.62 ? 487 ASP B CB 1 ATOM 6967 C CG . ASP B 1 428 ? 25.317 36.990 41.592 1.00 108.10 ? 487 ASP B CG 1 ATOM 6968 O OD1 . ASP B 1 428 ? 26.522 37.256 41.398 1.00 110.81 ? 487 ASP B OD1 1 ATOM 6969 O OD2 . ASP B 1 428 ? 24.660 37.471 42.539 1.00 107.47 ? 487 ASP B OD2 1 ATOM 6970 N N . PRO C 1 3 ? 34.728 79.923 17.128 1.00 61.43 ? 62 PRO C N 1 ATOM 6971 C CA . PRO C 1 3 ? 34.461 79.459 18.494 1.00 63.44 ? 62 PRO C CA 1 ATOM 6972 C C . PRO C 1 3 ? 34.602 77.946 18.633 1.00 63.31 ? 62 PRO C C 1 ATOM 6973 O O . PRO C 1 3 ? 34.158 77.203 17.759 1.00 62.10 ? 62 PRO C O 1 ATOM 6974 C CB . PRO C 1 3 ? 33.014 79.897 18.733 1.00 50.32 ? 62 PRO C CB 1 ATOM 6975 C CG . PRO C 1 3 ? 32.409 79.939 17.374 1.00 40.55 ? 62 PRO C CG 1 ATOM 6976 C CD . PRO C 1 3 ? 33.506 80.399 16.457 1.00 46.20 ? 62 PRO C CD 1 ATOM 6977 N N . HIS C 1 4 ? 35.218 77.501 19.724 1.00 51.40 ? 63 HIS C N 1 ATOM 6978 C CA . HIS C 1 4 ? 35.393 76.076 19.977 1.00 43.04 ? 63 HIS C CA 1 ATOM 6979 C C . HIS C 1 4 ? 34.066 75.430 20.358 1.00 44.37 ? 63 HIS C C 1 ATOM 6980 O O . HIS C 1 4 ? 33.781 74.300 19.964 1.00 54.42 ? 63 HIS C O 1 ATOM 6981 C CB . HIS C 1 4 ? 36.436 75.843 21.070 1.00 53.06 ? 63 HIS C CB 1 ATOM 6982 C CG . HIS C 1 4 ? 37.829 76.222 20.668 1.00 57.30 ? 63 HIS C CG 1 ATOM 6983 N ND1 . HIS C 1 4 ? 38.108 77.330 19.897 1.00 49.91 ? 63 HIS C ND1 1 ATOM 6984 C CD2 . HIS C 1 4 ? 39.022 75.636 20.928 1.00 52.25 ? 63 HIS C CD2 1 ATOM 6985 C CE1 . HIS C 1 4 ? 39.411 77.412 19.701 1.00 61.48 ? 63 HIS C CE1 1 ATOM 6986 N NE2 . HIS C 1 4 ? 39.989 76.396 20.316 1.00 53.42 ? 63 HIS C NE2 1 ATOM 6987 N N . GLN C 1 5 ? 33.262 76.149 21.137 1.00 38.40 ? 64 GLN C N 1 ATOM 6988 C CA . GLN C 1 5 ? 31.888 75.737 21.403 1.00 45.47 ? 64 GLN C CA 1 ATOM 6989 C C . GLN C 1 5 ? 30.926 76.593 20.586 1.00 48.32 ? 64 GLN C C 1 ATOM 6990 O O . GLN C 1 5 ? 30.560 77.692 21.003 1.00 50.85 ? 64 GLN C O 1 ATOM 6991 C CB . GLN C 1 5 ? 31.558 75.843 22.894 1.00 30.24 ? 64 GLN C CB 1 ATOM 6992 C CG . GLN C 1 5 ? 32.264 74.815 23.763 1.00 43.66 ? 64 GLN C CG 1 ATOM 6993 C CD . GLN C 1 5 ? 31.742 74.800 25.186 1.00 40.79 ? 64 GLN C CD 1 ATOM 6994 O OE1 . GLN C 1 5 ? 30.533 74.773 25.415 1.00 49.95 ? 64 GLN C OE1 1 ATOM 6995 N NE2 . GLN C 1 5 ? 32.653 74.815 26.151 1.00 41.42 ? 64 GLN C NE2 1 ATOM 6996 N N . PRO C 1 6 ? 30.514 76.088 19.414 1.00 42.61 ? 65 PRO C N 1 ATOM 6997 C CA . PRO C 1 6 ? 29.684 76.850 18.478 1.00 50.71 ? 65 PRO C CA 1 ATOM 6998 C C . PRO C 1 6 ? 28.205 76.849 18.849 1.00 36.68 ? 65 PRO C C 1 ATOM 6999 O O . PRO C 1 6 ? 27.795 76.138 19.767 1.00 42.53 ? 65 PRO C O 1 ATOM 7000 C CB . PRO C 1 6 ? 29.906 76.120 17.155 1.00 28.91 ? 65 PRO C CB 1 ATOM 7001 C CG . PRO C 1 6 ? 30.106 74.708 17.566 1.00 44.46 ? 65 PRO C CG 1 ATOM 7002 C CD . PRO C 1 6 ? 30.837 74.750 18.888 1.00 40.49 ? 65 PRO C CD 1 ATOM 7003 N N . ILE C 1 7 ? 27.420 77.646 18.132 1.00 39.94 ? 66 ILE C N 1 ATOM 7004 C CA . ILE C 1 7 ? 25.972 77.659 18.297 1.00 51.69 ? 66 ILE C CA 1 ATOM 7005 C C . ILE C 1 7 ? 25.377 76.321 17.874 1.00 45.94 ? 66 ILE C C 1 ATOM 7006 O O . ILE C 1 7 ? 26.018 75.558 17.149 1.00 43.67 ? 66 ILE C O 1 ATOM 7007 C CB . ILE C 1 7 ? 25.318 78.786 17.469 1.00 58.14 ? 66 ILE C CB 1 ATOM 7008 C CG1 . ILE C 1 7 ? 25.705 78.658 15.995 1.00 37.48 ? 66 ILE C CG1 1 ATOM 7009 C CG2 . ILE C 1 7 ? 25.711 80.149 18.012 1.00 62.68 ? 66 ILE C CG2 1 ATOM 7010 C CD1 . ILE C 1 7 ? 24.968 79.616 15.087 1.00 55.48 ? 66 ILE C CD1 1 ATOM 7011 N N . PRO C 1 8 ? 24.152 76.022 18.334 1.00 50.97 ? 67 PRO C N 1 ATOM 7012 C CA . PRO C 1 8 ? 23.436 74.870 17.780 1.00 43.67 ? 67 PRO C CA 1 ATOM 7013 C C . PRO C 1 8 ? 23.260 75.011 16.270 1.00 51.25 ? 67 PRO C C 1 ATOM 7014 O O . PRO C 1 8 ? 22.779 76.049 15.815 1.00 33.96 ? 67 PRO C O 1 ATOM 7015 C CB . PRO C 1 8 ? 22.088 74.912 18.506 1.00 41.89 ? 67 PRO C CB 1 ATOM 7016 C CG . PRO C 1 8 ? 22.383 75.604 19.793 1.00 39.79 ? 67 PRO C CG 1 ATOM 7017 C CD . PRO C 1 8 ? 23.438 76.622 19.476 1.00 50.72 ? 67 PRO C CD 1 ATOM 7018 N N . PRO C 1 9 ? 23.658 73.982 15.504 1.00 39.48 ? 68 PRO C N 1 ATOM 7019 C CA . PRO C 1 9 ? 23.628 73.999 14.035 1.00 46.21 ? 68 PRO C CA 1 ATOM 7020 C C . PRO C 1 9 ? 22.257 74.351 13.460 1.00 50.11 ? 68 PRO C C 1 ATOM 7021 O O . PRO C 1 9 ? 22.183 74.936 12.380 1.00 48.58 ? 68 PRO C O 1 ATOM 7022 C CB . PRO C 1 9 ? 24.022 72.564 13.656 1.00 46.04 ? 68 PRO C CB 1 ATOM 7023 C CG . PRO C 1 9 ? 23.809 71.757 14.893 1.00 48.92 ? 68 PRO C CG 1 ATOM 7024 C CD . PRO C 1 9 ? 24.106 72.681 16.025 1.00 39.48 ? 68 PRO C CD 1 ATOM 7025 N N . SER C 1 10 ? 21.194 73.990 14.172 1.00 40.77 ? 69 SER C N 1 ATOM 7026 C CA . SER C 1 10 ? 19.836 74.325 13.758 1.00 48.10 ? 69 SER C CA 1 ATOM 7027 C C . SER C 1 10 ? 19.607 75.834 13.752 1.00 58.40 ? 69 SER C C 1 ATOM 7028 O O . SER C 1 10 ? 18.786 76.343 12.990 1.00 69.91 ? 69 SER C O 1 ATOM 7029 C CB . SER C 1 10 ? 18.816 73.645 14.673 1.00 38.20 ? 69 SER C CB 1 ATOM 7030 O OG . SER C 1 10 ? 18.860 74.195 15.979 1.00 55.60 ? 69 SER C OG 1 ATOM 7031 N N . LEU C 1 11 ? 20.337 76.542 14.609 1.00 55.23 ? 70 LEU C N 1 ATOM 7032 C CA . LEU C 1 11 ? 20.231 77.996 14.699 1.00 44.11 ? 70 LEU C CA 1 ATOM 7033 C C . LEU C 1 11 ? 21.248 78.697 13.803 1.00 35.34 ? 70 LEU C C 1 ATOM 7034 O O . LEU C 1 11 ? 21.365 79.922 13.824 1.00 39.48 ? 70 LEU C O 1 ATOM 7035 C CB . LEU C 1 11 ? 20.405 78.457 16.149 1.00 43.77 ? 70 LEU C CB 1 ATOM 7036 C CG . LEU C 1 11 ? 19.308 78.029 17.125 1.00 55.02 ? 70 LEU C CG 1 ATOM 7037 C CD1 . LEU C 1 11 ? 19.645 78.472 18.541 1.00 29.99 ? 70 LEU C CD1 1 ATOM 7038 C CD2 . LEU C 1 11 ? 17.960 78.582 16.688 1.00 30.31 ? 70 LEU C CD2 1 ATOM 7039 N N . GLY C 1 12 ? 21.977 77.915 13.014 1.00 52.75 ? 71 GLY C N 1 ATOM 7040 C CA . GLY C 1 12 ? 22.990 78.450 12.122 1.00 55.47 ? 71 GLY C CA 1 ATOM 7041 C C . GLY C 1 12 ? 22.527 78.440 10.678 1.00 61.48 ? 71 GLY C C 1 ATOM 7042 O O . GLY C 1 12 ? 21.360 78.167 10.402 1.00 59.96 ? 71 GLY C O 1 ATOM 7043 N N . GLU C 1 13 ? 23.438 78.741 9.756 1.00 53.89 ? 72 GLU C N 1 ATOM 7044 C CA . GLU C 1 13 ? 23.110 78.726 8.334 1.00 70.73 ? 72 GLU C CA 1 ATOM 7045 C C . GLU C 1 13 ? 22.701 77.323 7.898 1.00 67.84 ? 72 GLU C C 1 ATOM 7046 O O . GLU C 1 13 ? 23.409 76.349 8.148 1.00 56.43 ? 72 GLU C O 1 ATOM 7047 C CB . GLU C 1 13 ? 24.281 79.230 7.493 1.00 82.99 ? 72 GLU C CB 1 ATOM 7048 C CG . GLU C 1 13 ? 24.107 78.965 6.009 1.00 99.59 ? 72 GLU C CG 1 ATOM 7049 C CD . GLU C 1 13 ? 25.076 79.754 5.157 1.00 109.01 ? 72 GLU C CD 1 ATOM 7050 O OE1 . GLU C 1 13 ? 24.936 80.994 5.100 1.00 111.13 ? 72 GLU C OE1 1 ATOM 7051 O OE2 . GLU C 1 13 ? 25.972 79.139 4.542 1.00 113.23 ? 72 GLU C OE2 1 ATOM 7052 N N . LYS C 1 14 ? 21.543 77.235 7.252 1.00 69.17 ? 73 LYS C N 1 ATOM 7053 C CA . LYS C 1 14 ? 20.961 75.958 6.868 1.00 59.16 ? 73 LYS C CA 1 ATOM 7054 C C . LYS C 1 14 ? 21.805 75.264 5.801 1.00 61.66 ? 73 LYS C C 1 ATOM 7055 O O . LYS C 1 14 ? 22.068 75.837 4.743 1.00 75.84 ? 73 LYS C O 1 ATOM 7056 C CB . LYS C 1 14 ? 19.543 76.177 6.338 1.00 62.06 ? 73 LYS C CB 1 ATOM 7057 C CG . LYS C 1 14 ? 18.525 76.590 7.396 1.00 80.10 ? 73 LYS C CG 1 ATOM 7058 C CD . LYS C 1 14 ? 18.316 75.561 8.486 1.00 97.19 ? 73 LYS C CD 1 ATOM 7059 C CE . LYS C 1 14 ? 17.560 76.191 9.651 1.00 100.01 ? 73 LYS C CE 1 ATOM 7060 N NZ . LYS C 1 14 ? 16.428 77.040 9.179 1.00 84.57 ? 73 LYS C NZ 1 ATOM 7061 N N . ASP C 1 15 ? 22.237 74.037 6.077 1.00 64.94 ? 74 ASP C N 1 ATOM 7062 C CA . ASP C 1 15 ? 23.000 73.278 5.092 1.00 68.66 ? 74 ASP C CA 1 ATOM 7063 C C . ASP C 1 15 ? 22.058 72.731 4.023 1.00 66.26 ? 74 ASP C C 1 ATOM 7064 O O . ASP C 1 15 ? 21.197 71.900 4.310 1.00 72.95 ? 74 ASP C O 1 ATOM 7065 C CB . ASP C 1 15 ? 23.778 72.142 5.760 1.00 65.55 ? 74 ASP C CB 1 ATOM 7066 C CG . ASP C 1 15 ? 24.727 71.441 4.802 1.00 68.21 ? 74 ASP C CG 1 ATOM 7067 O OD1 . ASP C 1 15 ? 24.934 71.950 3.681 1.00 83.39 ? 74 ASP C OD1 1 ATOM 7068 O OD2 . ASP C 1 15 ? 25.274 70.382 5.175 1.00 80.26 ? 74 ASP C OD2 1 ATOM 7069 N N . LEU C 1 16 ? 22.230 73.197 2.792 1.00 67.89 ? 75 LEU C N 1 ATOM 7070 C CA . LEU C 1 16 ? 21.353 72.807 1.693 1.00 74.26 ? 75 LEU C CA 1 ATOM 7071 C C . LEU C 1 16 ? 21.979 71.736 0.805 1.00 68.51 ? 75 LEU C C 1 ATOM 7072 O O . LEU C 1 16 ? 21.370 71.289 -0.167 1.00 61.80 ? 75 LEU C O 1 ATOM 7073 C CB . LEU C 1 16 ? 20.983 74.031 0.858 1.00 70.76 ? 75 LEU C CB 1 ATOM 7074 C CG . LEU C 1 16 ? 20.279 75.148 1.630 1.00 61.23 ? 75 LEU C CG 1 ATOM 7075 C CD1 . LEU C 1 16 ? 19.927 76.287 0.700 1.00 68.11 ? 75 LEU C CD1 1 ATOM 7076 C CD2 . LEU C 1 16 ? 19.036 74.621 2.331 1.00 42.43 ? 75 LEU C CD2 1 ATOM 7077 N N . SER C 1 17 ? 23.197 71.331 1.145 1.00 62.13 ? 76 SER C N 1 ATOM 7078 C CA . SER C 1 17 ? 23.937 70.360 0.348 1.00 61.51 ? 76 SER C CA 1 ATOM 7079 C C . SER C 1 17 ? 23.292 68.979 0.400 1.00 60.39 ? 76 SER C C 1 ATOM 7080 O O . SER C 1 17 ? 22.579 68.654 1.347 1.00 68.15 ? 76 SER C O 1 ATOM 7081 C CB . SER C 1 17 ? 25.388 70.277 0.825 1.00 59.16 ? 76 SER C CB 1 ATOM 7082 O OG . SER C 1 17 ? 25.456 69.803 2.159 1.00 73.01 ? 76 SER C OG 1 ATOM 7083 N N . ASP C 1 18 ? 23.547 68.175 -0.627 1.00 64.06 ? 77 ASP C N 1 ATOM 7084 C CA . ASP C 1 18 ? 23.018 66.817 -0.693 1.00 67.56 ? 77 ASP C CA 1 ATOM 7085 C C . ASP C 1 18 ? 23.828 65.908 0.225 1.00 65.25 ? 77 ASP C C 1 ATOM 7086 O O . ASP C 1 18 ? 25.018 65.695 -0.001 1.00 51.20 ? 77 ASP C O 1 ATOM 7087 C CB . ASP C 1 18 ? 23.055 66.301 -2.135 1.00 75.01 ? 77 ASP C CB 1 ATOM 7088 C CG . ASP C 1 18 ? 22.430 64.925 -2.288 1.00 77.73 ? 77 ASP C CG 1 ATOM 7089 O OD1 . ASP C 1 18 ? 21.731 64.470 -1.360 1.00 84.64 ? 77 ASP C OD1 1 ATOM 7090 O OD2 . ASP C 1 18 ? 22.641 64.296 -3.347 1.00 72.63 ? 77 ASP C OD2 1 ATOM 7091 N N . PRO C 1 19 ? 23.179 65.367 1.268 1.00 55.50 ? 78 PRO C N 1 ATOM 7092 C CA . PRO C 1 19 ? 23.848 64.516 2.259 1.00 40.16 ? 78 PRO C CA 1 ATOM 7093 C C . PRO C 1 19 ? 24.325 63.178 1.698 1.00 39.05 ? 78 PRO C C 1 ATOM 7094 O O . PRO C 1 19 ? 25.037 62.450 2.388 1.00 58.74 ? 78 PRO C O 1 ATOM 7095 C CB . PRO C 1 19 ? 22.762 64.289 3.321 1.00 53.59 ? 78 PRO C CB 1 ATOM 7096 C CG . PRO C 1 19 ? 21.741 65.356 3.083 1.00 46.94 ? 78 PRO C CG 1 ATOM 7097 C CD . PRO C 1 19 ? 21.768 65.609 1.614 1.00 52.74 ? 78 PRO C CD 1 ATOM 7098 N N . PHE C 1 20 ? 23.941 62.863 0.467 1.00 48.20 ? 79 PHE C N 1 ATOM 7099 C CA . PHE C 1 20 ? 24.279 61.572 -0.120 1.00 64.40 ? 79 PHE C CA 1 ATOM 7100 C C . PHE C 1 20 ? 24.914 61.716 -1.501 1.00 64.68 ? 79 PHE C C 1 ATOM 7101 O O . PHE C 1 20 ? 24.748 60.857 -2.366 1.00 69.79 ? 79 PHE C O 1 ATOM 7102 C CB . PHE C 1 20 ? 23.032 60.690 -0.181 1.00 51.07 ? 79 PHE C CB 1 ATOM 7103 C CG . PHE C 1 20 ? 22.382 60.484 1.158 1.00 46.09 ? 79 PHE C CG 1 ATOM 7104 C CD1 . PHE C 1 20 ? 22.811 59.474 2.003 1.00 54.55 ? 79 PHE C CD1 1 ATOM 7105 C CD2 . PHE C 1 20 ? 21.358 61.316 1.582 1.00 36.76 ? 79 PHE C CD2 1 ATOM 7106 C CE1 . PHE C 1 20 ? 22.225 59.290 3.241 1.00 46.26 ? 79 PHE C CE1 1 ATOM 7107 C CE2 . PHE C 1 20 ? 20.768 61.136 2.819 1.00 44.39 ? 79 PHE C CE2 1 ATOM 7108 C CZ . PHE C 1 20 ? 21.203 60.124 3.650 1.00 54.12 ? 79 PHE C CZ 1 ATOM 7109 N N . ASN C 1 21 ? 25.641 62.811 -1.695 1.00 72.32 ? 80 ASN C N 1 ATOM 7110 C CA . ASN C 1 21 ? 26.382 63.048 -2.928 1.00 69.37 ? 80 ASN C CA 1 ATOM 7111 C C . ASN C 1 21 ? 27.767 62.396 -2.846 1.00 66.09 ? 80 ASN C C 1 ATOM 7112 O O . ASN C 1 21 ? 28.763 62.975 -3.279 1.00 88.84 ? 80 ASN C O 1 ATOM 7113 C CB . ASN C 1 21 ? 26.499 64.554 -3.196 1.00 76.60 ? 80 ASN C CB 1 ATOM 7114 C CG . ASN C 1 21 ? 26.952 64.876 -4.617 1.00 80.71 ? 80 ASN C CG 1 ATOM 7115 O OD1 . ASN C 1 21 ? 26.268 65.599 -5.340 1.00 89.53 ? 80 ASN C OD1 1 ATOM 7116 N ND2 . ASN C 1 21 ? 28.102 64.348 -5.019 1.00 83.96 ? 80 ASN C ND2 1 ATOM 7117 N N . PHE C 1 22 ? 27.830 61.194 -2.282 1.00 57.84 ? 81 PHE C N 1 ATOM 7118 C CA . PHE C 1 22 ? 29.093 60.470 -2.188 1.00 62.98 ? 81 PHE C CA 1 ATOM 7119 C C . PHE C 1 22 ? 29.063 59.179 -3.002 1.00 64.97 ? 81 PHE C C 1 ATOM 7120 O O . PHE C 1 22 ? 28.000 58.617 -3.261 1.00 65.92 ? 81 PHE C O 1 ATOM 7121 C CB . PHE C 1 22 ? 29.445 60.178 -0.724 1.00 56.89 ? 81 PHE C CB 1 ATOM 7122 C CG . PHE C 1 22 ? 28.441 59.318 -0.008 1.00 53.97 ? 81 PHE C CG 1 ATOM 7123 C CD1 . PHE C 1 22 ? 28.571 57.939 0.000 1.00 50.91 ? 81 PHE C CD1 1 ATOM 7124 C CD2 . PHE C 1 22 ? 27.381 59.889 0.676 1.00 43.30 ? 81 PHE C CD2 1 ATOM 7125 C CE1 . PHE C 1 22 ? 27.655 57.145 0.663 1.00 48.08 ? 81 PHE C CE1 1 ATOM 7126 C CE2 . PHE C 1 22 ? 26.461 59.100 1.342 1.00 45.64 ? 81 PHE C CE2 1 ATOM 7127 C CZ . PHE C 1 22 ? 26.599 57.726 1.336 1.00 44.78 ? 81 PHE C CZ 1 ATOM 7128 N N . LEU C 1 23 ? 30.245 58.727 -3.412 1.00 72.55 ? 82 LEU C N 1 ATOM 7129 C CA . LEU C 1 23 ? 30.383 57.527 -4.231 1.00 75.26 ? 82 LEU C CA 1 ATOM 7130 C C . LEU C 1 23 ? 30.473 56.259 -3.389 1.00 69.27 ? 82 LEU C C 1 ATOM 7131 O O . LEU C 1 23 ? 31.260 56.184 -2.446 1.00 77.53 ? 82 LEU C O 1 ATOM 7132 C CB . LEU C 1 23 ? 31.630 57.635 -5.113 1.00 88.98 ? 82 LEU C CB 1 ATOM 7133 C CG . LEU C 1 23 ? 31.605 58.578 -6.317 1.00 94.05 ? 82 LEU C CG 1 ATOM 7134 C CD1 . LEU C 1 23 ? 33.013 58.758 -6.867 1.00 93.46 ? 82 LEU C CD1 1 ATOM 7135 C CD2 . LEU C 1 23 ? 30.670 58.060 -7.398 1.00 89.89 ? 82 LEU C CD2 1 ATOM 7136 N N . PHE C 1 24 ? 29.659 55.264 -3.731 1.00 75.60 ? 83 PHE C N 1 ATOM 7137 C CA . PHE C 1 24 ? 29.727 53.968 -3.067 1.00 80.59 ? 83 PHE C CA 1 ATOM 7138 C C . PHE C 1 24 ? 29.655 52.862 -4.125 1.00 80.12 ? 83 PHE C C 1 ATOM 7139 O O . PHE C 1 24 ? 29.446 53.144 -5.305 1.00 83.48 ? 83 PHE C O 1 ATOM 7140 C CB . PHE C 1 24 ? 28.606 53.830 -2.034 1.00 79.29 ? 83 PHE C CB 1 ATOM 7141 C CG . PHE C 1 24 ? 28.872 52.784 -0.989 1.00 73.76 ? 83 PHE C CG 1 ATOM 7142 C CD1 . PHE C 1 24 ? 29.805 53.020 0.008 1.00 55.54 ? 83 PHE C CD1 1 ATOM 7143 C CD2 . PHE C 1 24 ? 28.192 51.578 -0.992 1.00 64.62 ? 83 PHE C CD2 1 ATOM 7144 C CE1 . PHE C 1 24 ? 30.063 52.072 0.977 1.00 61.47 ? 83 PHE C CE1 1 ATOM 7145 C CE2 . PHE C 1 24 ? 28.446 50.623 -0.023 1.00 65.63 ? 83 PHE C CE2 1 ATOM 7146 C CZ . PHE C 1 24 ? 29.382 50.872 0.963 1.00 59.78 ? 83 PHE C CZ 1 ATOM 7147 N N . SER C 1 25 ? 29.820 51.609 -3.709 1.00 90.76 ? 84 SER C N 1 ATOM 7148 C CA . SER C 1 25 ? 29.791 50.491 -4.651 1.00 100.31 ? 84 SER C CA 1 ATOM 7149 C C . SER C 1 25 ? 28.474 49.715 -4.668 1.00 98.01 ? 84 SER C C 1 ATOM 7150 O O . SER C 1 25 ? 27.769 49.632 -3.662 1.00 98.77 ? 84 SER C O 1 ATOM 7151 C CB . SER C 1 25 ? 30.938 49.526 -4.342 1.00 97.46 ? 84 SER C CB 1 ATOM 7152 O OG . SER C 1 25 ? 30.899 48.399 -5.200 1.00 90.90 ? 84 SER C OG 1 ATOM 7153 N N . SER C 1 26 ? 28.153 49.156 -5.831 1.00 93.95 ? 85 SER C N 1 ATOM 7154 C CA . SER C 1 26 ? 26.932 48.380 -6.020 1.00 95.37 ? 85 SER C CA 1 ATOM 7155 C C . SER C 1 26 ? 27.259 46.939 -6.406 1.00 92.47 ? 85 SER C C 1 ATOM 7156 O O . SER C 1 26 ? 26.427 46.240 -6.984 1.00 85.03 ? 85 SER C O 1 ATOM 7157 C CB . SER C 1 26 ? 26.044 49.027 -7.086 1.00 90.57 ? 85 SER C CB 1 ATOM 7158 O OG . SER C 1 26 ? 26.604 48.878 -8.379 1.00 81.06 ? 85 SER C OG 1 ATOM 7159 N N . ASN C 1 27 ? 28.479 46.506 -6.097 1.00 87.07 ? 86 ASN C N 1 ATOM 7160 C CA . ASN C 1 27 ? 28.921 45.149 -6.409 1.00 76.20 ? 86 ASN C CA 1 ATOM 7161 C C . ASN C 1 27 ? 28.118 44.097 -5.642 1.00 75.59 ? 86 ASN C C 1 ATOM 7162 O O . ASN C 1 27 ? 28.131 44.053 -4.412 1.00 89.47 ? 86 ASN C O 1 ATOM 7163 C CB . ASN C 1 27 ? 30.419 45.002 -6.123 1.00 75.61 ? 86 ASN C CB 1 ATOM 7164 C CG . ASN C 1 27 ? 30.983 43.668 -6.591 1.00 74.22 ? 86 ASN C CG 1 ATOM 7165 O OD1 . ASN C 1 27 ? 30.519 42.603 -6.187 1.00 60.88 ? 86 ASN C OD1 1 ATOM 7166 N ND2 . ASN C 1 27 ? 31.990 43.727 -7.455 1.00 91.03 ? 86 ASN C ND2 1 ATOM 7167 N N . LYS C 1 28 ? 27.424 43.255 -6.399 1.00 61.99 ? 87 LYS C N 1 ATOM 7168 C CA . LYS C 1 28 ? 26.470 42.274 -5.880 1.00 69.19 ? 87 LYS C CA 1 ATOM 7169 C C . LYS C 1 28 ? 27.035 40.895 -5.538 1.00 64.03 ? 87 LYS C C 1 ATOM 7170 O O . LYS C 1 28 ? 26.287 40.025 -5.097 1.00 56.11 ? 87 LYS C O 1 ATOM 7171 C CB . LYS C 1 28 ? 25.313 42.112 -6.866 1.00 67.41 ? 87 LYS C CB 1 ATOM 7172 C CG . LYS C 1 28 ? 24.655 43.424 -7.238 1.00 68.61 ? 87 LYS C CG 1 ATOM 7173 C CD . LYS C 1 28 ? 24.109 44.085 -5.982 1.00 78.14 ? 87 LYS C CD 1 ATOM 7174 C CE . LYS C 1 28 ? 23.445 45.413 -6.271 1.00 91.66 ? 87 LYS C CE 1 ATOM 7175 N NZ . LYS C 1 28 ? 23.023 46.088 -5.014 1.00 82.33 ? 87 LYS C NZ 1 ATOM 7176 N N . ILE C 1 29 ? 28.334 40.687 -5.730 1.00 64.90 ? 88 ILE C N 1 ATOM 7177 C CA . ILE C 1 29 ? 28.922 39.366 -5.500 1.00 72.93 ? 88 ILE C CA 1 ATOM 7178 C C . ILE C 1 29 ? 28.784 38.887 -4.054 1.00 73.80 ? 88 ILE C C 1 ATOM 7179 O O . ILE C 1 29 ? 28.322 37.769 -3.823 1.00 78.42 ? 88 ILE C O 1 ATOM 7180 C CB . ILE C 1 29 ? 30.419 39.347 -5.874 1.00 65.10 ? 88 ILE C CB 1 ATOM 7181 C CG1 . ILE C 1 29 ? 30.604 39.609 -7.370 1.00 61.01 ? 88 ILE C CG1 1 ATOM 7182 C CG2 . ILE C 1 29 ? 31.048 38.015 -5.499 1.00 32.94 ? 88 ILE C CG2 1 ATOM 7183 C CD1 . ILE C 1 29 ? 29.757 38.723 -8.257 1.00 66.07 ? 88 ILE C CD1 1 ATOM 7184 N N . THR C 1 30 ? 29.174 39.713 -3.089 1.00 67.08 ? 89 THR C N 1 ATOM 7185 C CA . THR C 1 30 ? 28.986 39.368 -1.680 1.00 66.96 ? 89 THR C CA 1 ATOM 7186 C C . THR C 1 30 ? 27.504 39.150 -1.373 1.00 65.66 ? 89 THR C C 1 ATOM 7187 O O . THR C 1 30 ? 27.132 38.200 -0.681 1.00 66.37 ? 89 THR C O 1 ATOM 7188 C CB . THR C 1 30 ? 29.546 40.457 -0.748 1.00 76.61 ? 89 THR C CB 1 ATOM 7189 O OG1 . THR C 1 30 ? 30.962 40.567 -0.935 1.00 76.72 ? 89 THR C OG1 1 ATOM 7190 C CG2 . THR C 1 30 ? 29.261 40.116 0.708 1.00 79.03 ? 89 THR C CG2 1 ATOM 7191 N N . LEU C 1 31 ? 26.669 40.038 -1.904 1.00 63.81 ? 90 LEU C N 1 ATOM 7192 C CA . LEU C 1 31 ? 25.221 39.980 -1.719 1.00 57.68 ? 90 LEU C CA 1 ATOM 7193 C C . LEU C 1 31 ? 24.614 38.667 -2.202 1.00 59.90 ? 90 LEU C C 1 ATOM 7194 O O . LEU C 1 31 ? 23.817 38.043 -1.502 1.00 53.54 ? 90 LEU C O 1 ATOM 7195 C CB . LEU C 1 31 ? 24.551 41.147 -2.451 1.00 45.11 ? 90 LEU C CB 1 ATOM 7196 C CG . LEU C 1 31 ? 23.021 41.214 -2.415 1.00 47.71 ? 90 LEU C CG 1 ATOM 7197 C CD1 . LEU C 1 31 ? 22.493 41.284 -0.996 1.00 39.42 ? 90 LEU C CD1 1 ATOM 7198 C CD2 . LEU C 1 31 ? 22.513 42.389 -3.233 1.00 56.85 ? 90 LEU C CD2 1 ATOM 7199 N N . ARG C 1 32 ? 24.999 38.259 -3.405 1.00 66.35 ? 91 ARG C N 1 ATOM 7200 C CA . ARG C 1 32 ? 24.455 37.062 -4.035 1.00 77.80 ? 91 ARG C CA 1 ATOM 7201 C C . ARG C 1 32 ? 24.923 35.780 -3.348 1.00 77.25 ? 91 ARG C C 1 ATOM 7202 O O . ARG C 1 32 ? 24.161 34.820 -3.232 1.00 61.20 ? 91 ARG C O 1 ATOM 7203 C CB . ARG C 1 32 ? 24.850 37.058 -5.512 1.00 78.96 ? 91 ARG C CB 1 ATOM 7204 C CG . ARG C 1 32 ? 24.149 38.148 -6.305 1.00 74.67 ? 91 ARG C CG 1 ATOM 7205 C CD . ARG C 1 32 ? 24.679 38.263 -7.722 1.00 79.86 ? 91 ARG C CD 1 ATOM 7206 N NE . ARG C 1 32 ? 24.097 39.416 -8.404 1.00 70.48 ? 91 ARG C NE 1 ATOM 7207 C CZ . ARG C 1 32 ? 24.281 39.702 -9.688 1.00 83.59 ? 91 ARG C CZ 1 ATOM 7208 N NH1 . ARG C 1 32 ? 25.047 38.924 -10.440 1.00 98.32 ? 91 ARG C NH1 1 ATOM 7209 N NH2 . ARG C 1 32 ? 23.712 40.777 -10.216 1.00 86.57 ? 91 ARG C NH2 1 ATOM 7210 N N . LYS C 1 33 ? 26.175 35.765 -2.901 1.00 64.47 ? 92 LYS C N 1 ATOM 7211 C CA . LYS C 1 33 ? 26.697 34.633 -2.139 1.00 60.47 ? 92 LYS C CA 1 ATOM 7212 C C . LYS C 1 33 ? 25.964 34.458 -0.813 1.00 76.84 ? 92 LYS C C 1 ATOM 7213 O O . LYS C 1 33 ? 25.698 33.336 -0.381 1.00 74.49 ? 92 LYS C O 1 ATOM 7214 C CB . LYS C 1 33 ? 28.196 34.801 -1.874 1.00 38.74 ? 92 LYS C CB 1 ATOM 7215 C CG . LYS C 1 33 ? 29.074 34.745 -3.110 1.00 37.85 ? 92 LYS C CG 1 ATOM 7216 C CD . LYS C 1 33 ? 30.540 34.869 -2.727 1.00 54.08 ? 92 LYS C CD 1 ATOM 7217 C CE . LYS C 1 33 ? 31.453 34.592 -3.907 1.00 69.58 ? 92 LYS C CE 1 ATOM 7218 N NZ . LYS C 1 33 ? 32.867 34.938 -3.595 1.00 73.38 ? 92 LYS C NZ 1 ATOM 7219 N N . LEU C 1 34 ? 25.641 35.578 -0.175 1.00 72.67 ? 93 LEU C N 1 ATOM 7220 C CA . LEU C 1 34 ? 24.911 35.562 1.087 1.00 68.26 ? 93 LEU C CA 1 ATOM 7221 C C . LEU C 1 34 ? 23.468 35.105 0.906 1.00 61.59 ? 93 LEU C C 1 ATOM 7222 O O . LEU C 1 34 ? 22.943 34.347 1.721 1.00 52.84 ? 93 LEU C O 1 ATOM 7223 C CB . LEU C 1 34 ? 24.948 36.949 1.733 1.00 64.35 ? 93 LEU C CB 1 ATOM 7224 C CG . LEU C 1 34 ? 26.247 37.306 2.460 1.00 61.05 ? 93 LEU C CG 1 ATOM 7225 C CD1 . LEU C 1 34 ? 26.312 38.795 2.763 1.00 63.48 ? 93 LEU C CD1 1 ATOM 7226 C CD2 . LEU C 1 34 ? 26.395 36.491 3.734 1.00 50.42 ? 93 LEU C CD2 1 ATOM 7227 N N . TYR C 1 35 ? 22.832 35.574 -0.163 1.00 78.69 ? 94 TYR C N 1 ATOM 7228 C CA . TYR C 1 35 ? 21.466 35.175 -0.483 1.00 84.73 ? 94 TYR C CA 1 ATOM 7229 C C . TYR C 1 35 ? 21.391 33.682 -0.780 1.00 77.94 ? 94 TYR C C 1 ATOM 7230 O O . TYR C 1 35 ? 20.529 32.976 -0.257 1.00 69.61 ? 94 TYR C O 1 ATOM 7231 C CB . TYR C 1 35 ? 20.927 35.976 -1.670 1.00 77.26 ? 94 TYR C CB 1 ATOM 7232 C CG . TYR C 1 35 ? 19.514 35.599 -2.061 1.00 76.45 ? 94 TYR C CG 1 ATOM 7233 C CD1 . TYR C 1 35 ? 18.423 36.162 -1.413 1.00 75.32 ? 94 TYR C CD1 1 ATOM 7234 C CD2 . TYR C 1 35 ? 19.271 34.680 -3.075 1.00 79.48 ? 94 TYR C CD2 1 ATOM 7235 C CE1 . TYR C 1 35 ? 17.129 35.821 -1.762 1.00 78.67 ? 94 TYR C CE1 1 ATOM 7236 C CE2 . TYR C 1 35 ? 17.981 34.333 -3.431 1.00 74.18 ? 94 TYR C CE2 1 ATOM 7237 C CZ . TYR C 1 35 ? 16.914 34.907 -2.772 1.00 83.95 ? 94 TYR C CZ 1 ATOM 7238 O OH . TYR C 1 35 ? 15.628 34.565 -3.123 1.00 92.01 ? 94 TYR C OH 1 ATOM 7239 N N . ASP C 1 36 ? 22.301 33.216 -1.631 1.00 72.22 ? 95 ASP C N 1 ATOM 7240 C CA . ASP C 1 36 ? 22.327 31.826 -2.073 1.00 78.73 ? 95 ASP C CA 1 ATOM 7241 C C . ASP C 1 36 ? 22.475 30.863 -0.898 1.00 74.36 ? 95 ASP C C 1 ATOM 7242 O O . ASP C 1 36 ? 21.843 29.809 -0.866 1.00 68.56 ? 95 ASP C O 1 ATOM 7243 C CB . ASP C 1 36 ? 23.463 31.614 -3.077 1.00 86.42 ? 95 ASP C CB 1 ATOM 7244 C CG . ASP C 1 36 ? 23.435 30.237 -3.708 1.00 101.35 ? 95 ASP C CG 1 ATOM 7245 O OD1 . ASP C 1 36 ? 22.595 30.010 -4.604 1.00 103.44 ? 95 ASP C OD1 1 ATOM 7246 O OD2 . ASP C 1 36 ? 24.258 29.384 -3.313 1.00 101.72 ? 95 ASP C OD2 1 ATOM 7247 N N . LEU C 1 37 ? 23.315 31.231 0.062 1.00 63.87 ? 96 LEU C N 1 ATOM 7248 C CA . LEU C 1 37 ? 23.584 30.381 1.217 1.00 59.59 ? 96 LEU C CA 1 ATOM 7249 C C . LEU C 1 37 ? 22.450 30.395 2.244 1.00 61.86 ? 96 LEU C C 1 ATOM 7250 O O . LEU C 1 37 ? 22.488 29.647 3.219 1.00 71.65 ? 96 LEU C O 1 ATOM 7251 C CB . LEU C 1 37 ? 24.889 30.806 1.895 1.00 62.33 ? 96 LEU C CB 1 ATOM 7252 C CG . LEU C 1 37 ? 26.197 30.400 1.212 1.00 69.30 ? 96 LEU C CG 1 ATOM 7253 C CD1 . LEU C 1 37 ? 27.340 31.282 1.687 1.00 62.25 ? 96 LEU C CD1 1 ATOM 7254 C CD2 . LEU C 1 37 ? 26.507 28.932 1.465 1.00 70.79 ? 96 LEU C CD2 1 ATOM 7255 N N . THR C 1 38 ? 21.440 31.232 2.023 1.00 59.14 ? 97 THR C N 1 ATOM 7256 C CA . THR C 1 38 ? 20.392 31.436 3.023 1.00 69.94 ? 97 THR C CA 1 ATOM 7257 C C . THR C 1 38 ? 18.972 31.362 2.463 1.00 74.47 ? 97 THR C C 1 ATOM 7258 O O . THR C 1 38 ? 18.002 31.524 3.203 1.00 79.01 ? 97 THR C O 1 ATOM 7259 C CB . THR C 1 38 ? 20.553 32.801 3.728 1.00 60.68 ? 97 THR C CB 1 ATOM 7260 O OG1 . THR C 1 38 ? 20.650 33.840 2.746 1.00 53.72 ? 97 THR C OG1 1 ATOM 7261 C CG2 . THR C 1 38 ? 21.800 32.817 4.599 1.00 49.80 ? 97 THR C CG2 1 ATOM 7262 N N . LYS C 1 39 ? 18.854 31.114 1.163 1.00 70.04 ? 98 LYS C N 1 ATOM 7263 C CA . LYS C 1 39 ? 17.551 31.066 0.503 1.00 74.07 ? 98 LYS C CA 1 ATOM 7264 C C . LYS C 1 39 ? 16.654 29.925 0.995 1.00 71.83 ? 98 LYS C C 1 ATOM 7265 O O . LYS C 1 39 ? 15.447 29.935 0.756 1.00 81.83 ? 98 LYS C O 1 ATOM 7266 C CB . LYS C 1 39 ? 17.741 30.967 -1.012 1.00 77.48 ? 98 LYS C CB 1 ATOM 7267 C CG . LYS C 1 39 ? 18.548 29.763 -1.465 1.00 90.59 ? 98 LYS C CG 1 ATOM 7268 C CD . LYS C 1 39 ? 18.603 29.692 -2.983 1.00 90.24 ? 98 LYS C CD 1 ATOM 7269 C CE . LYS C 1 39 ? 19.492 28.553 -3.457 1.00 80.82 ? 98 LYS C CE 1 ATOM 7270 N NZ . LYS C 1 39 ? 19.082 27.241 -2.890 1.00 73.92 ? 98 LYS C NZ 1 ATOM 7271 N N . ASN C 1 40 ? 17.243 28.950 1.680 1.00 78.25 ? 99 ASN C N 1 ATOM 7272 C CA . ASN C 1 40 ? 16.485 27.817 2.208 1.00 87.10 ? 99 ASN C CA 1 ATOM 7273 C C . ASN C 1 40 ? 16.330 27.876 3.725 1.00 81.18 ? 99 ASN C C 1 ATOM 7274 O O . ASN C 1 40 ? 15.879 26.915 4.350 1.00 79.19 ? 99 ASN C O 1 ATOM 7275 C CB . ASN C 1 40 ? 17.138 26.494 1.804 1.00 93.49 ? 99 ASN C CB 1 ATOM 7276 C CG . ASN C 1 40 ? 17.087 26.251 0.309 1.00 84.06 ? 99 ASN C CG 1 ATOM 7277 O OD1 . ASN C 1 40 ? 16.094 26.563 -0.349 1.00 75.23 ? 99 ASN C OD1 1 ATOM 7278 N ND2 . ASN C 1 40 ? 18.158 25.687 -0.236 1.00 87.98 ? 99 ASN C ND2 1 ATOM 7279 N N . VAL C 1 41 ? 16.711 29.004 4.314 1.00 79.77 ? 100 VAL C N 1 ATOM 7280 C CA . VAL C 1 41 ? 16.578 29.195 5.754 1.00 77.17 ? 100 VAL C CA 1 ATOM 7281 C C . VAL C 1 41 ? 15.159 29.629 6.106 1.00 77.21 ? 100 VAL C C 1 ATOM 7282 O O . VAL C 1 41 ? 14.627 30.574 5.523 1.00 74.99 ? 100 VAL C O 1 ATOM 7283 C CB . VAL C 1 41 ? 17.581 30.242 6.281 1.00 59.02 ? 100 VAL C CB 1 ATOM 7284 C CG1 . VAL C 1 41 ? 17.394 30.460 7.774 1.00 48.55 ? 100 VAL C CG1 1 ATOM 7285 C CG2 . VAL C 1 41 ? 19.007 29.814 5.971 1.00 49.57 ? 100 VAL C CG2 1 ATOM 7286 N N . ASP C 1 42 ? 14.549 28.932 7.059 1.00 79.83 ? 101 ASP C N 1 ATOM 7287 C CA . ASP C 1 42 ? 13.195 29.259 7.487 1.00 79.65 ? 101 ASP C CA 1 ATOM 7288 C C . ASP C 1 42 ? 13.245 30.391 8.504 1.00 79.77 ? 101 ASP C C 1 ATOM 7289 O O . ASP C 1 42 ? 13.256 30.157 9.713 1.00 89.48 ? 101 ASP C O 1 ATOM 7290 C CB . ASP C 1 42 ? 12.506 28.029 8.083 1.00 90.18 ? 101 ASP C CB 1 ATOM 7291 C CG . ASP C 1 42 ? 11.042 28.271 8.405 1.00 95.98 ? 101 ASP C CG 1 ATOM 7292 O OD1 . ASP C 1 42 ? 10.517 29.349 8.056 1.00 88.53 ? 101 ASP C OD1 1 ATOM 7293 O OD2 . ASP C 1 42 ? 10.414 27.377 9.011 1.00 103.53 ? 101 ASP C OD2 1 ATOM 7294 N N . PHE C 1 43 ? 13.270 31.620 8.001 1.00 78.34 ? 102 PHE C N 1 ATOM 7295 C CA . PHE C 1 43 ? 13.387 32.798 8.849 1.00 79.45 ? 102 PHE C CA 1 ATOM 7296 C C . PHE C 1 43 ? 12.130 33.043 9.674 1.00 75.71 ? 102 PHE C C 1 ATOM 7297 O O . PHE C 1 43 ? 12.211 33.475 10.822 1.00 88.48 ? 102 PHE C O 1 ATOM 7298 C CB . PHE C 1 43 ? 13.695 34.033 8.000 1.00 76.11 ? 102 PHE C CB 1 ATOM 7299 C CG . PHE C 1 43 ? 15.105 34.079 7.482 1.00 72.96 ? 102 PHE C CG 1 ATOM 7300 C CD1 . PHE C 1 43 ? 15.387 33.743 6.168 1.00 72.27 ? 102 PHE C CD1 1 ATOM 7301 C CD2 . PHE C 1 43 ? 16.150 34.451 8.312 1.00 65.73 ? 102 PHE C CD2 1 ATOM 7302 C CE1 . PHE C 1 43 ? 16.683 33.782 5.690 1.00 66.23 ? 102 PHE C CE1 1 ATOM 7303 C CE2 . PHE C 1 43 ? 17.449 34.492 7.839 1.00 67.58 ? 102 PHE C CE2 1 ATOM 7304 C CZ . PHE C 1 43 ? 17.715 34.157 6.526 1.00 64.70 ? 102 PHE C CZ 1 ATOM 7305 N N . ASP C 1 44 ? 10.971 32.757 9.088 1.00 74.08 ? 103 ASP C N 1 ATOM 7306 C CA . ASP C 1 44 ? 9.692 32.986 9.754 1.00 77.78 ? 103 ASP C CA 1 ATOM 7307 C C . ASP C 1 44 ? 9.573 32.247 11.083 1.00 71.82 ? 103 ASP C C 1 ATOM 7308 O O . ASP C 1 44 ? 9.152 32.825 12.086 1.00 69.20 ? 103 ASP C O 1 ATOM 7309 C CB . ASP C 1 44 ? 8.537 32.584 8.835 1.00 78.22 ? 103 ASP C CB 1 ATOM 7310 C CG . ASP C 1 44 ? 8.329 33.566 7.699 1.00 83.41 ? 103 ASP C CG 1 ATOM 7311 O OD1 . ASP C 1 44 ? 8.794 34.720 7.816 1.00 85.85 ? 103 ASP C OD1 1 ATOM 7312 O OD2 . ASP C 1 44 ? 7.699 33.187 6.690 1.00 96.12 ? 103 ASP C OD2 1 ATOM 7313 N N . GLN C 1 45 ? 9.943 30.971 11.091 1.00 66.95 ? 104 GLN C N 1 ATOM 7314 C CA . GLN C 1 45 ? 9.878 30.184 12.315 1.00 71.55 ? 104 GLN C CA 1 ATOM 7315 C C . GLN C 1 45 ? 11.012 30.560 13.266 1.00 75.14 ? 104 GLN C C 1 ATOM 7316 O O . GLN C 1 45 ? 10.853 30.508 14.486 1.00 74.86 ? 104 GLN C O 1 ATOM 7317 C CB . GLN C 1 45 ? 9.926 28.688 11.996 1.00 76.00 ? 104 GLN C CB 1 ATOM 7318 C CG . GLN C 1 45 ? 9.537 27.799 13.165 1.00 102.38 ? 104 GLN C CG 1 ATOM 7319 C CD . GLN C 1 45 ? 8.156 28.127 13.703 1.00 110.61 ? 104 GLN C CD 1 ATOM 7320 O OE1 . GLN C 1 45 ? 8.015 28.679 14.794 1.00 105.76 ? 104 GLN C OE1 1 ATOM 7321 N NE2 . GLN C 1 45 ? 7.126 27.789 12.934 1.00 107.93 ? 104 GLN C NE2 1 ATOM 7322 N N . LEU C 1 46 ? 12.154 30.943 12.701 1.00 70.84 ? 105 LEU C N 1 ATOM 7323 C CA . LEU C 1 46 ? 13.306 31.344 13.503 1.00 69.93 ? 105 LEU C CA 1 ATOM 7324 C C . LEU C 1 46 ? 13.048 32.659 14.230 1.00 71.04 ? 105 LEU C C 1 ATOM 7325 O O . LEU C 1 46 ? 13.328 32.778 15.422 1.00 67.96 ? 105 LEU C O 1 ATOM 7326 C CB . LEU C 1 46 ? 14.559 31.456 12.634 1.00 55.50 ? 105 LEU C CB 1 ATOM 7327 C CG . LEU C 1 46 ? 15.246 30.127 12.316 1.00 37.19 ? 105 LEU C CG 1 ATOM 7328 C CD1 . LEU C 1 46 ? 16.313 30.317 11.254 1.00 42.06 ? 105 LEU C CD1 1 ATOM 7329 C CD2 . LEU C 1 46 ? 15.839 29.517 13.579 1.00 37.06 ? 105 LEU C CD2 1 ATOM 7330 N N . ARG C 1 47 ? 12.520 33.645 13.508 1.00 66.60 ? 106 ARG C N 1 ATOM 7331 C CA . ARG C 1 47 ? 12.198 34.938 14.104 1.00 67.36 ? 106 ARG C CA 1 ATOM 7332 C C . ARG C 1 47 ? 11.212 34.773 15.254 1.00 71.50 ? 106 ARG C C 1 ATOM 7333 O O . ARG C 1 47 ? 11.223 35.543 16.214 1.00 61.03 ? 106 ARG C O 1 ATOM 7334 C CB . ARG C 1 47 ? 11.617 35.892 13.058 1.00 61.67 ? 106 ARG C CB 1 ATOM 7335 C CG . ARG C 1 47 ? 12.591 36.327 11.978 1.00 73.15 ? 106 ARG C CG 1 ATOM 7336 C CD . ARG C 1 47 ? 11.867 37.098 10.887 1.00 78.77 ? 106 ARG C CD 1 ATOM 7337 N NE . ARG C 1 47 ? 11.266 38.326 11.396 1.00 83.76 ? 106 ARG C NE 1 ATOM 7338 C CZ . ARG C 1 47 ? 11.813 39.531 11.282 1.00 73.61 ? 106 ARG C CZ 1 ATOM 7339 N NH1 . ARG C 1 47 ? 12.980 39.676 10.670 1.00 64.76 ? 106 ARG C NH1 1 ATOM 7340 N NH2 . ARG C 1 47 ? 11.191 40.592 11.777 1.00 72.21 ? 106 ARG C NH2 1 ATOM 7341 N N . GLN C 1 48 ? 10.363 33.756 15.146 1.00 82.03 ? 107 GLN C N 1 ATOM 7342 C CA . GLN C 1 48 ? 9.316 33.516 16.130 1.00 83.94 ? 107 GLN C CA 1 ATOM 7343 C C . GLN C 1 48 ? 9.893 32.903 17.406 1.00 68.87 ? 107 GLN C C 1 ATOM 7344 O O . GLN C 1 48 ? 9.188 32.740 18.401 1.00 72.62 ? 107 GLN C O 1 ATOM 7345 C CB . GLN C 1 48 ? 8.236 32.608 15.537 1.00 91.14 ? 107 GLN C CB 1 ATOM 7346 C CG . GLN C 1 48 ? 6.862 32.765 16.164 1.00 97.15 ? 107 GLN C CG 1 ATOM 7347 C CD . GLN C 1 48 ? 5.782 32.045 15.380 1.00 97.55 ? 107 GLN C CD 1 ATOM 7348 O OE1 . GLN C 1 48 ? 6.070 31.311 14.435 1.00 96.79 ? 107 GLN C OE1 1 ATOM 7349 N NE2 . GLN C 1 48 ? 4.529 32.257 15.766 1.00 97.08 ? 107 GLN C NE2 1 ATOM 7350 N N . ASN C 1 49 ? 11.180 32.568 17.370 1.00 64.10 ? 108 ASN C N 1 ATOM 7351 C CA . ASN C 1 49 ? 11.848 31.971 18.521 1.00 66.64 ? 108 ASN C CA 1 ATOM 7352 C C . ASN C 1 49 ? 12.837 32.928 19.176 1.00 63.73 ? 108 ASN C C 1 ATOM 7353 O O . ASN C 1 49 ? 13.396 32.628 20.231 1.00 58.70 ? 108 ASN C O 1 ATOM 7354 C CB . ASN C 1 49 ? 12.572 30.688 18.110 1.00 71.34 ? 108 ASN C CB 1 ATOM 7355 C CG . ASN C 1 49 ? 11.626 29.521 17.916 1.00 80.08 ? 108 ASN C CG 1 ATOM 7356 O OD1 . ASN C 1 49 ? 11.329 28.785 18.856 1.00 88.16 ? 108 ASN C OD1 1 ATOM 7357 N ND2 . ASN C 1 49 ? 11.150 29.343 16.689 1.00 74.67 ? 108 ASN C ND2 1 ATOM 7358 N N . GLU C 1 50 ? 13.051 34.079 18.545 1.00 66.19 ? 109 GLU C N 1 ATOM 7359 C CA . GLU C 1 50 ? 13.993 35.069 19.056 1.00 65.03 ? 109 GLU C CA 1 ATOM 7360 C C . GLU C 1 50 ? 13.482 35.688 20.351 1.00 63.28 ? 109 GLU C C 1 ATOM 7361 O O . GLU C 1 50 ? 14.264 36.077 21.218 1.00 57.20 ? 109 GLU C O 1 ATOM 7362 C CB . GLU C 1 50 ? 14.247 36.157 18.014 1.00 55.02 ? 109 GLU C CB 1 ATOM 7363 C CG . GLU C 1 50 ? 14.829 35.642 16.711 1.00 53.37 ? 109 GLU C CG 1 ATOM 7364 C CD . GLU C 1 50 ? 15.081 36.753 15.714 1.00 67.89 ? 109 GLU C CD 1 ATOM 7365 O OE1 . GLU C 1 50 ? 14.920 37.932 16.092 1.00 73.31 ? 109 GLU C OE1 1 ATOM 7366 O OE2 . GLU C 1 50 ? 15.438 36.448 14.556 1.00 59.28 ? 109 GLU C OE2 1 ATOM 7367 N N . CYS C 1 51 ? 12.162 35.772 20.472 1.00 59.00 ? 110 CYS C N 1 ATOM 7368 C CA . CYS C 1 51 ? 11.531 36.308 21.669 1.00 70.15 ? 110 CYS C CA 1 ATOM 7369 C C . CYS C 1 51 ? 10.658 35.242 22.320 1.00 72.88 ? 110 CYS C C 1 ATOM 7370 O O . CYS C 1 51 ? 9.692 34.767 21.721 1.00 79.90 ? 110 CYS C O 1 ATOM 7371 C CB . CYS C 1 51 ? 10.701 37.550 21.334 1.00 85.89 ? 110 CYS C CB 1 ATOM 7372 S SG . CYS C 1 51 ? 9.923 38.344 22.762 1.00 90.14 ? 110 CYS C SG 1 ATOM 7373 N N . LYS C 1 52 ? 11.011 34.868 23.546 1.00 73.51 ? 111 LYS C N 1 ATOM 7374 C CA . LYS C 1 52 ? 10.294 33.833 24.283 1.00 84.34 ? 111 LYS C CA 1 ATOM 7375 C C . LYS C 1 52 ? 8.830 34.209 24.489 1.00 82.01 ? 111 LYS C C 1 ATOM 7376 O O . LYS C 1 52 ? 7.938 33.632 23.869 1.00 86.06 ? 111 LYS C O 1 ATOM 7377 C CB . LYS C 1 52 ? 10.971 33.582 25.632 1.00 81.05 ? 111 LYS C CB 1 ATOM 7378 C CG . LYS C 1 52 ? 11.111 32.116 26.000 1.00 79.80 ? 111 LYS C CG 1 ATOM 7379 C CD . LYS C 1 52 ? 12.011 31.949 27.212 1.00 84.36 ? 111 LYS C CD 1 ATOM 7380 C CE . LYS C 1 52 ? 12.318 30.488 27.488 1.00 87.08 ? 111 LYS C CE 1 ATOM 7381 N NZ . LYS C 1 52 ? 13.309 30.339 28.589 1.00 85.81 ? 111 LYS C NZ 1 ATOM 7382 N N . LYS C 1 53 ? 8.590 35.181 25.361 1.00 78.66 ? 112 LYS C N 1 ATOM 7383 C CA . LYS C 1 53 ? 7.240 35.670 25.611 1.00 74.99 ? 112 LYS C CA 1 ATOM 7384 C C . LYS C 1 53 ? 7.188 37.185 25.464 1.00 79.21 ? 112 LYS C C 1 ATOM 7385 O O . LYS C 1 53 ? 7.911 37.908 26.144 1.00 74.92 ? 112 LYS C O 1 ATOM 7386 C CB . LYS C 1 53 ? 6.754 35.262 27.003 1.00 68.38 ? 112 LYS C CB 1 ATOM 7387 C CG . LYS C 1 53 ? 6.502 33.776 27.179 1.00 80.71 ? 112 LYS C CG 1 ATOM 7388 C CD . LYS C 1 53 ? 5.869 33.492 28.533 1.00 84.92 ? 112 LYS C CD 1 ATOM 7389 C CE . LYS C 1 53 ? 5.555 32.015 28.702 1.00 83.00 ? 112 LYS C CE 1 ATOM 7390 N NZ . LYS C 1 53 ? 6.785 31.178 28.683 1.00 72.81 ? 112 LYS C NZ 1 ATOM 7391 N N . ASN C 1 54 ? 6.346 37.669 24.560 1.00 78.00 ? 113 ASN C N 1 ATOM 7392 C CA . ASN C 1 54 ? 6.225 39.105 24.365 1.00 63.24 ? 113 ASN C CA 1 ATOM 7393 C C . ASN C 1 54 ? 5.215 39.686 25.339 1.00 67.18 ? 113 ASN C C 1 ATOM 7394 O O . ASN C 1 54 ? 4.012 39.677 25.078 1.00 70.21 ? 113 ASN C O 1 ATOM 7395 C CB . ASN C 1 54 ? 5.810 39.439 22.939 1.00 46.53 ? 113 ASN C CB 1 ATOM 7396 C CG . ASN C 1 54 ? 5.950 40.915 22.627 1.00 56.73 ? 113 ASN C CG 1 ATOM 7397 O OD1 . ASN C 1 54 ? 6.095 41.748 23.526 1.00 44.16 ? 113 ASN C OD1 1 ATOM 7398 N ND2 . ASN C 1 54 ? 5.886 41.249 21.346 1.00 49.80 ? 113 ASN C ND2 1 ATOM 7399 N N . ILE C 1 55 ? 5.709 40.194 26.461 1.00 63.34 ? 114 ILE C N 1 ATOM 7400 C CA . ILE C 1 55 ? 4.840 40.785 27.465 1.00 72.09 ? 114 ILE C CA 1 ATOM 7401 C C . ILE C 1 55 ? 5.352 42.157 27.913 1.00 75.65 ? 114 ILE C C 1 ATOM 7402 O O . ILE C 1 55 ? 6.559 42.370 28.036 1.00 77.38 ? 114 ILE C O 1 ATOM 7403 C CB . ILE C 1 55 ? 4.710 39.834 28.678 1.00 60.65 ? 114 ILE C CB 1 ATOM 7404 C CG1 . ILE C 1 55 ? 3.744 40.392 29.720 1.00 67.95 ? 114 ILE C CG1 1 ATOM 7405 C CG2 . ILE C 1 55 ? 6.076 39.549 29.295 1.00 55.25 ? 114 ILE C CG2 1 ATOM 7406 C CD1 . ILE C 1 55 ? 3.558 39.475 30.903 1.00 68.86 ? 114 ILE C CD1 1 ATOM 7407 N N . THR C 1 56 ? 4.429 43.089 28.139 1.00 70.18 ? 115 THR C N 1 ATOM 7408 C CA . THR C 1 56 ? 4.787 44.428 28.596 1.00 63.89 ? 115 THR C CA 1 ATOM 7409 C C . THR C 1 56 ? 4.879 44.466 30.116 1.00 59.55 ? 115 THR C C 1 ATOM 7410 O O . THR C 1 56 ? 4.578 43.478 30.786 1.00 60.03 ? 115 THR C O 1 ATOM 7411 C CB . THR C 1 56 ? 3.775 45.490 28.122 1.00 60.17 ? 115 THR C CB 1 ATOM 7412 O OG1 . THR C 1 56 ? 2.563 45.375 28.877 1.00 65.67 ? 115 THR C OG1 1 ATOM 7413 C CG2 . THR C 1 56 ? 3.468 45.317 26.641 1.00 40.32 ? 115 THR C CG2 1 ATOM 7414 N N . LEU C 1 57 ? 5.293 45.606 30.659 1.00 68.40 ? 116 LEU C N 1 ATOM 7415 C CA . LEU C 1 57 ? 5.452 45.737 32.102 1.00 73.05 ? 116 LEU C CA 1 ATOM 7416 C C . LEU C 1 57 ? 4.097 45.818 32.801 1.00 78.10 ? 116 LEU C C 1 ATOM 7417 O O . LEU C 1 57 ? 3.937 45.334 33.921 1.00 85.04 ? 116 LEU C O 1 ATOM 7418 C CB . LEU C 1 57 ? 6.295 46.968 32.435 1.00 60.50 ? 116 LEU C CB 1 ATOM 7419 C CG . LEU C 1 57 ? 6.957 46.975 33.813 1.00 68.52 ? 116 LEU C CG 1 ATOM 7420 C CD1 . LEU C 1 57 ? 7.856 45.759 33.983 1.00 65.21 ? 116 LEU C CD1 1 ATOM 7421 C CD2 . LEU C 1 57 ? 7.744 48.259 34.010 1.00 74.50 ? 116 LEU C CD2 1 ATOM 7422 N N . SER C 1 58 ? 3.126 46.434 32.134 1.00 75.00 ? 117 SER C N 1 ATOM 7423 C CA . SER C 1 58 ? 1.779 46.559 32.680 1.00 82.17 ? 117 SER C CA 1 ATOM 7424 C C . SER C 1 58 ? 1.098 45.196 32.642 1.00 81.96 ? 117 SER C C 1 ATOM 7425 O O . SER C 1 58 ? 0.434 44.785 33.593 1.00 85.34 ? 117 SER C O 1 ATOM 7426 C CB . SER C 1 58 ? 0.965 47.595 31.902 1.00 75.82 ? 117 SER C CB 1 ATOM 7427 O OG . SER C 1 58 ? 0.676 47.140 30.592 1.00 78.32 ? 117 SER C OG 1 ATOM 7428 N N . LYS C 1 59 ? 1.281 44.506 31.520 1.00 72.94 ? 118 LYS C N 1 ATOM 7429 C CA . LYS C 1 59 ? 0.725 43.177 31.295 1.00 78.31 ? 118 LYS C CA 1 ATOM 7430 C C . LYS C 1 59 ? 1.368 42.170 32.247 1.00 75.44 ? 118 LYS C C 1 ATOM 7431 O O . LYS C 1 59 ? 0.803 41.112 32.529 1.00 90.34 ? 118 LYS C O 1 ATOM 7432 C CB . LYS C 1 59 ? 0.928 42.756 29.835 1.00 77.99 ? 118 LYS C CB 1 ATOM 7433 C CG . LYS C 1 59 ? 0.361 41.390 29.469 1.00 77.55 ? 118 LYS C CG 1 ATOM 7434 C CD . LYS C 1 59 ? -1.144 41.325 29.661 1.00 89.17 ? 118 LYS C CD 1 ATOM 7435 C CE . LYS C 1 59 ? -1.677 39.952 29.278 1.00 88.27 ? 118 LYS C CE 1 ATOM 7436 N NZ . LYS C 1 59 ? -3.155 39.855 29.429 1.00 78.80 ? 118 LYS C NZ 1 ATOM 7437 N N . PHE C 1 60 ? 2.546 42.518 32.754 1.00 75.08 ? 119 PHE C N 1 ATOM 7438 C CA . PHE C 1 60 ? 3.268 41.659 33.682 1.00 77.50 ? 119 PHE C CA 1 ATOM 7439 C C . PHE C 1 60 ? 2.544 41.605 35.021 1.00 74.98 ? 119 PHE C C 1 ATOM 7440 O O . PHE C 1 60 ? 2.591 40.591 35.717 1.00 78.77 ? 119 PHE C O 1 ATOM 7441 C CB . PHE C 1 60 ? 4.705 42.156 33.866 1.00 87.36 ? 119 PHE C CB 1 ATOM 7442 C CG . PHE C 1 60 ? 5.504 41.359 34.858 1.00 86.27 ? 119 PHE C CG 1 ATOM 7443 C CD1 . PHE C 1 60 ? 6.061 40.143 34.501 1.00 79.12 ? 119 PHE C CD1 1 ATOM 7444 C CD2 . PHE C 1 60 ? 5.711 41.833 36.144 1.00 91.79 ? 119 PHE C CD2 1 ATOM 7445 C CE1 . PHE C 1 60 ? 6.800 39.409 35.410 1.00 70.70 ? 119 PHE C CE1 1 ATOM 7446 C CE2 . PHE C 1 60 ? 6.449 41.104 37.057 1.00 79.42 ? 119 PHE C CE2 1 ATOM 7447 C CZ . PHE C 1 60 ? 6.994 39.890 36.689 1.00 67.89 ? 119 PHE C CZ 1 ATOM 7448 N N . TRP C 1 61 ? 1.874 42.695 35.380 1.00 87.26 ? 120 TRP C N 1 ATOM 7449 C CA . TRP C 1 61 ? 1.109 42.725 36.619 1.00 93.94 ? 120 TRP C CA 1 ATOM 7450 C C . TRP C 1 61 ? -0.170 41.905 36.477 1.00 99.70 ? 120 TRP C C 1 ATOM 7451 O O . TRP C 1 61 ? -1.069 42.267 35.717 1.00 100.81 ? 120 TRP C O 1 ATOM 7452 C CB . TRP C 1 61 ? 0.766 44.158 37.025 1.00 102.63 ? 120 TRP C CB 1 ATOM 7453 C CG . TRP C 1 61 ? -0.350 44.225 38.025 1.00 126.05 ? 120 TRP C CG 1 ATOM 7454 C CD1 . TRP C 1 61 ? -1.559 44.836 37.865 1.00 144.66 ? 120 TRP C CD1 1 ATOM 7455 C CD2 . TRP C 1 61 ? -0.369 43.633 39.331 1.00 130.82 ? 120 TRP C CD2 1 ATOM 7456 N NE1 . TRP C 1 61 ? -2.325 44.673 38.994 1.00 151.68 ? 120 TRP C NE1 1 ATOM 7457 C CE2 . TRP C 1 61 ? -1.618 43.938 39.908 1.00 143.59 ? 120 TRP C CE2 1 ATOM 7458 C CE3 . TRP C 1 61 ? 0.550 42.881 40.069 1.00 119.90 ? 120 TRP C CE3 1 ATOM 7459 C CZ2 . TRP C 1 61 ? -1.969 43.517 41.189 1.00 133.38 ? 120 TRP C CZ2 1 ATOM 7460 C CZ3 . TRP C 1 61 ? 0.199 42.464 41.340 1.00 117.03 ? 120 TRP C CZ3 1 ATOM 7461 C CH2 . TRP C 1 61 ? -1.050 42.783 41.887 1.00 117.18 ? 120 TRP C CH2 1 ATOM 7462 N N . GLU C 1 71 ? -1.711 56.406 33.531 1.00 61.10 ? 130 GLU C N 1 ATOM 7463 C CA . GLU C 1 71 ? -1.097 56.753 32.253 1.00 71.88 ? 130 GLU C CA 1 ATOM 7464 C C . GLU C 1 71 ? -1.489 58.161 31.815 1.00 71.17 ? 130 GLU C C 1 ATOM 7465 O O . GLU C 1 71 ? -2.027 58.361 30.726 1.00 54.44 ? 130 GLU C O 1 ATOM 7466 C CB . GLU C 1 71 ? -1.473 55.733 31.179 1.00 70.23 ? 130 GLU C CB 1 ATOM 7467 C CG . GLU C 1 71 ? -0.786 54.390 31.361 1.00 70.28 ? 130 GLU C CG 1 ATOM 7468 C CD . GLU C 1 71 ? -0.897 53.504 30.140 1.00 79.42 ? 130 GLU C CD 1 ATOM 7469 O OE1 . GLU C 1 71 ? -1.522 53.932 29.147 1.00 85.25 ? 130 GLU C OE1 1 ATOM 7470 O OE2 . GLU C 1 71 ? -0.357 52.378 30.173 1.00 80.13 ? 130 GLU C OE2 1 ATOM 7471 N N . ASP C 1 72 ? -1.216 59.132 32.680 1.00 75.25 ? 131 ASP C N 1 ATOM 7472 C CA . ASP C 1 72 ? -1.520 60.530 32.401 1.00 78.62 ? 131 ASP C CA 1 ATOM 7473 C C . ASP C 1 72 ? -0.523 61.164 31.428 1.00 75.81 ? 131 ASP C C 1 ATOM 7474 O O . ASP C 1 72 ? -0.881 62.078 30.685 1.00 82.57 ? 131 ASP C O 1 ATOM 7475 C CB . ASP C 1 72 ? -1.575 61.337 33.701 1.00 84.82 ? 131 ASP C CB 1 ATOM 7476 C CG . ASP C 1 72 ? -0.527 60.906 34.702 1.00 88.99 ? 131 ASP C CG 1 ATOM 7477 O OD1 . ASP C 1 72 ? -0.853 60.091 35.592 1.00 84.29 ? 131 ASP C OD1 1 ATOM 7478 O OD2 . ASP C 1 72 ? 0.623 61.382 34.603 1.00 97.71 ? 131 ASP C OD2 1 ATOM 7479 N N . ASP C 1 73 ? 0.720 60.687 31.425 1.00 65.48 ? 132 ASP C N 1 ATOM 7480 C CA . ASP C 1 73 ? 1.725 61.262 30.533 1.00 63.99 ? 132 ASP C CA 1 ATOM 7481 C C . ASP C 1 73 ? 2.510 60.207 29.757 1.00 61.67 ? 132 ASP C C 1 ATOM 7482 O O . ASP C 1 73 ? 2.408 59.010 30.026 1.00 55.59 ? 132 ASP C O 1 ATOM 7483 C CB . ASP C 1 73 ? 2.700 62.140 31.327 1.00 46.66 ? 132 ASP C CB 1 ATOM 7484 C CG . ASP C 1 73 ? 3.299 61.421 32.528 1.00 50.96 ? 132 ASP C CG 1 ATOM 7485 O OD1 . ASP C 1 73 ? 3.234 61.973 33.645 1.00 60.29 ? 132 ASP C OD1 1 ATOM 7486 O OD2 . ASP C 1 73 ? 3.860 60.319 32.354 1.00 50.68 ? 132 ASP C OD2 1 ATOM 7487 N N . ASN C 1 74 ? 3.300 60.674 28.794 1.00 51.34 ? 133 ASN C N 1 ATOM 7488 C CA . ASN C 1 74 ? 4.042 59.796 27.898 1.00 51.93 ? 133 ASN C CA 1 ATOM 7489 C C . ASN C 1 74 ? 5.194 59.062 28.578 1.00 55.91 ? 133 ASN C C 1 ATOM 7490 O O . ASN C 1 74 ? 5.689 58.062 28.060 1.00 50.39 ? 133 ASN C O 1 ATOM 7491 C CB . ASN C 1 74 ? 4.570 60.598 26.707 1.00 54.36 ? 133 ASN C CB 1 ATOM 7492 C CG . ASN C 1 74 ? 3.457 61.106 25.812 1.00 46.65 ? 133 ASN C CG 1 ATOM 7493 O OD1 . ASN C 1 74 ? 2.884 62.166 26.060 1.00 57.19 ? 133 ASN C OD1 1 ATOM 7494 N ND2 . ASN C 1 74 ? 3.144 60.350 24.767 1.00 51.53 ? 133 ASN C ND2 1 ATOM 7495 N N . TRP C 1 75 ? 5.623 59.564 29.733 1.00 43.24 ? 134 TRP C N 1 ATOM 7496 C CA . TRP C 1 75 ? 6.602 58.855 30.547 1.00 52.74 ? 134 TRP C CA 1 ATOM 7497 C C . TRP C 1 75 ? 5.999 57.546 31.029 1.00 60.32 ? 134 TRP C C 1 ATOM 7498 O O . TRP C 1 75 ? 6.578 56.473 30.854 1.00 61.05 ? 134 TRP C O 1 ATOM 7499 C CB . TRP C 1 75 ? 7.043 59.699 31.745 1.00 54.37 ? 134 TRP C CB 1 ATOM 7500 C CG . TRP C 1 75 ? 8.068 60.746 31.435 1.00 51.02 ? 134 TRP C CG 1 ATOM 7501 C CD1 . TRP C 1 75 ? 9.398 60.705 31.740 1.00 44.63 ? 134 TRP C CD1 1 ATOM 7502 C CD2 . TRP C 1 75 ? 7.845 62.003 30.785 1.00 52.72 ? 134 TRP C CD2 1 ATOM 7503 N NE1 . TRP C 1 75 ? 10.019 61.851 31.308 1.00 54.64 ? 134 TRP C NE1 1 ATOM 7504 C CE2 . TRP C 1 75 ? 9.088 62.665 30.720 1.00 53.37 ? 134 TRP C CE2 1 ATOM 7505 C CE3 . TRP C 1 75 ? 6.717 62.631 30.248 1.00 43.26 ? 134 TRP C CE3 1 ATOM 7506 C CZ2 . TRP C 1 75 ? 9.234 63.924 30.139 1.00 53.12 ? 134 TRP C CZ2 1 ATOM 7507 C CZ3 . TRP C 1 75 ? 6.864 63.880 29.671 1.00 38.68 ? 134 TRP C CZ3 1 ATOM 7508 C CH2 . TRP C 1 75 ? 8.113 64.513 29.621 1.00 43.25 ? 134 TRP C CH2 1 ATOM 7509 N N . GLU C 1 76 ? 4.819 57.656 31.631 1.00 58.03 ? 135 GLU C N 1 ATOM 7510 C CA . GLU C 1 76 ? 4.102 56.514 32.179 1.00 65.69 ? 135 GLU C CA 1 ATOM 7511 C C . GLU C 1 76 ? 3.702 55.530 31.084 1.00 61.11 ? 135 GLU C C 1 ATOM 7512 O O . GLU C 1 76 ? 3.740 54.316 31.288 1.00 48.01 ? 135 GLU C O 1 ATOM 7513 C CB . GLU C 1 76 ? 2.869 56.990 32.948 1.00 41.13 ? 135 GLU C CB 1 ATOM 7514 C CG . GLU C 1 76 ? 3.205 57.707 34.247 1.00 65.10 ? 135 GLU C CG 1 ATOM 7515 C CD . GLU C 1 76 ? 1.978 58.238 34.958 1.00 84.06 ? 135 GLU C CD 1 ATOM 7516 O OE1 . GLU C 1 76 ? 0.882 58.193 34.363 1.00 89.19 ? 135 GLU C OE1 1 ATOM 7517 O OE2 . GLU C 1 76 ? 2.112 58.710 36.106 1.00 82.46 ? 135 GLU C OE2 1 ATOM 7518 N N . ARG C 1 77 ? 3.318 56.056 29.925 1.00 48.25 ? 136 ARG C N 1 ATOM 7519 C CA . ARG C 1 77 ? 2.980 55.209 28.788 1.00 45.77 ? 136 ARG C CA 1 ATOM 7520 C C . ARG C 1 77 ? 4.212 54.473 28.269 1.00 62.26 ? 136 ARG C C 1 ATOM 7521 O O . ARG C 1 77 ? 4.120 53.329 27.823 1.00 67.65 ? 136 ARG C O 1 ATOM 7522 C CB . ARG C 1 77 ? 2.361 56.041 27.663 1.00 48.11 ? 136 ARG C CB 1 ATOM 7523 C CG . ARG C 1 77 ? 0.963 56.557 27.956 1.00 59.61 ? 136 ARG C CG 1 ATOM 7524 C CD . ARG C 1 77 ? 0.346 57.191 26.721 1.00 59.10 ? 136 ARG C CD 1 ATOM 7525 N NE . ARG C 1 77 ? -0.696 58.155 27.062 1.00 71.51 ? 136 ARG C NE 1 ATOM 7526 C CZ . ARG C 1 77 ? -0.477 59.454 27.231 1.00 79.61 ? 136 ARG C CZ 1 ATOM 7527 N NH1 . ARG C 1 77 ? 0.746 59.944 27.088 1.00 83.31 ? 136 ARG C NH1 1 ATOM 7528 N NH2 . ARG C 1 77 ? -1.479 60.266 27.541 1.00 71.85 ? 136 ARG C NH2 1 ATOM 7529 N N . PHE C 1 78 ? 5.363 55.136 28.332 1.00 58.94 ? 137 PHE C N 1 ATOM 7530 C CA . PHE C 1 78 ? 6.629 54.514 27.963 1.00 43.06 ? 137 PHE C CA 1 ATOM 7531 C C . PHE C 1 78 ? 7.035 53.433 28.959 1.00 52.68 ? 137 PHE C C 1 ATOM 7532 O O . PHE C 1 78 ? 7.395 52.322 28.571 1.00 54.88 ? 137 PHE C O 1 ATOM 7533 C CB . PHE C 1 78 ? 7.736 55.564 27.852 1.00 49.20 ? 137 PHE C CB 1 ATOM 7534 C CG . PHE C 1 78 ? 9.122 54.986 27.890 1.00 50.35 ? 137 PHE C CG 1 ATOM 7535 C CD1 . PHE C 1 78 ? 9.612 54.261 26.817 1.00 45.78 ? 137 PHE C CD1 1 ATOM 7536 C CD2 . PHE C 1 78 ? 9.936 55.171 28.995 1.00 34.47 ? 137 PHE C CD2 1 ATOM 7537 C CE1 . PHE C 1 78 ? 10.886 53.726 26.846 1.00 34.55 ? 137 PHE C CE1 1 ATOM 7538 C CE2 . PHE C 1 78 ? 11.211 54.639 29.031 1.00 39.33 ? 137 PHE C CE2 1 ATOM 7539 C CZ . PHE C 1 78 ? 11.687 53.916 27.954 1.00 42.59 ? 137 PHE C CZ 1 ATOM 7540 N N . TYR C 1 79 ? 6.986 53.777 30.243 1.00 44.37 ? 138 TYR C N 1 ATOM 7541 C CA . TYR C 1 79 ? 7.339 52.848 31.312 1.00 48.49 ? 138 TYR C CA 1 ATOM 7542 C C . TYR C 1 79 ? 6.478 51.590 31.273 1.00 56.05 ? 138 TYR C C 1 ATOM 7543 O O . TYR C 1 79 ? 6.977 50.480 31.453 1.00 60.03 ? 138 TYR C O 1 ATOM 7544 C CB . TYR C 1 79 ? 7.207 53.527 32.677 1.00 40.98 ? 138 TYR C CB 1 ATOM 7545 C CG . TYR C 1 79 ? 8.173 54.670 32.894 1.00 57.33 ? 138 TYR C CG 1 ATOM 7546 C CD1 . TYR C 1 79 ? 9.452 54.635 32.355 1.00 59.49 ? 138 TYR C CD1 1 ATOM 7547 C CD2 . TYR C 1 79 ? 7.807 55.782 33.641 1.00 62.72 ? 138 TYR C CD2 1 ATOM 7548 C CE1 . TYR C 1 79 ? 10.337 55.678 32.551 1.00 55.72 ? 138 TYR C CE1 1 ATOM 7549 C CE2 . TYR C 1 79 ? 8.686 56.830 33.843 1.00 56.88 ? 138 TYR C CE2 1 ATOM 7550 C CZ . TYR C 1 79 ? 9.950 56.773 33.296 1.00 59.10 ? 138 TYR C CZ 1 ATOM 7551 O OH . TYR C 1 79 ? 10.828 57.814 33.495 1.00 48.12 ? 138 TYR C OH 1 ATOM 7552 N N . SER C 1 80 ? 5.182 51.777 31.043 1.00 57.39 ? 139 SER C N 1 ATOM 7553 C CA . SER C 1 80 ? 4.234 50.668 31.016 1.00 62.03 ? 139 SER C CA 1 ATOM 7554 C C . SER C 1 80 ? 4.504 49.709 29.860 1.00 59.23 ? 139 SER C C 1 ATOM 7555 O O . SER C 1 80 ? 4.329 48.499 29.996 1.00 66.23 ? 139 SER C O 1 ATOM 7556 C CB . SER C 1 80 ? 2.801 51.197 30.926 1.00 47.81 ? 139 SER C CB 1 ATOM 7557 O OG . SER C 1 80 ? 2.386 51.756 32.160 1.00 55.71 ? 139 SER C OG 1 ATOM 7558 N N . ASN C 1 81 ? 4.930 50.255 28.726 1.00 52.97 ? 140 ASN C N 1 ATOM 7559 C CA . ASN C 1 81 ? 5.147 49.452 27.527 1.00 57.23 ? 140 ASN C CA 1 ATOM 7560 C C . ASN C 1 81 ? 6.572 48.927 27.379 1.00 51.09 ? 140 ASN C C 1 ATOM 7561 O O . ASN C 1 81 ? 6.936 48.412 26.322 1.00 48.15 ? 140 ASN C O 1 ATOM 7562 C CB . ASN C 1 81 ? 4.772 50.256 26.282 1.00 58.85 ? 140 ASN C CB 1 ATOM 7563 C CG . ASN C 1 81 ? 3.274 50.404 26.119 1.00 54.51 ? 140 ASN C CG 1 ATOM 7564 O OD1 . ASN C 1 81 ? 2.628 49.593 25.456 1.00 53.60 ? 140 ASN C OD1 1 ATOM 7565 N ND2 . ASN C 1 81 ? 2.711 51.441 26.728 1.00 42.42 ? 140 ASN C ND2 1 ATOM 7566 N N . ILE C 1 82 ? 7.380 49.064 28.426 1.00 36.01 ? 141 ILE C N 1 ATOM 7567 C CA . ILE C 1 82 ? 8.702 48.449 28.426 1.00 58.58 ? 141 ILE C CA 1 ATOM 7568 C C . ILE C 1 82 ? 8.535 46.935 28.377 1.00 56.31 ? 141 ILE C C 1 ATOM 7569 O O . ILE C 1 82 ? 8.043 46.323 29.326 1.00 59.97 ? 141 ILE C O 1 ATOM 7570 C CB . ILE C 1 82 ? 9.531 48.851 29.658 1.00 53.47 ? 141 ILE C CB 1 ATOM 7571 C CG1 . ILE C 1 82 ? 9.871 50.342 29.606 1.00 49.15 ? 141 ILE C CG1 1 ATOM 7572 C CG2 . ILE C 1 82 ? 10.807 48.031 29.733 1.00 51.51 ? 141 ILE C CG2 1 ATOM 7573 C CD1 . ILE C 1 82 ? 10.611 50.840 30.825 1.00 42.05 ? 141 ILE C CD1 1 ATOM 7574 N N . GLY C 1 83 ? 8.944 46.336 27.264 1.00 51.57 ? 142 GLY C N 1 ATOM 7575 C CA . GLY C 1 83 ? 8.681 44.930 27.021 1.00 62.11 ? 142 GLY C CA 1 ATOM 7576 C C . GLY C 1 83 ? 9.794 43.996 27.446 1.00 53.49 ? 142 GLY C C 1 ATOM 7577 O O . GLY C 1 83 ? 10.856 44.428 27.891 1.00 40.10 ? 142 GLY C O 1 ATOM 7578 N N . SER C 1 84 ? 9.538 42.701 27.300 1.00 62.28 ? 143 SER C N 1 ATOM 7579 C CA . SER C 1 84 ? 10.477 41.672 27.722 1.00 60.81 ? 143 SER C CA 1 ATOM 7580 C C . SER C 1 84 ? 11.519 41.359 26.653 1.00 62.21 ? 143 SER C C 1 ATOM 7581 O O . SER C 1 84 ? 12.533 40.720 26.936 1.00 64.81 ? 143 SER C O 1 ATOM 7582 C CB . SER C 1 84 ? 9.720 40.400 28.099 1.00 51.99 ? 143 SER C CB 1 ATOM 7583 O OG . SER C 1 84 ? 8.918 39.948 27.022 1.00 56.93 ? 143 SER C OG 1 ATOM 7584 N N . CYS C 1 85 ? 11.265 41.800 25.425 1.00 56.38 ? 144 CYS C N 1 ATOM 7585 C CA . CYS C 1 85 ? 12.190 41.547 24.326 1.00 71.82 ? 144 CYS C CA 1 ATOM 7586 C C . CYS C 1 85 ? 12.527 42.831 23.573 1.00 66.90 ? 144 CYS C C 1 ATOM 7587 O O . CYS C 1 85 ? 13.189 42.797 22.535 1.00 61.03 ? 144 CYS C O 1 ATOM 7588 C CB . CYS C 1 85 ? 11.604 40.511 23.363 1.00 87.67 ? 144 CYS C CB 1 ATOM 7589 S SG . CYS C 1 85 ? 11.373 38.868 24.084 1.00 72.51 ? 144 CYS C SG 1 ATOM 7590 N N . SER C 1 86 ? 12.075 43.959 24.113 1.00 70.55 ? 145 SER C N 1 ATOM 7591 C CA . SER C 1 86 ? 12.328 45.269 23.521 1.00 48.55 ? 145 SER C CA 1 ATOM 7592 C C . SER C 1 86 ? 11.982 46.363 24.523 1.00 56.82 ? 145 SER C C 1 ATOM 7593 O O . SER C 1 86 ? 11.113 46.179 25.373 1.00 56.79 ? 145 SER C O 1 ATOM 7594 C CB . SER C 1 86 ? 11.525 45.460 22.232 1.00 41.36 ? 145 SER C CB 1 ATOM 7595 O OG . SER C 1 86 ? 10.236 45.982 22.505 1.00 72.70 ? 145 SER C OG 1 ATOM 7596 N N . VAL C 1 87 ? 12.662 47.500 24.424 1.00 44.47 ? 146 VAL C N 1 ATOM 7597 C CA . VAL C 1 87 ? 12.386 48.625 25.308 1.00 52.13 ? 146 VAL C CA 1 ATOM 7598 C C . VAL C 1 87 ? 11.071 49.302 24.919 1.00 43.97 ? 146 VAL C C 1 ATOM 7599 O O . VAL C 1 87 ? 10.294 49.717 25.782 1.00 43.83 ? 146 VAL C O 1 ATOM 7600 C CB . VAL C 1 87 ? 13.543 49.653 25.277 1.00 57.74 ? 146 VAL C CB 1 ATOM 7601 C CG1 . VAL C 1 87 ? 13.098 50.999 25.827 1.00 39.73 ? 146 VAL C CG1 1 ATOM 7602 C CG2 . VAL C 1 87 ? 14.738 49.127 26.057 1.00 49.29 ? 146 VAL C CG2 1 ATOM 7603 N N . TYR C 1 88 ? 10.815 49.384 23.617 1.00 43.18 ? 147 TYR C N 1 ATOM 7604 C CA . TYR C 1 88 ? 9.578 49.970 23.108 1.00 35.53 ? 147 TYR C CA 1 ATOM 7605 C C . TYR C 1 88 ? 9.211 49.374 21.752 1.00 42.04 ? 147 TYR C C 1 ATOM 7606 O O . TYR C 1 88 ? 10.078 48.898 21.024 1.00 49.02 ? 147 TYR C O 1 ATOM 7607 C CB . TYR C 1 88 ? 9.702 51.495 23.018 1.00 35.28 ? 147 TYR C CB 1 ATOM 7608 C CG . TYR C 1 88 ? 10.612 51.996 21.919 1.00 46.88 ? 147 TYR C CG 1 ATOM 7609 C CD1 . TYR C 1 88 ? 11.983 52.101 22.121 1.00 46.91 ? 147 TYR C CD1 1 ATOM 7610 C CD2 . TYR C 1 88 ? 10.101 52.378 20.686 1.00 35.14 ? 147 TYR C CD2 1 ATOM 7611 C CE1 . TYR C 1 88 ? 12.819 52.564 21.122 1.00 38.38 ? 147 TYR C CE1 1 ATOM 7612 C CE2 . TYR C 1 88 ? 10.929 52.845 19.682 1.00 54.57 ? 147 TYR C CE2 1 ATOM 7613 C CZ . TYR C 1 88 ? 12.287 52.935 19.905 1.00 39.85 ? 147 TYR C CZ 1 ATOM 7614 O OH . TYR C 1 88 ? 13.114 53.396 18.908 1.00 46.98 ? 147 TYR C OH 1 ATOM 7615 N N . SER C 1 89 ? 7.922 49.390 21.420 1.00 62.35 ? 148 SER C N 1 ATOM 7616 C CA . SER C 1 89 ? 7.468 48.915 20.114 1.00 60.11 ? 148 SER C CA 1 ATOM 7617 C C . SER C 1 89 ? 6.501 49.880 19.435 1.00 63.02 ? 148 SER C C 1 ATOM 7618 O O . SER C 1 89 ? 6.092 49.653 18.296 1.00 71.46 ? 148 SER C O 1 ATOM 7619 C CB . SER C 1 89 ? 6.803 47.546 20.250 1.00 40.29 ? 148 SER C CB 1 ATOM 7620 O OG . SER C 1 89 ? 5.991 47.495 21.409 1.00 46.94 ? 148 SER C OG 1 ATOM 7621 N N . ASP C 1 90 ? 6.184 50.982 20.107 1.00 51.52 ? 149 ASP C N 1 ATOM 7622 C CA . ASP C 1 90 ? 5.217 51.934 19.577 1.00 55.56 ? 149 ASP C CA 1 ATOM 7623 C C . ASP C 1 90 ? 5.942 53.239 19.299 1.00 56.46 ? 149 ASP C C 1 ATOM 7624 O O . ASP C 1 90 ? 6.120 54.074 20.183 1.00 47.63 ? 149 ASP C O 1 ATOM 7625 C CB . ASP C 1 90 ? 4.063 52.156 20.560 1.00 54.23 ? 149 ASP C CB 1 ATOM 7626 C CG . ASP C 1 90 ? 2.961 53.037 19.989 1.00 59.06 ? 149 ASP C CG 1 ATOM 7627 O OD1 . ASP C 1 90 ? 3.014 53.368 18.787 1.00 54.04 ? 149 ASP C OD1 1 ATOM 7628 O OD2 . ASP C 1 90 ? 2.041 53.403 20.750 1.00 61.55 ? 149 ASP C OD2 1 ATOM 7629 N N . ASP C 1 91 ? 6.349 53.399 18.044 1.00 35.96 ? 150 ASP C N 1 ATOM 7630 C CA . ASP C 1 91 ? 7.171 54.526 17.627 1.00 60.48 ? 150 ASP C CA 1 ATOM 7631 C C . ASP C 1 91 ? 6.452 55.867 17.749 1.00 60.83 ? 150 ASP C C 1 ATOM 7632 O O . ASP C 1 91 ? 7.070 56.876 18.087 1.00 44.93 ? 150 ASP C O 1 ATOM 7633 C CB . ASP C 1 91 ? 7.642 54.325 16.184 1.00 44.05 ? 150 ASP C CB 1 ATOM 7634 C CG . ASP C 1 91 ? 8.623 53.175 16.045 1.00 50.56 ? 150 ASP C CG 1 ATOM 7635 O OD1 . ASP C 1 91 ? 9.103 52.671 17.081 1.00 48.56 ? 150 ASP C OD1 1 ATOM 7636 O OD2 . ASP C 1 91 ? 8.923 52.779 14.898 1.00 48.30 ? 150 ASP C OD2 1 ATOM 7637 N N . GLN C 1 92 ? 5.150 55.875 17.480 1.00 58.27 ? 151 GLN C N 1 ATOM 7638 C CA . GLN C 1 92 ? 4.396 57.124 17.462 1.00 50.24 ? 151 GLN C CA 1 ATOM 7639 C C . GLN C 1 92 ? 4.280 57.750 18.847 1.00 57.02 ? 151 GLN C C 1 ATOM 7640 O O . GLN C 1 92 ? 4.477 58.955 19.004 1.00 49.29 ? 151 GLN C O 1 ATOM 7641 C CB . GLN C 1 92 ? 3.001 56.904 16.875 1.00 43.37 ? 151 GLN C CB 1 ATOM 7642 C CG . GLN C 1 92 ? 2.193 58.187 16.741 1.00 52.28 ? 151 GLN C CG 1 ATOM 7643 C CD . GLN C 1 92 ? 2.961 59.288 16.029 1.00 62.75 ? 151 GLN C CD 1 ATOM 7644 O OE1 . GLN C 1 92 ? 3.105 60.395 16.548 1.00 71.50 ? 151 GLN C OE1 1 ATOM 7645 N NE2 . GLN C 1 92 ? 3.456 58.988 14.833 1.00 62.90 ? 151 GLN C NE2 1 HETATM 7646 N N . MSE C 1 93 ? 3.962 56.937 19.850 1.00 43.99 ? 152 MSE C N 1 HETATM 7647 C CA . MSE C 1 93 ? 3.835 57.446 21.210 1.00 58.22 ? 152 MSE C CA 1 HETATM 7648 C C . MSE C 1 93 ? 5.212 57.767 21.779 1.00 57.67 ? 152 MSE C C 1 HETATM 7649 O O . MSE C 1 93 ? 5.342 58.586 22.688 1.00 44.15 ? 152 MSE C O 1 HETATM 7650 C CB . MSE C 1 93 ? 3.095 56.445 22.105 1.00 67.47 ? 152 MSE C CB 1 HETATM 7651 C CG . MSE C 1 93 ? 3.927 55.267 22.591 1.00 74.21 ? 152 MSE C CG 1 HETATM 7652 SE SE . MSE C 1 93 ? 4.882 55.607 24.263 1.00 104.21 ? 152 MSE C SE 1 HETATM 7653 C CE . MSE C 1 93 ? 5.554 53.803 24.576 1.00 59.20 ? 152 MSE C CE 1 ATOM 7654 N N . ILE C 1 94 ? 6.237 57.113 21.240 1.00 62.20 ? 153 ILE C N 1 ATOM 7655 C CA . ILE C 1 94 ? 7.612 57.413 21.616 1.00 43.82 ? 153 ILE C CA 1 ATOM 7656 C C . ILE C 1 94 ? 8.005 58.754 21.009 1.00 45.05 ? 153 ILE C C 1 ATOM 7657 O O . ILE C 1 94 ? 8.611 59.593 21.674 1.00 38.51 ? 153 ILE C O 1 ATOM 7658 C CB . ILE C 1 94 ? 8.588 56.312 21.160 1.00 52.56 ? 153 ILE C CB 1 ATOM 7659 C CG1 . ILE C 1 94 ? 8.451 55.080 22.056 1.00 35.06 ? 153 ILE C CG1 1 ATOM 7660 C CG2 . ILE C 1 94 ? 10.022 56.813 21.201 1.00 45.15 ? 153 ILE C CG2 1 ATOM 7661 C CD1 . ILE C 1 94 ? 8.706 55.359 23.519 1.00 38.58 ? 153 ILE C CD1 1 ATOM 7662 N N . ASP C 1 95 ? 7.644 58.952 19.743 1.00 42.30 ? 154 ASP C N 1 ATOM 7663 C CA . ASP C 1 95 ? 7.827 60.240 19.080 1.00 55.95 ? 154 ASP C CA 1 ATOM 7664 C C . ASP C 1 95 ? 7.097 61.348 19.835 1.00 39.96 ? 154 ASP C C 1 ATOM 7665 O O . ASP C 1 95 ? 7.524 62.503 19.828 1.00 57.23 ? 154 ASP C O 1 ATOM 7666 C CB . ASP C 1 95 ? 7.336 60.179 17.631 1.00 34.71 ? 154 ASP C CB 1 ATOM 7667 C CG . ASP C 1 95 ? 8.286 59.421 16.724 1.00 60.87 ? 154 ASP C CG 1 ATOM 7668 O OD1 . ASP C 1 95 ? 9.116 58.644 17.243 1.00 60.38 ? 154 ASP C OD1 1 ATOM 7669 O OD2 . ASP C 1 95 ? 8.205 59.605 15.492 1.00 51.35 ? 154 ASP C OD2 1 ATOM 7670 N N . ASN C 1 96 ? 5.995 60.987 20.485 1.00 36.96 ? 155 ASN C N 1 ATOM 7671 C CA . ASN C 1 96 ? 5.280 61.917 21.346 1.00 49.71 ? 155 ASN C CA 1 ATOM 7672 C C . ASN C 1 96 ? 6.093 62.211 22.601 1.00 53.17 ? 155 ASN C C 1 ATOM 7673 O O . ASN C 1 96 ? 6.154 63.351 23.061 1.00 49.86 ? 155 ASN C O 1 ATOM 7674 C CB . ASN C 1 96 ? 3.906 61.361 21.725 1.00 38.93 ? 155 ASN C CB 1 ATOM 7675 C CG . ASN C 1 96 ? 2.983 61.220 20.530 1.00 54.18 ? 155 ASN C CG 1 ATOM 7676 O OD1 . ASN C 1 96 ? 3.146 61.904 19.521 1.00 53.25 ? 155 ASN C OD1 1 ATOM 7677 N ND2 . ASN C 1 96 ? 2.005 60.329 20.641 1.00 56.34 ? 155 ASN C ND2 1 ATOM 7678 N N . LEU C 1 97 ? 6.712 61.171 23.152 1.00 38.22 ? 156 LEU C N 1 ATOM 7679 C CA . LEU C 1 97 ? 7.581 61.315 24.313 1.00 44.91 ? 156 LEU C CA 1 ATOM 7680 C C . LEU C 1 97 ? 8.799 62.170 23.973 1.00 54.77 ? 156 LEU C C 1 ATOM 7681 O O . LEU C 1 97 ? 9.230 62.999 24.775 1.00 42.31 ? 156 LEU C O 1 ATOM 7682 C CB . LEU C 1 97 ? 8.021 59.944 24.829 1.00 45.72 ? 156 LEU C CB 1 ATOM 7683 C CG . LEU C 1 97 ? 9.026 59.938 25.983 1.00 46.61 ? 156 LEU C CG 1 ATOM 7684 C CD1 . LEU C 1 97 ? 8.468 60.681 27.190 1.00 45.08 ? 156 LEU C CD1 1 ATOM 7685 C CD2 . LEU C 1 97 ? 9.413 58.514 26.353 1.00 54.16 ? 156 LEU C CD2 1 ATOM 7686 N N . LEU C 1 98 ? 9.350 61.955 22.782 1.00 33.81 ? 157 LEU C N 1 ATOM 7687 C CA . LEU C 1 98 ? 10.469 62.752 22.289 1.00 33.48 ? 157 LEU C CA 1 ATOM 7688 C C . LEU C 1 98 ? 10.100 64.228 22.219 1.00 43.24 ? 157 LEU C C 1 ATOM 7689 O O . LEU C 1 98 ? 10.856 65.089 22.668 1.00 48.78 ? 157 LEU C O 1 ATOM 7690 C CB . LEU C 1 98 ? 10.921 62.256 20.914 1.00 33.52 ? 157 LEU C CB 1 ATOM 7691 C CG . LEU C 1 98 ? 11.484 60.834 20.847 1.00 36.06 ? 157 LEU C CG 1 ATOM 7692 C CD1 . LEU C 1 98 ? 12.074 60.555 19.475 1.00 38.21 ? 157 LEU C CD1 1 ATOM 7693 C CD2 . LEU C 1 98 ? 12.526 60.616 21.935 1.00 33.39 ? 157 LEU C CD2 1 ATOM 7694 N N . HIS C 1 99 ? 8.934 64.508 21.645 1.00 54.95 ? 158 HIS C N 1 ATOM 7695 C CA . HIS C 1 99 ? 8.417 65.868 21.560 1.00 33.46 ? 158 HIS C CA 1 ATOM 7696 C C . HIS C 1 99 ? 8.259 66.499 22.941 1.00 46.74 ? 158 HIS C C 1 ATOM 7697 O O . HIS C 1 99 ? 8.552 67.679 23.134 1.00 36.65 ? 158 HIS C O 1 ATOM 7698 C CB . HIS C 1 99 ? 7.076 65.880 20.824 1.00 36.18 ? 158 HIS C CB 1 ATOM 7699 C CG . HIS C 1 99 ? 6.397 67.214 20.826 1.00 52.28 ? 158 HIS C CG 1 ATOM 7700 N ND1 . HIS C 1 99 ? 5.460 67.571 21.772 1.00 52.04 ? 158 HIS C ND1 1 ATOM 7701 C CD2 . HIS C 1 99 ? 6.519 68.278 19.998 1.00 58.18 ? 158 HIS C CD2 1 ATOM 7702 C CE1 . HIS C 1 99 ? 5.034 68.797 21.526 1.00 57.73 ? 158 HIS C CE1 1 ATOM 7703 N NE2 . HIS C 1 99 ? 5.661 69.249 20.455 1.00 59.39 ? 158 HIS C NE2 1 ATOM 7704 N N . ASP C 1 100 ? 7.794 65.701 23.897 1.00 33.50 ? 159 ASP C N 1 ATOM 7705 C CA . ASP C 1 100 ? 7.598 66.166 25.264 1.00 33.41 ? 159 ASP C CA 1 ATOM 7706 C C . ASP C 1 100 ? 8.919 66.449 25.962 1.00 37.21 ? 159 ASP C C 1 ATOM 7707 O O . ASP C 1 100 ? 9.040 67.416 26.710 1.00 41.40 ? 159 ASP C O 1 ATOM 7708 C CB . ASP C 1 100 ? 6.794 65.144 26.063 1.00 55.40 ? 159 ASP C CB 1 ATOM 7709 C CG . ASP C 1 100 ? 5.362 65.056 25.598 1.00 65.25 ? 159 ASP C CG 1 ATOM 7710 O OD1 . ASP C 1 100 ? 5.066 65.637 24.534 1.00 64.59 ? 159 ASP C OD1 1 ATOM 7711 O OD2 . ASP C 1 100 ? 4.540 64.420 26.289 1.00 59.45 ? 159 ASP C OD2 1 ATOM 7712 N N . LEU C 1 101 ? 9.908 65.598 25.711 1.00 57.52 ? 160 LEU C N 1 ATOM 7713 C CA . LEU C 1 101 ? 11.234 65.776 26.287 1.00 43.01 ? 160 LEU C CA 1 ATOM 7714 C C . LEU C 1 101 ? 11.850 67.084 25.800 1.00 56.37 ? 160 LEU C C 1 ATOM 7715 O O . LEU C 1 101 ? 12.602 67.735 26.523 1.00 40.55 ? 160 LEU C O 1 ATOM 7716 C CB . LEU C 1 101 ? 12.139 64.595 25.933 1.00 38.27 ? 160 LEU C CB 1 ATOM 7717 C CG . LEU C 1 101 ? 11.898 63.271 26.662 1.00 45.21 ? 160 LEU C CG 1 ATOM 7718 C CD1 . LEU C 1 101 ? 12.726 62.160 26.034 1.00 32.97 ? 160 LEU C CD1 1 ATOM 7719 C CD2 . LEU C 1 101 ? 12.215 63.408 28.142 1.00 32.81 ? 160 LEU C CD2 1 ATOM 7720 N N . ASN C 1 102 ? 11.522 67.455 24.567 1.00 43.94 ? 161 ASN C N 1 ATOM 7721 C CA . ASN C 1 102 ? 12.018 68.687 23.968 1.00 36.32 ? 161 ASN C CA 1 ATOM 7722 C C . ASN C 1 102 ? 11.315 69.957 24.455 1.00 42.71 ? 161 ASN C C 1 ATOM 7723 O O . ASN C 1 102 ? 11.944 71.009 24.572 1.00 42.98 ? 161 ASN C O 1 ATOM 7724 C CB . ASN C 1 102 ? 11.907 68.598 22.442 1.00 32.36 ? 161 ASN C CB 1 ATOM 7725 C CG . ASN C 1 102 ? 12.313 69.884 21.750 1.00 37.70 ? 161 ASN C CG 1 ATOM 7726 O OD1 . ASN C 1 102 ? 11.478 70.747 21.479 1.00 50.46 ? 161 ASN C OD1 1 ATOM 7727 N ND2 . ASN C 1 102 ? 13.602 70.018 21.458 1.00 33.45 ? 161 ASN C ND2 1 ATOM 7728 N N . THR C 1 103 ? 10.018 69.863 24.741 1.00 40.81 ? 162 THR C N 1 ATOM 7729 C CA . THR C 1 103 ? 9.209 71.061 24.978 1.00 43.07 ? 162 THR C CA 1 ATOM 7730 C C . THR C 1 103 ? 8.736 71.272 26.420 1.00 32.37 ? 162 THR C C 1 ATOM 7731 O O . THR C 1 103 ? 8.419 72.398 26.802 1.00 40.11 ? 162 THR C O 1 ATOM 7732 C CB . THR C 1 103 ? 7.958 71.066 24.077 1.00 32.76 ? 162 THR C CB 1 ATOM 7733 O OG1 . THR C 1 103 ? 7.141 69.928 24.380 1.00 49.92 ? 162 THR C OG1 1 ATOM 7734 C CG2 . THR C 1 103 ? 8.355 71.025 22.611 1.00 32.64 ? 162 THR C CG2 1 ATOM 7735 N N . SER C 1 104 ? 8.681 70.205 27.214 1.00 39.13 ? 163 SER C N 1 ATOM 7736 C CA . SER C 1 104 ? 8.167 70.305 28.581 1.00 32.53 ? 163 SER C CA 1 ATOM 7737 C C . SER C 1 104 ? 8.970 71.287 29.429 1.00 46.06 ? 163 SER C C 1 ATOM 7738 O O . SER C 1 104 ? 10.199 71.293 29.382 1.00 64.66 ? 163 SER C O 1 ATOM 7739 C CB . SER C 1 104 ? 8.155 68.932 29.259 1.00 32.76 ? 163 SER C CB 1 ATOM 7740 O OG . SER C 1 104 ? 7.417 67.993 28.498 1.00 48.32 ? 163 SER C OG 1 ATOM 7741 N N . PRO C 1 105 ? 8.267 72.123 30.209 1.00 61.64 ? 164 PRO C N 1 ATOM 7742 C CA . PRO C 1 105 ? 8.902 73.111 31.089 1.00 56.82 ? 164 PRO C CA 1 ATOM 7743 C C . PRO C 1 105 ? 9.710 72.465 32.209 1.00 48.13 ? 164 PRO C C 1 ATOM 7744 O O . PRO C 1 105 ? 9.285 71.464 32.788 1.00 34.53 ? 164 PRO C O 1 ATOM 7745 C CB . PRO C 1 105 ? 7.713 73.892 31.657 1.00 45.40 ? 164 PRO C CB 1 ATOM 7746 C CG . PRO C 1 105 ? 6.555 72.963 31.537 1.00 51.58 ? 164 PRO C CG 1 ATOM 7747 C CD . PRO C 1 105 ? 6.797 72.178 30.287 1.00 56.86 ? 164 PRO C CD 1 ATOM 7748 N N . ILE C 1 106 ? 10.871 73.040 32.504 1.00 39.62 ? 165 ILE C N 1 ATOM 7749 C CA . ILE C 1 106 ? 11.762 72.500 33.523 1.00 33.13 ? 165 ILE C CA 1 ATOM 7750 C C . ILE C 1 106 ? 11.543 73.161 34.883 1.00 38.75 ? 165 ILE C C 1 ATOM 7751 O O . ILE C 1 106 ? 11.537 74.386 34.996 1.00 42.51 ? 165 ILE C O 1 ATOM 7752 C CB . ILE C 1 106 ? 13.235 72.662 33.106 1.00 47.39 ? 165 ILE C CB 1 ATOM 7753 C CG1 . ILE C 1 106 ? 13.517 71.837 31.849 1.00 35.73 ? 165 ILE C CG1 1 ATOM 7754 C CG2 . ILE C 1 106 ? 14.163 72.239 34.233 1.00 47.24 ? 165 ILE C CG2 1 ATOM 7755 C CD1 . ILE C 1 106 ? 14.594 72.419 30.973 1.00 37.72 ? 165 ILE C CD1 1 ATOM 7756 N N . LYS C 1 107 ? 11.362 72.337 35.910 1.00 39.03 ? 166 LYS C N 1 ATOM 7757 C CA . LYS C 1 107 ? 11.153 72.828 37.266 1.00 34.89 ? 166 LYS C CA 1 ATOM 7758 C C . LYS C 1 107 ? 12.473 72.911 38.022 1.00 48.41 ? 166 LYS C C 1 ATOM 7759 O O . LYS C 1 107 ? 12.791 73.934 38.628 1.00 44.64 ? 166 LYS C O 1 ATOM 7760 C CB . LYS C 1 107 ? 10.184 71.924 38.031 1.00 52.89 ? 166 LYS C CB 1 ATOM 7761 C CG . LYS C 1 107 ? 9.873 72.415 39.436 1.00 53.79 ? 166 LYS C CG 1 ATOM 7762 C CD . LYS C 1 107 ? 9.160 71.351 40.254 1.00 64.34 ? 166 LYS C CD 1 ATOM 7763 C CE . LYS C 1 107 ? 7.888 70.880 39.579 1.00 66.11 ? 166 LYS C CE 1 ATOM 7764 N NZ . LYS C 1 107 ? 7.194 69.847 40.395 1.00 69.57 ? 166 LYS C NZ 1 ATOM 7765 N N . HIS C 1 108 ? 13.240 71.827 37.975 1.00 34.95 ? 167 HIS C N 1 ATOM 7766 C CA . HIS C 1 108 ? 14.513 71.762 38.679 1.00 35.45 ? 167 HIS C CA 1 ATOM 7767 C C . HIS C 1 108 ? 15.621 71.217 37.793 1.00 41.13 ? 167 HIS C C 1 ATOM 7768 O O . HIS C 1 108 ? 15.380 70.389 36.914 1.00 43.14 ? 167 HIS C O 1 ATOM 7769 C CB . HIS C 1 108 ? 14.392 70.882 39.926 1.00 40.57 ? 167 HIS C CB 1 ATOM 7770 C CG . HIS C 1 108 ? 13.427 71.399 40.947 1.00 63.42 ? 167 HIS C CG 1 ATOM 7771 N ND1 . HIS C 1 108 ? 13.522 72.660 41.493 1.00 75.49 ? 167 HIS C ND1 1 ATOM 7772 C CD2 . HIS C 1 108 ? 12.348 70.819 41.523 1.00 65.42 ? 167 HIS C CD2 1 ATOM 7773 C CE1 . HIS C 1 108 ? 12.542 72.836 42.361 1.00 82.17 ? 167 HIS C CE1 1 ATOM 7774 N NE2 . HIS C 1 108 ? 11.815 71.734 42.398 1.00 67.16 ? 167 HIS C NE2 1 ATOM 7775 N N . VAL C 1 109 ? 16.838 71.695 38.026 1.00 40.25 ? 168 VAL C N 1 ATOM 7776 C CA . VAL C 1 109 ? 18.019 71.117 37.402 1.00 49.13 ? 168 VAL C CA 1 ATOM 7777 C C . VAL C 1 109 ? 19.011 70.712 38.486 1.00 35.56 ? 168 VAL C C 1 ATOM 7778 O O . VAL C 1 109 ? 19.456 71.545 39.274 1.00 38.74 ? 168 VAL C O 1 ATOM 7779 C CB . VAL C 1 109 ? 18.695 72.094 36.420 1.00 35.46 ? 168 VAL C CB 1 ATOM 7780 C CG1 . VAL C 1 109 ? 19.927 71.450 35.798 1.00 35.39 ? 168 VAL C CG1 1 ATOM 7781 C CG2 . VAL C 1 109 ? 17.716 72.524 35.340 1.00 32.97 ? 168 VAL C CG2 1 ATOM 7782 N N . HIS C 1 110 ? 19.349 69.428 38.526 1.00 45.32 ? 169 HIS C N 1 ATOM 7783 C CA . HIS C 1 110 ? 20.285 68.928 39.524 1.00 52.81 ? 169 HIS C CA 1 ATOM 7784 C C . HIS C 1 110 ? 21.460 68.235 38.850 1.00 42.67 ? 169 HIS C C 1 ATOM 7785 O O . HIS C 1 110 ? 21.338 67.708 37.745 1.00 33.44 ? 169 HIS C O 1 ATOM 7786 C CB . HIS C 1 110 ? 19.595 67.965 40.495 1.00 47.41 ? 169 HIS C CB 1 ATOM 7787 C CG . HIS C 1 110 ? 18.620 68.627 41.419 1.00 58.51 ? 169 HIS C CG 1 ATOM 7788 N ND1 . HIS C 1 110 ? 17.331 68.939 41.043 1.00 57.53 ? 169 HIS C ND1 1 ATOM 7789 C CD2 . HIS C 1 110 ? 18.745 69.031 42.705 1.00 49.03 ? 169 HIS C CD2 1 ATOM 7790 C CE1 . HIS C 1 110 ? 16.705 69.509 42.058 1.00 62.48 ? 169 HIS C CE1 1 ATOM 7791 N NE2 . HIS C 1 110 ? 17.541 69.577 43.077 1.00 69.18 ? 169 HIS C NE2 1 ATOM 7792 N N . ILE C 1 111 ? 22.603 68.254 39.521 1.00 35.55 ? 170 ILE C N 1 ATOM 7793 C CA . ILE C 1 111 ? 23.784 67.552 39.045 1.00 41.63 ? 170 ILE C CA 1 ATOM 7794 C C . ILE C 1 111 ? 23.686 66.051 39.297 1.00 47.74 ? 170 ILE C C 1 ATOM 7795 O O . ILE C 1 111 ? 23.551 65.614 40.440 1.00 44.32 ? 170 ILE C O 1 ATOM 7796 C CB . ILE C 1 111 ? 25.048 68.107 39.709 1.00 35.78 ? 170 ILE C CB 1 ATOM 7797 C CG1 . ILE C 1 111 ? 25.214 69.578 39.331 1.00 39.38 ? 170 ILE C CG1 1 ATOM 7798 C CG2 . ILE C 1 111 ? 26.268 67.288 39.316 1.00 35.58 ? 170 ILE C CG2 1 ATOM 7799 C CD1 . ILE C 1 111 ? 26.380 70.247 39.984 1.00 48.78 ? 170 ILE C CD1 1 HETATM 7800 N N . MSE C 1 112 ? 23.750 65.269 38.224 1.00 53.15 ? 171 MSE C N 1 HETATM 7801 C CA . MSE C 1 112 ? 23.718 63.815 38.336 1.00 60.50 ? 171 MSE C CA 1 HETATM 7802 C C . MSE C 1 112 ? 24.974 63.288 39.018 1.00 63.80 ? 171 MSE C C 1 HETATM 7803 O O . MSE C 1 112 ? 26.092 63.635 38.638 1.00 61.16 ? 171 MSE C O 1 HETATM 7804 C CB . MSE C 1 112 ? 23.561 63.170 36.959 1.00 78.46 ? 171 MSE C CB 1 HETATM 7805 C CG . MSE C 1 112 ? 22.123 62.879 36.574 1.00 81.99 ? 171 MSE C CG 1 HETATM 7806 SE SE . MSE C 1 112 ? 21.918 61.052 35.931 1.00 112.93 ? 171 MSE C SE 1 HETATM 7807 C CE . MSE C 1 112 ? 22.678 60.111 37.463 1.00 107.21 ? 171 MSE C CE 1 ATOM 7808 N N . ASP C 1 113 ? 24.780 62.444 40.027 1.00 92.84 ? 172 ASP C N 1 ATOM 7809 C CA . ASP C 1 113 ? 25.890 61.906 40.806 1.00 103.38 ? 172 ASP C CA 1 ATOM 7810 C C . ASP C 1 113 ? 26.533 60.698 40.136 1.00 106.86 ? 172 ASP C C 1 ATOM 7811 O O . ASP C 1 113 ? 27.653 60.316 40.474 1.00 107.20 ? 172 ASP C O 1 ATOM 7812 C CB . ASP C 1 113 ? 25.416 61.520 42.209 1.00 104.00 ? 172 ASP C CB 1 ATOM 7813 C CG . ASP C 1 113 ? 25.013 62.720 43.041 1.00 110.88 ? 172 ASP C CG 1 ATOM 7814 O OD1 . ASP C 1 113 ? 25.312 63.860 42.630 1.00 122.11 ? 172 ASP C OD1 1 ATOM 7815 O OD2 . ASP C 1 113 ? 24.399 62.520 44.111 1.00 102.64 ? 172 ASP C OD2 1 ATOM 7816 N N . GLY C 1 114 ? 25.827 60.103 39.180 1.00 93.55 ? 173 GLY C N 1 ATOM 7817 C CA . GLY C 1 114 ? 26.260 58.847 38.599 1.00 106.37 ? 173 GLY C CA 1 ATOM 7818 C C . GLY C 1 114 ? 26.958 58.971 37.260 1.00 110.22 ? 173 GLY C C 1 ATOM 7819 O O . GLY C 1 114 ? 26.326 59.231 36.237 1.00 123.34 ? 173 GLY C O 1 ATOM 7820 N N . GLY C 1 115 ? 28.273 58.775 37.272 1.00 81.43 ? 174 GLY C N 1 ATOM 7821 C CA . GLY C 1 115 ? 29.065 58.788 36.057 1.00 63.67 ? 174 GLY C CA 1 ATOM 7822 C C . GLY C 1 115 ? 30.383 59.522 36.215 1.00 71.01 ? 174 GLY C C 1 ATOM 7823 O O . GLY C 1 115 ? 30.927 59.623 37.315 1.00 63.31 ? 174 GLY C O 1 ATOM 7824 N N . THR C 1 116 ? 30.897 60.036 35.103 1.00 67.04 ? 175 THR C N 1 ATOM 7825 C CA . THR C 1 116 ? 32.207 60.674 35.080 1.00 61.06 ? 175 THR C CA 1 ATOM 7826 C C . THR C 1 116 ? 32.133 62.094 34.530 1.00 47.74 ? 175 THR C C 1 ATOM 7827 O O . THR C 1 116 ? 32.588 63.042 35.167 1.00 57.91 ? 175 THR C O 1 ATOM 7828 C CB . THR C 1 116 ? 33.217 59.861 34.249 1.00 72.11 ? 175 THR C CB 1 ATOM 7829 O OG1 . THR C 1 116 ? 32.519 58.881 33.471 1.00 79.56 ? 175 THR C OG1 1 ATOM 7830 C CG2 . THR C 1 116 ? 34.209 59.158 35.161 1.00 68.23 ? 175 THR C CG2 1 ATOM 7831 N N . GLN C 1 117 ? 31.570 62.228 33.335 1.00 44.32 ? 176 GLN C N 1 ATOM 7832 C CA . GLN C 1 117 ? 31.465 63.523 32.673 1.00 36.17 ? 176 GLN C CA 1 ATOM 7833 C C . GLN C 1 117 ? 30.187 64.268 33.050 1.00 30.05 ? 176 GLN C C 1 ATOM 7834 O O . GLN C 1 117 ? 29.267 63.692 33.633 1.00 58.46 ? 176 GLN C O 1 ATOM 7835 C CB . GLN C 1 117 ? 31.543 63.343 31.155 1.00 34.80 ? 176 GLN C CB 1 ATOM 7836 C CG . GLN C 1 117 ? 32.920 62.922 30.672 1.00 44.69 ? 176 GLN C CG 1 ATOM 7837 C CD . GLN C 1 117 ? 32.977 62.669 29.179 1.00 49.80 ? 176 GLN C CD 1 ATOM 7838 O OE1 . GLN C 1 117 ? 32.671 63.550 28.375 1.00 50.36 ? 176 GLN C OE1 1 ATOM 7839 N NE2 . GLN C 1 117 ? 33.379 61.461 28.799 1.00 42.50 ? 176 GLN C NE2 1 ATOM 7840 N N . VAL C 1 118 ? 30.150 65.556 32.714 1.00 37.55 ? 177 VAL C N 1 ATOM 7841 C CA . VAL C 1 118 ? 29.061 66.455 33.096 1.00 30.53 ? 177 VAL C CA 1 ATOM 7842 C C . VAL C 1 118 ? 27.685 65.960 32.645 1.00 36.31 ? 177 VAL C C 1 ATOM 7843 O O . VAL C 1 118 ? 27.462 65.676 31.468 1.00 35.55 ? 177 VAL C O 1 ATOM 7844 C CB . VAL C 1 118 ? 29.302 67.882 32.543 1.00 41.79 ? 177 VAL C CB 1 ATOM 7845 C CG1 . VAL C 1 118 ? 29.589 67.853 31.043 1.00 29.19 ? 177 VAL C CG1 1 ATOM 7846 C CG2 . VAL C 1 118 ? 28.128 68.796 32.874 1.00 29.87 ? 177 VAL C CG2 1 ATOM 7847 N N . LYS C 1 119 ? 26.765 65.861 33.601 1.00 37.40 ? 178 LYS C N 1 ATOM 7848 C CA . LYS C 1 119 ? 25.395 65.448 33.318 1.00 41.91 ? 178 LYS C CA 1 ATOM 7849 C C . LYS C 1 119 ? 24.410 66.079 34.292 1.00 39.34 ? 178 LYS C C 1 ATOM 7850 O O . LYS C 1 119 ? 24.686 66.189 35.487 1.00 48.22 ? 178 LYS C O 1 ATOM 7851 C CB . LYS C 1 119 ? 25.265 63.925 33.408 1.00 30.21 ? 178 LYS C CB 1 ATOM 7852 C CG . LYS C 1 119 ? 25.758 63.148 32.207 1.00 53.74 ? 178 LYS C CG 1 ATOM 7853 C CD . LYS C 1 119 ? 25.436 61.671 32.366 1.00 60.88 ? 178 LYS C CD 1 ATOM 7854 C CE . LYS C 1 119 ? 25.996 61.125 33.669 1.00 74.02 ? 178 LYS C CE 1 ATOM 7855 N NZ . LYS C 1 119 ? 27.477 61.279 33.743 1.00 77.59 ? 178 LYS C NZ 1 ATOM 7856 N N . PHE C 1 120 ? 23.260 66.496 33.774 1.00 30.23 ? 179 PHE C N 1 ATOM 7857 C CA . PHE C 1 120 ? 22.203 67.043 34.615 1.00 40.59 ? 179 PHE C CA 1 ATOM 7858 C C . PHE C 1 120 ? 21.017 66.090 34.651 1.00 38.37 ? 179 PHE C C 1 ATOM 7859 O O . PHE C 1 120 ? 20.785 65.343 33.701 1.00 30.79 ? 179 PHE C O 1 ATOM 7860 C CB . PHE C 1 120 ? 21.746 68.416 34.112 1.00 30.24 ? 179 PHE C CB 1 ATOM 7861 C CG . PHE C 1 120 ? 22.793 69.491 34.218 1.00 40.55 ? 179 PHE C CG 1 ATOM 7862 C CD1 . PHE C 1 120 ? 23.875 69.347 35.069 1.00 29.76 ? 179 PHE C CD1 1 ATOM 7863 C CD2 . PHE C 1 120 ? 22.684 70.654 33.471 1.00 30.24 ? 179 PHE C CD2 1 ATOM 7864 C CE1 . PHE C 1 120 ? 24.835 70.338 35.165 1.00 42.26 ? 179 PHE C CE1 1 ATOM 7865 C CE2 . PHE C 1 120 ? 23.641 71.648 33.563 1.00 34.86 ? 179 PHE C CE2 1 ATOM 7866 C CZ . PHE C 1 120 ? 24.717 71.490 34.412 1.00 30.89 ? 179 PHE C CZ 1 ATOM 7867 N N . VAL C 1 121 ? 20.270 66.114 35.749 1.00 42.35 ? 180 VAL C N 1 ATOM 7868 C CA . VAL C 1 121 ? 18.951 65.494 35.778 1.00 44.65 ? 180 VAL C CA 1 ATOM 7869 C C . VAL C 1 121 ? 17.890 66.589 35.713 1.00 35.69 ? 180 VAL C C 1 ATOM 7870 O O . VAL C 1 121 ? 17.839 67.473 36.570 1.00 39.65 ? 180 VAL C O 1 ATOM 7871 C CB . VAL C 1 121 ? 18.743 64.608 37.027 1.00 38.92 ? 180 VAL C CB 1 ATOM 7872 C CG1 . VAL C 1 121 ? 19.286 65.278 38.271 1.00 39.88 ? 180 VAL C CG1 1 ATOM 7873 C CG2 . VAL C 1 121 ? 17.271 64.245 37.189 1.00 35.38 ? 180 VAL C CG2 1 ATOM 7874 N N . PHE C 1 122 ? 17.054 66.539 34.683 1.00 40.56 ? 181 PHE C N 1 ATOM 7875 C CA . PHE C 1 122 ? 15.962 67.495 34.554 1.00 39.06 ? 181 PHE C CA 1 ATOM 7876 C C . PHE C 1 122 ? 14.726 67.003 35.286 1.00 49.15 ? 181 PHE C C 1 ATOM 7877 O O . PHE C 1 122 ? 14.256 65.900 35.038 1.00 50.24 ? 181 PHE C O 1 ATOM 7878 C CB . PHE C 1 122 ? 15.618 67.735 33.082 1.00 40.39 ? 181 PHE C CB 1 ATOM 7879 C CG . PHE C 1 122 ? 16.572 68.651 32.373 1.00 33.77 ? 181 PHE C CG 1 ATOM 7880 C CD1 . PHE C 1 122 ? 17.564 69.319 33.070 1.00 34.57 ? 181 PHE C CD1 1 ATOM 7881 C CD2 . PHE C 1 122 ? 16.469 68.848 31.006 1.00 35.66 ? 181 PHE C CD2 1 ATOM 7882 C CE1 . PHE C 1 122 ? 18.439 70.163 32.415 1.00 45.14 ? 181 PHE C CE1 1 ATOM 7883 C CE2 . PHE C 1 122 ? 17.340 69.689 30.348 1.00 33.07 ? 181 PHE C CE2 1 ATOM 7884 C CZ . PHE C 1 122 ? 18.326 70.348 31.053 1.00 31.58 ? 181 PHE C CZ 1 ATOM 7885 N N . THR C 1 123 ? 14.204 67.818 36.194 1.00 58.45 ? 182 THR C N 1 ATOM 7886 C CA . THR C 1 123 ? 12.905 67.536 36.784 1.00 43.30 ? 182 THR C CA 1 ATOM 7887 C C . THR C 1 123 ? 11.895 68.513 36.206 1.00 46.26 ? 182 THR C C 1 ATOM 7888 O O . THR C 1 123 ? 11.981 69.718 36.439 1.00 51.04 ? 182 THR C O 1 ATOM 7889 C CB . THR C 1 123 ? 12.925 67.641 38.320 1.00 43.02 ? 182 THR C CB 1 ATOM 7890 O OG1 . THR C 1 123 ? 13.796 66.639 38.857 1.00 47.05 ? 182 THR C OG1 1 ATOM 7891 C CG2 . THR C 1 123 ? 11.527 67.443 38.883 1.00 37.18 ? 182 THR C CG2 1 ATOM 7892 N N . PHE C 1 124 ? 10.943 67.991 35.441 1.00 43.40 ? 183 PHE C N 1 ATOM 7893 C CA . PHE C 1 124 ? 9.972 68.840 34.770 1.00 46.97 ? 183 PHE C CA 1 ATOM 7894 C C . PHE C 1 124 ? 8.840 69.190 35.725 1.00 52.66 ? 183 PHE C C 1 ATOM 7895 O O . PHE C 1 124 ? 8.753 68.640 36.824 1.00 48.41 ? 183 PHE C O 1 ATOM 7896 C CB . PHE C 1 124 ? 9.429 68.145 33.520 1.00 32.96 ? 183 PHE C CB 1 ATOM 7897 C CG . PHE C 1 124 ? 10.488 67.812 32.505 1.00 47.34 ? 183 PHE C CG 1 ATOM 7898 C CD1 . PHE C 1 124 ? 11.014 68.794 31.683 1.00 39.18 ? 183 PHE C CD1 1 ATOM 7899 C CD2 . PHE C 1 124 ? 10.964 66.516 32.382 1.00 49.42 ? 183 PHE C CD2 1 ATOM 7900 C CE1 . PHE C 1 124 ? 11.992 68.489 30.751 1.00 48.43 ? 183 PHE C CE1 1 ATOM 7901 C CE2 . PHE C 1 124 ? 11.942 66.204 31.453 1.00 41.46 ? 183 PHE C CE2 1 ATOM 7902 C CZ . PHE C 1 124 ? 12.456 67.193 30.637 1.00 32.13 ? 183 PHE C CZ 1 ATOM 7903 N N . LYS C 1 125 ? 7.985 70.117 35.306 1.00 54.80 ? 184 LYS C N 1 ATOM 7904 C CA . LYS C 1 125 ? 6.851 70.553 36.116 1.00 52.30 ? 184 LYS C CA 1 ATOM 7905 C C . LYS C 1 125 ? 5.925 69.390 36.469 1.00 50.11 ? 184 LYS C C 1 ATOM 7906 O O . LYS C 1 125 ? 5.379 69.338 37.571 1.00 45.99 ? 184 LYS C O 1 ATOM 7907 C CB . LYS C 1 125 ? 6.086 71.669 35.406 1.00 51.40 ? 184 LYS C CB 1 ATOM 7908 C CG . LYS C 1 125 ? 6.716 73.038 35.631 1.00 62.89 ? 184 LYS C CG 1 ATOM 7909 C CD . LYS C 1 125 ? 5.979 74.153 34.915 1.00 63.37 ? 184 LYS C CD 1 ATOM 7910 C CE . LYS C 1 125 ? 6.673 75.488 35.146 1.00 65.09 ? 184 LYS C CE 1 ATOM 7911 N NZ . LYS C 1 125 ? 6.079 76.596 34.347 1.00 62.44 ? 184 LYS C NZ 1 ATOM 7912 N N . ASN C 1 126 ? 5.751 68.459 35.535 1.00 38.30 ? 185 ASN C N 1 ATOM 7913 C CA . ASN C 1 126 ? 4.951 67.263 35.786 1.00 43.69 ? 185 ASN C CA 1 ATOM 7914 C C . ASN C 1 126 ? 5.658 66.246 36.689 1.00 43.91 ? 185 ASN C C 1 ATOM 7915 O O . ASN C 1 126 ? 5.193 65.116 36.841 1.00 55.76 ? 185 ASN C O 1 ATOM 7916 C CB . ASN C 1 126 ? 4.555 66.599 34.461 1.00 33.58 ? 185 ASN C CB 1 ATOM 7917 C CG . ASN C 1 126 ? 5.757 66.170 33.629 1.00 57.64 ? 185 ASN C CG 1 ATOM 7918 O OD1 . ASN C 1 126 ? 6.903 66.239 34.077 1.00 43.46 ? 185 ASN C OD1 1 ATOM 7919 N ND2 . ASN C 1 126 ? 5.494 65.720 32.408 1.00 44.98 ? 185 ASN C ND2 1 ATOM 7920 N N . ASP C 1 127 ? 6.791 66.657 37.256 1.00 47.04 ? 186 ASP C N 1 ATOM 7921 C CA . ASP C 1 127 ? 7.603 65.839 38.164 1.00 56.54 ? 186 ASP C CA 1 ATOM 7922 C C . ASP C 1 127 ? 8.231 64.601 37.520 1.00 53.55 ? 186 ASP C C 1 ATOM 7923 O O . ASP C 1 127 ? 8.851 63.794 38.211 1.00 54.32 ? 186 ASP C O 1 ATOM 7924 C CB . ASP C 1 127 ? 6.781 65.414 39.384 1.00 53.42 ? 186 ASP C CB 1 ATOM 7925 C CG . ASP C 1 127 ? 6.565 66.548 40.363 1.00 68.10 ? 186 ASP C CG 1 ATOM 7926 O OD1 . ASP C 1 127 ? 7.482 67.381 40.520 1.00 45.52 ? 186 ASP C OD1 1 ATOM 7927 O OD2 . ASP C 1 127 ? 5.480 66.606 40.980 1.00 88.12 ? 186 ASP C OD2 1 ATOM 7928 N N . LYS C 1 128 ? 8.073 64.444 36.210 1.00 45.14 ? 187 LYS C N 1 ATOM 7929 C CA . LYS C 1 128 ? 8.826 63.421 35.494 1.00 53.46 ? 187 LYS C CA 1 ATOM 7930 C C . LYS C 1 128 ? 10.254 63.912 35.284 1.00 56.17 ? 187 LYS C C 1 ATOM 7931 O O . LYS C 1 128 ? 10.537 65.094 35.473 1.00 44.69 ? 187 LYS C O 1 ATOM 7932 C CB . LYS C 1 128 ? 8.162 63.078 34.161 1.00 42.01 ? 187 LYS C CB 1 ATOM 7933 C CG . LYS C 1 128 ? 6.843 62.339 34.307 1.00 43.88 ? 187 LYS C CG 1 ATOM 7934 C CD . LYS C 1 128 ? 7.029 61.048 35.092 1.00 39.63 ? 187 LYS C CD 1 ATOM 7935 C CE . LYS C 1 128 ? 5.743 60.240 35.146 1.00 56.09 ? 187 LYS C CE 1 ATOM 7936 N NZ . LYS C 1 128 ? 4.584 61.059 35.597 1.00 54.38 ? 187 LYS C NZ 1 ATOM 7937 N N . GLN C 1 129 ? 11.156 63.015 34.896 1.00 58.91 ? 188 GLN C N 1 ATOM 7938 C CA . GLN C 1 129 ? 12.571 63.373 34.847 1.00 39.75 ? 188 GLN C CA 1 ATOM 7939 C C . GLN C 1 129 ? 13.289 62.913 33.581 1.00 47.02 ? 188 GLN C C 1 ATOM 7940 O O . GLN C 1 129 ? 12.807 62.042 32.856 1.00 42.31 ? 188 GLN C O 1 ATOM 7941 C CB . GLN C 1 129 ? 13.301 62.821 36.074 1.00 39.94 ? 188 GLN C CB 1 ATOM 7942 C CG . GLN C 1 129 ? 12.864 63.453 37.388 1.00 32.35 ? 188 GLN C CG 1 ATOM 7943 C CD . GLN C 1 129 ? 13.679 62.972 38.571 1.00 42.67 ? 188 GLN C CD 1 ATOM 7944 O OE1 . GLN C 1 129 ? 13.822 61.769 38.795 1.00 42.05 ? 188 GLN C OE1 1 ATOM 7945 N NE2 . GLN C 1 129 ? 14.217 63.912 39.338 1.00 31.97 ? 188 GLN C NE2 1 ATOM 7946 N N . ALA C 1 130 ? 14.447 63.518 33.326 1.00 56.66 ? 189 ALA C N 1 ATOM 7947 C CA . ALA C 1 130 ? 15.263 63.191 32.163 1.00 48.25 ? 189 ALA C CA 1 ATOM 7948 C C . ALA C 1 130 ? 16.749 63.431 32.432 1.00 53.44 ? 189 ALA C C 1 ATOM 7949 O O . ALA C 1 130 ? 17.112 64.173 33.344 1.00 37.54 ? 189 ALA C O 1 ATOM 7950 C CB . ALA C 1 130 ? 14.807 64.001 30.958 1.00 37.59 ? 189 ALA C CB 1 ATOM 7951 N N . VAL C 1 131 ? 17.601 62.796 31.632 1.00 41.29 ? 190 VAL C N 1 ATOM 7952 C CA . VAL C 1 131 ? 19.045 63.003 31.716 1.00 31.46 ? 190 VAL C CA 1 ATOM 7953 C C . VAL C 1 131 ? 19.512 63.999 30.657 1.00 34.98 ? 190 VAL C C 1 ATOM 7954 O O . VAL C 1 131 ? 19.233 63.829 29.470 1.00 31.40 ? 190 VAL C O 1 ATOM 7955 C CB . VAL C 1 131 ? 19.822 61.681 31.550 1.00 36.74 ? 190 VAL C CB 1 ATOM 7956 C CG1 . VAL C 1 131 ? 21.319 61.944 31.496 1.00 31.19 ? 190 VAL C CG1 1 ATOM 7957 C CG2 . VAL C 1 131 ? 19.490 60.724 32.683 1.00 31.63 ? 190 VAL C CG2 1 ATOM 7958 N N . PHE C 1 132 ? 20.223 65.035 31.089 1.00 31.02 ? 191 PHE C N 1 ATOM 7959 C CA . PHE C 1 132 ? 20.715 66.061 30.175 1.00 36.81 ? 191 PHE C CA 1 ATOM 7960 C C . PHE C 1 132 ? 22.230 66.034 29.995 1.00 49.65 ? 191 PHE C C 1 ATOM 7961 O O . PHE C 1 132 ? 22.984 66.059 30.968 1.00 30.43 ? 191 PHE C O 1 ATOM 7962 C CB . PHE C 1 132 ? 20.285 67.445 30.660 1.00 37.55 ? 191 PHE C CB 1 ATOM 7963 C CG . PHE C 1 132 ? 20.874 68.575 29.866 1.00 30.51 ? 191 PHE C CG 1 ATOM 7964 C CD1 . PHE C 1 132 ? 20.403 68.868 28.599 1.00 30.63 ? 191 PHE C CD1 1 ATOM 7965 C CD2 . PHE C 1 132 ? 21.896 69.349 30.391 1.00 31.60 ? 191 PHE C CD2 1 ATOM 7966 C CE1 . PHE C 1 132 ? 20.943 69.907 27.868 1.00 30.42 ? 191 PHE C CE1 1 ATOM 7967 C CE2 . PHE C 1 132 ? 22.439 70.391 29.665 1.00 33.14 ? 191 PHE C CE2 1 ATOM 7968 C CZ . PHE C 1 132 ? 21.961 70.671 28.401 1.00 30.15 ? 191 PHE C CZ 1 ATOM 7969 N N . LYS C 1 133 ? 22.667 65.988 28.740 1.00 30.57 ? 192 LYS C N 1 ATOM 7970 C CA . LYS C 1 133 ? 24.084 66.093 28.407 1.00 34.73 ? 192 LYS C CA 1 ATOM 7971 C C . LYS C 1 133 ? 24.305 67.268 27.460 1.00 35.55 ? 192 LYS C C 1 ATOM 7972 O O . LYS C 1 133 ? 23.778 67.277 26.350 1.00 41.46 ? 192 LYS C O 1 ATOM 7973 C CB . LYS C 1 133 ? 24.594 64.799 27.770 1.00 30.42 ? 192 LYS C CB 1 ATOM 7974 C CG . LYS C 1 133 ? 24.661 63.612 28.715 1.00 30.50 ? 192 LYS C CG 1 ATOM 7975 C CD . LYS C 1 133 ? 25.044 62.346 27.963 1.00 30.60 ? 192 LYS C CD 1 ATOM 7976 C CE . LYS C 1 133 ? 25.268 61.180 28.912 1.00 32.07 ? 192 LYS C CE 1 ATOM 7977 N NZ . LYS C 1 133 ? 25.796 59.976 28.215 1.00 35.29 ? 192 LYS C NZ 1 ATOM 7978 N N . PRO C 1 134 ? 25.095 68.261 27.895 1.00 38.66 ? 193 PRO C N 1 ATOM 7979 C CA . PRO C 1 134 ? 25.297 69.494 27.124 1.00 29.81 ? 193 PRO C CA 1 ATOM 7980 C C . PRO C 1 134 ? 26.182 69.318 25.890 1.00 29.74 ? 193 PRO C C 1 ATOM 7981 O O . PRO C 1 134 ? 27.102 68.501 25.892 1.00 30.25 ? 193 PRO C O 1 ATOM 7982 C CB . PRO C 1 134 ? 25.966 70.426 28.136 1.00 29.57 ? 193 PRO C CB 1 ATOM 7983 C CG . PRO C 1 134 ? 26.691 69.511 29.057 1.00 34.19 ? 193 PRO C CG 1 ATOM 7984 C CD . PRO C 1 134 ? 25.839 68.276 29.168 1.00 29.78 ? 193 PRO C CD 1 HETATM 7985 N N . MSE C 1 135 ? 25.888 70.088 24.846 1.00 35.15 ? 194 MSE C N 1 HETATM 7986 C CA . MSE C 1 135 ? 26.706 70.122 23.638 1.00 34.73 ? 194 MSE C CA 1 HETATM 7987 C C . MSE C 1 135 ? 28.058 70.758 23.937 1.00 29.39 ? 194 MSE C C 1 HETATM 7988 O O . MSE C 1 135 ? 28.157 71.641 24.788 1.00 29.25 ? 194 MSE C O 1 HETATM 7989 C CB . MSE C 1 135 ? 25.986 70.894 22.528 1.00 29.74 ? 194 MSE C CB 1 HETATM 7990 C CG . MSE C 1 135 ? 26.811 71.155 21.278 1.00 43.78 ? 194 MSE C CG 1 HETATM 7991 SE SE . MSE C 1 135 ? 25.784 72.056 19.889 1.00 65.53 ? 194 MSE C SE 1 HETATM 7992 C CE . MSE C 1 135 ? 27.213 72.333 18.590 1.00 100.94 ? 194 MSE C CE 1 ATOM 7993 N N . ARG C 1 136 ? 29.101 70.312 23.244 1.00 40.30 ? 195 ARG C N 1 ATOM 7994 C CA . ARG C 1 136 ? 30.425 70.872 23.463 1.00 29.06 ? 195 ARG C CA 1 ATOM 7995 C C . ARG C 1 136 ? 30.954 71.455 22.157 1.00 28.98 ? 195 ARG C C 1 ATOM 7996 O O . ARG C 1 136 ? 30.857 72.657 21.922 1.00 43.31 ? 195 ARG C O 1 ATOM 7997 C CB . ARG C 1 136 ? 31.375 69.801 23.992 1.00 31.69 ? 195 ARG C CB 1 ATOM 7998 C CG . ARG C 1 136 ? 32.664 70.328 24.589 1.00 29.66 ? 195 ARG C CG 1 ATOM 7999 C CD . ARG C 1 136 ? 33.450 69.183 25.200 1.00 30.77 ? 195 ARG C CD 1 ATOM 8000 N NE . ARG C 1 136 ? 32.985 68.858 26.548 1.00 29.72 ? 195 ARG C NE 1 ATOM 8001 C CZ . ARG C 1 136 ? 33.401 69.444 27.664 1.00 28.61 ? 195 ARG C CZ 1 ATOM 8002 N NH1 . ARG C 1 136 ? 34.295 70.419 27.617 1.00 43.11 ? 195 ARG C NH1 1 ATOM 8003 N NH2 . ARG C 1 136 ? 32.904 69.061 28.831 1.00 44.44 ? 195 ARG C NH2 1 ATOM 8004 N N . PHE C 1 137 ? 31.494 70.592 21.302 1.00 34.09 ? 196 PHE C N 1 ATOM 8005 C CA . PHE C 1 137 ? 32.028 71.021 20.012 1.00 29.25 ? 196 PHE C CA 1 ATOM 8006 C C . PHE C 1 137 ? 30.992 70.888 18.899 1.00 38.19 ? 196 PHE C C 1 ATOM 8007 O O . PHE C 1 137 ? 29.906 70.344 19.106 1.00 41.09 ? 196 PHE C O 1 ATOM 8008 C CB . PHE C 1 137 ? 33.278 70.218 19.649 1.00 28.87 ? 196 PHE C CB 1 ATOM 8009 C CG . PHE C 1 137 ? 34.309 70.175 20.736 1.00 45.01 ? 196 PHE C CG 1 ATOM 8010 C CD1 . PHE C 1 137 ? 34.890 71.342 21.205 1.00 29.20 ? 196 PHE C CD1 1 ATOM 8011 C CD2 . PHE C 1 137 ? 34.703 68.966 21.288 1.00 28.71 ? 196 PHE C CD2 1 ATOM 8012 C CE1 . PHE C 1 137 ? 35.840 71.305 22.207 1.00 32.98 ? 196 PHE C CE1 1 ATOM 8013 C CE2 . PHE C 1 137 ? 35.653 68.922 22.290 1.00 35.63 ? 196 PHE C CE2 1 ATOM 8014 C CZ . PHE C 1 137 ? 36.223 70.094 22.750 1.00 33.11 ? 196 PHE C CZ 1 ATOM 8015 N N . GLY C 1 138 ? 31.341 71.386 17.716 1.00 38.79 ? 197 GLY C N 1 ATOM 8016 C CA . GLY C 1 138 ? 30.480 71.288 16.552 1.00 29.30 ? 197 GLY C CA 1 ATOM 8017 C C . GLY C 1 138 ? 30.396 69.878 16.000 1.00 36.85 ? 197 GLY C C 1 ATOM 8018 O O . GLY C 1 138 ? 31.104 68.978 16.452 1.00 46.90 ? 197 GLY C O 1 ATOM 8019 N N . ARG C 1 139 ? 29.522 69.690 15.018 1.00 29.65 ? 198 ARG C N 1 ATOM 8020 C CA . ARG C 1 139 ? 29.296 68.382 14.412 1.00 33.13 ? 198 ARG C CA 1 ATOM 8021 C C . ARG C 1 139 ? 30.515 67.882 13.637 1.00 31.96 ? 198 ARG C C 1 ATOM 8022 O O . ARG C 1 139 ? 30.670 66.680 13.420 1.00 35.48 ? 198 ARG C O 1 ATOM 8023 C CB . ARG C 1 139 ? 28.078 68.435 13.487 1.00 30.05 ? 198 ARG C CB 1 ATOM 8024 C CG . ARG C 1 139 ? 26.809 68.937 14.160 1.00 38.95 ? 198 ARG C CG 1 ATOM 8025 C CD . ARG C 1 139 ? 26.358 68.000 15.268 1.00 36.09 ? 198 ARG C CD 1 ATOM 8026 N NE . ARG C 1 139 ? 24.935 68.145 15.560 1.00 34.91 ? 198 ARG C NE 1 ATOM 8027 C CZ . ARG C 1 139 ? 24.449 68.838 16.586 1.00 47.35 ? 198 ARG C CZ 1 ATOM 8028 N NH1 . ARG C 1 139 ? 25.273 69.451 17.423 1.00 30.21 ? 198 ARG C NH1 1 ATOM 8029 N NH2 . ARG C 1 139 ? 23.139 68.918 16.774 1.00 30.64 ? 198 ARG C NH2 1 ATOM 8030 N N . ASP C 1 140 ? 31.376 68.807 13.224 1.00 35.93 ? 199 ASP C N 1 ATOM 8031 C CA . ASP C 1 140 ? 32.523 68.470 12.384 1.00 42.36 ? 199 ASP C CA 1 ATOM 8032 C C . ASP C 1 140 ? 33.722 67.978 13.188 1.00 29.26 ? 199 ASP C C 1 ATOM 8033 O O . ASP C 1 140 ? 34.647 67.387 12.630 1.00 34.25 ? 199 ASP C O 1 ATOM 8034 C CB . ASP C 1 140 ? 32.936 69.678 11.539 1.00 29.31 ? 199 ASP C CB 1 ATOM 8035 C CG . ASP C 1 140 ? 31.905 70.034 10.486 1.00 64.91 ? 199 ASP C CG 1 ATOM 8036 O OD1 . ASP C 1 140 ? 31.203 69.121 10.004 1.00 60.77 ? 199 ASP C OD1 1 ATOM 8037 O OD2 . ASP C 1 140 ? 31.800 71.229 10.137 1.00 79.76 ? 199 ASP C OD2 1 ATOM 8038 N N . TYR C 1 141 ? 33.709 68.228 14.494 1.00 30.01 ? 200 TYR C N 1 ATOM 8039 C CA . TYR C 1 141 ? 34.813 67.825 15.360 1.00 29.02 ? 200 TYR C CA 1 ATOM 8040 C C . TYR C 1 141 ? 35.015 66.316 15.359 1.00 32.08 ? 200 TYR C C 1 ATOM 8041 O O . TYR C 1 141 ? 34.063 65.550 15.500 1.00 53.53 ? 200 TYR C O 1 ATOM 8042 C CB . TYR C 1 141 ? 34.579 68.309 16.794 1.00 43.33 ? 200 TYR C CB 1 ATOM 8043 C CG . TYR C 1 141 ? 35.721 68.002 17.742 1.00 43.11 ? 200 TYR C CG 1 ATOM 8044 C CD1 . TYR C 1 141 ? 36.775 68.891 17.905 1.00 43.75 ? 200 TYR C CD1 1 ATOM 8045 C CD2 . TYR C 1 141 ? 35.741 66.821 18.477 1.00 45.13 ? 200 TYR C CD2 1 ATOM 8046 C CE1 . TYR C 1 141 ? 37.819 68.612 18.771 1.00 49.98 ? 200 TYR C CE1 1 ATOM 8047 C CE2 . TYR C 1 141 ? 36.779 66.532 19.342 1.00 46.82 ? 200 TYR C CE2 1 ATOM 8048 C CZ . TYR C 1 141 ? 37.815 67.431 19.487 1.00 65.18 ? 200 TYR C CZ 1 ATOM 8049 O OH . TYR C 1 141 ? 38.849 67.145 20.350 1.00 74.32 ? 200 TYR C OH 1 ATOM 8050 N N . GLU C 1 142 ? 36.265 65.897 15.196 1.00 28.97 ? 201 GLU C N 1 ATOM 8051 C CA . GLU C 1 142 ? 36.604 64.484 15.264 1.00 38.47 ? 201 GLU C CA 1 ATOM 8052 C C . GLU C 1 142 ? 37.563 64.245 16.424 1.00 32.64 ? 201 GLU C C 1 ATOM 8053 O O . GLU C 1 142 ? 38.374 65.110 16.759 1.00 33.05 ? 201 GLU C O 1 ATOM 8054 C CB . GLU C 1 142 ? 37.219 64.007 13.947 1.00 29.02 ? 201 GLU C CB 1 ATOM 8055 C CG . GLU C 1 142 ? 36.411 64.385 12.713 1.00 37.64 ? 201 GLU C CG 1 ATOM 8056 C CD . GLU C 1 142 ? 36.290 63.248 11.717 1.00 36.46 ? 201 GLU C CD 1 ATOM 8057 O OE1 . GLU C 1 142 ? 36.765 62.133 12.021 1.00 52.50 ? 201 GLU C OE1 1 ATOM 8058 O OE2 . GLU C 1 142 ? 35.722 63.470 10.627 1.00 31.29 ? 201 GLU C OE2 1 ATOM 8059 N N . SER C 1 143 ? 37.459 63.072 17.038 1.00 46.14 ? 202 SER C N 1 ATOM 8060 C CA . SER C 1 143 ? 38.290 62.727 18.185 1.00 42.56 ? 202 SER C CA 1 ATOM 8061 C C . SER C 1 143 ? 39.771 62.687 17.816 1.00 28.58 ? 202 SER C C 1 ATOM 8062 O O . SER C 1 143 ? 40.136 62.275 16.715 1.00 35.71 ? 202 SER C O 1 ATOM 8063 C CB . SER C 1 143 ? 37.851 61.385 18.776 1.00 28.93 ? 202 SER C CB 1 ATOM 8064 O OG . SER C 1 143 ? 37.754 60.392 17.771 1.00 60.62 ? 202 SER C OG 1 ATOM 8065 N N . ASP C 1 144 ? 40.613 63.132 18.744 1.00 45.48 ? 203 ASP C N 1 ATOM 8066 C CA . ASP C 1 144 ? 42.064 63.082 18.585 1.00 29.34 ? 203 ASP C CA 1 ATOM 8067 C C . ASP C 1 144 ? 42.522 61.644 18.364 1.00 35.54 ? 203 ASP C C 1 ATOM 8068 O O . ASP C 1 144 ? 42.196 60.759 19.155 1.00 34.87 ? 203 ASP C O 1 ATOM 8069 C CB . ASP C 1 144 ? 42.748 63.683 19.819 1.00 34.13 ? 203 ASP C CB 1 ATOM 8070 C CG . ASP C 1 144 ? 44.222 63.991 19.597 1.00 46.71 ? 203 ASP C CG 1 ATOM 8071 O OD1 . ASP C 1 144 ? 44.920 63.207 18.921 1.00 41.56 ? 203 ASP C OD1 1 ATOM 8072 O OD2 . ASP C 1 144 ? 44.688 65.024 20.120 1.00 52.67 ? 203 ASP C OD2 1 ATOM 8073 N N . PRO C 1 145 ? 43.276 61.404 17.279 1.00 34.74 ? 204 PRO C N 1 ATOM 8074 C CA . PRO C 1 145 ? 43.797 60.066 16.973 1.00 39.46 ? 204 PRO C CA 1 ATOM 8075 C C . PRO C 1 145 ? 44.699 59.514 18.077 1.00 40.03 ? 204 PRO C C 1 ATOM 8076 O O . PRO C 1 145 ? 44.861 58.298 18.183 1.00 44.52 ? 204 PRO C O 1 ATOM 8077 C CB . PRO C 1 145 ? 44.591 60.287 15.681 1.00 29.09 ? 204 PRO C CB 1 ATOM 8078 C CG . PRO C 1 145 ? 43.967 61.487 15.059 1.00 33.53 ? 204 PRO C CG 1 ATOM 8079 C CD . PRO C 1 145 ? 43.570 62.369 16.205 1.00 28.11 ? 204 PRO C CD 1 ATOM 8080 N N . ASN C 1 146 ? 45.274 60.400 18.884 1.00 30.19 ? 205 ASN C N 1 ATOM 8081 C CA . ASN C 1 146 ? 46.118 59.990 20.000 1.00 42.91 ? 205 ASN C CA 1 ATOM 8082 C C . ASN C 1 146 ? 45.313 59.705 21.265 1.00 36.95 ? 205 ASN C C 1 ATOM 8083 O O . ASN C 1 146 ? 45.850 59.195 22.250 1.00 42.12 ? 205 ASN C O 1 ATOM 8084 C CB . ASN C 1 146 ? 47.177 61.057 20.289 1.00 27.53 ? 205 ASN C CB 1 ATOM 8085 C CG . ASN C 1 146 ? 48.171 61.213 19.156 1.00 31.10 ? 205 ASN C CG 1 ATOM 8086 O OD1 . ASN C 1 146 ? 48.614 60.229 18.564 1.00 35.68 ? 205 ASN C OD1 1 ATOM 8087 N ND2 . ASN C 1 146 ? 48.530 62.453 18.850 1.00 33.63 ? 205 ASN C ND2 1 ATOM 8088 N N . HIS C 1 147 ? 44.027 60.039 21.236 1.00 35.94 ? 206 HIS C N 1 ATOM 8089 C CA . HIS C 1 147 ? 43.160 59.836 22.392 1.00 37.20 ? 206 HIS C CA 1 ATOM 8090 C C . HIS C 1 147 ? 42.652 58.402 22.488 1.00 43.67 ? 206 HIS C C 1 ATOM 8091 O O . HIS C 1 147 ? 42.143 57.844 21.515 1.00 37.39 ? 206 HIS C O 1 ATOM 8092 C CB . HIS C 1 147 ? 41.969 60.796 22.348 1.00 32.27 ? 206 HIS C CB 1 ATOM 8093 C CG . HIS C 1 147 ? 42.264 62.153 22.905 1.00 44.35 ? 206 HIS C CG 1 ATOM 8094 N ND1 . HIS C 1 147 ? 41.397 63.217 22.772 1.00 44.36 ? 206 HIS C ND1 1 ATOM 8095 C CD2 . HIS C 1 147 ? 43.326 62.619 23.603 1.00 29.15 ? 206 HIS C CD2 1 ATOM 8096 C CE1 . HIS C 1 147 ? 41.915 64.280 23.360 1.00 27.98 ? 206 HIS C CE1 1 ATOM 8097 N NE2 . HIS C 1 147 ? 43.084 63.944 23.873 1.00 36.96 ? 206 HIS C NE2 1 ATOM 8098 N N . PHE C 1 148 ? 42.796 57.811 23.670 1.00 43.15 ? 207 PHE C N 1 ATOM 8099 C CA . PHE C 1 148 ? 42.197 56.516 23.956 1.00 29.64 ? 207 PHE C CA 1 ATOM 8100 C C . PHE C 1 148 ? 40.689 56.644 24.124 1.00 40.78 ? 207 PHE C C 1 ATOM 8101 O O . PHE C 1 148 ? 40.161 57.747 24.268 1.00 28.63 ? 207 PHE C O 1 ATOM 8102 C CB . PHE C 1 148 ? 42.810 55.899 25.216 1.00 29.70 ? 207 PHE C CB 1 ATOM 8103 C CG . PHE C 1 148 ? 44.188 55.335 25.013 1.00 42.60 ? 207 PHE C CG 1 ATOM 8104 C CD1 . PHE C 1 148 ? 45.313 56.081 25.322 1.00 38.74 ? 207 PHE C CD1 1 ATOM 8105 C CD2 . PHE C 1 148 ? 44.356 54.056 24.507 1.00 33.92 ? 207 PHE C CD2 1 ATOM 8106 C CE1 . PHE C 1 148 ? 46.581 55.561 25.133 1.00 27.74 ? 207 PHE C CE1 1 ATOM 8107 C CE2 . PHE C 1 148 ? 45.620 53.529 24.318 1.00 41.49 ? 207 PHE C CE2 1 ATOM 8108 C CZ . PHE C 1 148 ? 46.734 54.283 24.631 1.00 40.32 ? 207 PHE C CZ 1 ATOM 8109 N N . TYR C 1 149 ? 40.003 55.506 24.100 1.00 34.90 ? 208 TYR C N 1 ATOM 8110 C CA . TYR C 1 149 ? 38.561 55.456 24.306 1.00 35.51 ? 208 TYR C CA 1 ATOM 8111 C C . TYR C 1 149 ? 38.151 56.045 25.655 1.00 45.82 ? 208 TYR C C 1 ATOM 8112 O O . TYR C 1 149 ? 37.049 56.573 25.797 1.00 57.06 ? 208 TYR C O 1 ATOM 8113 C CB . TYR C 1 149 ? 38.058 54.014 24.191 1.00 29.25 ? 208 TYR C CB 1 ATOM 8114 C CG . TYR C 1 149 ? 38.968 52.994 24.841 1.00 46.46 ? 208 TYR C CG 1 ATOM 8115 C CD1 . TYR C 1 149 ? 40.018 52.420 24.134 1.00 37.25 ? 208 TYR C CD1 1 ATOM 8116 C CD2 . TYR C 1 149 ? 38.775 52.603 26.159 1.00 29.17 ? 208 TYR C CD2 1 ATOM 8117 C CE1 . TYR C 1 149 ? 40.852 51.491 24.724 1.00 39.48 ? 208 TYR C CE1 1 ATOM 8118 C CE2 . TYR C 1 149 ? 39.603 51.671 26.755 1.00 45.58 ? 208 TYR C CE2 1 ATOM 8119 C CZ . TYR C 1 149 ? 40.639 51.120 26.034 1.00 48.71 ? 208 TYR C CZ 1 ATOM 8120 O OH . TYR C 1 149 ? 41.465 50.193 26.624 1.00 51.94 ? 208 TYR C OH 1 ATOM 8121 N N . PHE C 1 150 ? 39.037 55.951 26.644 1.00 45.86 ? 209 PHE C N 1 ATOM 8122 C CA . PHE C 1 150 ? 38.736 56.459 27.979 1.00 45.81 ? 209 PHE C CA 1 ATOM 8123 C C . PHE C 1 150 ? 39.160 57.916 28.162 1.00 45.08 ? 209 PHE C C 1 ATOM 8124 O O . PHE C 1 150 ? 39.050 58.466 29.258 1.00 45.64 ? 209 PHE C O 1 ATOM 8125 C CB . PHE C 1 150 ? 39.400 55.584 29.052 1.00 40.07 ? 209 PHE C CB 1 ATOM 8126 C CG . PHE C 1 150 ? 40.876 55.363 28.844 1.00 37.10 ? 209 PHE C CG 1 ATOM 8127 C CD1 . PHE C 1 150 ? 41.799 56.336 29.199 1.00 28.32 ? 209 PHE C CD1 1 ATOM 8128 C CD2 . PHE C 1 150 ? 41.343 54.169 28.318 1.00 28.56 ? 209 PHE C CD2 1 ATOM 8129 C CE1 . PHE C 1 150 ? 43.155 56.129 29.015 1.00 35.94 ? 209 PHE C CE1 1 ATOM 8130 C CE2 . PHE C 1 150 ? 42.698 53.954 28.135 1.00 41.60 ? 209 PHE C CE2 1 ATOM 8131 C CZ . PHE C 1 150 ? 43.605 54.936 28.484 1.00 36.58 ? 209 PHE C CZ 1 ATOM 8132 N N . SER C 1 151 ? 39.647 58.536 27.091 1.00 51.19 ? 210 SER C N 1 ATOM 8133 C CA . SER C 1 151 ? 40.040 59.940 27.140 1.00 45.58 ? 210 SER C CA 1 ATOM 8134 C C . SER C 1 151 ? 39.112 60.831 26.318 1.00 45.19 ? 210 SER C C 1 ATOM 8135 O O . SER C 1 151 ? 39.178 62.057 26.402 1.00 40.94 ? 210 SER C O 1 ATOM 8136 C CB . SER C 1 151 ? 41.481 60.106 26.654 1.00 50.95 ? 210 SER C CB 1 ATOM 8137 O OG . SER C 1 151 ? 42.388 59.443 27.516 1.00 68.50 ? 210 SER C OG 1 ATOM 8138 N N . ASP C 1 152 ? 38.245 60.209 25.527 1.00 52.88 ? 211 ASP C N 1 ATOM 8139 C CA . ASP C 1 152 ? 37.363 60.941 24.626 1.00 57.84 ? 211 ASP C CA 1 ATOM 8140 C C . ASP C 1 152 ? 36.251 61.688 25.365 1.00 53.84 ? 211 ASP C C 1 ATOM 8141 O O . ASP C 1 152 ? 35.567 61.119 26.216 1.00 50.36 ? 211 ASP C O 1 ATOM 8142 C CB . ASP C 1 152 ? 36.753 59.985 23.599 1.00 63.75 ? 211 ASP C CB 1 ATOM 8143 C CG . ASP C 1 152 ? 36.333 60.690 22.326 1.00 68.48 ? 211 ASP C CG 1 ATOM 8144 O OD1 . ASP C 1 152 ? 36.846 61.797 22.059 1.00 55.30 ? 211 ASP C OD1 1 ATOM 8145 O OD2 . ASP C 1 152 ? 35.491 60.133 21.590 1.00 74.73 ? 211 ASP C OD2 1 ATOM 8146 N N . PHE C 1 153 ? 36.081 62.964 25.032 1.00 49.41 ? 212 PHE C N 1 ATOM 8147 C CA . PHE C 1 153 ? 34.962 63.756 25.537 1.00 36.45 ? 212 PHE C CA 1 ATOM 8148 C C . PHE C 1 153 ? 33.658 63.270 24.912 1.00 32.24 ? 212 PHE C C 1 ATOM 8149 O O . PHE C 1 153 ? 33.622 62.930 23.729 1.00 42.54 ? 212 PHE C O 1 ATOM 8150 C CB . PHE C 1 153 ? 35.169 65.243 25.232 1.00 37.02 ? 212 PHE C CB 1 ATOM 8151 C CG . PHE C 1 153 ? 35.482 66.079 26.442 1.00 39.40 ? 212 PHE C CG 1 ATOM 8152 C CD1 . PHE C 1 153 ? 35.016 65.719 27.696 1.00 47.70 ? 212 PHE C CD1 1 ATOM 8153 C CD2 . PHE C 1 153 ? 36.242 67.233 26.322 1.00 40.65 ? 212 PHE C CD2 1 ATOM 8154 C CE1 . PHE C 1 153 ? 35.304 66.492 28.808 1.00 37.81 ? 212 PHE C CE1 1 ATOM 8155 C CE2 . PHE C 1 153 ? 36.532 68.010 27.429 1.00 28.31 ? 212 PHE C CE2 1 ATOM 8156 C CZ . PHE C 1 153 ? 36.064 67.639 28.673 1.00 42.93 ? 212 PHE C CZ 1 ATOM 8157 N N . GLU C 1 154 ? 32.591 63.231 25.704 1.00 29.35 ? 213 GLU C N 1 ATOM 8158 C CA . GLU C 1 154 ? 31.287 62.805 25.200 1.00 32.22 ? 213 GLU C CA 1 ATOM 8159 C C . GLU C 1 154 ? 30.733 63.746 24.137 1.00 29.65 ? 213 GLU C C 1 ATOM 8160 O O . GLU C 1 154 ? 30.983 64.950 24.160 1.00 37.71 ? 213 GLU C O 1 ATOM 8161 C CB . GLU C 1 154 ? 30.271 62.685 26.339 1.00 37.99 ? 213 GLU C CB 1 ATOM 8162 C CG . GLU C 1 154 ? 30.360 61.395 27.135 1.00 41.73 ? 213 GLU C CG 1 ATOM 8163 C CD . GLU C 1 154 ? 29.161 61.195 28.043 1.00 45.06 ? 213 GLU C CD 1 ATOM 8164 O OE1 . GLU C 1 154 ? 28.471 60.164 27.900 1.00 52.22 ? 213 GLU C OE1 1 ATOM 8165 O OE2 . GLU C 1 154 ? 28.906 62.068 28.899 1.00 53.26 ? 213 GLU C OE2 1 ATOM 8166 N N . ARG C 1 155 ? 29.977 63.177 23.206 1.00 31.28 ? 214 ARG C N 1 ATOM 8167 C CA . ARG C 1 155 ? 29.262 63.956 22.206 1.00 30.66 ? 214 ARG C CA 1 ATOM 8168 C C . ARG C 1 155 ? 27.764 63.745 22.388 1.00 30.20 ? 214 ARG C C 1 ATOM 8169 O O . ARG C 1 155 ? 27.262 62.633 22.220 1.00 41.01 ? 214 ARG C O 1 ATOM 8170 C CB . ARG C 1 155 ? 29.697 63.564 20.793 1.00 29.96 ? 214 ARG C CB 1 ATOM 8171 C CG . ARG C 1 155 ? 31.131 63.950 20.460 1.00 29.71 ? 214 ARG C CG 1 ATOM 8172 C CD . ARG C 1 155 ? 31.628 63.231 19.217 1.00 29.74 ? 214 ARG C CD 1 ATOM 8173 N NE . ARG C 1 155 ? 31.978 61.843 19.500 1.00 38.19 ? 214 ARG C NE 1 ATOM 8174 C CZ . ARG C 1 155 ? 33.119 61.457 20.063 1.00 34.36 ? 214 ARG C CZ 1 ATOM 8175 N NH1 . ARG C 1 155 ? 34.032 62.357 20.406 1.00 37.42 ? 214 ARG C NH1 1 ATOM 8176 N NH2 . ARG C 1 155 ? 33.348 60.169 20.284 1.00 45.38 ? 214 ARG C NH2 1 ATOM 8177 N N . HIS C 1 156 ? 27.060 64.814 22.747 1.00 30.19 ? 215 HIS C N 1 ATOM 8178 C CA . HIS C 1 156 ? 25.628 64.746 23.027 1.00 30.43 ? 215 HIS C CA 1 ATOM 8179 C C . HIS C 1 156 ? 24.839 64.256 21.816 1.00 43.20 ? 215 HIS C C 1 ATOM 8180 O O . HIS C 1 156 ? 23.838 63.555 21.960 1.00 36.50 ? 215 HIS C O 1 ATOM 8181 C CB . HIS C 1 156 ? 25.103 66.115 23.465 1.00 30.35 ? 215 HIS C CB 1 ATOM 8182 C CG . HIS C 1 156 ? 24.749 67.016 22.324 1.00 39.79 ? 215 HIS C CG 1 ATOM 8183 N ND1 . HIS C 1 156 ? 25.696 67.562 21.484 1.00 41.95 ? 215 HIS C ND1 1 ATOM 8184 C CD2 . HIS C 1 156 ? 23.550 67.456 21.875 1.00 31.79 ? 215 HIS C CD2 1 ATOM 8185 C CE1 . HIS C 1 156 ? 25.094 68.301 20.568 1.00 32.01 ? 215 HIS C CE1 1 ATOM 8186 N NE2 . HIS C 1 156 ? 23.793 68.256 20.785 1.00 38.52 ? 215 HIS C NE2 1 ATOM 8187 N N . HIS C 1 157 ? 25.297 64.625 20.624 1.00 30.59 ? 216 HIS C N 1 ATOM 8188 C CA . HIS C 1 157 ? 24.595 64.280 19.395 1.00 35.33 ? 216 HIS C CA 1 ATOM 8189 C C . HIS C 1 157 ? 24.794 62.813 19.026 1.00 35.97 ? 216 HIS C C 1 ATOM 8190 O O . HIS C 1 157 ? 24.091 62.282 18.169 1.00 47.19 ? 216 HIS C O 1 ATOM 8191 C CB . HIS C 1 157 ? 25.048 65.187 18.246 1.00 30.67 ? 216 HIS C CB 1 ATOM 8192 C CG . HIS C 1 157 ? 26.504 65.073 17.919 1.00 38.88 ? 216 HIS C CG 1 ATOM 8193 N ND1 . HIS C 1 157 ? 27.462 65.877 18.497 1.00 30.19 ? 216 HIS C ND1 1 ATOM 8194 C CD2 . HIS C 1 157 ? 27.165 64.255 17.066 1.00 30.46 ? 216 HIS C CD2 1 ATOM 8195 C CE1 . HIS C 1 157 ? 28.651 65.557 18.019 1.00 42.31 ? 216 HIS C CE1 1 ATOM 8196 N NE2 . HIS C 1 157 ? 28.498 64.574 17.149 1.00 35.02 ? 216 HIS C NE2 1 ATOM 8197 N N . ALA C 1 158 ? 25.752 62.161 19.675 1.00 40.21 ? 217 ALA C N 1 ATOM 8198 C CA . ALA C 1 158 ? 25.968 60.734 19.472 1.00 35.90 ? 217 ALA C CA 1 ATOM 8199 C C . ALA C 1 158 ? 24.906 59.931 20.217 1.00 38.49 ? 217 ALA C C 1 ATOM 8200 O O . ALA C 1 158 ? 24.463 58.883 19.746 1.00 45.18 ? 217 ALA C O 1 ATOM 8201 C CB . ALA C 1 158 ? 27.362 60.333 19.925 1.00 39.69 ? 217 ALA C CB 1 ATOM 8202 N N . GLU C 1 159 ? 24.509 60.431 21.384 1.00 35.82 ? 218 GLU C N 1 ATOM 8203 C CA . GLU C 1 159 ? 23.417 59.841 22.153 1.00 45.71 ? 218 GLU C CA 1 ATOM 8204 C C . GLU C 1 159 ? 22.122 59.831 21.347 1.00 34.74 ? 218 GLU C C 1 ATOM 8205 O O . GLU C 1 159 ? 21.404 58.832 21.315 1.00 40.86 ? 218 GLU C O 1 ATOM 8206 C CB . GLU C 1 159 ? 23.208 60.602 23.466 1.00 31.29 ? 218 GLU C CB 1 ATOM 8207 C CG . GLU C 1 159 ? 24.314 60.416 24.500 1.00 42.46 ? 218 GLU C CG 1 ATOM 8208 C CD . GLU C 1 159 ? 24.216 59.101 25.260 1.00 51.94 ? 218 GLU C CD 1 ATOM 8209 O OE1 . GLU C 1 159 ? 23.761 58.092 24.682 1.00 40.09 ? 218 GLU C OE1 1 ATOM 8210 O OE2 . GLU C 1 159 ? 24.597 59.078 26.448 1.00 43.22 ? 218 GLU C OE2 1 ATOM 8211 N N . ILE C 1 160 ? 21.831 60.957 20.705 1.00 36.56 ? 219 ILE C N 1 ATOM 8212 C CA . ILE C 1 160 ? 20.640 61.094 19.873 1.00 31.84 ? 219 ILE C CA 1 ATOM 8213 C C . ILE C 1 160 ? 20.708 60.194 18.642 1.00 44.36 ? 219 ILE C C 1 ATOM 8214 O O . ILE C 1 160 ? 19.790 59.417 18.377 1.00 47.23 ? 219 ILE C O 1 ATOM 8215 C CB . ILE C 1 160 ? 20.448 62.552 19.415 1.00 41.28 ? 219 ILE C CB 1 ATOM 8216 C CG1 . ILE C 1 160 ? 20.230 63.467 20.621 1.00 31.60 ? 219 ILE C CG1 1 ATOM 8217 C CG2 . ILE C 1 160 ? 19.292 62.658 18.432 1.00 31.96 ? 219 ILE C CG2 1 ATOM 8218 C CD1 . ILE C 1 160 ? 20.527 64.919 20.334 1.00 31.39 ? 219 ILE C CD1 1 ATOM 8219 N N . ALA C 1 161 ? 21.803 60.314 17.898 1.00 31.79 ? 220 ALA C N 1 ATOM 8220 C CA . ALA C 1 161 ? 21.995 59.577 16.652 1.00 37.89 ? 220 ALA C CA 1 ATOM 8221 C C . ALA C 1 161 ? 21.893 58.062 16.813 1.00 32.62 ? 220 ALA C C 1 ATOM 8222 O O . ALA C 1 161 ? 21.317 57.381 15.964 1.00 44.13 ? 220 ALA C O 1 ATOM 8223 C CB . ALA C 1 161 ? 23.339 59.937 16.042 1.00 33.55 ? 220 ALA C CB 1 ATOM 8224 N N . THR C 1 162 ? 22.447 57.535 17.900 1.00 31.98 ? 221 THR C N 1 ATOM 8225 C CA . THR C 1 162 ? 22.502 56.090 18.087 1.00 36.46 ? 221 THR C CA 1 ATOM 8226 C C . THR C 1 162 ? 21.129 55.531 18.446 1.00 37.85 ? 221 THR C C 1 ATOM 8227 O O . THR C 1 162 ? 20.772 54.429 18.026 1.00 44.82 ? 221 THR C O 1 ATOM 8228 C CB . THR C 1 162 ? 23.517 55.695 19.177 1.00 33.07 ? 221 THR C CB 1 ATOM 8229 O OG1 . THR C 1 162 ? 24.785 56.299 18.894 1.00 41.79 ? 221 THR C OG1 1 ATOM 8230 C CG2 . THR C 1 162 ? 23.684 54.183 19.223 1.00 34.38 ? 221 THR C CG2 1 ATOM 8231 N N . PHE C 1 163 ? 20.364 56.292 19.224 1.00 39.47 ? 222 PHE C N 1 ATOM 8232 C CA . PHE C 1 163 ? 18.991 55.914 19.541 1.00 43.26 ? 222 PHE C CA 1 ATOM 8233 C C . PHE C 1 163 ? 18.164 55.719 18.276 1.00 38.86 ? 222 PHE C C 1 ATOM 8234 O O . PHE C 1 163 ? 17.436 54.736 18.145 1.00 55.94 ? 222 PHE C O 1 ATOM 8235 C CB . PHE C 1 163 ? 18.328 56.961 20.437 1.00 32.76 ? 222 PHE C CB 1 ATOM 8236 C CG . PHE C 1 163 ? 16.829 56.869 20.458 1.00 39.92 ? 222 PHE C CG 1 ATOM 8237 C CD1 . PHE C 1 163 ? 16.196 55.819 21.102 1.00 47.70 ? 222 PHE C CD1 1 ATOM 8238 C CD2 . PHE C 1 163 ? 16.053 57.831 19.832 1.00 42.48 ? 222 PHE C CD2 1 ATOM 8239 C CE1 . PHE C 1 163 ? 14.817 55.726 21.116 1.00 42.72 ? 222 PHE C CE1 1 ATOM 8240 C CE2 . PHE C 1 163 ? 14.673 57.747 19.847 1.00 41.42 ? 222 PHE C CE2 1 ATOM 8241 C CZ . PHE C 1 163 ? 14.055 56.693 20.491 1.00 39.95 ? 222 PHE C CZ 1 ATOM 8242 N N . HIS C 1 164 ? 18.284 56.664 17.348 1.00 39.13 ? 223 HIS C N 1 ATOM 8243 C CA . HIS C 1 164 ? 17.589 56.580 16.068 1.00 49.33 ? 223 HIS C CA 1 ATOM 8244 C C . HIS C 1 164 ? 18.068 55.395 15.235 1.00 45.19 ? 223 HIS C C 1 ATOM 8245 O O . HIS C 1 164 ? 17.261 54.696 14.624 1.00 47.34 ? 223 HIS C O 1 ATOM 8246 C CB . HIS C 1 164 ? 17.755 57.881 15.283 1.00 36.78 ? 223 HIS C CB 1 ATOM 8247 C CG . HIS C 1 164 ? 16.883 58.994 15.776 1.00 39.32 ? 223 HIS C CG 1 ATOM 8248 N ND1 . HIS C 1 164 ? 15.812 59.475 15.055 1.00 33.17 ? 223 HIS C ND1 1 ATOM 8249 C CD2 . HIS C 1 164 ? 16.918 59.713 16.923 1.00 44.40 ? 223 HIS C CD2 1 ATOM 8250 C CE1 . HIS C 1 164 ? 15.227 60.445 15.735 1.00 45.96 ? 223 HIS C CE1 1 ATOM 8251 N NE2 . HIS C 1 164 ? 15.879 60.610 16.872 1.00 41.86 ? 223 HIS C NE2 1 ATOM 8252 N N . LEU C 1 165 ? 19.380 55.179 15.198 1.00 32.97 ? 224 LEU C N 1 ATOM 8253 C CA . LEU C 1 165 ? 19.936 54.046 14.464 1.00 47.48 ? 224 LEU C CA 1 ATOM 8254 C C . LEU C 1 165 ? 19.439 52.733 15.060 1.00 48.65 ? 224 LEU C C 1 ATOM 8255 O O . LEU C 1 165 ? 19.211 51.758 14.343 1.00 35.60 ? 224 LEU C O 1 ATOM 8256 C CB . LEU C 1 165 ? 21.465 54.088 14.467 1.00 32.70 ? 224 LEU C CB 1 ATOM 8257 C CG . LEU C 1 165 ? 22.143 52.917 13.750 1.00 48.89 ? 224 LEU C CG 1 ATOM 8258 C CD1 . LEU C 1 165 ? 21.765 52.898 12.278 1.00 35.03 ? 224 LEU C CD1 1 ATOM 8259 C CD2 . LEU C 1 165 ? 23.649 52.983 13.912 1.00 32.40 ? 224 LEU C CD2 1 ATOM 8260 N N . ASP C 1 166 ? 19.270 52.720 16.379 1.00 33.24 ? 225 ASP C N 1 ATOM 8261 C CA . ASP C 1 166 ? 18.751 51.552 17.080 1.00 38.77 ? 225 ASP C CA 1 ATOM 8262 C C . ASP C 1 166 ? 17.318 51.260 16.636 1.00 43.81 ? 225 ASP C C 1 ATOM 8263 O O . ASP C 1 166 ? 16.881 50.109 16.632 1.00 45.90 ? 225 ASP C O 1 ATOM 8264 C CB . ASP C 1 166 ? 18.816 51.764 18.593 1.00 42.21 ? 225 ASP C CB 1 ATOM 8265 C CG . ASP C 1 166 ? 18.240 50.601 19.371 1.00 44.56 ? 225 ASP C CG 1 ATOM 8266 O OD1 . ASP C 1 166 ? 17.050 50.667 19.736 1.00 42.08 ? 225 ASP C OD1 1 ATOM 8267 O OD2 . ASP C 1 166 ? 18.976 49.624 19.622 1.00 47.09 ? 225 ASP C OD2 1 ATOM 8268 N N . ARG C 1 167 ? 16.595 52.311 16.261 1.00 35.61 ? 226 ARG C N 1 ATOM 8269 C CA . ARG C 1 167 ? 15.250 52.169 15.713 1.00 34.21 ? 226 ARG C CA 1 ATOM 8270 C C . ARG C 1 167 ? 15.315 51.619 14.295 1.00 47.50 ? 226 ARG C C 1 ATOM 8271 O O . ARG C 1 167 ? 14.608 50.672 13.947 1.00 37.30 ? 226 ARG C O 1 ATOM 8272 C CB . ARG C 1 167 ? 14.519 53.512 15.698 1.00 44.27 ? 226 ARG C CB 1 ATOM 8273 C CG . ARG C 1 167 ? 13.157 53.453 15.024 1.00 45.43 ? 226 ARG C CG 1 ATOM 8274 C CD . ARG C 1 167 ? 12.395 54.761 15.149 1.00 36.56 ? 226 ARG C CD 1 ATOM 8275 N NE . ARG C 1 167 ? 11.902 55.023 16.496 1.00 43.86 ? 226 ARG C NE 1 ATOM 8276 C CZ . ARG C 1 167 ? 11.264 56.136 16.844 1.00 55.30 ? 226 ARG C CZ 1 ATOM 8277 N NH1 . ARG C 1 167 ? 11.048 57.085 15.944 1.00 43.02 ? 226 ARG C NH1 1 ATOM 8278 N NH2 . ARG C 1 167 ? 10.844 56.304 18.089 1.00 48.88 ? 226 ARG C NH2 1 ATOM 8279 N N . VAL C 1 168 ? 16.168 52.239 13.484 1.00 36.19 ? 227 VAL C N 1 ATOM 8280 C CA . VAL C 1 168 ? 16.337 51.886 12.079 1.00 37.98 ? 227 VAL C CA 1 ATOM 8281 C C . VAL C 1 168 ? 16.743 50.424 11.898 1.00 35.34 ? 227 VAL C C 1 ATOM 8282 O O . VAL C 1 168 ? 16.309 49.763 10.953 1.00 55.44 ? 227 VAL C O 1 ATOM 8283 C CB . VAL C 1 168 ? 17.387 52.805 11.410 1.00 42.55 ? 227 VAL C CB 1 ATOM 8284 C CG1 . VAL C 1 168 ? 17.696 52.348 9.997 1.00 52.20 ? 227 VAL C CG1 1 ATOM 8285 C CG2 . VAL C 1 168 ? 16.893 54.241 11.396 1.00 34.11 ? 227 VAL C CG2 1 ATOM 8286 N N . LEU C 1 169 ? 17.552 49.913 12.821 1.00 36.06 ? 228 LEU C N 1 ATOM 8287 C CA . LEU C 1 169 ? 18.006 48.528 12.749 1.00 43.34 ? 228 LEU C CA 1 ATOM 8288 C C . LEU C 1 169 ? 16.946 47.570 13.279 1.00 44.34 ? 228 LEU C C 1 ATOM 8289 O O . LEU C 1 169 ? 17.090 46.352 13.181 1.00 43.70 ? 228 LEU C O 1 ATOM 8290 C CB . LEU C 1 169 ? 19.311 48.349 13.528 1.00 34.87 ? 228 LEU C CB 1 ATOM 8291 C CG . LEU C 1 169 ? 20.547 49.048 12.957 1.00 40.13 ? 228 LEU C CG 1 ATOM 8292 C CD1 . LEU C 1 169 ? 21.729 48.911 13.905 1.00 33.25 ? 228 LEU C CD1 1 ATOM 8293 C CD2 . LEU C 1 169 ? 20.885 48.495 11.581 1.00 33.57 ? 228 LEU C CD2 1 ATOM 8294 N N . GLY C 1 170 ? 15.879 48.131 13.839 1.00 48.81 ? 229 GLY C N 1 ATOM 8295 C CA . GLY C 1 170 ? 14.749 47.341 14.288 1.00 35.01 ? 229 GLY C CA 1 ATOM 8296 C C . GLY C 1 170 ? 14.964 46.721 15.652 1.00 50.92 ? 229 GLY C C 1 ATOM 8297 O O . GLY C 1 170 ? 14.235 45.814 16.053 1.00 54.49 ? 229 GLY C O 1 ATOM 8298 N N . PHE C 1 171 ? 15.966 47.215 16.371 1.00 48.41 ? 230 PHE C N 1 ATOM 8299 C CA . PHE C 1 171 ? 16.239 46.721 17.713 1.00 46.14 ? 230 PHE C CA 1 ATOM 8300 C C . PHE C 1 171 ? 15.233 47.279 18.712 1.00 40.22 ? 230 PHE C C 1 ATOM 8301 O O . PHE C 1 171 ? 14.611 46.521 19.455 1.00 45.29 ? 230 PHE C O 1 ATOM 8302 C CB . PHE C 1 171 ? 17.660 47.085 18.154 1.00 60.12 ? 230 PHE C CB 1 ATOM 8303 C CG . PHE C 1 171 ? 18.740 46.383 17.382 1.00 53.53 ? 230 PHE C CG 1 ATOM 8304 C CD1 . PHE C 1 171 ? 18.490 45.179 16.748 1.00 36.20 ? 230 PHE C CD1 1 ATOM 8305 C CD2 . PHE C 1 171 ? 20.011 46.930 17.297 1.00 53.51 ? 230 PHE C CD2 1 ATOM 8306 C CE1 . PHE C 1 171 ? 19.486 44.534 16.039 1.00 49.23 ? 230 PHE C CE1 1 ATOM 8307 C CE2 . PHE C 1 171 ? 21.011 46.290 16.590 1.00 44.49 ? 230 PHE C CE2 1 ATOM 8308 C CZ . PHE C 1 171 ? 20.748 45.091 15.960 1.00 46.53 ? 230 PHE C CZ 1 ATOM 8309 N N . ARG C 1 172 ? 15.079 48.603 18.717 1.00 50.23 ? 231 ARG C N 1 ATOM 8310 C CA . ARG C 1 172 ? 14.220 49.288 19.682 1.00 40.34 ? 231 ARG C CA 1 ATOM 8311 C C . ARG C 1 172 ? 14.530 48.886 21.122 1.00 43.03 ? 231 ARG C C 1 ATOM 8312 O O . ARG C 1 172 ? 13.626 48.663 21.927 1.00 51.21 ? 231 ARG C O 1 ATOM 8313 C CB . ARG C 1 172 ? 12.738 49.064 19.359 1.00 40.26 ? 231 ARG C CB 1 ATOM 8314 C CG . ARG C 1 172 ? 12.222 49.982 18.261 1.00 49.73 ? 231 ARG C CG 1 ATOM 8315 C CD . ARG C 1 172 ? 10.804 49.655 17.822 1.00 40.11 ? 231 ARG C CD 1 ATOM 8316 N NE . ARG C 1 172 ? 10.529 50.166 16.481 1.00 44.48 ? 231 ARG C NE 1 ATOM 8317 C CZ . ARG C 1 172 ? 10.743 49.501 15.353 1.00 46.19 ? 231 ARG C CZ 1 ATOM 8318 N NH1 . ARG C 1 172 ? 11.245 48.277 15.386 1.00 43.51 ? 231 ARG C NH1 1 ATOM 8319 N NH2 . ARG C 1 172 ? 10.459 50.071 14.190 1.00 50.10 ? 231 ARG C NH2 1 ATOM 8320 N N . ARG C 1 173 ? 15.820 48.788 21.428 1.00 34.31 ? 232 ARG C N 1 ATOM 8321 C CA . ARG C 1 173 ? 16.274 48.468 22.776 1.00 44.40 ? 232 ARG C CA 1 ATOM 8322 C C . ARG C 1 173 ? 17.093 49.619 23.348 1.00 51.75 ? 232 ARG C C 1 ATOM 8323 O O . ARG C 1 173 ? 17.779 49.466 24.358 1.00 33.69 ? 232 ARG C O 1 ATOM 8324 C CB . ARG C 1 173 ? 17.093 47.175 22.781 1.00 39.40 ? 232 ARG C CB 1 ATOM 8325 C CG . ARG C 1 173 ? 16.353 45.977 22.211 1.00 43.47 ? 232 ARG C CG 1 ATOM 8326 C CD . ARG C 1 173 ? 16.938 44.666 22.711 1.00 39.14 ? 232 ARG C CD 1 ATOM 8327 N NE . ARG C 1 173 ? 18.254 44.390 22.143 1.00 46.95 ? 232 ARG C NE 1 ATOM 8328 C CZ . ARG C 1 173 ? 18.457 43.917 20.918 1.00 46.16 ? 232 ARG C CZ 1 ATOM 8329 N NH1 . ARG C 1 173 ? 17.426 43.665 20.122 1.00 37.95 ? 232 ARG C NH1 1 ATOM 8330 N NH2 . ARG C 1 173 ? 19.691 43.693 20.486 1.00 58.41 ? 232 ARG C NH2 1 ATOM 8331 N N . ALA C 1 174 ? 17.021 50.772 22.689 1.00 33.74 ? 233 ALA C N 1 ATOM 8332 C CA . ALA C 1 174 ? 17.678 51.981 23.172 1.00 42.00 ? 233 ALA C CA 1 ATOM 8333 C C . ALA C 1 174 ? 16.699 52.853 23.952 1.00 43.51 ? 233 ALA C C 1 ATOM 8334 O O . ALA C 1 174 ? 15.490 52.625 23.925 1.00 45.95 ? 233 ALA C O 1 ATOM 8335 C CB . ALA C 1 174 ? 18.279 52.765 22.017 1.00 34.85 ? 233 ALA C CB 1 ATOM 8336 N N . ILE C 1 175 ? 17.229 53.852 24.648 1.00 38.57 ? 234 ILE C N 1 ATOM 8337 C CA . ILE C 1 175 ? 16.411 54.728 25.477 1.00 33.90 ? 234 ILE C CA 1 ATOM 8338 C C . ILE C 1 175 ? 16.096 56.025 24.734 1.00 42.55 ? 234 ILE C C 1 ATOM 8339 O O . ILE C 1 175 ? 17.005 56.670 24.211 1.00 53.79 ? 234 ILE C O 1 ATOM 8340 C CB . ILE C 1 175 ? 17.121 55.054 26.805 1.00 37.81 ? 234 ILE C CB 1 ATOM 8341 C CG1 . ILE C 1 175 ? 17.593 53.767 27.486 1.00 33.07 ? 234 ILE C CG1 1 ATOM 8342 C CG2 . ILE C 1 175 ? 16.215 55.866 27.717 1.00 33.07 ? 234 ILE C CG2 1 ATOM 8343 C CD1 . ILE C 1 175 ? 18.279 53.998 28.811 1.00 45.59 ? 234 ILE C CD1 1 ATOM 8344 N N . PRO C 1 176 ? 14.804 56.398 24.670 1.00 50.00 ? 235 PRO C N 1 ATOM 8345 C CA . PRO C 1 176 ? 14.342 57.606 23.972 1.00 38.27 ? 235 PRO C CA 1 ATOM 8346 C C . PRO C 1 176 ? 15.160 58.852 24.306 1.00 46.63 ? 235 PRO C C 1 ATOM 8347 O O . PRO C 1 176 ? 15.240 59.256 25.466 1.00 35.57 ? 235 PRO C O 1 ATOM 8348 C CB . PRO C 1 176 ? 12.901 57.754 24.458 1.00 37.93 ? 235 PRO C CB 1 ATOM 8349 C CG . PRO C 1 176 ? 12.462 56.360 24.724 1.00 46.93 ? 235 PRO C CG 1 ATOM 8350 C CD . PRO C 1 176 ? 13.679 55.608 25.203 1.00 37.02 ? 235 PRO C CD 1 ATOM 8351 N N . THR C 1 177 ? 15.757 59.451 23.281 1.00 32.85 ? 236 THR C N 1 ATOM 8352 C CA . THR C 1 177 ? 16.625 60.607 23.459 1.00 38.61 ? 236 THR C CA 1 ATOM 8353 C C . THR C 1 177 ? 16.350 61.648 22.379 1.00 39.84 ? 236 THR C C 1 ATOM 8354 O O . THR C 1 177 ? 16.242 61.314 21.199 1.00 36.33 ? 236 THR C O 1 ATOM 8355 C CB . THR C 1 177 ? 18.114 60.204 23.419 1.00 43.44 ? 236 THR C CB 1 ATOM 8356 O OG1 . THR C 1 177 ? 18.350 59.144 24.354 1.00 45.67 ? 236 THR C OG1 1 ATOM 8357 C CG2 . THR C 1 177 ? 19.004 61.389 23.762 1.00 31.96 ? 236 THR C CG2 1 ATOM 8358 N N . VAL C 1 178 ? 16.238 62.908 22.786 1.00 32.32 ? 237 VAL C N 1 ATOM 8359 C CA . VAL C 1 178 ? 15.945 63.982 21.846 1.00 32.27 ? 237 VAL C CA 1 ATOM 8360 C C . VAL C 1 178 ? 16.891 65.164 22.048 1.00 31.94 ? 237 VAL C C 1 ATOM 8361 O O . VAL C 1 178 ? 17.430 65.365 23.138 1.00 35.55 ? 237 VAL C O 1 ATOM 8362 C CB . VAL C 1 178 ? 14.476 64.460 21.986 1.00 41.30 ? 237 VAL C CB 1 ATOM 8363 C CG1 . VAL C 1 178 ? 14.313 65.353 23.206 1.00 32.34 ? 237 VAL C CG1 1 ATOM 8364 C CG2 . VAL C 1 178 ? 14.020 65.186 20.730 1.00 32.52 ? 237 VAL C CG2 1 ATOM 8365 N N . GLY C 1 179 ? 17.111 65.928 20.982 1.00 42.97 ? 238 GLY C N 1 ATOM 8366 C CA . GLY C 1 179 ? 17.871 67.159 21.069 1.00 33.12 ? 238 GLY C CA 1 ATOM 8367 C C . GLY C 1 179 ? 17.019 68.290 21.609 1.00 42.97 ? 238 GLY C C 1 ATOM 8368 O O . GLY C 1 179 ? 15.801 68.299 21.430 1.00 33.62 ? 238 GLY C O 1 ATOM 8369 N N . ARG C 1 180 ? 17.659 69.248 22.270 1.00 32.62 ? 239 ARG C N 1 ATOM 8370 C CA . ARG C 1 180 ? 16.946 70.394 22.818 1.00 31.22 ? 239 ARG C CA 1 ATOM 8371 C C . ARG C 1 180 ? 17.868 71.589 23.018 1.00 44.60 ? 239 ARG C C 1 ATOM 8372 O O . ARG C 1 180 ? 18.917 71.478 23.651 1.00 38.58 ? 239 ARG C O 1 ATOM 8373 C CB . ARG C 1 180 ? 16.281 70.025 24.146 1.00 31.32 ? 239 ARG C CB 1 ATOM 8374 C CG . ARG C 1 180 ? 15.427 71.135 24.740 1.00 35.47 ? 239 ARG C CG 1 ATOM 8375 C CD . ARG C 1 180 ? 14.790 70.709 26.053 1.00 31.41 ? 239 ARG C CD 1 ATOM 8376 N NE . ARG C 1 180 ? 14.057 71.806 26.679 1.00 46.90 ? 239 ARG C NE 1 ATOM 8377 C CZ . ARG C 1 180 ? 12.976 71.649 27.436 1.00 40.68 ? 239 ARG C CZ 1 ATOM 8378 N NH1 . ARG C 1 180 ? 12.489 70.436 27.662 1.00 38.96 ? 239 ARG C NH1 1 ATOM 8379 N NH2 . ARG C 1 180 ? 12.377 72.708 27.965 1.00 31.45 ? 239 ARG C NH2 1 ATOM 8380 N N . VAL C 1 181 ? 17.466 72.733 22.474 1.00 31.63 ? 240 VAL C N 1 ATOM 8381 C CA . VAL C 1 181 ? 18.211 73.967 22.671 1.00 30.57 ? 240 VAL C CA 1 ATOM 8382 C C . VAL C 1 181 ? 17.633 74.711 23.866 1.00 30.51 ? 240 VAL C C 1 ATOM 8383 O O . VAL C 1 181 ? 16.479 75.138 23.846 1.00 51.72 ? 240 VAL C O 1 ATOM 8384 C CB . VAL C 1 181 ? 18.168 74.868 21.425 1.00 30.51 ? 240 VAL C CB 1 ATOM 8385 C CG1 . VAL C 1 181 ? 18.986 76.132 21.657 1.00 30.22 ? 240 VAL C CG1 1 ATOM 8386 C CG2 . VAL C 1 181 ? 18.672 74.109 20.208 1.00 30.59 ? 240 VAL C CG2 1 ATOM 8387 N N . LEU C 1 182 ? 18.443 74.860 24.907 1.00 46.49 ? 241 LEU C N 1 ATOM 8388 C CA . LEU C 1 182 ? 17.975 75.452 26.152 1.00 37.67 ? 241 LEU C CA 1 ATOM 8389 C C . LEU C 1 182 ? 18.442 76.884 26.353 1.00 38.72 ? 241 LEU C C 1 ATOM 8390 O O . LEU C 1 182 ? 19.539 77.261 25.941 1.00 54.12 ? 241 LEU C O 1 ATOM 8391 C CB . LEU C 1 182 ? 18.422 74.602 27.341 1.00 37.89 ? 241 LEU C CB 1 ATOM 8392 C CG . LEU C 1 182 ? 17.696 73.270 27.509 1.00 41.69 ? 241 LEU C CG 1 ATOM 8393 C CD1 . LEU C 1 182 ? 18.451 72.141 26.831 1.00 38.83 ? 241 LEU C CD1 1 ATOM 8394 C CD2 . LEU C 1 182 ? 17.507 72.983 28.979 1.00 55.97 ? 241 LEU C CD2 1 ATOM 8395 N N . ASN C 1 183 ? 17.590 77.677 26.990 1.00 34.37 ? 242 ASN C N 1 ATOM 8396 C CA . ASN C 1 183 ? 17.986 78.987 27.474 1.00 31.35 ? 242 ASN C CA 1 ATOM 8397 C C . ASN C 1 183 ? 18.736 78.815 28.788 1.00 35.82 ? 242 ASN C C 1 ATOM 8398 O O . ASN C 1 183 ? 18.155 78.404 29.793 1.00 42.58 ? 242 ASN C O 1 ATOM 8399 C CB . ASN C 1 183 ? 16.765 79.889 27.654 1.00 29.80 ? 242 ASN C CB 1 ATOM 8400 C CG . ASN C 1 183 ? 17.135 81.300 28.059 1.00 44.24 ? 242 ASN C CG 1 ATOM 8401 O OD1 . ASN C 1 183 ? 17.593 81.542 29.176 1.00 50.61 ? 242 ASN C OD1 1 ATOM 8402 N ND2 . ASN C 1 183 ? 16.933 82.243 27.149 1.00 47.03 ? 242 ASN C ND2 1 HETATM 8403 N N . MSE C 1 184 ? 20.031 79.115 28.773 1.00 40.60 ? 243 MSE C N 1 HETATM 8404 C CA . MSE C 1 184 ? 20.888 78.888 29.932 1.00 44.52 ? 243 MSE C CA 1 HETATM 8405 C C . MSE C 1 184 ? 20.474 79.715 31.142 1.00 47.07 ? 243 MSE C C 1 HETATM 8406 O O . MSE C 1 184 ? 20.613 79.272 32.280 1.00 48.14 ? 243 MSE C O 1 HETATM 8407 C CB . MSE C 1 184 ? 22.344 79.192 29.581 1.00 29.04 ? 243 MSE C CB 1 HETATM 8408 C CG . MSE C 1 184 ? 22.925 78.289 28.513 1.00 29.11 ? 243 MSE C CG 1 HETATM 8409 SE SE . MSE C 1 184 ? 24.813 78.648 28.227 1.00 61.05 ? 243 MSE C SE 1 HETATM 8410 C CE . MSE C 1 184 ? 25.441 78.378 30.053 1.00 29.84 ? 243 MSE C CE 1 ATOM 8411 N N . THR C 1 185 ? 19.966 80.917 30.892 1.00 35.61 ? 244 THR C N 1 ATOM 8412 C CA . THR C 1 185 ? 19.579 81.814 31.972 1.00 43.97 ? 244 THR C CA 1 ATOM 8413 C C . THR C 1 185 ? 18.325 81.329 32.694 1.00 40.02 ? 244 THR C C 1 ATOM 8414 O O . THR C 1 185 ? 18.323 81.180 33.914 1.00 42.70 ? 244 THR C O 1 ATOM 8415 C CB . THR C 1 185 ? 19.334 83.246 31.454 1.00 41.68 ? 244 THR C CB 1 ATOM 8416 O OG1 . THR C 1 185 ? 20.506 83.722 30.780 1.00 36.44 ? 244 THR C OG1 1 ATOM 8417 C CG2 . THR C 1 185 ? 19.006 84.179 32.608 1.00 35.24 ? 244 THR C CG2 1 ATOM 8418 N N . THR C 1 186 ? 17.266 81.075 31.933 1.00 31.72 ? 245 THR C N 1 ATOM 8419 C CA . THR C 1 186 ? 15.966 80.750 32.516 1.00 42.17 ? 245 THR C CA 1 ATOM 8420 C C . THR C 1 186 ? 15.757 79.268 32.828 1.00 40.85 ? 245 THR C C 1 ATOM 8421 O O . THR C 1 186 ? 15.153 78.928 33.843 1.00 59.95 ? 245 THR C O 1 ATOM 8422 C CB . THR C 1 186 ? 14.824 81.208 31.591 1.00 29.72 ? 245 THR C CB 1 ATOM 8423 O OG1 . THR C 1 186 ? 14.964 80.582 30.310 1.00 37.39 ? 245 THR C OG1 1 ATOM 8424 C CG2 . THR C 1 186 ? 14.856 82.716 31.418 1.00 29.52 ? 245 THR C CG2 1 ATOM 8425 N N . GLU C 1 187 ? 16.251 78.389 31.962 1.00 40.73 ? 246 GLU C N 1 ATOM 8426 C CA . GLU C 1 187 ? 15.971 76.962 32.101 1.00 30.73 ? 246 GLU C CA 1 ATOM 8427 C C . GLU C 1 187 ? 17.066 76.182 32.823 1.00 39.22 ? 246 GLU C C 1 ATOM 8428 O O . GLU C 1 187 ? 16.815 75.096 33.347 1.00 48.11 ? 246 GLU C O 1 ATOM 8429 C CB . GLU C 1 187 ? 15.728 76.340 30.725 1.00 35.20 ? 246 GLU C CB 1 ATOM 8430 C CG . GLU C 1 187 ? 14.502 76.882 30.012 1.00 30.44 ? 246 GLU C CG 1 ATOM 8431 C CD . GLU C 1 187 ? 14.280 76.230 28.664 1.00 40.68 ? 246 GLU C CD 1 ATOM 8432 O OE1 . GLU C 1 187 ? 15.058 76.515 27.730 1.00 41.22 ? 246 GLU C OE1 1 ATOM 8433 O OE2 . GLU C 1 187 ? 13.332 75.426 28.540 1.00 34.46 ? 246 GLU C OE2 1 ATOM 8434 N N . LEU C 1 188 ? 18.276 76.729 32.854 1.00 41.24 ? 247 LEU C N 1 ATOM 8435 C CA . LEU C 1 188 ? 19.385 76.055 33.519 1.00 38.40 ? 247 LEU C CA 1 ATOM 8436 C C . LEU C 1 188 ? 19.787 76.776 34.799 1.00 32.65 ? 247 LEU C C 1 ATOM 8437 O O . LEU C 1 188 ? 19.615 76.244 35.892 1.00 45.43 ? 247 LEU C O 1 ATOM 8438 C CB . LEU C 1 188 ? 20.587 75.935 32.578 1.00 29.55 ? 247 LEU C CB 1 ATOM 8439 C CG . LEU C 1 188 ? 20.432 74.949 31.418 1.00 44.19 ? 247 LEU C CG 1 ATOM 8440 C CD1 . LEU C 1 188 ? 21.763 74.727 30.715 1.00 29.60 ? 247 LEU C CD1 1 ATOM 8441 C CD2 . LEU C 1 188 ? 19.853 73.628 31.906 1.00 29.97 ? 247 LEU C CD2 1 ATOM 8442 N N . PHE C 1 189 ? 20.315 77.987 34.654 1.00 31.59 ? 248 PHE C N 1 ATOM 8443 C CA . PHE C 1 189 ? 20.795 78.773 35.787 1.00 39.20 ? 248 PHE C CA 1 ATOM 8444 C C . PHE C 1 189 ? 19.730 78.988 36.862 1.00 48.56 ? 248 PHE C C 1 ATOM 8445 O O . PHE C 1 189 ? 19.938 78.650 38.027 1.00 33.27 ? 248 PHE C O 1 ATOM 8446 C CB . PHE C 1 189 ? 21.315 80.128 35.301 1.00 35.96 ? 248 PHE C CB 1 ATOM 8447 C CG . PHE C 1 189 ? 21.826 81.012 36.401 1.00 37.82 ? 248 PHE C CG 1 ATOM 8448 C CD1 . PHE C 1 189 ? 23.009 80.714 37.056 1.00 33.54 ? 248 PHE C CD1 1 ATOM 8449 C CD2 . PHE C 1 189 ? 21.124 82.145 36.777 1.00 28.54 ? 248 PHE C CD2 1 ATOM 8450 C CE1 . PHE C 1 189 ? 23.481 81.529 38.067 1.00 33.38 ? 248 PHE C CE1 1 ATOM 8451 C CE2 . PHE C 1 189 ? 21.590 82.962 37.788 1.00 28.34 ? 248 PHE C CE2 1 ATOM 8452 C CZ . PHE C 1 189 ? 22.769 82.654 38.434 1.00 28.21 ? 248 PHE C CZ 1 ATOM 8453 N N . GLU C 1 190 ? 18.593 79.552 36.466 1.00 45.99 ? 249 GLU C N 1 ATOM 8454 C CA . GLU C 1 190 ? 17.534 79.889 37.413 1.00 47.84 ? 249 GLU C CA 1 ATOM 8455 C C . GLU C 1 190 ? 16.824 78.659 37.977 1.00 43.26 ? 249 GLU C C 1 ATOM 8456 O O . GLU C 1 190 ? 16.183 78.735 39.024 1.00 53.48 ? 249 GLU C O 1 ATOM 8457 C CB . GLU C 1 190 ? 16.511 80.817 36.753 1.00 46.22 ? 249 GLU C CB 1 ATOM 8458 C CG . GLU C 1 190 ? 16.997 82.247 36.566 1.00 40.03 ? 249 GLU C CG 1 ATOM 8459 C CD . GLU C 1 190 ? 16.118 83.042 35.620 1.00 54.83 ? 249 GLU C CD 1 ATOM 8460 O OE1 . GLU C 1 190 ? 15.104 82.491 35.143 1.00 62.34 ? 249 GLU C OE1 1 ATOM 8461 O OE2 . GLU C 1 190 ? 16.443 84.218 35.349 1.00 53.11 ? 249 GLU C OE2 1 ATOM 8462 N N . LYS C 1 191 ? 16.938 77.530 37.286 1.00 45.66 ? 250 LYS C N 1 ATOM 8463 C CA . LYS C 1 191 ? 16.288 76.301 37.732 1.00 43.07 ? 250 LYS C CA 1 ATOM 8464 C C . LYS C 1 191 ? 17.250 75.347 38.439 1.00 47.85 ? 250 LYS C C 1 ATOM 8465 O O . LYS C 1 191 ? 16.859 74.251 38.844 1.00 47.07 ? 250 LYS C O 1 ATOM 8466 C CB . LYS C 1 191 ? 15.637 75.588 36.544 1.00 40.92 ? 250 LYS C CB 1 ATOM 8467 C CG . LYS C 1 191 ? 14.585 76.417 35.827 1.00 43.24 ? 250 LYS C CG 1 ATOM 8468 C CD . LYS C 1 191 ? 13.455 76.813 36.761 1.00 49.75 ? 250 LYS C CD 1 ATOM 8469 C CE . LYS C 1 191 ? 12.439 77.693 36.051 1.00 49.00 ? 250 LYS C CE 1 ATOM 8470 N NZ . LYS C 1 191 ? 11.301 78.057 36.939 1.00 51.43 ? 250 LYS C NZ 1 ATOM 8471 N N . ALA C 1 192 ? 18.502 75.766 38.587 1.00 43.76 ? 251 ALA C N 1 ATOM 8472 C CA . ALA C 1 192 ? 19.544 74.890 39.115 1.00 48.12 ? 251 ALA C CA 1 ATOM 8473 C C . ALA C 1 192 ? 19.602 74.896 40.637 1.00 36.18 ? 251 ALA C C 1 ATOM 8474 O O . ALA C 1 192 ? 19.307 75.907 41.276 1.00 46.85 ? 251 ALA C O 1 ATOM 8475 C CB . ALA C 1 192 ? 20.899 75.282 38.546 1.00 43.69 ? 251 ALA C CB 1 ATOM 8476 N N . GLU C 1 193 ? 19.983 73.757 41.208 1.00 47.12 ? 252 GLU C N 1 ATOM 8477 C CA . GLU C 1 193 ? 20.250 73.660 42.638 1.00 29.52 ? 252 GLU C CA 1 ATOM 8478 C C . GLU C 1 193 ? 21.425 74.564 43.001 1.00 51.54 ? 252 GLU C C 1 ATOM 8479 O O . GLU C 1 193 ? 22.186 74.977 42.126 1.00 48.52 ? 252 GLU C O 1 ATOM 8480 C CB . GLU C 1 193 ? 20.532 72.214 43.049 1.00 35.79 ? 252 GLU C CB 1 ATOM 8481 C CG . GLU C 1 193 ? 21.776 71.613 42.425 1.00 45.95 ? 252 GLU C CG 1 ATOM 8482 C CD . GLU C 1 193 ? 22.097 70.242 42.984 1.00 59.79 ? 252 GLU C CD 1 ATOM 8483 O OE1 . GLU C 1 193 ? 21.895 70.033 44.200 1.00 64.00 ? 252 GLU C OE1 1 ATOM 8484 O OE2 . GLU C 1 193 ? 22.550 69.373 42.210 1.00 57.29 ? 252 GLU C OE2 1 ATOM 8485 N N . LYS C 1 194 ? 21.566 74.868 44.288 1.00 55.98 ? 253 LYS C N 1 ATOM 8486 C CA . LYS C 1 194 ? 22.544 75.852 44.747 1.00 52.30 ? 253 LYS C CA 1 ATOM 8487 C C . LYS C 1 194 ? 23.980 75.581 44.313 1.00 56.35 ? 253 LYS C C 1 ATOM 8488 O O . LYS C 1 194 ? 24.658 76.468 43.793 1.00 54.79 ? 253 LYS C O 1 ATOM 8489 C CB . LYS C 1 194 ? 22.550 75.913 46.268 1.00 69.50 ? 253 LYS C CB 1 ATOM 8490 C CG . LYS C 1 194 ? 23.598 76.866 46.808 1.00 85.12 ? 253 LYS C CG 1 ATOM 8491 C CD . LYS C 1 194 ? 23.953 76.498 48.225 1.00 92.18 ? 253 LYS C CD 1 ATOM 8492 C CE . LYS C 1 194 ? 24.709 75.171 48.186 1.00 95.20 ? 253 LYS C CE 1 ATOM 8493 N NZ . LYS C 1 194 ? 25.210 74.721 49.504 1.00 97.85 ? 253 LYS C NZ 1 ATOM 8494 N N . LYS C 1 195 ? 24.434 74.351 44.525 1.00 56.95 ? 254 LYS C N 1 ATOM 8495 C CA . LYS C 1 195 ? 25.819 73.993 44.242 1.00 62.62 ? 254 LYS C CA 1 ATOM 8496 C C . LYS C 1 195 ? 26.111 74.002 42.748 1.00 54.51 ? 254 LYS C C 1 ATOM 8497 O O . LYS C 1 195 ? 27.249 74.218 42.334 1.00 54.79 ? 254 LYS C O 1 ATOM 8498 C CB . LYS C 1 195 ? 26.164 72.635 44.865 1.00 57.46 ? 254 LYS C CB 1 ATOM 8499 C CG . LYS C 1 195 ? 25.381 71.445 44.348 1.00 68.48 ? 254 LYS C CG 1 ATOM 8500 C CD . LYS C 1 195 ? 26.006 70.156 44.867 1.00 63.28 ? 254 LYS C CD 1 ATOM 8501 C CE . LYS C 1 195 ? 25.168 68.939 44.526 1.00 63.49 ? 254 LYS C CE 1 ATOM 8502 N NZ . LYS C 1 195 ? 25.094 68.711 43.059 1.00 84.65 ? 254 LYS C NZ 1 ATOM 8503 N N . LEU C 1 196 ? 25.083 73.768 41.942 1.00 49.08 ? 255 LEU C N 1 ATOM 8504 C CA . LEU C 1 196 ? 25.234 73.866 40.501 1.00 47.50 ? 255 LEU C CA 1 ATOM 8505 C C . LEU C 1 196 ? 25.179 75.335 40.072 1.00 40.16 ? 255 LEU C C 1 ATOM 8506 O O . LEU C 1 196 ? 25.898 75.748 39.162 1.00 41.86 ? 255 LEU C O 1 ATOM 8507 C CB . LEU C 1 196 ? 24.154 73.046 39.783 1.00 40.45 ? 255 LEU C CB 1 ATOM 8508 C CG . LEU C 1 196 ? 24.094 73.205 38.262 1.00 30.15 ? 255 LEU C CG 1 ATOM 8509 C CD1 . LEU C 1 196 ? 25.426 72.844 37.615 1.00 29.04 ? 255 LEU C CD1 1 ATOM 8510 C CD2 . LEU C 1 196 ? 22.971 72.361 37.684 1.00 31.21 ? 255 LEU C CD2 1 ATOM 8511 N N . LYS C 1 197 ? 24.324 76.115 40.732 1.00 45.62 ? 256 LYS C N 1 ATOM 8512 C CA . LYS C 1 197 ? 24.126 77.525 40.387 1.00 39.59 ? 256 LYS C CA 1 ATOM 8513 C C . LYS C 1 197 ? 25.394 78.343 40.516 1.00 48.32 ? 256 LYS C C 1 ATOM 8514 O O . LYS C 1 197 ? 25.664 79.235 39.710 1.00 47.61 ? 256 LYS C O 1 ATOM 8515 C CB . LYS C 1 197 ? 23.048 78.152 41.275 1.00 44.46 ? 256 LYS C CB 1 ATOM 8516 C CG . LYS C 1 197 ? 22.430 79.414 40.702 1.00 55.38 ? 256 LYS C CG 1 ATOM 8517 C CD . LYS C 1 197 ? 21.252 79.865 41.548 1.00 51.22 ? 256 LYS C CD 1 ATOM 8518 C CE . LYS C 1 197 ? 20.260 80.672 40.723 1.00 54.91 ? 256 LYS C CE 1 ATOM 8519 N NZ . LYS C 1 197 ? 19.209 81.333 41.550 1.00 74.80 ? 256 LYS C NZ 1 ATOM 8520 N N . LYS C 1 198 ? 26.163 78.035 41.551 1.00 43.62 ? 257 LYS C N 1 ATOM 8521 C CA . LYS C 1 198 ? 27.352 78.804 41.870 1.00 36.35 ? 257 LYS C CA 1 ATOM 8522 C C . LYS C 1 198 ? 28.512 78.535 40.919 1.00 41.21 ? 257 LYS C C 1 ATOM 8523 O O . LYS C 1 198 ? 29.494 79.273 40.919 1.00 40.77 ? 257 LYS C O 1 ATOM 8524 C CB . LYS C 1 198 ? 27.782 78.539 43.316 1.00 40.09 ? 257 LYS C CB 1 ATOM 8525 C CG . LYS C 1 198 ? 28.122 77.096 43.635 1.00 65.66 ? 257 LYS C CG 1 ATOM 8526 C CD . LYS C 1 198 ? 28.579 76.958 45.083 1.00 83.87 ? 257 LYS C CD 1 ATOM 8527 C CE . LYS C 1 198 ? 29.439 75.719 45.282 1.00 90.34 ? 257 LYS C CE 1 ATOM 8528 N NZ . LYS C 1 198 ? 29.916 75.603 46.689 1.00 91.44 ? 257 LYS C NZ 1 ATOM 8529 N N . THR C 1 199 ? 28.401 77.486 40.110 1.00 48.02 ? 258 THR C N 1 ATOM 8530 C CA . THR C 1 199 ? 29.473 77.133 39.187 1.00 41.65 ? 258 THR C CA 1 ATOM 8531 C C . THR C 1 199 ? 29.301 77.842 37.848 1.00 43.32 ? 258 THR C C 1 ATOM 8532 O O . THR C 1 199 ? 30.011 77.550 36.887 1.00 39.87 ? 258 THR C O 1 ATOM 8533 C CB . THR C 1 199 ? 29.542 75.612 38.942 1.00 39.77 ? 258 THR C CB 1 ATOM 8534 O OG1 . THR C 1 199 ? 28.391 75.190 38.199 1.00 34.95 ? 258 THR C OG1 1 ATOM 8535 C CG2 . THR C 1 199 ? 29.594 74.859 40.261 1.00 28.16 ? 258 THR C CG2 1 ATOM 8536 N N . PHE C 1 200 ? 28.360 78.778 37.795 1.00 40.84 ? 259 PHE C N 1 ATOM 8537 C CA . PHE C 1 200 ? 28.122 79.560 36.588 1.00 33.64 ? 259 PHE C CA 1 ATOM 8538 C C . PHE C 1 200 ? 28.982 80.819 36.573 1.00 39.49 ? 259 PHE C C 1 ATOM 8539 O O . PHE C 1 200 ? 29.311 81.366 37.626 1.00 42.86 ? 259 PHE C O 1 ATOM 8540 C CB . PHE C 1 200 ? 26.643 79.936 36.474 1.00 34.31 ? 259 PHE C CB 1 ATOM 8541 C CG . PHE C 1 200 ? 25.778 78.845 35.908 1.00 28.38 ? 259 PHE C CG 1 ATOM 8542 C CD1 . PHE C 1 200 ? 25.396 77.767 36.690 1.00 28.52 ? 259 PHE C CD1 1 ATOM 8543 C CD2 . PHE C 1 200 ? 25.335 78.905 34.597 1.00 31.30 ? 259 PHE C CD2 1 ATOM 8544 C CE1 . PHE C 1 200 ? 24.595 76.766 36.171 1.00 41.52 ? 259 PHE C CE1 1 ATOM 8545 C CE2 . PHE C 1 200 ? 24.533 77.909 34.073 1.00 43.08 ? 259 PHE C CE2 1 ATOM 8546 C CZ . PHE C 1 200 ? 24.162 76.838 34.860 1.00 28.86 ? 259 PHE C CZ 1 ATOM 8547 N N . PHE C 1 201 ? 29.340 81.273 35.376 1.00 40.90 ? 260 PHE C N 1 ATOM 8548 C CA . PHE C 1 201 ? 30.153 82.475 35.220 1.00 37.61 ? 260 PHE C CA 1 ATOM 8549 C C . PHE C 1 201 ? 30.120 82.972 33.780 1.00 28.66 ? 260 PHE C C 1 ATOM 8550 O O . PHE C 1 201 ? 29.571 82.314 32.897 1.00 34.28 ? 260 PHE C O 1 ATOM 8551 C CB . PHE C 1 201 ? 31.604 82.215 35.644 1.00 27.36 ? 260 PHE C CB 1 ATOM 8552 C CG . PHE C 1 201 ? 32.345 81.271 34.736 1.00 40.35 ? 260 PHE C CG 1 ATOM 8553 C CD1 . PHE C 1 201 ? 32.224 79.899 34.889 1.00 27.54 ? 260 PHE C CD1 1 ATOM 8554 C CD2 . PHE C 1 201 ? 33.172 81.757 33.735 1.00 33.46 ? 260 PHE C CD2 1 ATOM 8555 C CE1 . PHE C 1 201 ? 32.907 79.033 34.056 1.00 27.58 ? 260 PHE C CE1 1 ATOM 8556 C CE2 . PHE C 1 201 ? 33.856 80.894 32.900 1.00 33.47 ? 260 PHE C CE2 1 ATOM 8557 C CZ . PHE C 1 201 ? 33.724 79.530 33.062 1.00 33.75 ? 260 PHE C CZ 1 ATOM 8558 N N . PHE C 1 202 ? 30.713 84.139 33.552 1.00 34.51 ? 261 PHE C N 1 ATOM 8559 C CA . PHE C 1 202 ? 30.838 84.682 32.207 1.00 34.60 ? 261 PHE C CA 1 ATOM 8560 C C . PHE C 1 202 ? 32.281 84.598 31.729 1.00 32.28 ? 261 PHE C C 1 ATOM 8561 O O . PHE C 1 202 ? 33.207 84.984 32.442 1.00 34.95 ? 261 PHE C O 1 ATOM 8562 C CB . PHE C 1 202 ? 30.355 86.133 32.153 1.00 27.25 ? 261 PHE C CB 1 ATOM 8563 C CG . PHE C 1 202 ? 28.864 86.284 32.241 1.00 31.22 ? 261 PHE C CG 1 ATOM 8564 C CD1 . PHE C 1 202 ? 28.245 86.504 33.460 1.00 29.06 ? 261 PHE C CD1 1 ATOM 8565 C CD2 . PHE C 1 202 ? 28.081 86.213 31.100 1.00 36.11 ? 261 PHE C CD2 1 ATOM 8566 C CE1 . PHE C 1 202 ? 26.871 86.648 33.540 1.00 35.85 ? 261 PHE C CE1 1 ATOM 8567 C CE2 . PHE C 1 202 ? 26.707 86.356 31.173 1.00 28.78 ? 261 PHE C CE2 1 ATOM 8568 C CZ . PHE C 1 202 ? 26.102 86.573 32.395 1.00 27.63 ? 261 PHE C CZ 1 ATOM 8569 N N . SER C 1 203 ? 32.465 84.083 30.519 1.00 35.45 ? 262 SER C N 1 ATOM 8570 C CA . SER C 1 203 ? 33.786 83.997 29.915 1.00 34.73 ? 262 SER C CA 1 ATOM 8571 C C . SER C 1 203 ? 34.267 85.399 29.540 1.00 35.09 ? 262 SER C C 1 ATOM 8572 O O . SER C 1 203 ? 33.467 86.334 29.508 1.00 37.20 ? 262 SER C O 1 ATOM 8573 C CB . SER C 1 203 ? 33.747 83.081 28.687 1.00 32.50 ? 262 SER C CB 1 ATOM 8574 O OG . SER C 1 203 ? 33.295 83.778 27.540 1.00 38.04 ? 262 SER C OG 1 ATOM 8575 N N . PRO C 1 204 ? 35.576 85.559 29.271 1.00 49.46 ? 263 PRO C N 1 ATOM 8576 C CA . PRO C 1 204 ? 36.068 86.861 28.800 1.00 42.31 ? 263 PRO C CA 1 ATOM 8577 C C . PRO C 1 204 ? 35.389 87.304 27.503 1.00 39.03 ? 263 PRO C C 1 ATOM 8578 O O . PRO C 1 204 ? 35.383 88.494 27.189 1.00 50.84 ? 263 PRO C O 1 ATOM 8579 C CB . PRO C 1 204 ? 37.570 86.619 28.583 1.00 28.87 ? 263 PRO C CB 1 ATOM 8580 C CG . PRO C 1 204 ? 37.737 85.130 28.569 1.00 37.96 ? 263 PRO C CG 1 ATOM 8581 C CD . PRO C 1 204 ? 36.681 84.608 29.483 1.00 35.97 ? 263 PRO C CD 1 ATOM 8582 N N . ALA C 1 205 ? 34.822 86.350 26.767 1.00 40.35 ? 264 ALA C N 1 ATOM 8583 C CA . ALA C 1 205 ? 34.102 86.645 25.533 1.00 27.13 ? 264 ALA C CA 1 ATOM 8584 C C . ALA C 1 205 ? 32.637 86.961 25.817 1.00 33.56 ? 264 ALA C C 1 ATOM 8585 O O . ALA C 1 205 ? 31.830 87.083 24.894 1.00 42.17 ? 264 ALA C O 1 ATOM 8586 C CB . ALA C 1 205 ? 34.214 85.483 24.563 1.00 29.15 ? 264 ALA C CB 1 ATOM 8587 N N . LYS C 1 206 ? 32.312 87.063 27.105 1.00 31.77 ? 265 LYS C N 1 ATOM 8588 C CA . LYS C 1 206 ? 30.983 87.434 27.597 1.00 51.77 ? 265 LYS C CA 1 ATOM 8589 C C . LYS C 1 206 ? 29.939 86.358 27.302 1.00 48.98 ? 265 LYS C C 1 ATOM 8590 O O . LYS C 1 206 ? 28.742 86.638 27.274 1.00 50.60 ? 265 LYS C O 1 ATOM 8591 C CB . LYS C 1 206 ? 30.529 88.749 26.972 1.00 40.43 ? 265 LYS C CB 1 ATOM 8592 C CG . LYS C 1 206 ? 31.303 89.973 27.404 1.00 43.51 ? 265 LYS C CG 1 ATOM 8593 C CD . LYS C 1 206 ? 30.476 91.218 27.204 1.00 50.96 ? 265 LYS C CD 1 ATOM 8594 C CE . LYS C 1 206 ? 31.378 92.342 26.743 1.00 75.56 ? 265 LYS C CE 1 ATOM 8595 N NZ . LYS C 1 206 ? 31.987 91.912 25.437 1.00 76.51 ? 265 LYS C NZ 1 ATOM 8596 N N . ASN C 1 207 ? 30.395 85.133 27.069 1.00 36.27 ? 266 ASN C N 1 ATOM 8597 C CA . ASN C 1 207 ? 29.493 84.000 26.923 1.00 34.46 ? 266 ASN C CA 1 ATOM 8598 C C . ASN C 1 207 ? 29.131 83.419 28.284 1.00 29.72 ? 266 ASN C C 1 ATOM 8599 O O . ASN C 1 207 ? 29.940 83.450 29.211 1.00 39.81 ? 266 ASN C O 1 ATOM 8600 C CB . ASN C 1 207 ? 30.117 82.923 26.036 1.00 27.85 ? 266 ASN C CB 1 ATOM 8601 C CG . ASN C 1 207 ? 30.312 83.386 24.606 1.00 39.92 ? 266 ASN C CG 1 ATOM 8602 O OD1 . ASN C 1 207 ? 29.447 84.047 24.031 1.00 28.69 ? 266 ASN C OD1 1 ATOM 8603 N ND2 . ASN C 1 207 ? 31.455 83.041 24.022 1.00 34.20 ? 266 ASN C ND2 1 ATOM 8604 N N . PHE C 1 208 ? 27.916 82.898 28.409 1.00 34.71 ? 267 PHE C N 1 ATOM 8605 C CA . PHE C 1 208 ? 27.483 82.313 29.671 1.00 28.05 ? 267 PHE C CA 1 ATOM 8606 C C . PHE C 1 208 ? 28.023 80.894 29.784 1.00 34.14 ? 267 PHE C C 1 ATOM 8607 O O . PHE C 1 208 ? 27.923 80.105 28.844 1.00 29.28 ? 267 PHE C O 1 ATOM 8608 C CB . PHE C 1 208 ? 25.958 82.318 29.788 1.00 37.80 ? 267 PHE C CB 1 ATOM 8609 C CG . PHE C 1 208 ? 25.462 82.261 31.203 1.00 43.42 ? 267 PHE C CG 1 ATOM 8610 C CD1 . PHE C 1 208 ? 26.223 82.782 32.237 1.00 42.86 ? 267 PHE C CD1 1 ATOM 8611 C CD2 . PHE C 1 208 ? 24.240 81.684 31.502 1.00 32.69 ? 267 PHE C CD2 1 ATOM 8612 C CE1 . PHE C 1 208 ? 25.773 82.732 33.543 1.00 30.39 ? 267 PHE C CE1 1 ATOM 8613 C CE2 . PHE C 1 208 ? 23.785 81.630 32.807 1.00 30.40 ? 267 PHE C CE2 1 ATOM 8614 C CZ . PHE C 1 208 ? 24.553 82.156 33.828 1.00 36.16 ? 267 PHE C CZ 1 ATOM 8615 N N . CYS C 1 209 ? 28.601 80.573 30.935 1.00 28.60 ? 268 CYS C N 1 ATOM 8616 C CA . CYS C 1 209 ? 29.291 79.301 31.103 1.00 43.94 ? 268 CYS C CA 1 ATOM 8617 C C . CYS C 1 209 ? 29.005 78.683 32.465 1.00 39.56 ? 268 CYS C C 1 ATOM 8618 O O . CYS C 1 209 ? 28.742 79.395 33.434 1.00 34.77 ? 268 CYS C O 1 ATOM 8619 C CB . CYS C 1 209 ? 30.802 79.484 30.931 1.00 31.94 ? 268 CYS C CB 1 ATOM 8620 S SG . CYS C 1 209 ? 31.327 80.148 29.330 1.00 27.84 ? 268 CYS C SG 1 ATOM 8621 N N . PHE C 1 210 ? 29.055 77.356 32.535 1.00 35.47 ? 269 PHE C N 1 ATOM 8622 C CA . PHE C 1 210 ? 28.984 76.665 33.816 1.00 39.41 ? 269 PHE C CA 1 ATOM 8623 C C . PHE C 1 210 ? 30.034 75.562 33.892 1.00 34.75 ? 269 PHE C C 1 ATOM 8624 O O . PHE C 1 210 ? 30.355 74.918 32.893 1.00 32.04 ? 269 PHE C O 1 ATOM 8625 C CB . PHE C 1 210 ? 27.574 76.103 34.066 1.00 28.52 ? 269 PHE C CB 1 ATOM 8626 C CG . PHE C 1 210 ? 27.123 75.075 33.059 1.00 33.95 ? 269 PHE C CG 1 ATOM 8627 C CD1 . PHE C 1 210 ? 27.488 73.742 33.185 1.00 30.33 ? 269 PHE C CD1 1 ATOM 8628 C CD2 . PHE C 1 210 ? 26.307 75.441 32.000 1.00 31.13 ? 269 PHE C CD2 1 ATOM 8629 C CE1 . PHE C 1 210 ? 27.065 72.801 32.265 1.00 34.42 ? 269 PHE C CE1 1 ATOM 8630 C CE2 . PHE C 1 210 ? 25.880 74.503 31.077 1.00 33.56 ? 269 PHE C CE2 1 ATOM 8631 C CZ . PHE C 1 210 ? 26.257 73.182 31.211 1.00 29.11 ? 269 PHE C CZ 1 ATOM 8632 N N . VAL C 1 211 ? 30.569 75.358 35.091 1.00 44.42 ? 270 VAL C N 1 ATOM 8633 C CA . VAL C 1 211 ? 31.595 74.352 35.320 1.00 28.13 ? 270 VAL C CA 1 ATOM 8634 C C . VAL C 1 211 ? 30.999 73.033 35.800 1.00 32.92 ? 270 VAL C C 1 ATOM 8635 O O . VAL C 1 211 ? 31.441 71.956 35.393 1.00 43.24 ? 270 VAL C O 1 ATOM 8636 C CB . VAL C 1 211 ? 32.624 74.849 36.359 1.00 51.57 ? 270 VAL C CB 1 ATOM 8637 C CG1 . VAL C 1 211 ? 33.579 73.740 36.759 1.00 27.88 ? 270 VAL C CG1 1 ATOM 8638 C CG2 . VAL C 1 211 ? 33.381 76.054 35.825 1.00 27.73 ? 270 VAL C CG2 1 ATOM 8639 N N . SER C 1 212 ? 29.984 73.138 36.654 1.00 30.07 ? 271 SER C N 1 ATOM 8640 C CA . SER C 1 212 ? 29.384 71.990 37.330 1.00 28.59 ? 271 SER C CA 1 ATOM 8641 C C . SER C 1 212 ? 30.443 71.259 38.152 1.00 41.35 ? 271 SER C C 1 ATOM 8642 O O . SER C 1 212 ? 31.531 71.785 38.391 1.00 42.84 ? 271 SER C O 1 ATOM 8643 C CB . SER C 1 212 ? 28.725 71.037 36.326 1.00 28.81 ? 271 SER C CB 1 ATOM 8644 O OG . SER C 1 212 ? 28.027 69.994 36.984 1.00 35.49 ? 271 SER C OG 1 ATOM 8645 N N . ARG C 1 213 ? 30.120 70.053 38.598 1.00 40.35 ? 272 ARG C N 1 ATOM 8646 C CA . ARG C 1 213 ? 31.087 69.234 39.319 1.00 39.96 ? 272 ARG C CA 1 ATOM 8647 C C . ARG C 1 213 ? 30.996 67.772 38.911 1.00 36.19 ? 272 ARG C C 1 ATOM 8648 O O . ARG C 1 213 ? 29.922 67.169 38.937 1.00 62.69 ? 272 ARG C O 1 ATOM 8649 C CB . ARG C 1 213 ? 30.901 69.378 40.827 1.00 39.06 ? 272 ARG C CB 1 ATOM 8650 C CG . ARG C 1 213 ? 29.466 69.511 41.250 1.00 65.88 ? 272 ARG C CG 1 ATOM 8651 C CD . ARG C 1 213 ? 29.345 69.585 42.748 1.00 88.67 ? 272 ARG C CD 1 ATOM 8652 N NE . ARG C 1 213 ? 30.230 70.593 43.317 1.00 97.34 ? 272 ARG C NE 1 ATOM 8653 C CZ . ARG C 1 213 ? 30.355 70.804 44.620 1.00 96.40 ? 272 ARG C CZ 1 ATOM 8654 N NH1 . ARG C 1 213 ? 29.645 70.073 45.465 1.00 100.45 ? 272 ARG C NH1 1 ATOM 8655 N NH2 . ARG C 1 213 ? 31.180 71.737 45.077 1.00 88.16 ? 272 ARG C NH2 1 ATOM 8656 N N . CYS C 1 214 ? 32.139 67.212 38.535 1.00 46.31 ? 273 CYS C N 1 ATOM 8657 C CA . CYS C 1 214 ? 32.232 65.814 38.146 1.00 41.66 ? 273 CYS C CA 1 ATOM 8658 C C . CYS C 1 214 ? 33.697 65.406 38.136 1.00 36.52 ? 273 CYS C C 1 ATOM 8659 O O . CYS C 1 214 ? 34.580 66.242 38.330 1.00 48.81 ? 273 CYS C O 1 ATOM 8660 C CB . CYS C 1 214 ? 31.590 65.582 36.775 1.00 30.90 ? 273 CYS C CB 1 ATOM 8661 S SG . CYS C 1 214 ? 32.530 66.235 35.374 1.00 39.93 ? 273 CYS C SG 1 ATOM 8662 N N . ASP C 1 215 ? 33.957 64.125 37.908 1.00 47.60 ? 274 ASP C N 1 ATOM 8663 C CA . ASP C 1 215 ? 35.320 63.617 37.960 1.00 54.28 ? 274 ASP C CA 1 ATOM 8664 C C . ASP C 1 215 ? 36.104 63.943 36.696 1.00 37.34 ? 274 ASP C C 1 ATOM 8665 O O . ASP C 1 215 ? 37.317 64.143 36.748 1.00 47.69 ? 274 ASP C O 1 ATOM 8666 C CB . ASP C 1 215 ? 35.319 62.106 38.199 1.00 63.63 ? 274 ASP C CB 1 ATOM 8667 C CG . ASP C 1 215 ? 34.785 61.733 39.567 1.00 76.20 ? 274 ASP C CG 1 ATOM 8668 O OD1 . ASP C 1 215 ? 34.875 62.570 40.490 1.00 58.37 ? 274 ASP C OD1 1 ATOM 8669 O OD2 . ASP C 1 215 ? 34.278 60.602 39.723 1.00 87.08 ? 274 ASP C OD2 1 ATOM 8670 N N . TYR C 1 216 ? 35.417 64.004 35.561 1.00 38.61 ? 275 TYR C N 1 ATOM 8671 C CA . TYR C 1 216 ? 36.116 64.138 34.292 1.00 36.23 ? 275 TYR C CA 1 ATOM 8672 C C . TYR C 1 216 ? 36.042 65.556 33.735 1.00 39.19 ? 275 TYR C C 1 ATOM 8673 O O . TYR C 1 216 ? 35.155 65.885 32.945 1.00 41.98 ? 275 TYR C O 1 ATOM 8674 C CB . TYR C 1 216 ? 35.563 63.146 33.266 1.00 50.93 ? 275 TYR C CB 1 ATOM 8675 C CG . TYR C 1 216 ? 36.464 62.972 32.065 1.00 71.59 ? 275 TYR C CG 1 ATOM 8676 C CD1 . TYR C 1 216 ? 37.551 62.109 32.111 1.00 75.21 ? 275 TYR C CD1 1 ATOM 8677 C CD2 . TYR C 1 216 ? 36.236 63.677 30.891 1.00 82.83 ? 275 TYR C CD2 1 ATOM 8678 C CE1 . TYR C 1 216 ? 38.381 61.949 31.020 1.00 77.23 ? 275 TYR C CE1 1 ATOM 8679 C CE2 . TYR C 1 216 ? 37.059 63.520 29.793 1.00 70.38 ? 275 TYR C CE2 1 ATOM 8680 C CZ . TYR C 1 216 ? 38.131 62.658 29.865 1.00 72.71 ? 275 TYR C CZ 1 ATOM 8681 O OH . TYR C 1 216 ? 38.956 62.502 28.778 1.00 79.39 ? 275 TYR C OH 1 ATOM 8682 N N . TYR C 1 217 ? 36.982 66.388 34.175 1.00 46.78 ? 276 TYR C N 1 ATOM 8683 C CA . TYR C 1 217 ? 37.213 67.716 33.610 1.00 32.67 ? 276 TYR C CA 1 ATOM 8684 C C . TYR C 1 217 ? 36.032 68.675 33.727 1.00 46.71 ? 276 TYR C C 1 ATOM 8685 O O . TYR C 1 217 ? 35.797 69.487 32.832 1.00 28.10 ? 276 TYR C O 1 ATOM 8686 C CB . TYR C 1 217 ? 37.632 67.592 32.146 1.00 30.09 ? 276 TYR C CB 1 ATOM 8687 C CG . TYR C 1 217 ? 38.969 66.913 31.979 1.00 52.32 ? 276 TYR C CG 1 ATOM 8688 C CD1 . TYR C 1 217 ? 39.066 65.668 31.375 1.00 28.01 ? 276 TYR C CD1 1 ATOM 8689 C CD2 . TYR C 1 217 ? 40.131 67.506 32.450 1.00 27.70 ? 276 TYR C CD2 1 ATOM 8690 C CE1 . TYR C 1 217 ? 40.283 65.039 31.227 1.00 52.65 ? 276 TYR C CE1 1 ATOM 8691 C CE2 . TYR C 1 217 ? 41.356 66.883 32.310 1.00 44.86 ? 276 TYR C CE2 1 ATOM 8692 C CZ . TYR C 1 217 ? 41.425 65.650 31.697 1.00 44.47 ? 276 TYR C CZ 1 ATOM 8693 O OH . TYR C 1 217 ? 42.641 65.023 31.553 1.00 57.26 ? 276 TYR C OH 1 ATOM 8694 N N . CYS C 1 218 ? 35.291 68.582 34.825 1.00 30.33 ? 277 CYS C N 1 ATOM 8695 C CA . CYS C 1 218 ? 34.391 69.664 35.199 1.00 31.56 ? 277 CYS C CA 1 ATOM 8696 C C . CYS C 1 218 ? 35.207 70.781 35.838 1.00 44.51 ? 277 CYS C C 1 ATOM 8697 O O . CYS C 1 218 ? 35.209 70.941 37.060 1.00 50.62 ? 277 CYS C O 1 ATOM 8698 C CB . CYS C 1 218 ? 33.304 69.179 36.160 1.00 33.87 ? 277 CYS C CB 1 ATOM 8699 S SG . CYS C 1 218 ? 32.001 68.196 35.391 1.00 30.16 ? 277 CYS C SG 1 ATOM 8700 N N . ASP C 1 219 ? 35.910 71.542 35.005 1.00 31.49 ? 278 ASP C N 1 ATOM 8701 C CA . ASP C 1 219 ? 36.718 72.662 35.477 1.00 36.19 ? 278 ASP C CA 1 ATOM 8702 C C . ASP C 1 219 ? 36.555 73.885 34.578 1.00 27.58 ? 278 ASP C C 1 ATOM 8703 O O . ASP C 1 219 ? 35.874 73.828 33.554 1.00 62.10 ? 278 ASP C O 1 ATOM 8704 C CB . ASP C 1 219 ? 38.191 72.255 35.574 1.00 27.48 ? 278 ASP C CB 1 ATOM 8705 C CG . ASP C 1 219 ? 38.707 71.601 34.306 1.00 34.60 ? 278 ASP C CG 1 ATOM 8706 O OD1 . ASP C 1 219 ? 38.335 72.044 33.200 1.00 40.78 ? 278 ASP C OD1 1 ATOM 8707 O OD2 . ASP C 1 219 ? 39.493 70.638 34.417 1.00 43.50 ? 278 ASP C OD2 1 ATOM 8708 N N . THR C 1 220 ? 37.188 74.986 34.973 1.00 42.10 ? 279 THR C N 1 ATOM 8709 C CA . THR C 1 220 ? 37.078 76.254 34.258 1.00 37.62 ? 279 THR C CA 1 ATOM 8710 C C . THR C 1 220 ? 37.515 76.143 32.799 1.00 42.03 ? 279 THR C C 1 ATOM 8711 O O . THR C 1 220 ? 36.843 76.650 31.900 1.00 56.69 ? 279 THR C O 1 ATOM 8712 C CB . THR C 1 220 ? 37.916 77.350 34.942 1.00 30.76 ? 279 THR C CB 1 ATOM 8713 O OG1 . THR C 1 220 ? 37.533 77.461 36.318 1.00 35.84 ? 279 THR C OG1 1 ATOM 8714 C CG2 . THR C 1 220 ? 37.712 78.691 34.251 1.00 27.08 ? 279 THR C CG2 1 ATOM 8715 N N . THR C 1 221 ? 38.645 75.479 32.573 1.00 31.63 ? 280 THR C N 1 ATOM 8716 C CA . THR C 1 221 ? 39.202 75.326 31.232 1.00 41.27 ? 280 THR C CA 1 ATOM 8717 C C . THR C 1 221 ? 38.245 74.589 30.296 1.00 37.70 ? 280 THR C C 1 ATOM 8718 O O . THR C 1 221 ? 38.125 74.930 29.118 1.00 32.13 ? 280 THR C O 1 ATOM 8719 C CB . THR C 1 221 ? 40.550 74.571 31.273 1.00 46.27 ? 280 THR C CB 1 ATOM 8720 O OG1 . THR C 1 221 ? 41.462 75.264 32.134 1.00 27.51 ? 280 THR C OG1 1 ATOM 8721 C CG2 . THR C 1 221 ? 41.156 74.462 29.881 1.00 27.17 ? 280 THR C CG2 1 ATOM 8722 N N . HIS C 1 222 ? 37.552 73.588 30.831 1.00 32.19 ? 281 HIS C N 1 ATOM 8723 C CA . HIS C 1 222 ? 36.654 72.765 30.027 1.00 28.46 ? 281 HIS C CA 1 ATOM 8724 C C . HIS C 1 222 ? 35.191 73.053 30.346 1.00 27.97 ? 281 HIS C C 1 ATOM 8725 O O . HIS C 1 222 ? 34.332 72.183 30.203 1.00 30.80 ? 281 HIS C O 1 ATOM 8726 C CB . HIS C 1 222 ? 36.954 71.281 30.248 1.00 27.89 ? 281 HIS C CB 1 ATOM 8727 C CG . HIS C 1 222 ? 38.369 70.900 29.944 1.00 40.86 ? 281 HIS C CG 1 ATOM 8728 N ND1 . HIS C 1 222 ? 39.384 71.010 30.870 1.00 39.93 ? 281 HIS C ND1 1 ATOM 8729 C CD2 . HIS C 1 222 ? 38.940 70.415 28.816 1.00 33.89 ? 281 HIS C CD2 1 ATOM 8730 C CE1 . HIS C 1 222 ? 40.519 70.607 30.327 1.00 37.27 ? 281 HIS C CE1 1 ATOM 8731 N NE2 . HIS C 1 222 ? 40.277 70.241 29.081 1.00 48.39 ? 281 HIS C NE2 1 ATOM 8732 N N . ALA C 1 223 ? 34.915 74.278 30.780 1.00 29.77 ? 282 ALA C N 1 ATOM 8733 C CA . ALA C 1 223 ? 33.552 74.696 31.086 1.00 35.92 ? 282 ALA C CA 1 ATOM 8734 C C . ALA C 1 223 ? 32.658 74.647 29.850 1.00 36.21 ? 282 ALA C C 1 ATOM 8735 O O . ALA C 1 223 ? 33.125 74.830 28.726 1.00 40.49 ? 282 ALA C O 1 ATOM 8736 C CB . ALA C 1 223 ? 33.552 76.095 31.681 1.00 35.31 ? 282 ALA C CB 1 ATOM 8737 N N . ILE C 1 224 ? 31.372 74.394 30.067 1.00 37.17 ? 283 ILE C N 1 ATOM 8738 C CA . ILE C 1 224 ? 30.399 74.415 28.985 1.00 28.51 ? 283 ILE C CA 1 ATOM 8739 C C . ILE C 1 224 ? 29.896 75.841 28.789 1.00 28.44 ? 283 ILE C C 1 ATOM 8740 O O . ILE C 1 224 ? 29.444 76.478 29.738 1.00 28.40 ? 283 ILE C O 1 ATOM 8741 C CB . ILE C 1 224 ? 29.212 73.477 29.273 1.00 32.70 ? 283 ILE C CB 1 ATOM 8742 C CG1 . ILE C 1 224 ? 29.681 72.021 29.339 1.00 28.83 ? 283 ILE C CG1 1 ATOM 8743 C CG2 . ILE C 1 224 ? 28.126 73.652 28.226 1.00 29.87 ? 283 ILE C CG2 1 ATOM 8744 C CD1 . ILE C 1 224 ? 30.262 71.503 28.042 1.00 34.95 ? 283 ILE C CD1 1 ATOM 8745 N N . CYS C 1 225 ? 29.976 76.340 27.560 1.00 37.38 ? 284 CYS C N 1 ATOM 8746 C CA . CYS C 1 225 ? 29.682 77.743 27.293 1.00 28.35 ? 284 CYS C CA 1 ATOM 8747 C C . CYS C 1 225 ? 28.710 77.923 26.135 1.00 37.45 ? 284 CYS C C 1 ATOM 8748 O O . CYS C 1 225 ? 28.792 77.223 25.126 1.00 31.18 ? 284 CYS C O 1 ATOM 8749 C CB . CYS C 1 225 ? 30.973 78.509 26.996 1.00 28.13 ? 284 CYS C CB 1 ATOM 8750 S SG . CYS C 1 225 ? 32.145 78.558 28.366 1.00 33.16 ? 284 CYS C SG 1 ATOM 8751 N N . GLY C 1 226 ? 27.798 78.877 26.284 1.00 28.51 ? 285 GLY C N 1 ATOM 8752 C CA . GLY C 1 226 ? 26.849 79.189 25.233 1.00 28.64 ? 285 GLY C CA 1 ATOM 8753 C C . GLY C 1 226 ? 27.424 80.222 24.288 1.00 39.82 ? 285 GLY C C 1 ATOM 8754 O O . GLY C 1 226 ? 28.587 80.604 24.414 1.00 34.00 ? 285 GLY C O 1 ATOM 8755 N N . LEU C 1 227 ? 26.619 80.670 23.331 1.00 28.60 ? 286 LEU C N 1 ATOM 8756 C CA . LEU C 1 227 ? 27.057 81.708 22.405 1.00 37.58 ? 286 LEU C CA 1 ATOM 8757 C C . LEU C 1 227 ? 25.964 82.743 22.119 1.00 28.61 ? 286 LEU C C 1 ATOM 8758 O O . LEU C 1 227 ? 25.457 82.815 21.001 1.00 35.36 ? 286 LEU C O 1 ATOM 8759 C CB . LEU C 1 227 ? 27.536 81.072 21.098 1.00 32.85 ? 286 LEU C CB 1 ATOM 8760 C CG . LEU C 1 227 ? 28.573 81.864 20.297 1.00 47.07 ? 286 LEU C CG 1 ATOM 8761 C CD1 . LEU C 1 227 ? 29.756 82.238 21.175 1.00 39.45 ? 286 LEU C CD1 1 ATOM 8762 C CD2 . LEU C 1 227 ? 29.041 81.065 19.093 1.00 40.38 ? 286 LEU C CD2 1 ATOM 8763 N N . PRO C 1 228 ? 25.610 83.563 23.123 1.00 28.42 ? 287 PRO C N 1 ATOM 8764 C CA . PRO C 1 228 ? 26.206 83.594 24.462 1.00 34.66 ? 287 PRO C CA 1 ATOM 8765 C C . PRO C 1 228 ? 25.416 82.827 25.526 1.00 34.56 ? 287 PRO C C 1 ATOM 8766 O O . PRO C 1 228 ? 26.014 82.377 26.503 1.00 40.36 ? 287 PRO C O 1 ATOM 8767 C CB . PRO C 1 228 ? 26.213 85.086 24.787 1.00 32.94 ? 287 PRO C CB 1 ATOM 8768 C CG . PRO C 1 228 ? 24.964 85.583 24.136 1.00 28.23 ? 287 PRO C CG 1 ATOM 8769 C CD . PRO C 1 228 ? 24.792 84.763 22.870 1.00 28.40 ? 287 PRO C CD 1 ATOM 8770 N N . ASP C 1 229 ? 24.106 82.675 25.345 1.00 33.45 ? 288 ASP C N 1 ATOM 8771 C CA . ASP C 1 229 ? 23.253 82.194 26.431 1.00 39.57 ? 288 ASP C CA 1 ATOM 8772 C C . ASP C 1 229 ? 22.357 81.015 26.055 1.00 32.12 ? 288 ASP C C 1 ATOM 8773 O O . ASP C 1 229 ? 21.442 80.669 26.802 1.00 41.05 ? 288 ASP C O 1 ATOM 8774 C CB . ASP C 1 229 ? 22.382 83.339 26.956 1.00 28.66 ? 288 ASP C CB 1 ATOM 8775 C CG . ASP C 1 229 ? 21.478 83.922 25.888 1.00 33.88 ? 288 ASP C CG 1 ATOM 8776 O OD1 . ASP C 1 229 ? 21.797 83.775 24.690 1.00 45.29 ? 288 ASP C OD1 1 ATOM 8777 O OD2 . ASP C 1 229 ? 20.444 84.525 26.247 1.00 44.14 ? 288 ASP C OD2 1 HETATM 8778 N N . MSE C 1 230 ? 22.611 80.399 24.907 1.00 34.38 ? 289 MSE C N 1 HETATM 8779 C CA . MSE C 1 230 ? 21.873 79.196 24.538 1.00 31.17 ? 289 MSE C CA 1 HETATM 8780 C C . MSE C 1 230 ? 22.816 78.000 24.488 1.00 35.12 ? 289 MSE C C 1 HETATM 8781 O O . MSE C 1 230 ? 23.997 78.139 24.170 1.00 47.98 ? 289 MSE C O 1 HETATM 8782 C CB . MSE C 1 230 ? 21.152 79.374 23.197 1.00 29.45 ? 289 MSE C CB 1 HETATM 8783 C CG . MSE C 1 230 ? 22.019 79.162 21.967 1.00 61.27 ? 289 MSE C CG 1 HETATM 8784 SE SE . MSE C 1 230 ? 23.417 80.500 21.792 1.00 63.54 ? 289 MSE C SE 1 HETATM 8785 C CE . MSE C 1 230 ? 22.300 82.098 21.803 1.00 36.59 ? 289 MSE C CE 1 ATOM 8786 N N . LYS C 1 231 ? 22.290 76.827 24.818 1.00 45.80 ? 290 LYS C N 1 ATOM 8787 C CA . LYS C 1 231 ? 23.092 75.613 24.836 1.00 29.55 ? 290 LYS C CA 1 ATOM 8788 C C . LYS C 1 231 ? 22.267 74.393 24.460 1.00 33.38 ? 290 LYS C C 1 ATOM 8789 O O . LYS C 1 231 ? 21.364 73.990 25.192 1.00 29.97 ? 290 LYS C O 1 ATOM 8790 C CB . LYS C 1 231 ? 23.731 75.413 26.213 1.00 30.11 ? 290 LYS C CB 1 ATOM 8791 C CG . LYS C 1 231 ? 24.467 74.089 26.385 1.00 29.46 ? 290 LYS C CG 1 ATOM 8792 C CD . LYS C 1 231 ? 25.535 73.870 25.318 1.00 42.68 ? 290 LYS C CD 1 ATOM 8793 C CE . LYS C 1 231 ? 26.558 74.993 25.299 1.00 31.09 ? 290 LYS C CE 1 ATOM 8794 N NZ . LYS C 1 231 ? 27.728 74.662 24.440 1.00 29.02 ? 290 LYS C NZ 1 ATOM 8795 N N . GLU C 1 232 ? 22.588 73.810 23.310 1.00 46.05 ? 291 GLU C N 1 ATOM 8796 C CA . GLU C 1 232 ? 21.953 72.577 22.874 1.00 32.25 ? 291 GLU C CA 1 ATOM 8797 C C . GLU C 1 232 ? 22.423 71.435 23.764 1.00 32.21 ? 291 GLU C C 1 ATOM 8798 O O . GLU C 1 232 ? 23.511 71.492 24.334 1.00 49.70 ? 291 GLU C O 1 ATOM 8799 C CB . GLU C 1 232 ? 22.276 72.289 21.404 1.00 33.96 ? 291 GLU C CB 1 ATOM 8800 C CG . GLU C 1 232 ? 21.657 71.009 20.855 1.00 30.46 ? 291 GLU C CG 1 ATOM 8801 C CD . GLU C 1 232 ? 21.973 70.785 19.390 1.00 40.81 ? 291 GLU C CD 1 ATOM 8802 O OE1 . GLU C 1 232 ? 21.777 71.721 18.589 1.00 51.47 ? 291 GLU C OE1 1 ATOM 8803 O OE2 . GLU C 1 232 ? 22.421 69.673 19.040 1.00 33.79 ? 291 GLU C OE2 1 ATOM 8804 N N . GLY C 1 233 ? 21.594 70.409 23.901 1.00 41.22 ? 292 GLY C N 1 ATOM 8805 C CA . GLY C 1 233 ? 21.985 69.224 24.633 1.00 44.33 ? 292 GLY C CA 1 ATOM 8806 C C . GLY C 1 233 ? 21.122 68.036 24.277 1.00 30.76 ? 292 GLY C C 1 ATOM 8807 O O . GLY C 1 233 ? 20.118 68.172 23.579 1.00 37.50 ? 292 GLY C O 1 ATOM 8808 N N . SER C 1 234 ? 21.517 66.862 24.752 1.00 39.54 ? 293 SER C N 1 ATOM 8809 C CA . SER C 1 234 ? 20.706 65.671 24.567 1.00 31.10 ? 293 SER C CA 1 ATOM 8810 C C . SER C 1 234 ? 19.786 65.500 25.767 1.00 31.23 ? 293 SER C C 1 ATOM 8811 O O . SER C 1 234 ? 20.198 65.699 26.910 1.00 31.09 ? 293 SER C O 1 ATOM 8812 C CB . SER C 1 234 ? 21.586 64.433 24.379 1.00 31.10 ? 293 SER C CB 1 ATOM 8813 O OG . SER C 1 234 ? 22.237 64.082 25.587 1.00 40.45 ? 293 SER C OG 1 ATOM 8814 N N . VAL C 1 235 ? 18.535 65.145 25.500 1.00 31.51 ? 294 VAL C N 1 ATOM 8815 C CA . VAL C 1 235 ? 17.559 64.949 26.560 1.00 31.67 ? 294 VAL C CA 1 ATOM 8816 C C . VAL C 1 235 ? 16.997 63.540 26.474 1.00 34.09 ? 294 VAL C C 1 ATOM 8817 O O . VAL C 1 235 ? 16.313 63.185 25.514 1.00 32.16 ? 294 VAL C O 1 ATOM 8818 C CB . VAL C 1 235 ? 16.413 65.975 26.485 1.00 44.40 ? 294 VAL C CB 1 ATOM 8819 C CG1 . VAL C 1 235 ? 15.371 65.682 27.553 1.00 40.85 ? 294 VAL C CG1 1 ATOM 8820 C CG2 . VAL C 1 235 ? 16.956 67.387 26.638 1.00 31.45 ? 294 VAL C CG2 1 ATOM 8821 N N . GLN C 1 236 ? 17.295 62.741 27.490 1.00 31.96 ? 295 GLN C N 1 ATOM 8822 C CA . GLN C 1 236 ? 16.951 61.328 27.490 1.00 48.77 ? 295 GLN C CA 1 ATOM 8823 C C . GLN C 1 236 ? 15.992 61.013 28.625 1.00 51.67 ? 295 GLN C C 1 ATOM 8824 O O . GLN C 1 236 ? 16.252 61.368 29.773 1.00 41.85 ? 295 GLN C O 1 ATOM 8825 C CB . GLN C 1 236 ? 18.216 60.477 27.617 1.00 32.08 ? 295 GLN C CB 1 ATOM 8826 C CG . GLN C 1 236 ? 17.952 58.989 27.738 1.00 40.77 ? 295 GLN C CG 1 ATOM 8827 C CD . GLN C 1 236 ? 19.228 58.171 27.752 1.00 40.91 ? 295 GLN C CD 1 ATOM 8828 O OE1 . GLN C 1 236 ? 19.704 57.761 28.810 1.00 40.84 ? 295 GLN C OE1 1 ATOM 8829 N NE2 . GLN C 1 236 ? 19.789 57.928 26.573 1.00 43.57 ? 295 GLN C NE2 1 ATOM 8830 N N . VAL C 1 237 ? 14.885 60.351 28.299 1.00 32.72 ? 296 VAL C N 1 ATOM 8831 C CA . VAL C 1 237 ? 13.889 59.999 29.303 1.00 39.55 ? 296 VAL C CA 1 ATOM 8832 C C . VAL C 1 237 ? 14.521 59.150 30.403 1.00 42.29 ? 296 VAL C C 1 ATOM 8833 O O . VAL C 1 237 ? 15.313 58.245 30.134 1.00 42.52 ? 296 VAL C O 1 ATOM 8834 C CB . VAL C 1 237 ? 12.688 59.249 28.676 1.00 51.82 ? 296 VAL C CB 1 ATOM 8835 C CG1 . VAL C 1 237 ? 13.137 57.952 28.015 1.00 33.71 ? 296 VAL C CG1 1 ATOM 8836 C CG2 . VAL C 1 237 ? 11.612 58.985 29.719 1.00 33.52 ? 296 VAL C CG2 1 ATOM 8837 N N . PHE C 1 238 ? 14.196 59.477 31.648 1.00 51.48 ? 297 PHE C N 1 ATOM 8838 C CA . PHE C 1 238 ? 14.697 58.725 32.789 1.00 40.81 ? 297 PHE C CA 1 ATOM 8839 C C . PHE C 1 238 ? 14.222 57.280 32.735 1.00 39.73 ? 297 PHE C C 1 ATOM 8840 O O . PHE C 1 238 ? 13.099 57.003 32.317 1.00 50.69 ? 297 PHE C O 1 ATOM 8841 C CB . PHE C 1 238 ? 14.251 59.381 34.096 1.00 33.44 ? 297 PHE C CB 1 ATOM 8842 C CG . PHE C 1 238 ? 15.387 59.755 35.003 1.00 44.24 ? 297 PHE C CG 1 ATOM 8843 C CD1 . PHE C 1 238 ? 16.254 60.779 34.660 1.00 43.23 ? 297 PHE C CD1 1 ATOM 8844 C CD2 . PHE C 1 238 ? 15.583 59.089 36.200 1.00 35.07 ? 297 PHE C CD2 1 ATOM 8845 C CE1 . PHE C 1 238 ? 17.300 61.127 35.492 1.00 41.75 ? 297 PHE C CE1 1 ATOM 8846 C CE2 . PHE C 1 238 ? 16.627 59.433 37.037 1.00 43.12 ? 297 PHE C CE2 1 ATOM 8847 C CZ . PHE C 1 238 ? 17.487 60.454 36.683 1.00 34.22 ? 297 PHE C CZ 1 ATOM 8848 N N . LEU C 1 239 ? 15.086 56.359 33.148 1.00 44.87 ? 298 LEU C N 1 ATOM 8849 C CA . LEU C 1 239 ? 14.679 54.973 33.324 1.00 53.40 ? 298 LEU C CA 1 ATOM 8850 C C . LEU C 1 239 ? 13.712 54.881 34.496 1.00 40.92 ? 298 LEU C C 1 ATOM 8851 O O . LEU C 1 239 ? 13.777 55.698 35.414 1.00 46.91 ? 298 LEU C O 1 ATOM 8852 C CB . LEU C 1 239 ? 15.899 54.077 33.553 1.00 50.60 ? 298 LEU C CB 1 ATOM 8853 C CG . LEU C 1 239 ? 16.722 53.744 32.307 1.00 51.83 ? 298 LEU C CG 1 ATOM 8854 C CD1 . LEU C 1 239 ? 17.998 53.011 32.686 1.00 45.50 ? 298 LEU C CD1 1 ATOM 8855 C CD2 . LEU C 1 239 ? 15.893 52.920 31.334 1.00 48.31 ? 298 LEU C CD2 1 ATOM 8856 N N . PRO C 1 240 ? 12.798 53.897 34.464 1.00 45.77 ? 299 PRO C N 1 ATOM 8857 C CA . PRO C 1 240 ? 11.879 53.715 35.593 1.00 43.94 ? 299 PRO C CA 1 ATOM 8858 C C . PRO C 1 240 ? 12.639 53.441 36.886 1.00 45.74 ? 299 PRO C C 1 ATOM 8859 O O . PRO C 1 240 ? 13.760 52.934 36.831 1.00 62.16 ? 299 PRO C O 1 ATOM 8860 C CB . PRO C 1 240 ? 11.036 52.504 35.176 1.00 48.51 ? 299 PRO C CB 1 ATOM 8861 C CG . PRO C 1 240 ? 11.839 51.813 34.122 1.00 60.72 ? 299 PRO C CG 1 ATOM 8862 C CD . PRO C 1 240 ? 12.576 52.899 33.404 1.00 55.42 ? 299 PRO C CD 1 ATOM 8863 N N . ASP C 1 241 ? 12.043 53.787 38.023 1.00 49.38 ? 300 ASP C N 1 ATOM 8864 C CA . ASP C 1 241 ? 12.717 53.663 39.312 1.00 47.41 ? 300 ASP C CA 1 ATOM 8865 C C . ASP C 1 241 ? 13.172 52.226 39.553 1.00 62.48 ? 300 ASP C C 1 ATOM 8866 O O . ASP C 1 241 ? 12.465 51.277 39.213 1.00 60.82 ? 300 ASP C O 1 ATOM 8867 C CB . ASP C 1 241 ? 11.797 54.131 40.441 1.00 67.06 ? 300 ASP C CB 1 ATOM 8868 C CG . ASP C 1 241 ? 12.538 54.357 41.743 1.00 89.85 ? 300 ASP C CG 1 ATOM 8869 O OD1 . ASP C 1 241 ? 13.141 55.439 41.905 1.00 100.62 ? 300 ASP C OD1 1 ATOM 8870 O OD2 . ASP C 1 241 ? 12.515 53.456 42.606 1.00 102.64 ? 300 ASP C OD2 1 ATOM 8871 N N . GLU C 1 242 ? 14.358 52.074 40.134 1.00 55.31 ? 301 GLU C N 1 ATOM 8872 C CA . GLU C 1 242 ? 14.945 50.754 40.347 1.00 64.07 ? 301 GLU C CA 1 ATOM 8873 C C . GLU C 1 242 ? 14.151 49.914 41.343 1.00 78.05 ? 301 GLU C C 1 ATOM 8874 O O . GLU C 1 242 ? 14.095 48.691 41.221 1.00 87.82 ? 301 GLU C O 1 ATOM 8875 C CB . GLU C 1 242 ? 16.397 50.879 40.807 1.00 76.40 ? 301 GLU C CB 1 ATOM 8876 C CG . GLU C 1 242 ? 17.378 51.083 39.663 1.00 81.14 ? 301 GLU C CG 1 ATOM 8877 C CD . GLU C 1 242 ? 18.750 50.514 39.958 1.00 87.77 ? 301 GLU C CD 1 ATOM 8878 O OE1 . GLU C 1 242 ? 19.237 49.689 39.157 1.00 87.05 ? 301 GLU C OE1 1 ATOM 8879 O OE2 . GLU C 1 242 ? 19.346 50.895 40.987 1.00 98.37 ? 301 GLU C OE2 1 ATOM 8880 N N . SER C 1 243 ? 13.549 50.569 42.332 1.00 89.20 ? 302 SER C N 1 ATOM 8881 C CA . SER C 1 243 ? 12.739 49.873 43.326 1.00 81.85 ? 302 SER C CA 1 ATOM 8882 C C . SER C 1 243 ? 11.582 49.142 42.654 1.00 62.45 ? 302 SER C C 1 ATOM 8883 O O . SER C 1 243 ? 11.210 48.040 43.058 1.00 63.52 ? 302 SER C O 1 ATOM 8884 C CB . SER C 1 243 ? 12.212 50.850 44.377 1.00 85.82 ? 302 SER C CB 1 ATOM 8885 O OG . SER C 1 243 ? 13.278 51.494 45.052 1.00 93.55 ? 302 SER C OG 1 ATOM 8886 N N . ALA C 1 244 ? 11.018 49.764 41.624 1.00 58.43 ? 303 ALA C N 1 ATOM 8887 C CA . ALA C 1 244 ? 9.934 49.163 40.860 1.00 51.07 ? 303 ALA C CA 1 ATOM 8888 C C . ALA C 1 244 ? 10.495 48.272 39.755 1.00 57.65 ? 303 ALA C C 1 ATOM 8889 O O . ALA C 1 244 ? 10.076 47.126 39.594 1.00 65.95 ? 303 ALA C O 1 ATOM 8890 C CB . ALA C 1 244 ? 9.032 50.237 40.274 1.00 49.50 ? 303 ALA C CB 1 ATOM 8891 N N . VAL C 1 245 ? 11.443 48.811 38.994 1.00 65.03 ? 304 VAL C N 1 ATOM 8892 C CA . VAL C 1 245 ? 12.062 48.077 37.896 1.00 60.74 ? 304 VAL C CA 1 ATOM 8893 C C . VAL C 1 245 ? 13.569 47.949 38.116 1.00 68.69 ? 304 VAL C C 1 ATOM 8894 O O . VAL C 1 245 ? 14.340 48.803 37.676 1.00 75.47 ? 304 VAL C O 1 ATOM 8895 C CB . VAL C 1 245 ? 11.802 48.765 36.542 1.00 50.08 ? 304 VAL C CB 1 ATOM 8896 C CG1 . VAL C 1 245 ? 12.286 47.887 35.398 1.00 55.03 ? 304 VAL C CG1 1 ATOM 8897 C CG2 . VAL C 1 245 ? 10.325 49.072 36.382 1.00 53.72 ? 304 VAL C CG2 1 ATOM 8898 N N . PRO C 1 246 ? 13.992 46.881 38.811 1.00 68.38 ? 305 PRO C N 1 ATOM 8899 C CA . PRO C 1 246 ? 15.407 46.641 39.127 1.00 75.87 ? 305 PRO C CA 1 ATOM 8900 C C . PRO C 1 246 ? 16.260 46.403 37.885 1.00 64.58 ? 305 PRO C C 1 ATOM 8901 O O . PRO C 1 246 ? 15.732 45.957 36.868 1.00 43.96 ? 305 PRO C O 1 ATOM 8902 C CB . PRO C 1 246 ? 15.364 45.374 39.993 1.00 65.54 ? 305 PRO C CB 1 ATOM 8903 C CG . PRO C 1 246 ? 13.953 45.281 40.484 1.00 65.82 ? 305 PRO C CG 1 ATOM 8904 C CD . PRO C 1 246 ? 13.116 45.848 39.388 1.00 56.54 ? 305 PRO C CD 1 ATOM 8905 N N . ARG C 1 247 ? 17.555 46.698 37.956 1.00 64.38 ? 306 ARG C N 1 ATOM 8906 C CA . ARG C 1 247 ? 18.405 46.512 36.789 1.00 58.72 ? 306 ARG C CA 1 ATOM 8907 C C . ARG C 1 247 ? 19.692 45.790 37.180 1.00 50.41 ? 306 ARG C C 1 ATOM 8908 O O . ARG C 1 247 ? 20.113 45.839 38.337 1.00 52.02 ? 306 ARG C O 1 ATOM 8909 C CB . ARG C 1 247 ? 18.783 47.838 36.134 1.00 60.98 ? 306 ARG C CB 1 ATOM 8910 C CG . ARG C 1 247 ? 17.716 48.516 35.304 1.00 61.70 ? 306 ARG C CG 1 ATOM 8911 C CD . ARG C 1 247 ? 18.337 49.714 34.603 1.00 45.53 ? 306 ARG C CD 1 ATOM 8912 N NE . ARG C 1 247 ? 19.148 50.525 35.503 1.00 57.49 ? 306 ARG C NE 1 ATOM 8913 C CZ . ARG C 1 247 ? 18.718 51.598 36.154 1.00 62.13 ? 306 ARG C CZ 1 ATOM 8914 N NH1 . ARG C 1 247 ? 17.467 52.021 36.015 1.00 88.85 ? 306 ARG C NH1 1 ATOM 8915 N NH2 . ARG C 1 247 ? 19.549 52.254 36.947 1.00 58.57 ? 306 ARG C NH2 1 ATOM 8916 N N . LYS C 1 248 ? 20.315 45.132 36.209 1.00 49.57 ? 307 LYS C N 1 ATOM 8917 C CA . LYS C 1 248 ? 21.569 44.421 36.436 1.00 56.59 ? 307 LYS C CA 1 ATOM 8918 C C . LYS C 1 248 ? 22.725 45.085 35.689 1.00 53.17 ? 307 LYS C C 1 ATOM 8919 O O . LYS C 1 248 ? 22.558 45.571 34.571 1.00 55.15 ? 307 LYS C O 1 ATOM 8920 C CB . LYS C 1 248 ? 21.444 42.955 36.026 1.00 60.32 ? 307 LYS C CB 1 ATOM 8921 C CG . LYS C 1 248 ? 20.723 42.104 37.052 1.00 80.22 ? 307 LYS C CG 1 ATOM 8922 C CD . LYS C 1 248 ? 21.466 42.138 38.378 1.00 84.55 ? 307 LYS C CD 1 ATOM 8923 C CE . LYS C 1 248 ? 20.781 41.284 39.428 1.00 85.51 ? 307 LYS C CE 1 ATOM 8924 N NZ . LYS C 1 248 ? 21.499 41.339 40.731 1.00 82.16 ? 307 LYS C NZ 1 ATOM 8925 N N . HIS C 1 249 ? 23.896 45.102 36.317 1.00 53.76 ? 308 HIS C N 1 ATOM 8926 C CA . HIS C 1 249 ? 25.086 45.698 35.720 1.00 65.13 ? 308 HIS C CA 1 ATOM 8927 C C . HIS C 1 249 ? 26.171 44.634 35.557 1.00 64.38 ? 308 HIS C C 1 ATOM 8928 O O . HIS C 1 249 ? 26.760 44.181 36.539 1.00 66.50 ? 308 HIS C O 1 ATOM 8929 C CB . HIS C 1 249 ? 25.584 46.861 36.584 1.00 68.19 ? 308 HIS C CB 1 ATOM 8930 C CG . HIS C 1 249 ? 26.487 47.814 35.864 1.00 99.65 ? 308 HIS C CG 1 ATOM 8931 N ND1 . HIS C 1 249 ? 26.059 48.597 34.813 1.00 113.08 ? 308 HIS C ND1 1 ATOM 8932 C CD2 . HIS C 1 249 ? 27.788 48.133 36.064 1.00 108.05 ? 308 HIS C CD2 1 ATOM 8933 C CE1 . HIS C 1 249 ? 27.061 49.344 34.386 1.00 117.42 ? 308 HIS C CE1 1 ATOM 8934 N NE2 . HIS C 1 249 ? 28.122 49.082 35.128 1.00 109.40 ? 308 HIS C NE2 1 ATOM 8935 N N . ASN C 1 250 ? 26.428 44.240 34.313 1.00 59.58 ? 309 ASN C N 1 ATOM 8936 C CA . ASN C 1 250 ? 27.357 43.149 34.027 1.00 56.90 ? 309 ASN C CA 1 ATOM 8937 C C . ASN C 1 250 ? 28.575 43.559 33.205 1.00 51.04 ? 309 ASN C C 1 ATOM 8938 O O . ASN C 1 250 ? 28.453 44.209 32.166 1.00 63.44 ? 309 ASN C O 1 ATOM 8939 C CB . ASN C 1 250 ? 26.628 42.013 33.307 1.00 54.40 ? 309 ASN C CB 1 ATOM 8940 C CG . ASN C 1 250 ? 25.578 41.353 34.176 1.00 63.16 ? 309 ASN C CG 1 ATOM 8941 O OD1 . ASN C 1 250 ? 24.389 41.379 33.859 1.00 71.76 ? 309 ASN C OD1 1 ATOM 8942 N ND2 . ASN C 1 250 ? 26.013 40.754 35.278 1.00 56.97 ? 309 ASN C ND2 1 ATOM 8943 N N . ARG C 1 251 ? 29.750 43.165 33.686 1.00 48.97 ? 310 ARG C N 1 ATOM 8944 C CA . ARG C 1 251 ? 31.006 43.390 32.980 1.00 48.00 ? 310 ARG C CA 1 ATOM 8945 C C . ARG C 1 251 ? 31.021 42.666 31.637 1.00 44.67 ? 310 ARG C C 1 ATOM 8946 O O . ARG C 1 251 ? 30.639 41.500 31.546 1.00 40.63 ? 310 ARG C O 1 ATOM 8947 C CB . ARG C 1 251 ? 32.183 42.923 33.838 1.00 53.47 ? 310 ARG C CB 1 ATOM 8948 C CG . ARG C 1 251 ? 33.549 43.157 33.216 1.00 79.71 ? 310 ARG C CG 1 ATOM 8949 C CD . ARG C 1 251 ? 34.640 42.510 34.054 1.00 87.17 ? 310 ARG C CD 1 ATOM 8950 N NE . ARG C 1 251 ? 34.667 43.036 35.416 1.00 90.05 ? 310 ARG C NE 1 ATOM 8951 C CZ . ARG C 1 251 ? 35.459 42.575 36.378 1.00 86.28 ? 310 ARG C CZ 1 ATOM 8952 N NH1 . ARG C 1 251 ? 36.292 41.573 36.130 1.00 80.72 ? 310 ARG C NH1 1 ATOM 8953 N NH2 . ARG C 1 251 ? 35.418 43.113 37.590 1.00 80.58 ? 310 ARG C NH2 1 ATOM 8954 N N . SER C 1 252 ? 31.467 43.364 30.597 1.00 49.10 ? 311 SER C N 1 ATOM 8955 C CA . SER C 1 252 ? 31.547 42.785 29.261 1.00 46.59 ? 311 SER C CA 1 ATOM 8956 C C . SER C 1 252 ? 32.736 41.840 29.132 1.00 49.62 ? 311 SER C C 1 ATOM 8957 O O . SER C 1 252 ? 33.824 42.137 29.623 1.00 36.53 ? 311 SER C O 1 ATOM 8958 C CB . SER C 1 252 ? 31.647 43.888 28.205 1.00 42.82 ? 311 SER C CB 1 ATOM 8959 O OG . SER C 1 252 ? 31.723 43.342 26.899 1.00 31.27 ? 311 SER C OG 1 ATOM 8960 N N . PRO C 1 253 ? 32.529 40.687 28.476 1.00 44.82 ? 312 PRO C N 1 ATOM 8961 C CA . PRO C 1 253 ? 33.639 39.773 28.188 1.00 42.33 ? 312 PRO C CA 1 ATOM 8962 C C . PRO C 1 253 ? 34.603 40.384 27.176 1.00 58.14 ? 312 PRO C C 1 ATOM 8963 O O . PRO C 1 253 ? 35.751 39.954 27.067 1.00 40.18 ? 312 PRO C O 1 ATOM 8964 C CB . PRO C 1 253 ? 32.944 38.538 27.603 1.00 31.42 ? 312 PRO C CB 1 ATOM 8965 C CG . PRO C 1 253 ? 31.511 38.661 28.011 1.00 50.80 ? 312 PRO C CG 1 ATOM 8966 C CD . PRO C 1 253 ? 31.231 40.127 28.071 1.00 44.66 ? 312 PRO C CD 1 ATOM 8967 N N . TYR C 1 254 ? 34.124 41.388 26.449 1.00 34.66 ? 313 TYR C N 1 ATOM 8968 C CA . TYR C 1 254 ? 34.950 42.128 25.506 1.00 37.43 ? 313 TYR C CA 1 ATOM 8969 C C . TYR C 1 254 ? 35.252 43.520 26.041 1.00 34.89 ? 313 TYR C C 1 ATOM 8970 O O . TYR C 1 254 ? 35.450 44.464 25.277 1.00 37.12 ? 313 TYR C O 1 ATOM 8971 C CB . TYR C 1 254 ? 34.280 42.206 24.135 1.00 30.90 ? 313 TYR C CB 1 ATOM 8972 C CG . TYR C 1 254 ? 34.338 40.901 23.379 1.00 59.84 ? 313 TYR C CG 1 ATOM 8973 C CD1 . TYR C 1 254 ? 33.364 39.929 23.555 1.00 47.42 ? 313 TYR C CD1 1 ATOM 8974 C CD2 . TYR C 1 254 ? 35.381 40.634 22.502 1.00 30.84 ? 313 TYR C CD2 1 ATOM 8975 C CE1 . TYR C 1 254 ? 33.421 38.732 22.869 1.00 41.52 ? 313 TYR C CE1 1 ATOM 8976 C CE2 . TYR C 1 254 ? 35.446 39.443 21.813 1.00 50.92 ? 313 TYR C CE2 1 ATOM 8977 C CZ . TYR C 1 254 ? 34.464 38.495 22.000 1.00 49.52 ? 313 TYR C CZ 1 ATOM 8978 O OH . TYR C 1 254 ? 34.528 37.306 21.313 1.00 40.06 ? 313 TYR C OH 1 ATOM 8979 N N . ARG C 1 255 ? 35.264 43.635 27.365 1.00 43.66 ? 314 ARG C N 1 ATOM 8980 C CA . ARG C 1 255 ? 35.730 44.844 28.023 1.00 38.82 ? 314 ARG C CA 1 ATOM 8981 C C . ARG C 1 255 ? 37.150 45.141 27.581 1.00 42.97 ? 314 ARG C C 1 ATOM 8982 O O . ARG C 1 255 ? 37.978 44.236 27.487 1.00 50.67 ? 314 ARG C O 1 ATOM 8983 C CB . ARG C 1 255 ? 35.681 44.686 29.545 1.00 40.99 ? 314 ARG C CB 1 ATOM 8984 C CG . ARG C 1 255 ? 36.217 45.877 30.328 1.00 55.10 ? 314 ARG C CG 1 ATOM 8985 C CD . ARG C 1 255 ? 36.197 45.596 31.824 1.00 70.71 ? 314 ARG C CD 1 ATOM 8986 N NE . ARG C 1 255 ? 36.700 46.718 32.614 1.00 72.47 ? 314 ARG C NE 1 ATOM 8987 C CZ . ARG C 1 255 ? 35.965 47.749 33.018 1.00 79.45 ? 314 ARG C CZ 1 ATOM 8988 N NH1 . ARG C 1 255 ? 34.683 47.817 32.701 1.00 77.26 ? 314 ARG C NH1 1 ATOM 8989 N NH2 . ARG C 1 255 ? 36.517 48.717 33.736 1.00 86.99 ? 314 ARG C NH2 1 ATOM 8990 N N . ARG C 1 256 ? 37.436 46.407 27.309 1.00 43.43 ? 315 ARG C N 1 ATOM 8991 C CA . ARG C 1 256 ? 38.790 46.774 26.936 1.00 45.63 ? 315 ARG C CA 1 ATOM 8992 C C . ARG C 1 256 ? 39.656 46.887 28.177 1.00 34.96 ? 315 ARG C C 1 ATOM 8993 O O . ARG C 1 256 ? 39.176 46.767 29.304 1.00 36.69 ? 315 ARG C O 1 ATOM 8994 C CB . ARG C 1 256 ? 38.820 48.078 26.136 1.00 34.23 ? 315 ARG C CB 1 ATOM 8995 C CG . ARG C 1 256 ? 38.322 47.950 24.705 1.00 42.09 ? 315 ARG C CG 1 ATOM 8996 C CD . ARG C 1 256 ? 38.140 49.313 24.065 1.00 32.86 ? 315 ARG C CD 1 ATOM 8997 N NE . ARG C 1 256 ? 38.773 49.368 22.748 1.00 40.50 ? 315 ARG C NE 1 ATOM 8998 C CZ . ARG C 1 256 ? 38.162 49.118 21.596 1.00 34.34 ? 315 ARG C CZ 1 ATOM 8999 N NH1 . ARG C 1 256 ? 36.880 48.785 21.578 1.00 45.34 ? 315 ARG C NH1 1 ATOM 9000 N NH2 . ARG C 1 256 ? 38.841 49.199 20.461 1.00 46.77 ? 315 ARG C NH2 1 ATOM 9001 N N . THR C 1 257 ? 40.942 47.108 27.956 1.00 36.03 ? 316 THR C N 1 ATOM 9002 C CA . THR C 1 257 ? 41.914 47.077 29.030 1.00 36.37 ? 316 THR C CA 1 ATOM 9003 C C . THR C 1 257 ? 41.914 48.377 29.845 1.00 48.53 ? 316 THR C C 1 ATOM 9004 O O . THR C 1 257 ? 42.175 48.354 31.049 1.00 44.15 ? 316 THR C O 1 ATOM 9005 C CB . THR C 1 257 ? 43.317 46.784 28.460 1.00 28.70 ? 316 THR C CB 1 ATOM 9006 O OG1 . THR C 1 257 ? 43.948 45.750 29.227 1.00 65.13 ? 316 THR C OG1 1 ATOM 9007 C CG2 . THR C 1 257 ? 44.172 48.022 28.456 1.00 47.45 ? 316 THR C CG2 1 ATOM 9008 N N . TYR C 1 258 ? 41.626 49.498 29.184 1.00 39.98 ? 317 TYR C N 1 ATOM 9009 C CA . TYR C 1 258 ? 41.641 50.818 29.817 1.00 45.75 ? 317 TYR C CA 1 ATOM 9010 C C . TYR C 1 258 ? 42.987 51.149 30.466 1.00 40.24 ? 317 TYR C C 1 ATOM 9011 O O . TYR C 1 258 ? 43.044 51.640 31.593 1.00 49.05 ? 317 TYR C O 1 ATOM 9012 C CB . TYR C 1 258 ? 40.506 50.930 30.839 1.00 29.81 ? 317 TYR C CB 1 ATOM 9013 C CG . TYR C 1 258 ? 39.142 50.967 30.190 1.00 47.46 ? 317 TYR C CG 1 ATOM 9014 C CD1 . TYR C 1 258 ? 38.490 52.174 29.978 1.00 37.70 ? 317 TYR C CD1 1 ATOM 9015 C CD2 . TYR C 1 258 ? 38.521 49.802 29.757 1.00 32.70 ? 317 TYR C CD2 1 ATOM 9016 C CE1 . TYR C 1 258 ? 37.251 52.220 29.372 1.00 38.02 ? 317 TYR C CE1 1 ATOM 9017 C CE2 . TYR C 1 258 ? 37.280 49.838 29.150 1.00 36.05 ? 317 TYR C CE2 1 ATOM 9018 C CZ . TYR C 1 258 ? 36.651 51.050 28.960 1.00 38.15 ? 317 TYR C CZ 1 ATOM 9019 O OH . TYR C 1 258 ? 35.417 51.100 28.356 1.00 35.25 ? 317 TYR C OH 1 ATOM 9020 N N . SER C 1 259 ? 44.065 50.864 29.742 1.00 33.36 ? 318 SER C N 1 ATOM 9021 C CA . SER C 1 259 ? 45.420 51.201 30.171 1.00 45.25 ? 318 SER C CA 1 ATOM 9022 C C . SER C 1 259 ? 46.286 51.550 28.963 1.00 46.81 ? 318 SER C C 1 ATOM 9023 O O . SER C 1 259 ? 46.140 50.946 27.900 1.00 41.83 ? 318 SER C O 1 ATOM 9024 C CB . SER C 1 259 ? 46.042 50.041 30.953 1.00 47.27 ? 318 SER C CB 1 ATOM 9025 O OG . SER C 1 259 ? 47.458 50.082 30.891 1.00 44.40 ? 318 SER C OG 1 ATOM 9026 N N . LYS C 1 260 ? 47.176 52.527 29.116 1.00 39.66 ? 319 LYS C N 1 ATOM 9027 C CA . LYS C 1 260 ? 48.070 52.903 28.021 1.00 46.90 ? 319 LYS C CA 1 ATOM 9028 C C . LYS C 1 260 ? 49.374 52.097 28.012 1.00 46.61 ? 319 LYS C C 1 ATOM 9029 O O . LYS C 1 260 ? 50.094 52.092 27.014 1.00 53.87 ? 319 LYS C O 1 ATOM 9030 C CB . LYS C 1 260 ? 48.379 54.403 28.070 1.00 36.02 ? 319 LYS C CB 1 ATOM 9031 C CG . LYS C 1 260 ? 48.870 54.914 29.410 1.00 52.19 ? 319 LYS C CG 1 ATOM 9032 C CD . LYS C 1 260 ? 48.903 56.434 29.414 1.00 48.13 ? 319 LYS C CD 1 ATOM 9033 C CE . LYS C 1 260 ? 49.427 56.979 30.729 1.00 54.34 ? 319 LYS C CE 1 ATOM 9034 N NZ . LYS C 1 260 ? 50.805 56.501 31.015 1.00 68.15 ? 319 LYS C NZ 1 ATOM 9035 N N . LYS C 1 261 ? 49.676 51.422 29.119 1.00 44.13 ? 320 LYS C N 1 ATOM 9036 C CA . LYS C 1 261 ? 50.825 50.514 29.175 1.00 57.80 ? 320 LYS C CA 1 ATOM 9037 C C . LYS C 1 261 ? 50.548 49.170 28.518 1.00 50.65 ? 320 LYS C C 1 ATOM 9038 O O . LYS C 1 261 ? 51.107 48.862 27.466 1.00 60.49 ? 320 LYS C O 1 ATOM 9039 C CB . LYS C 1 261 ? 51.283 50.295 30.621 1.00 61.22 ? 320 LYS C CB 1 ATOM 9040 C CG . LYS C 1 261 ? 52.475 51.144 31.046 1.00 82.40 ? 320 LYS C CG 1 ATOM 9041 C CD . LYS C 1 261 ? 52.270 52.634 30.887 1.00 87.21 ? 320 LYS C CD 1 ATOM 9042 C CE . LYS C 1 261 ? 53.542 53.368 31.290 1.00 74.55 ? 320 LYS C CE 1 ATOM 9043 N NZ . LYS C 1 261 ? 53.430 54.841 31.135 1.00 75.16 ? 320 LYS C NZ 1 ATOM 9044 N N . ASN C 1 262 ? 49.687 48.372 29.134 1.00 51.08 ? 321 ASN C N 1 ATOM 9045 C CA . ASN C 1 262 ? 49.296 47.103 28.541 1.00 54.19 ? 321 ASN C CA 1 ATOM 9046 C C . ASN C 1 262 ? 48.034 47.309 27.726 1.00 37.82 ? 321 ASN C C 1 ATOM 9047 O O . ASN C 1 262 ? 46.947 47.219 28.266 1.00 50.61 ? 321 ASN C O 1 ATOM 9048 C CB . ASN C 1 262 ? 49.051 46.050 29.623 1.00 55.44 ? 321 ASN C CB 1 ATOM 9049 C CG . ASN C 1 262 ? 50.165 45.994 30.646 1.00 71.28 ? 321 ASN C CG 1 ATOM 9050 O OD1 . ASN C 1 262 ? 51.320 46.292 30.343 1.00 83.41 ? 321 ASN C OD1 1 ATOM 9051 N ND2 . ASN C 1 262 ? 49.822 45.615 31.872 1.00 66.59 ? 321 ASN C ND2 1 ATOM 9052 N N . GLN C 1 263 ? 48.173 47.543 26.425 1.00 42.60 ? 322 GLN C N 1 ATOM 9053 C CA . GLN C 1 263 ? 47.038 47.979 25.612 1.00 40.52 ? 322 GLN C CA 1 ATOM 9054 C C . GLN C 1 263 ? 46.284 46.859 24.902 1.00 44.33 ? 322 GLN C C 1 ATOM 9055 O O . GLN C 1 263 ? 45.355 47.125 24.138 1.00 37.31 ? 322 GLN C O 1 ATOM 9056 C CB . GLN C 1 263 ? 47.499 48.997 24.567 1.00 29.15 ? 322 GLN C CB 1 ATOM 9057 C CG . GLN C 1 263 ? 48.108 50.260 25.145 1.00 36.33 ? 322 GLN C CG 1 ATOM 9058 C CD . GLN C 1 263 ? 48.668 51.171 24.071 1.00 28.82 ? 322 GLN C CD 1 ATOM 9059 O OE1 . GLN C 1 263 ? 48.333 51.039 22.894 1.00 27.75 ? 322 GLN C OE1 1 ATOM 9060 N NE2 . GLN C 1 263 ? 49.521 52.106 24.472 1.00 37.08 ? 322 GLN C NE2 1 ATOM 9061 N N . VAL C 1 264 ? 46.672 45.614 25.145 1.00 40.74 ? 323 VAL C N 1 ATOM 9062 C CA . VAL C 1 264 ? 46.093 44.500 24.406 1.00 29.97 ? 323 VAL C CA 1 ATOM 9063 C C . VAL C 1 264 ? 45.389 43.503 25.320 1.00 35.02 ? 323 VAL C C 1 ATOM 9064 O O . VAL C 1 264 ? 46.033 42.742 26.043 1.00 53.64 ? 323 VAL C O 1 ATOM 9065 C CB . VAL C 1 264 ? 47.161 43.753 23.583 1.00 41.80 ? 323 VAL C CB 1 ATOM 9066 C CG1 . VAL C 1 264 ? 46.534 42.582 22.841 1.00 28.48 ? 323 VAL C CG1 1 ATOM 9067 C CG2 . VAL C 1 264 ? 47.842 44.703 22.611 1.00 28.14 ? 323 VAL C CG2 1 ATOM 9068 N N . ALA C 1 265 ? 44.061 43.518 25.284 1.00 42.16 ? 324 ALA C N 1 ATOM 9069 C CA . ALA C 1 265 ? 43.265 42.544 26.017 1.00 45.48 ? 324 ALA C CA 1 ATOM 9070 C C . ALA C 1 265 ? 43.371 41.184 25.340 1.00 39.56 ? 324 ALA C C 1 ATOM 9071 O O . ALA C 1 265 ? 43.747 41.096 24.171 1.00 48.90 ? 324 ALA C O 1 ATOM 9072 C CB . ALA C 1 265 ? 41.817 42.990 26.104 1.00 30.13 ? 324 ALA C CB 1 ATOM 9073 N N . GLU C 1 266 ? 43.048 40.129 26.083 1.00 29.21 ? 325 GLU C N 1 ATOM 9074 C CA . GLU C 1 266 ? 43.120 38.764 25.569 1.00 40.52 ? 325 GLU C CA 1 ATOM 9075 C C . GLU C 1 266 ? 42.343 38.581 24.266 1.00 47.20 ? 325 GLU C C 1 ATOM 9076 O O . GLU C 1 266 ? 42.824 37.935 23.335 1.00 37.01 ? 325 GLU C O 1 ATOM 9077 C CB . GLU C 1 266 ? 42.608 37.777 26.621 1.00 46.11 ? 325 GLU C CB 1 ATOM 9078 C CG . GLU C 1 266 ? 42.606 36.329 26.160 1.00 60.16 ? 325 GLU C CG 1 ATOM 9079 C CD . GLU C 1 266 ? 42.192 35.366 27.254 1.00 70.93 ? 325 GLU C CD 1 ATOM 9080 O OE1 . GLU C 1 266 ? 42.024 35.812 28.409 1.00 73.68 ? 325 GLU C OE1 1 ATOM 9081 O OE2 . GLU C 1 266 ? 42.040 34.162 26.960 1.00 71.66 ? 325 GLU C OE2 1 ATOM 9082 N N . TRP C 1 267 ? 41.143 39.151 24.203 1.00 46.48 ? 326 TRP C N 1 ATOM 9083 C CA . TRP C 1 267 ? 40.286 39.003 23.028 1.00 39.56 ? 326 TRP C CA 1 ATOM 9084 C C . TRP C 1 267 ? 40.826 39.738 21.803 1.00 42.24 ? 326 TRP C C 1 ATOM 9085 O O . TRP C 1 267 ? 40.376 39.500 20.682 1.00 29.92 ? 326 TRP C O 1 ATOM 9086 C CB . TRP C 1 267 ? 38.864 39.478 23.344 1.00 32.79 ? 326 TRP C CB 1 ATOM 9087 C CG . TRP C 1 267 ? 38.755 40.903 23.789 1.00 44.56 ? 326 TRP C CG 1 ATOM 9088 C CD1 . TRP C 1 267 ? 38.793 41.364 25.072 1.00 47.43 ? 326 TRP C CD1 1 ATOM 9089 C CD2 . TRP C 1 267 ? 38.548 42.050 22.957 1.00 36.07 ? 326 TRP C CD2 1 ATOM 9090 N NE1 . TRP C 1 267 ? 38.642 42.728 25.090 1.00 46.67 ? 326 TRP C NE1 1 ATOM 9091 C CE2 . TRP C 1 267 ? 38.488 43.175 23.804 1.00 45.18 ? 326 TRP C CE2 1 ATOM 9092 C CE3 . TRP C 1 267 ? 38.415 42.238 21.578 1.00 36.08 ? 326 TRP C CE3 1 ATOM 9093 C CZ2 . TRP C 1 267 ? 38.303 44.467 23.318 1.00 29.93 ? 326 TRP C CZ2 1 ATOM 9094 C CZ3 . TRP C 1 267 ? 38.230 43.521 21.097 1.00 41.55 ? 326 TRP C CZ3 1 ATOM 9095 C CH2 . TRP C 1 267 ? 38.177 44.619 21.965 1.00 31.15 ? 326 TRP C CH2 1 ATOM 9096 N N . GLN C 1 268 ? 41.790 40.627 22.018 1.00 35.95 ? 327 GLN C N 1 ATOM 9097 C CA . GLN C 1 268 ? 42.389 41.377 20.920 1.00 49.17 ? 327 GLN C CA 1 ATOM 9098 C C . GLN C 1 268 ? 43.561 40.636 20.277 1.00 50.46 ? 327 GLN C C 1 ATOM 9099 O O . GLN C 1 268 ? 43.954 40.946 19.153 1.00 41.79 ? 327 GLN C O 1 ATOM 9100 C CB . GLN C 1 268 ? 42.839 42.759 21.397 1.00 29.21 ? 327 GLN C CB 1 ATOM 9101 C CG . GLN C 1 268 ? 41.707 43.771 21.468 1.00 29.36 ? 327 GLN C CG 1 ATOM 9102 C CD . GLN C 1 268 ? 42.090 45.037 22.207 1.00 39.53 ? 327 GLN C CD 1 ATOM 9103 O OE1 . GLN C 1 268 ? 42.683 44.986 23.284 1.00 38.01 ? 327 GLN C OE1 1 ATOM 9104 N NE2 . GLN C 1 268 ? 41.753 46.184 21.628 1.00 29.20 ? 327 GLN C NE2 1 ATOM 9105 N N . SER C 1 269 ? 44.118 39.659 20.986 1.00 45.50 ? 328 SER C N 1 ATOM 9106 C CA . SER C 1 269 ? 45.264 38.920 20.466 1.00 56.28 ? 328 SER C CA 1 ATOM 9107 C C . SER C 1 269 ? 44.901 37.470 20.158 1.00 66.81 ? 328 SER C C 1 ATOM 9108 O O . SER C 1 269 ? 45.511 36.839 19.295 1.00 75.29 ? 328 SER C O 1 ATOM 9109 C CB . SER C 1 269 ? 46.429 38.971 21.457 1.00 37.26 ? 328 SER C CB 1 ATOM 9110 O OG . SER C 1 269 ? 46.028 38.531 22.742 1.00 59.20 ? 328 SER C OG 1 ATOM 9111 N N . SER C 1 270 ? 43.911 36.944 20.872 1.00 63.49 ? 329 SER C N 1 ATOM 9112 C CA . SER C 1 270 ? 43.468 35.568 20.677 1.00 46.04 ? 329 SER C CA 1 ATOM 9113 C C . SER C 1 270 ? 42.139 35.535 19.928 1.00 48.86 ? 329 SER C C 1 ATOM 9114 O O . SER C 1 270 ? 41.127 36.025 20.429 1.00 58.70 ? 329 SER C O 1 ATOM 9115 C CB . SER C 1 270 ? 43.344 34.846 22.020 1.00 37.57 ? 329 SER C CB 1 ATOM 9116 O OG . SER C 1 270 ? 42.637 33.627 21.883 1.00 64.30 ? 329 SER C OG 1 HETATM 9117 N N . MSE C 1 271 ? 42.139 34.954 18.732 1.00 30.52 ? 330 MSE C N 1 HETATM 9118 C CA . MSE C 1 271 ? 40.927 34.902 17.918 1.00 36.84 ? 330 MSE C CA 1 HETATM 9119 C C . MSE C 1 271 ? 39.959 33.831 18.407 1.00 48.51 ? 330 MSE C C 1 HETATM 9120 O O . MSE C 1 271 ? 38.803 33.790 17.984 1.00 48.18 ? 330 MSE C O 1 HETATM 9121 C CB . MSE C 1 271 ? 41.275 34.653 16.450 1.00 35.44 ? 330 MSE C CB 1 HETATM 9122 C CG . MSE C 1 271 ? 42.058 35.777 15.791 1.00 65.30 ? 330 MSE C CG 1 HETATM 9123 SE SE . MSE C 1 271 ? 41.149 37.501 15.889 1.00 103.53 ? 330 MSE C SE 1 HETATM 9124 C CE . MSE C 1 271 ? 42.147 38.293 17.369 1.00 30.82 ? 330 MSE C CE 1 ATOM 9125 N N . ASN C 1 272 ? 40.434 32.966 19.296 1.00 55.00 ? 331 ASN C N 1 ATOM 9126 C CA . ASN C 1 272 ? 39.608 31.888 19.822 1.00 48.33 ? 331 ASN C CA 1 ATOM 9127 C C . ASN C 1 272 ? 39.000 32.254 21.172 1.00 45.68 ? 331 ASN C C 1 ATOM 9128 O O . ASN C 1 272 ? 38.500 31.390 21.890 1.00 46.89 ? 331 ASN C O 1 ATOM 9129 C CB . ASN C 1 272 ? 40.432 30.606 19.955 1.00 61.61 ? 331 ASN C CB 1 ATOM 9130 C CG . ASN C 1 272 ? 41.776 30.845 20.620 1.00 72.47 ? 331 ASN C CG 1 ATOM 9131 O OD1 . ASN C 1 272 ? 42.663 31.477 20.047 1.00 66.29 ? 331 ASN C OD1 1 ATOM 9132 N ND2 . ASN C 1 272 ? 41.932 30.335 21.836 1.00 85.78 ? 331 ASN C ND2 1 ATOM 9133 N N . TYR C 1 273 ? 39.058 33.540 21.506 1.00 46.45 ? 332 TYR C N 1 ATOM 9134 C CA . TYR C 1 273 ? 38.556 34.052 22.779 1.00 44.38 ? 332 TYR C CA 1 ATOM 9135 C C . TYR C 1 273 ? 37.098 33.686 23.049 1.00 52.00 ? 332 TYR C C 1 ATOM 9136 O O . TYR C 1 273 ? 36.756 33.239 24.143 1.00 50.12 ? 332 TYR C O 1 ATOM 9137 C CB . TYR C 1 273 ? 38.714 35.572 22.833 1.00 49.88 ? 332 TYR C CB 1 ATOM 9138 C CG . TYR C 1 273 ? 38.246 36.189 24.131 1.00 44.51 ? 332 TYR C CG 1 ATOM 9139 C CD1 . TYR C 1 273 ? 39.060 36.186 25.255 1.00 39.39 ? 332 TYR C CD1 1 ATOM 9140 C CD2 . TYR C 1 273 ? 36.989 36.775 24.234 1.00 39.43 ? 332 TYR C CD2 1 ATOM 9141 C CE1 . TYR C 1 273 ? 38.639 36.750 26.444 1.00 37.13 ? 332 TYR C CE1 1 ATOM 9142 C CE2 . TYR C 1 273 ? 36.561 37.342 25.417 1.00 41.26 ? 332 TYR C CE2 1 ATOM 9143 C CZ . TYR C 1 273 ? 37.389 37.326 26.519 1.00 45.53 ? 332 TYR C CZ 1 ATOM 9144 O OH . TYR C 1 273 ? 36.965 37.889 27.701 1.00 45.87 ? 332 TYR C OH 1 ATOM 9145 N N . CYS C 1 274 ? 36.244 33.886 22.050 1.00 46.49 ? 333 CYS C N 1 ATOM 9146 C CA . CYS C 1 274 ? 34.815 33.629 22.198 1.00 54.66 ? 333 CYS C CA 1 ATOM 9147 C C . CYS C 1 274 ? 34.533 32.152 22.435 1.00 67.15 ? 333 CYS C C 1 ATOM 9148 O O . CYS C 1 274 ? 33.749 31.793 23.313 1.00 60.50 ? 333 CYS C O 1 ATOM 9149 C CB . CYS C 1 274 ? 34.051 34.113 20.965 1.00 40.22 ? 333 CYS C CB 1 ATOM 9150 S SG . CYS C 1 274 ? 32.255 34.052 21.146 1.00 39.79 ? 333 CYS C SG 1 ATOM 9151 N N . THR C 1 275 ? 35.175 31.304 21.639 1.00 66.00 ? 334 THR C N 1 ATOM 9152 C CA . THR C 1 275 ? 35.006 29.861 21.746 1.00 53.97 ? 334 THR C CA 1 ATOM 9153 C C . THR C 1 275 ? 35.419 29.341 23.122 1.00 49.94 ? 334 THR C C 1 ATOM 9154 O O . THR C 1 275 ? 34.689 28.574 23.748 1.00 36.46 ? 334 THR C O 1 ATOM 9155 C CB . THR C 1 275 ? 35.818 29.123 20.661 1.00 53.24 ? 334 THR C CB 1 ATOM 9156 O OG1 . THR C 1 275 ? 35.244 29.378 19.373 1.00 55.40 ? 334 THR C OG1 1 ATOM 9157 C CG2 . THR C 1 275 ? 35.831 27.622 20.921 1.00 45.28 ? 334 THR C CG2 1 ATOM 9158 N N . ASP C 1 276 ? 36.586 29.770 23.591 1.00 31.40 ? 335 ASP C N 1 ATOM 9159 C CA . ASP C 1 276 ? 37.150 29.239 24.829 1.00 41.70 ? 335 ASP C CA 1 ATOM 9160 C C . ASP C 1 276 ? 36.675 29.953 26.095 1.00 50.31 ? 335 ASP C C 1 ATOM 9161 O O . ASP C 1 276 ? 36.525 29.325 27.143 1.00 66.15 ? 335 ASP C O 1 ATOM 9162 C CB . ASP C 1 276 ? 38.679 29.295 24.768 1.00 38.32 ? 335 ASP C CB 1 ATOM 9163 C CG . ASP C 1 276 ? 39.238 28.614 23.536 1.00 51.73 ? 335 ASP C CG 1 ATOM 9164 O OD1 . ASP C 1 276 ? 40.305 29.042 23.047 1.00 67.95 ? 335 ASP C OD1 1 ATOM 9165 O OD2 . ASP C 1 276 ? 38.607 27.652 23.052 1.00 36.17 ? 335 ASP C OD2 1 ATOM 9166 N N . LYS C 1 277 ? 36.437 31.258 26.002 1.00 45.52 ? 336 LYS C N 1 ATOM 9167 C CA . LYS C 1 277 ? 36.213 32.064 27.202 1.00 44.81 ? 336 LYS C CA 1 ATOM 9168 C C . LYS C 1 277 ? 34.810 32.655 27.332 1.00 47.32 ? 336 LYS C C 1 ATOM 9169 O O . LYS C 1 277 ? 34.422 33.086 28.417 1.00 47.11 ? 336 LYS C O 1 ATOM 9170 C CB . LYS C 1 277 ? 37.244 33.191 27.269 1.00 55.42 ? 336 LYS C CB 1 ATOM 9171 C CG . LYS C 1 277 ? 38.679 32.696 27.280 1.00 54.74 ? 336 LYS C CG 1 ATOM 9172 C CD . LYS C 1 277 ? 39.002 32.021 28.602 1.00 51.77 ? 336 LYS C CD 1 ATOM 9173 C CE . LYS C 1 277 ? 40.404 31.438 28.603 1.00 64.61 ? 336 LYS C CE 1 ATOM 9174 N NZ . LYS C 1 277 ? 41.449 32.497 28.532 1.00 66.69 ? 336 LYS C NZ 1 ATOM 9175 N N . VAL C 1 278 ? 34.050 32.688 26.243 1.00 34.42 ? 337 VAL C N 1 ATOM 9176 C CA . VAL C 1 278 ? 32.717 33.280 26.298 1.00 35.14 ? 337 VAL C CA 1 ATOM 9177 C C . VAL C 1 278 ? 31.626 32.236 26.093 1.00 44.86 ? 337 VAL C C 1 ATOM 9178 O O . VAL C 1 278 ? 30.690 32.146 26.885 1.00 34.43 ? 337 VAL C O 1 ATOM 9179 C CB . VAL C 1 278 ? 32.547 34.389 25.243 1.00 45.28 ? 337 VAL C CB 1 ATOM 9180 C CG1 . VAL C 1 278 ? 31.120 34.914 25.252 1.00 45.35 ? 337 VAL C CG1 1 ATOM 9181 C CG2 . VAL C 1 278 ? 33.529 35.516 25.497 1.00 36.92 ? 337 VAL C CG2 1 ATOM 9182 N N . LYS C 1 279 ? 31.759 31.441 25.038 1.00 36.98 ? 338 LYS C N 1 ATOM 9183 C CA . LYS C 1 279 ? 30.809 30.370 24.766 1.00 36.52 ? 338 LYS C CA 1 ATOM 9184 C C . LYS C 1 279 ? 30.793 29.324 25.881 1.00 56.00 ? 338 LYS C C 1 ATOM 9185 O O . LYS C 1 279 ? 29.818 28.588 26.037 1.00 59.91 ? 338 LYS C O 1 ATOM 9186 C CB . LYS C 1 279 ? 31.125 29.706 23.425 1.00 39.00 ? 338 LYS C CB 1 ATOM 9187 C CG . LYS C 1 279 ? 30.571 30.455 22.224 1.00 37.93 ? 338 LYS C CG 1 ATOM 9188 C CD . LYS C 1 279 ? 30.976 29.793 20.917 1.00 33.39 ? 338 LYS C CD 1 ATOM 9189 C CE . LYS C 1 279 ? 30.274 30.435 19.731 1.00 38.18 ? 338 LYS C CE 1 ATOM 9190 N NZ . LYS C 1 279 ? 30.728 29.855 18.438 1.00 44.36 ? 338 LYS C NZ 1 ATOM 9191 N N . THR C 1 280 ? 31.874 29.259 26.652 1.00 50.00 ? 339 THR C N 1 ATOM 9192 C CA . THR C 1 280 ? 31.990 28.265 27.714 1.00 44.44 ? 339 THR C CA 1 ATOM 9193 C C . THR C 1 280 ? 31.484 28.765 29.067 1.00 56.29 ? 339 THR C C 1 ATOM 9194 O O . THR C 1 280 ? 31.387 27.990 30.019 1.00 65.08 ? 339 THR C O 1 ATOM 9195 C CB . THR C 1 280 ? 33.449 27.806 27.883 1.00 46.27 ? 339 THR C CB 1 ATOM 9196 O OG1 . THR C 1 280 ? 34.271 28.935 28.204 1.00 56.79 ? 339 THR C OG1 1 ATOM 9197 C CG2 . THR C 1 280 ? 33.957 27.166 26.602 1.00 38.00 ? 339 THR C CG2 1 ATOM 9198 N N . LYS C 1 281 ? 31.162 30.052 29.156 1.00 55.91 ? 340 LYS C N 1 ATOM 9199 C CA . LYS C 1 281 ? 30.611 30.597 30.394 1.00 65.38 ? 340 LYS C CA 1 ATOM 9200 C C . LYS C 1 281 ? 29.133 30.252 30.532 1.00 73.57 ? 340 LYS C C 1 ATOM 9201 O O . LYS C 1 281 ? 28.409 30.196 29.540 1.00 68.87 ? 340 LYS C O 1 ATOM 9202 C CB . LYS C 1 281 ? 30.809 32.113 30.466 1.00 64.81 ? 340 LYS C CB 1 ATOM 9203 C CG . LYS C 1 281 ? 32.242 32.542 30.733 1.00 65.68 ? 340 LYS C CG 1 ATOM 9204 C CD . LYS C 1 281 ? 32.363 34.056 30.804 1.00 77.02 ? 340 LYS C CD 1 ATOM 9205 C CE . LYS C 1 281 ? 33.667 34.475 31.465 1.00 81.45 ? 340 LYS C CE 1 ATOM 9206 N NZ . LYS C 1 281 ? 34.855 34.094 30.652 1.00 87.03 ? 340 LYS C NZ 1 ATOM 9207 N N . ARG C 1 282 ? 28.696 30.035 31.769 1.00 75.49 ? 341 ARG C N 1 ATOM 9208 C CA . ARG C 1 282 ? 27.307 29.692 32.071 1.00 69.69 ? 341 ARG C CA 1 ATOM 9209 C C . ARG C 1 282 ? 26.313 30.717 31.525 1.00 60.84 ? 341 ARG C C 1 ATOM 9210 O O . ARG C 1 282 ? 25.316 30.352 30.903 1.00 59.30 ? 341 ARG C O 1 ATOM 9211 C CB . ARG C 1 282 ? 27.119 29.537 33.583 1.00 83.26 ? 341 ARG C CB 1 ATOM 9212 C CG . ARG C 1 282 ? 27.820 28.319 34.174 1.00 102.34 ? 341 ARG C CG 1 ATOM 9213 C CD . ARG C 1 282 ? 27.197 27.010 33.704 1.00 114.41 ? 341 ARG C CD 1 ATOM 9214 N NE . ARG C 1 282 ? 26.045 26.623 34.514 1.00 127.47 ? 341 ARG C NE 1 ATOM 9215 C CZ . ARG C 1 282 ? 25.411 25.459 34.406 1.00 127.68 ? 341 ARG C CZ 1 ATOM 9216 N NH1 . ARG C 1 282 ? 25.818 24.561 33.520 1.00 133.78 ? 341 ARG C NH1 1 ATOM 9217 N NH2 . ARG C 1 282 ? 24.373 25.191 35.187 1.00 112.55 ? 341 ARG C NH2 1 ATOM 9218 N N . GLN C 1 283 ? 26.588 31.996 31.765 1.00 73.34 ? 342 GLN C N 1 ATOM 9219 C CA . GLN C 1 283 ? 25.681 33.065 31.355 1.00 66.57 ? 342 GLN C CA 1 ATOM 9220 C C . GLN C 1 283 ? 25.532 33.165 29.837 1.00 52.65 ? 342 GLN C C 1 ATOM 9221 O O . GLN C 1 283 ? 24.540 33.699 29.343 1.00 54.64 ? 342 GLN C O 1 ATOM 9222 C CB . GLN C 1 283 ? 26.156 34.411 31.912 1.00 73.83 ? 342 GLN C CB 1 ATOM 9223 C CG . GLN C 1 283 ? 26.338 34.441 33.421 1.00 92.19 ? 342 GLN C CG 1 ATOM 9224 C CD . GLN C 1 283 ? 27.754 34.104 33.847 1.00 97.55 ? 342 GLN C CD 1 ATOM 9225 O OE1 . GLN C 1 283 ? 28.468 33.379 33.154 1.00 89.60 ? 342 GLN C OE1 1 ATOM 9226 N NE2 . GLN C 1 283 ? 28.168 34.633 34.993 1.00 98.70 ? 342 GLN C NE2 1 ATOM 9227 N N . TYR C 1 284 ? 26.516 32.659 29.101 1.00 43.83 ? 343 TYR C N 1 ATOM 9228 C CA . TYR C 1 284 ? 26.515 32.788 27.647 1.00 39.99 ? 343 TYR C CA 1 ATOM 9229 C C . TYR C 1 284 ? 26.331 31.444 26.946 1.00 47.37 ? 343 TYR C C 1 ATOM 9230 O O . TYR C 1 284 ? 26.128 31.395 25.734 1.00 51.92 ? 343 TYR C O 1 ATOM 9231 C CB . TYR C 1 284 ? 27.810 33.448 27.168 1.00 51.13 ? 343 TYR C CB 1 ATOM 9232 C CG . TYR C 1 284 ? 27.937 34.904 27.552 1.00 56.71 ? 343 TYR C CG 1 ATOM 9233 C CD1 . TYR C 1 284 ? 27.341 35.897 26.785 1.00 54.38 ? 343 TYR C CD1 1 ATOM 9234 C CD2 . TYR C 1 284 ? 28.652 35.286 28.679 1.00 49.58 ? 343 TYR C CD2 1 ATOM 9235 C CE1 . TYR C 1 284 ? 27.453 37.230 27.132 1.00 50.82 ? 343 TYR C CE1 1 ATOM 9236 C CE2 . TYR C 1 284 ? 28.769 36.617 29.033 1.00 52.93 ? 343 TYR C CE2 1 ATOM 9237 C CZ . TYR C 1 284 ? 28.168 37.584 28.256 1.00 49.63 ? 343 TYR C CZ 1 ATOM 9238 O OH . TYR C 1 284 ? 28.280 38.910 28.604 1.00 59.42 ? 343 TYR C OH 1 ATOM 9239 N N . ALA C 1 285 ? 26.404 30.359 27.711 1.00 55.36 ? 344 ALA C N 1 ATOM 9240 C CA . ALA C 1 285 ? 26.326 29.018 27.141 1.00 49.58 ? 344 ALA C CA 1 ATOM 9241 C C . ALA C 1 285 ? 24.940 28.717 26.589 1.00 57.03 ? 344 ALA C C 1 ATOM 9242 O O . ALA C 1 285 ? 24.796 27.964 25.625 1.00 52.17 ? 344 ALA C O 1 ATOM 9243 C CB . ALA C 1 285 ? 26.710 27.975 28.179 1.00 43.39 ? 344 ALA C CB 1 ATOM 9244 N N . HIS C 1 286 ? 23.920 29.308 27.201 1.00 46.00 ? 345 HIS C N 1 ATOM 9245 C CA . HIS C 1 286 ? 22.546 29.069 26.780 1.00 45.56 ? 345 HIS C CA 1 ATOM 9246 C C . HIS C 1 286 ? 21.708 30.335 26.919 1.00 51.22 ? 345 HIS C C 1 ATOM 9247 O O . HIS C 1 286 ? 21.729 30.987 27.962 1.00 53.98 ? 345 HIS C O 1 ATOM 9248 C CB . HIS C 1 286 ? 21.924 27.940 27.606 1.00 54.08 ? 345 HIS C CB 1 ATOM 9249 C CG . HIS C 1 286 ? 22.652 26.636 27.493 1.00 57.80 ? 345 HIS C CG 1 ATOM 9250 N ND1 . HIS C 1 286 ? 22.417 25.734 26.478 1.00 64.55 ? 345 HIS C ND1 1 ATOM 9251 C CD2 . HIS C 1 286 ? 23.615 26.085 28.270 1.00 50.32 ? 345 HIS C CD2 1 ATOM 9252 C CE1 . HIS C 1 286 ? 23.202 24.683 26.635 1.00 71.82 ? 345 HIS C CE1 1 ATOM 9253 N NE2 . HIS C 1 286 ? 23.938 24.871 27.715 1.00 67.95 ? 345 HIS C NE2 1 ATOM 9254 N N . GLY C 1 287 ? 20.969 30.679 25.869 1.00 35.20 ? 346 GLY C N 1 ATOM 9255 C CA . GLY C 1 287 ? 20.086 31.829 25.929 1.00 48.67 ? 346 GLY C CA 1 ATOM 9256 C C . GLY C 1 287 ? 20.232 32.818 24.790 1.00 52.32 ? 346 GLY C C 1 ATOM 9257 O O . GLY C 1 287 ? 20.511 32.446 23.649 1.00 43.79 ? 346 GLY C O 1 ATOM 9258 N N . ARG C 1 288 ? 20.039 34.093 25.115 1.00 42.46 ? 347 ARG C N 1 ATOM 9259 C CA . ARG C 1 288 ? 20.063 35.173 24.134 1.00 55.03 ? 347 ARG C CA 1 ATOM 9260 C C . ARG C 1 288 ? 21.227 36.131 24.372 1.00 56.79 ? 347 ARG C C 1 ATOM 9261 O O . ARG C 1 288 ? 21.476 37.025 23.564 1.00 58.80 ? 347 ARG C O 1 ATOM 9262 C CB . ARG C 1 288 ? 18.742 35.946 24.171 1.00 45.21 ? 347 ARG C CB 1 ATOM 9263 C CG . ARG C 1 288 ? 18.465 36.613 25.512 1.00 38.82 ? 347 ARG C CG 1 ATOM 9264 C CD . ARG C 1 288 ? 17.249 37.526 25.454 1.00 41.76 ? 347 ARG C CD 1 ATOM 9265 N NE . ARG C 1 288 ? 17.463 38.684 24.591 1.00 51.04 ? 347 ARG C NE 1 ATOM 9266 C CZ . ARG C 1 288 ? 16.596 39.102 23.674 1.00 53.25 ? 347 ARG C CZ 1 ATOM 9267 N NH1 . ARG C 1 288 ? 15.451 38.457 23.497 1.00 53.39 ? 347 ARG C NH1 1 ATOM 9268 N NH2 . ARG C 1 288 ? 16.874 40.166 22.932 1.00 49.74 ? 347 ARG C NH2 1 ATOM 9269 N N . ARG C 1 289 ? 21.921 35.943 25.492 1.00 47.70 ? 348 ARG C N 1 ATOM 9270 C CA . ARG C 1 289 ? 22.994 36.840 25.918 1.00 46.75 ? 348 ARG C CA 1 ATOM 9271 C C . ARG C 1 289 ? 24.060 37.080 24.851 1.00 47.36 ? 348 ARG C C 1 ATOM 9272 O O . ARG C 1 289 ? 24.417 38.224 24.569 1.00 47.81 ? 348 ARG C O 1 ATOM 9273 C CB . ARG C 1 289 ? 23.664 36.288 27.179 1.00 37.10 ? 348 ARG C CB 1 ATOM 9274 C CG . ARG C 1 289 ? 23.782 37.289 28.313 1.00 51.53 ? 348 ARG C CG 1 ATOM 9275 C CD . ARG C 1 289 ? 22.493 37.372 29.110 1.00 60.61 ? 348 ARG C CD 1 ATOM 9276 N NE . ARG C 1 289 ? 22.652 36.822 30.453 1.00 76.05 ? 348 ARG C NE 1 ATOM 9277 C CZ . ARG C 1 289 ? 22.934 37.550 31.528 1.00 98.35 ? 348 ARG C CZ 1 ATOM 9278 N NH1 . ARG C 1 289 ? 23.083 38.864 31.420 1.00 112.41 ? 348 ARG C NH1 1 ATOM 9279 N NH2 . ARG C 1 289 ? 23.063 36.968 32.713 1.00 98.96 ? 348 ARG C NH2 1 ATOM 9280 N N . LEU C 1 290 ? 24.564 36.000 24.261 1.00 51.68 ? 349 LEU C N 1 ATOM 9281 C CA . LEU C 1 290 ? 25.604 36.102 23.243 1.00 42.60 ? 349 LEU C CA 1 ATOM 9282 C C . LEU C 1 290 ? 25.072 36.754 21.971 1.00 49.17 ? 349 LEU C C 1 ATOM 9283 O O . LEU C 1 290 ? 25.770 37.538 21.327 1.00 67.33 ? 349 LEU C O 1 ATOM 9284 C CB . LEU C 1 290 ? 26.191 34.724 22.931 1.00 53.57 ? 349 LEU C CB 1 ATOM 9285 C CG . LEU C 1 290 ? 27.483 34.728 22.113 1.00 53.36 ? 349 LEU C CG 1 ATOM 9286 C CD1 . LEU C 1 290 ? 28.518 35.631 22.759 1.00 52.54 ? 349 LEU C CD1 1 ATOM 9287 C CD2 . LEU C 1 290 ? 28.027 33.317 21.974 1.00 51.48 ? 349 LEU C CD2 1 ATOM 9288 N N . LEU C 1 291 ? 23.834 36.426 21.612 1.00 56.29 ? 350 LEU C N 1 ATOM 9289 C CA . LEU C 1 291 ? 23.189 37.028 20.450 1.00 49.20 ? 350 LEU C CA 1 ATOM 9290 C C . LEU C 1 291 ? 22.993 38.530 20.642 1.00 58.07 ? 350 LEU C C 1 ATOM 9291 O O . LEU C 1 291 ? 23.088 39.304 19.688 1.00 53.05 ? 350 LEU C O 1 ATOM 9292 C CB . LEU C 1 291 ? 21.843 36.355 20.176 1.00 35.52 ? 350 LEU C CB 1 ATOM 9293 C CG . LEU C 1 291 ? 21.901 34.977 19.513 1.00 53.76 ? 350 LEU C CG 1 ATOM 9294 C CD1 . LEU C 1 291 ? 20.524 34.330 19.493 1.00 42.04 ? 350 LEU C CD1 1 ATOM 9295 C CD2 . LEU C 1 291 ? 22.476 35.081 18.109 1.00 41.14 ? 350 LEU C CD2 1 ATOM 9296 N N . ASP C 1 292 ? 22.720 38.935 21.878 1.00 46.77 ? 351 ASP C N 1 ATOM 9297 C CA . ASP C 1 292 ? 22.613 40.351 22.216 1.00 48.03 ? 351 ASP C CA 1 ATOM 9298 C C . ASP C 1 292 ? 23.965 41.041 22.064 1.00 50.90 ? 351 ASP C C 1 ATOM 9299 O O . ASP C 1 292 ? 24.057 42.135 21.506 1.00 48.60 ? 351 ASP C O 1 ATOM 9300 C CB . ASP C 1 292 ? 22.083 40.532 23.638 1.00 33.81 ? 351 ASP C CB 1 ATOM 9301 C CG . ASP C 1 292 ? 20.624 40.140 23.772 1.00 48.84 ? 351 ASP C CG 1 ATOM 9302 O OD1 . ASP C 1 292 ? 19.930 40.065 22.736 1.00 37.05 ? 351 ASP C OD1 1 ATOM 9303 O OD2 . ASP C 1 292 ? 20.171 39.912 24.914 1.00 54.98 ? 351 ASP C OD2 1 ATOM 9304 N N . LEU C 1 293 ? 25.005 40.392 22.580 1.00 43.72 ? 352 LEU C N 1 ATOM 9305 C CA . LEU C 1 293 ? 26.366 40.914 22.515 1.00 36.69 ? 352 LEU C CA 1 ATOM 9306 C C . LEU C 1 293 ? 26.821 41.139 21.075 1.00 40.22 ? 352 LEU C C 1 ATOM 9307 O O . LEU C 1 293 ? 27.503 42.117 20.776 1.00 39.01 ? 352 LEU C O 1 ATOM 9308 C CB . LEU C 1 293 ? 27.331 39.967 23.230 1.00 40.99 ? 352 LEU C CB 1 ATOM 9309 C CG . LEU C 1 293 ? 28.777 40.441 23.385 1.00 35.85 ? 352 LEU C CG 1 ATOM 9310 C CD1 . LEU C 1 293 ? 29.251 40.249 24.814 1.00 45.39 ? 352 LEU C CD1 1 ATOM 9311 C CD2 . LEU C 1 293 ? 29.685 39.701 22.418 1.00 42.67 ? 352 LEU C CD2 1 ATOM 9312 N N . VAL C 1 294 ? 26.447 40.225 20.186 1.00 36.64 ? 353 VAL C N 1 ATOM 9313 C CA . VAL C 1 294 ? 26.774 40.367 18.773 1.00 43.02 ? 353 VAL C CA 1 ATOM 9314 C C . VAL C 1 294 ? 25.998 41.535 18.171 1.00 44.54 ? 353 VAL C C 1 ATOM 9315 O O . VAL C 1 294 ? 26.548 42.331 17.409 1.00 44.04 ? 353 VAL C O 1 ATOM 9316 C CB . VAL C 1 294 ? 26.471 39.075 17.986 1.00 33.10 ? 353 VAL C CB 1 ATOM 9317 C CG1 . VAL C 1 294 ? 26.639 39.304 16.494 1.00 33.08 ? 353 VAL C CG1 1 ATOM 9318 C CG2 . VAL C 1 294 ? 27.382 37.952 18.450 1.00 37.70 ? 353 VAL C CG2 1 ATOM 9319 N N . ASP C 1 295 ? 24.723 41.640 18.531 1.00 46.31 ? 354 ASP C N 1 ATOM 9320 C CA . ASP C 1 295 ? 23.868 42.722 18.048 1.00 40.78 ? 354 ASP C CA 1 ATOM 9321 C C . ASP C 1 295 ? 24.388 44.097 18.456 1.00 53.39 ? 354 ASP C C 1 ATOM 9322 O O . ASP C 1 295 ? 24.450 45.015 17.637 1.00 40.52 ? 354 ASP C O 1 ATOM 9323 C CB . ASP C 1 295 ? 22.438 42.546 18.566 1.00 36.35 ? 354 ASP C CB 1 ATOM 9324 C CG . ASP C 1 295 ? 21.558 41.774 17.603 1.00 52.63 ? 354 ASP C CG 1 ATOM 9325 O OD1 . ASP C 1 295 ? 22.003 41.517 16.466 1.00 44.04 ? 354 ASP C OD1 1 ATOM 9326 O OD2 . ASP C 1 295 ? 20.417 41.435 17.979 1.00 45.46 ? 354 ASP C OD2 1 ATOM 9327 N N . ILE C 1 296 ? 24.764 44.232 19.723 1.00 34.09 ? 355 ILE C N 1 ATOM 9328 C CA . ILE C 1 296 ? 25.186 45.518 20.264 1.00 48.72 ? 355 ILE C CA 1 ATOM 9329 C C . ILE C 1 296 ? 26.566 45.930 19.739 1.00 59.09 ? 355 ILE C C 1 ATOM 9330 O O . ILE C 1 296 ? 26.846 47.120 19.589 1.00 32.15 ? 355 ILE C O 1 ATOM 9331 C CB . ILE C 1 296 ? 25.182 45.497 21.816 1.00 35.22 ? 355 ILE C CB 1 ATOM 9332 C CG1 . ILE C 1 296 ? 25.301 46.910 22.385 1.00 41.90 ? 355 ILE C CG1 1 ATOM 9333 C CG2 . ILE C 1 296 ? 26.272 44.587 22.366 1.00 47.40 ? 355 ILE C CG2 1 ATOM 9334 C CD1 . ILE C 1 296 ? 25.150 46.960 23.887 1.00 40.75 ? 355 ILE C CD1 1 ATOM 9335 N N . HIS C 1 297 ? 27.422 44.951 19.454 1.00 38.99 ? 356 HIS C N 1 ATOM 9336 C CA . HIS C 1 297 ? 28.734 45.236 18.881 1.00 33.25 ? 356 HIS C CA 1 ATOM 9337 C C . HIS C 1 297 ? 28.628 45.568 17.397 1.00 36.35 ? 356 HIS C C 1 ATOM 9338 O O . HIS C 1 297 ? 29.482 46.263 16.846 1.00 38.29 ? 356 HIS C O 1 ATOM 9339 C CB . HIS C 1 297 ? 29.693 44.065 19.100 1.00 31.86 ? 356 HIS C CB 1 ATOM 9340 C CG . HIS C 1 297 ? 30.464 44.151 20.380 1.00 42.78 ? 356 HIS C CG 1 ATOM 9341 N ND1 . HIS C 1 297 ? 31.768 44.592 20.434 1.00 31.33 ? 356 HIS C ND1 1 ATOM 9342 C CD2 . HIS C 1 297 ? 30.111 43.863 21.655 1.00 31.71 ? 356 HIS C CD2 1 ATOM 9343 C CE1 . HIS C 1 297 ? 32.188 44.568 21.687 1.00 38.61 ? 356 HIS C CE1 1 ATOM 9344 N NE2 . HIS C 1 297 ? 31.201 44.130 22.447 1.00 39.32 ? 356 HIS C NE2 1 ATOM 9345 N N . ILE C 1 298 ? 27.581 45.065 16.751 1.00 35.43 ? 357 ILE C N 1 ATOM 9346 C CA . ILE C 1 298 ? 27.291 45.444 15.375 1.00 44.42 ? 357 ILE C CA 1 ATOM 9347 C C . ILE C 1 298 ? 26.908 46.920 15.356 1.00 53.78 ? 357 ILE C C 1 ATOM 9348 O O . ILE C 1 298 ? 27.330 47.679 14.483 1.00 44.92 ? 357 ILE C O 1 ATOM 9349 C CB . ILE C 1 298 ? 26.159 44.586 14.767 1.00 32.71 ? 357 ILE C CB 1 ATOM 9350 C CG1 . ILE C 1 298 ? 26.690 43.207 14.367 1.00 34.28 ? 357 ILE C CG1 1 ATOM 9351 C CG2 . ILE C 1 298 ? 25.540 45.275 13.560 1.00 38.97 ? 357 ILE C CG2 1 ATOM 9352 C CD1 . ILE C 1 298 ? 25.630 42.284 13.804 1.00 35.56 ? 357 ILE C CD1 1 ATOM 9353 N N . LEU C 1 299 ? 26.118 47.319 16.348 1.00 40.59 ? 358 LEU C N 1 ATOM 9354 C CA . LEU C 1 299 ? 25.718 48.709 16.515 1.00 40.98 ? 358 LEU C CA 1 ATOM 9355 C C . LEU C 1 299 ? 26.925 49.594 16.811 1.00 56.61 ? 358 LEU C C 1 ATOM 9356 O O . LEU C 1 299 ? 27.103 50.647 16.197 1.00 31.86 ? 358 LEU C O 1 ATOM 9357 C CB . LEU C 1 299 ? 24.688 48.834 17.639 1.00 32.49 ? 358 LEU C CB 1 ATOM 9358 C CG . LEU C 1 299 ? 24.170 50.239 17.952 1.00 32.44 ? 358 LEU C CG 1 ATOM 9359 C CD1 . LEU C 1 299 ? 23.337 50.774 16.799 1.00 38.38 ? 358 LEU C CD1 1 ATOM 9360 C CD2 . LEU C 1 299 ? 23.368 50.238 19.243 1.00 38.67 ? 358 LEU C CD2 1 ATOM 9361 N N . ASP C 1 300 ? 27.749 49.156 17.759 1.00 36.75 ? 359 ASP C N 1 ATOM 9362 C CA . ASP C 1 300 ? 28.932 49.905 18.171 1.00 31.49 ? 359 ASP C CA 1 ATOM 9363 C C . ASP C 1 300 ? 29.949 50.072 17.044 1.00 43.64 ? 359 ASP C C 1 ATOM 9364 O O . ASP C 1 300 ? 30.620 51.099 16.956 1.00 35.07 ? 359 ASP C O 1 ATOM 9365 C CB . ASP C 1 300 ? 29.600 49.225 19.368 1.00 31.38 ? 359 ASP C CB 1 ATOM 9366 C CG . ASP C 1 300 ? 28.827 49.419 20.656 1.00 36.68 ? 359 ASP C CG 1 ATOM 9367 O OD1 . ASP C 1 300 ? 27.989 50.343 20.717 1.00 38.05 ? 359 ASP C OD1 1 ATOM 9368 O OD2 . ASP C 1 300 ? 29.061 48.649 21.611 1.00 37.08 ? 359 ASP C OD2 1 ATOM 9369 N N . TYR C 1 301 ? 30.062 49.064 16.186 1.00 34.52 ? 360 TYR C N 1 ATOM 9370 C CA . TYR C 1 301 ? 31.002 49.125 15.072 1.00 37.52 ? 360 TYR C CA 1 ATOM 9371 C C . TYR C 1 301 ? 30.527 50.112 14.013 1.00 38.19 ? 360 TYR C C 1 ATOM 9372 O O . TYR C 1 301 ? 31.329 50.823 13.410 1.00 31.10 ? 360 TYR C O 1 ATOM 9373 C CB . TYR C 1 301 ? 31.200 47.740 14.452 1.00 37.74 ? 360 TYR C CB 1 ATOM 9374 C CG . TYR C 1 301 ? 32.099 47.740 13.237 1.00 47.45 ? 360 TYR C CG 1 ATOM 9375 C CD1 . TYR C 1 301 ? 33.466 47.954 13.362 1.00 45.06 ? 360 TYR C CD1 1 ATOM 9376 C CD2 . TYR C 1 301 ? 31.584 47.522 11.965 1.00 43.65 ? 360 TYR C CD2 1 ATOM 9377 C CE1 . TYR C 1 301 ? 34.293 47.956 12.256 1.00 36.00 ? 360 TYR C CE1 1 ATOM 9378 C CE2 . TYR C 1 301 ? 32.405 47.521 10.852 1.00 37.38 ? 360 TYR C CE2 1 ATOM 9379 C CZ . TYR C 1 301 ? 33.758 47.738 11.004 1.00 49.15 ? 360 TYR C CZ 1 ATOM 9380 O OH . TYR C 1 301 ? 34.580 47.738 9.902 1.00 41.83 ? 360 TYR C OH 1 ATOM 9381 N N . LEU C 1 302 ? 29.218 50.146 13.789 1.00 44.83 ? 361 LEU C N 1 ATOM 9382 C CA . LEU C 1 302 ? 28.624 51.074 12.835 1.00 32.86 ? 361 LEU C CA 1 ATOM 9383 C C . LEU C 1 302 ? 28.813 52.520 13.285 1.00 50.24 ? 361 LEU C C 1 ATOM 9384 O O . LEU C 1 302 ? 28.964 53.423 12.461 1.00 48.60 ? 361 LEU C O 1 ATOM 9385 C CB . LEU C 1 302 ? 27.137 50.768 12.646 1.00 31.97 ? 361 LEU C CB 1 ATOM 9386 C CG . LEU C 1 302 ? 26.797 49.523 11.820 1.00 50.44 ? 361 LEU C CG 1 ATOM 9387 C CD1 . LEU C 1 302 ? 25.330 49.153 11.980 1.00 32.53 ? 361 LEU C CD1 1 ATOM 9388 C CD2 . LEU C 1 302 ? 27.142 49.731 10.353 1.00 32.15 ? 361 LEU C CD2 1 ATOM 9389 N N . ILE C 1 303 ? 28.803 52.733 14.598 1.00 39.00 ? 362 ILE C N 1 ATOM 9390 C CA . ILE C 1 303 ? 28.921 54.074 15.160 1.00 34.76 ? 362 ILE C CA 1 ATOM 9391 C C . ILE C 1 303 ? 30.328 54.367 15.677 1.00 46.29 ? 362 ILE C C 1 ATOM 9392 O O . ILE C 1 303 ? 30.623 55.489 16.087 1.00 39.47 ? 362 ILE C O 1 ATOM 9393 C CB . ILE C 1 303 ? 27.918 54.283 16.310 1.00 31.44 ? 362 ILE C CB 1 ATOM 9394 C CG1 . ILE C 1 303 ? 28.300 53.416 17.511 1.00 31.30 ? 362 ILE C CG1 1 ATOM 9395 C CG2 . ILE C 1 303 ? 26.511 53.957 15.849 1.00 31.65 ? 362 ILE C CG2 1 ATOM 9396 C CD1 . ILE C 1 303 ? 27.221 53.323 18.570 1.00 36.21 ? 362 ILE C CD1 1 ATOM 9397 N N . GLY C 1 304 ? 31.191 53.356 15.655 1.00 30.82 ? 363 GLY C N 1 ATOM 9398 C CA . GLY C 1 304 ? 32.562 53.513 16.109 1.00 30.54 ? 363 GLY C CA 1 ATOM 9399 C C . GLY C 1 304 ? 32.707 53.664 17.613 1.00 30.44 ? 363 GLY C C 1 ATOM 9400 O O . GLY C 1 304 ? 33.661 54.278 18.090 1.00 41.85 ? 363 GLY C O 1 ATOM 9401 N N . ASN C 1 305 ? 31.761 53.105 18.363 1.00 45.18 ? 364 ASN C N 1 ATOM 9402 C CA . ASN C 1 305 ? 31.803 53.156 19.821 1.00 31.30 ? 364 ASN C CA 1 ATOM 9403 C C . ASN C 1 305 ? 32.729 52.097 20.417 1.00 39.62 ? 364 ASN C C 1 ATOM 9404 O O . ASN C 1 305 ? 32.491 50.898 20.267 1.00 30.63 ? 364 ASN C O 1 ATOM 9405 C CB . ASN C 1 305 ? 30.395 52.993 20.398 1.00 34.07 ? 364 ASN C CB 1 ATOM 9406 C CG . ASN C 1 305 ? 30.383 52.969 21.914 1.00 30.79 ? 364 ASN C CG 1 ATOM 9407 O OD1 . ASN C 1 305 ? 31.218 53.598 22.565 1.00 30.56 ? 364 ASN C OD1 1 ATOM 9408 N ND2 . ASN C 1 305 ? 29.435 52.236 22.486 1.00 36.23 ? 364 ASN C ND2 1 ATOM 9409 N N . GLN C 1 306 ? 33.781 52.547 21.095 1.00 30.22 ? 365 GLN C N 1 ATOM 9410 C CA . GLN C 1 306 ? 34.758 51.637 21.687 1.00 49.38 ? 365 GLN C CA 1 ATOM 9411 C C . GLN C 1 306 ? 34.541 51.417 23.184 1.00 35.72 ? 365 GLN C C 1 ATOM 9412 O O . GLN C 1 306 ? 35.149 50.527 23.778 1.00 35.47 ? 365 GLN C O 1 ATOM 9413 C CB . GLN C 1 306 ? 36.179 52.161 21.458 1.00 32.70 ? 365 GLN C CB 1 ATOM 9414 C CG . GLN C 1 306 ? 36.564 52.345 20.000 1.00 35.55 ? 365 GLN C CG 1 ATOM 9415 C CD . GLN C 1 306 ? 37.953 52.938 19.844 1.00 45.04 ? 365 GLN C CD 1 ATOM 9416 O OE1 . GLN C 1 306 ? 38.282 53.947 20.467 1.00 29.33 ? 365 GLN C OE1 1 ATOM 9417 N NE2 . GLN C 1 306 ? 38.778 52.306 19.017 1.00 29.41 ? 365 GLN C NE2 1 ATOM 9418 N N . ASP C 1 307 ? 33.672 52.221 23.789 1.00 38.89 ? 366 ASP C N 1 ATOM 9419 C CA . ASP C 1 307 ? 33.589 52.291 25.247 1.00 38.80 ? 366 ASP C CA 1 ATOM 9420 C C . ASP C 1 307 ? 32.516 51.377 25.843 1.00 35.71 ? 366 ASP C C 1 ATOM 9421 O O . ASP C 1 307 ? 31.869 51.733 26.827 1.00 57.72 ? 366 ASP C O 1 ATOM 9422 C CB . ASP C 1 307 ? 33.336 53.736 25.686 1.00 38.90 ? 366 ASP C CB 1 ATOM 9423 C CG . ASP C 1 307 ? 33.762 53.995 27.120 1.00 37.95 ? 366 ASP C CG 1 ATOM 9424 O OD1 . ASP C 1 307 ? 34.629 53.253 27.626 1.00 41.39 ? 366 ASP C OD1 1 ATOM 9425 O OD2 . ASP C 1 307 ? 33.229 54.939 27.741 1.00 52.06 ? 366 ASP C OD2 1 ATOM 9426 N N . ARG C 1 308 ? 32.324 50.206 25.244 1.00 31.96 ? 367 ARG C N 1 ATOM 9427 C CA . ARG C 1 308 ? 31.337 49.252 25.744 1.00 30.84 ? 367 ARG C CA 1 ATOM 9428 C C . ARG C 1 308 ? 31.979 48.307 26.760 1.00 45.26 ? 367 ARG C C 1 ATOM 9429 O O . ARG C 1 308 ? 32.313 47.167 26.435 1.00 51.75 ? 367 ARG C O 1 ATOM 9430 C CB . ARG C 1 308 ? 30.722 48.453 24.594 1.00 36.61 ? 367 ARG C CB 1 ATOM 9431 C CG . ARG C 1 308 ? 29.518 47.611 24.994 1.00 34.52 ? 367 ARG C CG 1 ATOM 9432 C CD . ARG C 1 308 ? 28.301 48.478 25.281 1.00 31.53 ? 367 ARG C CD 1 ATOM 9433 N NE . ARG C 1 308 ? 27.816 49.134 24.070 1.00 44.19 ? 367 ARG C NE 1 ATOM 9434 C CZ . ARG C 1 308 ? 26.770 49.951 24.027 1.00 44.16 ? 367 ARG C CZ 1 ATOM 9435 N NH1 . ARG C 1 308 ? 26.085 50.217 25.131 1.00 37.40 ? 367 ARG C NH1 1 ATOM 9436 N NH2 . ARG C 1 308 ? 26.403 50.497 22.876 1.00 42.23 ? 367 ARG C NH2 1 ATOM 9437 N N . HIS C 1 309 ? 32.149 48.784 27.989 1.00 39.00 ? 368 HIS C N 1 ATOM 9438 C CA . HIS C 1 309 ? 32.821 48.000 29.023 1.00 39.31 ? 368 HIS C CA 1 ATOM 9439 C C . HIS C 1 309 ? 31.847 47.203 29.890 1.00 38.53 ? 368 HIS C C 1 ATOM 9440 O O . HIS C 1 309 ? 32.202 46.156 30.431 1.00 30.82 ? 368 HIS C O 1 ATOM 9441 C CB . HIS C 1 309 ? 33.676 48.914 29.902 1.00 30.30 ? 368 HIS C CB 1 ATOM 9442 C CG . HIS C 1 309 ? 32.942 50.104 30.437 1.00 49.91 ? 368 HIS C CG 1 ATOM 9443 N ND1 . HIS C 1 309 ? 32.204 50.063 31.600 1.00 46.47 ? 368 HIS C ND1 1 ATOM 9444 C CD2 . HIS C 1 309 ? 32.841 51.372 29.971 1.00 33.60 ? 368 HIS C CD2 1 ATOM 9445 C CE1 . HIS C 1 309 ? 31.676 51.253 31.826 1.00 31.33 ? 368 HIS C CE1 1 ATOM 9446 N NE2 . HIS C 1 309 ? 32.047 52.065 30.853 1.00 42.03 ? 368 HIS C NE2 1 ATOM 9447 N N . HIS C 1 310 ? 30.623 47.703 30.023 1.00 58.06 ? 369 HIS C N 1 ATOM 9448 C CA . HIS C 1 310 ? 29.591 47.017 30.796 1.00 31.26 ? 369 HIS C CA 1 ATOM 9449 C C . HIS C 1 310 ? 28.275 46.943 30.035 1.00 37.41 ? 369 HIS C C 1 ATOM 9450 O O . HIS C 1 310 ? 28.045 47.705 29.097 1.00 35.34 ? 369 HIS C O 1 ATOM 9451 C CB . HIS C 1 310 ? 29.351 47.706 32.144 1.00 45.13 ? 369 HIS C CB 1 ATOM 9452 C CG . HIS C 1 310 ? 30.318 47.310 33.216 1.00 58.80 ? 369 HIS C CG 1 ATOM 9453 N ND1 . HIS C 1 310 ? 31.679 47.498 33.107 1.00 75.56 ? 369 HIS C ND1 1 ATOM 9454 C CD2 . HIS C 1 310 ? 30.115 46.719 34.417 1.00 70.72 ? 369 HIS C CD2 1 ATOM 9455 C CE1 . HIS C 1 310 ? 32.270 47.050 34.201 1.00 74.87 ? 369 HIS C CE1 1 ATOM 9456 N NE2 . HIS C 1 310 ? 31.345 46.572 35.011 1.00 75.30 ? 369 HIS C NE2 1 ATOM 9457 N N . PHE C 1 311 ? 27.417 46.015 30.441 1.00 51.17 ? 370 PHE C N 1 ATOM 9458 C CA . PHE C 1 311 ? 26.077 45.926 29.884 1.00 42.83 ? 370 PHE C CA 1 ATOM 9459 C C . PHE C 1 311 ? 25.046 46.244 30.958 1.00 45.21 ? 370 PHE C C 1 ATOM 9460 O O . PHE C 1 311 ? 25.256 45.962 32.137 1.00 48.53 ? 370 PHE C O 1 ATOM 9461 C CB . PHE C 1 311 ? 25.813 44.537 29.298 1.00 41.27 ? 370 PHE C CB 1 ATOM 9462 C CG . PHE C 1 311 ? 26.704 44.184 28.143 1.00 50.48 ? 370 PHE C CG 1 ATOM 9463 C CD1 . PHE C 1 311 ? 26.535 44.791 26.909 1.00 51.14 ? 370 PHE C CD1 1 ATOM 9464 C CD2 . PHE C 1 311 ? 27.696 43.229 28.283 1.00 44.39 ? 370 PHE C CD2 1 ATOM 9465 C CE1 . PHE C 1 311 ? 27.350 44.465 25.843 1.00 55.46 ? 370 PHE C CE1 1 ATOM 9466 C CE2 . PHE C 1 311 ? 28.512 42.896 27.218 1.00 41.92 ? 370 PHE C CE2 1 ATOM 9467 C CZ . PHE C 1 311 ? 28.340 43.517 25.997 1.00 44.81 ? 370 PHE C CZ 1 ATOM 9468 N N . GLU C 1 312 ? 23.934 46.838 30.543 1.00 48.79 ? 371 GLU C N 1 ATOM 9469 C CA . GLU C 1 312 ? 22.863 47.183 31.466 1.00 32.97 ? 371 GLU C CA 1 ATOM 9470 C C . GLU C 1 312 ? 21.595 46.456 31.038 1.00 47.14 ? 371 GLU C C 1 ATOM 9471 O O . GLU C 1 312 ? 21.268 46.418 29.852 1.00 35.71 ? 371 GLU C O 1 ATOM 9472 C CB . GLU C 1 312 ? 22.645 48.697 31.505 1.00 40.76 ? 371 GLU C CB 1 ATOM 9473 C CG . GLU C 1 312 ? 21.719 49.169 32.614 1.00 56.01 ? 371 GLU C CG 1 ATOM 9474 C CD . GLU C 1 312 ? 22.457 49.431 33.914 1.00 64.80 ? 371 GLU C CD 1 ATOM 9475 O OE1 . GLU C 1 312 ? 23.672 49.145 33.977 1.00 63.95 ? 371 GLU C OE1 1 ATOM 9476 O OE2 . GLU C 1 312 ? 21.823 49.921 34.871 1.00 73.09 ? 371 GLU C OE2 1 ATOM 9477 N N . SER C 1 313 ? 20.884 45.876 31.999 1.00 53.76 ? 372 SER C N 1 ATOM 9478 C CA . SER C 1 313 ? 19.695 45.092 31.688 1.00 50.95 ? 372 SER C CA 1 ATOM 9479 C C . SER C 1 313 ? 18.640 45.183 32.782 1.00 54.32 ? 372 SER C C 1 ATOM 9480 O O . SER C 1 313 ? 18.968 45.291 33.961 1.00 45.79 ? 372 SER C O 1 ATOM 9481 C CB . SER C 1 313 ? 20.074 43.627 31.460 1.00 44.01 ? 372 SER C CB 1 ATOM 9482 O OG . SER C 1 313 ? 20.823 43.121 32.550 1.00 54.92 ? 372 SER C OG 1 ATOM 9483 N N . PHE C 1 314 ? 17.373 45.135 32.383 1.00 62.89 ? 373 PHE C N 1 ATOM 9484 C CA . PHE C 1 314 ? 16.270 45.072 33.336 1.00 54.10 ? 373 PHE C CA 1 ATOM 9485 C C . PHE C 1 314 ? 16.236 43.728 34.056 1.00 61.90 ? 373 PHE C C 1 ATOM 9486 O O . PHE C 1 314 ? 16.545 42.690 33.468 1.00 62.67 ? 373 PHE C O 1 ATOM 9487 C CB . PHE C 1 314 ? 14.932 45.311 32.632 1.00 37.08 ? 373 PHE C CB 1 ATOM 9488 C CG . PHE C 1 314 ? 14.792 46.682 32.034 1.00 37.58 ? 373 PHE C CG 1 ATOM 9489 C CD1 . PHE C 1 314 ? 14.796 47.809 32.839 1.00 39.38 ? 373 PHE C CD1 1 ATOM 9490 C CD2 . PHE C 1 314 ? 14.643 46.842 30.667 1.00 34.55 ? 373 PHE C CD2 1 ATOM 9491 C CE1 . PHE C 1 314 ? 14.660 49.070 32.291 1.00 42.89 ? 373 PHE C CE1 1 ATOM 9492 C CE2 . PHE C 1 314 ? 14.507 48.099 30.113 1.00 45.65 ? 373 PHE C CE2 1 ATOM 9493 C CZ . PHE C 1 314 ? 14.516 49.215 30.926 1.00 43.69 ? 373 PHE C CZ 1 ATOM 9494 N N . ASN C 1 315 ? 15.863 43.754 35.331 1.00 67.42 ? 374 ASN C N 1 ATOM 9495 C CA . ASN C 1 315 ? 15.700 42.533 36.109 1.00 67.59 ? 374 ASN C CA 1 ATOM 9496 C C . ASN C 1 315 ? 14.342 42.486 36.806 1.00 62.62 ? 374 ASN C C 1 ATOM 9497 O O . ASN C 1 315 ? 14.259 42.601 38.029 1.00 61.86 ? 374 ASN C O 1 ATOM 9498 C CB . ASN C 1 315 ? 16.824 42.403 37.139 1.00 66.33 ? 374 ASN C CB 1 ATOM 9499 C CG . ASN C 1 315 ? 16.901 41.016 37.745 1.00 62.99 ? 374 ASN C CG 1 ATOM 9500 O OD1 . ASN C 1 315 ? 16.407 40.046 37.169 1.00 65.49 ? 374 ASN C OD1 1 ATOM 9501 N ND2 . ASN C 1 315 ? 17.515 40.917 38.917 1.00 50.25 ? 374 ASN C ND2 1 ATOM 9502 N N . VAL C 1 316 ? 13.281 42.321 36.023 1.00 50.93 ? 375 VAL C N 1 ATOM 9503 C CA . VAL C 1 316 ? 11.921 42.474 36.529 1.00 77.71 ? 375 VAL C CA 1 ATOM 9504 C C . VAL C 1 316 ? 11.023 41.338 36.029 1.00 78.50 ? 375 VAL C C 1 ATOM 9505 O O . VAL C 1 316 ? 10.043 40.969 36.678 1.00 83.08 ? 375 VAL C O 1 ATOM 9506 C CB . VAL C 1 316 ? 11.324 43.848 36.123 1.00 67.61 ? 375 VAL C CB 1 ATOM 9507 C CG1 . VAL C 1 316 ? 11.213 43.974 34.608 1.00 57.08 ? 375 VAL C CG1 1 ATOM 9508 C CG2 . VAL C 1 316 ? 9.975 44.080 36.796 1.00 69.81 ? 375 VAL C CG2 1 ATOM 9509 N N . PHE C 1 317 ? 11.380 40.780 34.877 1.00 71.91 ? 376 PHE C N 1 ATOM 9510 C CA . PHE C 1 317 ? 10.661 39.657 34.286 1.00 66.38 ? 376 PHE C CA 1 ATOM 9511 C C . PHE C 1 317 ? 11.177 38.334 34.851 1.00 83.95 ? 376 PHE C C 1 ATOM 9512 O O . PHE C 1 317 ? 12.290 37.910 34.540 1.00 92.92 ? 376 PHE C O 1 ATOM 9513 C CB . PHE C 1 317 ? 10.776 39.686 32.761 1.00 66.87 ? 376 PHE C CB 1 ATOM 9514 C CG . PHE C 1 317 ? 10.152 40.900 32.135 1.00 77.68 ? 376 PHE C CG 1 ATOM 9515 C CD1 . PHE C 1 317 ? 8.777 40.992 31.994 1.00 85.52 ? 376 PHE C CD1 1 ATOM 9516 C CD2 . PHE C 1 317 ? 10.938 41.950 31.690 1.00 76.42 ? 376 PHE C CD2 1 ATOM 9517 C CE1 . PHE C 1 317 ? 8.196 42.110 31.423 1.00 80.13 ? 376 PHE C CE1 1 ATOM 9518 C CE2 . PHE C 1 317 ? 10.363 43.071 31.117 1.00 79.75 ? 376 PHE C CE2 1 ATOM 9519 C CZ . PHE C 1 317 ? 8.990 43.150 30.983 1.00 84.42 ? 376 PHE C CZ 1 ATOM 9520 N N . ASN C 1 318 ? 10.357 37.698 35.684 1.00 101.46 ? 377 ASN C N 1 ATOM 9521 C CA . ASN C 1 318 ? 10.728 36.484 36.413 1.00 112.78 ? 377 ASN C CA 1 ATOM 9522 C C . ASN C 1 318 ? 11.323 35.360 35.565 1.00 106.31 ? 377 ASN C C 1 ATOM 9523 O O . ASN C 1 318 ? 12.543 35.193 35.522 1.00 94.44 ? 377 ASN C O 1 ATOM 9524 C CB . ASN C 1 318 ? 9.498 35.946 37.148 1.00 123.94 ? 377 ASN C CB 1 ATOM 9525 C CG . ASN C 1 318 ? 9.857 34.995 38.269 1.00 134.94 ? 377 ASN C CG 1 ATOM 9526 O OD1 . ASN C 1 318 ? 10.971 35.026 38.789 1.00 138.57 ? 377 ASN C OD1 1 ATOM 9527 N ND2 . ASN C 1 318 ? 8.911 34.143 38.649 1.00 134.38 ? 377 ASN C ND2 1 ATOM 9528 N N . ASP C 1 319 ? 10.463 34.583 34.915 1.00 112.30 ? 378 ASP C N 1 ATOM 9529 C CA . ASP C 1 319 ? 10.898 33.510 34.022 1.00 112.09 ? 378 ASP C CA 1 ATOM 9530 C C . ASP C 1 319 ? 11.860 34.002 32.945 1.00 101.92 ? 378 ASP C C 1 ATOM 9531 O O . ASP C 1 319 ? 13.066 33.766 33.010 1.00 112.08 ? 378 ASP C O 1 ATOM 9532 C CB . ASP C 1 319 ? 9.692 32.846 33.354 1.00 115.54 ? 378 ASP C CB 1 ATOM 9533 C CG . ASP C 1 319 ? 8.858 32.035 34.323 1.00 114.90 ? 378 ASP C CG 1 ATOM 9534 O OD1 . ASP C 1 319 ? 9.392 31.623 35.374 1.00 102.97 ? 378 ASP C OD1 1 ATOM 9535 O OD2 . ASP C 1 319 ? 7.666 31.807 34.029 1.00 127.43 ? 378 ASP C OD2 1 ATOM 9536 N N . LEU C 1 320 ? 11.272 34.650 31.944 1.00 84.43 ? 379 LEU C N 1 ATOM 9537 C CA . LEU C 1 320 ? 11.939 35.223 30.774 1.00 83.05 ? 379 LEU C CA 1 ATOM 9538 C C . LEU C 1 320 ? 13.396 35.685 30.910 1.00 70.42 ? 379 LEU C C 1 ATOM 9539 O O . LEU C 1 320 ? 13.820 36.144 31.971 1.00 58.59 ? 379 LEU C O 1 ATOM 9540 C CB . LEU C 1 320 ? 11.112 36.422 30.304 1.00 72.74 ? 379 LEU C CB 1 ATOM 9541 C CG . LEU C 1 320 ? 9.657 36.137 29.931 1.00 77.52 ? 379 LEU C CG 1 ATOM 9542 C CD1 . LEU C 1 320 ? 8.710 36.369 31.107 1.00 72.58 ? 379 LEU C CD1 1 ATOM 9543 C CD2 . LEU C 1 320 ? 9.266 36.993 28.761 1.00 79.75 ? 379 LEU C CD2 1 ATOM 9544 N N . PRO C 1 321 ? 14.161 35.580 29.809 1.00 58.90 ? 380 PRO C N 1 ATOM 9545 C CA . PRO C 1 321 ? 15.553 36.037 29.750 1.00 57.34 ? 380 PRO C CA 1 ATOM 9546 C C . PRO C 1 321 ? 15.635 37.549 29.552 1.00 51.24 ? 380 PRO C C 1 ATOM 9547 O O . PRO C 1 321 ? 14.819 38.106 28.818 1.00 61.58 ? 380 PRO C O 1 ATOM 9548 C CB . PRO C 1 321 ? 16.119 35.286 28.544 1.00 46.64 ? 380 PRO C CB 1 ATOM 9549 C CG . PRO C 1 321 ? 14.945 35.061 27.667 1.00 51.44 ? 380 PRO C CG 1 ATOM 9550 C CD . PRO C 1 321 ? 13.776 34.844 28.590 1.00 44.03 ? 380 PRO C CD 1 ATOM 9551 N N . SER C 1 322 ? 16.597 38.203 30.195 1.00 57.03 ? 381 SER C N 1 ATOM 9552 C CA . SER C 1 322 ? 16.767 39.643 30.034 1.00 50.79 ? 381 SER C CA 1 ATOM 9553 C C . SER C 1 322 ? 17.586 39.979 28.790 1.00 62.36 ? 381 SER C C 1 ATOM 9554 O O . SER C 1 322 ? 18.240 39.111 28.211 1.00 57.94 ? 381 SER C O 1 ATOM 9555 C CB . SER C 1 322 ? 17.433 40.246 31.273 1.00 49.77 ? 381 SER C CB 1 ATOM 9556 O OG . SER C 1 322 ? 18.636 39.567 31.587 1.00 55.14 ? 381 SER C OG 1 ATOM 9557 N N . TYR C 1 323 ? 17.544 41.245 28.386 1.00 57.12 ? 382 TYR C N 1 ATOM 9558 C CA . TYR C 1 323 ? 18.319 41.717 27.244 1.00 56.76 ? 382 TYR C CA 1 ATOM 9559 C C . TYR C 1 323 ? 19.146 42.939 27.624 1.00 49.16 ? 382 TYR C C 1 ATOM 9560 O O . TYR C 1 323 ? 18.809 43.655 28.565 1.00 49.36 ? 382 TYR C O 1 ATOM 9561 C CB . TYR C 1 323 ? 17.398 42.053 26.067 1.00 50.31 ? 382 TYR C CB 1 ATOM 9562 C CG . TYR C 1 323 ? 16.311 43.053 26.402 1.00 51.10 ? 382 TYR C CG 1 ATOM 9563 C CD1 . TYR C 1 323 ? 15.041 42.630 26.765 1.00 46.04 ? 382 TYR C CD1 1 ATOM 9564 C CD2 . TYR C 1 323 ? 16.557 44.421 26.356 1.00 55.56 ? 382 TYR C CD2 1 ATOM 9565 C CE1 . TYR C 1 323 ? 14.045 43.538 27.073 1.00 55.94 ? 382 TYR C CE1 1 ATOM 9566 C CE2 . TYR C 1 323 ? 15.568 45.336 26.664 1.00 61.50 ? 382 TYR C CE2 1 ATOM 9567 C CZ . TYR C 1 323 ? 14.314 44.888 27.021 1.00 55.94 ? 382 TYR C CZ 1 ATOM 9568 O OH . TYR C 1 323 ? 13.325 45.794 27.327 1.00 47.48 ? 382 TYR C OH 1 ATOM 9569 N N . ALA C 1 324 ? 20.219 43.184 26.880 1.00 48.79 ? 383 ALA C N 1 ATOM 9570 C CA . ALA C 1 324 ? 21.083 44.328 27.145 1.00 53.18 ? 383 ALA C CA 1 ATOM 9571 C C . ALA C 1 324 ? 20.442 45.622 26.658 1.00 45.34 ? 383 ALA C C 1 ATOM 9572 O O . ALA C 1 324 ? 20.052 45.733 25.497 1.00 45.63 ? 383 ALA C O 1 ATOM 9573 C CB . ALA C 1 324 ? 22.441 44.130 26.490 1.00 43.29 ? 383 ALA C CB 1 ATOM 9574 N N . ILE C 1 325 ? 20.328 46.598 27.554 1.00 44.55 ? 384 ILE C N 1 ATOM 9575 C CA . ILE C 1 325 ? 19.807 47.909 27.187 1.00 42.50 ? 384 ILE C CA 1 ATOM 9576 C C . ILE C 1 325 ? 20.872 48.717 26.455 1.00 36.55 ? 384 ILE C C 1 ATOM 9577 O O . ILE C 1 325 ? 21.961 48.941 26.981 1.00 45.69 ? 384 ILE C O 1 ATOM 9578 C CB . ILE C 1 325 ? 19.335 48.699 28.422 1.00 57.13 ? 384 ILE C CB 1 ATOM 9579 C CG1 . ILE C 1 325 ? 18.328 47.880 29.232 1.00 42.68 ? 384 ILE C CG1 1 ATOM 9580 C CG2 . ILE C 1 325 ? 18.745 50.038 28.006 1.00 45.21 ? 384 ILE C CG2 1 ATOM 9581 C CD1 . ILE C 1 325 ? 18.024 48.467 30.593 1.00 37.87 ? 384 ILE C CD1 1 ATOM 9582 N N . HIS C 1 326 ? 20.559 49.145 25.236 1.00 37.25 ? 385 HIS C N 1 ATOM 9583 C CA . HIS C 1 326 ? 21.505 49.920 24.444 1.00 34.92 ? 385 HIS C CA 1 ATOM 9584 C C . HIS C 1 326 ? 21.582 51.373 24.913 1.00 32.62 ? 385 HIS C C 1 ATOM 9585 O O . HIS C 1 326 ? 20.853 52.233 24.419 1.00 35.14 ? 385 HIS C O 1 ATOM 9586 C CB . HIS C 1 326 ? 21.118 49.865 22.966 1.00 32.96 ? 385 HIS C CB 1 ATOM 9587 C CG . HIS C 1 326 ? 21.144 48.484 22.388 1.00 42.45 ? 385 HIS C CG 1 ATOM 9588 N ND1 . HIS C 1 326 ? 20.656 48.192 21.132 1.00 45.15 ? 385 HIS C ND1 1 ATOM 9589 C CD2 . HIS C 1 326 ? 21.598 47.313 22.895 1.00 52.94 ? 385 HIS C CD2 1 ATOM 9590 C CE1 . HIS C 1 326 ? 20.808 46.902 20.891 1.00 33.44 ? 385 HIS C CE1 1 ATOM 9591 N NE2 . HIS C 1 326 ? 21.377 46.346 21.944 1.00 49.51 ? 385 HIS C NE2 1 ATOM 9592 N N . LEU C 1 327 ? 22.467 51.638 25.870 1.00 48.20 ? 386 LEU C N 1 ATOM 9593 C CA . LEU C 1 327 ? 22.618 52.975 26.442 1.00 41.87 ? 386 LEU C CA 1 ATOM 9594 C C . LEU C 1 327 ? 24.071 53.453 26.382 1.00 45.33 ? 386 LEU C C 1 ATOM 9595 O O . LEU C 1 327 ? 24.955 52.712 25.952 1.00 41.21 ? 386 LEU C O 1 ATOM 9596 C CB . LEU C 1 327 ? 22.088 53.015 27.882 1.00 44.46 ? 386 LEU C CB 1 ATOM 9597 C CG . LEU C 1 327 ? 22.247 51.839 28.853 1.00 58.46 ? 386 LEU C CG 1 ATOM 9598 C CD1 . LEU C 1 327 ? 23.654 51.248 28.864 1.00 64.66 ? 386 LEU C CD1 1 ATOM 9599 C CD2 . LEU C 1 327 ? 21.828 52.262 30.255 1.00 58.24 ? 386 LEU C CD2 1 ATOM 9600 N N . ASP C 1 328 ? 24.301 54.687 26.827 1.00 43.50 ? 387 ASP C N 1 ATOM 9601 C CA . ASP C 1 328 ? 25.644 55.267 26.926 1.00 36.81 ? 387 ASP C CA 1 ATOM 9602 C C . ASP C 1 328 ? 26.406 55.218 25.605 1.00 42.49 ? 387 ASP C C 1 ATOM 9603 O O . ASP C 1 328 ? 27.359 54.455 25.451 1.00 42.41 ? 387 ASP C O 1 ATOM 9604 C CB . ASP C 1 328 ? 26.455 54.559 28.015 1.00 38.51 ? 387 ASP C CB 1 ATOM 9605 C CG . ASP C 1 328 ? 25.876 54.763 29.399 1.00 55.52 ? 387 ASP C CG 1 ATOM 9606 O OD1 . ASP C 1 328 ? 26.192 53.958 30.300 1.00 69.59 ? 387 ASP C OD1 1 ATOM 9607 O OD2 . ASP C 1 328 ? 25.098 55.722 29.585 1.00 71.30 ? 387 ASP C OD2 1 ATOM 9608 N N . HIS C 1 329 ? 25.973 56.045 24.659 1.00 31.23 ? 388 HIS C N 1 ATOM 9609 C CA . HIS C 1 329 ? 26.585 56.112 23.337 1.00 34.25 ? 388 HIS C CA 1 ATOM 9610 C C . HIS C 1 329 ? 27.300 57.440 23.110 1.00 45.10 ? 388 HIS C C 1 ATOM 9611 O O . HIS C 1 329 ? 27.556 57.826 21.970 1.00 31.61 ? 388 HIS C O 1 ATOM 9612 C CB . HIS C 1 329 ? 25.530 55.895 22.254 1.00 31.41 ? 388 HIS C CB 1 ATOM 9613 C CG . HIS C 1 329 ? 24.786 54.605 22.390 1.00 41.34 ? 388 HIS C CG 1 ATOM 9614 N ND1 . HIS C 1 329 ? 23.415 54.544 22.512 1.00 39.54 ? 388 HIS C ND1 1 ATOM 9615 C CD2 . HIS C 1 329 ? 25.223 53.323 22.409 1.00 36.54 ? 388 HIS C CD2 1 ATOM 9616 C CE1 . HIS C 1 329 ? 23.039 53.282 22.607 1.00 53.90 ? 388 HIS C CE1 1 ATOM 9617 N NE2 . HIS C 1 329 ? 24.117 52.520 22.547 1.00 34.95 ? 388 HIS C NE2 1 ATOM 9618 N N . GLY C 1 330 ? 27.608 58.139 24.198 1.00 30.73 ? 389 GLY C N 1 ATOM 9619 C CA . GLY C 1 330 ? 28.248 59.441 24.124 1.00 30.48 ? 389 GLY C CA 1 ATOM 9620 C C . GLY C 1 330 ? 29.579 59.469 23.393 1.00 35.50 ? 389 GLY C C 1 ATOM 9621 O O . GLY C 1 330 ? 29.958 60.497 22.830 1.00 39.98 ? 389 GLY C O 1 ATOM 9622 N N . ARG C 1 331 ? 30.292 58.347 23.398 1.00 30.26 ? 390 ARG C N 1 ATOM 9623 C CA . ARG C 1 331 ? 31.599 58.276 22.752 1.00 34.15 ? 390 ARG C CA 1 ATOM 9624 C C . ARG C 1 331 ? 31.529 57.599 21.385 1.00 30.23 ? 390 ARG C C 1 ATOM 9625 O O . ARG C 1 331 ? 32.489 56.967 20.943 1.00 37.71 ? 390 ARG C O 1 ATOM 9626 C CB . ARG C 1 331 ? 32.602 57.550 23.651 1.00 29.92 ? 390 ARG C CB 1 ATOM 9627 C CG . ARG C 1 331 ? 33.328 58.477 24.611 1.00 29.68 ? 390 ARG C CG 1 ATOM 9628 C CD . ARG C 1 331 ? 33.975 57.725 25.758 1.00 41.25 ? 390 ARG C CD 1 ATOM 9629 N NE . ARG C 1 331 ? 34.735 58.625 26.621 1.00 39.45 ? 390 ARG C NE 1 ATOM 9630 C CZ . ARG C 1 331 ? 35.246 58.282 27.799 1.00 48.74 ? 390 ARG C CZ 1 ATOM 9631 N NH1 . ARG C 1 331 ? 35.084 57.051 28.263 1.00 44.60 ? 390 ARG C NH1 1 ATOM 9632 N NH2 . ARG C 1 331 ? 35.923 59.172 28.512 1.00 44.69 ? 390 ARG C NH2 1 ATOM 9633 N N . ALA C 1 332 ? 30.385 57.734 20.723 1.00 31.80 ? 391 ALA C N 1 ATOM 9634 C CA . ALA C 1 332 ? 30.212 57.219 19.369 1.00 30.52 ? 391 ALA C CA 1 ATOM 9635 C C . ALA C 1 332 ? 30.409 58.329 18.339 1.00 34.61 ? 391 ALA C C 1 ATOM 9636 O O . ALA C 1 332 ? 30.396 59.511 18.684 1.00 39.56 ? 391 ALA C O 1 ATOM 9637 C CB . ALA C 1 332 ? 28.842 56.586 19.214 1.00 30.83 ? 391 ALA C CB 1 ATOM 9638 N N . PHE C 1 333 ? 30.597 57.936 17.081 1.00 30.47 ? 392 PHE C N 1 ATOM 9639 C CA . PHE C 1 333 ? 30.720 58.874 15.964 1.00 48.84 ? 392 PHE C CA 1 ATOM 9640 C C . PHE C 1 333 ? 31.868 59.862 16.149 1.00 34.64 ? 392 PHE C C 1 ATOM 9641 O O . PHE C 1 333 ? 31.756 61.032 15.781 1.00 33.29 ? 392 PHE C O 1 ATOM 9642 C CB . PHE C 1 333 ? 29.411 59.640 15.751 1.00 30.57 ? 392 PHE C CB 1 ATOM 9643 C CG . PHE C 1 333 ? 28.258 58.772 15.336 1.00 32.34 ? 392 PHE C CG 1 ATOM 9644 C CD1 . PHE C 1 333 ? 28.121 58.366 14.019 1.00 45.76 ? 392 PHE C CD1 1 ATOM 9645 C CD2 . PHE C 1 333 ? 27.305 58.372 16.258 1.00 45.69 ? 392 PHE C CD2 1 ATOM 9646 C CE1 . PHE C 1 333 ? 27.061 57.570 13.629 1.00 32.13 ? 392 PHE C CE1 1 ATOM 9647 C CE2 . PHE C 1 333 ? 26.241 57.577 15.874 1.00 32.41 ? 392 PHE C CE2 1 ATOM 9648 C CZ . PHE C 1 333 ? 26.119 57.176 14.557 1.00 32.60 ? 392 PHE C CZ 1 ATOM 9649 N N . GLY C 1 334 ? 32.969 59.388 16.721 1.00 44.38 ? 393 GLY C N 1 ATOM 9650 C CA . GLY C 1 334 ? 34.134 60.225 16.938 1.00 29.67 ? 393 GLY C CA 1 ATOM 9651 C C . GLY C 1 334 ? 34.997 60.371 15.698 1.00 47.47 ? 393 GLY C C 1 ATOM 9652 O O . GLY C 1 334 ? 35.690 61.375 15.532 1.00 29.39 ? 393 GLY C O 1 ATOM 9653 N N . ARG C 1 335 ? 34.961 59.367 14.826 1.00 34.76 ? 394 ARG C N 1 ATOM 9654 C CA . ARG C 1 335 ? 35.798 59.360 13.630 1.00 40.99 ? 394 ARG C CA 1 ATOM 9655 C C . ARG C 1 335 ? 34.996 58.924 12.407 1.00 45.22 ? 394 ARG C C 1 ATOM 9656 O O . ARG C 1 335 ? 34.283 57.921 12.450 1.00 54.91 ? 394 ARG C O 1 ATOM 9657 C CB . ARG C 1 335 ? 37.003 58.435 13.824 1.00 31.13 ? 394 ARG C CB 1 ATOM 9658 C CG . ARG C 1 335 ? 37.869 58.783 15.026 1.00 41.55 ? 394 ARG C CG 1 ATOM 9659 C CD . ARG C 1 335 ? 38.953 59.787 14.672 1.00 39.70 ? 394 ARG C CD 1 ATOM 9660 N NE . ARG C 1 335 ? 39.905 59.253 13.704 1.00 46.48 ? 394 ARG C NE 1 ATOM 9661 C CZ . ARG C 1 335 ? 40.919 58.454 14.017 1.00 40.78 ? 394 ARG C CZ 1 ATOM 9662 N NH1 . ARG C 1 335 ? 41.119 58.093 15.277 1.00 56.82 ? 394 ARG C NH1 1 ATOM 9663 N NH2 . ARG C 1 335 ? 41.739 58.016 13.071 1.00 50.14 ? 394 ARG C NH2 1 ATOM 9664 N N . SER C 1 336 ? 35.110 59.683 11.322 1.00 35.88 ? 395 SER C N 1 ATOM 9665 C CA . SER C 1 336 ? 34.413 59.355 10.082 1.00 40.82 ? 395 SER C CA 1 ATOM 9666 C C . SER C 1 336 ? 35.337 58.669 9.081 1.00 35.95 ? 395 SER C C 1 ATOM 9667 O O . SER C 1 336 ? 34.883 58.111 8.083 1.00 42.25 ? 395 SER C O 1 ATOM 9668 C CB . SER C 1 336 ? 33.812 60.617 9.457 1.00 36.94 ? 395 SER C CB 1 ATOM 9669 O OG . SER C 1 336 ? 34.826 61.502 9.017 1.00 34.28 ? 395 SER C OG 1 ATOM 9670 N N . ASP C 1 337 ? 36.637 58.719 9.351 1.00 35.21 ? 396 ASP C N 1 ATOM 9671 C CA . ASP C 1 337 ? 37.633 58.201 8.421 1.00 44.61 ? 396 ASP C CA 1 ATOM 9672 C C . ASP C 1 337 ? 38.344 56.974 8.978 1.00 49.47 ? 396 ASP C C 1 ATOM 9673 O O . ASP C 1 337 ? 39.345 56.521 8.422 1.00 41.57 ? 396 ASP C O 1 ATOM 9674 C CB . ASP C 1 337 ? 38.658 59.285 8.081 1.00 49.34 ? 396 ASP C CB 1 ATOM 9675 C CG . ASP C 1 337 ? 39.433 59.759 9.297 1.00 53.61 ? 396 ASP C CG 1 ATOM 9676 O OD1 . ASP C 1 337 ? 40.549 60.293 9.122 1.00 69.43 ? 396 ASP C OD1 1 ATOM 9677 O OD2 . ASP C 1 337 ? 38.935 59.582 10.428 1.00 62.06 ? 396 ASP C OD2 1 ATOM 9678 N N . PHE C 1 338 ? 37.825 56.435 10.075 1.00 36.96 ? 397 PHE C N 1 ATOM 9679 C CA . PHE C 1 338 ? 38.456 55.296 10.730 1.00 38.46 ? 397 PHE C CA 1 ATOM 9680 C C . PHE C 1 338 ? 37.443 54.264 11.208 1.00 29.78 ? 397 PHE C C 1 ATOM 9681 O O . PHE C 1 338 ? 36.489 54.591 11.914 1.00 47.71 ? 397 PHE C O 1 ATOM 9682 C CB . PHE C 1 338 ? 39.304 55.770 11.911 1.00 44.84 ? 397 PHE C CB 1 ATOM 9683 C CG . PHE C 1 338 ? 39.770 54.657 12.806 1.00 39.80 ? 397 PHE C CG 1 ATOM 9684 C CD1 . PHE C 1 338 ? 40.610 53.667 12.324 1.00 48.83 ? 397 PHE C CD1 1 ATOM 9685 C CD2 . PHE C 1 338 ? 39.361 54.597 14.128 1.00 29.32 ? 397 PHE C CD2 1 ATOM 9686 C CE1 . PHE C 1 338 ? 41.037 52.640 13.145 1.00 33.68 ? 397 PHE C CE1 1 ATOM 9687 C CE2 . PHE C 1 338 ? 39.784 53.573 14.954 1.00 37.96 ? 397 PHE C CE2 1 ATOM 9688 C CZ . PHE C 1 338 ? 40.624 52.594 14.462 1.00 40.39 ? 397 PHE C CZ 1 ATOM 9689 N N . ASP C 1 339 ? 37.660 53.015 10.811 1.00 45.69 ? 398 ASP C N 1 ATOM 9690 C CA . ASP C 1 339 ? 36.849 51.904 11.289 1.00 41.76 ? 398 ASP C CA 1 ATOM 9691 C C . ASP C 1 339 ? 37.662 51.032 12.239 1.00 42.98 ? 398 ASP C C 1 ATOM 9692 O O . ASP C 1 339 ? 38.709 50.503 11.866 1.00 50.78 ? 398 ASP C O 1 ATOM 9693 C CB . ASP C 1 339 ? 36.330 51.068 10.117 1.00 30.25 ? 398 ASP C CB 1 ATOM 9694 C CG . ASP C 1 339 ? 35.724 51.916 9.018 1.00 37.30 ? 398 ASP C CG 1 ATOM 9695 O OD1 . ASP C 1 339 ? 35.812 51.513 7.839 1.00 36.78 ? 398 ASP C OD1 1 ATOM 9696 O OD2 . ASP C 1 339 ? 35.169 52.990 9.331 1.00 45.47 ? 398 ASP C OD2 1 ATOM 9697 N N . ASP C 1 340 ? 37.181 50.889 13.469 1.00 38.89 ? 399 ASP C N 1 ATOM 9698 C CA . ASP C 1 340 ? 37.867 50.070 14.459 1.00 34.92 ? 399 ASP C CA 1 ATOM 9699 C C . ASP C 1 340 ? 37.337 48.641 14.409 1.00 37.11 ? 399 ASP C C 1 ATOM 9700 O O . ASP C 1 340 ? 36.338 48.317 15.052 1.00 36.63 ? 399 ASP C O 1 ATOM 9701 C CB . ASP C 1 340 ? 37.702 50.658 15.862 1.00 37.02 ? 399 ASP C CB 1 ATOM 9702 C CG . ASP C 1 340 ? 38.486 49.893 16.912 1.00 42.04 ? 399 ASP C CG 1 ATOM 9703 O OD1 . ASP C 1 340 ? 39.436 49.173 16.540 1.00 56.44 ? 399 ASP C OD1 1 ATOM 9704 O OD2 . ASP C 1 340 ? 38.155 50.013 18.110 1.00 39.26 ? 399 ASP C OD2 1 ATOM 9705 N N . ASP C 1 341 ? 38.012 47.794 13.638 1.00 32.03 ? 400 ASP C N 1 ATOM 9706 C CA . ASP C 1 341 ? 37.577 46.416 13.426 1.00 48.48 ? 400 ASP C CA 1 ATOM 9707 C C . ASP C 1 341 ? 37.633 45.567 14.696 1.00 44.13 ? 400 ASP C C 1 ATOM 9708 O O . ASP C 1 341 ? 37.082 44.466 14.736 1.00 43.54 ? 400 ASP C O 1 ATOM 9709 C CB . ASP C 1 341 ? 38.419 45.764 12.329 1.00 50.61 ? 400 ASP C CB 1 ATOM 9710 C CG . ASP C 1 341 ? 38.251 46.446 10.984 1.00 67.19 ? 400 ASP C CG 1 ATOM 9711 O OD1 . ASP C 1 341 ? 37.125 46.892 10.678 1.00 65.99 ? 400 ASP C OD1 1 ATOM 9712 O OD2 . ASP C 1 341 ? 39.244 46.535 10.232 1.00 70.88 ? 400 ASP C OD2 1 ATOM 9713 N N . ASP C 1 342 ? 38.305 46.072 15.726 1.00 30.03 ? 401 ASP C N 1 ATOM 9714 C CA . ASP C 1 342 ? 38.331 45.401 17.022 1.00 43.19 ? 401 ASP C CA 1 ATOM 9715 C C . ASP C 1 342 ? 36.935 45.341 17.639 1.00 39.97 ? 401 ASP C C 1 ATOM 9716 O O . ASP C 1 342 ? 36.622 44.427 18.400 1.00 41.62 ? 401 ASP C O 1 ATOM 9717 C CB . ASP C 1 342 ? 39.297 46.104 17.976 1.00 37.72 ? 401 ASP C CB 1 ATOM 9718 C CG . ASP C 1 342 ? 40.725 45.621 17.819 1.00 41.56 ? 401 ASP C CG 1 ATOM 9719 O OD1 . ASP C 1 342 ? 41.031 44.996 16.782 1.00 38.21 ? 401 ASP C OD1 1 ATOM 9720 O OD2 . ASP C 1 342 ? 41.541 45.864 18.733 1.00 39.81 ? 401 ASP C OD2 1 ATOM 9721 N N . ILE C 1 343 ? 36.104 46.326 17.314 1.00 31.66 ? 402 ILE C N 1 ATOM 9722 C CA . ILE C 1 343 ? 34.758 46.404 17.868 1.00 47.34 ? 402 ILE C CA 1 ATOM 9723 C C . ILE C 1 343 ? 33.867 45.273 17.350 1.00 50.23 ? 402 ILE C C 1 ATOM 9724 O O . ILE C 1 343 ? 33.054 44.721 18.093 1.00 41.76 ? 402 ILE C O 1 ATOM 9725 C CB . ILE C 1 343 ? 34.098 47.765 17.541 1.00 39.19 ? 402 ILE C CB 1 ATOM 9726 C CG1 . ILE C 1 343 ? 34.940 48.919 18.088 1.00 56.82 ? 402 ILE C CG1 1 ATOM 9727 C CG2 . ILE C 1 343 ? 32.689 47.832 18.101 1.00 34.52 ? 402 ILE C CG2 1 ATOM 9728 C CD1 . ILE C 1 343 ? 34.516 50.281 17.570 1.00 30.39 ? 402 ILE C CD1 1 ATOM 9729 N N . ILE C 1 344 ? 34.034 44.922 16.078 1.00 31.48 ? 403 ILE C N 1 ATOM 9730 C CA . ILE C 1 344 ? 33.209 43.893 15.449 1.00 42.94 ? 403 ILE C CA 1 ATOM 9731 C C . ILE C 1 344 ? 33.824 42.494 15.598 1.00 32.54 ? 403 ILE C C 1 ATOM 9732 O O . ILE C 1 344 ? 33.345 41.521 15.012 1.00 46.49 ? 403 ILE C O 1 ATOM 9733 C CB . ILE C 1 344 ? 32.978 44.218 13.950 1.00 31.31 ? 403 ILE C CB 1 ATOM 9734 C CG1 . ILE C 1 344 ? 31.723 43.518 13.418 1.00 46.27 ? 403 ILE C CG1 1 ATOM 9735 C CG2 . ILE C 1 344 ? 34.221 43.900 13.124 1.00 39.96 ? 403 ILE C CG2 1 ATOM 9736 C CD1 . ILE C 1 344 ? 30.480 43.785 14.238 1.00 31.87 ? 403 ILE C CD1 1 ATOM 9737 N N . LEU C 1 345 ? 34.879 42.396 16.402 1.00 41.80 ? 404 LEU C N 1 ATOM 9738 C CA . LEU C 1 345 ? 35.529 41.111 16.676 1.00 45.91 ? 404 LEU C CA 1 ATOM 9739 C C . LEU C 1 345 ? 34.613 40.011 17.238 1.00 51.54 ? 404 LEU C C 1 ATOM 9740 O O . LEU C 1 345 ? 34.788 38.844 16.885 1.00 63.39 ? 404 LEU C O 1 ATOM 9741 C CB . LEU C 1 345 ? 36.710 41.310 17.630 1.00 30.64 ? 404 LEU C CB 1 ATOM 9742 C CG . LEU C 1 345 ? 38.046 41.616 16.956 1.00 55.12 ? 404 LEU C CG 1 ATOM 9743 C CD1 . LEU C 1 345 ? 39.150 41.743 17.992 1.00 41.81 ? 404 LEU C CD1 1 ATOM 9744 C CD2 . LEU C 1 345 ? 38.382 40.541 15.935 1.00 30.40 ? 404 LEU C CD2 1 ATOM 9745 N N . PRO C 1 346 ? 33.654 40.360 18.123 1.00 54.01 ? 405 PRO C N 1 ATOM 9746 C CA . PRO C 1 346 ? 32.729 39.309 18.569 1.00 38.75 ? 405 PRO C CA 1 ATOM 9747 C C . PRO C 1 346 ? 31.992 38.602 17.430 1.00 51.51 ? 405 PRO C C 1 ATOM 9748 O O . PRO C 1 346 ? 31.798 37.391 17.504 1.00 42.63 ? 405 PRO C O 1 ATOM 9749 C CB . PRO C 1 346 ? 31.745 40.075 19.452 1.00 32.22 ? 405 PRO C CB 1 ATOM 9750 C CG . PRO C 1 346 ? 32.567 41.156 20.036 1.00 46.03 ? 405 PRO C CG 1 ATOM 9751 C CD . PRO C 1 346 ? 33.491 41.586 18.929 1.00 43.08 ? 405 PRO C CD 1 ATOM 9752 N N . LEU C 1 347 ? 31.600 39.342 16.398 1.00 40.23 ? 406 LEU C N 1 ATOM 9753 C CA . LEU C 1 347 ? 30.961 38.742 15.230 1.00 38.56 ? 406 LEU C CA 1 ATOM 9754 C C . LEU C 1 347 ? 31.874 37.719 14.563 1.00 44.69 ? 406 LEU C C 1 ATOM 9755 O O . LEU C 1 347 ? 31.438 36.629 14.193 1.00 55.63 ? 406 LEU C O 1 ATOM 9756 C CB . LEU C 1 347 ? 30.560 39.819 14.221 1.00 39.02 ? 406 LEU C CB 1 ATOM 9757 C CG . LEU C 1 347 ? 29.979 39.312 12.899 1.00 32.42 ? 406 LEU C CG 1 ATOM 9758 C CD1 . LEU C 1 347 ? 28.726 38.485 13.143 1.00 32.78 ? 406 LEU C CD1 1 ATOM 9759 C CD2 . LEU C 1 347 ? 29.687 40.471 11.959 1.00 39.43 ? 406 LEU C CD2 1 ATOM 9760 N N . ARG C 1 348 ? 33.142 38.081 14.409 1.00 54.29 ? 407 ARG C N 1 ATOM 9761 C CA . ARG C 1 348 ? 34.112 37.229 13.733 1.00 55.26 ? 407 ARG C CA 1 ATOM 9762 C C . ARG C 1 348 ? 34.554 36.057 14.605 1.00 48.75 ? 407 ARG C C 1 ATOM 9763 O O . ARG C 1 348 ? 34.849 34.974 14.099 1.00 41.00 ? 407 ARG C O 1 ATOM 9764 C CB . ARG C 1 348 ? 35.325 38.057 13.302 1.00 46.07 ? 407 ARG C CB 1 ATOM 9765 C CG . ARG C 1 348 ? 34.993 39.117 12.263 1.00 62.20 ? 407 ARG C CG 1 ATOM 9766 C CD . ARG C 1 348 ? 36.101 40.148 12.132 1.00 74.08 ? 407 ARG C CD 1 ATOM 9767 N NE . ARG C 1 348 ? 37.381 39.542 11.780 1.00 94.76 ? 407 ARG C NE 1 ATOM 9768 C CZ . ARG C 1 348 ? 38.549 40.171 11.854 1.00 97.08 ? 407 ARG C CZ 1 ATOM 9769 N NH1 . ARG C 1 348 ? 38.600 41.431 12.266 1.00 95.45 ? 407 ARG C NH1 1 ATOM 9770 N NH2 . ARG C 1 348 ? 39.666 39.543 11.513 1.00 85.85 ? 407 ARG C NH2 1 ATOM 9771 N N . GLN C 1 349 ? 34.595 36.275 15.916 1.00 44.56 ? 408 GLN C N 1 ATOM 9772 C CA . GLN C 1 349 ? 35.046 35.244 16.846 1.00 37.11 ? 408 GLN C CA 1 ATOM 9773 C C . GLN C 1 349 ? 33.937 34.266 17.234 1.00 51.07 ? 408 GLN C C 1 ATOM 9774 O O . GLN C 1 349 ? 34.157 33.055 17.263 1.00 58.65 ? 408 GLN C O 1 ATOM 9775 C CB . GLN C 1 349 ? 35.635 35.885 18.105 1.00 38.14 ? 408 GLN C CB 1 ATOM 9776 C CG . GLN C 1 349 ? 36.967 36.579 17.877 1.00 37.92 ? 408 GLN C CG 1 ATOM 9777 C CD . GLN C 1 349 ? 37.537 37.181 19.146 1.00 50.67 ? 408 GLN C CD 1 ATOM 9778 O OE1 . GLN C 1 349 ? 37.050 36.919 20.245 1.00 54.11 ? 408 GLN C OE1 1 ATOM 9779 N NE2 . GLN C 1 349 ? 38.579 37.992 18.999 1.00 30.45 ? 408 GLN C NE2 1 ATOM 9780 N N . CYS C 1 350 ? 32.752 34.788 17.537 1.00 45.17 ? 409 CYS C N 1 ATOM 9781 C CA . CYS C 1 350 ? 31.638 33.946 17.967 1.00 44.38 ? 409 CYS C CA 1 ATOM 9782 C C . CYS C 1 350 ? 30.929 33.317 16.770 1.00 51.01 ? 409 CYS C C 1 ATOM 9783 O O . CYS C 1 350 ? 30.513 32.159 16.820 1.00 42.88 ? 409 CYS C O 1 ATOM 9784 C CB . CYS C 1 350 ? 30.642 34.753 18.802 1.00 32.51 ? 409 CYS C CB 1 ATOM 9785 S SG . CYS C 1 350 ? 31.372 35.624 20.211 1.00 42.48 ? 409 CYS C SG 1 ATOM 9786 N N . CYS C 1 351 ? 30.798 34.098 15.701 1.00 45.10 ? 410 CYS C N 1 ATOM 9787 C CA . CYS C 1 351 ? 30.147 33.664 14.465 1.00 38.94 ? 410 CYS C CA 1 ATOM 9788 C C . CYS C 1 351 ? 28.735 33.116 14.665 1.00 40.99 ? 410 CYS C C 1 ATOM 9789 O O . CYS C 1 351 ? 28.342 32.151 14.014 1.00 48.58 ? 410 CYS C O 1 ATOM 9790 C CB . CYS C 1 351 ? 31.004 32.616 13.750 1.00 39.02 ? 410 CYS C CB 1 ATOM 9791 S SG . CYS C 1 351 ? 32.314 33.318 12.719 1.00 54.72 ? 410 CYS C SG 1 ATOM 9792 N N . ILE C 1 352 ? 27.980 33.725 15.573 1.00 48.20 ? 411 ILE C N 1 ATOM 9793 C CA . ILE C 1 352 ? 26.542 33.491 15.632 1.00 53.13 ? 411 ILE C CA 1 ATOM 9794 C C . ILE C 1 352 ? 25.835 34.827 15.428 1.00 45.88 ? 411 ILE C C 1 ATOM 9795 O O . ILE C 1 352 ? 26.386 35.883 15.739 1.00 42.33 ? 411 ILE C O 1 ATOM 9796 C CB . ILE C 1 352 ? 26.094 32.845 16.958 1.00 55.08 ? 411 ILE C CB 1 ATOM 9797 C CG1 . ILE C 1 352 ? 26.153 33.850 18.108 1.00 54.34 ? 411 ILE C CG1 1 ATOM 9798 C CG2 . ILE C 1 352 ? 26.921 31.600 17.255 1.00 46.42 ? 411 ILE C CG2 1 ATOM 9799 C CD1 . ILE C 1 352 ? 25.528 33.336 19.380 1.00 46.87 ? 411 ILE C CD1 1 ATOM 9800 N N . LEU C 1 353 ? 24.621 34.783 14.894 1.00 45.71 ? 412 LEU C N 1 ATOM 9801 C CA . LEU C 1 353 ? 23.934 36.003 14.498 1.00 34.14 ? 412 LEU C CA 1 ATOM 9802 C C . LEU C 1 353 ? 22.423 35.816 14.468 1.00 41.28 ? 412 LEU C C 1 ATOM 9803 O O . LEU C 1 353 ? 21.912 34.915 13.804 1.00 46.83 ? 412 LEU C O 1 ATOM 9804 C CB . LEU C 1 353 ? 24.434 36.469 13.129 1.00 34.01 ? 412 LEU C CB 1 ATOM 9805 C CG . LEU C 1 353 ? 23.755 37.697 12.524 1.00 36.63 ? 412 LEU C CG 1 ATOM 9806 C CD1 . LEU C 1 353 ? 24.001 38.929 13.378 1.00 34.56 ? 412 LEU C CD1 1 ATOM 9807 C CD2 . LEU C 1 353 ? 24.244 37.920 11.103 1.00 40.19 ? 412 LEU C CD2 1 ATOM 9808 N N . ARG C 1 354 ? 21.722 36.669 15.209 1.00 40.53 ? 413 ARG C N 1 ATOM 9809 C CA . ARG C 1 354 ? 20.265 36.646 15.264 1.00 51.89 ? 413 ARG C CA 1 ATOM 9810 C C . ARG C 1 354 ? 19.672 36.826 13.868 1.00 55.63 ? 413 ARG C C 1 ATOM 9811 O O . ARG C 1 354 ? 20.030 37.764 13.157 1.00 46.56 ? 413 ARG C O 1 ATOM 9812 C CB . ARG C 1 354 ? 19.758 37.733 16.216 1.00 49.39 ? 413 ARG C CB 1 ATOM 9813 C CG . ARG C 1 354 ? 18.264 37.704 16.473 1.00 44.99 ? 413 ARG C CG 1 ATOM 9814 C CD . ARG C 1 354 ? 17.885 38.614 17.633 1.00 45.55 ? 413 ARG C CD 1 ATOM 9815 N NE . ARG C 1 354 ? 18.119 37.987 18.933 1.00 45.91 ? 413 ARG C NE 1 ATOM 9816 C CZ . ARG C 1 354 ? 18.772 38.565 19.936 1.00 39.35 ? 413 ARG C CZ 1 ATOM 9817 N NH1 . ARG C 1 354 ? 19.262 39.788 19.793 1.00 40.79 ? 413 ARG C NH1 1 ATOM 9818 N NH2 . ARG C 1 354 ? 18.935 37.920 21.082 1.00 47.85 ? 413 ARG C NH2 1 ATOM 9819 N N . PRO C 1 355 ? 18.772 35.912 13.470 1.00 57.18 ? 414 PRO C N 1 ATOM 9820 C CA . PRO C 1 355 ? 18.206 35.857 12.116 1.00 43.30 ? 414 PRO C CA 1 ATOM 9821 C C . PRO C 1 355 ? 17.541 37.158 11.672 1.00 49.84 ? 414 PRO C C 1 ATOM 9822 O O . PRO C 1 355 ? 17.678 37.539 10.509 1.00 39.24 ? 414 PRO C O 1 ATOM 9823 C CB . PRO C 1 355 ? 17.174 34.732 12.218 1.00 42.77 ? 414 PRO C CB 1 ATOM 9824 C CG . PRO C 1 355 ? 17.697 33.853 13.296 1.00 48.06 ? 414 PRO C CG 1 ATOM 9825 C CD . PRO C 1 355 ? 18.309 34.786 14.300 1.00 61.82 ? 414 PRO C CD 1 ATOM 9826 N N . SER C 1 356 ? 16.834 37.825 12.580 1.00 35.78 ? 415 SER C N 1 ATOM 9827 C CA . SER C 1 356 ? 16.187 39.092 12.253 1.00 49.43 ? 415 SER C CA 1 ATOM 9828 C C . SER C 1 356 ? 17.222 40.167 11.941 1.00 53.80 ? 415 SER C C 1 ATOM 9829 O O . SER C 1 356 ? 17.037 40.970 11.027 1.00 38.58 ? 415 SER C O 1 ATOM 9830 C CB . SER C 1 356 ? 15.281 39.550 13.397 1.00 35.93 ? 415 SER C CB 1 ATOM 9831 O OG . SER C 1 356 ? 16.009 39.687 14.605 1.00 49.55 ? 415 SER C OG 1 ATOM 9832 N N . THR C 1 357 ? 18.307 40.177 12.711 1.00 40.44 ? 416 THR C N 1 ATOM 9833 C CA . THR C 1 357 ? 19.399 41.119 12.493 1.00 52.07 ? 416 THR C CA 1 ATOM 9834 C C . THR C 1 357 ? 20.003 40.930 11.107 1.00 60.52 ? 416 THR C C 1 ATOM 9835 O O . THR C 1 357 ? 20.273 41.901 10.401 1.00 44.16 ? 416 THR C O 1 ATOM 9836 C CB . THR C 1 357 ? 20.507 40.968 13.552 1.00 46.81 ? 416 THR C CB 1 ATOM 9837 O OG1 . THR C 1 357 ? 19.950 41.138 14.862 1.00 39.32 ? 416 THR C OG1 1 ATOM 9838 C CG2 . THR C 1 357 ? 21.601 42.003 13.333 1.00 34.81 ? 416 THR C CG2 1 ATOM 9839 N N . PHE C 1 358 ? 20.206 39.673 10.723 1.00 51.93 ? 417 PHE C N 1 ATOM 9840 C CA . PHE C 1 358 ? 20.794 39.352 9.428 1.00 39.41 ? 417 PHE C CA 1 ATOM 9841 C C . PHE C 1 358 ? 19.928 39.866 8.287 1.00 45.54 ? 417 PHE C C 1 ATOM 9842 O O . PHE C 1 358 ? 20.433 40.465 7.340 1.00 53.50 ? 417 PHE C O 1 ATOM 9843 C CB . PHE C 1 358 ? 21.005 37.843 9.286 1.00 48.61 ? 417 PHE C CB 1 ATOM 9844 C CG . PHE C 1 358 ? 21.400 37.415 7.899 1.00 49.91 ? 417 PHE C CG 1 ATOM 9845 C CD1 . PHE C 1 358 ? 22.714 37.520 7.476 1.00 44.63 ? 417 PHE C CD1 1 ATOM 9846 C CD2 . PHE C 1 358 ? 20.459 36.898 7.022 1.00 44.69 ? 417 PHE C CD2 1 ATOM 9847 C CE1 . PHE C 1 358 ? 23.081 37.128 6.202 1.00 49.85 ? 417 PHE C CE1 1 ATOM 9848 C CE2 . PHE C 1 358 ? 20.820 36.503 5.748 1.00 41.01 ? 417 PHE C CE2 1 ATOM 9849 C CZ . PHE C 1 358 ? 22.133 36.618 5.338 1.00 47.54 ? 417 PHE C CZ 1 ATOM 9850 N N . GLN C 1 359 ? 18.624 39.624 8.383 1.00 47.03 ? 418 GLN C N 1 ATOM 9851 C CA . GLN C 1 359 ? 17.681 40.071 7.364 1.00 58.90 ? 418 GLN C CA 1 ATOM 9852 C C . GLN C 1 359 ? 17.653 41.594 7.253 1.00 60.94 ? 418 GLN C C 1 ATOM 9853 O O . GLN C 1 359 ? 17.702 42.143 6.152 1.00 43.40 ? 418 GLN C O 1 ATOM 9854 C CB . GLN C 1 359 ? 16.279 39.539 7.667 1.00 60.19 ? 418 GLN C CB 1 ATOM 9855 C CG . GLN C 1 359 ? 16.100 38.059 7.366 1.00 63.76 ? 418 GLN C CG 1 ATOM 9856 C CD . GLN C 1 359 ? 14.654 37.615 7.460 1.00 67.21 ? 418 GLN C CD 1 ATOM 9857 O OE1 . GLN C 1 359 ? 14.002 37.797 8.488 1.00 61.04 ? 418 GLN C OE1 1 ATOM 9858 N NE2 . GLN C 1 359 ? 14.144 37.028 6.383 1.00 62.35 ? 418 GLN C NE2 1 ATOM 9859 N N . THR C 1 360 ? 17.568 42.265 8.399 1.00 43.82 ? 419 THR C N 1 ATOM 9860 C CA . THR C 1 360 ? 17.632 43.723 8.455 1.00 38.20 ? 419 THR C CA 1 ATOM 9861 C C . THR C 1 360 ? 18.900 44.261 7.796 1.00 45.40 ? 419 THR C C 1 ATOM 9862 O O . THR C 1 360 ? 18.840 45.157 6.954 1.00 48.63 ? 419 THR C O 1 ATOM 9863 C CB . THR C 1 360 ? 17.569 44.236 9.905 1.00 45.04 ? 419 THR C CB 1 ATOM 9864 O OG1 . THR C 1 360 ? 16.362 43.778 10.526 1.00 44.95 ? 419 THR C OG1 1 ATOM 9865 C CG2 . THR C 1 360 ? 17.596 45.754 9.932 1.00 34.70 ? 419 THR C CG2 1 ATOM 9866 N N . LEU C 1 361 ? 20.044 43.705 8.183 1.00 34.44 ? 420 LEU C N 1 ATOM 9867 C CA . LEU C 1 361 ? 21.324 44.105 7.612 1.00 46.12 ? 420 LEU C CA 1 ATOM 9868 C C . LEU C 1 361 ? 21.387 43.765 6.127 1.00 51.18 ? 420 LEU C C 1 ATOM 9869 O O . LEU C 1 361 ? 21.985 44.497 5.340 1.00 59.59 ? 420 LEU C O 1 ATOM 9870 C CB . LEU C 1 361 ? 22.483 43.431 8.353 1.00 45.23 ? 420 LEU C CB 1 ATOM 9871 C CG . LEU C 1 361 ? 22.730 43.855 9.803 1.00 44.91 ? 420 LEU C CG 1 ATOM 9872 C CD1 . LEU C 1 361 ? 23.895 43.076 10.397 1.00 38.57 ? 420 LEU C CD1 1 ATOM 9873 C CD2 . LEU C 1 361 ? 22.969 45.354 9.907 1.00 42.76 ? 420 LEU C CD2 1 HETATM 9874 N N . MSE C 1 362 ? 20.762 42.654 5.751 1.00 58.36 ? 421 MSE C N 1 HETATM 9875 C CA . MSE C 1 362 ? 20.737 42.221 4.359 1.00 41.42 ? 421 MSE C CA 1 HETATM 9876 C C . MSE C 1 362 ? 19.894 43.166 3.511 1.00 53.68 ? 421 MSE C C 1 HETATM 9877 O O . MSE C 1 362 ? 20.245 43.473 2.370 1.00 34.64 ? 421 MSE C O 1 HETATM 9878 C CB . MSE C 1 362 ? 20.197 40.792 4.249 1.00 38.25 ? 421 MSE C CB 1 HETATM 9879 C CG . MSE C 1 362 ? 20.470 40.103 2.919 1.00 88.12 ? 421 MSE C CG 1 HETATM 9880 SE SE . MSE C 1 362 ? 22.238 39.277 2.813 1.00 82.15 ? 421 MSE C SE 1 HETATM 9881 C CE . MSE C 1 362 ? 23.310 40.844 2.385 1.00 94.94 ? 421 MSE C CE 1 ATOM 9882 N N . ASN C 1 363 ? 18.782 43.622 4.077 1.00 34.91 ? 422 ASN C N 1 ATOM 9883 C CA . ASN C 1 363 ? 17.890 44.546 3.387 1.00 39.73 ? 422 ASN C CA 1 ATOM 9884 C C . ASN C 1 363 ? 18.580 45.868 3.070 1.00 50.51 ? 422 ASN C C 1 ATOM 9885 O O . ASN C 1 363 ? 18.484 46.378 1.955 1.00 60.33 ? 422 ASN C O 1 ATOM 9886 C CB . ASN C 1 363 ? 16.636 44.797 4.227 1.00 48.46 ? 422 ASN C CB 1 ATOM 9887 C CG . ASN C 1 363 ? 15.700 43.604 4.249 1.00 58.06 ? 422 ASN C CG 1 ATOM 9888 O OD1 . ASN C 1 363 ? 15.762 42.735 3.379 1.00 52.65 ? 422 ASN C OD1 1 ATOM 9889 N ND2 . ASN C 1 363 ? 14.830 43.553 5.252 1.00 66.45 ? 422 ASN C ND2 1 ATOM 9890 N N . PHE C 1 364 ? 19.274 46.418 4.061 1.00 43.69 ? 423 PHE C N 1 ATOM 9891 C CA . PHE C 1 364 ? 20.011 47.665 3.882 1.00 46.63 ? 423 PHE C CA 1 ATOM 9892 C C . PHE C 1 364 ? 21.211 47.510 2.954 1.00 51.34 ? 423 PHE C C 1 ATOM 9893 O O . PHE C 1 364 ? 21.463 48.369 2.114 1.00 52.23 ? 423 PHE C O 1 ATOM 9894 C CB . PHE C 1 364 ? 20.468 48.216 5.234 1.00 34.83 ? 423 PHE C CB 1 ATOM 9895 C CG . PHE C 1 364 ? 19.354 48.788 6.059 1.00 40.48 ? 423 PHE C CG 1 ATOM 9896 C CD1 . PHE C 1 364 ? 18.501 49.740 5.526 1.00 36.32 ? 423 PHE C CD1 1 ATOM 9897 C CD2 . PHE C 1 364 ? 19.159 48.379 7.367 1.00 34.13 ? 423 PHE C CD2 1 ATOM 9898 C CE1 . PHE C 1 364 ? 17.474 50.272 6.278 1.00 39.63 ? 423 PHE C CE1 1 ATOM 9899 C CE2 . PHE C 1 364 ? 18.133 48.907 8.127 1.00 37.66 ? 423 PHE C CE2 1 ATOM 9900 C CZ . PHE C 1 364 ? 17.288 49.855 7.580 1.00 41.49 ? 423 PHE C CZ 1 ATOM 9901 N N . TYR C 1 365 ? 21.957 46.422 3.116 1.00 45.96 ? 424 TYR C N 1 ATOM 9902 C CA . TYR C 1 365 ? 23.163 46.198 2.322 1.00 45.68 ? 424 TYR C CA 1 ATOM 9903 C C . TYR C 1 365 ? 22.846 46.061 0.834 1.00 56.06 ? 424 TYR C C 1 ATOM 9904 O O . TYR C 1 365 ? 23.604 46.531 -0.014 1.00 51.73 ? 424 TYR C O 1 ATOM 9905 C CB . TYR C 1 365 ? 23.908 44.956 2.813 1.00 37.25 ? 424 TYR C CB 1 ATOM 9906 C CG . TYR C 1 365 ? 25.193 44.682 2.064 1.00 51.17 ? 424 TYR C CG 1 ATOM 9907 C CD1 . TYR C 1 365 ? 26.194 45.641 1.992 1.00 48.66 ? 424 TYR C CD1 1 ATOM 9908 C CD2 . TYR C 1 365 ? 25.408 43.464 1.434 1.00 54.15 ? 424 TYR C CD2 1 ATOM 9909 C CE1 . TYR C 1 365 ? 27.371 45.397 1.310 1.00 38.89 ? 424 TYR C CE1 1 ATOM 9910 C CE2 . TYR C 1 365 ? 26.581 43.209 0.751 1.00 58.50 ? 424 TYR C CE2 1 ATOM 9911 C CZ . TYR C 1 365 ? 27.559 44.179 0.692 1.00 55.55 ? 424 TYR C CZ 1 ATOM 9912 O OH . TYR C 1 365 ? 28.729 43.929 0.013 1.00 56.00 ? 424 TYR C OH 1 ATOM 9913 N N . SER C 1 366 ? 21.726 45.414 0.522 1.00 54.43 ? 425 SER C N 1 ATOM 9914 C CA . SER C 1 366 ? 21.350 45.162 -0.867 1.00 60.42 ? 425 SER C CA 1 ATOM 9915 C C . SER C 1 366 ? 20.962 46.447 -1.591 1.00 62.35 ? 425 SER C C 1 ATOM 9916 O O . SER C 1 366 ? 20.939 46.494 -2.822 1.00 66.10 ? 425 SER C O 1 ATOM 9917 C CB . SER C 1 366 ? 20.194 44.162 -0.932 1.00 59.56 ? 425 SER C CB 1 ATOM 9918 O OG . SER C 1 366 ? 19.125 44.565 -0.095 1.00 59.35 ? 425 SER C OG 1 ATOM 9919 N N . THR C 1 367 ? 20.657 47.486 -0.822 1.00 57.32 ? 426 THR C N 1 ATOM 9920 C CA . THR C 1 367 ? 20.363 48.798 -1.384 1.00 63.51 ? 426 THR C CA 1 ATOM 9921 C C . THR C 1 367 ? 21.290 49.850 -0.785 1.00 60.00 ? 426 THR C C 1 ATOM 9922 O O . THR C 1 367 ? 21.050 50.328 0.320 1.00 45.42 ? 426 THR C O 1 ATOM 9923 C CB . THR C 1 367 ? 18.898 49.205 -1.137 1.00 62.15 ? 426 THR C CB 1 ATOM 9924 O OG1 . THR C 1 367 ? 18.024 48.203 -1.670 1.00 56.84 ? 426 THR C OG1 1 ATOM 9925 C CG2 . THR C 1 367 ? 18.596 50.543 -1.796 1.00 58.73 ? 426 THR C CG2 1 ATOM 9926 N N . PRO C 1 368 ? 22.360 50.205 -1.512 1.00 62.72 ? 427 PRO C N 1 ATOM 9927 C CA . PRO C 1 368 ? 23.354 51.171 -1.026 1.00 66.77 ? 427 PRO C CA 1 ATOM 9928 C C . PRO C 1 368 ? 22.734 52.487 -0.554 1.00 57.87 ? 427 PRO C C 1 ATOM 9929 O O . PRO C 1 368 ? 21.783 52.971 -1.167 1.00 57.01 ? 427 PRO C O 1 ATOM 9930 C CB . PRO C 1 368 ? 24.244 51.395 -2.250 1.00 70.86 ? 427 PRO C CB 1 ATOM 9931 C CG . PRO C 1 368 ? 24.144 50.117 -3.012 1.00 62.96 ? 427 PRO C CG 1 ATOM 9932 C CD . PRO C 1 368 ? 22.728 49.649 -2.825 1.00 58.62 ? 427 PRO C CD 1 ATOM 9933 N N . LYS C 1 369 ? 23.266 53.021 0.545 1.00 49.80 ? 428 LYS C N 1 ATOM 9934 C CA . LYS C 1 369 ? 22.827 54.281 1.155 1.00 46.53 ? 428 LYS C CA 1 ATOM 9935 C C . LYS C 1 369 ? 21.444 54.224 1.800 1.00 50.82 ? 428 LYS C C 1 ATOM 9936 O O . LYS C 1 369 ? 20.961 55.236 2.300 1.00 49.26 ? 428 LYS C O 1 ATOM 9937 C CB . LYS C 1 369 ? 22.853 55.431 0.141 1.00 45.78 ? 428 LYS C CB 1 ATOM 9938 C CG . LYS C 1 369 ? 24.202 55.681 -0.501 1.00 42.97 ? 428 LYS C CG 1 ATOM 9939 C CD . LYS C 1 369 ? 24.087 56.717 -1.605 1.00 59.86 ? 428 LYS C CD 1 ATOM 9940 C CE . LYS C 1 369 ? 25.439 57.005 -2.229 1.00 67.06 ? 428 LYS C CE 1 ATOM 9941 N NZ . LYS C 1 369 ? 25.343 58.006 -3.329 1.00 69.74 ? 428 LYS C NZ 1 ATOM 9942 N N . SER C 1 370 ? 20.807 53.058 1.804 1.00 49.84 ? 429 SER C N 1 ATOM 9943 C CA . SER C 1 370 ? 19.455 52.960 2.346 1.00 51.89 ? 429 SER C CA 1 ATOM 9944 C C . SER C 1 370 ? 19.470 53.063 3.867 1.00 42.34 ? 429 SER C C 1 ATOM 9945 O O . SER C 1 370 ? 18.559 53.639 4.464 1.00 38.26 ? 429 SER C O 1 ATOM 9946 C CB . SER C 1 370 ? 18.784 51.654 1.915 1.00 50.10 ? 429 SER C CB 1 ATOM 9947 O OG . SER C 1 370 ? 19.408 50.538 2.521 1.00 45.93 ? 429 SER C OG 1 ATOM 9948 N N . LEU C 1 371 ? 20.503 52.502 4.489 1.00 41.75 ? 430 LEU C N 1 ATOM 9949 C CA . LEU C 1 371 ? 20.650 52.565 5.940 1.00 59.62 ? 430 LEU C CA 1 ATOM 9950 C C . LEU C 1 371 ? 20.788 54.003 6.437 1.00 49.80 ? 430 LEU C C 1 ATOM 9951 O O . LEU C 1 371 ? 20.054 54.434 7.326 1.00 39.75 ? 430 LEU C O 1 ATOM 9952 C CB . LEU C 1 371 ? 21.857 51.742 6.394 1.00 50.40 ? 430 LEU C CB 1 ATOM 9953 C CG . LEU C 1 371 ? 22.178 51.810 7.888 1.00 45.84 ? 430 LEU C CG 1 ATOM 9954 C CD1 . LEU C 1 371 ? 21.047 51.213 8.710 1.00 37.77 ? 430 LEU C CD1 1 ATOM 9955 C CD2 . LEU C 1 371 ? 23.493 51.110 8.190 1.00 39.34 ? 430 LEU C CD2 1 ATOM 9956 N N . THR C 1 372 ? 21.730 54.739 5.856 1.00 42.45 ? 431 THR C N 1 ATOM 9957 C CA . THR C 1 372 ? 21.980 56.120 6.258 1.00 60.14 ? 431 THR C CA 1 ATOM 9958 C C . THR C 1 372 ? 20.851 57.060 5.849 1.00 46.15 ? 431 THR C C 1 ATOM 9959 O O . THR C 1 372 ? 20.616 58.076 6.504 1.00 54.67 ? 431 THR C O 1 ATOM 9960 C CB . THR C 1 372 ? 23.299 56.644 5.665 1.00 50.43 ? 431 THR C CB 1 ATOM 9961 O OG1 . THR C 1 372 ? 23.287 56.467 4.244 1.00 61.17 ? 431 THR C OG1 1 ATOM 9962 C CG2 . THR C 1 372 ? 24.476 55.888 6.251 1.00 32.24 ? 431 THR C CG2 1 ATOM 9963 N N . LYS C 1 373 ? 20.157 56.726 4.766 1.00 43.61 ? 432 LYS C N 1 ATOM 9964 C CA . LYS C 1 373 ? 18.987 57.493 4.352 1.00 46.25 ? 432 LYS C CA 1 ATOM 9965 C C . LYS C 1 373 ? 17.846 57.301 5.342 1.00 40.20 ? 432 LYS C C 1 ATOM 9966 O O . LYS C 1 373 ? 17.161 58.257 5.703 1.00 42.69 ? 432 LYS C O 1 ATOM 9967 C CB . LYS C 1 373 ? 18.545 57.101 2.942 1.00 58.88 ? 432 LYS C CB 1 ATOM 9968 C CG . LYS C 1 373 ? 19.261 57.879 1.850 1.00 60.89 ? 432 LYS C CG 1 ATOM 9969 C CD . LYS C 1 373 ? 19.023 57.287 0.475 1.00 66.37 ? 432 LYS C CD 1 ATOM 9970 C CE . LYS C 1 373 ? 19.757 58.089 -0.587 1.00 63.96 ? 432 LYS C CE 1 ATOM 9971 N NZ . LYS C 1 373 ? 19.382 59.530 -0.543 1.00 45.10 ? 432 LYS C NZ 1 ATOM 9972 N N . ALA C 1 374 ? 17.645 56.061 5.776 1.00 43.63 ? 433 ALA C N 1 ATOM 9973 C CA . ALA C 1 374 ? 16.633 55.762 6.783 1.00 43.33 ? 433 ALA C CA 1 ATOM 9974 C C . ALA C 1 374 ? 17.002 56.393 8.124 1.00 45.99 ? 433 ALA C C 1 ATOM 9975 O O . ALA C 1 374 ? 16.130 56.732 8.922 1.00 57.23 ? 433 ALA C O 1 ATOM 9976 C CB . ALA C 1 374 ? 16.455 54.260 6.931 1.00 34.04 ? 433 ALA C CB 1 ATOM 9977 N N . LEU C 1 375 ? 18.301 56.545 8.366 1.00 48.17 ? 434 LEU C N 1 ATOM 9978 C CA . LEU C 1 375 ? 18.784 57.194 9.577 1.00 48.13 ? 434 LEU C CA 1 ATOM 9979 C C . LEU C 1 375 ? 18.600 58.701 9.458 1.00 48.48 ? 434 LEU C C 1 ATOM 9980 O O . LEU C 1 375 ? 18.152 59.359 10.400 1.00 42.00 ? 434 LEU C O 1 ATOM 9981 C CB . LEU C 1 375 ? 20.252 56.849 9.835 1.00 38.26 ? 434 LEU C CB 1 ATOM 9982 C CG . LEU C 1 375 ? 20.915 57.549 11.023 1.00 44.03 ? 434 LEU C CG 1 ATOM 9983 C CD1 . LEU C 1 375 ? 20.262 57.126 12.330 1.00 32.87 ? 434 LEU C CD1 1 ATOM 9984 C CD2 . LEU C 1 375 ? 22.406 57.255 11.048 1.00 33.30 ? 434 LEU C CD2 1 ATOM 9985 N N . HIS C 1 376 ? 18.957 59.235 8.293 1.00 43.02 ? 435 HIS C N 1 ATOM 9986 C CA . HIS C 1 376 ? 18.840 60.662 8.033 1.00 45.02 ? 435 HIS C CA 1 ATOM 9987 C C . HIS C 1 376 ? 17.411 61.124 8.199 1.00 50.02 ? 435 HIS C C 1 ATOM 9988 O O . HIS C 1 376 ? 17.135 62.150 8.826 1.00 33.50 ? 435 HIS C O 1 ATOM 9989 C CB . HIS C 1 376 ? 19.300 61.006 6.620 1.00 51.56 ? 435 HIS C CB 1 ATOM 9990 C CG . HIS C 1 376 ? 19.336 62.476 6.353 1.00 60.45 ? 435 HIS C CG 1 ATOM 9991 N ND1 . HIS C 1 376 ? 20.250 63.306 6.968 1.00 60.77 ? 435 HIS C ND1 1 ATOM 9992 C CD2 . HIS C 1 376 ? 18.580 63.270 5.559 1.00 55.82 ? 435 HIS C CD2 1 ATOM 9993 C CE1 . HIS C 1 376 ? 20.056 64.546 6.563 1.00 55.64 ? 435 HIS C CE1 1 ATOM 9994 N NE2 . HIS C 1 376 ? 19.050 64.554 5.706 1.00 54.44 ? 435 HIS C NE2 1 ATOM 9995 N N . GLU C 1 377 ? 16.511 60.331 7.629 1.00 48.95 ? 436 GLU C N 1 ATOM 9996 C CA . GLU C 1 377 ? 15.087 60.608 7.639 1.00 55.93 ? 436 GLU C CA 1 ATOM 9997 C C . GLU C 1 377 ? 14.541 60.620 9.060 1.00 40.01 ? 436 GLU C C 1 ATOM 9998 O O . GLU C 1 377 ? 13.689 61.439 9.400 1.00 48.94 ? 436 GLU C O 1 ATOM 9999 C CB . GLU C 1 377 ? 14.354 59.563 6.794 1.00 57.97 ? 436 GLU C CB 1 ATOM 10000 C CG . GLU C 1 377 ? 12.880 59.845 6.558 1.00 73.24 ? 436 GLU C CG 1 ATOM 10001 C CD . GLU C 1 377 ? 12.644 60.942 5.531 1.00 99.11 ? 436 GLU C CD 1 ATOM 10002 O OE1 . GLU C 1 377 ? 13.629 61.487 4.989 1.00 95.15 ? 436 GLU C OE1 1 ATOM 10003 O OE2 . GLU C 1 377 ? 11.467 61.256 5.260 1.00 106.23 ? 436 GLU C OE2 1 ATOM 10004 N N . SER C 1 378 ? 15.038 59.703 9.884 1.00 50.10 ? 437 SER C N 1 ATOM 10005 C CA . SER C 1 378 ? 14.640 59.624 11.285 1.00 36.68 ? 437 SER C CA 1 ATOM 10006 C C . SER C 1 378 ? 15.169 60.814 12.082 1.00 50.57 ? 437 SER C C 1 ATOM 10007 O O . SER C 1 378 ? 14.441 61.421 12.868 1.00 51.44 ? 437 SER C O 1 ATOM 10008 C CB . SER C 1 378 ? 15.130 58.316 11.909 1.00 37.73 ? 437 SER C CB 1 ATOM 10009 O OG . SER C 1 378 ? 14.613 58.151 13.219 1.00 50.09 ? 437 SER C OG 1 ATOM 10010 N N . LEU C 1 379 ? 16.442 61.136 11.868 1.00 44.51 ? 438 LEU C N 1 ATOM 10011 C CA . LEU C 1 379 ? 17.101 62.240 12.563 1.00 44.11 ? 438 LEU C CA 1 ATOM 10012 C C . LEU C 1 379 ? 16.453 63.587 12.259 1.00 41.05 ? 438 LEU C C 1 ATOM 10013 O O . LEU C 1 379 ? 16.448 64.482 13.102 1.00 44.01 ? 438 LEU C O 1 ATOM 10014 C CB . LEU C 1 379 ? 18.587 62.285 12.199 1.00 51.04 ? 438 LEU C CB 1 ATOM 10015 C CG . LEU C 1 379 ? 19.450 61.129 12.708 1.00 32.50 ? 438 LEU C CG 1 ATOM 10016 C CD1 . LEU C 1 379 ? 20.876 61.256 12.194 1.00 32.57 ? 438 LEU C CD1 1 ATOM 10017 C CD2 . LEU C 1 379 ? 19.426 61.063 14.229 1.00 37.84 ? 438 LEU C CD2 1 ATOM 10018 N N . SER C 1 380 ? 15.919 63.724 11.050 1.00 40.92 ? 439 SER C N 1 ATOM 10019 C CA . SER C 1 380 ? 15.287 64.965 10.610 1.00 42.21 ? 439 SER C CA 1 ATOM 10020 C C . SER C 1 380 ? 14.118 65.379 11.503 1.00 48.07 ? 439 SER C C 1 ATOM 10021 O O . SER C 1 380 ? 13.795 66.563 11.603 1.00 56.22 ? 439 SER C O 1 ATOM 10022 C CB . SER C 1 380 ? 14.809 64.830 9.163 1.00 47.26 ? 439 SER C CB 1 ATOM 10023 O OG . SER C 1 380 ? 15.900 64.610 8.288 1.00 66.61 ? 439 SER C OG 1 ATOM 10024 N N . LYS C 1 381 ? 13.485 64.403 12.146 1.00 33.10 ? 440 LYS C N 1 ATOM 10025 C CA . LYS C 1 381 ? 12.347 64.671 13.019 1.00 42.61 ? 440 LYS C CA 1 ATOM 10026 C C . LYS C 1 381 ? 12.783 65.275 14.353 1.00 41.17 ? 440 LYS C C 1 ATOM 10027 O O . LYS C 1 381 ? 11.972 65.854 15.075 1.00 54.47 ? 440 LYS C O 1 ATOM 10028 C CB . LYS C 1 381 ? 11.554 63.385 13.262 1.00 44.43 ? 440 LYS C CB 1 ATOM 10029 C CG . LYS C 1 381 ? 10.940 62.788 12.005 1.00 60.83 ? 440 LYS C CG 1 ATOM 10030 C CD . LYS C 1 381 ? 9.953 61.679 12.334 1.00 71.69 ? 440 LYS C CD 1 ATOM 10031 C CE . LYS C 1 381 ? 10.580 60.633 13.243 1.00 71.83 ? 440 LYS C CE 1 ATOM 10032 N NZ . LYS C 1 381 ? 9.656 59.494 13.504 1.00 70.45 ? 440 LYS C NZ 1 ATOM 10033 N N . ASP C 1 382 ? 14.065 65.136 14.676 1.00 39.78 ? 441 ASP C N 1 ATOM 10034 C CA . ASP C 1 382 ? 14.618 65.729 15.890 1.00 36.18 ? 441 ASP C CA 1 ATOM 10035 C C . ASP C 1 382 ? 14.762 67.240 15.732 1.00 40.74 ? 441 ASP C C 1 ATOM 10036 O O . ASP C 1 382 ? 15.297 67.713 14.730 1.00 43.23 ? 441 ASP C O 1 ATOM 10037 C CB . ASP C 1 382 ? 15.971 65.095 16.225 1.00 40.95 ? 441 ASP C CB 1 ATOM 10038 C CG . ASP C 1 382 ? 16.505 65.530 17.576 1.00 36.33 ? 441 ASP C CG 1 ATOM 10039 O OD1 . ASP C 1 382 ? 17.051 66.649 17.671 1.00 37.70 ? 441 ASP C OD1 1 ATOM 10040 O OD2 . ASP C 1 382 ? 16.386 64.750 18.544 1.00 41.85 ? 441 ASP C OD2 1 ATOM 10041 N N . PRO C 1 383 ? 14.276 68.004 16.724 1.00 34.44 ? 442 PRO C N 1 ATOM 10042 C CA . PRO C 1 383 ? 14.281 69.473 16.675 1.00 38.60 ? 442 PRO C CA 1 ATOM 10043 C C . PRO C 1 383 ? 15.685 70.075 16.600 1.00 33.42 ? 442 PRO C C 1 ATOM 10044 O O . PRO C 1 383 ? 15.828 71.234 16.209 1.00 45.02 ? 442 PRO C O 1 ATOM 10045 C CB . PRO C 1 383 ? 13.597 69.874 17.988 1.00 32.08 ? 442 PRO C CB 1 ATOM 10046 C CG . PRO C 1 383 ? 12.817 68.679 18.402 1.00 42.49 ? 442 PRO C CG 1 ATOM 10047 C CD . PRO C 1 383 ? 13.595 67.493 17.924 1.00 39.87 ? 442 PRO C CD 1 ATOM 10048 N N . ALA C 1 384 ? 16.702 69.300 16.965 1.00 44.43 ? 443 ALA C N 1 ATOM 10049 C CA . ALA C 1 384 ? 18.072 69.805 16.990 1.00 33.13 ? 443 ALA C CA 1 ATOM 10050 C C . ALA C 1 384 ? 18.847 69.380 15.749 1.00 33.81 ? 443 ALA C C 1 ATOM 10051 O O . ALA C 1 384 ? 20.069 69.516 15.697 1.00 44.09 ? 443 ALA C O 1 ATOM 10052 C CB . ALA C 1 384 ? 18.787 69.333 18.246 1.00 31.24 ? 443 ALA C CB 1 ATOM 10053 N N . HIS C 1 385 ? 18.132 68.858 14.757 1.00 40.24 ? 444 HIS C N 1 ATOM 10054 C CA . HIS C 1 385 ? 18.748 68.432 13.507 1.00 31.57 ? 444 HIS C CA 1 ATOM 10055 C C . HIS C 1 385 ? 19.377 69.626 12.787 1.00 31.36 ? 444 HIS C C 1 ATOM 10056 O O . HIS C 1 385 ? 18.898 70.751 12.925 1.00 39.81 ? 444 HIS C O 1 ATOM 10057 C CB . HIS C 1 385 ? 17.716 67.736 12.613 1.00 40.11 ? 444 HIS C CB 1 ATOM 10058 C CG . HIS C 1 385 ? 16.719 68.668 11.998 1.00 65.87 ? 444 HIS C CG 1 ATOM 10059 N ND1 . HIS C 1 385 ? 15.662 69.199 12.707 1.00 80.45 ? 444 HIS C ND1 1 ATOM 10060 C CD2 . HIS C 1 385 ? 16.612 69.159 10.741 1.00 61.37 ? 444 HIS C CD2 1 ATOM 10061 C CE1 . HIS C 1 385 ? 14.950 69.980 11.914 1.00 64.21 ? 444 HIS C CE1 1 ATOM 10062 N NE2 . HIS C 1 385 ? 15.505 69.973 10.716 1.00 69.68 ? 444 HIS C NE2 1 ATOM 10063 N N . PRO C 1 386 ? 20.457 69.392 12.020 1.00 36.30 ? 445 PRO C N 1 ATOM 10064 C CA . PRO C 1 386 ? 21.139 68.115 11.764 1.00 37.21 ? 445 PRO C CA 1 ATOM 10065 C C . PRO C 1 386 ? 21.869 67.556 12.986 1.00 41.77 ? 445 PRO C C 1 ATOM 10066 O O . PRO C 1 386 ? 22.560 68.291 13.691 1.00 45.82 ? 445 PRO C O 1 ATOM 10067 C CB . PRO C 1 386 ? 22.136 68.470 10.658 1.00 33.97 ? 445 PRO C CB 1 ATOM 10068 C CG . PRO C 1 386 ? 22.411 69.915 10.861 1.00 30.91 ? 445 PRO C CG 1 ATOM 10069 C CD . PRO C 1 386 ? 21.110 70.508 11.313 1.00 31.04 ? 445 PRO C CD 1 ATOM 10070 N N . ILE C 1 387 ? 21.702 66.260 13.224 1.00 42.35 ? 446 ILE C N 1 ATOM 10071 C CA . ILE C 1 387 ? 22.315 65.600 14.369 1.00 48.02 ? 446 ILE C CA 1 ATOM 10072 C C . ILE C 1 387 ? 23.749 65.171 14.065 1.00 45.23 ? 446 ILE C C 1 ATOM 10073 O O . ILE C 1 387 ? 24.640 65.317 14.901 1.00 38.42 ? 446 ILE C O 1 ATOM 10074 C CB . ILE C 1 387 ? 21.493 64.368 14.807 1.00 39.22 ? 446 ILE C CB 1 ATOM 10075 C CG1 . ILE C 1 387 ? 20.044 64.768 15.091 1.00 35.96 ? 446 ILE C CG1 1 ATOM 10076 C CG2 . ILE C 1 387 ? 22.114 63.713 16.028 1.00 38.99 ? 446 ILE C CG2 1 ATOM 10077 C CD1 . ILE C 1 387 ? 19.906 65.876 16.114 1.00 36.09 ? 446 ILE C CD1 1 ATOM 10078 N N . LEU C 1 388 ? 23.964 64.640 12.866 1.00 42.14 ? 447 LEU C N 1 ATOM 10079 C CA . LEU C 1 388 ? 25.286 64.176 12.456 1.00 42.99 ? 447 LEU C CA 1 ATOM 10080 C C . LEU C 1 388 ? 25.820 64.930 11.244 1.00 30.86 ? 447 LEU C C 1 ATOM 10081 O O . LEU C 1 388 ? 25.063 65.291 10.344 1.00 34.77 ? 447 LEU C O 1 ATOM 10082 C CB . LEU C 1 388 ? 25.255 62.679 12.143 1.00 31.15 ? 447 LEU C CB 1 ATOM 10083 C CG . LEU C 1 388 ? 25.076 61.704 13.306 1.00 48.13 ? 447 LEU C CG 1 ATOM 10084 C CD1 . LEU C 1 388 ? 24.906 60.289 12.777 1.00 32.46 ? 447 LEU C CD1 1 ATOM 10085 C CD2 . LEU C 1 388 ? 26.255 61.784 14.261 1.00 42.00 ? 447 LEU C CD2 1 ATOM 10086 N N . ALA C 1 389 ? 27.127 65.173 11.231 1.00 39.56 ? 448 ALA C N 1 ATOM 10087 C CA . ALA C 1 389 ? 27.795 65.643 10.024 1.00 43.45 ? 448 ALA C CA 1 ATOM 10088 C C . ALA C 1 389 ? 27.684 64.564 8.952 1.00 41.20 ? 448 ALA C C 1 ATOM 10089 O O . ALA C 1 389 ? 27.801 63.375 9.249 1.00 57.07 ? 448 ALA C O 1 ATOM 10090 C CB . ALA C 1 389 ? 29.249 65.981 10.306 1.00 30.24 ? 448 ALA C CB 1 ATOM 10091 N N . TYR C 1 390 ? 27.459 64.979 7.709 1.00 43.57 ? 449 TYR C N 1 ATOM 10092 C CA . TYR C 1 390 ? 27.147 64.045 6.629 1.00 47.50 ? 449 TYR C CA 1 ATOM 10093 C C . TYR C 1 390 ? 28.290 63.093 6.285 1.00 45.39 ? 449 TYR C C 1 ATOM 10094 O O . TYR C 1 390 ? 28.061 62.039 5.693 1.00 39.60 ? 449 TYR C O 1 ATOM 10095 C CB . TYR C 1 390 ? 26.730 64.808 5.370 1.00 35.79 ? 449 TYR C CB 1 ATOM 10096 C CG . TYR C 1 390 ? 25.476 65.634 5.536 1.00 37.88 ? 449 TYR C CG 1 ATOM 10097 C CD1 . TYR C 1 390 ? 24.500 65.271 6.453 1.00 32.02 ? 449 TYR C CD1 1 ATOM 10098 C CD2 . TYR C 1 390 ? 25.262 66.768 4.765 1.00 38.69 ? 449 TYR C CD2 1 ATOM 10099 C CE1 . TYR C 1 390 ? 23.350 66.021 6.607 1.00 47.70 ? 449 TYR C CE1 1 ATOM 10100 C CE2 . TYR C 1 390 ? 24.114 67.523 4.910 1.00 32.07 ? 449 TYR C CE2 1 ATOM 10101 C CZ . TYR C 1 390 ? 23.162 67.145 5.833 1.00 44.15 ? 449 TYR C CZ 1 ATOM 10102 O OH . TYR C 1 390 ? 22.019 67.895 5.980 1.00 49.89 ? 449 TYR C OH 1 ATOM 10103 N N . LYS C 1 391 ? 29.513 63.462 6.650 1.00 30.59 ? 450 LYS C N 1 ATOM 10104 C CA . LYS C 1 391 ? 30.682 62.635 6.352 1.00 31.77 ? 450 LYS C CA 1 ATOM 10105 C C . LYS C 1 391 ? 30.631 61.279 7.055 1.00 36.75 ? 450 LYS C C 1 ATOM 10106 O O . LYS C 1 391 ? 31.368 60.361 6.696 1.00 53.07 ? 450 LYS C O 1 ATOM 10107 C CB . LYS C 1 391 ? 31.973 63.368 6.732 1.00 30.19 ? 450 LYS C CB 1 ATOM 10108 C CG . LYS C 1 391 ? 32.007 63.895 8.155 1.00 35.98 ? 450 LYS C CG 1 ATOM 10109 C CD . LYS C 1 391 ? 33.333 64.579 8.447 1.00 29.80 ? 450 LYS C CD 1 ATOM 10110 C CE . LYS C 1 391 ? 33.276 65.374 9.740 1.00 54.25 ? 450 LYS C CE 1 ATOM 10111 N NZ . LYS C 1 391 ? 34.605 65.939 10.100 1.00 29.42 ? 450 LYS C NZ 1 ATOM 10112 N N . HIS C 1 392 ? 29.766 61.159 8.057 1.00 34.46 ? 451 HIS C N 1 ATOM 10113 C CA . HIS C 1 392 ? 29.599 59.903 8.781 1.00 45.02 ? 451 HIS C CA 1 ATOM 10114 C C . HIS C 1 392 ? 28.754 58.894 8.007 1.00 42.90 ? 451 HIS C C 1 ATOM 10115 O O . HIS C 1 392 ? 28.824 57.693 8.267 1.00 41.54 ? 451 HIS C O 1 ATOM 10116 C CB . HIS C 1 392 ? 28.969 60.159 10.152 1.00 30.83 ? 451 HIS C CB 1 ATOM 10117 C CG . HIS C 1 392 ? 29.879 60.853 11.114 1.00 46.48 ? 451 HIS C CG 1 ATOM 10118 N ND1 . HIS C 1 392 ? 30.818 60.182 11.866 1.00 44.21 ? 451 HIS C ND1 1 ATOM 10119 C CD2 . HIS C 1 392 ? 29.995 62.160 11.448 1.00 44.94 ? 451 HIS C CD2 1 ATOM 10120 C CE1 . HIS C 1 392 ? 31.474 61.045 12.621 1.00 41.39 ? 451 HIS C CE1 1 ATOM 10121 N NE2 . HIS C 1 392 ? 30.993 62.253 12.386 1.00 48.67 ? 451 HIS C NE2 1 ATOM 10122 N N . TYR C 1 393 ? 27.957 59.384 7.062 1.00 45.41 ? 452 TYR C N 1 ATOM 10123 C CA . TYR C 1 393 ? 27.103 58.511 6.256 1.00 33.87 ? 452 TYR C CA 1 ATOM 10124 C C . TYR C 1 393 ? 27.894 57.521 5.385 1.00 42.47 ? 452 TYR C C 1 ATOM 10125 O O . TYR C 1 393 ? 27.602 56.325 5.412 1.00 35.37 ? 452 TYR C O 1 ATOM 10126 C CB . TYR C 1 393 ? 26.156 59.338 5.376 1.00 33.88 ? 452 TYR C CB 1 ATOM 10127 C CG . TYR C 1 393 ? 25.118 60.122 6.146 1.00 40.54 ? 452 TYR C CG 1 ATOM 10128 C CD1 . TYR C 1 393 ? 24.689 59.703 7.398 1.00 44.79 ? 452 TYR C CD1 1 ATOM 10129 C CD2 . TYR C 1 393 ? 24.555 61.274 5.612 1.00 44.54 ? 452 TYR C CD2 1 ATOM 10130 C CE1 . TYR C 1 393 ? 23.738 60.417 8.103 1.00 52.14 ? 452 TYR C CE1 1 ATOM 10131 C CE2 . TYR C 1 393 ? 23.602 61.992 6.307 1.00 37.19 ? 452 TYR C CE2 1 ATOM 10132 C CZ . TYR C 1 393 ? 23.198 61.560 7.552 1.00 41.50 ? 452 TYR C CZ 1 ATOM 10133 O OH . TYR C 1 393 ? 22.249 62.276 8.247 1.00 35.12 ? 452 TYR C OH 1 ATOM 10134 N N . PRO C 1 394 ? 28.886 58.001 4.603 1.00 49.93 ? 453 PRO C N 1 ATOM 10135 C CA . PRO C 1 394 ? 29.651 57.007 3.838 1.00 52.14 ? 453 PRO C CA 1 ATOM 10136 C C . PRO C 1 394 ? 30.446 56.063 4.735 1.00 55.62 ? 453 PRO C C 1 ATOM 10137 O O . PRO C 1 394 ? 30.711 54.925 4.346 1.00 70.87 ? 453 PRO C O 1 ATOM 10138 C CB . PRO C 1 394 ? 30.595 57.860 2.981 1.00 43.14 ? 453 PRO C CB 1 ATOM 10139 C CG . PRO C 1 394 ? 30.667 59.169 3.664 1.00 33.80 ? 453 PRO C CG 1 ATOM 10140 C CD . PRO C 1 394 ? 29.343 59.374 4.321 1.00 31.08 ? 453 PRO C CD 1 ATOM 10141 N N . ALA C 1 395 ? 30.821 56.538 5.918 1.00 41.55 ? 454 ALA C N 1 ATOM 10142 C CA . ALA C 1 395 ? 31.564 55.725 6.874 1.00 53.87 ? 454 ALA C CA 1 ATOM 10143 C C . ALA C 1 395 ? 30.734 54.540 7.353 1.00 52.17 ? 454 ALA C C 1 ATOM 10144 O O . ALA C 1 395 ? 31.243 53.428 7.480 1.00 35.91 ? 454 ALA C O 1 ATOM 10145 C CB . ALA C 1 395 ? 32.009 56.570 8.057 1.00 30.69 ? 454 ALA C CB 1 HETATM 10146 N N . MSE C 1 396 ? 29.453 54.784 7.612 1.00 37.87 ? 455 MSE C N 1 HETATM 10147 C CA . MSE C 1 396 ? 28.556 53.736 8.086 1.00 51.20 ? 455 MSE C CA 1 HETATM 10148 C C . MSE C 1 396 ? 28.238 52.729 6.987 1.00 51.82 ? 455 MSE C C 1 HETATM 10149 O O . MSE C 1 396 ? 28.098 51.535 7.250 1.00 56.16 ? 455 MSE C O 1 HETATM 10150 C CB . MSE C 1 396 ? 27.265 54.346 8.631 1.00 31.75 ? 455 MSE C CB 1 HETATM 10151 C CG . MSE C 1 396 ? 27.458 55.159 9.898 1.00 31.58 ? 455 MSE C CG 1 HETATM 10152 SE SE . MSE C 1 396 ? 25.778 55.866 10.581 1.00 67.47 ? 455 MSE C SE 1 HETATM 10153 C CE . MSE C 1 396 ? 24.775 54.198 10.659 1.00 38.28 ? 455 MSE C CE 1 ATOM 10154 N N . GLU C 1 397 ? 28.119 53.217 5.756 1.00 52.21 ? 456 GLU C N 1 ATOM 10155 C CA . GLU C 1 397 ? 27.897 52.343 4.610 1.00 47.51 ? 456 GLU C CA 1 ATOM 10156 C C . GLU C 1 397 ? 29.104 51.437 4.402 1.00 44.83 ? 456 GLU C C 1 ATOM 10157 O O . GLU C 1 397 ? 28.961 50.251 4.106 1.00 52.10 ? 456 GLU C O 1 ATOM 10158 C CB . GLU C 1 397 ? 27.617 53.162 3.350 1.00 44.42 ? 456 GLU C CB 1 ATOM 10159 C CG . GLU C 1 397 ? 26.339 53.980 3.421 1.00 42.31 ? 456 GLU C CG 1 ATOM 10160 C CD . GLU C 1 397 ? 25.095 53.114 3.471 1.00 51.40 ? 456 GLU C CD 1 ATOM 10161 O OE1 . GLU C 1 397 ? 25.134 51.983 2.940 1.00 56.07 ? 456 GLU C OE1 1 ATOM 10162 O OE2 . GLU C 1 397 ? 24.079 53.562 4.042 1.00 40.89 ? 456 GLU C OE2 1 ATOM 10163 N N . ARG C 1 398 ? 30.293 52.012 4.557 1.00 52.34 ? 457 ARG C N 1 ATOM 10164 C CA . ARG C 1 398 ? 31.539 51.266 4.432 1.00 48.69 ? 457 ARG C CA 1 ATOM 10165 C C . ARG C 1 398 ? 31.648 50.196 5.513 1.00 47.16 ? 457 ARG C C 1 ATOM 10166 O O . ARG C 1 398 ? 32.117 49.088 5.257 1.00 43.16 ? 457 ARG C O 1 ATOM 10167 C CB . ARG C 1 398 ? 32.738 52.215 4.500 1.00 39.23 ? 457 ARG C CB 1 ATOM 10168 C CG . ARG C 1 398 ? 34.086 51.522 4.386 1.00 39.33 ? 457 ARG C CG 1 ATOM 10169 C CD . ARG C 1 398 ? 35.241 52.509 4.475 1.00 40.56 ? 457 ARG C CD 1 ATOM 10170 N NE . ARG C 1 398 ? 35.296 53.197 5.761 1.00 49.61 ? 457 ARG C NE 1 ATOM 10171 C CZ . ARG C 1 398 ? 35.081 54.500 5.918 1.00 43.46 ? 457 ARG C CZ 1 ATOM 10172 N NH1 . ARG C 1 398 ? 34.802 55.257 4.867 1.00 37.98 ? 457 ARG C NH1 1 ATOM 10173 N NH2 . ARG C 1 398 ? 35.151 55.047 7.124 1.00 40.35 ? 457 ARG C NH2 1 ATOM 10174 N N . ARG C 1 399 ? 31.205 50.534 6.719 1.00 40.81 ? 458 ARG C N 1 ATOM 10175 C CA . ARG C 1 399 ? 31.274 49.613 7.848 1.00 47.22 ? 458 ARG C CA 1 ATOM 10176 C C . ARG C 1 399 ? 30.263 48.478 7.715 1.00 43.88 ? 458 ARG C C 1 ATOM 10177 O O . ARG C 1 399 ? 30.547 47.341 8.090 1.00 45.73 ? 458 ARG C O 1 ATOM 10178 C CB . ARG C 1 399 ? 31.051 50.368 9.159 1.00 31.35 ? 458 ARG C CB 1 ATOM 10179 C CG . ARG C 1 399 ? 32.205 51.280 9.540 1.00 39.10 ? 458 ARG C CG 1 ATOM 10180 C CD . ARG C 1 399 ? 31.788 52.305 10.579 1.00 37.31 ? 458 ARG C CD 1 ATOM 10181 N NE . ARG C 1 399 ? 32.739 53.410 10.657 1.00 31.89 ? 458 ARG C NE 1 ATOM 10182 C CZ . ARG C 1 399 ? 32.516 54.545 11.312 1.00 34.44 ? 458 ARG C CZ 1 ATOM 10183 N NH1 . ARG C 1 399 ? 31.368 54.733 11.947 1.00 38.40 ? 458 ARG C NH1 1 ATOM 10184 N NH2 . ARG C 1 399 ? 33.441 55.495 11.328 1.00 45.48 ? 458 ARG C NH2 1 ATOM 10185 N N . LEU C 1 400 ? 29.085 48.792 7.184 1.00 42.19 ? 459 LEU C N 1 ATOM 10186 C CA . LEU C 1 400 ? 28.059 47.782 6.942 1.00 54.25 ? 459 LEU C CA 1 ATOM 10187 C C . LEU C 1 400 ? 28.562 46.717 5.975 1.00 59.69 ? 459 LEU C C 1 ATOM 10188 O O . LEU C 1 400 ? 28.388 45.522 6.209 1.00 47.41 ? 459 LEU C O 1 ATOM 10189 C CB . LEU C 1 400 ? 26.782 48.423 6.398 1.00 45.08 ? 459 LEU C CB 1 ATOM 10190 C CG . LEU C 1 400 ? 25.657 47.441 6.062 1.00 47.45 ? 459 LEU C CG 1 ATOM 10191 C CD1 . LEU C 1 400 ? 25.210 46.692 7.307 1.00 32.98 ? 459 LEU C CD1 1 ATOM 10192 C CD2 . LEU C 1 400 ? 24.484 48.160 5.414 1.00 33.58 ? 459 LEU C CD2 1 ATOM 10193 N N . ALA C 1 401 ? 29.188 47.164 4.890 1.00 52.21 ? 460 ALA C N 1 ATOM 10194 C CA . ALA C 1 401 ? 29.749 46.263 3.890 1.00 52.30 ? 460 ALA C CA 1 ATOM 10195 C C . ALA C 1 401 ? 30.796 45.337 4.502 1.00 54.40 ? 460 ALA C C 1 ATOM 10196 O O . ALA C 1 401 ? 30.857 44.152 4.177 1.00 59.60 ? 460 ALA C O 1 ATOM 10197 C CB . ALA C 1 401 ? 30.350 47.057 2.742 1.00 42.42 ? 460 ALA C CB 1 ATOM 10198 N N . LYS C 1 402 ? 31.620 45.888 5.388 1.00 39.56 ? 461 LYS C N 1 ATOM 10199 C CA . LYS C 1 402 ? 32.644 45.106 6.069 1.00 56.99 ? 461 LYS C CA 1 ATOM 10200 C C . LYS C 1 402 ? 32.010 44.064 6.987 1.00 51.73 ? 461 LYS C C 1 ATOM 10201 O O . LYS C 1 402 ? 32.533 42.960 7.137 1.00 59.35 ? 461 LYS C O 1 ATOM 10202 C CB . LYS C 1 402 ? 33.575 46.025 6.861 1.00 31.28 ? 461 LYS C CB 1 ATOM 10203 C CG . LYS C 1 402 ? 34.390 46.968 5.987 1.00 48.59 ? 461 LYS C CG 1 ATOM 10204 C CD . LYS C 1 402 ? 35.252 47.903 6.818 1.00 45.81 ? 461 LYS C CD 1 ATOM 10205 C CE . LYS C 1 402 ? 36.303 48.592 5.963 1.00 50.98 ? 461 LYS C CE 1 ATOM 10206 N NZ . LYS C 1 402 ? 37.222 49.427 6.785 1.00 58.98 ? 461 LYS C NZ 1 ATOM 10207 N N . ILE C 1 403 ? 30.888 44.424 7.604 1.00 51.01 ? 462 ILE C N 1 ATOM 10208 C CA . ILE C 1 403 ? 30.152 43.498 8.459 1.00 39.49 ? 462 ILE C CA 1 ATOM 10209 C C . ILE C 1 403 ? 29.649 42.305 7.653 1.00 50.91 ? 462 ILE C C 1 ATOM 10210 O O . ILE C 1 403 ? 29.820 41.155 8.059 1.00 44.61 ? 462 ILE C O 1 ATOM 10211 C CB . ILE C 1 403 ? 28.957 44.184 9.153 1.00 33.77 ? 462 ILE C CB 1 ATOM 10212 C CG1 . ILE C 1 403 ? 29.448 45.154 10.228 1.00 37.03 ? 462 ILE C CG1 1 ATOM 10213 C CG2 . ILE C 1 403 ? 28.032 43.150 9.777 1.00 34.37 ? 462 ILE C CG2 1 ATOM 10214 C CD1 . ILE C 1 403 ? 28.411 46.175 10.641 1.00 36.27 ? 462 ILE C CD1 1 HETATM 10215 N N . MSE C 1 404 ? 29.038 42.588 6.506 1.00 35.04 ? 463 MSE C N 1 HETATM 10216 C CA . MSE C 1 404 ? 28.508 41.543 5.636 1.00 47.89 ? 463 MSE C CA 1 HETATM 10217 C C . MSE C 1 404 ? 29.615 40.613 5.151 1.00 32.65 ? 463 MSE C C 1 HETATM 10218 O O . MSE C 1 404 ? 29.391 39.419 4.950 1.00 46.56 ? 463 MSE C O 1 HETATM 10219 C CB . MSE C 1 404 ? 27.778 42.155 4.438 1.00 32.95 ? 463 MSE C CB 1 HETATM 10220 C CG . MSE C 1 404 ? 26.734 43.198 4.802 1.00 33.08 ? 463 MSE C CG 1 HETATM 10221 SE SE . MSE C 1 404 ? 25.564 42.664 6.269 1.00 77.41 ? 463 MSE C SE 1 HETATM 10222 C CE . MSE C 1 404 ? 24.887 40.988 5.543 1.00 55.95 ? 463 MSE C CE 1 ATOM 10223 N N . SER C 1 405 ? 30.808 41.168 4.963 1.00 35.04 ? 464 SER C N 1 ATOM 10224 C CA . SER C 1 405 ? 31.967 40.377 4.573 1.00 40.25 ? 464 SER C CA 1 ATOM 10225 C C . SER C 1 405 ? 32.339 39.391 5.677 1.00 51.44 ? 464 SER C C 1 ATOM 10226 O O . SER C 1 405 ? 32.683 38.241 5.407 1.00 57.47 ? 464 SER C O 1 ATOM 10227 C CB . SER C 1 405 ? 33.155 41.288 4.252 1.00 39.21 ? 464 SER C CB 1 ATOM 10228 O OG . SER C 1 405 ? 34.328 40.532 4.010 1.00 66.27 ? 464 SER C OG 1 ATOM 10229 N N . HIS C 1 406 ? 32.269 39.855 6.921 1.00 50.59 ? 465 HIS C N 1 ATOM 10230 C CA . HIS C 1 406 ? 32.538 39.014 8.082 1.00 55.53 ? 465 HIS C CA 1 ATOM 10231 C C . HIS C 1 406 ? 31.465 37.945 8.271 1.00 52.13 ? 465 HIS C C 1 ATOM 10232 O O . HIS C 1 406 ? 31.749 36.843 8.740 1.00 49.66 ? 465 HIS C O 1 ATOM 10233 C CB . HIS C 1 406 ? 32.653 39.869 9.344 1.00 35.11 ? 465 HIS C CB 1 ATOM 10234 C CG . HIS C 1 406 ? 33.777 40.856 9.302 1.00 46.05 ? 465 HIS C CG 1 ATOM 10235 N ND1 . HIS C 1 406 ? 34.963 40.603 8.648 1.00 57.66 ? 465 HIS C ND1 1 ATOM 10236 C CD2 . HIS C 1 406 ? 33.894 42.097 9.830 1.00 55.01 ? 465 HIS C CD2 1 ATOM 10237 C CE1 . HIS C 1 406 ? 35.765 41.645 8.777 1.00 51.95 ? 465 HIS C CE1 1 ATOM 10238 N NE2 . HIS C 1 406 ? 35.140 42.566 9.489 1.00 61.61 ? 465 HIS C NE2 1 ATOM 10239 N N . ILE C 1 407 ? 30.232 38.279 7.906 1.00 42.26 ? 466 ILE C N 1 ATOM 10240 C CA . ILE C 1 407 ? 29.117 37.346 8.020 1.00 49.87 ? 466 ILE C CA 1 ATOM 10241 C C . ILE C 1 407 ? 29.261 36.205 7.017 1.00 61.97 ? 466 ILE C C 1 ATOM 10242 O O . ILE C 1 407 ? 29.024 35.043 7.350 1.00 42.37 ? 466 ILE C O 1 ATOM 10243 C CB . ILE C 1 407 ? 27.766 38.058 7.810 1.00 39.93 ? 466 ILE C CB 1 ATOM 10244 C CG1 . ILE C 1 407 ? 27.504 39.045 8.948 1.00 33.15 ? 466 ILE C CG1 1 ATOM 10245 C CG2 . ILE C 1 407 ? 26.631 37.051 7.724 1.00 44.16 ? 466 ILE C CG2 1 ATOM 10246 C CD1 . ILE C 1 407 ? 26.301 39.930 8.723 1.00 33.55 ? 466 ILE C CD1 1 ATOM 10247 N N . LEU C 1 408 ? 29.657 36.542 5.794 1.00 57.17 ? 467 LEU C N 1 ATOM 10248 C CA . LEU C 1 408 ? 29.899 35.541 4.762 1.00 45.15 ? 467 LEU C CA 1 ATOM 10249 C C . LEU C 1 408 ? 30.985 34.562 5.195 1.00 56.27 ? 467 LEU C C 1 ATOM 10250 O O . LEU C 1 408 ? 30.916 33.369 4.898 1.00 55.94 ? 467 LEU C O 1 ATOM 10251 C CB . LEU C 1 408 ? 30.291 36.209 3.442 1.00 46.40 ? 467 LEU C CB 1 ATOM 10252 C CG . LEU C 1 408 ? 30.584 35.278 2.263 1.00 38.98 ? 467 LEU C CG 1 ATOM 10253 C CD1 . LEU C 1 408 ? 29.402 34.360 1.994 1.00 45.09 ? 467 LEU C CD1 1 ATOM 10254 C CD2 . LEU C 1 408 ? 30.941 36.078 1.020 1.00 40.59 ? 467 LEU C CD2 1 ATOM 10255 N N . GLU C 1 409 ? 31.984 35.074 5.907 1.00 61.34 ? 468 GLU C N 1 ATOM 10256 C CA . GLU C 1 409 ? 33.077 34.245 6.403 1.00 57.13 ? 468 GLU C CA 1 ATOM 10257 C C . GLU C 1 409 ? 32.592 33.264 7.467 1.00 62.57 ? 468 GLU C C 1 ATOM 10258 O O . GLU C 1 409 ? 33.031 32.115 7.506 1.00 70.39 ? 468 GLU C O 1 ATOM 10259 C CB . GLU C 1 409 ? 34.198 35.125 6.965 1.00 56.71 ? 468 GLU C CB 1 ATOM 10260 C CG . GLU C 1 409 ? 35.319 34.359 7.654 1.00 77.64 ? 468 GLU C CG 1 ATOM 10261 C CD . GLU C 1 409 ? 36.094 33.461 6.707 1.00 96.68 ? 468 GLU C CD 1 ATOM 10262 O OE1 . GLU C 1 409 ? 36.080 33.722 5.486 1.00 108.61 ? 468 GLU C OE1 1 ATOM 10263 O OE2 . GLU C 1 409 ? 36.720 32.492 7.187 1.00 93.80 ? 468 GLU C OE2 1 ATOM 10264 N N . CYS C 1 410 ? 31.685 33.720 8.324 1.00 53.34 ? 469 CYS C N 1 ATOM 10265 C CA . CYS C 1 410 ? 31.087 32.851 9.332 1.00 57.52 ? 469 CYS C CA 1 ATOM 10266 C C . CYS C 1 410 ? 30.235 31.762 8.686 1.00 58.13 ? 469 CYS C C 1 ATOM 10267 O O . CYS C 1 410 ? 30.212 30.623 9.151 1.00 69.19 ? 469 CYS C O 1 ATOM 10268 C CB . CYS C 1 410 ? 30.249 33.664 10.321 1.00 49.84 ? 469 CYS C CB 1 ATOM 10269 S SG . CYS C 1 410 ? 31.221 34.571 11.547 1.00 49.14 ? 469 CYS C SG 1 ATOM 10270 N N . PHE C 1 411 ? 29.536 32.120 7.614 1.00 54.90 ? 470 PHE C N 1 ATOM 10271 C CA . PHE C 1 411 ? 28.712 31.166 6.877 1.00 52.98 ? 470 PHE C CA 1 ATOM 10272 C C . PHE C 1 411 ? 29.552 30.073 6.222 1.00 64.33 ? 470 PHE C C 1 ATOM 10273 O O . PHE C 1 411 ? 29.166 28.905 6.209 1.00 50.37 ? 470 PHE C O 1 ATOM 10274 C CB . PHE C 1 411 ? 27.880 31.882 5.809 1.00 45.62 ? 470 PHE C CB 1 ATOM 10275 C CG . PHE C 1 411 ? 26.717 32.662 6.358 1.00 49.07 ? 470 PHE C CG 1 ATOM 10276 C CD1 . PHE C 1 411 ? 26.406 32.621 7.707 1.00 40.46 ? 470 PHE C CD1 1 ATOM 10277 C CD2 . PHE C 1 411 ? 25.928 33.429 5.518 1.00 44.72 ? 470 PHE C CD2 1 ATOM 10278 C CE1 . PHE C 1 411 ? 25.335 33.337 8.208 1.00 51.31 ? 470 PHE C CE1 1 ATOM 10279 C CE2 . PHE C 1 411 ? 24.855 34.145 6.012 1.00 51.71 ? 470 PHE C CE2 1 ATOM 10280 C CZ . PHE C 1 411 ? 24.558 34.099 7.358 1.00 55.43 ? 470 PHE C CZ 1 ATOM 10281 N N . GLU C 1 412 ? 30.703 30.457 5.682 1.00 57.85 ? 471 GLU C N 1 ATOM 10282 C CA . GLU C 1 412 ? 31.557 29.524 4.957 1.00 52.59 ? 471 GLU C CA 1 ATOM 10283 C C . GLU C 1 412 ? 32.364 28.638 5.902 1.00 50.39 ? 471 GLU C C 1 ATOM 10284 O O . GLU C 1 412 ? 32.676 27.492 5.579 1.00 63.64 ? 471 GLU C O 1 ATOM 10285 C CB . GLU C 1 412 ? 32.495 30.290 4.021 1.00 43.19 ? 471 GLU C CB 1 ATOM 10286 C CG . GLU C 1 412 ? 31.779 30.985 2.873 1.00 48.73 ? 471 GLU C CG 1 ATOM 10287 C CD . GLU C 1 412 ? 32.717 31.791 1.998 1.00 66.09 ? 471 GLU C CD 1 ATOM 10288 O OE1 . GLU C 1 412 ? 33.840 32.098 2.451 1.00 73.67 ? 471 GLU C OE1 1 ATOM 10289 O OE2 . GLU C 1 412 ? 32.329 32.122 0.857 1.00 59.49 ? 471 GLU C OE2 1 ATOM 10290 N N . SER C 1 413 ? 32.696 29.179 7.068 1.00 50.95 ? 472 SER C N 1 ATOM 10291 C CA . SER C 1 413 ? 33.494 28.466 8.061 1.00 52.66 ? 472 SER C CA 1 ATOM 10292 C C . SER C 1 413 ? 32.658 27.562 8.966 1.00 57.84 ? 472 SER C C 1 ATOM 10293 O O . SER C 1 413 ? 33.051 26.433 9.257 1.00 78.07 ? 472 SER C O 1 ATOM 10294 C CB . SER C 1 413 ? 34.288 29.458 8.916 1.00 53.33 ? 472 SER C CB 1 ATOM 10295 O OG . SER C 1 413 ? 33.438 30.161 9.803 1.00 77.08 ? 472 SER C OG 1 ATOM 10296 N N . ARG C 1 414 ? 31.507 28.058 9.410 1.00 57.84 ? 473 ARG C N 1 ATOM 10297 C CA . ARG C 1 414 ? 30.692 27.334 10.381 1.00 47.42 ? 473 ARG C CA 1 ATOM 10298 C C . ARG C 1 414 ? 29.428 26.719 9.788 1.00 50.96 ? 473 ARG C C 1 ATOM 10299 O O . ARG C 1 414 ? 28.906 25.735 10.310 1.00 55.66 ? 473 ARG C O 1 ATOM 10300 C CB . ARG C 1 414 ? 30.285 28.271 11.520 1.00 56.27 ? 473 ARG C CB 1 ATOM 10301 C CG . ARG C 1 414 ? 31.420 29.082 12.112 1.00 62.09 ? 473 ARG C CG 1 ATOM 10302 C CD . ARG C 1 414 ? 32.319 28.241 12.991 1.00 63.26 ? 473 ARG C CD 1 ATOM 10303 N NE . ARG C 1 414 ? 33.203 29.084 13.789 1.00 87.81 ? 473 ARG C NE 1 ATOM 10304 C CZ . ARG C 1 414 ? 32.851 29.651 14.939 1.00 101.61 ? 473 ARG C CZ 1 ATOM 10305 N NH1 . ARG C 1 414 ? 31.633 29.461 15.427 1.00 106.66 ? 473 ARG C NH1 1 ATOM 10306 N NH2 . ARG C 1 414 ? 33.716 30.407 15.601 1.00 100.15 ? 473 ARG C NH2 1 ATOM 10307 N N . GLY C 1 415 ? 28.939 27.299 8.699 1.00 52.33 ? 474 GLY C N 1 ATOM 10308 C CA . GLY C 1 415 ? 27.689 26.861 8.108 1.00 50.51 ? 474 GLY C CA 1 ATOM 10309 C C . GLY C 1 415 ? 26.577 27.771 8.589 1.00 64.18 ? 474 GLY C C 1 ATOM 10310 O O . GLY C 1 415 ? 26.631 28.285 9.705 1.00 63.98 ? 474 GLY C O 1 ATOM 10311 N N . VAL C 1 416 ? 25.561 27.962 7.756 1.00 55.66 ? 475 VAL C N 1 ATOM 10312 C CA . VAL C 1 416 ? 24.488 28.904 8.059 1.00 56.65 ? 475 VAL C CA 1 ATOM 10313 C C . VAL C 1 416 ? 23.581 28.450 9.202 1.00 59.44 ? 475 VAL C C 1 ATOM 10314 O O . VAL C 1 416 ? 22.971 29.277 9.880 1.00 61.79 ? 475 VAL C O 1 ATOM 10315 C CB . VAL C 1 416 ? 23.618 29.172 6.814 1.00 67.13 ? 475 VAL C CB 1 ATOM 10316 C CG1 . VAL C 1 416 ? 24.441 29.860 5.738 1.00 68.97 ? 475 VAL C CG1 1 ATOM 10317 C CG2 . VAL C 1 416 ? 23.017 27.878 6.289 1.00 64.20 ? 475 VAL C CG2 1 ATOM 10318 N N . ALA C 1 417 ? 23.490 27.141 9.412 1.00 62.12 ? 476 ALA C N 1 ATOM 10319 C CA . ALA C 1 417 ? 22.585 26.599 10.419 1.00 53.39 ? 476 ALA C CA 1 ATOM 10320 C C . ALA C 1 417 ? 23.101 26.778 11.845 1.00 48.09 ? 476 ALA C C 1 ATOM 10321 O O . ALA C 1 417 ? 22.335 26.665 12.802 1.00 68.81 ? 476 ALA C O 1 ATOM 10322 C CB . ALA C 1 417 ? 22.322 25.127 10.140 1.00 46.48 ? 476 ALA C CB 1 ATOM 10323 N N . GLU C 1 418 ? 24.390 27.064 11.990 1.00 45.47 ? 477 GLU C N 1 ATOM 10324 C CA . GLU C 1 418 ? 24.969 27.264 13.315 1.00 66.70 ? 477 GLU C CA 1 ATOM 10325 C C . GLU C 1 418 ? 25.210 28.741 13.606 1.00 59.44 ? 477 GLU C C 1 ATOM 10326 O O . GLU C 1 418 ? 25.365 29.137 14.761 1.00 63.87 ? 477 GLU C O 1 ATOM 10327 C CB . GLU C 1 418 ? 26.274 26.479 13.462 1.00 58.80 ? 477 GLU C CB 1 ATOM 10328 C CG . GLU C 1 418 ? 26.133 24.990 13.197 1.00 77.94 ? 477 GLU C CG 1 ATOM 10329 C CD . GLU C 1 418 ? 26.951 24.149 14.159 1.00 99.47 ? 477 GLU C CD 1 ATOM 10330 O OE1 . GLU C 1 418 ? 27.472 24.709 15.145 1.00 105.82 ? 477 GLU C OE1 1 ATOM 10331 O OE2 . GLU C 1 418 ? 27.071 22.927 13.929 1.00 98.51 ? 477 GLU C OE2 1 ATOM 10332 N N . VAL C 1 419 ? 25.241 29.554 12.556 1.00 48.22 ? 478 VAL C N 1 ATOM 10333 C CA . VAL C 1 419 ? 25.389 30.995 12.717 1.00 66.33 ? 478 VAL C CA 1 ATOM 10334 C C . VAL C 1 419 ? 24.033 31.642 12.968 1.00 65.69 ? 478 VAL C C 1 ATOM 10335 O O . VAL C 1 419 ? 23.844 32.357 13.953 1.00 58.72 ? 478 VAL C O 1 ATOM 10336 C CB . VAL C 1 419 ? 26.043 31.647 11.484 1.00 48.26 ? 478 VAL C CB 1 ATOM 10337 C CG1 . VAL C 1 419 ? 26.201 33.145 11.700 1.00 56.37 ? 478 VAL C CG1 1 ATOM 10338 C CG2 . VAL C 1 419 ? 27.385 31.000 11.185 1.00 33.88 ? 478 VAL C CG2 1 ATOM 10339 N N . LEU C 1 420 ? 23.092 31.388 12.065 1.00 51.72 ? 479 LEU C N 1 ATOM 10340 C CA . LEU C 1 420 ? 21.766 31.987 12.146 1.00 48.18 ? 479 LEU C CA 1 ATOM 10341 C C . LEU C 1 420 ? 20.853 31.217 13.095 1.00 52.94 ? 479 LEU C C 1 ATOM 10342 O O . LEU C 1 420 ? 20.023 30.420 12.658 1.00 62.39 ? 479 LEU C O 1 ATOM 10343 C CB . LEU C 1 420 ? 21.131 32.058 10.756 1.00 36.23 ? 479 LEU C CB 1 ATOM 10344 C CG . LEU C 1 420 ? 21.891 32.879 9.712 1.00 52.06 ? 479 LEU C CG 1 ATOM 10345 C CD1 . LEU C 1 420 ? 21.200 32.794 8.360 1.00 50.85 ? 479 LEU C CD1 1 ATOM 10346 C CD2 . LEU C 1 420 ? 22.033 34.325 10.161 1.00 62.91 ? 479 LEU C CD2 1 ATOM 10347 N N . VAL C 1 421 ? 21.009 31.456 14.392 1.00 49.62 ? 480 VAL C N 1 ATOM 10348 C CA . VAL C 1 421 ? 20.190 30.777 15.389 1.00 45.67 ? 480 VAL C CA 1 ATOM 10349 C C . VAL C 1 421 ? 19.411 31.790 16.224 1.00 57.38 ? 480 VAL C C 1 ATOM 10350 O O . VAL C 1 421 ? 19.895 32.887 16.502 1.00 52.64 ? 480 VAL C O 1 ATOM 10351 C CB . VAL C 1 421 ? 21.044 29.882 16.318 1.00 43.07 ? 480 VAL C CB 1 ATOM 10352 C CG1 . VAL C 1 421 ? 21.733 28.789 15.514 1.00 43.50 ? 480 VAL C CG1 1 ATOM 10353 C CG2 . VAL C 1 421 ? 22.064 30.712 17.087 1.00 45.51 ? 480 VAL C CG2 1 ATOM 10354 N N . ALA C 1 422 ? 18.196 31.418 16.613 1.00 56.81 ? 481 ALA C N 1 ATOM 10355 C CA . ALA C 1 422 ? 17.335 32.312 17.376 1.00 45.43 ? 481 ALA C CA 1 ATOM 10356 C C . ALA C 1 422 ? 17.671 32.235 18.859 1.00 49.56 ? 481 ALA C C 1 ATOM 10357 O O . ALA C 1 422 ? 17.389 33.157 19.625 1.00 59.17 ? 481 ALA C O 1 ATOM 10358 C CB . ALA C 1 422 ? 15.877 31.971 17.141 1.00 44.11 ? 481 ALA C CB 1 ATOM 10359 N N . GLU C 1 423 ? 18.270 31.117 19.254 1.00 65.06 ? 482 GLU C N 1 ATOM 10360 C CA . GLU C 1 423 ? 18.795 30.943 20.602 1.00 62.36 ? 482 GLU C CA 1 ATOM 10361 C C . GLU C 1 423 ? 20.097 30.155 20.523 1.00 48.66 ? 482 GLU C C 1 ATOM 10362 O O . GLU C 1 423 ? 20.232 29.254 19.694 1.00 60.35 ? 482 GLU C O 1 ATOM 10363 C CB . GLU C 1 423 ? 17.780 30.226 21.494 1.00 69.76 ? 482 GLU C CB 1 ATOM 10364 C CG . GLU C 1 423 ? 18.131 30.201 22.977 1.00 89.23 ? 482 GLU C CG 1 ATOM 10365 C CD . GLU C 1 423 ? 17.329 29.164 23.740 1.00 85.17 ? 482 GLU C CD 1 ATOM 10366 O OE1 . GLU C 1 423 ? 16.266 28.750 23.232 1.00 91.50 ? 482 GLU C OE1 1 ATOM 10367 O OE2 . GLU C 1 423 ? 17.749 28.773 24.850 1.00 90.79 ? 482 GLU C OE2 1 ATOM 10368 N N . TYR C 1 424 ? 21.056 30.490 21.378 1.00 53.26 ? 483 TYR C N 1 ATOM 10369 C CA . TYR C 1 424 ? 22.322 29.771 21.389 1.00 56.66 ? 483 TYR C CA 1 ATOM 10370 C C . TYR C 1 424 ? 22.377 28.741 22.510 1.00 55.54 ? 483 TYR C C 1 ATOM 10371 O O . TYR C 1 424 ? 22.046 29.038 23.655 1.00 57.72 ? 483 TYR C O 1 ATOM 10372 C CB . TYR C 1 424 ? 23.502 30.733 21.518 1.00 49.23 ? 483 TYR C CB 1 ATOM 10373 C CG . TYR C 1 424 ? 24.824 30.010 21.611 1.00 46.58 ? 483 TYR C CG 1 ATOM 10374 C CD1 . TYR C 1 424 ? 25.377 29.395 20.495 1.00 34.31 ? 483 TYR C CD1 1 ATOM 10375 C CD2 . TYR C 1 424 ? 25.513 29.928 22.814 1.00 35.48 ? 483 TYR C CD2 1 ATOM 10376 C CE1 . TYR C 1 424 ? 26.580 28.724 20.572 1.00 34.06 ? 483 TYR C CE1 1 ATOM 10377 C CE2 . TYR C 1 424 ? 26.720 29.259 22.900 1.00 35.36 ? 483 TYR C CE2 1 ATOM 10378 C CZ . TYR C 1 424 ? 27.248 28.660 21.776 1.00 45.90 ? 483 TYR C CZ 1 ATOM 10379 O OH . TYR C 1 424 ? 28.448 27.992 21.854 1.00 61.50 ? 483 TYR C OH 1 ATOM 10380 N N . ASN C 1 425 ? 22.792 27.529 22.164 1.00 65.25 ? 484 ASN C N 1 ATOM 10381 C CA . ASN C 1 425 ? 22.956 26.457 23.135 1.00 65.74 ? 484 ASN C CA 1 ATOM 10382 C C . ASN C 1 425 ? 24.275 25.735 22.914 1.00 65.66 ? 484 ASN C C 1 ATOM 10383 O O . ASN C 1 425 ? 24.529 25.222 21.827 1.00 47.40 ? 484 ASN C O 1 ATOM 10384 C CB . ASN C 1 425 ? 21.787 25.477 23.052 1.00 43.03 ? 484 ASN C CB 1 ATOM 10385 C CG . ASN C 1 425 ? 20.462 26.136 23.364 1.00 55.78 ? 484 ASN C CG 1 ATOM 10386 O OD1 . ASN C 1 425 ? 19.655 26.383 22.469 1.00 68.79 ? 484 ASN C OD1 1 ATOM 10387 N ND2 . ASN C 1 425 ? 20.228 26.422 24.639 1.00 49.29 ? 484 ASN C ND2 1 ATOM 10388 N N . ASN C 1 426 ? 25.113 25.704 23.946 1.00 69.98 ? 485 ASN C N 1 ATOM 10389 C CA . ASN C 1 426 ? 26.415 25.056 23.854 1.00 71.17 ? 485 ASN C CA 1 ATOM 10390 C C . ASN C 1 426 ? 26.399 23.616 24.366 1.00 80.22 ? 485 ASN C C 1 ATOM 10391 O O . ASN C 1 426 ? 26.177 23.379 25.553 1.00 75.67 ? 485 ASN C O 1 ATOM 10392 C CB . ASN C 1 426 ? 27.460 25.867 24.620 1.00 64.35 ? 485 ASN C CB 1 ATOM 10393 C CG . ASN C 1 426 ? 28.865 25.330 24.436 1.00 75.19 ? 485 ASN C CG 1 ATOM 10394 O OD1 . ASN C 1 426 ? 29.127 24.540 23.530 1.00 83.71 ? 485 ASN C OD1 1 ATOM 10395 N ND2 . ASN C 1 426 ? 29.779 25.760 25.299 1.00 71.85 ? 485 ASN C ND2 1 ATOM 10396 N N . PRO C 1 427 ? 26.621 22.650 23.458 1.00 87.06 ? 486 PRO C N 1 ATOM 10397 C CA . PRO C 1 427 ? 26.702 21.215 23.762 1.00 92.92 ? 486 PRO C CA 1 ATOM 10398 C C . PRO C 1 427 ? 27.661 20.893 24.908 1.00 85.79 ? 486 PRO C C 1 ATOM 10399 O O . PRO C 1 427 ? 27.420 19.956 25.669 1.00 66.89 ? 486 PRO C O 1 ATOM 10400 C CB . PRO C 1 427 ? 27.225 20.600 22.459 1.00 83.74 ? 486 PRO C CB 1 ATOM 10401 C CG . PRO C 1 427 ? 26.998 21.615 21.393 1.00 77.66 ? 486 PRO C CG 1 ATOM 10402 C CD . PRO C 1 427 ? 26.567 22.907 22.009 1.00 75.74 ? 486 PRO C CD 1 ATOM 10403 N N . ASP C 1 428 ? 28.735 21.668 25.023 1.00 84.37 ? 487 ASP C N 1 ATOM 10404 C CA . ASP C 1 428 ? 29.812 21.367 25.962 1.00 71.09 ? 487 ASP C CA 1 ATOM 10405 C C . ASP C 1 428 ? 29.500 21.788 27.396 1.00 85.47 ? 487 ASP C C 1 ATOM 10406 O O . ASP C 1 428 ? 30.325 21.608 28.292 1.00 79.01 ? 487 ASP C O 1 ATOM 10407 C CB . ASP C 1 428 ? 31.105 22.045 25.506 1.00 89.27 ? 487 ASP C CB 1 ATOM 10408 C CG . ASP C 1 428 ? 31.545 21.594 24.128 1.00 90.06 ? 487 ASP C CG 1 ATOM 10409 O OD1 . ASP C 1 428 ? 32.765 21.427 23.915 1.00 77.99 ? 487 ASP C OD1 1 ATOM 10410 O OD2 . ASP C 1 428 ? 30.671 21.413 23.255 1.00 85.34 ? 487 ASP C OD2 1 ATOM 10411 N N . VAL C 1 429 ? 28.313 22.344 27.613 1.00 90.27 ? 488 VAL C N 1 ATOM 10412 C CA . VAL C 1 429 ? 27.921 22.791 28.945 1.00 98.29 ? 488 VAL C CA 1 ATOM 10413 C C . VAL C 1 429 ? 26.675 22.060 29.434 1.00 105.79 ? 488 VAL C C 1 ATOM 10414 O O . VAL C 1 429 ? 25.593 22.232 28.873 1.00 90.71 ? 488 VAL C O 1 ATOM 10415 C CB . VAL C 1 429 ? 27.662 24.308 28.975 1.00 92.79 ? 488 VAL C CB 1 ATOM 10416 C CG1 . VAL C 1 429 ? 27.183 24.737 30.354 1.00 80.80 ? 488 VAL C CG1 1 ATOM 10417 C CG2 . VAL C 1 429 ? 28.922 25.066 28.583 1.00 65.17 ? 488 VAL C CG2 1 ATOM 10418 N N . SER C 1 430 ? 26.867 21.252 30.480 1.00 118.99 ? 489 SER C N 1 ATOM 10419 C CA . SER C 1 430 ? 25.837 20.442 31.149 1.00 112.17 ? 489 SER C CA 1 ATOM 10420 C C . SER C 1 430 ? 24.391 20.663 30.706 1.00 118.70 ? 489 SER C C 1 ATOM 10421 O O . SER C 1 430 ? 23.773 19.782 30.108 1.00 114.04 ? 489 SER C O 1 ATOM 10422 C CB . SER C 1 430 ? 25.924 20.672 32.661 1.00 98.80 ? 489 SER C CB 1 ATOM 10423 O OG . SER C 1 430 ? 25.856 22.053 32.969 1.00 98.24 ? 489 SER C OG 1 ATOM 10424 N N . LEU D 1 2 ? -34.660 74.815 75.008 1.00 65.89 ? 61 LEU D N 1 ATOM 10425 C CA . LEU D 1 2 ? -34.101 73.586 74.459 1.00 77.97 ? 61 LEU D CA 1 ATOM 10426 C C . LEU D 1 2 ? -33.834 73.702 72.962 1.00 85.44 ? 61 LEU D C 1 ATOM 10427 O O . LEU D 1 2 ? -34.767 73.706 72.159 1.00 112.57 ? 61 LEU D O 1 ATOM 10428 C CB . LEU D 1 2 ? -35.038 72.404 74.721 1.00 86.22 ? 61 LEU D CB 1 ATOM 10429 C CG . LEU D 1 2 ? -34.687 71.095 74.006 1.00 83.19 ? 61 LEU D CG 1 ATOM 10430 C CD1 . LEU D 1 2 ? -33.449 70.448 74.613 1.00 87.36 ? 61 LEU D CD1 1 ATOM 10431 C CD2 . LEU D 1 2 ? -35.866 70.133 74.011 1.00 62.44 ? 61 LEU D CD2 1 ATOM 10432 N N . PRO D 1 3 ? -32.553 73.817 72.582 1.00 63.53 ? 62 PRO D N 1 ATOM 10433 C CA . PRO D 1 3 ? -32.197 73.702 71.166 1.00 63.15 ? 62 PRO D CA 1 ATOM 10434 C C . PRO D 1 3 ? -32.403 72.269 70.682 1.00 64.72 ? 62 PRO D C 1 ATOM 10435 O O . PRO D 1 3 ? -32.055 71.334 71.402 1.00 60.38 ? 62 PRO D O 1 ATOM 10436 C CB . PRO D 1 3 ? -30.714 74.088 71.139 1.00 46.28 ? 62 PRO D CB 1 ATOM 10437 C CG . PRO D 1 3 ? -30.501 74.884 72.387 1.00 41.83 ? 62 PRO D CG 1 ATOM 10438 C CD . PRO D 1 3 ? -31.423 74.281 73.403 1.00 45.36 ? 62 PRO D CD 1 ATOM 10439 N N . HIS D 1 4 ? -32.965 72.096 69.490 1.00 55.38 ? 63 HIS D N 1 ATOM 10440 C CA . HIS D 1 4 ? -33.180 70.758 68.953 1.00 42.57 ? 63 HIS D CA 1 ATOM 10441 C C . HIS D 1 4 ? -31.853 70.144 68.525 1.00 49.75 ? 63 HIS D C 1 ATOM 10442 O O . HIS D 1 4 ? -31.614 68.953 68.726 1.00 53.67 ? 63 HIS D O 1 ATOM 10443 C CB . HIS D 1 4 ? -34.160 70.794 67.779 1.00 51.57 ? 63 HIS D CB 1 ATOM 10444 C CG . HIS D 1 4 ? -35.559 71.164 68.167 1.00 53.64 ? 63 HIS D CG 1 ATOM 10445 N ND1 . HIS D 1 4 ? -35.841 72.114 69.126 1.00 43.99 ? 63 HIS D ND1 1 ATOM 10446 C CD2 . HIS D 1 4 ? -36.756 70.714 67.721 1.00 54.65 ? 63 HIS D CD2 1 ATOM 10447 C CE1 . HIS D 1 4 ? -37.151 72.231 69.256 1.00 58.25 ? 63 HIS D CE1 1 ATOM 10448 N NE2 . HIS D 1 4 ? -37.729 71.393 68.414 1.00 49.01 ? 63 HIS D NE2 1 ATOM 10449 N N . GLN D 1 5 ? -30.993 70.965 67.932 1.00 47.72 ? 64 GLN D N 1 ATOM 10450 C CA . GLN D 1 5 ? -29.614 70.573 67.666 1.00 53.84 ? 64 GLN D CA 1 ATOM 10451 C C . GLN D 1 5 ? -28.691 71.263 68.664 1.00 58.29 ? 64 GLN D C 1 ATOM 10452 O O . GLN D 1 5 ? -28.296 72.411 68.458 1.00 53.87 ? 64 GLN D O 1 ATOM 10453 C CB . GLN D 1 5 ? -29.206 70.921 66.233 1.00 43.89 ? 64 GLN D CB 1 ATOM 10454 C CG . GLN D 1 5 ? -29.878 70.069 65.171 1.00 51.08 ? 64 GLN D CG 1 ATOM 10455 C CD . GLN D 1 5 ? -29.288 70.288 63.792 1.00 52.37 ? 64 GLN D CD 1 ATOM 10456 O OE1 . GLN D 1 5 ? -28.069 70.281 63.618 1.00 51.57 ? 64 GLN D OE1 1 ATOM 10457 N NE2 . GLN D 1 5 ? -30.152 70.485 62.804 1.00 39.40 ? 64 GLN D NE2 1 ATOM 10458 N N . PRO D 1 6 ? -28.350 70.565 69.756 1.00 49.40 ? 65 PRO D N 1 ATOM 10459 C CA . PRO D 1 6 ? -27.563 71.161 70.837 1.00 45.96 ? 65 PRO D CA 1 ATOM 10460 C C . PRO D 1 6 ? -26.069 71.189 70.536 1.00 40.68 ? 65 PRO D C 1 ATOM 10461 O O . PRO D 1 6 ? -25.623 70.619 69.540 1.00 49.68 ? 65 PRO D O 1 ATOM 10462 C CB . PRO D 1 6 ? -27.859 70.243 72.020 1.00 38.62 ? 65 PRO D CB 1 ATOM 10463 C CG . PRO D 1 6 ? -28.053 68.911 71.388 1.00 51.91 ? 65 PRO D CG 1 ATOM 10464 C CD . PRO D 1 6 ? -28.715 69.168 70.053 1.00 46.84 ? 65 PRO D CD 1 ATOM 10465 N N . ILE D 1 7 ? -25.311 71.854 71.401 1.00 45.75 ? 66 ILE D N 1 ATOM 10466 C CA . ILE D 1 7 ? -23.857 71.873 71.309 1.00 61.13 ? 66 ILE D CA 1 ATOM 10467 C C . ILE D 1 7 ? -23.281 70.480 71.550 1.00 48.93 ? 66 ILE D C 1 ATOM 10468 O O . ILE D 1 7 ? -23.959 69.617 72.109 1.00 50.82 ? 66 ILE D O 1 ATOM 10469 C CB . ILE D 1 7 ? -23.247 72.861 72.326 1.00 59.65 ? 66 ILE D CB 1 ATOM 10470 C CG1 . ILE D 1 7 ? -23.742 72.548 73.736 1.00 46.36 ? 66 ILE D CG1 1 ATOM 10471 C CG2 . ILE D 1 7 ? -23.597 74.289 71.965 1.00 67.63 ? 66 ILE D CG2 1 ATOM 10472 C CD1 . ILE D 1 7 ? -23.065 73.369 74.801 1.00 62.44 ? 66 ILE D CD1 1 ATOM 10473 N N . PRO D 1 8 ? -22.030 70.253 71.118 1.00 48.01 ? 67 PRO D N 1 ATOM 10474 C CA . PRO D 1 8 ? -21.327 69.028 71.511 1.00 42.05 ? 67 PRO D CA 1 ATOM 10475 C C . PRO D 1 8 ? -21.247 68.909 73.031 1.00 55.38 ? 67 PRO D C 1 ATOM 10476 O O . PRO D 1 8 ? -20.835 69.865 73.687 1.00 44.85 ? 67 PRO D O 1 ATOM 10477 C CB . PRO D 1 8 ? -19.937 69.208 70.894 1.00 42.55 ? 67 PRO D CB 1 ATOM 10478 C CG . PRO D 1 8 ? -20.164 70.103 69.726 1.00 42.74 ? 67 PRO D CG 1 ATOM 10479 C CD . PRO D 1 8 ? -21.260 71.041 70.138 1.00 49.94 ? 67 PRO D CD 1 ATOM 10480 N N . PRO D 1 9 ? -21.654 67.753 73.584 1.00 54.27 ? 68 PRO D N 1 ATOM 10481 C CA . PRO D 1 9 ? -21.710 67.537 75.037 1.00 56.20 ? 68 PRO D CA 1 ATOM 10482 C C . PRO D 1 9 ? -20.392 67.851 75.741 1.00 58.45 ? 68 PRO D C 1 ATOM 10483 O O . PRO D 1 9 ? -20.406 68.262 76.901 1.00 70.74 ? 68 PRO D O 1 ATOM 10484 C CB . PRO D 1 9 ? -22.056 66.046 75.162 1.00 46.80 ? 68 PRO D CB 1 ATOM 10485 C CG . PRO D 1 9 ? -21.740 65.452 73.828 1.00 55.84 ? 68 PRO D CG 1 ATOM 10486 C CD . PRO D 1 9 ? -22.016 66.537 72.838 1.00 48.57 ? 68 PRO D CD 1 ATOM 10487 N N . SER D 1 10 ? -19.275 67.658 75.049 1.00 41.08 ? 69 SER D N 1 ATOM 10488 C CA . SER D 1 10 ? -17.968 67.995 75.600 1.00 55.26 ? 69 SER D CA 1 ATOM 10489 C C . SER D 1 10 ? -17.844 69.498 75.848 1.00 58.11 ? 69 SER D C 1 ATOM 10490 O O . SER D 1 10 ? -17.117 69.930 76.742 1.00 67.79 ? 69 SER D O 1 ATOM 10491 C CB . SER D 1 10 ? -16.854 67.520 74.664 1.00 41.58 ? 69 SER D CB 1 ATOM 10492 O OG . SER D 1 10 ? -16.858 68.259 73.455 1.00 51.38 ? 69 SER D OG 1 ATOM 10493 N N . LEU D 1 11 ? -18.559 70.288 75.052 1.00 52.57 ? 70 LEU D N 1 ATOM 10494 C CA . LEU D 1 11 ? -18.546 71.740 75.196 1.00 53.59 ? 70 LEU D CA 1 ATOM 10495 C C . LEU D 1 11 ? -19.678 72.245 76.090 1.00 55.55 ? 70 LEU D C 1 ATOM 10496 O O . LEU D 1 11 ? -19.852 73.451 76.259 1.00 52.72 ? 70 LEU D O 1 ATOM 10497 C CB . LEU D 1 11 ? -18.640 72.411 73.823 1.00 37.63 ? 70 LEU D CB 1 ATOM 10498 C CG . LEU D 1 11 ? -17.461 72.208 72.870 1.00 59.93 ? 70 LEU D CG 1 ATOM 10499 C CD1 . LEU D 1 11 ? -17.742 72.856 71.521 1.00 35.67 ? 70 LEU D CD1 1 ATOM 10500 C CD2 . LEU D 1 11 ? -16.180 72.755 73.479 1.00 35.31 ? 70 LEU D CD2 1 ATOM 10501 N N . GLY D 1 12 ? -20.445 71.322 76.661 1.00 61.92 ? 71 GLY D N 1 ATOM 10502 C CA . GLY D 1 12 ? -21.565 71.691 77.508 1.00 57.88 ? 71 GLY D CA 1 ATOM 10503 C C . GLY D 1 12 ? -21.347 71.458 78.988 1.00 71.30 ? 71 GLY D C 1 ATOM 10504 O O . GLY D 1 12 ? -20.241 71.129 79.420 1.00 69.27 ? 71 GLY D O 1 ATOM 10505 N N . GLU D 1 13 ? -22.407 71.642 79.770 1.00 64.08 ? 72 GLU D N 1 ATOM 10506 C CA . GLU D 1 13 ? -22.348 71.392 81.204 1.00 73.35 ? 72 GLU D CA 1 ATOM 10507 C C . GLU D 1 13 ? -22.088 69.910 81.455 1.00 73.08 ? 72 GLU D C 1 ATOM 10508 O O . GLU D 1 13 ? -22.837 69.050 80.990 1.00 69.61 ? 72 GLU D O 1 ATOM 10509 C CB . GLU D 1 13 ? -23.647 71.831 81.885 1.00 84.53 ? 72 GLU D CB 1 ATOM 10510 C CG . GLU D 1 13 ? -23.886 73.338 81.884 1.00 99.56 ? 72 GLU D CG 1 ATOM 10511 C CD . GLU D 1 13 ? -22.981 74.087 82.845 1.00 106.88 ? 72 GLU D CD 1 ATOM 10512 O OE1 . GLU D 1 13 ? -21.871 74.484 82.435 1.00 107.15 ? 72 GLU D OE1 1 ATOM 10513 O OE2 . GLU D 1 13 ? -23.385 74.285 84.011 1.00 109.57 ? 72 GLU D OE2 1 ATOM 10514 N N . LYS D 1 14 ? -21.022 69.620 82.191 1.00 67.83 ? 73 LYS D N 1 ATOM 10515 C CA . LYS D 1 14 ? -20.624 68.246 82.477 1.00 63.81 ? 73 LYS D CA 1 ATOM 10516 C C . LYS D 1 14 ? -21.579 67.528 83.427 1.00 70.08 ? 73 LYS D C 1 ATOM 10517 O O . LYS D 1 14 ? -21.887 68.020 84.511 1.00 83.40 ? 73 LYS D O 1 ATOM 10518 C CB . LYS D 1 14 ? -19.199 68.220 83.027 1.00 64.69 ? 73 LYS D CB 1 ATOM 10519 C CG . LYS D 1 14 ? -18.156 68.416 81.940 1.00 79.97 ? 73 LYS D CG 1 ATOM 10520 C CD . LYS D 1 14 ? -17.024 69.317 82.382 1.00 98.79 ? 73 LYS D CD 1 ATOM 10521 C CE . LYS D 1 14 ? -16.018 69.498 81.257 1.00 99.53 ? 73 LYS D CE 1 ATOM 10522 N NZ . LYS D 1 14 ? -15.370 68.208 80.887 1.00 89.30 ? 73 LYS D NZ 1 ATOM 10523 N N . ASP D 1 15 ? -22.044 66.359 82.996 1.00 71.30 ? 74 ASP D N 1 ATOM 10524 C CA . ASP D 1 15 ? -22.937 65.520 83.788 1.00 73.37 ? 74 ASP D CA 1 ATOM 10525 C C . ASP D 1 15 ? -22.177 64.859 84.934 1.00 79.19 ? 74 ASP D C 1 ATOM 10526 O O . ASP D 1 15 ? -21.223 64.114 84.708 1.00 85.02 ? 74 ASP D O 1 ATOM 10527 C CB . ASP D 1 15 ? -23.592 64.457 82.903 1.00 66.33 ? 74 ASP D CB 1 ATOM 10528 C CG . ASP D 1 15 ? -24.654 63.656 83.635 1.00 78.34 ? 74 ASP D CG 1 ATOM 10529 O OD1 . ASP D 1 15 ? -25.038 64.047 84.757 1.00 89.82 ? 74 ASP D OD1 1 ATOM 10530 O OD2 . ASP D 1 15 ? -25.102 62.627 83.085 1.00 91.33 ? 74 ASP D OD2 1 ATOM 10531 N N . LEU D 1 16 ? -22.602 65.136 86.164 1.00 78.55 ? 75 LEU D N 1 ATOM 10532 C CA . LEU D 1 16 ? -21.901 64.642 87.345 1.00 75.79 ? 75 LEU D CA 1 ATOM 10533 C C . LEU D 1 16 ? -22.524 63.362 87.894 1.00 77.39 ? 75 LEU D C 1 ATOM 10534 O O . LEU D 1 16 ? -22.048 62.813 88.888 1.00 73.43 ? 75 LEU D O 1 ATOM 10535 C CB . LEU D 1 16 ? -21.891 65.704 88.450 1.00 70.92 ? 75 LEU D CB 1 ATOM 10536 C CG . LEU D 1 16 ? -21.281 67.086 88.192 1.00 73.78 ? 75 LEU D CG 1 ATOM 10537 C CD1 . LEU D 1 16 ? -20.088 67.008 87.247 1.00 68.52 ? 75 LEU D CD1 1 ATOM 10538 C CD2 . LEU D 1 16 ? -22.334 68.064 87.682 1.00 65.85 ? 75 LEU D CD2 1 ATOM 10539 N N . SER D 1 17 ? -23.586 62.890 87.249 1.00 71.97 ? 76 SER D N 1 ATOM 10540 C CA . SER D 1 17 ? -24.293 61.706 87.725 1.00 59.54 ? 76 SER D CA 1 ATOM 10541 C C . SER D 1 17 ? -23.444 60.448 87.578 1.00 61.89 ? 76 SER D C 1 ATOM 10542 O O . SER D 1 17 ? -22.561 60.376 86.724 1.00 65.47 ? 76 SER D O 1 ATOM 10543 C CB . SER D 1 17 ? -25.616 61.532 86.973 1.00 65.31 ? 76 SER D CB 1 ATOM 10544 O OG . SER D 1 17 ? -25.392 61.298 85.593 1.00 80.55 ? 76 SER D OG 1 ATOM 10545 N N . ASP D 1 18 ? -23.722 59.459 88.420 1.00 75.50 ? 77 ASP D N 1 ATOM 10546 C CA . ASP D 1 18 ? -23.023 58.182 88.373 1.00 65.40 ? 77 ASP D CA 1 ATOM 10547 C C . ASP D 1 18 ? -23.581 57.340 87.233 1.00 72.54 ? 77 ASP D C 1 ATOM 10548 O O . ASP D 1 18 ? -24.758 56.977 87.248 1.00 67.88 ? 77 ASP D O 1 ATOM 10549 C CB . ASP D 1 18 ? -23.160 57.446 89.710 1.00 74.23 ? 77 ASP D CB 1 ATOM 10550 C CG . ASP D 1 18 ? -22.373 56.146 89.755 1.00 78.65 ? 77 ASP D CG 1 ATOM 10551 O OD1 . ASP D 1 18 ? -21.515 55.926 88.876 1.00 77.28 ? 77 ASP D OD1 1 ATOM 10552 O OD2 . ASP D 1 18 ? -22.614 55.341 90.679 1.00 78.78 ? 77 ASP D OD2 1 ATOM 10553 N N . PRO D 1 19 ? -22.737 57.025 86.236 1.00 60.41 ? 78 PRO D N 1 ATOM 10554 C CA . PRO D 1 19 ? -23.186 56.251 85.072 1.00 54.65 ? 78 PRO D CA 1 ATOM 10555 C C . PRO D 1 19 ? -23.583 54.824 85.437 1.00 55.99 ? 78 PRO D C 1 ATOM 10556 O O . PRO D 1 19 ? -24.124 54.100 84.602 1.00 68.80 ? 78 PRO D O 1 ATOM 10557 C CB . PRO D 1 19 ? -21.958 56.252 84.150 1.00 57.46 ? 78 PRO D CB 1 ATOM 10558 C CG . PRO D 1 19 ? -21.093 57.368 84.641 1.00 58.39 ? 78 PRO D CG 1 ATOM 10559 C CD . PRO D 1 19 ? -21.330 57.441 86.113 1.00 62.66 ? 78 PRO D CD 1 ATOM 10560 N N . PHE D 1 20 ? -23.312 54.431 86.676 1.00 59.13 ? 79 PHE D N 1 ATOM 10561 C CA . PHE D 1 20 ? -23.596 53.078 87.126 1.00 72.23 ? 79 PHE D CA 1 ATOM 10562 C C . PHE D 1 20 ? -24.382 53.104 88.432 1.00 70.10 ? 79 PHE D C 1 ATOM 10563 O O . PHE D 1 20 ? -24.256 52.208 89.267 1.00 72.14 ? 79 PHE D O 1 ATOM 10564 C CB . PHE D 1 20 ? -22.296 52.289 87.272 1.00 63.84 ? 79 PHE D CB 1 ATOM 10565 C CG . PHE D 1 20 ? -21.483 52.252 86.011 1.00 56.78 ? 79 PHE D CG 1 ATOM 10566 C CD1 . PHE D 1 20 ? -21.724 51.293 85.043 1.00 61.74 ? 79 PHE D CD1 1 ATOM 10567 C CD2 . PHE D 1 20 ? -20.498 53.198 85.780 1.00 48.94 ? 79 PHE D CD2 1 ATOM 10568 C CE1 . PHE D 1 20 ? -20.987 51.269 83.875 1.00 54.74 ? 79 PHE D CE1 1 ATOM 10569 C CE2 . PHE D 1 20 ? -19.758 53.178 84.615 1.00 52.89 ? 79 PHE D CE2 1 ATOM 10570 C CZ . PHE D 1 20 ? -20.004 52.215 83.661 1.00 63.10 ? 79 PHE D CZ 1 ATOM 10571 N N . ASN D 1 21 ? -25.193 54.147 88.596 1.00 78.78 ? 80 ASN D N 1 ATOM 10572 C CA . ASN D 1 21 ? -26.088 54.258 89.741 1.00 74.42 ? 80 ASN D CA 1 ATOM 10573 C C . ASN D 1 21 ? -27.401 53.533 89.455 1.00 72.26 ? 80 ASN D C 1 ATOM 10574 O O . ASN D 1 21 ? -28.481 53.988 89.834 1.00 88.64 ? 80 ASN D O 1 ATOM 10575 C CB . ASN D 1 21 ? -26.345 55.730 90.081 1.00 79.72 ? 80 ASN D CB 1 ATOM 10576 C CG . ASN D 1 21 ? -27.046 55.912 91.416 1.00 85.70 ? 80 ASN D CG 1 ATOM 10577 O OD1 . ASN D 1 21 ? -27.017 55.028 92.272 1.00 88.22 ? 80 ASN D OD1 1 ATOM 10578 N ND2 . ASN D 1 21 ? -27.686 57.062 91.596 1.00 84.99 ? 80 ASN D ND2 1 ATOM 10579 N N . PHE D 1 22 ? -27.299 52.401 88.769 1.00 60.26 ? 81 PHE D N 1 ATOM 10580 C CA . PHE D 1 22 ? -28.463 51.573 88.502 1.00 65.25 ? 81 PHE D CA 1 ATOM 10581 C C . PHE D 1 22 ? -28.283 50.211 89.152 1.00 71.89 ? 81 PHE D C 1 ATOM 10582 O O . PHE D 1 22 ? -27.161 49.733 89.316 1.00 78.43 ? 81 PHE D O 1 ATOM 10583 C CB . PHE D 1 22 ? -28.695 51.426 86.993 1.00 60.25 ? 81 PHE D CB 1 ATOM 10584 C CG . PHE D 1 22 ? -27.555 50.770 86.259 1.00 58.46 ? 81 PHE D CG 1 ATOM 10585 C CD1 . PHE D 1 22 ? -27.516 49.393 86.093 1.00 54.04 ? 81 PHE D CD1 1 ATOM 10586 C CD2 . PHE D 1 22 ? -26.530 51.531 85.721 1.00 48.18 ? 81 PHE D CD2 1 ATOM 10587 C CE1 . PHE D 1 22 ? -26.471 48.789 85.416 1.00 50.52 ? 81 PHE D CE1 1 ATOM 10588 C CE2 . PHE D 1 22 ? -25.483 50.932 85.042 1.00 52.28 ? 81 PHE D CE2 1 ATOM 10589 C CZ . PHE D 1 22 ? -25.454 49.560 84.890 1.00 48.10 ? 81 PHE D CZ 1 ATOM 10590 N N . LEU D 1 23 ? -29.394 49.589 89.521 1.00 75.05 ? 82 LEU D N 1 ATOM 10591 C CA . LEU D 1 23 ? -29.359 48.271 90.133 1.00 77.48 ? 82 LEU D CA 1 ATOM 10592 C C . LEU D 1 23 ? -29.448 47.194 89.062 1.00 74.68 ? 82 LEU D C 1 ATOM 10593 O O . LEU D 1 23 ? -30.302 47.252 88.177 1.00 85.16 ? 82 LEU D O 1 ATOM 10594 C CB . LEU D 1 23 ? -30.479 48.101 91.164 1.00 88.76 ? 82 LEU D CB 1 ATOM 10595 C CG . LEU D 1 23 ? -30.322 48.784 92.530 1.00 93.76 ? 82 LEU D CG 1 ATOM 10596 C CD1 . LEU D 1 23 ? -30.303 50.309 92.439 1.00 90.38 ? 82 LEU D CD1 1 ATOM 10597 C CD2 . LEU D 1 23 ? -31.407 48.312 93.491 1.00 94.59 ? 82 LEU D CD2 1 ATOM 10598 N N . PHE D 1 24 ? -28.560 46.212 89.149 1.00 81.34 ? 83 PHE D N 1 ATOM 10599 C CA . PHE D 1 24 ? -28.586 45.080 88.236 1.00 80.69 ? 83 PHE D CA 1 ATOM 10600 C C . PHE D 1 24 ? -28.487 43.765 88.984 1.00 85.14 ? 83 PHE D C 1 ATOM 10601 O O . PHE D 1 24 ? -27.412 43.370 89.437 1.00 86.77 ? 83 PHE D O 1 ATOM 10602 C CB . PHE D 1 24 ? -27.448 45.161 87.220 1.00 75.34 ? 83 PHE D CB 1 ATOM 10603 C CG . PHE D 1 24 ? -27.623 44.234 86.054 1.00 75.17 ? 83 PHE D CG 1 ATOM 10604 C CD1 . PHE D 1 24 ? -28.882 43.780 85.695 1.00 59.36 ? 83 PHE D CD1 1 ATOM 10605 C CD2 . PHE D 1 24 ? -26.523 43.763 85.356 1.00 73.38 ? 83 PHE D CD2 1 ATOM 10606 C CE1 . PHE D 1 24 ? -29.045 42.912 84.636 1.00 62.94 ? 83 PHE D CE1 1 ATOM 10607 C CE2 . PHE D 1 24 ? -26.680 42.888 84.300 1.00 72.00 ? 83 PHE D CE2 1 ATOM 10608 C CZ . PHE D 1 24 ? -27.943 42.463 83.940 1.00 64.30 ? 83 PHE D CZ 1 ATOM 10609 N N . SER D 1 25 ? -29.623 43.089 89.104 1.00 95.29 ? 84 SER D N 1 ATOM 10610 C CA . SER D 1 25 ? -29.667 41.800 89.767 1.00 102.76 ? 84 SER D CA 1 ATOM 10611 C C . SER D 1 25 ? -28.998 40.755 88.887 1.00 97.71 ? 84 SER D C 1 ATOM 10612 O O . SER D 1 25 ? -29.003 40.864 87.660 1.00 102.18 ? 84 SER D O 1 ATOM 10613 C CB . SER D 1 25 ? -31.110 41.398 90.078 1.00 98.81 ? 84 SER D CB 1 ATOM 10614 O OG . SER D 1 25 ? -31.165 40.115 90.678 1.00 99.78 ? 84 SER D OG 1 ATOM 10615 N N . SER D 1 26 ? -28.419 39.745 89.521 1.00 91.76 ? 85 SER D N 1 ATOM 10616 C CA . SER D 1 26 ? -27.728 38.687 88.803 1.00 94.80 ? 85 SER D CA 1 ATOM 10617 C C . SER D 1 26 ? -28.449 37.373 89.044 1.00 97.66 ? 85 SER D C 1 ATOM 10618 O O . SER D 1 26 ? -28.351 36.796 90.125 1.00 92.29 ? 85 SER D O 1 ATOM 10619 C CB . SER D 1 26 ? -26.265 38.588 89.238 1.00 90.53 ? 85 SER D CB 1 ATOM 10620 O OG . SER D 1 26 ? -25.577 37.606 88.481 1.00 88.84 ? 85 SER D OG 1 ATOM 10621 N N . ASN D 1 27 ? -29.185 36.911 88.039 1.00 92.81 ? 86 ASN D N 1 ATOM 10622 C CA . ASN D 1 27 ? -29.915 35.657 88.148 1.00 78.28 ? 86 ASN D CA 1 ATOM 10623 C C . ASN D 1 27 ? -28.918 34.523 88.379 1.00 84.42 ? 86 ASN D C 1 ATOM 10624 O O . ASN D 1 27 ? -28.078 34.240 87.525 1.00 90.87 ? 86 ASN D O 1 ATOM 10625 C CB . ASN D 1 27 ? -30.750 35.437 86.884 1.00 71.92 ? 86 ASN D CB 1 ATOM 10626 C CG . ASN D 1 27 ? -31.636 34.218 86.968 1.00 78.75 ? 86 ASN D CG 1 ATOM 10627 O OD1 . ASN D 1 27 ? -31.157 33.108 87.167 1.00 71.40 ? 86 ASN D OD1 1 ATOM 10628 N ND2 . ASN D 1 27 ? -32.941 34.422 86.824 1.00 95.51 ? 86 ASN D ND2 1 ATOM 10629 N N . LYS D 1 28 ? -29.016 33.878 89.541 1.00 82.44 ? 87 LYS D N 1 ATOM 10630 C CA . LYS D 1 28 ? -27.985 32.932 89.965 1.00 79.86 ? 87 LYS D CA 1 ATOM 10631 C C . LYS D 1 28 ? -28.207 31.485 89.533 1.00 72.90 ? 87 LYS D C 1 ATOM 10632 O O . LYS D 1 28 ? -27.259 30.699 89.498 1.00 69.46 ? 87 LYS D O 1 ATOM 10633 C CB . LYS D 1 28 ? -27.870 32.965 91.491 1.00 78.24 ? 87 LYS D CB 1 ATOM 10634 C CG . LYS D 1 28 ? -27.757 34.359 92.086 1.00 85.35 ? 87 LYS D CG 1 ATOM 10635 C CD . LYS D 1 28 ? -27.365 34.298 93.553 1.00 89.95 ? 87 LYS D CD 1 ATOM 10636 C CE . LYS D 1 28 ? -27.537 35.647 94.237 1.00 99.13 ? 87 LYS D CE 1 ATOM 10637 N NZ . LYS D 1 28 ? -26.840 36.744 93.512 1.00 94.57 ? 87 LYS D NZ 1 ATOM 10638 N N . ILE D 1 29 ? -29.443 31.129 89.198 1.00 73.07 ? 88 ILE D N 1 ATOM 10639 C CA . ILE D 1 29 ? -29.717 29.770 88.742 1.00 77.39 ? 88 ILE D CA 1 ATOM 10640 C C . ILE D 1 29 ? -29.166 29.579 87.331 1.00 90.61 ? 88 ILE D C 1 ATOM 10641 O O . ILE D 1 29 ? -28.445 28.618 87.067 1.00 92.47 ? 88 ILE D O 1 ATOM 10642 C CB . ILE D 1 29 ? -31.226 29.416 88.808 1.00 70.71 ? 88 ILE D CB 1 ATOM 10643 C CG1 . ILE D 1 29 ? -31.568 28.306 87.813 1.00 69.17 ? 88 ILE D CG1 1 ATOM 10644 C CG2 . ILE D 1 29 ? -32.089 30.632 88.569 1.00 62.17 ? 88 ILE D CG2 1 ATOM 10645 C CD1 . ILE D 1 29 ? -32.911 27.650 88.069 1.00 71.85 ? 88 ILE D CD1 1 ATOM 10646 N N . THR D 1 30 ? -29.502 30.504 86.435 1.00 85.51 ? 89 THR D N 1 ATOM 10647 C CA . THR D 1 30 ? -28.990 30.482 85.067 1.00 76.81 ? 89 THR D CA 1 ATOM 10648 C C . THR D 1 30 ? -27.465 30.530 85.032 1.00 76.79 ? 89 THR D C 1 ATOM 10649 O O . THR D 1 30 ? -26.831 29.813 84.256 1.00 70.15 ? 89 THR D O 1 ATOM 10650 C CB . THR D 1 30 ? -29.537 31.660 84.230 1.00 75.39 ? 89 THR D CB 1 ATOM 10651 O OG1 . THR D 1 30 ? -29.043 32.898 84.756 1.00 81.03 ? 89 THR D OG1 1 ATOM 10652 C CG2 . THR D 1 30 ? -31.059 31.673 84.245 1.00 78.32 ? 89 THR D CG2 1 ATOM 10653 N N . LEU D 1 31 ? -26.887 31.384 85.870 1.00 75.63 ? 90 LEU D N 1 ATOM 10654 C CA . LEU D 1 31 ? -25.438 31.557 85.938 1.00 72.37 ? 90 LEU D CA 1 ATOM 10655 C C . LEU D 1 31 ? -24.702 30.257 86.261 1.00 74.78 ? 90 LEU D C 1 ATOM 10656 O O . LEU D 1 31 ? -23.714 29.918 85.608 1.00 80.17 ? 90 LEU D O 1 ATOM 10657 C CB . LEU D 1 31 ? -25.081 32.625 86.975 1.00 58.75 ? 90 LEU D CB 1 ATOM 10658 C CG . LEU D 1 31 ? -23.589 32.908 87.169 1.00 69.07 ? 90 LEU D CG 1 ATOM 10659 C CD1 . LEU D 1 31 ? -22.948 33.342 85.859 1.00 57.87 ? 90 LEU D CD1 1 ATOM 10660 C CD2 . LEU D 1 31 ? -23.386 33.966 88.242 1.00 69.37 ? 90 LEU D CD2 1 ATOM 10661 N N . ARG D 1 32 ? -25.181 29.537 87.271 1.00 78.50 ? 91 ARG D N 1 ATOM 10662 C CA . ARG D 1 32 ? -24.532 28.300 87.697 1.00 84.83 ? 91 ARG D CA 1 ATOM 10663 C C . ARG D 1 32 ? -24.709 27.191 86.660 1.00 84.23 ? 91 ARG D C 1 ATOM 10664 O O . ARG D 1 32 ? -23.805 26.382 86.448 1.00 78.59 ? 91 ARG D O 1 ATOM 10665 C CB . ARG D 1 32 ? -25.079 27.842 89.053 1.00 83.79 ? 91 ARG D CB 1 ATOM 10666 C CG . ARG D 1 32 ? -24.511 26.508 89.520 1.00 83.48 ? 91 ARG D CG 1 ATOM 10667 C CD . ARG D 1 32 ? -25.168 26.019 90.800 1.00 85.40 ? 91 ARG D CD 1 ATOM 10668 N NE . ARG D 1 32 ? -26.611 25.856 90.652 1.00 84.76 ? 91 ARG D NE 1 ATOM 10669 C CZ . ARG D 1 32 ? -27.189 24.753 90.187 1.00 91.53 ? 91 ARG D CZ 1 ATOM 10670 N NH1 . ARG D 1 32 ? -26.447 23.716 89.825 1.00 97.17 ? 91 ARG D NH1 1 ATOM 10671 N NH2 . ARG D 1 32 ? -28.510 24.686 90.085 1.00 88.21 ? 91 ARG D NH2 1 ATOM 10672 N N . LYS D 1 33 ? -25.871 27.164 86.011 1.00 77.42 ? 92 LYS D N 1 ATOM 10673 C CA . LYS D 1 33 ? -26.130 26.202 84.941 1.00 67.00 ? 92 LYS D CA 1 ATOM 10674 C C . LYS D 1 33 ? -25.151 26.371 83.786 1.00 80.39 ? 92 LYS D C 1 ATOM 10675 O O . LYS D 1 33 ? -24.722 25.392 83.173 1.00 73.54 ? 92 LYS D O 1 ATOM 10676 C CB . LYS D 1 33 ? -27.562 26.342 84.417 1.00 56.61 ? 92 LYS D CB 1 ATOM 10677 C CG . LYS D 1 33 ? -28.652 25.957 85.400 1.00 55.36 ? 92 LYS D CG 1 ATOM 10678 C CD . LYS D 1 33 ? -30.021 26.091 84.751 1.00 65.07 ? 92 LYS D CD 1 ATOM 10679 C CE . LYS D 1 33 ? -31.116 25.498 85.620 1.00 75.29 ? 92 LYS D CE 1 ATOM 10680 N NZ . LYS D 1 33 ? -32.470 25.836 85.101 1.00 80.01 ? 92 LYS D NZ 1 ATOM 10681 N N . LEU D 1 34 ? -24.804 27.619 83.495 1.00 84.02 ? 93 LEU D N 1 ATOM 10682 C CA . LEU D 1 34 ? -23.841 27.925 82.446 1.00 79.29 ? 93 LEU D CA 1 ATOM 10683 C C . LEU D 1 34 ? -22.442 27.462 82.838 1.00 78.15 ? 93 LEU D C 1 ATOM 10684 O O . LEU D 1 34 ? -21.695 26.935 82.012 1.00 70.86 ? 93 LEU D O 1 ATOM 10685 C CB . LEU D 1 34 ? -23.838 29.427 82.154 1.00 73.23 ? 93 LEU D CB 1 ATOM 10686 C CG . LEU D 1 34 ? -24.987 29.951 81.290 1.00 68.76 ? 93 LEU D CG 1 ATOM 10687 C CD1 . LEU D 1 34 ? -25.057 31.470 81.357 1.00 68.71 ? 93 LEU D CD1 1 ATOM 10688 C CD2 . LEU D 1 34 ? -24.847 29.479 79.854 1.00 60.47 ? 93 LEU D CD2 1 ATOM 10689 N N . TYR D 1 35 ? -22.097 27.666 84.105 1.00 90.93 ? 94 TYR D N 1 ATOM 10690 C CA . TYR D 1 35 ? -20.810 27.240 84.645 1.00 93.05 ? 94 TYR D CA 1 ATOM 10691 C C . TYR D 1 35 ? -20.649 25.722 84.599 1.00 85.97 ? 94 TYR D C 1 ATOM 10692 O O . TYR D 1 35 ? -19.634 25.211 84.123 1.00 74.43 ? 94 TYR D O 1 ATOM 10693 C CB . TYR D 1 35 ? -20.652 27.739 86.088 1.00 87.24 ? 94 TYR D CB 1 ATOM 10694 C CG . TYR D 1 35 ? -19.225 27.774 86.609 1.00 86.07 ? 94 TYR D CG 1 ATOM 10695 C CD1 . TYR D 1 35 ? -18.938 28.333 87.848 1.00 81.64 ? 94 TYR D CD1 1 ATOM 10696 C CD2 . TYR D 1 35 ? -18.171 27.252 85.869 1.00 83.04 ? 94 TYR D CD2 1 ATOM 10697 C CE1 . TYR D 1 35 ? -17.644 28.369 88.335 1.00 78.06 ? 94 TYR D CE1 1 ATOM 10698 C CE2 . TYR D 1 35 ? -16.874 27.284 86.348 1.00 80.76 ? 94 TYR D CE2 1 ATOM 10699 C CZ . TYR D 1 35 ? -16.616 27.843 87.580 1.00 86.53 ? 94 TYR D CZ 1 ATOM 10700 O OH . TYR D 1 35 ? -15.327 27.878 88.061 1.00 95.75 ? 94 TYR D OH 1 ATOM 10701 N N . ASP D 1 36 ? -21.658 25.009 85.090 1.00 80.15 ? 95 ASP D N 1 ATOM 10702 C CA . ASP D 1 36 ? -21.596 23.554 85.200 1.00 85.26 ? 95 ASP D CA 1 ATOM 10703 C C . ASP D 1 36 ? -21.396 22.833 83.867 1.00 83.40 ? 95 ASP D C 1 ATOM 10704 O O . ASP D 1 36 ? -20.606 21.894 83.778 1.00 82.84 ? 95 ASP D O 1 ATOM 10705 C CB . ASP D 1 36 ? -22.871 23.031 85.866 1.00 96.43 ? 95 ASP D CB 1 ATOM 10706 C CG . ASP D 1 36 ? -23.004 23.481 87.307 1.00 103.78 ? 95 ASP D CG 1 ATOM 10707 O OD1 . ASP D 1 36 ? -22.029 24.043 87.848 1.00 106.19 ? 95 ASP D OD1 1 ATOM 10708 O OD2 . ASP D 1 36 ? -24.083 23.270 87.901 1.00 102.59 ? 95 ASP D OD2 1 ATOM 10709 N N . LEU D 1 37 ? -22.104 23.275 82.833 1.00 88.72 ? 96 LEU D N 1 ATOM 10710 C CA . LEU D 1 37 ? -22.051 22.605 81.536 1.00 78.48 ? 96 LEU D CA 1 ATOM 10711 C C . LEU D 1 37 ? -20.805 22.905 80.703 1.00 80.16 ? 96 LEU D C 1 ATOM 10712 O O . LEU D 1 37 ? -20.615 22.306 79.643 1.00 94.82 ? 96 LEU D O 1 ATOM 10713 C CB . LEU D 1 37 ? -23.294 22.958 80.716 1.00 77.47 ? 96 LEU D CB 1 ATOM 10714 C CG . LEU D 1 37 ? -24.233 21.786 80.426 1.00 87.60 ? 96 LEU D CG 1 ATOM 10715 C CD1 . LEU D 1 37 ? -25.626 22.278 80.060 1.00 81.23 ? 96 LEU D CD1 1 ATOM 10716 C CD2 . LEU D 1 37 ? -23.660 20.898 79.330 1.00 90.30 ? 96 LEU D CD2 1 ATOM 10717 N N . THR D 1 38 ? -19.964 23.829 81.158 1.00 65.66 ? 97 THR D N 1 ATOM 10718 C CA . THR D 1 38 ? -18.838 24.264 80.333 1.00 79.38 ? 97 THR D CA 1 ATOM 10719 C C . THR D 1 38 ? -17.501 24.352 81.068 1.00 83.98 ? 97 THR D C 1 ATOM 10720 O O . THR D 1 38 ? -16.485 24.708 80.469 1.00 86.64 ? 97 THR D O 1 ATOM 10721 C CB . THR D 1 38 ? -19.119 25.645 79.709 1.00 74.71 ? 97 THR D CB 1 ATOM 10722 O OG1 . THR D 1 38 ? -19.458 26.580 80.741 1.00 69.02 ? 97 THR D OG1 1 ATOM 10723 C CG2 . THR D 1 38 ? -20.256 25.562 78.696 1.00 74.52 ? 97 THR D CG2 1 ATOM 10724 N N . LYS D 1 39 ? -17.503 24.055 82.363 1.00 78.35 ? 98 LYS D N 1 ATOM 10725 C CA . LYS D 1 39 ? -16.281 24.131 83.161 1.00 82.39 ? 98 LYS D CA 1 ATOM 10726 C C . LYS D 1 39 ? -15.236 23.079 82.768 1.00 80.54 ? 98 LYS D C 1 ATOM 10727 O O . LYS D 1 39 ? -14.066 23.194 83.137 1.00 85.38 ? 98 LYS D O 1 ATOM 10728 C CB . LYS D 1 39 ? -16.619 24.036 84.653 1.00 83.86 ? 98 LYS D CB 1 ATOM 10729 C CG . LYS D 1 39 ? -17.372 22.790 85.081 1.00 86.22 ? 98 LYS D CG 1 ATOM 10730 C CD . LYS D 1 39 ? -17.560 22.797 86.593 1.00 85.27 ? 98 LYS D CD 1 ATOM 10731 C CE . LYS D 1 39 ? -18.405 21.628 87.073 1.00 83.23 ? 98 LYS D CE 1 ATOM 10732 N NZ . LYS D 1 39 ? -17.867 20.312 86.641 1.00 77.69 ? 98 LYS D NZ 1 ATOM 10733 N N . ASN D 1 40 ? -15.659 22.055 82.032 1.00 80.08 ? 99 ASN D N 1 ATOM 10734 C CA . ASN D 1 40 ? -14.743 21.008 81.579 1.00 85.73 ? 99 ASN D CA 1 ATOM 10735 C C . ASN D 1 40 ? -14.469 21.064 80.075 1.00 83.58 ? 99 ASN D C 1 ATOM 10736 O O . ASN D 1 40 ? -13.838 20.165 79.518 1.00 87.06 ? 99 ASN D O 1 ATOM 10737 C CB . ASN D 1 40 ? -15.284 19.626 81.950 1.00 93.24 ? 99 ASN D CB 1 ATOM 10738 C CG . ASN D 1 40 ? -15.337 19.403 83.449 1.00 90.77 ? 99 ASN D CG 1 ATOM 10739 O OD1 . ASN D 1 40 ? -16.352 18.961 83.988 1.00 78.61 ? 99 ASN D OD1 1 ATOM 10740 N ND2 . ASN D 1 40 ? -14.238 19.707 84.131 1.00 91.97 ? 99 ASN D ND2 1 ATOM 10741 N N . VAL D 1 41 ? -14.946 22.120 79.424 1.00 79.44 ? 100 VAL D N 1 ATOM 10742 C CA . VAL D 1 41 ? -14.731 22.311 77.990 1.00 80.27 ? 100 VAL D CA 1 ATOM 10743 C C . VAL D 1 41 ? -13.376 22.959 77.706 1.00 77.42 ? 100 VAL D C 1 ATOM 10744 O O . VAL D 1 41 ? -13.030 23.975 78.310 1.00 79.22 ? 100 VAL D O 1 ATOM 10745 C CB . VAL D 1 41 ? -15.850 23.166 77.361 1.00 68.76 ? 100 VAL D CB 1 ATOM 10746 C CG1 . VAL D 1 41 ? -15.589 23.382 75.876 1.00 61.89 ? 100 VAL D CG1 1 ATOM 10747 C CG2 . VAL D 1 41 ? -17.204 22.508 77.581 1.00 58.56 ? 100 VAL D CG2 1 ATOM 10748 N N . ASP D 1 42 ? -12.612 22.368 76.791 1.00 86.69 ? 101 ASP D N 1 ATOM 10749 C CA . ASP D 1 42 ? -11.300 22.902 76.437 1.00 91.28 ? 101 ASP D CA 1 ATOM 10750 C C . ASP D 1 42 ? -11.432 24.033 75.418 1.00 90.86 ? 101 ASP D C 1 ATOM 10751 O O . ASP D 1 42 ? -11.327 23.817 74.209 1.00 99.47 ? 101 ASP D O 1 ATOM 10752 C CB . ASP D 1 42 ? -10.403 21.793 75.879 1.00 95.20 ? 101 ASP D CB 1 ATOM 10753 C CG . ASP D 1 42 ? -8.975 22.255 75.634 1.00 102.39 ? 101 ASP D CG 1 ATOM 10754 O OD1 . ASP D 1 42 ? -8.633 23.395 76.012 1.00 94.36 ? 101 ASP D OD1 1 ATOM 10755 O OD2 . ASP D 1 42 ? -8.193 21.472 75.052 1.00 110.18 ? 101 ASP D OD2 1 ATOM 10756 N N . PHE D 1 43 ? -11.657 25.241 75.926 1.00 83.77 ? 102 PHE D N 1 ATOM 10757 C CA . PHE D 1 43 ? -11.849 26.424 75.094 1.00 81.26 ? 102 PHE D CA 1 ATOM 10758 C C . PHE D 1 43 ? -10.560 26.858 74.403 1.00 85.98 ? 102 PHE D C 1 ATOM 10759 O O . PHE D 1 43 ? -10.588 27.370 73.282 1.00 93.57 ? 102 PHE D O 1 ATOM 10760 C CB . PHE D 1 43 ? -12.401 27.576 75.932 1.00 75.60 ? 102 PHE D CB 1 ATOM 10761 C CG . PHE D 1 43 ? -13.849 27.422 76.297 1.00 79.01 ? 102 PHE D CG 1 ATOM 10762 C CD1 . PHE D 1 43 ? -14.841 27.693 75.369 1.00 80.59 ? 102 PHE D CD1 1 ATOM 10763 C CD2 . PHE D 1 43 ? -14.218 26.999 77.563 1.00 79.49 ? 102 PHE D CD2 1 ATOM 10764 C CE1 . PHE D 1 43 ? -16.174 27.551 75.699 1.00 79.76 ? 102 PHE D CE1 1 ATOM 10765 C CE2 . PHE D 1 43 ? -15.551 26.853 77.898 1.00 78.65 ? 102 PHE D CE2 1 ATOM 10766 C CZ . PHE D 1 43 ? -16.530 27.130 76.965 1.00 78.42 ? 102 PHE D CZ 1 ATOM 10767 N N . ASP D 1 44 ? -9.437 26.666 75.089 1.00 74.85 ? 103 ASP D N 1 ATOM 10768 C CA . ASP D 1 44 ? -8.127 27.057 74.576 1.00 84.07 ? 103 ASP D CA 1 ATOM 10769 C C . ASP D 1 44 ? -7.827 26.417 73.224 1.00 74.53 ? 103 ASP D C 1 ATOM 10770 O O . ASP D 1 44 ? -7.351 27.085 72.309 1.00 71.07 ? 103 ASP D O 1 ATOM 10771 C CB . ASP D 1 44 ? -7.031 26.698 75.580 1.00 81.16 ? 103 ASP D CB 1 ATOM 10772 C CG . ASP D 1 44 ? -7.028 27.611 76.790 1.00 89.01 ? 103 ASP D CG 1 ATOM 10773 O OD1 . ASP D 1 44 ? -7.589 28.723 76.699 1.00 93.61 ? 103 ASP D OD1 1 ATOM 10774 O OD2 . ASP D 1 44 ? -6.461 27.219 77.832 1.00 98.91 ? 103 ASP D OD2 1 ATOM 10775 N N . GLN D 1 45 ? -8.112 25.125 73.102 1.00 68.89 ? 104 GLN D N 1 ATOM 10776 C CA . GLN D 1 45 ? -7.886 24.413 71.850 1.00 72.57 ? 104 GLN D CA 1 ATOM 10777 C C . GLN D 1 45 ? -8.918 24.826 70.805 1.00 81.38 ? 104 GLN D C 1 ATOM 10778 O O . GLN D 1 45 ? -8.637 24.828 69.606 1.00 77.27 ? 104 GLN D O 1 ATOM 10779 C CB . GLN D 1 45 ? -7.933 22.899 72.073 1.00 72.22 ? 104 GLN D CB 1 ATOM 10780 C CG . GLN D 1 45 ? -7.422 22.079 70.898 1.00 100.25 ? 104 GLN D CG 1 ATOM 10781 C CD . GLN D 1 45 ? -6.005 22.448 70.502 1.00 111.52 ? 104 GLN D CD 1 ATOM 10782 O OE1 . GLN D 1 45 ? -5.780 23.060 69.458 1.00 110.72 ? 104 GLN D OE1 1 ATOM 10783 N NE2 . GLN D 1 45 ? -5.041 22.074 71.335 1.00 107.24 ? 104 GLN D NE2 1 ATOM 10784 N N . LEU D 1 46 ? -10.111 25.179 71.273 1.00 78.94 ? 105 LEU D N 1 ATOM 10785 C CA . LEU D 1 46 ? -11.196 25.607 70.395 1.00 70.45 ? 105 LEU D CA 1 ATOM 10786 C C . LEU D 1 46 ? -10.888 26.943 69.722 1.00 75.17 ? 105 LEU D C 1 ATOM 10787 O O . LEU D 1 46 ? -11.096 27.102 68.519 1.00 76.30 ? 105 LEU D O 1 ATOM 10788 C CB . LEU D 1 46 ? -12.506 25.706 71.178 1.00 56.86 ? 105 LEU D CB 1 ATOM 10789 C CG . LEU D 1 46 ? -13.238 24.388 71.442 1.00 55.27 ? 105 LEU D CG 1 ATOM 10790 C CD1 . LEU D 1 46 ? -14.371 24.591 72.437 1.00 48.22 ? 105 LEU D CD1 1 ATOM 10791 C CD2 . LEU D 1 46 ? -13.760 23.794 70.141 1.00 46.19 ? 105 LEU D CD2 1 ATOM 10792 N N . ARG D 1 47 ? -10.401 27.898 70.509 1.00 72.56 ? 106 ARG D N 1 ATOM 10793 C CA . ARG D 1 47 ? -10.058 29.227 70.007 1.00 65.54 ? 106 ARG D CA 1 ATOM 10794 C C . ARG D 1 47 ? -9.026 29.171 68.878 1.00 76.31 ? 106 ARG D C 1 ATOM 10795 O O . ARG D 1 47 ? -9.018 30.024 67.989 1.00 78.88 ? 106 ARG D O 1 ATOM 10796 C CB . ARG D 1 47 ? -9.539 30.105 71.151 1.00 65.96 ? 106 ARG D CB 1 ATOM 10797 C CG . ARG D 1 47 ? -9.122 31.509 70.730 1.00 75.66 ? 106 ARG D CG 1 ATOM 10798 C CD . ARG D 1 47 ? -8.536 32.298 71.891 1.00 78.73 ? 106 ARG D CD 1 ATOM 10799 N NE . ARG D 1 47 ? -9.461 33.310 72.395 1.00 87.36 ? 106 ARG D NE 1 ATOM 10800 C CZ . ARG D 1 47 ? -10.307 33.118 73.401 1.00 83.81 ? 106 ARG D CZ 1 ATOM 10801 N NH1 . ARG D 1 47 ? -10.350 31.946 74.020 1.00 70.51 ? 106 ARG D NH1 1 ATOM 10802 N NH2 . ARG D 1 47 ? -11.111 34.098 73.790 1.00 78.57 ? 106 ARG D NH2 1 ATOM 10803 N N . GLN D 1 48 ? -8.167 28.157 68.909 1.00 85.43 ? 107 GLN D N 1 ATOM 10804 C CA . GLN D 1 48 ? -7.078 28.041 67.941 1.00 85.71 ? 107 GLN D CA 1 ATOM 10805 C C . GLN D 1 48 ? -7.570 27.599 66.563 1.00 73.26 ? 107 GLN D C 1 ATOM 10806 O O . GLN D 1 48 ? -6.794 27.547 65.609 1.00 70.97 ? 107 GLN D O 1 ATOM 10807 C CB . GLN D 1 48 ? -6.019 27.053 68.442 1.00 93.05 ? 107 GLN D CB 1 ATOM 10808 C CG . GLN D 1 48 ? -5.481 27.341 69.835 1.00 95.60 ? 107 GLN D CG 1 ATOM 10809 C CD . GLN D 1 48 ? -4.704 28.639 69.918 1.00 98.51 ? 107 GLN D CD 1 ATOM 10810 O OE1 . GLN D 1 48 ? -4.154 29.112 68.924 1.00 100.64 ? 107 GLN D OE1 1 ATOM 10811 N NE2 . GLN D 1 48 ? -4.654 29.222 71.110 1.00 95.47 ? 107 GLN D NE2 1 ATOM 10812 N N . ASN D 1 49 ? -8.858 27.282 66.459 1.00 70.83 ? 108 ASN D N 1 ATOM 10813 C CA . ASN D 1 49 ? -9.423 26.799 65.202 1.00 69.96 ? 108 ASN D CA 1 ATOM 10814 C C . ASN D 1 49 ? -10.332 27.808 64.506 1.00 70.61 ? 108 ASN D C 1 ATOM 10815 O O . ASN D 1 49 ? -10.793 27.571 63.389 1.00 70.30 ? 108 ASN D O 1 ATOM 10816 C CB . ASN D 1 49 ? -10.202 25.506 65.451 1.00 69.69 ? 108 ASN D CB 1 ATOM 10817 C CG . ASN D 1 49 ? -9.294 24.312 65.660 1.00 83.45 ? 108 ASN D CG 1 ATOM 10818 O OD1 . ASN D 1 49 ? -8.911 23.633 64.708 1.00 92.62 ? 108 ASN D OD1 1 ATOM 10819 N ND2 . ASN D 1 49 ? -8.945 24.048 66.915 1.00 79.03 ? 108 ASN D ND2 1 ATOM 10820 N N . GLU D 1 50 ? -10.590 28.930 65.167 1.00 68.01 ? 109 GLU D N 1 ATOM 10821 C CA . GLU D 1 50 ? -11.483 29.949 64.625 1.00 73.02 ? 109 GLU D CA 1 ATOM 10822 C C . GLU D 1 50 ? -10.911 30.645 63.390 1.00 71.96 ? 109 GLU D C 1 ATOM 10823 O O . GLU D 1 50 ? -11.658 31.078 62.512 1.00 68.37 ? 109 GLU D O 1 ATOM 10824 C CB . GLU D 1 50 ? -11.810 30.981 65.705 1.00 60.09 ? 109 GLU D CB 1 ATOM 10825 C CG . GLU D 1 50 ? -12.498 30.382 66.922 1.00 55.94 ? 109 GLU D CG 1 ATOM 10826 C CD . GLU D 1 50 ? -12.826 31.414 67.981 1.00 71.68 ? 109 GLU D CD 1 ATOM 10827 O OE1 . GLU D 1 50 ? -12.629 32.620 67.723 1.00 68.96 ? 109 GLU D OE1 1 ATOM 10828 O OE2 . GLU D 1 50 ? -13.291 31.017 69.071 1.00 62.04 ? 109 GLU D OE2 1 ATOM 10829 N N . CYS D 1 51 ? -9.587 30.753 63.330 1.00 65.19 ? 110 CYS D N 1 ATOM 10830 C CA . CYS D 1 51 ? -8.914 31.381 62.195 1.00 77.82 ? 110 CYS D CA 1 ATOM 10831 C C . CYS D 1 51 ? -7.962 30.427 61.479 1.00 73.88 ? 110 CYS D C 1 ATOM 10832 O O . CYS D 1 51 ? -7.004 29.933 62.076 1.00 78.34 ? 110 CYS D O 1 ATOM 10833 C CB . CYS D 1 51 ? -8.150 32.624 62.655 1.00 84.46 ? 110 CYS D CB 1 ATOM 10834 S SG . CYS D 1 51 ? -7.320 33.525 61.326 1.00 93.38 ? 110 CYS D SG 1 ATOM 10835 N N . LYS D 1 52 ? -8.235 30.163 60.203 1.00 74.01 ? 111 LYS D N 1 ATOM 10836 C CA . LYS D 1 52 ? -7.405 29.259 59.411 1.00 87.43 ? 111 LYS D CA 1 ATOM 10837 C C . LYS D 1 52 ? -5.967 29.768 59.323 1.00 81.85 ? 111 LYS D C 1 ATOM 10838 O O . LYS D 1 52 ? -5.064 29.201 59.939 1.00 82.43 ? 111 LYS D O 1 ATOM 10839 C CB . LYS D 1 52 ? -7.982 29.082 58.005 1.00 80.95 ? 111 LYS D CB 1 ATOM 10840 C CG . LYS D 1 52 ? -9.118 28.073 57.915 1.00 87.00 ? 111 LYS D CG 1 ATOM 10841 C CD . LYS D 1 52 ? -9.028 27.245 56.640 1.00 89.47 ? 111 LYS D CD 1 ATOM 10842 C CE . LYS D 1 52 ? -8.990 28.127 55.402 1.00 89.99 ? 111 LYS D CE 1 ATOM 10843 N NZ . LYS D 1 52 ? -9.142 27.342 54.146 1.00 82.05 ? 111 LYS D NZ 1 ATOM 10844 N N . LYS D 1 53 ? -5.760 30.835 58.557 1.00 80.60 ? 112 LYS D N 1 ATOM 10845 C CA . LYS D 1 53 ? -4.434 31.434 58.433 1.00 77.83 ? 112 LYS D CA 1 ATOM 10846 C C . LYS D 1 53 ? -4.483 32.937 58.710 1.00 79.53 ? 112 LYS D C 1 ATOM 10847 O O . LYS D 1 53 ? -5.163 33.687 58.008 1.00 81.60 ? 112 LYS D O 1 ATOM 10848 C CB . LYS D 1 53 ? -3.861 31.165 57.041 1.00 74.22 ? 112 LYS D CB 1 ATOM 10849 C CG . LYS D 1 53 ? -2.357 31.336 56.935 1.00 79.14 ? 112 LYS D CG 1 ATOM 10850 C CD . LYS D 1 53 ? -1.892 31.179 55.497 1.00 80.88 ? 112 LYS D CD 1 ATOM 10851 C CE . LYS D 1 53 ? -0.376 31.095 55.406 1.00 80.55 ? 112 LYS D CE 1 ATOM 10852 N NZ . LYS D 1 53 ? 0.300 32.287 55.982 1.00 71.83 ? 112 LYS D NZ 1 ATOM 10853 N N . ASN D 1 54 ? -3.757 33.365 59.738 1.00 73.86 ? 113 ASN D N 1 ATOM 10854 C CA . ASN D 1 54 ? -3.714 34.771 60.130 1.00 62.25 ? 113 ASN D CA 1 ATOM 10855 C C . ASN D 1 54 ? -2.612 35.547 59.405 1.00 71.23 ? 113 ASN D C 1 ATOM 10856 O O . ASN D 1 54 ? -1.465 35.571 59.852 1.00 80.24 ? 113 ASN D O 1 ATOM 10857 C CB . ASN D 1 54 ? -3.523 34.879 61.646 1.00 56.14 ? 113 ASN D CB 1 ATOM 10858 C CG . ASN D 1 54 ? -3.753 36.287 62.174 1.00 64.24 ? 113 ASN D CG 1 ATOM 10859 O OD1 . ASN D 1 54 ? -3.776 37.260 61.419 1.00 50.63 ? 113 ASN D OD1 1 ATOM 10860 N ND2 . ASN D 1 54 ? -3.918 36.398 63.486 1.00 56.17 ? 113 ASN D ND2 1 ATOM 10861 N N . ILE D 1 55 ? -2.967 36.182 58.291 1.00 66.53 ? 114 ILE D N 1 ATOM 10862 C CA . ILE D 1 55 ? -2.019 36.993 57.528 1.00 76.81 ? 114 ILE D CA 1 ATOM 10863 C C . ILE D 1 55 ? -2.608 38.354 57.161 1.00 73.33 ? 114 ILE D C 1 ATOM 10864 O O . ILE D 1 55 ? -3.800 38.469 56.876 1.00 81.60 ? 114 ILE D O 1 ATOM 10865 C CB . ILE D 1 55 ? -1.557 36.274 56.249 1.00 68.46 ? 114 ILE D CB 1 ATOM 10866 C CG1 . ILE D 1 55 ? -2.672 35.385 55.698 1.00 67.80 ? 114 ILE D CG1 1 ATOM 10867 C CG2 . ILE D 1 55 ? -0.310 35.454 56.526 1.00 61.73 ? 114 ILE D CG2 1 ATOM 10868 C CD1 . ILE D 1 55 ? -3.531 36.062 54.657 1.00 61.34 ? 114 ILE D CD1 1 ATOM 10869 N N . THR D 1 56 ? -1.760 39.379 57.161 1.00 70.22 ? 115 THR D N 1 ATOM 10870 C CA . THR D 1 56 ? -2.186 40.740 56.846 1.00 68.32 ? 115 THR D CA 1 ATOM 10871 C C . THR D 1 56 ? -2.192 41.056 55.350 1.00 64.32 ? 115 THR D C 1 ATOM 10872 O O . THR D 1 56 ? -1.773 40.243 54.525 1.00 68.31 ? 115 THR D O 1 ATOM 10873 C CB . THR D 1 56 ? -1.289 41.772 57.549 1.00 67.62 ? 115 THR D CB 1 ATOM 10874 O OG1 . THR D 1 56 ? -0.010 41.811 56.902 1.00 71.35 ? 115 THR D OG1 1 ATOM 10875 C CG2 . THR D 1 56 ? -1.100 41.404 59.011 1.00 38.75 ? 115 THR D CG2 1 ATOM 10876 N N . LEU D 1 57 ? -2.670 42.253 55.020 1.00 67.55 ? 116 LEU D N 1 ATOM 10877 C CA . LEU D 1 57 ? -2.805 42.712 53.639 1.00 70.01 ? 116 LEU D CA 1 ATOM 10878 C C . LEU D 1 57 ? -1.453 43.061 53.012 1.00 80.44 ? 116 LEU D C 1 ATOM 10879 O O . LEU D 1 57 ? -1.252 42.886 51.813 1.00 87.54 ? 116 LEU D O 1 ATOM 10880 C CB . LEU D 1 57 ? -3.747 43.925 53.591 1.00 67.97 ? 116 LEU D CB 1 ATOM 10881 C CG . LEU D 1 57 ? -4.500 44.346 52.318 1.00 72.19 ? 116 LEU D CG 1 ATOM 10882 C CD1 . LEU D 1 57 ? -3.595 44.899 51.220 1.00 65.01 ? 116 LEU D CD1 1 ATOM 10883 C CD2 . LEU D 1 57 ? -5.347 43.194 51.794 1.00 71.34 ? 116 LEU D CD2 1 ATOM 10884 N N . SER D 1 58 ? -0.524 43.538 53.833 1.00 80.21 ? 117 SER D N 1 ATOM 10885 C CA . SER D 1 58 ? 0.791 43.966 53.357 1.00 84.85 ? 117 SER D CA 1 ATOM 10886 C C . SER D 1 58 ? 1.656 42.806 52.874 1.00 85.20 ? 117 SER D C 1 ATOM 10887 O O . SER D 1 58 ? 2.352 42.918 51.864 1.00 90.68 ? 117 SER D O 1 ATOM 10888 C CB . SER D 1 58 ? 1.531 44.728 54.458 1.00 79.70 ? 117 SER D CB 1 ATOM 10889 O OG . SER D 1 58 ? 1.897 43.866 55.520 1.00 78.24 ? 117 SER D OG 1 ATOM 10890 N N . LYS D 1 59 ? 1.606 41.696 53.602 1.00 77.22 ? 118 LYS D N 1 ATOM 10891 C CA . LYS D 1 59 ? 2.415 40.522 53.291 1.00 79.91 ? 118 LYS D CA 1 ATOM 10892 C C . LYS D 1 59 ? 2.050 39.901 51.942 1.00 84.07 ? 118 LYS D C 1 ATOM 10893 O O . LYS D 1 59 ? 2.865 39.210 51.330 1.00 95.26 ? 118 LYS D O 1 ATOM 10894 C CB . LYS D 1 59 ? 2.263 39.478 54.400 1.00 78.63 ? 118 LYS D CB 1 ATOM 10895 C CG . LYS D 1 59 ? 2.697 39.951 55.786 1.00 74.19 ? 118 LYS D CG 1 ATOM 10896 C CD . LYS D 1 59 ? 4.132 39.556 56.114 1.00 83.91 ? 118 LYS D CD 1 ATOM 10897 C CE . LYS D 1 59 ? 5.145 40.532 55.534 1.00 87.44 ? 118 LYS D CE 1 ATOM 10898 N NZ . LYS D 1 59 ? 4.947 41.913 56.055 1.00 77.16 ? 118 LYS D NZ 1 ATOM 10899 N N . PHE D 1 60 ? 0.829 40.153 51.482 1.00 85.22 ? 119 PHE D N 1 ATOM 10900 C CA . PHE D 1 60 ? 0.366 39.642 50.193 1.00 77.10 ? 119 PHE D CA 1 ATOM 10901 C C . PHE D 1 60 ? 1.010 40.375 49.016 1.00 75.57 ? 119 PHE D C 1 ATOM 10902 O O . PHE D 1 60 ? 2.175 40.770 49.072 1.00 75.12 ? 119 PHE D O 1 ATOM 10903 C CB . PHE D 1 60 ? -1.164 39.743 50.111 1.00 85.24 ? 119 PHE D CB 1 ATOM 10904 C CG . PHE D 1 60 ? -1.672 40.559 48.946 1.00 91.56 ? 119 PHE D CG 1 ATOM 10905 C CD1 . PHE D 1 60 ? -1.742 41.943 49.022 1.00 86.86 ? 119 PHE D CD1 1 ATOM 10906 C CD2 . PHE D 1 60 ? -2.110 39.937 47.788 1.00 91.73 ? 119 PHE D CD2 1 ATOM 10907 C CE1 . PHE D 1 60 ? -2.214 42.691 47.959 1.00 77.48 ? 119 PHE D CE1 1 ATOM 10908 C CE2 . PHE D 1 60 ? -2.587 40.681 46.722 1.00 82.71 ? 119 PHE D CE2 1 ATOM 10909 C CZ . PHE D 1 60 ? -2.639 42.059 46.809 1.00 71.69 ? 119 PHE D CZ 1 ATOM 10910 N N . GLU D 1 71 ? 4.239 53.146 53.679 1.00 70.20 ? 130 GLU D N 1 ATOM 10911 C CA . GLU D 1 71 ? 3.767 53.345 55.045 1.00 76.75 ? 130 GLU D CA 1 ATOM 10912 C C . GLU D 1 71 ? 4.210 54.701 55.588 1.00 66.87 ? 130 GLU D C 1 ATOM 10913 O O . GLU D 1 71 ? 4.853 54.785 56.633 1.00 53.43 ? 130 GLU D O 1 ATOM 10914 C CB . GLU D 1 71 ? 4.256 52.216 55.953 1.00 77.30 ? 130 GLU D CB 1 ATOM 10915 C CG . GLU D 1 71 ? 3.554 50.892 55.697 1.00 73.25 ? 130 GLU D CG 1 ATOM 10916 C CD . GLU D 1 71 ? 3.798 49.875 56.791 1.00 82.93 ? 130 GLU D CD 1 ATOM 10917 O OE1 . GLU D 1 71 ? 4.530 50.195 57.750 1.00 89.76 ? 130 GLU D OE1 1 ATOM 10918 O OE2 . GLU D 1 71 ? 3.255 48.754 56.692 1.00 81.59 ? 130 GLU D OE2 1 ATOM 10919 N N . ASP D 1 72 ? 3.856 55.761 54.866 1.00 69.32 ? 131 ASP D N 1 ATOM 10920 C CA . ASP D 1 72 ? 4.206 57.120 55.265 1.00 69.49 ? 131 ASP D CA 1 ATOM 10921 C C . ASP D 1 72 ? 3.325 57.641 56.398 1.00 67.24 ? 131 ASP D C 1 ATOM 10922 O O . ASP D 1 72 ? 3.775 58.429 57.229 1.00 77.45 ? 131 ASP D O 1 ATOM 10923 C CB . ASP D 1 72 ? 4.108 58.064 54.064 1.00 82.41 ? 131 ASP D CB 1 ATOM 10924 C CG . ASP D 1 72 ? 5.161 57.780 53.011 1.00 88.11 ? 131 ASP D CG 1 ATOM 10925 O OD1 . ASP D 1 72 ? 6.293 57.408 53.384 1.00 80.23 ? 131 ASP D OD1 1 ATOM 10926 O OD2 . ASP D 1 72 ? 4.856 57.932 51.809 1.00 95.20 ? 131 ASP D OD2 1 ATOM 10927 N N . ASP D 1 73 ? 2.071 57.201 56.426 1.00 70.64 ? 132 ASP D N 1 ATOM 10928 C CA . ASP D 1 73 ? 1.132 57.642 57.452 1.00 63.49 ? 132 ASP D CA 1 ATOM 10929 C C . ASP D 1 73 ? 0.321 56.487 58.037 1.00 60.48 ? 132 ASP D C 1 ATOM 10930 O O . ASP D 1 73 ? 0.392 55.356 57.556 1.00 48.43 ? 132 ASP D O 1 ATOM 10931 C CB . ASP D 1 73 ? 0.198 58.714 56.885 1.00 44.14 ? 132 ASP D CB 1 ATOM 10932 C CG . ASP D 1 73 ? -0.451 58.294 55.582 1.00 53.29 ? 132 ASP D CG 1 ATOM 10933 O OD1 . ASP D 1 73 ? -1.068 57.209 55.538 1.00 53.02 ? 132 ASP D OD1 1 ATOM 10934 O OD2 . ASP D 1 73 ? -0.343 59.051 54.594 1.00 51.97 ? 132 ASP D OD2 1 ATOM 10935 N N . ASN D 1 74 ? -0.449 56.791 59.078 1.00 49.89 ? 133 ASN D N 1 ATOM 10936 C CA . ASN D 1 74 ? -1.211 55.783 59.807 1.00 47.50 ? 133 ASN D CA 1 ATOM 10937 C C . ASN D 1 74 ? -2.365 55.180 59.009 1.00 52.65 ? 133 ASN D C 1 ATOM 10938 O O . ASN D 1 74 ? -2.890 54.129 59.375 1.00 47.10 ? 133 ASN D O 1 ATOM 10939 C CB . ASN D 1 74 ? -1.743 56.374 61.115 1.00 48.80 ? 133 ASN D CB 1 ATOM 10940 C CG . ASN D 1 74 ? -0.637 56.680 62.108 1.00 56.11 ? 133 ASN D CG 1 ATOM 10941 O OD1 . ASN D 1 74 ? 0.377 55.981 62.161 1.00 46.77 ? 133 ASN D OD1 1 ATOM 10942 N ND2 . ASN D 1 74 ? -0.826 57.729 62.899 1.00 54.60 ? 133 ASN D ND2 1 ATOM 10943 N N . TRP D 1 75 ? -2.768 55.846 57.931 1.00 43.19 ? 134 TRP D N 1 ATOM 10944 C CA . TRP D 1 75 ? -3.735 55.257 57.010 1.00 46.49 ? 134 TRP D CA 1 ATOM 10945 C C . TRP D 1 75 ? -3.138 54.010 56.371 1.00 60.69 ? 134 TRP D C 1 ATOM 10946 O O . TRP D 1 75 ? -3.742 52.937 56.386 1.00 48.00 ? 134 TRP D O 1 ATOM 10947 C CB . TRP D 1 75 ? -4.150 56.248 55.918 1.00 45.47 ? 134 TRP D CB 1 ATOM 10948 C CG . TRP D 1 75 ? -5.209 57.235 56.315 1.00 57.34 ? 134 TRP D CG 1 ATOM 10949 C CD1 . TRP D 1 75 ? -6.523 57.212 55.947 1.00 48.02 ? 134 TRP D CD1 1 ATOM 10950 C CD2 . TRP D 1 75 ? -5.042 58.403 57.129 1.00 57.17 ? 134 TRP D CD2 1 ATOM 10951 N NE1 . TRP D 1 75 ? -7.187 58.283 56.491 1.00 55.88 ? 134 TRP D NE1 1 ATOM 10952 C CE2 . TRP D 1 75 ? -6.301 59.031 57.221 1.00 55.78 ? 134 TRP D CE2 1 ATOM 10953 C CE3 . TRP D 1 75 ? -3.953 58.974 57.795 1.00 38.71 ? 134 TRP D CE3 1 ATOM 10954 C CZ2 . TRP D 1 75 ? -6.500 60.201 57.950 1.00 58.05 ? 134 TRP D CZ2 1 ATOM 10955 C CZ3 . TRP D 1 75 ? -4.154 60.137 58.519 1.00 38.81 ? 134 TRP D CZ3 1 ATOM 10956 C CH2 . TRP D 1 75 ? -5.417 60.737 58.590 1.00 49.96 ? 134 TRP D CH2 1 ATOM 10957 N N . GLU D 1 76 ? -1.940 54.170 55.819 1.00 69.31 ? 135 GLU D N 1 ATOM 10958 C CA . GLU D 1 76 ? -1.237 53.093 55.131 1.00 65.72 ? 135 GLU D CA 1 ATOM 10959 C C . GLU D 1 76 ? -0.882 51.935 56.064 1.00 55.97 ? 135 GLU D C 1 ATOM 10960 O O . GLU D 1 76 ? -0.955 50.773 55.666 1.00 46.19 ? 135 GLU D O 1 ATOM 10961 C CB . GLU D 1 76 ? 0.015 53.651 54.451 1.00 40.61 ? 135 GLU D CB 1 ATOM 10962 C CG . GLU D 1 76 ? -0.319 54.529 53.251 1.00 69.57 ? 135 GLU D CG 1 ATOM 10963 C CD . GLU D 1 76 ? 0.892 55.175 52.609 1.00 86.15 ? 135 GLU D CD 1 ATOM 10964 O OE1 . GLU D 1 76 ? 1.994 55.091 53.184 1.00 96.28 ? 135 GLU D OE1 1 ATOM 10965 O OE2 . GLU D 1 76 ? 0.736 55.777 51.525 1.00 78.68 ? 135 GLU D OE2 1 ATOM 10966 N N . ARG D 1 77 ? -0.498 52.248 57.299 1.00 52.44 ? 136 ARG D N 1 ATOM 10967 C CA . ARG D 1 77 ? -0.227 51.208 58.290 1.00 51.37 ? 136 ARG D CA 1 ATOM 10968 C C . ARG D 1 77 ? -1.502 50.463 58.682 1.00 65.54 ? 136 ARG D C 1 ATOM 10969 O O . ARG D 1 77 ? -1.462 49.270 58.983 1.00 74.69 ? 136 ARG D O 1 ATOM 10970 C CB . ARG D 1 77 ? 0.448 51.794 59.533 1.00 46.29 ? 136 ARG D CB 1 ATOM 10971 C CG . ARG D 1 77 ? 1.899 52.191 59.313 1.00 62.57 ? 136 ARG D CG 1 ATOM 10972 C CD . ARG D 1 77 ? 2.585 52.556 60.621 1.00 56.58 ? 136 ARG D CD 1 ATOM 10973 N NE . ARG D 1 77 ? 2.373 53.952 60.990 1.00 72.34 ? 136 ARG D NE 1 ATOM 10974 C CZ . ARG D 1 77 ? 3.180 54.945 60.630 1.00 78.68 ? 136 ARG D CZ 1 ATOM 10975 N NH1 . ARG D 1 77 ? 4.251 54.695 59.889 1.00 76.87 ? 136 ARG D NH1 1 ATOM 10976 N NH2 . ARG D 1 77 ? 2.917 56.188 61.009 1.00 66.04 ? 136 ARG D NH2 1 ATOM 10977 N N . PHE D 1 78 ? -2.629 51.168 58.683 1.00 60.46 ? 137 PHE D N 1 ATOM 10978 C CA . PHE D 1 78 ? -3.919 50.534 58.931 1.00 51.66 ? 137 PHE D CA 1 ATOM 10979 C C . PHE D 1 78 ? -4.271 49.586 57.791 1.00 53.48 ? 137 PHE D C 1 ATOM 10980 O O . PHE D 1 78 ? -4.656 48.439 58.020 1.00 51.71 ? 137 PHE D O 1 ATOM 10981 C CB . PHE D 1 78 ? -5.022 51.580 59.102 1.00 55.17 ? 137 PHE D CB 1 ATOM 10982 C CG . PHE D 1 78 ? -6.410 51.030 58.925 1.00 51.04 ? 137 PHE D CG 1 ATOM 10983 C CD1 . PHE D 1 78 ? -6.969 50.201 59.883 1.00 51.63 ? 137 PHE D CD1 1 ATOM 10984 C CD2 . PHE D 1 78 ? -7.153 51.339 57.798 1.00 41.77 ? 137 PHE D CD2 1 ATOM 10985 C CE1 . PHE D 1 78 ? -8.244 49.690 59.721 1.00 38.96 ? 137 PHE D CE1 1 ATOM 10986 C CE2 . PHE D 1 78 ? -8.429 50.832 57.629 1.00 48.85 ? 137 PHE D CE2 1 ATOM 10987 C CZ . PHE D 1 78 ? -8.975 50.007 58.593 1.00 41.70 ? 137 PHE D CZ 1 ATOM 10988 N N . TYR D 1 79 ? -4.141 50.082 56.564 1.00 46.19 ? 138 TYR D N 1 ATOM 10989 C CA . TYR D 1 79 ? -4.419 49.298 55.366 1.00 56.29 ? 138 TYR D CA 1 ATOM 10990 C C . TYR D 1 79 ? -3.553 48.043 55.308 1.00 59.27 ? 138 TYR D C 1 ATOM 10991 O O . TYR D 1 79 ? -4.025 46.964 54.950 1.00 63.56 ? 138 TYR D O 1 ATOM 10992 C CB . TYR D 1 79 ? -4.198 50.146 54.112 1.00 37.95 ? 138 TYR D CB 1 ATOM 10993 C CG . TYR D 1 79 ? -5.150 51.314 53.989 1.00 64.39 ? 138 TYR D CG 1 ATOM 10994 C CD1 . TYR D 1 79 ? -6.463 51.214 54.434 1.00 62.68 ? 138 TYR D CD1 1 ATOM 10995 C CD2 . TYR D 1 79 ? -4.736 52.518 53.436 1.00 57.65 ? 138 TYR D CD2 1 ATOM 10996 C CE1 . TYR D 1 79 ? -7.337 52.280 54.328 1.00 46.83 ? 138 TYR D CE1 1 ATOM 10997 C CE2 . TYR D 1 79 ? -5.602 53.590 53.326 1.00 47.29 ? 138 TYR D CE2 1 ATOM 10998 C CZ . TYR D 1 79 ? -6.901 53.465 53.773 1.00 53.56 ? 138 TYR D CZ 1 ATOM 10999 O OH . TYR D 1 79 ? -7.765 54.530 53.665 1.00 48.35 ? 138 TYR D OH 1 ATOM 11000 N N . SER D 1 80 ? -2.282 48.199 55.662 1.00 50.80 ? 139 SER D N 1 ATOM 11001 C CA . SER D 1 80 ? -1.321 47.104 55.615 1.00 63.82 ? 139 SER D CA 1 ATOM 11002 C C . SER D 1 80 ? -1.652 45.978 56.593 1.00 57.44 ? 139 SER D C 1 ATOM 11003 O O . SER D 1 80 ? -1.435 44.805 56.293 1.00 60.03 ? 139 SER D O 1 ATOM 11004 C CB . SER D 1 80 ? 0.088 47.633 55.898 1.00 58.90 ? 139 SER D CB 1 ATOM 11005 O OG . SER D 1 80 ? 0.589 48.363 54.791 1.00 58.87 ? 139 SER D OG 1 ATOM 11006 N N . ASN D 1 81 ? -2.180 46.338 57.759 1.00 51.84 ? 140 ASN D N 1 ATOM 11007 C CA . ASN D 1 81 ? -2.460 45.361 58.808 1.00 55.21 ? 140 ASN D CA 1 ATOM 11008 C C . ASN D 1 81 ? -3.869 44.777 58.776 1.00 55.78 ? 140 ASN D C 1 ATOM 11009 O O . ASN D 1 81 ? -4.287 44.118 59.729 1.00 53.52 ? 140 ASN D O 1 ATOM 11010 C CB . ASN D 1 81 ? -2.206 45.983 60.181 1.00 61.47 ? 140 ASN D CB 1 ATOM 11011 C CG . ASN D 1 81 ? -0.732 46.137 60.484 1.00 56.68 ? 140 ASN D CG 1 ATOM 11012 O OD1 . ASN D 1 81 ? -0.112 45.252 61.073 1.00 54.38 ? 140 ASN D OD1 1 ATOM 11013 N ND2 . ASN D 1 81 ? -0.159 47.265 60.080 1.00 50.90 ? 140 ASN D ND2 1 ATOM 11014 N N . ILE D 1 82 ? -4.607 45.025 57.698 1.00 51.04 ? 141 ILE D N 1 ATOM 11015 C CA . ILE D 1 82 ? -5.909 44.387 57.527 1.00 55.79 ? 141 ILE D CA 1 ATOM 11016 C C . ILE D 1 82 ? -5.730 42.873 57.398 1.00 59.14 ? 141 ILE D C 1 ATOM 11017 O O . ILE D 1 82 ? -5.186 42.381 56.410 1.00 66.21 ? 141 ILE D O 1 ATOM 11018 C CB . ILE D 1 82 ? -6.654 44.940 56.296 1.00 58.72 ? 141 ILE D CB 1 ATOM 11019 C CG1 . ILE D 1 82 ? -7.005 46.416 56.504 1.00 57.34 ? 141 ILE D CG1 1 ATOM 11020 C CG2 . ILE D 1 82 ? -7.910 44.127 56.022 1.00 53.09 ? 141 ILE D CG2 1 ATOM 11021 C CD1 . ILE D 1 82 ? -7.658 47.066 55.302 1.00 46.55 ? 141 ILE D CD1 1 ATOM 11022 N N . GLY D 1 83 ? -6.194 42.145 58.410 1.00 48.62 ? 142 GLY D N 1 ATOM 11023 C CA . GLY D 1 83 ? -5.960 40.714 58.519 1.00 63.12 ? 142 GLY D CA 1 ATOM 11024 C C . GLY D 1 83 ? -7.068 39.834 57.970 1.00 69.00 ? 142 GLY D C 1 ATOM 11025 O O . GLY D 1 83 ? -8.098 40.327 57.511 1.00 64.00 ? 142 GLY D O 1 ATOM 11026 N N . SER D 1 84 ? -6.851 38.522 58.024 1.00 64.57 ? 143 SER D N 1 ATOM 11027 C CA . SER D 1 84 ? -7.805 37.557 57.485 1.00 60.67 ? 143 SER D CA 1 ATOM 11028 C C . SER D 1 84 ? -8.915 37.211 58.472 1.00 59.06 ? 143 SER D C 1 ATOM 11029 O O . SER D 1 84 ? -9.936 36.642 58.088 1.00 67.64 ? 143 SER D O 1 ATOM 11030 C CB . SER D 1 84 ? -7.086 36.273 57.067 1.00 62.83 ? 143 SER D CB 1 ATOM 11031 O OG . SER D 1 84 ? -6.423 36.438 55.828 1.00 73.50 ? 143 SER D OG 1 ATOM 11032 N N . CYS D 1 85 ? -8.714 37.548 59.742 1.00 58.93 ? 144 CYS D N 1 ATOM 11033 C CA . CYS D 1 85 ? -9.709 37.253 60.766 1.00 74.90 ? 144 CYS D CA 1 ATOM 11034 C C . CYS D 1 85 ? -10.031 38.494 61.589 1.00 73.06 ? 144 CYS D C 1 ATOM 11035 O O . CYS D 1 85 ? -10.747 38.422 62.589 1.00 66.84 ? 144 CYS D O 1 ATOM 11036 C CB . CYS D 1 85 ? -9.221 36.125 61.678 1.00 85.44 ? 144 CYS D CB 1 ATOM 11037 S SG . CYS D 1 85 ? -9.017 34.532 60.845 1.00 81.17 ? 144 CYS D SG 1 ATOM 11038 N N . SER D 1 86 ? -9.500 39.631 61.152 1.00 74.47 ? 145 SER D N 1 ATOM 11039 C CA . SER D 1 86 ? -9.728 40.909 61.816 1.00 57.39 ? 145 SER D CA 1 ATOM 11040 C C . SER D 1 86 ? -9.279 42.047 60.912 1.00 57.16 ? 145 SER D C 1 ATOM 11041 O O . SER D 1 86 ? -8.354 41.886 60.120 1.00 60.38 ? 145 SER D O 1 ATOM 11042 C CB . SER D 1 86 ? -8.978 40.978 63.151 1.00 52.65 ? 145 SER D CB 1 ATOM 11043 O OG . SER D 1 86 ? -9.447 40.003 64.066 1.00 71.89 ? 145 SER D OG 1 ATOM 11044 N N . VAL D 1 87 ? -9.936 43.195 61.025 1.00 50.52 ? 146 VAL D N 1 ATOM 11045 C CA . VAL D 1 87 ? -9.536 44.369 60.260 1.00 57.45 ? 146 VAL D CA 1 ATOM 11046 C C . VAL D 1 87 ? -8.274 44.951 60.888 1.00 45.18 ? 146 VAL D C 1 ATOM 11047 O O . VAL D 1 87 ? -7.411 45.488 60.194 1.00 47.10 ? 146 VAL D O 1 ATOM 11048 C CB . VAL D 1 87 ? -10.649 45.430 60.189 1.00 64.20 ? 146 VAL D CB 1 ATOM 11049 C CG1 . VAL D 1 87 ? -11.757 44.973 59.250 1.00 46.52 ? 146 VAL D CG1 1 ATOM 11050 C CG2 . VAL D 1 87 ? -11.200 45.708 61.561 1.00 61.56 ? 146 VAL D CG2 1 ATOM 11051 N N . TYR D 1 88 ? -8.177 44.843 62.210 1.00 52.00 ? 147 TYR D N 1 ATOM 11052 C CA . TYR D 1 88 ? -6.996 45.304 62.926 1.00 39.49 ? 147 TYR D CA 1 ATOM 11053 C C . TYR D 1 88 ? -6.766 44.481 64.186 1.00 56.17 ? 147 TYR D C 1 ATOM 11054 O O . TYR D 1 88 ? -7.711 43.992 64.805 1.00 59.52 ? 147 TYR D O 1 ATOM 11055 C CB . TYR D 1 88 ? -7.137 46.786 63.297 1.00 39.21 ? 147 TYR D CB 1 ATOM 11056 C CG . TYR D 1 88 ? -8.142 47.058 64.404 1.00 48.40 ? 147 TYR D CG 1 ATOM 11057 C CD1 . TYR D 1 88 ? -9.491 47.223 64.118 1.00 49.74 ? 147 TYR D CD1 1 ATOM 11058 C CD2 . TYR D 1 88 ? -7.740 47.156 65.732 1.00 41.45 ? 147 TYR D CD2 1 ATOM 11059 C CE1 . TYR D 1 88 ? -10.413 47.470 65.120 1.00 39.91 ? 147 TYR D CE1 1 ATOM 11060 C CE2 . TYR D 1 88 ? -8.655 47.404 66.742 1.00 51.43 ? 147 TYR D CE2 1 ATOM 11061 C CZ . TYR D 1 88 ? -9.989 47.561 66.429 1.00 45.14 ? 147 TYR D CZ 1 ATOM 11062 O OH . TYR D 1 88 ? -10.902 47.809 67.428 1.00 55.16 ? 147 TYR D OH 1 ATOM 11063 N N . SER D 1 89 ? -5.501 44.333 64.561 1.00 62.27 ? 148 SER D N 1 ATOM 11064 C CA . SER D 1 89 ? -5.149 43.676 65.811 1.00 56.57 ? 148 SER D CA 1 ATOM 11065 C C . SER D 1 89 ? -4.062 44.445 66.551 1.00 67.76 ? 148 SER D C 1 ATOM 11066 O O . SER D 1 89 ? -3.042 43.874 66.920 1.00 81.62 ? 148 SER D O 1 ATOM 11067 C CB . SER D 1 89 ? -4.691 42.242 65.544 1.00 46.38 ? 148 SER D CB 1 ATOM 11068 O OG . SER D 1 89 ? -3.880 42.175 64.383 1.00 61.68 ? 148 SER D OG 1 ATOM 11069 N N . ASP D 1 90 ? -4.291 45.732 66.784 1.00 65.67 ? 149 ASP D N 1 ATOM 11070 C CA . ASP D 1 90 ? -3.298 46.582 67.434 1.00 60.64 ? 149 ASP D CA 1 ATOM 11071 C C . ASP D 1 90 ? -3.974 47.873 67.874 1.00 60.93 ? 149 ASP D C 1 ATOM 11072 O O . ASP D 1 90 ? -4.131 48.801 67.083 1.00 57.19 ? 149 ASP D O 1 ATOM 11073 C CB . ASP D 1 90 ? -2.121 46.874 66.497 1.00 61.04 ? 149 ASP D CB 1 ATOM 11074 C CG . ASP D 1 90 ? -0.985 47.610 67.192 1.00 68.44 ? 149 ASP D CG 1 ATOM 11075 O OD1 . ASP D 1 90 ? -1.050 47.783 68.427 1.00 58.89 ? 149 ASP D OD1 1 ATOM 11076 O OD2 . ASP D 1 90 ? -0.020 48.006 66.504 1.00 62.07 ? 149 ASP D OD2 1 ATOM 11077 N N . ASP D 1 91 ? -4.363 47.927 69.143 1.00 44.66 ? 150 ASP D N 1 ATOM 11078 C CA . ASP D 1 91 ? -5.147 49.043 69.657 1.00 57.68 ? 150 ASP D CA 1 ATOM 11079 C C . ASP D 1 91 ? -4.409 50.378 69.627 1.00 62.46 ? 150 ASP D C 1 ATOM 11080 O O . ASP D 1 91 ? -5.015 51.412 69.355 1.00 55.40 ? 150 ASP D O 1 ATOM 11081 C CB . ASP D 1 91 ? -5.600 48.743 71.087 1.00 49.46 ? 150 ASP D CB 1 ATOM 11082 C CG . ASP D 1 91 ? -6.605 47.609 71.153 1.00 60.90 ? 150 ASP D CG 1 ATOM 11083 O OD1 . ASP D 1 91 ? -7.112 47.200 70.087 1.00 55.28 ? 150 ASP D OD1 1 ATOM 11084 O OD2 . ASP D 1 91 ? -6.894 47.131 72.270 1.00 57.88 ? 150 ASP D OD2 1 ATOM 11085 N N . GLN D 1 92 ? -3.105 50.356 69.884 1.00 61.79 ? 151 GLN D N 1 ATOM 11086 C CA . GLN D 1 92 ? -2.339 51.596 69.993 1.00 55.49 ? 151 GLN D CA 1 ATOM 11087 C C . GLN D 1 92 ? -2.216 52.341 68.666 1.00 58.98 ? 151 GLN D C 1 ATOM 11088 O O . GLN D 1 92 ? -2.522 53.531 68.590 1.00 58.92 ? 151 GLN D O 1 ATOM 11089 C CB . GLN D 1 92 ? -0.944 51.318 70.554 1.00 57.05 ? 151 GLN D CB 1 ATOM 11090 C CG . GLN D 1 92 ? -0.121 52.577 70.786 1.00 55.20 ? 151 GLN D CG 1 ATOM 11091 C CD . GLN D 1 92 ? -0.873 53.624 71.589 1.00 67.04 ? 151 GLN D CD 1 ATOM 11092 O OE1 . GLN D 1 92 ? -1.005 54.772 71.164 1.00 73.55 ? 151 GLN D OE1 1 ATOM 11093 N NE2 . GLN D 1 92 ? -1.371 53.231 72.756 1.00 63.13 ? 151 GLN D NE2 1 HETATM 11094 N N . MSE D 1 93 ? -1.768 51.644 67.626 1.00 56.65 ? 152 MSE D N 1 HETATM 11095 C CA . MSE D 1 93 ? -1.562 52.281 66.328 1.00 55.23 ? 152 MSE D CA 1 HETATM 11096 C C . MSE D 1 93 ? -2.897 52.672 65.704 1.00 67.50 ? 152 MSE D C 1 HETATM 11097 O O . MSE D 1 93 ? -2.962 53.581 64.877 1.00 79.26 ? 152 MSE D O 1 HETATM 11098 C CB . MSE D 1 93 ? -0.772 51.361 65.388 1.00 36.63 ? 152 MSE D CB 1 HETATM 11099 C CG . MSE D 1 93 ? -1.595 50.311 64.653 1.00 110.63 ? 152 MSE D CG 1 HETATM 11100 SE SE . MSE D 1 93 ? -2.284 50.934 62.932 1.00 128.63 ? 152 MSE D SE 1 HETATM 11101 C CE . MSE D 1 93 ? -2.869 49.220 62.211 1.00 49.43 ? 152 MSE D CE 1 ATOM 11102 N N . ILE D 1 94 ? -3.960 51.983 66.107 1.00 65.81 ? 153 ILE D N 1 ATOM 11103 C CA . ILE D 1 94 ? -5.302 52.332 65.662 1.00 39.64 ? 153 ILE D CA 1 ATOM 11104 C C . ILE D 1 94 ? -5.760 53.581 66.407 1.00 50.72 ? 153 ILE D C 1 ATOM 11105 O O . ILE D 1 94 ? -6.314 54.503 65.808 1.00 53.84 ? 153 ILE D O 1 ATOM 11106 C CB . ILE D 1 94 ? -6.298 51.179 65.885 1.00 54.91 ? 153 ILE D CB 1 ATOM 11107 C CG1 . ILE D 1 94 ? -6.057 50.068 64.861 1.00 46.13 ? 153 ILE D CG1 1 ATOM 11108 C CG2 . ILE D 1 94 ? -7.731 51.679 65.790 1.00 51.75 ? 153 ILE D CG2 1 ATOM 11109 C CD1 . ILE D 1 94 ? -6.174 50.523 63.423 1.00 51.18 ? 153 ILE D CD1 1 ATOM 11110 N N . ASP D 1 95 ? -5.515 53.605 67.715 1.00 41.67 ? 154 ASP D N 1 ATOM 11111 C CA . ASP D 1 95 ? -5.767 54.794 68.528 1.00 58.78 ? 154 ASP D CA 1 ATOM 11112 C C . ASP D 1 95 ? -4.982 55.991 68.005 1.00 47.40 ? 154 ASP D C 1 ATOM 11113 O O . ASP D 1 95 ? -5.409 57.137 68.150 1.00 63.21 ? 154 ASP D O 1 ATOM 11114 C CB . ASP D 1 95 ? -5.426 54.532 69.996 1.00 44.97 ? 154 ASP D CB 1 ATOM 11115 C CG . ASP D 1 95 ? -6.471 53.677 70.690 1.00 64.59 ? 154 ASP D CG 1 ATOM 11116 O OD1 . ASP D 1 95 ? -7.246 52.997 69.985 1.00 61.25 ? 154 ASP D OD1 1 ATOM 11117 O OD2 . ASP D 1 95 ? -6.519 53.686 71.937 1.00 63.35 ? 154 ASP D OD2 1 ATOM 11118 N N . ASN D 1 96 ? -3.833 55.716 67.398 1.00 39.89 ? 155 ASN D N 1 ATOM 11119 C CA . ASN D 1 96 ? -3.052 56.755 66.745 1.00 49.32 ? 155 ASN D CA 1 ATOM 11120 C C . ASN D 1 96 ? -3.772 57.261 65.499 1.00 60.09 ? 155 ASN D C 1 ATOM 11121 O O . ASN D 1 96 ? -3.780 58.459 65.220 1.00 60.15 ? 155 ASN D O 1 ATOM 11122 C CB . ASN D 1 96 ? -1.659 56.239 66.380 1.00 39.66 ? 155 ASN D CB 1 ATOM 11123 C CG . ASN D 1 96 ? -0.822 55.904 67.599 1.00 55.29 ? 155 ASN D CG 1 ATOM 11124 O OD1 . ASN D 1 96 ? -1.052 56.428 68.689 1.00 50.35 ? 155 ASN D OD1 1 ATOM 11125 N ND2 . ASN D 1 96 ? 0.161 55.029 67.420 1.00 58.45 ? 155 ASN D ND2 1 ATOM 11126 N N . LEU D 1 97 ? -4.375 56.338 64.754 1.00 58.08 ? 156 LEU D N 1 ATOM 11127 C CA . LEU D 1 97 ? -5.147 56.694 63.568 1.00 52.74 ? 156 LEU D CA 1 ATOM 11128 C C . LEU D 1 97 ? -6.371 57.540 63.916 1.00 50.90 ? 156 LEU D C 1 ATOM 11129 O O . LEU D 1 97 ? -6.682 58.501 63.210 1.00 44.17 ? 156 LEU D O 1 ATOM 11130 C CB . LEU D 1 97 ? -5.577 55.433 62.815 1.00 52.21 ? 156 LEU D CB 1 ATOM 11131 C CG . LEU D 1 97 ? -6.484 55.641 61.601 1.00 53.75 ? 156 LEU D CG 1 ATOM 11132 C CD1 . LEU D 1 97 ? -5.806 56.547 60.584 1.00 50.20 ? 156 LEU D CD1 1 ATOM 11133 C CD2 . LEU D 1 97 ? -6.846 54.304 60.972 1.00 52.91 ? 156 LEU D CD2 1 ATOM 11134 N N . LEU D 1 98 ? -7.063 57.182 64.996 1.00 39.04 ? 157 LEU D N 1 ATOM 11135 C CA . LEU D 1 98 ? -8.200 57.974 65.470 1.00 37.06 ? 157 LEU D CA 1 ATOM 11136 C C . LEU D 1 98 ? -7.781 59.399 65.809 1.00 42.59 ? 157 LEU D C 1 ATOM 11137 O O . LEU D 1 98 ? -8.456 60.355 65.423 1.00 45.97 ? 157 LEU D O 1 ATOM 11138 C CB . LEU D 1 98 ? -8.886 57.324 66.683 1.00 45.41 ? 157 LEU D CB 1 ATOM 11139 C CG . LEU D 1 98 ? -9.646 55.993 66.552 1.00 44.04 ? 157 LEU D CG 1 ATOM 11140 C CD1 . LEU D 1 98 ? -9.756 55.526 65.105 1.00 49.99 ? 157 LEU D CD1 1 ATOM 11141 C CD2 . LEU D 1 98 ? -9.086 54.893 67.444 1.00 42.14 ? 157 LEU D CD2 1 ATOM 11142 N N . HIS D 1 99 ? -6.678 59.538 66.539 1.00 45.25 ? 158 HIS D N 1 ATOM 11143 C CA . HIS D 1 99 ? -6.149 60.857 66.863 1.00 38.68 ? 158 HIS D CA 1 ATOM 11144 C C . HIS D 1 99 ? -5.852 61.637 65.586 1.00 45.85 ? 158 HIS D C 1 ATOM 11145 O O . HIS D 1 99 ? -6.092 62.841 65.515 1.00 41.59 ? 158 HIS D O 1 ATOM 11146 C CB . HIS D 1 99 ? -4.887 60.753 67.720 1.00 46.27 ? 158 HIS D CB 1 ATOM 11147 C CG . HIS D 1 99 ? -4.221 62.071 67.965 1.00 57.55 ? 158 HIS D CG 1 ATOM 11148 N ND1 . HIS D 1 99 ? -3.197 62.547 67.174 1.00 57.66 ? 158 HIS D ND1 1 ATOM 11149 C CD2 . HIS D 1 99 ? -4.445 63.021 68.903 1.00 59.70 ? 158 HIS D CD2 1 ATOM 11150 C CE1 . HIS D 1 99 ? -2.813 63.730 67.620 1.00 57.08 ? 158 HIS D CE1 1 ATOM 11151 N NE2 . HIS D 1 99 ? -3.554 64.041 68.669 1.00 64.84 ? 158 HIS D NE2 1 ATOM 11152 N N . ASP D 1 100 ? -5.331 60.942 64.581 1.00 35.80 ? 159 ASP D N 1 ATOM 11153 C CA . ASP D 1 100 ? -5.040 61.569 63.300 1.00 35.63 ? 159 ASP D CA 1 ATOM 11154 C C . ASP D 1 100 ? -6.332 61.964 62.597 1.00 38.71 ? 159 ASP D C 1 ATOM 11155 O O . ASP D 1 100 ? -6.415 63.030 61.995 1.00 49.92 ? 159 ASP D O 1 ATOM 11156 C CB . ASP D 1 100 ? -4.216 60.634 62.413 1.00 54.86 ? 159 ASP D CB 1 ATOM 11157 C CG . ASP D 1 100 ? -2.800 60.455 62.918 1.00 60.15 ? 159 ASP D CG 1 ATOM 11158 O OD1 . ASP D 1 100 ? -2.511 60.900 64.049 1.00 65.68 ? 159 ASP D OD1 1 ATOM 11159 O OD2 . ASP D 1 100 ? -1.975 59.869 62.187 1.00 56.36 ? 159 ASP D OD2 1 ATOM 11160 N N . LEU D 1 101 ? -7.343 61.106 62.689 1.00 56.74 ? 160 LEU D N 1 ATOM 11161 C CA . LEU D 1 101 ? -8.645 61.399 62.101 1.00 43.49 ? 160 LEU D CA 1 ATOM 11162 C C . LEU D 1 101 ? -9.268 62.622 62.769 1.00 53.93 ? 160 LEU D C 1 ATOM 11163 O O . LEU D 1 101 ? -9.975 63.400 62.130 1.00 37.21 ? 160 LEU D O 1 ATOM 11164 C CB . LEU D 1 101 ? -9.579 60.194 62.225 1.00 36.99 ? 160 LEU D CB 1 ATOM 11165 C CG . LEU D 1 101 ? -9.325 59.007 61.295 1.00 42.12 ? 160 LEU D CG 1 ATOM 11166 C CD1 . LEU D 1 101 ? -10.192 57.824 61.697 1.00 37.66 ? 160 LEU D CD1 1 ATOM 11167 C CD2 . LEU D 1 101 ? -9.581 59.396 59.847 1.00 37.22 ? 160 LEU D CD2 1 ATOM 11168 N N . ASN D 1 102 ? -8.997 62.778 64.060 1.00 41.97 ? 161 ASN D N 1 ATOM 11169 C CA . ASN D 1 102 ? -9.505 63.905 64.831 1.00 38.49 ? 161 ASN D CA 1 ATOM 11170 C C . ASN D 1 102 ? -8.755 65.216 64.588 1.00 42.00 ? 161 ASN D C 1 ATOM 11171 O O . ASN D 1 102 ? -9.353 66.291 64.619 1.00 47.84 ? 161 ASN D O 1 ATOM 11172 C CB . ASN D 1 102 ? -9.471 63.570 66.326 1.00 36.13 ? 161 ASN D CB 1 ATOM 11173 C CG . ASN D 1 102 ? -9.885 64.741 67.197 1.00 44.25 ? 161 ASN D CG 1 ATOM 11174 O OD1 . ASN D 1 102 ? -9.048 65.525 67.642 1.00 53.87 ? 161 ASN D OD1 1 ATOM 11175 N ND2 . ASN D 1 102 ? -11.185 64.865 67.443 1.00 36.20 ? 161 ASN D ND2 1 ATOM 11176 N N . THR D 1 103 ? -7.451 65.127 64.342 1.00 39.62 ? 162 THR D N 1 ATOM 11177 C CA . THR D 1 103 ? -6.601 66.316 64.345 1.00 42.66 ? 162 THR D CA 1 ATOM 11178 C C . THR D 1 103 ? -6.076 66.752 62.976 1.00 36.05 ? 162 THR D C 1 ATOM 11179 O O . THR D 1 103 ? -5.704 67.913 62.803 1.00 39.15 ? 162 THR D O 1 ATOM 11180 C CB . THR D 1 103 ? -5.384 66.115 65.270 1.00 43.07 ? 162 THR D CB 1 ATOM 11181 O OG1 . THR D 1 103 ? -4.598 65.013 64.798 1.00 45.83 ? 162 THR D OG1 1 ATOM 11182 C CG2 . THR D 1 103 ? -5.839 65.834 66.694 1.00 34.84 ? 162 THR D CG2 1 ATOM 11183 N N . SER D 1 104 ? -6.032 65.834 62.012 1.00 37.36 ? 163 SER D N 1 ATOM 11184 C CA . SER D 1 104 ? -5.476 66.153 60.697 1.00 37.42 ? 163 SER D CA 1 ATOM 11185 C C . SER D 1 104 ? -6.230 67.290 60.017 1.00 47.00 ? 163 SER D C 1 ATOM 11186 O O . SER D 1 104 ? -7.460 67.323 60.033 1.00 55.15 ? 163 SER D O 1 ATOM 11187 C CB . SER D 1 104 ? -5.481 64.922 59.788 1.00 35.13 ? 163 SER D CB 1 ATOM 11188 O OG . SER D 1 104 ? -4.792 63.841 60.387 1.00 57.85 ? 163 SER D OG 1 ATOM 11189 N N . PRO D 1 105 ? -5.484 68.230 59.418 1.00 53.59 ? 164 PRO D N 1 ATOM 11190 C CA . PRO D 1 105 ? -6.071 69.364 58.698 1.00 55.41 ? 164 PRO D CA 1 ATOM 11191 C C . PRO D 1 105 ? -6.831 68.910 57.456 1.00 45.14 ? 164 PRO D C 1 ATOM 11192 O O . PRO D 1 105 ? -6.372 68.015 56.746 1.00 38.37 ? 164 PRO D O 1 ATOM 11193 C CB . PRO D 1 105 ? -4.852 70.213 58.323 1.00 48.97 ? 164 PRO D CB 1 ATOM 11194 C CG . PRO D 1 105 ? -3.709 69.259 58.328 1.00 52.98 ? 164 PRO D CG 1 ATOM 11195 C CD . PRO D 1 105 ? -4.012 68.272 59.411 1.00 50.21 ? 164 PRO D CD 1 ATOM 11196 N N . ILE D 1 106 ? -7.978 69.530 57.202 1.00 37.03 ? 165 ILE D N 1 ATOM 11197 C CA . ILE D 1 106 ? -8.826 69.152 56.079 1.00 35.07 ? 165 ILE D CA 1 ATOM 11198 C C . ILE D 1 106 ? -8.534 69.991 54.837 1.00 37.77 ? 165 ILE D C 1 ATOM 11199 O O . ILE D 1 106 ? -8.506 71.221 54.893 1.00 44.49 ? 165 ILE D O 1 ATOM 11200 C CB . ILE D 1 106 ? -10.318 69.274 56.449 1.00 55.65 ? 165 ILE D CB 1 ATOM 11201 C CG1 . ILE D 1 106 ? -10.666 68.279 57.556 1.00 43.93 ? 165 ILE D CG1 1 ATOM 11202 C CG2 . ILE D 1 106 ? -11.196 69.032 55.233 1.00 54.09 ? 165 ILE D CG2 1 ATOM 11203 C CD1 . ILE D 1 106 ? -11.784 68.739 58.458 1.00 50.31 ? 165 ILE D CD1 1 ATOM 11204 N N . LYS D 1 107 ? -8.321 69.306 53.717 1.00 35.01 ? 166 LYS D N 1 ATOM 11205 C CA . LYS D 1 107 ? -8.007 69.944 52.443 1.00 41.98 ? 166 LYS D CA 1 ATOM 11206 C C . LYS D 1 107 ? -9.279 70.186 51.629 1.00 38.83 ? 166 LYS D C 1 ATOM 11207 O O . LYS D 1 107 ? -9.514 71.294 51.145 1.00 51.04 ? 166 LYS D O 1 ATOM 11208 C CB . LYS D 1 107 ? -7.019 69.075 51.663 1.00 57.21 ? 166 LYS D CB 1 ATOM 11209 C CG . LYS D 1 107 ? -6.551 69.613 50.322 1.00 63.58 ? 166 LYS D CG 1 ATOM 11210 C CD . LYS D 1 107 ? -5.790 68.521 49.573 1.00 69.55 ? 166 LYS D CD 1 ATOM 11211 C CE . LYS D 1 107 ? -5.729 68.771 48.075 1.00 73.24 ? 166 LYS D CE 1 ATOM 11212 N NZ . LYS D 1 107 ? -4.994 70.016 47.730 1.00 73.25 ? 166 LYS D NZ 1 ATOM 11213 N N . HIS D 1 108 ? -10.093 69.145 51.478 1.00 37.22 ? 167 HIS D N 1 ATOM 11214 C CA . HIS D 1 108 ? -11.351 69.249 50.740 1.00 35.77 ? 167 HIS D CA 1 ATOM 11215 C C . HIS D 1 108 ? -12.516 68.567 51.453 1.00 45.58 ? 167 HIS D C 1 ATOM 11216 O O . HIS D 1 108 ? -12.338 67.567 52.149 1.00 47.52 ? 167 HIS D O 1 ATOM 11217 C CB . HIS D 1 108 ? -11.203 68.669 49.332 1.00 45.43 ? 167 HIS D CB 1 ATOM 11218 C CG . HIS D 1 108 ? -10.251 69.428 48.462 1.00 70.71 ? 167 HIS D CG 1 ATOM 11219 N ND1 . HIS D 1 108 ? -10.376 70.782 48.230 1.00 80.03 ? 167 HIS D ND1 1 ATOM 11220 C CD2 . HIS D 1 108 ? -9.170 69.024 47.754 1.00 73.41 ? 167 HIS D CD2 1 ATOM 11221 C CE1 . HIS D 1 108 ? -9.407 71.180 47.425 1.00 81.62 ? 167 HIS D CE1 1 ATOM 11222 N NE2 . HIS D 1 108 ? -8.662 70.132 47.121 1.00 75.49 ? 167 HIS D NE2 1 ATOM 11223 N N . VAL D 1 109 ? -13.712 69.119 51.268 1.00 47.10 ? 168 VAL D N 1 ATOM 11224 C CA . VAL D 1 109 ? -14.943 68.478 51.718 1.00 41.71 ? 168 VAL D CA 1 ATOM 11225 C C . VAL D 1 109 ? -15.912 68.311 50.551 1.00 37.00 ? 168 VAL D C 1 ATOM 11226 O O . VAL D 1 109 ? -16.307 69.292 49.921 1.00 45.67 ? 168 VAL D O 1 ATOM 11227 C CB . VAL D 1 109 ? -15.632 69.284 52.837 1.00 42.83 ? 168 VAL D CB 1 ATOM 11228 C CG1 . VAL D 1 109 ? -16.914 68.594 53.277 1.00 39.22 ? 168 VAL D CG1 1 ATOM 11229 C CG2 . VAL D 1 109 ? -14.691 69.468 54.017 1.00 36.34 ? 168 VAL D CG2 1 ATOM 11230 N N . HIS D 1 110 ? -16.288 67.069 50.264 1.00 38.41 ? 169 HIS D N 1 ATOM 11231 C CA . HIS D 1 110 ? -17.199 66.779 49.159 1.00 46.09 ? 169 HIS D CA 1 ATOM 11232 C C . HIS D 1 110 ? -18.422 65.989 49.610 1.00 46.29 ? 169 HIS D C 1 ATOM 11233 O O . HIS D 1 110 ? -18.370 65.245 50.589 1.00 43.78 ? 169 HIS D O 1 ATOM 11234 C CB . HIS D 1 110 ? -16.477 66.003 48.054 1.00 48.17 ? 169 HIS D CB 1 ATOM 11235 C CG . HIS D 1 110 ? -15.467 66.813 47.302 1.00 61.87 ? 169 HIS D CG 1 ATOM 11236 N ND1 . HIS D 1 110 ? -14.197 67.051 47.781 1.00 58.43 ? 169 HIS D ND1 1 ATOM 11237 C CD2 . HIS D 1 110 ? -15.536 67.427 46.097 1.00 57.06 ? 169 HIS D CD2 1 ATOM 11238 C CE1 . HIS D 1 110 ? -13.530 67.784 46.908 1.00 59.92 ? 169 HIS D CE1 1 ATOM 11239 N NE2 . HIS D 1 110 ? -14.319 68.026 45.877 1.00 65.35 ? 169 HIS D NE2 1 ATOM 11240 N N . ILE D 1 111 ? -19.523 66.158 48.885 1.00 43.36 ? 170 ILE D N 1 ATOM 11241 C CA . ILE D 1 111 ? -20.724 65.370 49.122 1.00 50.33 ? 170 ILE D CA 1 ATOM 11242 C C . ILE D 1 111 ? -20.538 63.962 48.567 1.00 51.91 ? 170 ILE D C 1 ATOM 11243 O O . ILE D 1 111 ? -20.287 63.787 47.376 1.00 57.92 ? 170 ILE D O 1 ATOM 11244 C CB . ILE D 1 111 ? -21.966 66.012 48.478 1.00 39.04 ? 170 ILE D CB 1 ATOM 11245 C CG1 . ILE D 1 111 ? -22.253 67.374 49.112 1.00 38.76 ? 170 ILE D CG1 1 ATOM 11246 C CG2 . ILE D 1 111 ? -23.170 65.092 48.611 1.00 39.56 ? 170 ILE D CG2 1 ATOM 11247 C CD1 . ILE D 1 111 ? -23.423 68.097 48.488 1.00 48.06 ? 170 ILE D CD1 1 HETATM 11248 N N . MSE D 1 112 ? -20.659 62.963 49.434 1.00 69.96 ? 171 MSE D N 1 HETATM 11249 C CA . MSE D 1 112 ? -20.482 61.575 49.027 1.00 58.92 ? 171 MSE D CA 1 HETATM 11250 C C . MSE D 1 112 ? -21.693 61.069 48.250 1.00 55.51 ? 171 MSE D C 1 HETATM 11251 O O . MSE D 1 112 ? -22.828 61.165 48.716 1.00 63.83 ? 171 MSE D O 1 HETATM 11252 C CB . MSE D 1 112 ? -20.226 60.693 50.249 1.00 65.84 ? 171 MSE D CB 1 HETATM 11253 C CG . MSE D 1 112 ? -19.975 59.233 49.928 1.00 91.80 ? 171 MSE D CG 1 HETATM 11254 SE SE . MSE D 1 112 ? -18.770 58.417 51.222 1.00 130.45 ? 171 MSE D SE 1 HETATM 11255 C CE . MSE D 1 112 ? -19.163 59.560 52.749 1.00 67.89 ? 171 MSE D CE 1 ATOM 11256 N N . ASP D 1 113 ? -21.440 60.526 47.063 1.00 87.16 ? 172 ASP D N 1 ATOM 11257 C CA . ASP D 1 113 ? -22.506 60.094 46.163 1.00 100.41 ? 172 ASP D CA 1 ATOM 11258 C C . ASP D 1 113 ? -23.142 58.772 46.582 1.00 107.32 ? 172 ASP D C 1 ATOM 11259 O O . ASP D 1 113 ? -24.191 58.392 46.063 1.00 108.48 ? 172 ASP D O 1 ATOM 11260 C CB . ASP D 1 113 ? -21.971 59.964 44.735 1.00 102.12 ? 172 ASP D CB 1 ATOM 11261 C CG . ASP D 1 113 ? -21.584 61.298 44.132 1.00 113.76 ? 172 ASP D CG 1 ATOM 11262 O OD1 . ASP D 1 113 ? -21.937 62.343 44.717 1.00 122.33 ? 172 ASP D OD1 1 ATOM 11263 O OD2 . ASP D 1 113 ? -20.926 61.300 43.070 1.00 109.16 ? 172 ASP D OD2 1 ATOM 11264 N N . GLY D 1 114 ? -22.511 58.075 47.519 1.00 96.45 ? 173 GLY D N 1 ATOM 11265 C CA . GLY D 1 114 ? -22.938 56.732 47.861 1.00 103.88 ? 173 GLY D CA 1 ATOM 11266 C C . GLY D 1 114 ? -23.775 56.608 49.118 1.00 98.96 ? 173 GLY D C 1 ATOM 11267 O O . GLY D 1 114 ? -23.250 56.318 50.193 1.00 118.36 ? 173 GLY D O 1 ATOM 11268 N N . GLY D 1 115 ? -25.082 56.820 48.989 1.00 74.64 ? 174 GLY D N 1 ATOM 11269 C CA . GLY D 1 115 ? -25.973 56.634 50.117 1.00 85.41 ? 174 GLY D CA 1 ATOM 11270 C C . GLY D 1 115 ? -27.313 57.345 50.083 1.00 90.49 ? 174 GLY D C 1 ATOM 11271 O O . GLY D 1 115 ? -27.860 57.658 49.024 1.00 90.81 ? 174 GLY D O 1 ATOM 11272 N N . THR D 1 116 ? -27.829 57.601 51.280 1.00 63.14 ? 175 THR D N 1 ATOM 11273 C CA . THR D 1 116 ? -29.159 58.153 51.491 1.00 60.63 ? 175 THR D CA 1 ATOM 11274 C C . THR D 1 116 ? -29.080 59.431 52.315 1.00 56.46 ? 175 THR D C 1 ATOM 11275 O O . THR D 1 116 ? -29.406 60.512 51.837 1.00 59.34 ? 175 THR D O 1 ATOM 11276 C CB . THR D 1 116 ? -30.097 57.152 52.190 1.00 70.50 ? 175 THR D CB 1 ATOM 11277 O OG1 . THR D 1 116 ? -29.466 56.644 53.372 1.00 82.43 ? 175 THR D OG1 1 ATOM 11278 C CG2 . THR D 1 116 ? -30.429 55.995 51.260 1.00 69.20 ? 175 THR D CG2 1 ATOM 11279 N N . GLN D 1 117 ? -28.670 59.285 53.570 1.00 50.78 ? 176 GLN D N 1 ATOM 11280 C CA . GLN D 1 117 ? -28.596 60.403 54.500 1.00 41.96 ? 176 GLN D CA 1 ATOM 11281 C C . GLN D 1 117 ? -27.280 61.168 54.370 1.00 41.42 ? 176 GLN D C 1 ATOM 11282 O O . GLN D 1 117 ? -26.332 60.695 53.744 1.00 59.70 ? 176 GLN D O 1 ATOM 11283 C CB . GLN D 1 117 ? -28.770 59.893 55.932 1.00 42.10 ? 176 GLN D CB 1 ATOM 11284 C CG . GLN D 1 117 ? -30.172 59.393 56.233 1.00 42.61 ? 176 GLN D CG 1 ATOM 11285 C CD . GLN D 1 117 ? -30.305 58.797 57.621 1.00 49.76 ? 176 GLN D CD 1 ATOM 11286 O OE1 . GLN D 1 117 ? -30.036 59.457 58.623 1.00 55.02 ? 176 GLN D OE1 1 ATOM 11287 N NE2 . GLN D 1 117 ? -30.730 57.540 57.685 1.00 52.99 ? 176 GLN D NE2 1 ATOM 11288 N N . VAL D 1 118 ? -27.244 62.355 54.970 1.00 41.08 ? 177 VAL D N 1 ATOM 11289 C CA . VAL D 1 118 ? -26.130 63.293 54.832 1.00 40.55 ? 177 VAL D CA 1 ATOM 11290 C C . VAL D 1 118 ? -24.763 62.714 55.211 1.00 41.73 ? 177 VAL D C 1 ATOM 11291 O O . VAL D 1 118 ? -24.572 62.183 56.305 1.00 40.38 ? 177 VAL D O 1 ATOM 11292 C CB . VAL D 1 118 ? -26.386 64.571 55.672 1.00 41.75 ? 177 VAL D CB 1 ATOM 11293 C CG1 . VAL D 1 118 ? -26.730 64.221 57.119 1.00 40.39 ? 177 VAL D CG1 1 ATOM 11294 C CG2 . VAL D 1 118 ? -25.195 65.519 55.593 1.00 39.72 ? 177 VAL D CG2 1 ATOM 11295 N N . LYS D 1 119 ? -23.818 62.824 54.282 1.00 44.95 ? 178 LYS D N 1 ATOM 11296 C CA . LYS D 1 119 ? -22.445 62.385 54.508 1.00 39.84 ? 178 LYS D CA 1 ATOM 11297 C C . LYS D 1 119 ? -21.460 63.217 53.697 1.00 39.42 ? 178 LYS D C 1 ATOM 11298 O O . LYS D 1 119 ? -21.728 63.572 52.550 1.00 57.24 ? 178 LYS D O 1 ATOM 11299 C CB . LYS D 1 119 ? -22.264 60.915 54.123 1.00 40.17 ? 178 LYS D CB 1 ATOM 11300 C CG . LYS D 1 119 ? -22.753 59.890 55.123 1.00 51.63 ? 178 LYS D CG 1 ATOM 11301 C CD . LYS D 1 119 ? -22.329 58.498 54.675 1.00 62.02 ? 178 LYS D CD 1 ATOM 11302 C CE . LYS D 1 119 ? -22.792 58.213 53.255 1.00 71.15 ? 178 LYS D CE 1 ATOM 11303 N NZ . LYS D 1 119 ? -22.150 56.995 52.688 1.00 67.34 ? 178 LYS D NZ 1 ATOM 11304 N N . PHE D 1 120 ? -20.320 63.528 54.302 1.00 39.04 ? 179 PHE D N 1 ATOM 11305 C CA . PHE D 1 120 ? -19.256 64.243 53.609 1.00 38.63 ? 179 PHE D CA 1 ATOM 11306 C C . PHE D 1 120 ? -18.070 63.320 53.378 1.00 42.25 ? 179 PHE D C 1 ATOM 11307 O O . PHE D 1 120 ? -17.859 62.368 54.130 1.00 38.71 ? 179 PHE D O 1 ATOM 11308 C CB . PHE D 1 120 ? -18.806 65.479 54.394 1.00 38.20 ? 179 PHE D CB 1 ATOM 11309 C CG . PHE D 1 120 ? -19.843 66.562 54.480 1.00 43.88 ? 179 PHE D CG 1 ATOM 11310 C CD1 . PHE D 1 120 ? -20.900 66.602 53.586 1.00 38.46 ? 179 PHE D CD1 1 ATOM 11311 C CD2 . PHE D 1 120 ? -19.748 67.554 55.442 1.00 37.89 ? 179 PHE D CD2 1 ATOM 11312 C CE1 . PHE D 1 120 ? -21.850 67.601 53.660 1.00 38.79 ? 179 PHE D CE1 1 ATOM 11313 C CE2 . PHE D 1 120 ? -20.695 68.557 55.520 1.00 37.87 ? 179 PHE D CE2 1 ATOM 11314 C CZ . PHE D 1 120 ? -21.746 68.580 54.626 1.00 38.14 ? 179 PHE D CZ 1 ATOM 11315 N N . VAL D 1 121 ? -17.299 63.598 52.333 1.00 38.35 ? 180 VAL D N 1 ATOM 11316 C CA . VAL D 1 121 ? -15.991 62.977 52.187 1.00 49.60 ? 180 VAL D CA 1 ATOM 11317 C C . VAL D 1 121 ? -14.918 63.982 52.571 1.00 37.68 ? 180 VAL D C 1 ATOM 11318 O O . VAL D 1 121 ? -14.798 65.039 51.952 1.00 46.24 ? 180 VAL D O 1 ATOM 11319 C CB . VAL D 1 121 ? -15.739 62.477 50.751 1.00 44.19 ? 180 VAL D CB 1 ATOM 11320 C CG1 . VAL D 1 121 ? -14.278 62.086 50.571 1.00 38.02 ? 180 VAL D CG1 1 ATOM 11321 C CG2 . VAL D 1 121 ? -16.651 61.306 50.431 1.00 40.49 ? 180 VAL D CG2 1 ATOM 11322 N N . PHE D 1 122 ? -14.145 63.657 53.600 1.00 42.17 ? 181 PHE D N 1 ATOM 11323 C CA . PHE D 1 122 ? -13.034 64.510 53.994 1.00 39.17 ? 181 PHE D CA 1 ATOM 11324 C C . PHE D 1 122 ? -11.777 64.112 53.238 1.00 53.43 ? 181 PHE D C 1 ATOM 11325 O O . PHE D 1 122 ? -11.359 62.960 53.285 1.00 45.71 ? 181 PHE D O 1 ATOM 11326 C CB . PHE D 1 122 ? -12.788 64.432 55.502 1.00 40.15 ? 181 PHE D CB 1 ATOM 11327 C CG . PHE D 1 122 ? -13.754 65.241 56.319 1.00 37.01 ? 181 PHE D CG 1 ATOM 11328 C CD1 . PHE D 1 122 ? -14.666 66.083 55.705 1.00 38.30 ? 181 PHE D CD1 1 ATOM 11329 C CD2 . PHE D 1 122 ? -13.738 65.172 57.703 1.00 36.98 ? 181 PHE D CD2 1 ATOM 11330 C CE1 . PHE D 1 122 ? -15.552 66.832 56.453 1.00 47.18 ? 181 PHE D CE1 1 ATOM 11331 C CE2 . PHE D 1 122 ? -14.621 65.921 58.457 1.00 42.90 ? 181 PHE D CE2 1 ATOM 11332 C CZ . PHE D 1 122 ? -15.529 66.752 57.830 1.00 37.03 ? 181 PHE D CZ 1 ATOM 11333 N N . THR D 1 123 ? -11.182 65.069 52.539 1.00 57.83 ? 182 THR D N 1 ATOM 11334 C CA . THR D 1 123 ? -9.866 64.867 51.954 1.00 50.42 ? 182 THR D CA 1 ATOM 11335 C C . THR D 1 123 ? -8.862 65.670 52.763 1.00 53.49 ? 182 THR D C 1 ATOM 11336 O O . THR D 1 123 ? -8.928 66.896 52.796 1.00 53.37 ? 182 THR D O 1 ATOM 11337 C CB . THR D 1 123 ? -9.815 65.290 50.474 1.00 46.73 ? 182 THR D CB 1 ATOM 11338 O OG1 . THR D 1 123 ? -10.691 64.455 49.708 1.00 54.79 ? 182 THR D OG1 1 ATOM 11339 C CG2 . THR D 1 123 ? -8.400 65.163 49.934 1.00 40.16 ? 182 THR D CG2 1 ATOM 11340 N N . PHE D 1 124 ? -7.953 64.977 53.439 1.00 49.39 ? 183 PHE D N 1 ATOM 11341 C CA . PHE D 1 124 ? -6.989 65.640 54.308 1.00 41.83 ? 183 PHE D CA 1 ATOM 11342 C C . PHE D 1 124 ? -5.788 66.150 53.523 1.00 54.03 ? 183 PHE D C 1 ATOM 11343 O O . PHE D 1 124 ? -5.652 65.872 52.331 1.00 55.32 ? 183 PHE D O 1 ATOM 11344 C CB . PHE D 1 124 ? -6.531 64.696 55.420 1.00 35.53 ? 183 PHE D CB 1 ATOM 11345 C CG . PHE D 1 124 ? -7.644 64.233 56.314 1.00 53.39 ? 183 PHE D CG 1 ATOM 11346 C CD1 . PHE D 1 124 ? -8.167 65.074 57.282 1.00 40.48 ? 183 PHE D CD1 1 ATOM 11347 C CD2 . PHE D 1 124 ? -8.167 62.957 56.190 1.00 43.31 ? 183 PHE D CD2 1 ATOM 11348 C CE1 . PHE D 1 124 ? -9.190 64.654 58.107 1.00 44.54 ? 183 PHE D CE1 1 ATOM 11349 C CE2 . PHE D 1 124 ? -9.190 62.530 57.013 1.00 36.53 ? 183 PHE D CE2 1 ATOM 11350 C CZ . PHE D 1 124 ? -9.703 63.380 57.973 1.00 36.44 ? 183 PHE D CZ 1 ATOM 11351 N N . LYS D 1 125 ? -4.932 66.912 54.198 1.00 56.22 ? 184 LYS D N 1 ATOM 11352 C CA . LYS D 1 125 ? -3.734 67.476 53.583 1.00 52.82 ? 184 LYS D CA 1 ATOM 11353 C C . LYS D 1 125 ? -2.835 66.387 53.002 1.00 49.58 ? 184 LYS D C 1 ATOM 11354 O O . LYS D 1 125 ? -2.250 66.561 51.934 1.00 44.85 ? 184 LYS D O 1 ATOM 11355 C CB . LYS D 1 125 ? -2.954 68.310 54.599 1.00 60.81 ? 184 LYS D CB 1 ATOM 11356 C CG . LYS D 1 125 ? -3.473 69.731 54.775 1.00 64.25 ? 184 LYS D CG 1 ATOM 11357 C CD . LYS D 1 125 ? -3.502 70.493 53.461 1.00 66.20 ? 184 LYS D CD 1 ATOM 11358 C CE . LYS D 1 125 ? -3.771 71.972 53.696 1.00 67.49 ? 184 LYS D CE 1 ATOM 11359 N NZ . LYS D 1 125 ? -5.018 72.202 54.479 1.00 63.44 ? 184 LYS D NZ 1 ATOM 11360 N N . ASN D 1 126 ? -2.732 65.263 53.706 1.00 34.65 ? 185 ASN D N 1 ATOM 11361 C CA . ASN D 1 126 ? -1.961 64.121 53.224 1.00 44.42 ? 185 ASN D CA 1 ATOM 11362 C C . ASN D 1 126 ? -2.663 63.352 52.103 1.00 46.52 ? 185 ASN D C 1 ATOM 11363 O O . ASN D 1 126 ? -2.229 62.264 51.723 1.00 58.25 ? 185 ASN D O 1 ATOM 11364 C CB . ASN D 1 126 ? -1.633 63.174 54.385 1.00 38.16 ? 185 ASN D CB 1 ATOM 11365 C CG . ASN D 1 126 ? -2.875 62.635 55.077 1.00 56.53 ? 185 ASN D CG 1 ATOM 11366 O OD1 . ASN D 1 126 ? -4.000 62.853 54.629 1.00 47.95 ? 185 ASN D OD1 1 ATOM 11367 N ND2 . ASN D 1 126 ? -2.671 61.927 56.181 1.00 46.22 ? 185 ASN D ND2 1 ATOM 11368 N N . ASP D 1 127 ? -3.761 63.920 51.606 1.00 45.15 ? 186 ASP D N 1 ATOM 11369 C CA . ASP D 1 127 ? -4.566 63.349 50.522 1.00 48.81 ? 186 ASP D CA 1 ATOM 11370 C C . ASP D 1 127 ? -5.247 62.028 50.886 1.00 55.29 ? 186 ASP D C 1 ATOM 11371 O O . ASP D 1 127 ? -5.874 61.398 50.034 1.00 53.21 ? 186 ASP D O 1 ATOM 11372 C CB . ASP D 1 127 ? -3.716 63.158 49.263 1.00 44.24 ? 186 ASP D CB 1 ATOM 11373 C CG . ASP D 1 127 ? -3.423 64.466 48.557 1.00 70.60 ? 186 ASP D CG 1 ATOM 11374 O OD1 . ASP D 1 127 ? -4.303 65.354 48.559 1.00 51.13 ? 186 ASP D OD1 1 ATOM 11375 O OD2 . ASP D 1 127 ? -2.315 64.608 47.998 1.00 84.73 ? 186 ASP D OD2 1 ATOM 11376 N N . LYS D 1 128 ? -5.124 61.607 52.140 1.00 44.41 ? 187 LYS D N 1 ATOM 11377 C CA . LYS D 1 128 ? -5.916 60.485 52.629 1.00 52.88 ? 187 LYS D CA 1 ATOM 11378 C C . LYS D 1 128 ? -7.334 60.956 52.919 1.00 59.20 ? 187 LYS D C 1 ATOM 11379 O O . LYS D 1 128 ? -7.595 62.158 52.963 1.00 51.96 ? 187 LYS D O 1 ATOM 11380 C CB . LYS D 1 128 ? -5.270 59.858 53.862 1.00 51.07 ? 187 LYS D CB 1 ATOM 11381 C CG . LYS D 1 128 ? -3.988 59.130 53.522 1.00 43.62 ? 187 LYS D CG 1 ATOM 11382 C CD . LYS D 1 128 ? -4.265 58.053 52.482 1.00 50.26 ? 187 LYS D CD 1 ATOM 11383 C CE . LYS D 1 128 ? -3.022 57.247 52.174 1.00 58.57 ? 187 LYS D CE 1 ATOM 11384 N NZ . LYS D 1 128 ? -2.163 57.110 53.374 1.00 68.72 ? 187 LYS D NZ 1 ATOM 11385 N N . GLN D 1 129 ? -8.250 60.015 53.119 1.00 54.42 ? 188 GLN D N 1 ATOM 11386 C CA . GLN D 1 129 ? -9.663 60.367 53.187 1.00 39.63 ? 188 GLN D CA 1 ATOM 11387 C C . GLN D 1 129 ? -10.417 59.713 54.340 1.00 53.69 ? 188 GLN D C 1 ATOM 11388 O O . GLN D 1 129 ? -9.958 58.734 54.930 1.00 47.23 ? 188 GLN D O 1 ATOM 11389 C CB . GLN D 1 129 ? -10.345 60.011 51.865 1.00 41.59 ? 188 GLN D CB 1 ATOM 11390 C CG . GLN D 1 129 ? -9.853 60.832 50.683 1.00 37.24 ? 188 GLN D CG 1 ATOM 11391 C CD . GLN D 1 129 ? -10.606 60.527 49.406 1.00 37.52 ? 188 GLN D CD 1 ATOM 11392 O OE1 . GLN D 1 129 ? -10.723 59.370 49.002 1.00 46.57 ? 188 GLN D OE1 1 ATOM 11393 N NE2 . GLN D 1 129 ? -11.122 61.566 48.762 1.00 37.44 ? 188 GLN D NE2 1 ATOM 11394 N N . ALA D 1 130 ? -11.584 60.273 54.651 1.00 58.60 ? 189 ALA D N 1 ATOM 11395 C CA . ALA D 1 130 ? -12.428 59.768 55.725 1.00 49.27 ? 189 ALA D CA 1 ATOM 11396 C C . ALA D 1 130 ? -13.906 60.039 55.451 1.00 55.88 ? 189 ALA D C 1 ATOM 11397 O O . ALA D 1 130 ? -14.251 60.902 54.645 1.00 50.37 ? 189 ALA D O 1 ATOM 11398 C CB . ALA D 1 130 ? -12.017 60.386 57.051 1.00 37.66 ? 189 ALA D CB 1 ATOM 11399 N N . VAL D 1 131 ? -14.772 59.293 56.129 1.00 38.74 ? 190 VAL D N 1 ATOM 11400 C CA . VAL D 1 131 ? -16.213 59.503 56.036 1.00 38.92 ? 190 VAL D CA 1 ATOM 11401 C C . VAL D 1 131 ? -16.710 60.349 57.203 1.00 40.49 ? 190 VAL D C 1 ATOM 11402 O O . VAL D 1 131 ? -16.467 60.020 58.364 1.00 38.79 ? 190 VAL D O 1 ATOM 11403 C CB . VAL D 1 131 ? -16.982 58.165 56.017 1.00 39.42 ? 190 VAL D CB 1 ATOM 11404 C CG1 . VAL D 1 131 ? -18.484 58.405 56.103 1.00 39.75 ? 190 VAL D CG1 1 ATOM 11405 C CG2 . VAL D 1 131 ? -16.628 57.365 54.775 1.00 39.55 ? 190 VAL D CG2 1 ATOM 11406 N N . PHE D 1 132 ? -17.403 61.440 56.893 1.00 38.73 ? 191 PHE D N 1 ATOM 11407 C CA . PHE D 1 132 ? -17.922 62.319 57.933 1.00 43.39 ? 191 PHE D CA 1 ATOM 11408 C C . PHE D 1 132 ? -19.444 62.282 58.039 1.00 47.80 ? 191 PHE D C 1 ATOM 11409 O O . PHE D 1 132 ? -20.152 62.469 57.050 1.00 39.17 ? 191 PHE D O 1 ATOM 11410 C CB . PHE D 1 132 ? -17.461 63.757 57.690 1.00 38.18 ? 191 PHE D CB 1 ATOM 11411 C CG . PHE D 1 132 ? -18.063 64.752 58.639 1.00 38.06 ? 191 PHE D CG 1 ATOM 11412 C CD1 . PHE D 1 132 ? -17.629 64.824 59.951 1.00 37.90 ? 191 PHE D CD1 1 ATOM 11413 C CD2 . PHE D 1 132 ? -19.059 65.619 58.219 1.00 41.59 ? 191 PHE D CD2 1 ATOM 11414 C CE1 . PHE D 1 132 ? -18.180 65.736 60.828 1.00 37.79 ? 191 PHE D CE1 1 ATOM 11415 C CE2 . PHE D 1 132 ? -19.613 66.535 59.092 1.00 37.99 ? 191 PHE D CE2 1 ATOM 11416 C CZ . PHE D 1 132 ? -19.172 66.593 60.398 1.00 37.83 ? 191 PHE D CZ 1 ATOM 11417 N N . LYS D 1 133 ? -19.936 62.037 59.249 1.00 39.15 ? 192 LYS D N 1 ATOM 11418 C CA . LYS D 1 133 ? -21.363 62.118 59.532 1.00 41.16 ? 192 LYS D CA 1 ATOM 11419 C C . LYS D 1 133 ? -21.594 63.119 60.658 1.00 39.26 ? 192 LYS D C 1 ATOM 11420 O O . LYS D 1 133 ? -21.109 62.924 61.771 1.00 51.38 ? 192 LYS D O 1 ATOM 11421 C CB . LYS D 1 133 ? -21.929 60.748 59.909 1.00 39.95 ? 192 LYS D CB 1 ATOM 11422 C CG . LYS D 1 133 ? -21.975 59.753 58.760 1.00 46.33 ? 192 LYS D CG 1 ATOM 11423 C CD . LYS D 1 133 ? -22.414 58.379 59.242 1.00 40.69 ? 192 LYS D CD 1 ATOM 11424 C CE . LYS D 1 133 ? -22.611 57.421 58.081 1.00 41.01 ? 192 LYS D CE 1 ATOM 11425 N NZ . LYS D 1 133 ? -23.185 56.121 58.522 1.00 41.48 ? 192 LYS D NZ 1 ATOM 11426 N N . PRO D 1 134 ? -22.336 64.198 60.370 1.00 39.18 ? 193 PRO D N 1 ATOM 11427 C CA . PRO D 1 134 ? -22.533 65.283 61.338 1.00 40.28 ? 193 PRO D CA 1 ATOM 11428 C C . PRO D 1 134 ? -23.478 64.911 62.479 1.00 39.22 ? 193 PRO D C 1 ATOM 11429 O O . PRO D 1 134 ? -24.346 64.055 62.313 1.00 39.66 ? 193 PRO D O 1 ATOM 11430 C CB . PRO D 1 134 ? -23.132 66.402 60.483 1.00 38.82 ? 193 PRO D CB 1 ATOM 11431 C CG . PRO D 1 134 ? -23.848 65.687 59.391 1.00 41.00 ? 193 PRO D CG 1 ATOM 11432 C CD . PRO D 1 134 ? -23.028 64.458 59.095 1.00 39.33 ? 193 PRO D CD 1 HETATM 11433 N N . MSE D 1 135 ? -23.297 65.554 63.628 1.00 66.83 ? 194 MSE D N 1 HETATM 11434 C CA . MSE D 1 135 ? -24.185 65.364 64.768 1.00 46.04 ? 194 MSE D CA 1 HETATM 11435 C C . MSE D 1 135 ? -25.513 66.069 64.523 1.00 39.37 ? 194 MSE D C 1 HETATM 11436 O O . MSE D 1 135 ? -25.549 67.156 63.948 1.00 43.32 ? 194 MSE D O 1 HETATM 11437 C CB . MSE D 1 135 ? -23.535 65.888 66.052 1.00 39.47 ? 194 MSE D CB 1 HETATM 11438 C CG . MSE D 1 135 ? -24.471 65.969 67.248 1.00 43.74 ? 194 MSE D CG 1 HETATM 11439 SE SE . MSE D 1 135 ? -23.590 66.610 68.862 1.00 76.68 ? 194 MSE D SE 1 HETATM 11440 C CE . MSE D 1 135 ? -25.164 66.875 69.983 1.00 38.92 ? 194 MSE D CE 1 ATOM 11441 N N . ARG D 1 136 ? -26.605 65.446 64.952 1.00 39.79 ? 195 ARG D N 1 ATOM 11442 C CA . ARG D 1 136 ? -27.920 66.054 64.808 1.00 39.97 ? 195 ARG D CA 1 ATOM 11443 C C . ARG D 1 136 ? -28.531 66.384 66.168 1.00 39.99 ? 195 ARG D C 1 ATOM 11444 O O . ARG D 1 136 ? -28.470 67.529 66.614 1.00 48.00 ? 195 ARG D O 1 ATOM 11445 C CB . ARG D 1 136 ? -28.842 65.136 64.002 1.00 40.47 ? 195 ARG D CB 1 ATOM 11446 C CG . ARG D 1 136 ? -30.154 65.779 63.598 1.00 40.65 ? 195 ARG D CG 1 ATOM 11447 C CD . ARG D 1 136 ? -30.932 64.898 62.637 1.00 41.12 ? 195 ARG D CD 1 ATOM 11448 N NE . ARG D 1 136 ? -31.112 65.546 61.340 1.00 41.03 ? 195 ARG D NE 1 ATOM 11449 C CZ . ARG D 1 136 ? -30.459 65.208 60.234 1.00 40.99 ? 195 ARG D CZ 1 ATOM 11450 N NH1 . ARG D 1 136 ? -29.573 64.224 60.259 1.00 41.02 ? 195 ARG D NH1 1 ATOM 11451 N NH2 . ARG D 1 136 ? -30.689 65.859 59.102 1.00 45.11 ? 195 ARG D NH2 1 ATOM 11452 N N . PHE D 1 137 ? -29.114 65.389 66.830 1.00 40.39 ? 196 PHE D N 1 ATOM 11453 C CA . PHE D 1 137 ? -29.714 65.612 68.143 1.00 40.45 ? 196 PHE D CA 1 ATOM 11454 C C . PHE D 1 137 ? -28.749 65.303 69.285 1.00 43.74 ? 196 PHE D C 1 ATOM 11455 O O . PHE D 1 137 ? -27.653 64.785 69.068 1.00 40.12 ? 196 PHE D O 1 ATOM 11456 C CB . PHE D 1 137 ? -30.987 64.778 68.310 1.00 41.00 ? 196 PHE D CB 1 ATOM 11457 C CG . PHE D 1 137 ? -31.977 64.948 67.195 1.00 47.53 ? 196 PHE D CG 1 ATOM 11458 C CD1 . PHE D 1 137 ? -32.527 66.190 66.927 1.00 41.05 ? 196 PHE D CD1 1 ATOM 11459 C CD2 . PHE D 1 137 ? -32.372 63.865 66.427 1.00 41.67 ? 196 PHE D CD2 1 ATOM 11460 C CE1 . PHE D 1 137 ? -33.444 66.353 65.906 1.00 44.96 ? 196 PHE D CE1 1 ATOM 11461 C CE2 . PHE D 1 137 ? -33.290 64.021 65.405 1.00 41.90 ? 196 PHE D CE2 1 ATOM 11462 C CZ . PHE D 1 137 ? -33.826 65.266 65.144 1.00 41.70 ? 196 PHE D CZ 1 ATOM 11463 N N . GLY D 1 138 ? -29.173 65.627 70.503 1.00 40.24 ? 197 GLY D N 1 ATOM 11464 C CA . GLY D 1 138 ? -28.385 65.354 71.691 1.00 40.08 ? 197 GLY D CA 1 ATOM 11465 C C . GLY D 1 138 ? -28.331 63.881 72.041 1.00 40.45 ? 197 GLY D C 1 ATOM 11466 O O . GLY D 1 138 ? -29.016 63.060 71.431 1.00 47.93 ? 197 GLY D O 1 ATOM 11467 N N . ARG D 1 139 ? -27.509 63.550 73.031 1.00 40.31 ? 198 ARG D N 1 ATOM 11468 C CA . ARG D 1 139 ? -27.315 62.168 73.455 1.00 42.25 ? 198 ARG D CA 1 ATOM 11469 C C . ARG D 1 139 ? -28.567 61.571 74.098 1.00 42.45 ? 198 ARG D C 1 ATOM 11470 O O . ARG D 1 139 ? -28.739 60.353 74.120 1.00 43.10 ? 198 ARG D O 1 ATOM 11471 C CB . ARG D 1 139 ? -26.139 62.079 74.430 1.00 40.31 ? 198 ARG D CB 1 ATOM 11472 C CG . ARG D 1 139 ? -24.840 62.654 73.892 1.00 39.84 ? 198 ARG D CG 1 ATOM 11473 C CD . ARG D 1 139 ? -24.347 61.876 72.686 1.00 39.95 ? 198 ARG D CD 1 ATOM 11474 N NE . ARG D 1 139 ? -22.911 62.036 72.482 1.00 41.80 ? 198 ARG D NE 1 ATOM 11475 C CZ . ARG D 1 139 ? -22.369 62.860 71.592 1.00 46.89 ? 198 ARG D CZ 1 ATOM 11476 N NH1 . ARG D 1 139 ? -23.145 63.605 70.817 1.00 39.25 ? 198 ARG D NH1 1 ATOM 11477 N NH2 . ARG D 1 139 ? -21.051 62.941 71.477 1.00 38.88 ? 198 ARG D NH2 1 ATOM 11478 N N . ASP D 1 140 ? -29.438 62.431 74.616 1.00 41.07 ? 199 ASP D N 1 ATOM 11479 C CA . ASP D 1 140 ? -30.617 61.974 75.347 1.00 47.01 ? 199 ASP D CA 1 ATOM 11480 C C . ASP D 1 140 ? -31.781 61.635 74.422 1.00 46.42 ? 199 ASP D C 1 ATOM 11481 O O . ASP D 1 140 ? -32.732 60.969 74.833 1.00 48.02 ? 199 ASP D O 1 ATOM 11482 C CB . ASP D 1 140 ? -31.057 63.031 76.362 1.00 41.60 ? 199 ASP D CB 1 ATOM 11483 C CG . ASP D 1 140 ? -30.065 63.202 77.493 1.00 69.68 ? 199 ASP D CG 1 ATOM 11484 O OD1 . ASP D 1 140 ? -29.958 64.326 78.025 1.00 69.03 ? 199 ASP D OD1 1 ATOM 11485 O OD2 . ASP D 1 140 ? -29.386 62.214 77.847 1.00 82.02 ? 199 ASP D OD2 1 ATOM 11486 N N . TYR D 1 141 ? -31.708 62.101 73.179 1.00 44.41 ? 200 TYR D N 1 ATOM 11487 C CA . TYR D 1 141 ? -32.772 61.859 72.208 1.00 42.18 ? 200 TYR D CA 1 ATOM 11488 C C . TYR D 1 141 ? -32.958 60.367 71.948 1.00 42.66 ? 200 TYR D C 1 ATOM 11489 O O . TYR D 1 141 ? -31.991 59.644 71.712 1.00 54.65 ? 200 TYR D O 1 ATOM 11490 C CB . TYR D 1 141 ? -32.477 62.584 70.893 1.00 45.91 ? 200 TYR D CB 1 ATOM 11491 C CG . TYR D 1 141 ? -33.583 62.468 69.864 1.00 52.36 ? 200 TYR D CG 1 ATOM 11492 C CD1 . TYR D 1 141 ? -34.656 63.350 69.868 1.00 50.54 ? 200 TYR D CD1 1 ATOM 11493 C CD2 . TYR D 1 141 ? -33.552 61.479 68.888 1.00 45.62 ? 200 TYR D CD2 1 ATOM 11494 C CE1 . TYR D 1 141 ? -35.668 63.250 68.931 1.00 45.42 ? 200 TYR D CE1 1 ATOM 11495 C CE2 . TYR D 1 141 ? -34.560 61.371 67.947 1.00 51.22 ? 200 TYR D CE2 1 ATOM 11496 C CZ . TYR D 1 141 ? -35.615 62.260 67.974 1.00 55.43 ? 200 TYR D CZ 1 ATOM 11497 O OH . TYR D 1 141 ? -36.620 62.158 67.041 1.00 70.80 ? 200 TYR D OH 1 ATOM 11498 N N . GLU D 1 142 ? -34.206 59.913 71.987 1.00 43.13 ? 201 GLU D N 1 ATOM 11499 C CA . GLU D 1 142 ? -34.520 58.522 71.684 1.00 48.84 ? 201 GLU D CA 1 ATOM 11500 C C . GLU D 1 142 ? -35.419 58.439 70.455 1.00 49.44 ? 201 GLU D C 1 ATOM 11501 O O . GLU D 1 142 ? -36.209 59.346 70.194 1.00 43.90 ? 201 GLU D O 1 ATOM 11502 C CB . GLU D 1 142 ? -35.181 57.838 72.883 1.00 43.98 ? 201 GLU D CB 1 ATOM 11503 C CG . GLU D 1 142 ? -34.428 58.012 74.192 1.00 53.12 ? 201 GLU D CG 1 ATOM 11504 C CD . GLU D 1 142 ? -34.329 56.715 74.973 1.00 47.66 ? 201 GLU D CD 1 ATOM 11505 O OE1 . GLU D 1 142 ? -34.780 55.674 74.452 1.00 56.19 ? 201 GLU D OE1 1 ATOM 11506 O OE2 . GLU D 1 142 ? -33.794 56.732 76.100 1.00 49.09 ? 201 GLU D OE2 1 ATOM 11507 N N . SER D 1 143 ? -35.283 57.354 69.697 1.00 50.63 ? 202 SER D N 1 ATOM 11508 C CA . SER D 1 143 ? -36.053 57.177 68.470 1.00 44.53 ? 202 SER D CA 1 ATOM 11509 C C . SER D 1 143 ? -37.549 57.126 68.739 1.00 44.98 ? 202 SER D C 1 ATOM 11510 O O . SER D 1 143 ? -37.996 56.583 69.750 1.00 57.01 ? 202 SER D O 1 ATOM 11511 C CB . SER D 1 143 ? -35.616 55.911 67.734 1.00 44.79 ? 202 SER D CB 1 ATOM 11512 O OG . SER D 1 143 ? -34.243 55.971 67.388 1.00 60.59 ? 202 SER D OG 1 ATOM 11513 N N . ASP D 1 144 ? -38.317 57.715 67.829 1.00 48.39 ? 203 ASP D N 1 ATOM 11514 C CA . ASP D 1 144 ? -39.770 57.663 67.893 1.00 45.49 ? 203 ASP D CA 1 ATOM 11515 C C . ASP D 1 144 ? -40.242 56.217 67.847 1.00 46.07 ? 203 ASP D C 1 ATOM 11516 O O . ASP D 1 144 ? -39.876 55.471 66.936 1.00 46.21 ? 203 ASP D O 1 ATOM 11517 C CB . ASP D 1 144 ? -40.384 58.467 66.743 1.00 45.47 ? 203 ASP D CB 1 ATOM 11518 C CG . ASP D 1 144 ? -41.864 58.756 66.946 1.00 45.81 ? 203 ASP D CG 1 ATOM 11519 O OD1 . ASP D 1 144 ? -42.604 57.880 67.443 1.00 46.78 ? 203 ASP D OD1 1 ATOM 11520 O OD2 . ASP D 1 144 ? -42.291 59.876 66.603 1.00 52.98 ? 203 ASP D OD2 1 ATOM 11521 N N . PRO D 1 145 ? -41.055 55.815 68.836 1.00 46.41 ? 204 PRO D N 1 ATOM 11522 C CA . PRO D 1 145 ? -41.605 54.457 68.878 1.00 46.99 ? 204 PRO D CA 1 ATOM 11523 C C . PRO D 1 145 ? -42.453 54.139 67.645 1.00 47.38 ? 204 PRO D C 1 ATOM 11524 O O . PRO D 1 145 ? -42.620 52.969 67.302 1.00 50.64 ? 204 PRO D O 1 ATOM 11525 C CB . PRO D 1 145 ? -42.464 54.465 70.147 1.00 47.22 ? 204 PRO D CB 1 ATOM 11526 C CG . PRO D 1 145 ? -41.863 55.527 71.001 1.00 46.68 ? 204 PRO D CG 1 ATOM 11527 C CD . PRO D 1 145 ? -41.398 56.586 70.045 1.00 46.25 ? 204 PRO D CD 1 ATOM 11528 N N . ASN D 1 146 ? -42.965 55.173 66.986 1.00 47.24 ? 205 ASN D N 1 ATOM 11529 C CA . ASN D 1 146 ? -43.761 54.998 65.778 1.00 47.94 ? 205 ASN D CA 1 ATOM 11530 C C . ASN D 1 146 ? -42.907 54.907 64.517 1.00 47.37 ? 205 ASN D C 1 ATOM 11531 O O . ASN D 1 146 ? -43.410 54.587 63.439 1.00 47.66 ? 205 ASN D O 1 ATOM 11532 C CB . ASN D 1 146 ? -44.767 56.144 65.637 1.00 47.53 ? 205 ASN D CB 1 ATOM 11533 C CG . ASN D 1 146 ? -45.806 56.146 66.740 1.00 47.82 ? 205 ASN D CG 1 ATOM 11534 O OD1 . ASN D 1 146 ? -46.311 55.095 67.134 1.00 48.30 ? 205 ASN D OD1 1 ATOM 11535 N ND2 . ASN D 1 146 ? -46.127 57.329 67.248 1.00 47.53 ? 205 ASN D ND2 1 ATOM 11536 N N . HIS D 1 147 ? -41.615 55.191 64.655 1.00 46.88 ? 206 HIS D N 1 ATOM 11537 C CA . HIS D 1 147 ? -40.701 55.156 63.519 1.00 46.65 ? 206 HIS D CA 1 ATOM 11538 C C . HIS D 1 147 ? -40.212 53.747 63.206 1.00 46.93 ? 206 HIS D C 1 ATOM 11539 O O . HIS D 1 147 ? -39.753 53.028 64.093 1.00 46.97 ? 206 HIS D O 1 ATOM 11540 C CB . HIS D 1 147 ? -39.496 56.065 63.769 1.00 46.00 ? 206 HIS D CB 1 ATOM 11541 C CG . HIS D 1 147 ? -39.740 57.501 63.427 1.00 50.86 ? 206 HIS D CG 1 ATOM 11542 N ND1 . HIS D 1 147 ? -38.860 58.506 63.764 1.00 45.09 ? 206 HIS D ND1 1 ATOM 11543 C CD2 . HIS D 1 147 ? -40.764 58.100 62.774 1.00 45.81 ? 206 HIS D CD2 1 ATOM 11544 C CE1 . HIS D 1 147 ? -39.331 59.663 63.335 1.00 44.90 ? 206 HIS D CE1 1 ATOM 11545 N NE2 . HIS D 1 147 ? -40.485 59.445 62.731 1.00 45.32 ? 206 HIS D NE2 1 ATOM 11546 N N . PHE D 1 148 ? -40.318 53.360 61.940 1.00 51.38 ? 207 PHE D N 1 ATOM 11547 C CA . PHE D 1 148 ? -39.716 52.120 61.473 1.00 47.30 ? 207 PHE D CA 1 ATOM 11548 C C . PHE D 1 148 ? -38.203 52.288 61.375 1.00 46.79 ? 207 PHE D C 1 ATOM 11549 O O . PHE D 1 148 ? -37.691 53.406 61.418 1.00 46.31 ? 207 PHE D O 1 ATOM 11550 C CB . PHE D 1 148 ? -40.296 51.708 60.118 1.00 47.65 ? 207 PHE D CB 1 ATOM 11551 C CG . PHE D 1 148 ? -41.687 51.146 60.197 1.00 48.25 ? 207 PHE D CG 1 ATOM 11552 C CD1 . PHE D 1 148 ? -42.790 51.949 59.955 1.00 48.37 ? 207 PHE D CD1 1 ATOM 11553 C CD2 . PHE D 1 148 ? -41.892 49.812 60.514 1.00 48.71 ? 207 PHE D CD2 1 ATOM 11554 C CE1 . PHE D 1 148 ? -44.070 51.433 60.026 1.00 48.93 ? 207 PHE D CE1 1 ATOM 11555 C CE2 . PHE D 1 148 ? -43.171 49.290 60.588 1.00 49.28 ? 207 PHE D CE2 1 ATOM 11556 C CZ . PHE D 1 148 ? -44.261 50.102 60.344 1.00 49.39 ? 207 PHE D CZ 1 ATOM 11557 N N . TYR D 1 149 ? -37.496 51.170 61.248 1.00 46.90 ? 208 TYR D N 1 ATOM 11558 C CA . TYR D 1 149 ? -36.044 51.176 61.092 1.00 46.45 ? 208 TYR D CA 1 ATOM 11559 C C . TYR D 1 149 ? -35.575 51.970 59.872 1.00 53.03 ? 208 TYR D C 1 ATOM 11560 O O . TYR D 1 149 ? -34.473 52.521 59.872 1.00 60.11 ? 208 TYR D O 1 ATOM 11561 C CB . TYR D 1 149 ? -35.514 49.740 61.015 1.00 46.70 ? 208 TYR D CB 1 ATOM 11562 C CG . TYR D 1 149 ? -36.386 48.800 60.210 1.00 47.26 ? 208 TYR D CG 1 ATOM 11563 C CD1 . TYR D 1 149 ? -36.165 48.601 58.855 1.00 47.29 ? 208 TYR D CD1 1 ATOM 11564 C CD2 . TYR D 1 149 ? -37.434 48.111 60.810 1.00 47.78 ? 208 TYR D CD2 1 ATOM 11565 C CE1 . TYR D 1 149 ? -36.961 47.743 58.119 1.00 47.81 ? 208 TYR D CE1 1 ATOM 11566 C CE2 . TYR D 1 149 ? -38.236 47.254 60.083 1.00 48.30 ? 208 TYR D CE2 1 ATOM 11567 C CZ . TYR D 1 149 ? -37.995 47.073 58.739 1.00 55.16 ? 208 TYR D CZ 1 ATOM 11568 O OH . TYR D 1 149 ? -38.790 46.218 58.011 1.00 64.35 ? 208 TYR D OH 1 ATOM 11569 N N . PHE D 1 150 ? -36.407 52.030 58.835 1.00 51.10 ? 209 PHE D N 1 ATOM 11570 C CA . PHE D 1 150 ? -36.041 52.744 57.614 1.00 49.85 ? 209 PHE D CA 1 ATOM 11571 C C . PHE D 1 150 ? -36.469 54.211 57.651 1.00 45.81 ? 209 PHE D C 1 ATOM 11572 O O . PHE D 1 150 ? -36.314 54.935 56.667 1.00 59.79 ? 209 PHE D O 1 ATOM 11573 C CB . PHE D 1 150 ? -36.641 52.051 56.384 1.00 46.52 ? 209 PHE D CB 1 ATOM 11574 C CG . PHE D 1 150 ? -38.120 51.795 56.483 1.00 47.05 ? 209 PHE D CG 1 ATOM 11575 C CD1 . PHE D 1 150 ? -38.595 50.538 56.818 1.00 47.55 ? 209 PHE D CD1 1 ATOM 11576 C CD2 . PHE D 1 150 ? -39.035 52.807 56.236 1.00 47.05 ? 209 PHE D CD2 1 ATOM 11577 C CE1 . PHE D 1 150 ? -39.953 50.295 56.907 1.00 48.05 ? 209 PHE D CE1 1 ATOM 11578 C CE2 . PHE D 1 150 ? -40.393 52.570 56.325 1.00 47.54 ? 209 PHE D CE2 1 ATOM 11579 C CZ . PHE D 1 150 ? -40.853 51.313 56.660 1.00 48.04 ? 209 PHE D CZ 1 ATOM 11580 N N . SER D 1 151 ? -37.009 54.642 58.786 1.00 61.96 ? 210 SER D N 1 ATOM 11581 C CA . SER D 1 151 ? -37.406 56.034 58.965 1.00 49.22 ? 210 SER D CA 1 ATOM 11582 C C . SER D 1 151 ? -36.492 56.735 59.965 1.00 52.07 ? 210 SER D C 1 ATOM 11583 O O . SER D 1 151 ? -36.545 57.953 60.126 1.00 50.98 ? 210 SER D O 1 ATOM 11584 C CB . SER D 1 151 ? -38.862 56.127 59.425 1.00 51.87 ? 210 SER D CB 1 ATOM 11585 O OG . SER D 1 151 ? -39.743 55.629 58.434 1.00 69.72 ? 210 SER D OG 1 ATOM 11586 N N . ASP D 1 152 ? -35.651 55.950 60.630 1.00 55.91 ? 211 ASP D N 1 ATOM 11587 C CA . ASP D 1 152 ? -34.776 56.454 61.682 1.00 56.89 ? 211 ASP D CA 1 ATOM 11588 C C . ASP D 1 152 ? -33.637 57.324 61.152 1.00 54.20 ? 211 ASP D C 1 ATOM 11589 O O . ASP D 1 152 ? -32.930 56.941 60.220 1.00 60.27 ? 211 ASP D O 1 ATOM 11590 C CB . ASP D 1 152 ? -34.200 55.283 62.479 1.00 64.38 ? 211 ASP D CB 1 ATOM 11591 C CG . ASP D 1 152 ? -33.780 55.680 63.877 1.00 72.71 ? 211 ASP D CG 1 ATOM 11592 O OD1 . ASP D 1 152 ? -34.272 56.715 64.375 1.00 65.22 ? 211 ASP D OD1 1 ATOM 11593 O OD2 . ASP D 1 152 ? -32.963 54.953 64.481 1.00 75.54 ? 211 ASP D OD2 1 ATOM 11594 N N . PHE D 1 153 ? -33.467 58.498 61.754 1.00 52.97 ? 212 PHE D N 1 ATOM 11595 C CA . PHE D 1 153 ? -32.321 59.354 61.467 1.00 43.05 ? 212 PHE D CA 1 ATOM 11596 C C . PHE D 1 153 ? -31.053 58.727 62.034 1.00 42.86 ? 212 PHE D C 1 ATOM 11597 O O . PHE D 1 153 ? -31.072 58.169 63.131 1.00 47.12 ? 212 PHE D O 1 ATOM 11598 C CB . PHE D 1 153 ? -32.523 60.752 62.059 1.00 42.70 ? 212 PHE D CB 1 ATOM 11599 C CG . PHE D 1 153 ? -32.917 61.795 61.051 1.00 42.55 ? 212 PHE D CG 1 ATOM 11600 C CD1 . PHE D 1 153 ? -32.542 61.676 59.723 1.00 52.63 ? 212 PHE D CD1 1 ATOM 11601 C CD2 . PHE D 1 153 ? -33.658 62.902 61.437 1.00 49.40 ? 212 PHE D CD2 1 ATOM 11602 C CE1 . PHE D 1 153 ? -32.902 62.640 58.798 1.00 42.39 ? 212 PHE D CE1 1 ATOM 11603 C CE2 . PHE D 1 153 ? -34.020 63.868 60.517 1.00 42.29 ? 212 PHE D CE2 1 ATOM 11604 C CZ . PHE D 1 153 ? -33.643 63.737 59.196 1.00 50.50 ? 212 PHE D CZ 1 ATOM 11605 N N . GLU D 1 154 ? -29.956 58.811 61.289 1.00 42.55 ? 213 GLU D N 1 ATOM 11606 C CA . GLU D 1 154 ? -28.682 58.281 61.762 1.00 42.33 ? 213 GLU D CA 1 ATOM 11607 C C . GLU D 1 154 ? -28.167 59.035 62.983 1.00 41.95 ? 213 GLU D C 1 ATOM 11608 O O . GLU D 1 154 ? -28.403 60.234 63.135 1.00 42.55 ? 213 GLU D O 1 ATOM 11609 C CB . GLU D 1 154 ? -27.623 58.321 60.658 1.00 42.06 ? 213 GLU D CB 1 ATOM 11610 C CG . GLU D 1 154 ? -27.707 57.177 59.665 1.00 49.62 ? 213 GLU D CG 1 ATOM 11611 C CD . GLU D 1 154 ? -26.476 57.088 58.782 1.00 54.06 ? 213 GLU D CD 1 ATOM 11612 O OE1 . GLU D 1 154 ? -25.820 56.025 58.786 1.00 58.67 ? 213 GLU D OE1 1 ATOM 11613 O OE2 . GLU D 1 154 ? -26.165 58.077 58.086 1.00 56.86 ? 213 GLU D OE2 1 ATOM 11614 N N . ARG D 1 155 ? -27.459 58.318 63.848 1.00 41.93 ? 214 ARG D N 1 ATOM 11615 C CA . ARG D 1 155 ? -26.786 58.931 64.983 1.00 41.55 ? 214 ARG D CA 1 ATOM 11616 C C . ARG D 1 155 ? -25.283 58.729 64.843 1.00 41.21 ? 214 ARG D C 1 ATOM 11617 O O . ARG D 1 155 ? -24.794 57.600 64.880 1.00 44.48 ? 214 ARG D O 1 ATOM 11618 C CB . ARG D 1 155 ? -27.294 58.339 66.298 1.00 41.81 ? 214 ARG D CB 1 ATOM 11619 C CG . ARG D 1 155 ? -28.737 58.699 66.613 1.00 42.10 ? 214 ARG D CG 1 ATOM 11620 C CD . ARG D 1 155 ? -29.310 57.803 67.696 1.00 42.47 ? 214 ARG D CD 1 ATOM 11621 N NE . ARG D 1 155 ? -29.662 56.488 67.167 1.00 42.94 ? 214 ARG D NE 1 ATOM 11622 C CZ . ARG D 1 155 ? -30.774 56.226 66.487 1.00 43.34 ? 214 ARG D CZ 1 ATOM 11623 N NH1 . ARG D 1 155 ? -31.657 57.188 66.249 1.00 43.33 ? 214 ARG D NH1 1 ATOM 11624 N NH2 . ARG D 1 155 ? -31.004 54.997 66.043 1.00 48.13 ? 214 ARG D NH2 1 ATOM 11625 N N . HIS D 1 156 ? -24.560 59.829 64.663 1.00 40.73 ? 215 HIS D N 1 ATOM 11626 C CA . HIS D 1 156 ? -23.117 59.785 64.448 1.00 40.37 ? 215 HIS D CA 1 ATOM 11627 C C . HIS D 1 156 ? -22.385 59.145 65.625 1.00 50.26 ? 215 HIS D C 1 ATOM 11628 O O . HIS D 1 156 ? -21.377 58.462 65.444 1.00 44.38 ? 215 HIS D O 1 ATOM 11629 C CB . HIS D 1 156 ? -22.577 61.193 64.200 1.00 39.89 ? 215 HIS D CB 1 ATOM 11630 C CG . HIS D 1 156 ? -22.302 61.960 65.454 1.00 48.83 ? 215 HIS D CG 1 ATOM 11631 N ND1 . HIS D 1 156 ? -21.024 62.252 65.882 1.00 39.19 ? 215 HIS D ND1 1 ATOM 11632 C CD2 . HIS D 1 156 ? -23.137 62.473 66.387 1.00 39.65 ? 215 HIS D CD2 1 ATOM 11633 C CE1 . HIS D 1 156 ? -21.086 62.924 67.017 1.00 39.47 ? 215 HIS D CE1 1 ATOM 11634 N NE2 . HIS D 1 156 ? -22.357 63.071 67.346 1.00 49.51 ? 215 HIS D NE2 1 ATOM 11635 N N . HIS D 1 157 ? -22.899 59.367 66.831 1.00 40.36 ? 216 HIS D N 1 ATOM 11636 C CA . HIS D 1 157 ? -22.255 58.862 68.037 1.00 40.29 ? 216 HIS D CA 1 ATOM 11637 C C . HIS D 1 157 ? -22.485 57.364 68.192 1.00 43.67 ? 216 HIS D C 1 ATOM 11638 O O . HIS D 1 157 ? -21.828 56.710 68.998 1.00 53.02 ? 216 HIS D O 1 ATOM 11639 C CB . HIS D 1 157 ? -22.760 59.612 69.274 1.00 40.20 ? 216 HIS D CB 1 ATOM 11640 C CG . HIS D 1 157 ? -24.229 59.462 69.519 1.00 41.23 ? 216 HIS D CG 1 ATOM 11641 N ND1 . HIS D 1 157 ? -25.162 60.339 69.010 1.00 40.65 ? 216 HIS D ND1 1 ATOM 11642 C CD2 . HIS D 1 157 ? -24.925 58.542 70.228 1.00 41.02 ? 216 HIS D CD2 1 ATOM 11643 C CE1 . HIS D 1 157 ? -26.370 59.963 69.390 1.00 41.05 ? 216 HIS D CE1 1 ATOM 11644 N NE2 . HIS D 1 157 ? -26.254 58.875 70.130 1.00 41.29 ? 216 HIS D NE2 1 ATOM 11645 N N . ALA D 1 158 ? -23.418 56.825 67.415 1.00 49.03 ? 217 ALA D N 1 ATOM 11646 C CA . ALA D 1 158 ? -23.655 55.388 67.406 1.00 44.63 ? 217 ALA D CA 1 ATOM 11647 C C . ALA D 1 158 ? -22.563 54.692 66.602 1.00 41.46 ? 217 ALA D C 1 ATOM 11648 O O . ALA D 1 158 ? -22.143 53.584 66.936 1.00 45.38 ? 217 ALA D O 1 ATOM 11649 C CB . ALA D 1 158 ? -25.028 55.073 66.838 1.00 43.85 ? 217 ALA D CB 1 ATOM 11650 N N . GLU D 1 159 ? -22.112 55.352 65.538 1.00 43.90 ? 218 GLU D N 1 ATOM 11651 C CA . GLU D 1 159 ? -20.982 54.871 64.750 1.00 50.66 ? 218 GLU D CA 1 ATOM 11652 C C . GLU D 1 159 ? -19.736 54.754 65.621 1.00 40.81 ? 218 GLU D C 1 ATOM 11653 O O . GLU D 1 159 ? -19.018 53.755 65.568 1.00 40.76 ? 218 GLU D O 1 ATOM 11654 C CB . GLU D 1 159 ? -20.708 55.804 63.566 1.00 40.76 ? 218 GLU D CB 1 ATOM 11655 C CG . GLU D 1 159 ? -21.757 55.774 62.458 1.00 50.58 ? 218 GLU D CG 1 ATOM 11656 C CD . GLU D 1 159 ? -21.624 54.576 61.528 1.00 57.40 ? 218 GLU D CD 1 ATOM 11657 O OE1 . GLU D 1 159 ? -21.210 53.490 61.982 1.00 46.21 ? 218 GLU D OE1 1 ATOM 11658 O OE2 . GLU D 1 159 ? -21.931 54.728 60.327 1.00 49.99 ? 218 GLU D OE2 1 ATOM 11659 N N . ILE D 1 160 ? -19.490 55.787 66.420 1.00 41.43 ? 219 ILE D N 1 ATOM 11660 C CA . ILE D 1 160 ? -18.348 55.815 67.327 1.00 40.04 ? 219 ILE D CA 1 ATOM 11661 C C . ILE D 1 160 ? -18.477 54.759 68.423 1.00 47.81 ? 219 ILE D C 1 ATOM 11662 O O . ILE D 1 160 ? -17.565 53.961 68.637 1.00 49.44 ? 219 ILE D O 1 ATOM 11663 C CB . ILE D 1 160 ? -18.190 57.202 67.981 1.00 48.88 ? 219 ILE D CB 1 ATOM 11664 C CG1 . ILE D 1 160 ? -17.905 58.265 66.918 1.00 39.35 ? 219 ILE D CG1 1 ATOM 11665 C CG2 . ILE D 1 160 ? -17.090 57.177 69.032 1.00 39.35 ? 219 ILE D CG2 1 ATOM 11666 C CD1 . ILE D 1 160 ? -18.216 59.673 67.373 1.00 39.29 ? 219 ILE D CD1 1 ATOM 11667 N N . ALA D 1 161 ? -19.614 54.772 69.113 1.00 40.59 ? 220 ALA D N 1 ATOM 11668 C CA . ALA D 1 161 ? -19.869 53.864 70.229 1.00 40.86 ? 220 ALA D CA 1 ATOM 11669 C C . ALA D 1 161 ? -19.745 52.390 69.849 1.00 41.20 ? 220 ALA D C 1 ATOM 11670 O O . ALA D 1 161 ? -19.219 51.587 70.620 1.00 54.45 ? 220 ALA D O 1 ATOM 11671 C CB . ALA D 1 161 ? -21.248 54.131 70.811 1.00 41.15 ? 220 ALA D CB 1 ATOM 11672 N N . THR D 1 162 ? -20.226 52.038 68.661 1.00 44.49 ? 221 THR D N 1 ATOM 11673 C CA . THR D 1 162 ? -20.262 50.640 68.243 1.00 47.12 ? 221 THR D CA 1 ATOM 11674 C C . THR D 1 162 ? -18.868 50.134 67.889 1.00 44.96 ? 221 THR D C 1 ATOM 11675 O O . THR D 1 162 ? -18.533 48.979 68.156 1.00 55.70 ? 221 THR D O 1 ATOM 11676 C CB . THR D 1 162 ? -21.202 50.431 67.038 1.00 42.14 ? 221 THR D CB 1 ATOM 11677 O OG1 . THR D 1 162 ? -22.493 50.979 67.335 1.00 43.47 ? 221 THR D OG1 1 ATOM 11678 C CG2 . THR D 1 162 ? -21.351 48.950 66.728 1.00 42.56 ? 221 THR D CG2 1 ATOM 11679 N N . PHE D 1 163 ? -18.060 51.002 67.288 1.00 41.75 ? 222 PHE D N 1 ATOM 11680 C CA . PHE D 1 163 ? -16.669 50.674 67.001 1.00 47.50 ? 222 PHE D CA 1 ATOM 11681 C C . PHE D 1 163 ? -15.937 50.276 68.278 1.00 48.35 ? 222 PHE D C 1 ATOM 11682 O O . PHE D 1 163 ? -15.197 49.293 68.303 1.00 55.53 ? 222 PHE D O 1 ATOM 11683 C CB . PHE D 1 163 ? -15.955 51.850 66.331 1.00 40.38 ? 222 PHE D CB 1 ATOM 11684 C CG . PHE D 1 163 ? -14.457 51.753 66.383 1.00 50.24 ? 222 PHE D CG 1 ATOM 11685 C CD1 . PHE D 1 163 ? -13.784 50.820 65.613 1.00 49.45 ? 222 PHE D CD1 1 ATOM 11686 C CD2 . PHE D 1 163 ? -13.723 52.596 67.201 1.00 44.37 ? 222 PHE D CD2 1 ATOM 11687 C CE1 . PHE D 1 163 ? -12.405 50.724 65.662 1.00 52.91 ? 222 PHE D CE1 1 ATOM 11688 C CE2 . PHE D 1 163 ? -12.344 52.507 67.252 1.00 44.21 ? 222 PHE D CE2 1 ATOM 11689 C CZ . PHE D 1 163 ? -11.684 51.571 66.480 1.00 39.31 ? 222 PHE D CZ 1 ATOM 11690 N N . HIS D 1 164 ? -16.150 51.054 69.335 1.00 42.37 ? 223 HIS D N 1 ATOM 11691 C CA . HIS D 1 164 ? -15.559 50.771 70.638 1.00 56.62 ? 223 HIS D CA 1 ATOM 11692 C C . HIS D 1 164 ? -16.071 49.461 71.232 1.00 57.71 ? 223 HIS D C 1 ATOM 11693 O O . HIS D 1 164 ? -15.293 48.676 71.776 1.00 51.33 ? 223 HIS D O 1 ATOM 11694 C CB . HIS D 1 164 ? -15.832 51.924 71.603 1.00 43.70 ? 223 HIS D CB 1 ATOM 11695 C CG . HIS D 1 164 ? -14.977 53.127 71.359 1.00 48.53 ? 223 HIS D CG 1 ATOM 11696 N ND1 . HIS D 1 164 ? -13.978 53.519 72.224 1.00 39.35 ? 223 HIS D ND1 1 ATOM 11697 C CD2 . HIS D 1 164 ? -14.969 54.024 70.345 1.00 53.05 ? 223 HIS D CD2 1 ATOM 11698 C CE1 . HIS D 1 164 ? -13.392 54.605 71.753 1.00 50.83 ? 223 HIS D CE1 1 ATOM 11699 N NE2 . HIS D 1 164 ? -13.975 54.933 70.614 1.00 52.44 ? 223 HIS D NE2 1 ATOM 11700 N N . LEU D 1 165 ? -17.377 49.228 71.135 1.00 41.74 ? 224 LEU D N 1 ATOM 11701 C CA . LEU D 1 165 ? -17.967 47.993 71.645 1.00 53.93 ? 224 LEU D CA 1 ATOM 11702 C C . LEU D 1 165 ? -17.413 46.779 70.911 1.00 58.26 ? 224 LEU D C 1 ATOM 11703 O O . LEU D 1 165 ? -17.216 45.716 71.501 1.00 51.45 ? 224 LEU D O 1 ATOM 11704 C CB . LEU D 1 165 ? -19.490 48.017 71.515 1.00 42.17 ? 224 LEU D CB 1 ATOM 11705 C CG . LEU D 1 165 ? -20.166 46.731 72.003 1.00 56.35 ? 224 LEU D CG 1 ATOM 11706 C CD1 . LEU D 1 165 ? -19.926 46.526 73.493 1.00 42.63 ? 224 LEU D CD1 1 ATOM 11707 C CD2 . LEU D 1 165 ? -21.645 46.707 71.677 1.00 43.12 ? 224 LEU D CD2 1 ATOM 11708 N N . ASP D 1 166 ? -17.156 46.950 69.619 1.00 41.81 ? 225 ASP D N 1 ATOM 11709 C CA . ASP D 1 166 ? -16.593 45.885 68.803 1.00 41.91 ? 225 ASP D CA 1 ATOM 11710 C C . ASP D 1 166 ? -15.197 45.525 69.310 1.00 55.37 ? 225 ASP D C 1 ATOM 11711 O O . ASP D 1 166 ? -14.762 44.378 69.204 1.00 55.05 ? 225 ASP D O 1 ATOM 11712 C CB . ASP D 1 166 ? -16.555 46.310 67.335 1.00 41.83 ? 225 ASP D CB 1 ATOM 11713 C CG . ASP D 1 166 ? -15.941 45.260 66.437 1.00 52.49 ? 225 ASP D CG 1 ATOM 11714 O OD1 . ASP D 1 166 ? -14.727 45.347 66.168 1.00 41.56 ? 225 ASP D OD1 1 ATOM 11715 O OD2 . ASP D 1 166 ? -16.676 44.353 65.993 1.00 52.44 ? 225 ASP D OD2 1 ATOM 11716 N N . ARG D 1 167 ? -14.503 46.518 69.862 1.00 47.07 ? 226 ARG D N 1 ATOM 11717 C CA . ARG D 1 167 ? -13.203 46.302 70.493 1.00 40.84 ? 226 ARG D CA 1 ATOM 11718 C C . ARG D 1 167 ? -13.335 45.625 71.854 1.00 49.20 ? 226 ARG D C 1 ATOM 11719 O O . ARG D 1 167 ? -12.658 44.636 72.135 1.00 45.72 ? 226 ARG D O 1 ATOM 11720 C CB . ARG D 1 167 ? -12.462 47.628 70.668 1.00 49.02 ? 226 ARG D CB 1 ATOM 11721 C CG . ARG D 1 167 ? -11.157 47.496 71.438 1.00 44.73 ? 226 ARG D CG 1 ATOM 11722 C CD . ARG D 1 167 ? -10.369 48.793 71.452 1.00 45.12 ? 226 ARG D CD 1 ATOM 11723 N NE . ARG D 1 167 ? -9.771 49.110 70.160 1.00 51.14 ? 226 ARG D NE 1 ATOM 11724 C CZ . ARG D 1 167 ? -9.089 50.224 69.914 1.00 62.71 ? 226 ARG D CZ 1 ATOM 11725 N NH1 . ARG D 1 167 ? -8.927 51.126 70.872 1.00 52.68 ? 226 ARG D NH1 1 ATOM 11726 N NH2 . ARG D 1 167 ? -8.573 50.439 68.713 1.00 63.30 ? 226 ARG D NH2 1 ATOM 11727 N N . VAL D 1 168 ? -14.208 46.177 72.693 1.00 41.11 ? 227 VAL D N 1 ATOM 11728 C CA . VAL D 1 168 ? -14.420 45.686 74.053 1.00 41.27 ? 227 VAL D CA 1 ATOM 11729 C C . VAL D 1 168 ? -14.850 44.221 74.069 1.00 46.67 ? 227 VAL D C 1 ATOM 11730 O O . VAL D 1 168 ? -14.450 43.453 74.947 1.00 62.07 ? 227 VAL D O 1 ATOM 11731 C CB . VAL D 1 168 ? -15.476 46.545 74.790 1.00 51.50 ? 227 VAL D CB 1 ATOM 11732 C CG1 . VAL D 1 168 ? -15.826 45.941 76.139 1.00 53.91 ? 227 VAL D CG1 1 ATOM 11733 C CG2 . VAL D 1 168 ? -14.968 47.968 74.965 1.00 41.66 ? 227 VAL D CG2 1 ATOM 11734 N N . LEU D 1 169 ? -15.645 43.832 73.079 1.00 44.79 ? 228 LEU D N 1 ATOM 11735 C CA . LEU D 1 169 ? -16.119 42.457 72.974 1.00 50.70 ? 228 LEU D CA 1 ATOM 11736 C C . LEU D 1 169 ? -15.063 41.557 72.338 1.00 53.26 ? 228 LEU D C 1 ATOM 11737 O O . LEU D 1 169 ? -15.238 40.341 72.256 1.00 59.04 ? 228 LEU D O 1 ATOM 11738 C CB . LEU D 1 169 ? -17.420 42.398 72.174 1.00 45.69 ? 228 LEU D CB 1 ATOM 11739 C CG . LEU D 1 169 ? -18.653 43.031 72.822 1.00 51.63 ? 228 LEU D CG 1 ATOM 11740 C CD1 . LEU D 1 169 ? -19.823 43.035 71.852 1.00 51.03 ? 228 LEU D CD1 1 ATOM 11741 C CD2 . LEU D 1 169 ? -19.019 42.298 74.105 1.00 43.41 ? 228 LEU D CD2 1 ATOM 11742 N N . GLY D 1 170 ? -13.973 42.165 71.881 1.00 48.66 ? 229 GLY D N 1 ATOM 11743 C CA . GLY D 1 170 ? -12.843 41.421 71.358 1.00 41.84 ? 229 GLY D CA 1 ATOM 11744 C C . GLY D 1 170 ? -12.966 40.981 69.911 1.00 51.35 ? 229 GLY D C 1 ATOM 11745 O O . GLY D 1 170 ? -12.223 40.111 69.459 1.00 60.40 ? 229 GLY D O 1 ATOM 11746 N N . PHE D 1 171 ? -13.901 41.578 69.181 1.00 47.51 ? 230 PHE D N 1 ATOM 11747 C CA . PHE D 1 171 ? -14.070 41.258 67.769 1.00 54.67 ? 230 PHE D CA 1 ATOM 11748 C C . PHE D 1 171 ? -12.988 41.912 66.916 1.00 48.94 ? 230 PHE D C 1 ATOM 11749 O O . PHE D 1 171 ? -12.320 41.240 66.129 1.00 51.40 ? 230 PHE D O 1 ATOM 11750 C CB . PHE D 1 171 ? -15.451 41.691 67.273 1.00 65.74 ? 230 PHE D CB 1 ATOM 11751 C CG . PHE D 1 171 ? -16.583 40.909 67.868 1.00 61.83 ? 230 PHE D CG 1 ATOM 11752 C CD1 . PHE D 1 171 ? -16.795 39.591 67.505 1.00 52.03 ? 230 PHE D CD1 1 ATOM 11753 C CD2 . PHE D 1 171 ? -17.443 41.493 68.782 1.00 58.11 ? 230 PHE D CD2 1 ATOM 11754 C CE1 . PHE D 1 171 ? -17.837 38.867 68.048 1.00 60.77 ? 230 PHE D CE1 1 ATOM 11755 C CE2 . PHE D 1 171 ? -18.490 40.773 69.327 1.00 56.18 ? 230 PHE D CE2 1 ATOM 11756 C CZ . PHE D 1 171 ? -18.686 39.459 68.960 1.00 56.67 ? 230 PHE D CZ 1 ATOM 11757 N N . ARG D 1 172 ? -12.819 43.221 67.092 1.00 54.89 ? 231 ARG D N 1 ATOM 11758 C CA . ARG D 1 172 ? -11.882 44.020 66.303 1.00 49.57 ? 231 ARG D CA 1 ATOM 11759 C C . ARG D 1 172 ? -12.114 43.834 64.806 1.00 48.74 ? 231 ARG D C 1 ATOM 11760 O O . ARG D 1 172 ? -11.166 43.710 64.030 1.00 55.46 ? 231 ARG D O 1 ATOM 11761 C CB . ARG D 1 172 ? -10.437 43.672 66.668 1.00 53.29 ? 231 ARG D CB 1 ATOM 11762 C CG . ARG D 1 172 ? -9.994 44.255 67.997 1.00 60.54 ? 231 ARG D CG 1 ATOM 11763 C CD . ARG D 1 172 ? -8.631 43.732 68.417 1.00 50.25 ? 231 ARG D CD 1 ATOM 11764 N NE . ARG D 1 172 ? -8.706 43.062 69.711 1.00 61.43 ? 231 ARG D NE 1 ATOM 11765 C CZ . ARG D 1 172 ? -8.670 43.689 70.883 1.00 58.09 ? 231 ARG D CZ 1 ATOM 11766 N NH1 . ARG D 1 172 ? -8.557 45.010 70.930 1.00 57.09 ? 231 ARG D NH1 1 ATOM 11767 N NH2 . ARG D 1 172 ? -8.749 42.994 72.009 1.00 55.88 ? 231 ARG D NH2 1 ATOM 11768 N N . ARG D 1 173 ? -13.385 43.802 64.412 1.00 48.55 ? 232 ARG D N 1 ATOM 11769 C CA . ARG D 1 173 ? -13.754 43.675 63.006 1.00 61.67 ? 232 ARG D CA 1 ATOM 11770 C C . ARG D 1 173 ? -14.549 44.887 62.518 1.00 57.35 ? 232 ARG D C 1 ATOM 11771 O O . ARG D 1 173 ? -15.144 44.856 61.441 1.00 41.88 ? 232 ARG D O 1 ATOM 11772 C CB . ARG D 1 173 ? -14.553 42.388 62.779 1.00 51.74 ? 232 ARG D CB 1 ATOM 11773 C CG . ARG D 1 173 ? -13.823 41.132 63.231 1.00 54.88 ? 232 ARG D CG 1 ATOM 11774 C CD . ARG D 1 173 ? -14.348 39.886 62.534 1.00 48.12 ? 232 ARG D CD 1 ATOM 11775 N NE . ARG D 1 173 ? -15.686 39.510 62.984 1.00 59.48 ? 232 ARG D NE 1 ATOM 11776 C CZ . ARG D 1 173 ? -15.943 38.873 64.122 1.00 57.67 ? 232 ARG D CZ 1 ATOM 11777 N NH1 . ARG D 1 173 ? -14.953 38.535 64.937 1.00 54.52 ? 232 ARG D NH1 1 ATOM 11778 N NH2 . ARG D 1 173 ? -17.194 38.569 64.446 1.00 60.58 ? 232 ARG D NH2 1 ATOM 11779 N N . ALA D 1 174 ? -14.551 45.952 63.316 1.00 41.42 ? 233 ALA D N 1 ATOM 11780 C CA . ALA D 1 174 ? -15.206 47.203 62.933 1.00 54.46 ? 233 ALA D CA 1 ATOM 11781 C C . ALA D 1 174 ? -14.214 48.200 62.340 1.00 48.43 ? 233 ALA D C 1 ATOM 11782 O O . ALA D 1 174 ? -13.003 48.028 62.452 1.00 53.12 ? 233 ALA D O 1 ATOM 11783 C CB . ALA D 1 174 ? -15.918 47.818 64.126 1.00 41.36 ? 233 ALA D CB 1 ATOM 11784 N N . ILE D 1 175 ? -14.736 49.261 61.733 1.00 47.70 ? 234 ILE D N 1 ATOM 11785 C CA . ILE D 1 175 ? -13.895 50.254 61.074 1.00 40.30 ? 234 ILE D CA 1 ATOM 11786 C C . ILE D 1 175 ? -13.643 51.452 61.984 1.00 46.40 ? 234 ILE D C 1 ATOM 11787 O O . ILE D 1 175 ? -14.584 52.023 62.536 1.00 51.53 ? 234 ILE D O 1 ATOM 11788 C CB . ILE D 1 175 ? -14.533 50.733 59.753 1.00 42.74 ? 234 ILE D CB 1 ATOM 11789 C CG1 . ILE D 1 175 ? -14.836 49.536 58.850 1.00 44.62 ? 234 ILE D CG1 1 ATOM 11790 C CG2 . ILE D 1 175 ? -13.618 51.706 59.028 1.00 39.95 ? 234 ILE D CG2 1 ATOM 11791 C CD1 . ILE D 1 175 ? -13.665 48.593 58.671 1.00 48.25 ? 234 ILE D CD1 1 ATOM 11792 N N . PRO D 1 176 ? -12.360 51.823 62.151 1.00 60.72 ? 235 PRO D N 1 ATOM 11793 C CA . PRO D 1 176 ? -11.911 52.924 63.012 1.00 48.75 ? 235 PRO D CA 1 ATOM 11794 C C . PRO D 1 176 ? -12.714 54.212 62.839 1.00 45.57 ? 235 PRO D C 1 ATOM 11795 O O . PRO D 1 176 ? -12.771 54.773 61.745 1.00 41.17 ? 235 PRO D O 1 ATOM 11796 C CB . PRO D 1 176 ? -10.461 53.130 62.575 1.00 38.73 ? 235 PRO D CB 1 ATOM 11797 C CG . PRO D 1 176 ? -10.018 51.785 62.139 1.00 53.31 ? 235 PRO D CG 1 ATOM 11798 C CD . PRO D 1 176 ? -11.223 51.105 61.544 1.00 39.39 ? 235 PRO D CD 1 ATOM 11799 N N . THR D 1 177 ? -13.328 54.664 63.927 1.00 39.09 ? 236 THR D N 1 ATOM 11800 C CA . THR D 1 177 ? -14.171 55.852 63.905 1.00 39.04 ? 236 THR D CA 1 ATOM 11801 C C . THR D 1 177 ? -13.921 56.703 65.147 1.00 41.61 ? 236 THR D C 1 ATOM 11802 O O . THR D 1 177 ? -13.863 56.182 66.261 1.00 48.15 ? 236 THR D O 1 ATOM 11803 C CB . THR D 1 177 ? -15.665 55.480 63.827 1.00 44.72 ? 236 THR D CB 1 ATOM 11804 O OG1 . THR D 1 177 ? -15.881 54.591 62.725 1.00 39.79 ? 236 THR D OG1 1 ATOM 11805 C CG2 . THR D 1 177 ? -16.521 56.726 63.648 1.00 39.44 ? 236 THR D CG2 1 ATOM 11806 N N . VAL D 1 178 ? -13.772 58.010 64.955 1.00 38.42 ? 237 VAL D N 1 ATOM 11807 C CA . VAL D 1 178 ? -13.505 58.912 66.068 1.00 43.57 ? 237 VAL D CA 1 ATOM 11808 C C . VAL D 1 178 ? -14.426 60.131 66.014 1.00 38.06 ? 237 VAL D C 1 ATOM 11809 O O . VAL D 1 178 ? -14.905 60.513 64.945 1.00 48.16 ? 237 VAL D O 1 ATOM 11810 C CB . VAL D 1 178 ? -12.025 59.373 66.076 1.00 49.60 ? 237 VAL D CB 1 ATOM 11811 C CG1 . VAL D 1 178 ? -11.789 60.444 65.023 1.00 37.38 ? 237 VAL D CG1 1 ATOM 11812 C CG2 . VAL D 1 178 ? -11.620 59.878 67.455 1.00 37.41 ? 237 VAL D CG2 1 ATOM 11813 N N . GLY D 1 179 ? -14.687 60.723 67.175 1.00 47.08 ? 238 GLY D N 1 ATOM 11814 C CA . GLY D 1 179 ? -15.436 61.964 67.248 1.00 37.85 ? 238 GLY D CA 1 ATOM 11815 C C . GLY D 1 179 ? -14.568 63.165 66.926 1.00 44.69 ? 238 GLY D C 1 ATOM 11816 O O . GLY D 1 179 ? -13.357 63.144 67.149 1.00 37.09 ? 238 GLY D O 1 ATOM 11817 N N . ARG D 1 180 ? -15.188 64.215 66.399 1.00 37.29 ? 239 ARG D N 1 ATOM 11818 C CA . ARG D 1 180 ? -14.464 65.436 66.064 1.00 36.85 ? 239 ARG D CA 1 ATOM 11819 C C . ARG D 1 180 ? -15.390 66.647 66.015 1.00 48.52 ? 239 ARG D C 1 ATOM 11820 O O . ARG D 1 180 ? -16.413 66.631 65.329 1.00 41.47 ? 239 ARG D O 1 ATOM 11821 C CB . ARG D 1 180 ? -13.746 65.277 64.722 1.00 36.76 ? 239 ARG D CB 1 ATOM 11822 C CG . ARG D 1 180 ? -12.870 66.460 64.338 1.00 36.30 ? 239 ARG D CG 1 ATOM 11823 C CD . ARG D 1 180 ? -12.191 66.230 62.996 1.00 36.24 ? 239 ARG D CD 1 ATOM 11824 N NE . ARG D 1 180 ? -11.424 67.394 62.562 1.00 42.64 ? 239 ARG D NE 1 ATOM 11825 C CZ . ARG D 1 180 ? -10.324 67.329 61.817 1.00 36.75 ? 239 ARG D CZ 1 ATOM 11826 N NH1 . ARG D 1 180 ? -9.857 66.152 61.423 1.00 38.48 ? 239 ARG D NH1 1 ATOM 11827 N NH2 . ARG D 1 180 ? -9.690 68.439 61.467 1.00 35.25 ? 239 ARG D NH2 1 ATOM 11828 N N . VAL D 1 181 ? -15.028 67.694 66.749 1.00 36.43 ? 240 VAL D N 1 ATOM 11829 C CA . VAL D 1 181 ? -15.774 68.946 66.715 1.00 36.31 ? 240 VAL D CA 1 ATOM 11830 C C . VAL D 1 181 ? -15.147 69.888 65.694 1.00 35.98 ? 240 VAL D C 1 ATOM 11831 O O . VAL D 1 181 ? -13.998 70.301 65.841 1.00 57.08 ? 240 VAL D O 1 ATOM 11832 C CB . VAL D 1 181 ? -15.813 69.628 68.094 1.00 36.12 ? 240 VAL D CB 1 ATOM 11833 C CG1 . VAL D 1 181 ? -16.632 70.910 68.028 1.00 36.00 ? 240 VAL D CG1 1 ATOM 11834 C CG2 . VAL D 1 181 ? -16.380 68.678 69.138 1.00 36.44 ? 240 VAL D CG2 1 ATOM 11835 N N . LEU D 1 182 ? -15.908 70.218 64.656 1.00 46.23 ? 241 LEU D N 1 ATOM 11836 C CA . LEU D 1 182 ? -15.391 71.019 63.551 1.00 46.00 ? 241 LEU D CA 1 ATOM 11837 C C . LEU D 1 182 ? -15.864 72.468 63.566 1.00 35.60 ? 241 LEU D C 1 ATOM 11838 O O . LEU D 1 182 ? -16.985 72.764 63.976 1.00 64.92 ? 241 LEU D O 1 ATOM 11839 C CB . LEU D 1 182 ? -15.781 70.377 62.218 1.00 36.11 ? 241 LEU D CB 1 ATOM 11840 C CG . LEU D 1 182 ? -15.050 69.087 61.853 1.00 44.82 ? 241 LEU D CG 1 ATOM 11841 C CD1 . LEU D 1 182 ? -15.839 67.873 62.307 1.00 38.96 ? 241 LEU D CD1 1 ATOM 11842 C CD2 . LEU D 1 182 ? -14.812 69.039 60.361 1.00 56.90 ? 241 LEU D CD2 1 ATOM 11843 N N . ASN D 1 183 ? -14.994 73.367 63.115 1.00 37.56 ? 242 ASN D N 1 ATOM 11844 C CA . ASN D 1 183 ? -15.394 74.736 62.821 1.00 34.99 ? 242 ASN D CA 1 ATOM 11845 C C . ASN D 1 183 ? -16.056 74.759 61.449 1.00 35.17 ? 242 ASN D C 1 ATOM 11846 O O . ASN D 1 183 ? -15.403 74.518 60.434 1.00 41.87 ? 242 ASN D O 1 ATOM 11847 C CB . ASN D 1 183 ? -14.193 75.686 62.865 1.00 34.53 ? 242 ASN D CB 1 ATOM 11848 C CG . ASN D 1 183 ? -14.583 77.139 62.641 1.00 44.45 ? 242 ASN D CG 1 ATOM 11849 O OD1 . ASN D 1 183 ? -14.969 77.526 61.538 1.00 48.94 ? 242 ASN D OD1 1 ATOM 11850 N ND2 . ASN D 1 183 ? -14.475 77.952 63.687 1.00 45.30 ? 242 ASN D ND2 1 HETATM 11851 N N . MSE D 1 184 ? -17.355 75.040 61.426 1.00 35.38 ? 243 MSE D N 1 HETATM 11852 C CA . MSE D 1 184 ? -18.150 74.937 60.204 1.00 37.86 ? 243 MSE D CA 1 HETATM 11853 C C . MSE D 1 184 ? -17.714 75.909 59.113 1.00 46.08 ? 243 MSE D C 1 HETATM 11854 O O . MSE D 1 184 ? -17.885 75.635 57.926 1.00 45.09 ? 243 MSE D O 1 HETATM 11855 C CB . MSE D 1 184 ? -19.629 75.158 60.523 1.00 48.62 ? 243 MSE D CB 1 HETATM 11856 C CG . MSE D 1 184 ? -20.221 74.115 61.451 1.00 45.71 ? 243 MSE D CG 1 HETATM 11857 SE SE . MSE D 1 184 ? -22.128 74.383 61.729 1.00 66.35 ? 243 MSE D SE 1 HETATM 11858 C CE . MSE D 1 184 ? -22.708 74.340 59.869 1.00 43.93 ? 243 MSE D CE 1 ATOM 11859 N N . THR D 1 185 ? -17.155 77.043 59.517 1.00 38.42 ? 244 THR D N 1 ATOM 11860 C CA . THR D 1 185 ? -16.724 78.058 58.563 1.00 51.09 ? 244 THR D CA 1 ATOM 11861 C C . THR D 1 185 ? -15.387 77.707 57.914 1.00 41.95 ? 244 THR D C 1 ATOM 11862 O O . THR D 1 185 ? -15.267 77.709 56.690 1.00 39.58 ? 244 THR D O 1 ATOM 11863 C CB . THR D 1 185 ? -16.617 79.445 59.226 1.00 47.27 ? 244 THR D CB 1 ATOM 11864 O OG1 . THR D 1 185 ? -16.329 79.288 60.620 1.00 52.75 ? 244 THR D OG1 1 ATOM 11865 C CG2 . THR D 1 185 ? -17.925 80.204 59.073 1.00 43.19 ? 244 THR D CG2 1 ATOM 11866 N N . THR D 1 186 ? -14.389 77.397 58.734 1.00 34.32 ? 245 THR D N 1 ATOM 11867 C CA . THR D 1 186 ? -13.034 77.191 58.232 1.00 43.91 ? 245 THR D CA 1 ATOM 11868 C C . THR D 1 186 ? -12.784 75.768 57.732 1.00 44.42 ? 245 THR D C 1 ATOM 11869 O O . THR D 1 186 ? -12.087 75.575 56.738 1.00 50.08 ? 245 THR D O 1 ATOM 11870 C CB . THR D 1 186 ? -11.983 77.517 59.312 1.00 37.33 ? 245 THR D CB 1 ATOM 11871 O OG1 . THR D 1 186 ? -12.204 76.691 60.462 1.00 43.03 ? 245 THR D OG1 1 ATOM 11872 C CG2 . THR D 1 186 ? -12.071 78.980 59.717 1.00 33.48 ? 245 THR D CG2 1 ATOM 11873 N N . GLU D 1 187 ? -13.346 74.775 58.415 1.00 48.46 ? 246 GLU D N 1 ATOM 11874 C CA . GLU D 1 187 ? -13.063 73.382 58.077 1.00 45.35 ? 246 GLU D CA 1 ATOM 11875 C C . GLU D 1 187 ? -14.120 72.759 57.169 1.00 40.14 ? 246 GLU D C 1 ATOM 11876 O O . GLU D 1 187 ? -13.854 71.762 56.496 1.00 51.67 ? 246 GLU D O 1 ATOM 11877 C CB . GLU D 1 187 ? -12.927 72.540 59.348 1.00 43.56 ? 246 GLU D CB 1 ATOM 11878 C CG . GLU D 1 187 ? -11.757 72.924 60.231 1.00 34.74 ? 246 GLU D CG 1 ATOM 11879 C CD . GLU D 1 187 ? -11.656 72.050 61.464 1.00 43.48 ? 246 GLU D CD 1 ATOM 11880 O OE1 . GLU D 1 187 ? -12.504 72.198 62.368 1.00 38.83 ? 246 GLU D OE1 1 ATOM 11881 O OE2 . GLU D 1 187 ? -10.733 71.210 61.526 1.00 34.86 ? 246 GLU D OE2 1 ATOM 11882 N N . LEU D 1 188 ? -15.315 73.338 57.151 1.00 44.61 ? 247 LEU D N 1 ATOM 11883 C CA . LEU D 1 188 ? -16.388 72.807 56.317 1.00 39.71 ? 247 LEU D CA 1 ATOM 11884 C C . LEU D 1 188 ? -16.717 73.721 55.143 1.00 38.60 ? 247 LEU D C 1 ATOM 11885 O O . LEU D 1 188 ? -16.469 73.367 53.995 1.00 44.72 ? 247 LEU D O 1 ATOM 11886 C CB . LEU D 1 188 ? -17.646 72.561 57.153 1.00 36.17 ? 247 LEU D CB 1 ATOM 11887 C CG . LEU D 1 188 ? -17.590 71.398 58.145 1.00 44.28 ? 247 LEU D CG 1 ATOM 11888 C CD1 . LEU D 1 188 ? -18.970 71.110 58.713 1.00 36.75 ? 247 LEU D CD1 1 ATOM 11889 C CD2 . LEU D 1 188 ? -17.015 70.158 57.481 1.00 36.58 ? 247 LEU D CD2 1 ATOM 11890 N N . PHE D 1 189 ? -17.260 74.899 55.441 1.00 35.60 ? 248 PHE D N 1 ATOM 11891 C CA . PHE D 1 189 ? -17.696 75.843 54.413 1.00 49.75 ? 248 PHE D CA 1 ATOM 11892 C C . PHE D 1 189 ? -16.584 76.215 53.433 1.00 52.03 ? 248 PHE D C 1 ATOM 11893 O O . PHE D 1 189 ? -16.731 76.046 52.222 1.00 43.70 ? 248 PHE D O 1 ATOM 11894 C CB . PHE D 1 189 ? -18.250 77.111 55.067 1.00 39.53 ? 248 PHE D CB 1 ATOM 11895 C CG . PHE D 1 189 ? -18.751 78.133 54.086 1.00 41.74 ? 248 PHE D CG 1 ATOM 11896 C CD1 . PHE D 1 189 ? -19.919 77.913 53.374 1.00 39.01 ? 248 PHE D CD1 1 ATOM 11897 C CD2 . PHE D 1 189 ? -18.060 79.316 53.879 1.00 48.39 ? 248 PHE D CD2 1 ATOM 11898 C CE1 . PHE D 1 189 ? -20.388 78.852 52.475 1.00 36.39 ? 248 PHE D CE1 1 ATOM 11899 C CE2 . PHE D 1 189 ? -18.523 80.258 52.979 1.00 38.98 ? 248 PHE D CE2 1 ATOM 11900 C CZ . PHE D 1 189 ? -19.688 80.025 52.275 1.00 35.01 ? 248 PHE D CZ 1 ATOM 11901 N N . GLU D 1 190 ? -15.475 76.719 53.963 1.00 48.62 ? 249 GLU D N 1 ATOM 11902 C CA . GLU D 1 190 ? -14.366 77.186 53.136 1.00 45.84 ? 249 GLU D CA 1 ATOM 11903 C C . GLU D 1 190 ? -13.628 76.037 52.450 1.00 48.85 ? 249 GLU D C 1 ATOM 11904 O O . GLU D 1 190 ? -12.917 76.247 51.468 1.00 52.12 ? 249 GLU D O 1 ATOM 11905 C CB . GLU D 1 190 ? -13.390 78.010 53.978 1.00 49.64 ? 249 GLU D CB 1 ATOM 11906 C CG . GLU D 1 190 ? -13.905 79.396 54.333 1.00 45.45 ? 249 GLU D CG 1 ATOM 11907 C CD . GLU D 1 190 ? -13.102 80.054 55.437 1.00 55.90 ? 249 GLU D CD 1 ATOM 11908 O OE1 . GLU D 1 190 ? -12.118 79.443 55.903 1.00 62.34 ? 249 GLU D OE1 1 ATOM 11909 O OE2 . GLU D 1 190 ? -13.458 81.181 55.841 1.00 60.68 ? 249 GLU D OE2 1 ATOM 11910 N N . LYS D 1 191 ? -13.798 74.825 52.969 1.00 49.83 ? 250 LYS D N 1 ATOM 11911 C CA . LYS D 1 191 ? -13.145 73.653 52.397 1.00 42.24 ? 250 LYS D CA 1 ATOM 11912 C C . LYS D 1 191 ? -14.099 72.854 51.512 1.00 41.46 ? 250 LYS D C 1 ATOM 11913 O O . LYS D 1 191 ? -13.727 71.812 50.970 1.00 46.59 ? 250 LYS D O 1 ATOM 11914 C CB . LYS D 1 191 ? -12.597 72.753 53.508 1.00 40.08 ? 250 LYS D CB 1 ATOM 11915 C CG . LYS D 1 191 ? -11.586 73.424 54.425 1.00 39.54 ? 250 LYS D CG 1 ATOM 11916 C CD . LYS D 1 191 ? -10.367 73.923 53.670 1.00 59.27 ? 250 LYS D CD 1 ATOM 11917 C CE . LYS D 1 191 ? -9.407 74.641 54.607 1.00 52.53 ? 250 LYS D CE 1 ATOM 11918 N NZ . LYS D 1 191 ? -9.068 73.805 55.793 1.00 54.85 ? 250 LYS D NZ 1 ATOM 11919 N N . ALA D 1 192 ? -15.325 73.348 51.364 1.00 44.36 ? 251 ALA D N 1 ATOM 11920 C CA . ALA D 1 192 ? -16.375 72.605 50.671 1.00 53.77 ? 251 ALA D CA 1 ATOM 11921 C C . ALA D 1 192 ? -16.359 72.816 49.165 1.00 36.12 ? 251 ALA D C 1 ATOM 11922 O O . ALA D 1 192 ? -15.994 73.886 48.677 1.00 35.81 ? 251 ALA D O 1 ATOM 11923 C CB . ALA D 1 192 ? -17.742 72.983 51.225 1.00 47.04 ? 251 ALA D CB 1 ATOM 11924 N N . GLU D 1 193 ? -16.760 71.780 48.436 1.00 44.76 ? 252 GLU D N 1 ATOM 11925 C CA . GLU D 1 193 ? -16.958 71.882 46.997 1.00 36.55 ? 252 GLU D CA 1 ATOM 11926 C C . GLU D 1 193 ? -18.073 72.881 46.698 1.00 59.23 ? 252 GLU D C 1 ATOM 11927 O O . GLU D 1 193 ? -18.884 73.195 47.569 1.00 56.00 ? 252 GLU D O 1 ATOM 11928 C CB . GLU D 1 193 ? -17.277 70.511 46.399 1.00 43.92 ? 252 GLU D CB 1 ATOM 11929 C CG . GLU D 1 193 ? -18.574 69.901 46.897 1.00 49.46 ? 252 GLU D CG 1 ATOM 11930 C CD . GLU D 1 193 ? -18.920 68.614 46.178 1.00 57.37 ? 252 GLU D CD 1 ATOM 11931 O OE1 . GLU D 1 193 ? -19.461 67.696 46.828 1.00 59.09 ? 252 GLU D OE1 1 ATOM 11932 O OE2 . GLU D 1 193 ? -18.660 68.525 44.959 1.00 55.90 ? 252 GLU D OE2 1 ATOM 11933 N N . LYS D 1 194 ? -18.100 73.379 45.466 1.00 62.24 ? 253 LYS D N 1 ATOM 11934 C CA . LYS D 1 194 ? -19.000 74.461 45.079 1.00 57.39 ? 253 LYS D CA 1 ATOM 11935 C C . LYS D 1 194 ? -20.479 74.141 45.319 1.00 61.35 ? 253 LYS D C 1 ATOM 11936 O O . LYS D 1 194 ? -21.211 74.959 45.877 1.00 58.98 ? 253 LYS D O 1 ATOM 11937 C CB . LYS D 1 194 ? -18.780 74.811 43.604 1.00 69.53 ? 253 LYS D CB 1 ATOM 11938 C CG . LYS D 1 194 ? -19.674 75.919 43.074 1.00 85.14 ? 253 LYS D CG 1 ATOM 11939 C CD . LYS D 1 194 ? -19.078 77.284 43.390 1.00 91.56 ? 253 LYS D CD 1 ATOM 11940 C CE . LYS D 1 194 ? -19.868 78.403 42.734 1.00 93.82 ? 253 LYS D CE 1 ATOM 11941 N NZ . LYS D 1 194 ? -19.975 78.227 41.260 1.00 93.34 ? 253 LYS D NZ 1 ATOM 11942 N N . LYS D 1 195 ? -20.915 72.955 44.900 1.00 60.44 ? 254 LYS D N 1 ATOM 11943 C CA . LYS D 1 195 ? -22.324 72.575 45.017 1.00 53.89 ? 254 LYS D CA 1 ATOM 11944 C C . LYS D 1 195 ? -22.769 72.362 46.464 1.00 56.66 ? 254 LYS D C 1 ATOM 11945 O O . LYS D 1 195 ? -23.942 72.543 46.792 1.00 57.89 ? 254 LYS D O 1 ATOM 11946 C CB . LYS D 1 195 ? -22.615 71.319 44.188 1.00 52.23 ? 254 LYS D CB 1 ATOM 11947 C CG . LYS D 1 195 ? -21.877 70.065 44.614 1.00 64.52 ? 254 LYS D CG 1 ATOM 11948 C CD . LYS D 1 195 ? -22.462 68.850 43.906 1.00 67.07 ? 254 LYS D CD 1 ATOM 11949 C CE . LYS D 1 195 ? -21.652 67.592 44.170 1.00 75.96 ? 254 LYS D CE 1 ATOM 11950 N NZ . LYS D 1 195 ? -20.319 67.640 43.510 1.00 85.93 ? 254 LYS D NZ 1 ATOM 11951 N N . LEU D 1 196 ? -21.833 71.983 47.325 1.00 51.51 ? 255 LEU D N 1 ATOM 11952 C CA . LEU D 1 196 ? -22.126 71.840 48.744 1.00 44.97 ? 255 LEU D CA 1 ATOM 11953 C C . LEU D 1 196 ? -22.140 73.224 49.391 1.00 41.80 ? 255 LEU D C 1 ATOM 11954 O O . LEU D 1 196 ? -22.917 73.485 50.312 1.00 42.06 ? 255 LEU D O 1 ATOM 11955 C CB . LEU D 1 196 ? -21.102 70.925 49.431 1.00 46.18 ? 255 LEU D CB 1 ATOM 11956 C CG . LEU D 1 196 ? -21.185 70.822 50.958 1.00 37.60 ? 255 LEU D CG 1 ATOM 11957 C CD1 . LEU D 1 196 ? -22.555 70.325 51.413 1.00 38.02 ? 255 LEU D CD1 1 ATOM 11958 C CD2 . LEU D 1 196 ? -20.078 69.935 51.509 1.00 37.54 ? 255 LEU D CD2 1 ATOM 11959 N N . LYS D 1 197 ? -21.265 74.100 48.904 1.00 48.53 ? 256 LYS D N 1 ATOM 11960 C CA . LYS D 1 197 ? -21.107 75.449 49.445 1.00 45.93 ? 256 LYS D CA 1 ATOM 11961 C C . LYS D 1 197 ? -22.404 76.235 49.372 1.00 38.42 ? 256 LYS D C 1 ATOM 11962 O O . LYS D 1 197 ? -22.714 77.037 50.254 1.00 44.14 ? 256 LYS D O 1 ATOM 11963 C CB . LYS D 1 197 ? -20.005 76.202 48.699 1.00 50.83 ? 256 LYS D CB 1 ATOM 11964 C CG . LYS D 1 197 ? -19.416 77.364 49.473 1.00 59.15 ? 256 LYS D CG 1 ATOM 11965 C CD . LYS D 1 197 ? -18.201 77.922 48.755 1.00 52.73 ? 256 LYS D CD 1 ATOM 11966 C CE . LYS D 1 197 ? -17.245 78.584 49.740 1.00 60.26 ? 256 LYS D CE 1 ATOM 11967 N NZ . LYS D 1 197 ? -16.150 79.352 49.079 1.00 80.21 ? 256 LYS D NZ 1 ATOM 11968 N N . LYS D 1 198 ? -23.154 76.001 48.303 1.00 46.51 ? 257 LYS D N 1 ATOM 11969 C CA . LYS D 1 198 ? -24.380 76.741 48.058 1.00 36.98 ? 257 LYS D CA 1 ATOM 11970 C C . LYS D 1 198 ? -25.498 76.350 49.009 1.00 45.80 ? 257 LYS D C 1 ATOM 11971 O O . LYS D 1 198 ? -26.487 77.069 49.123 1.00 48.38 ? 257 LYS D O 1 ATOM 11972 C CB . LYS D 1 198 ? -24.853 76.527 46.618 1.00 37.20 ? 257 LYS D CB 1 ATOM 11973 C CG . LYS D 1 198 ? -23.954 77.117 45.541 1.00 58.33 ? 257 LYS D CG 1 ATOM 11974 C CD . LYS D 1 198 ? -23.751 78.612 45.738 1.00 80.61 ? 257 LYS D CD 1 ATOM 11975 C CE . LYS D 1 198 ? -22.537 79.101 44.971 1.00 89.41 ? 257 LYS D CE 1 ATOM 11976 N NZ . LYS D 1 198 ? -22.250 80.538 45.228 1.00 88.78 ? 257 LYS D NZ 1 ATOM 11977 N N . THR D 1 199 ? -25.339 75.227 49.699 1.00 39.13 ? 258 THR D N 1 ATOM 11978 C CA . THR D 1 199 ? -26.378 74.744 50.598 1.00 43.94 ? 258 THR D CA 1 ATOM 11979 C C . THR D 1 199 ? -26.207 75.247 52.027 1.00 44.70 ? 258 THR D C 1 ATOM 11980 O O . THR D 1 199 ? -26.921 74.814 52.929 1.00 37.84 ? 258 THR D O 1 ATOM 11981 C CB . THR D 1 199 ? -26.422 73.209 50.615 1.00 43.09 ? 258 THR D CB 1 ATOM 11982 O OG1 . THR D 1 199 ? -25.234 72.703 51.237 1.00 45.38 ? 258 THR D OG1 1 ATOM 11983 C CG2 . THR D 1 199 ? -26.513 72.666 49.198 1.00 38.45 ? 258 THR D CG2 1 ATOM 11984 N N . PHE D 1 200 ? -25.266 76.163 52.232 1.00 39.10 ? 259 PHE D N 1 ATOM 11985 C CA . PHE D 1 200 ? -25.055 76.746 53.553 1.00 36.90 ? 259 PHE D CA 1 ATOM 11986 C C . PHE D 1 200 ? -25.905 77.996 53.744 1.00 43.08 ? 259 PHE D C 1 ATOM 11987 O O . PHE D 1 200 ? -26.185 78.716 52.785 1.00 46.77 ? 259 PHE D O 1 ATOM 11988 C CB . PHE D 1 200 ? -23.577 77.081 53.769 1.00 36.49 ? 259 PHE D CB 1 ATOM 11989 C CG . PHE D 1 200 ? -22.743 75.908 54.205 1.00 36.58 ? 259 PHE D CG 1 ATOM 11990 C CD1 . PHE D 1 200 ? -22.341 74.945 53.294 1.00 36.95 ? 259 PHE D CD1 1 ATOM 11991 C CD2 . PHE D 1 200 ? -22.353 75.776 55.527 1.00 36.48 ? 259 PHE D CD2 1 ATOM 11992 C CE1 . PHE D 1 200 ? -21.569 73.868 53.697 1.00 41.55 ? 259 PHE D CE1 1 ATOM 11993 C CE2 . PHE D 1 200 ? -21.582 74.704 55.936 1.00 46.19 ? 259 PHE D CE2 1 ATOM 11994 C CZ . PHE D 1 200 ? -21.189 73.748 55.021 1.00 36.74 ? 259 PHE D CZ 1 ATOM 11995 N N . PHE D 1 201 ? -26.305 78.252 54.987 1.00 40.83 ? 260 PHE D N 1 ATOM 11996 C CA . PHE D 1 201 ? -27.110 79.425 55.314 1.00 39.89 ? 260 PHE D CA 1 ATOM 11997 C C . PHE D 1 201 ? -27.138 79.669 56.819 1.00 41.75 ? 260 PHE D C 1 ATOM 11998 O O . PHE D 1 201 ? -26.643 78.856 57.600 1.00 39.39 ? 260 PHE D O 1 ATOM 11999 C CB . PHE D 1 201 ? -28.540 79.272 54.781 1.00 36.97 ? 260 PHE D CB 1 ATOM 12000 C CG . PHE D 1 201 ? -29.337 78.199 55.470 1.00 41.62 ? 260 PHE D CG 1 ATOM 12001 C CD1 . PHE D 1 201 ? -29.219 76.873 55.086 1.00 39.21 ? 260 PHE D CD1 1 ATOM 12002 C CD2 . PHE D 1 201 ? -30.218 78.520 56.491 1.00 37.48 ? 260 PHE D CD2 1 ATOM 12003 C CE1 . PHE D 1 201 ? -29.955 75.885 55.717 1.00 38.15 ? 260 PHE D CE1 1 ATOM 12004 C CE2 . PHE D 1 201 ? -30.957 77.537 57.125 1.00 42.36 ? 260 PHE D CE2 1 ATOM 12005 C CZ . PHE D 1 201 ? -30.826 76.218 56.736 1.00 40.61 ? 260 PHE D CZ 1 ATOM 12006 N N . PHE D 1 202 ? -27.721 80.795 57.217 1.00 36.29 ? 261 PHE D N 1 ATOM 12007 C CA . PHE D 1 202 ? -27.893 81.118 58.628 1.00 36.19 ? 261 PHE D CA 1 ATOM 12008 C C . PHE D 1 202 ? -29.356 81.005 59.041 1.00 36.52 ? 261 PHE D C 1 ATOM 12009 O O . PHE D 1 202 ? -30.245 81.526 58.367 1.00 36.60 ? 261 PHE D O 1 ATOM 12010 C CB . PHE D 1 202 ? -27.368 82.523 58.931 1.00 37.19 ? 261 PHE D CB 1 ATOM 12011 C CG . PHE D 1 202 ? -25.870 82.628 58.919 1.00 38.36 ? 261 PHE D CG 1 ATOM 12012 C CD1 . PHE D 1 202 ? -25.196 82.993 57.764 1.00 35.18 ? 261 PHE D CD1 1 ATOM 12013 C CD2 . PHE D 1 202 ? -25.134 82.363 60.062 1.00 35.94 ? 261 PHE D CD2 1 ATOM 12014 C CE1 . PHE D 1 202 ? -23.817 83.091 57.750 1.00 34.87 ? 261 PHE D CE1 1 ATOM 12015 C CE2 . PHE D 1 202 ? -23.754 82.460 60.055 1.00 35.45 ? 261 PHE D CE2 1 ATOM 12016 C CZ . PHE D 1 202 ? -23.095 82.824 58.897 1.00 34.75 ? 261 PHE D CZ 1 ATOM 12017 N N . SER D 1 203 ? -29.596 80.321 60.153 1.00 36.71 ? 262 SER D N 1 ATOM 12018 C CA . SER D 1 203 ? -30.942 80.173 60.692 1.00 37.03 ? 262 SER D CA 1 ATOM 12019 C C . SER D 1 203 ? -31.431 81.513 61.244 1.00 38.75 ? 262 SER D C 1 ATOM 12020 O O . SER D 1 203 ? -30.630 82.429 61.431 1.00 37.99 ? 262 SER D O 1 ATOM 12021 C CB . SER D 1 203 ? -30.956 79.093 61.780 1.00 37.28 ? 262 SER D CB 1 ATOM 12022 O OG . SER D 1 203 ? -30.540 79.614 63.029 1.00 37.19 ? 262 SER D OG 1 ATOM 12023 N N . PRO D 1 204 ? -32.749 81.645 61.491 1.00 42.23 ? 263 PRO D N 1 ATOM 12024 C CA . PRO D 1 204 ? -33.250 82.881 62.108 1.00 43.06 ? 263 PRO D CA 1 ATOM 12025 C C . PRO D 1 204 ? -32.604 83.170 63.463 1.00 40.12 ? 263 PRO D C 1 ATOM 12026 O O . PRO D 1 204 ? -32.604 84.316 63.912 1.00 48.63 ? 263 PRO D O 1 ATOM 12027 C CB . PRO D 1 204 ? -34.756 82.619 62.260 1.00 37.13 ? 263 PRO D CB 1 ATOM 12028 C CG . PRO D 1 204 ? -34.927 81.140 62.080 1.00 45.34 ? 263 PRO D CG 1 ATOM 12029 C CD . PRO D 1 204 ? -33.850 80.737 61.129 1.00 47.50 ? 263 PRO D CD 1 ATOM 12030 N N . ALA D 1 205 ? -32.064 82.138 64.102 1.00 36.60 ? 264 ALA D N 1 ATOM 12031 C CA . ALA D 1 205 ? -31.358 82.301 65.366 1.00 36.36 ? 264 ALA D CA 1 ATOM 12032 C C . ALA D 1 205 ? -29.877 82.591 65.130 1.00 35.97 ? 264 ALA D C 1 ATOM 12033 O O . ALA D 1 205 ? -29.084 82.588 66.073 1.00 49.13 ? 264 ALA D O 1 ATOM 12034 C CB . ALA D 1 205 ? -31.524 81.062 66.233 1.00 36.70 ? 264 ALA D CB 1 ATOM 12035 N N . LYS D 1 206 ? -29.512 82.807 63.866 1.00 38.93 ? 265 LYS D N 1 ATOM 12036 C CA . LYS D 1 206 ? -28.135 83.125 63.472 1.00 54.43 ? 265 LYS D CA 1 ATOM 12037 C C . LYS D 1 206 ? -27.155 81.974 63.687 1.00 54.79 ? 265 LYS D C 1 ATOM 12038 O O . LYS D 1 206 ? -25.952 82.196 63.813 1.00 47.75 ? 265 LYS D O 1 ATOM 12039 C CB . LYS D 1 206 ? -27.621 84.383 64.184 1.00 35.06 ? 265 LYS D CB 1 ATOM 12040 C CG . LYS D 1 206 ? -28.105 85.691 63.578 1.00 35.15 ? 265 LYS D CG 1 ATOM 12041 C CD . LYS D 1 206 ? -28.855 86.561 64.564 1.00 56.22 ? 265 LYS D CD 1 ATOM 12042 C CE . LYS D 1 206 ? -29.830 87.467 63.830 1.00 73.36 ? 265 LYS D CE 1 ATOM 12043 N NZ . LYS D 1 206 ? -30.818 86.683 63.041 1.00 69.01 ? 265 LYS D NZ 1 ATOM 12044 N N . ASN D 1 207 ? -27.671 80.751 63.733 1.00 36.05 ? 266 ASN D N 1 ATOM 12045 C CA . ASN D 1 207 ? -26.810 79.577 63.756 1.00 41.95 ? 266 ASN D CA 1 ATOM 12046 C C . ASN D 1 207 ? -26.403 79.215 62.333 1.00 36.23 ? 266 ASN D C 1 ATOM 12047 O O . ASN D 1 207 ? -27.181 79.401 61.397 1.00 43.30 ? 266 ASN D O 1 ATOM 12048 C CB . ASN D 1 207 ? -27.510 78.392 64.424 1.00 36.61 ? 266 ASN D CB 1 ATOM 12049 C CG . ASN D 1 207 ? -27.783 78.624 65.896 1.00 37.94 ? 266 ASN D CG 1 ATOM 12050 O OD1 . ASN D 1 207 ? -26.943 79.159 66.618 1.00 36.21 ? 266 ASN D OD1 1 ATOM 12051 N ND2 . ASN D 1 207 ? -28.965 78.221 66.349 1.00 42.84 ? 266 ASN D ND2 1 ATOM 12052 N N . PHE D 1 208 ? -25.190 78.698 62.167 1.00 36.11 ? 267 PHE D N 1 ATOM 12053 C CA . PHE D 1 208 ? -24.704 78.330 60.842 1.00 36.15 ? 267 PHE D CA 1 ATOM 12054 C C . PHE D 1 208 ? -25.244 76.958 60.458 1.00 42.95 ? 267 PHE D C 1 ATOM 12055 O O . PHE D 1 208 ? -25.185 76.016 61.249 1.00 45.99 ? 267 PHE D O 1 ATOM 12056 C CB . PHE D 1 208 ? -23.174 78.338 60.802 1.00 36.72 ? 267 PHE D CB 1 ATOM 12057 C CG . PHE D 1 208 ? -22.602 78.531 59.426 1.00 39.90 ? 267 PHE D CG 1 ATOM 12058 C CD1 . PHE D 1 208 ? -23.304 79.237 58.462 1.00 36.88 ? 267 PHE D CD1 1 ATOM 12059 C CD2 . PHE D 1 208 ? -21.362 78.010 59.097 1.00 40.55 ? 267 PHE D CD2 1 ATOM 12060 C CE1 . PHE D 1 208 ? -22.781 79.418 57.196 1.00 35.60 ? 267 PHE D CE1 1 ATOM 12061 C CE2 . PHE D 1 208 ? -20.833 78.187 57.832 1.00 37.10 ? 267 PHE D CE2 1 ATOM 12062 C CZ . PHE D 1 208 ? -21.544 78.893 56.880 1.00 36.15 ? 267 PHE D CZ 1 ATOM 12063 N N . CYS D 1 209 ? -25.771 76.847 59.243 1.00 36.82 ? 268 CYS D N 1 ATOM 12064 C CA . CYS D 1 209 ? -26.458 75.629 58.830 1.00 43.64 ? 268 CYS D CA 1 ATOM 12065 C C . CYS D 1 209 ? -26.121 75.241 57.396 1.00 42.74 ? 268 CYS D C 1 ATOM 12066 O O . CYS D 1 209 ? -25.819 76.100 56.570 1.00 45.20 ? 268 CYS D O 1 ATOM 12067 C CB . CYS D 1 209 ? -27.973 75.801 58.970 1.00 37.60 ? 268 CYS D CB 1 ATOM 12068 S SG . CYS D 1 209 ? -28.546 76.183 60.643 1.00 39.56 ? 268 CYS D SG 1 ATOM 12069 N N . PHE D 1 210 ? -26.178 73.944 57.104 1.00 38.49 ? 269 PHE D N 1 ATOM 12070 C CA . PHE D 1 210 ? -26.050 73.471 55.729 1.00 43.98 ? 269 PHE D CA 1 ATOM 12071 C C . PHE D 1 210 ? -27.106 72.416 55.406 1.00 38.41 ? 269 PHE D C 1 ATOM 12072 O O . PHE D 1 210 ? -27.505 71.629 56.264 1.00 38.68 ? 269 PHE D O 1 ATOM 12073 C CB . PHE D 1 210 ? -24.639 72.924 55.454 1.00 37.71 ? 269 PHE D CB 1 ATOM 12074 C CG . PHE D 1 210 ? -24.260 71.727 56.288 1.00 37.89 ? 269 PHE D CG 1 ATOM 12075 C CD1 . PHE D 1 210 ? -24.652 70.449 55.919 1.00 38.32 ? 269 PHE D CD1 1 ATOM 12076 C CD2 . PHE D 1 210 ? -23.479 71.878 57.421 1.00 37.63 ? 269 PHE D CD2 1 ATOM 12077 C CE1 . PHE D 1 210 ? -24.298 69.351 56.680 1.00 38.49 ? 269 PHE D CE1 1 ATOM 12078 C CE2 . PHE D 1 210 ? -23.117 70.783 58.184 1.00 38.21 ? 269 PHE D CE2 1 ATOM 12079 C CZ . PHE D 1 210 ? -23.525 69.518 57.810 1.00 38.22 ? 269 PHE D CZ 1 ATOM 12080 N N . VAL D 1 211 ? -27.554 72.420 54.155 1.00 47.91 ? 270 VAL D N 1 ATOM 12081 C CA . VAL D 1 211 ? -28.568 71.488 53.679 1.00 39.07 ? 270 VAL D CA 1 ATOM 12082 C C . VAL D 1 211 ? -27.929 70.256 53.045 1.00 39.26 ? 270 VAL D C 1 ATOM 12083 O O . VAL D 1 211 ? -28.424 69.137 53.200 1.00 49.92 ? 270 VAL D O 1 ATOM 12084 C CB . VAL D 1 211 ? -29.505 72.168 52.655 1.00 50.16 ? 270 VAL D CB 1 ATOM 12085 C CG1 . VAL D 1 211 ? -30.450 71.159 52.027 1.00 39.68 ? 270 VAL D CG1 1 ATOM 12086 C CG2 . VAL D 1 211 ? -30.284 73.294 53.314 1.00 39.02 ? 270 VAL D CG2 1 ATOM 12087 N N . SER D 1 212 ? -26.818 70.478 52.344 1.00 38.96 ? 271 SER D N 1 ATOM 12088 C CA . SER D 1 212 ? -26.146 69.448 51.551 1.00 40.95 ? 271 SER D CA 1 ATOM 12089 C C . SER D 1 212 ? -27.070 68.905 50.463 1.00 40.83 ? 271 SER D C 1 ATOM 12090 O O . SER D 1 212 ? -28.093 69.512 50.147 1.00 48.05 ? 271 SER D O 1 ATOM 12091 C CB . SER D 1 212 ? -25.642 68.307 52.440 1.00 39.23 ? 271 SER D CB 1 ATOM 12092 O OG . SER D 1 212 ? -24.880 67.378 51.690 1.00 41.91 ? 271 SER D OG 1 ATOM 12093 N N . ARG D 1 213 ? -26.704 67.767 49.884 1.00 42.35 ? 272 ARG D N 1 ATOM 12094 C CA . ARG D 1 213 ? -27.532 67.140 48.861 1.00 40.13 ? 272 ARG D CA 1 ATOM 12095 C C . ARG D 1 213 ? -27.616 65.635 49.089 1.00 40.53 ? 272 ARG D C 1 ATOM 12096 O O . ARG D 1 213 ? -26.592 64.952 49.129 1.00 65.35 ? 272 ARG D O 1 ATOM 12097 C CB . ARG D 1 213 ? -26.950 67.430 47.474 1.00 44.23 ? 272 ARG D CB 1 ATOM 12098 C CG . ARG D 1 213 ? -26.963 68.902 47.077 1.00 60.34 ? 272 ARG D CG 1 ATOM 12099 C CD . ARG D 1 213 ? -26.146 69.149 45.813 1.00 85.65 ? 272 ARG D CD 1 ATOM 12100 N NE . ARG D 1 213 ? -26.712 68.511 44.628 1.00 93.61 ? 272 ARG D NE 1 ATOM 12101 C CZ . ARG D 1 213 ? -27.509 69.126 43.761 1.00 91.26 ? 272 ARG D CZ 1 ATOM 12102 N NH1 . ARG D 1 213 ? -27.831 70.400 43.942 1.00 93.68 ? 272 ARG D NH1 1 ATOM 12103 N NH2 . ARG D 1 213 ? -27.978 68.471 42.708 1.00 86.88 ? 272 ARG D NH2 1 ATOM 12104 N N . CYS D 1 214 ? -28.838 65.123 49.224 1.00 40.97 ? 273 CYS D N 1 ATOM 12105 C CA . CYS D 1 214 ? -29.059 63.690 49.402 1.00 44.56 ? 273 CYS D CA 1 ATOM 12106 C C . CYS D 1 214 ? -30.538 63.334 49.245 1.00 41.89 ? 273 CYS D C 1 ATOM 12107 O O . CYS D 1 214 ? -31.385 64.216 49.103 1.00 61.44 ? 273 CYS D O 1 ATOM 12108 C CB . CYS D 1 214 ? -28.555 63.228 50.771 1.00 41.34 ? 273 CYS D CB 1 ATOM 12109 S SG . CYS D 1 214 ? -29.582 63.726 52.170 1.00 53.30 ? 273 CYS D SG 1 ATOM 12110 N N . ASP D 1 215 ? -30.842 62.040 49.275 1.00 49.17 ? 274 ASP D N 1 ATOM 12111 C CA . ASP D 1 215 ? -32.210 61.567 49.080 1.00 57.19 ? 274 ASP D CA 1 ATOM 12112 C C . ASP D 1 215 ? -33.077 61.673 50.336 1.00 45.40 ? 274 ASP D C 1 ATOM 12113 O O . ASP D 1 215 ? -34.281 61.913 50.243 1.00 52.47 ? 274 ASP D O 1 ATOM 12114 C CB . ASP D 1 215 ? -32.202 60.116 48.593 1.00 67.36 ? 274 ASP D CB 1 ATOM 12115 C CG . ASP D 1 215 ? -31.606 59.969 47.208 1.00 78.12 ? 274 ASP D CG 1 ATOM 12116 O OD1 . ASP D 1 215 ? -31.653 60.947 46.433 1.00 58.63 ? 274 ASP D OD1 1 ATOM 12117 O OD2 . ASP D 1 215 ? -31.093 58.874 46.894 1.00 89.26 ? 274 ASP D OD2 1 ATOM 12118 N N . TYR D 1 216 ? -32.468 61.501 51.506 1.00 54.58 ? 275 TYR D N 1 ATOM 12119 C CA . TYR D 1 216 ? -33.239 61.401 52.741 1.00 43.03 ? 275 TYR D CA 1 ATOM 12120 C C . TYR D 1 216 ? -33.185 62.673 53.581 1.00 42.63 ? 275 TYR D C 1 ATOM 12121 O O . TYR D 1 216 ? -32.344 62.810 54.469 1.00 47.14 ? 275 TYR D O 1 ATOM 12122 C CB . TYR D 1 216 ? -32.760 60.210 53.577 1.00 49.38 ? 275 TYR D CB 1 ATOM 12123 C CG . TYR D 1 216 ? -33.719 59.828 54.682 1.00 67.71 ? 275 TYR D CG 1 ATOM 12124 C CD1 . TYR D 1 216 ? -34.831 59.040 54.416 1.00 75.18 ? 275 TYR D CD1 1 ATOM 12125 C CD2 . TYR D 1 216 ? -33.512 60.249 55.989 1.00 82.79 ? 275 TYR D CD2 1 ATOM 12126 C CE1 . TYR D 1 216 ? -35.713 58.688 55.419 1.00 77.22 ? 275 TYR D CE1 1 ATOM 12127 C CE2 . TYR D 1 216 ? -34.387 59.898 57.000 1.00 69.67 ? 275 TYR D CE2 1 ATOM 12128 C CZ . TYR D 1 216 ? -35.487 59.118 56.707 1.00 72.19 ? 275 TYR D CZ 1 ATOM 12129 O OH . TYR D 1 216 ? -36.364 58.768 57.705 1.00 74.19 ? 275 TYR D OH 1 ATOM 12130 N N . TYR D 1 217 ? -34.093 63.595 53.279 1.00 52.70 ? 276 TYR D N 1 ATOM 12131 C CA . TYR D 1 217 ? -34.332 64.790 54.084 1.00 42.34 ? 276 TYR D CA 1 ATOM 12132 C C . TYR D 1 217 ? -33.140 65.734 54.198 1.00 47.26 ? 276 TYR D C 1 ATOM 12133 O O . TYR D 1 217 ? -32.940 66.363 55.237 1.00 41.49 ? 276 TYR D O 1 ATOM 12134 C CB . TYR D 1 217 ? -34.798 64.398 55.486 1.00 42.53 ? 276 TYR D CB 1 ATOM 12135 C CG . TYR D 1 217 ? -36.154 63.735 55.500 1.00 54.58 ? 276 TYR D CG 1 ATOM 12136 C CD1 . TYR D 1 217 ? -37.292 64.438 55.129 1.00 43.21 ? 276 TYR D CD1 1 ATOM 12137 C CD2 . TYR D 1 217 ? -36.297 62.409 55.880 1.00 43.49 ? 276 TYR D CD2 1 ATOM 12138 C CE1 . TYR D 1 217 ? -38.533 63.838 55.137 1.00 50.80 ? 276 TYR D CE1 1 ATOM 12139 C CE2 . TYR D 1 217 ? -37.532 61.800 55.892 1.00 44.01 ? 276 TYR D CE2 1 ATOM 12140 C CZ . TYR D 1 217 ? -38.648 62.519 55.520 1.00 45.40 ? 276 TYR D CZ 1 ATOM 12141 O OH . TYR D 1 217 ? -39.884 61.915 55.530 1.00 55.98 ? 276 TYR D OH 1 ATOM 12142 N N . CYS D 1 218 ? -32.345 65.832 53.138 1.00 41.56 ? 277 CYS D N 1 ATOM 12143 C CA . CYS D 1 218 ? -31.435 66.961 53.003 1.00 41.02 ? 277 CYS D CA 1 ATOM 12144 C C . CYS D 1 218 ? -32.217 68.170 52.506 1.00 43.12 ? 277 CYS D C 1 ATOM 12145 O O . CYS D 1 218 ? -32.154 68.522 51.328 1.00 52.30 ? 277 CYS D O 1 ATOM 12146 C CB . CYS D 1 218 ? -30.278 66.644 52.054 1.00 40.84 ? 277 CYS D CB 1 ATOM 12147 S SG . CYS D 1 218 ? -29.003 65.578 52.758 1.00 42.04 ? 277 CYS D SG 1 ATOM 12148 N N . ASP D 1 219 ? -32.968 68.792 53.410 1.00 40.90 ? 278 ASP D N 1 ATOM 12149 C CA . ASP D 1 219 ? -33.743 69.984 53.081 1.00 40.78 ? 278 ASP D CA 1 ATOM 12150 C C . ASP D 1 219 ? -33.618 71.035 54.179 1.00 40.42 ? 278 ASP D C 1 ATOM 12151 O O . ASP D 1 219 ? -32.990 70.794 55.210 1.00 57.71 ? 278 ASP D O 1 ATOM 12152 C CB . ASP D 1 219 ? -35.214 69.624 52.837 1.00 41.27 ? 278 ASP D CB 1 ATOM 12153 C CG . ASP D 1 219 ? -35.810 68.786 53.955 1.00 42.09 ? 278 ASP D CG 1 ATOM 12154 O OD1 . ASP D 1 219 ? -36.607 67.875 53.647 1.00 42.10 ? 278 ASP D OD1 1 ATOM 12155 O OD2 . ASP D 1 219 ? -35.498 69.037 55.137 1.00 41.80 ? 278 ASP D OD2 1 ATOM 12156 N N . THR D 1 220 ? -34.222 72.197 53.949 1.00 49.52 ? 279 THR D N 1 ATOM 12157 C CA . THR D 1 220 ? -34.133 73.324 54.873 1.00 39.95 ? 279 THR D CA 1 ATOM 12158 C C . THR D 1 220 ? -34.621 72.971 56.275 1.00 46.40 ? 279 THR D C 1 ATOM 12159 O O . THR D 1 220 ? -33.979 73.313 57.269 1.00 44.02 ? 279 THR D O 1 ATOM 12160 C CB . THR D 1 220 ? -34.947 74.526 54.361 1.00 39.77 ? 279 THR D CB 1 ATOM 12161 O OG1 . THR D 1 220 ? -34.531 74.860 53.032 1.00 40.33 ? 279 THR D OG1 1 ATOM 12162 C CG2 . THR D 1 220 ? -34.757 75.730 55.273 1.00 39.35 ? 279 THR D CG2 1 ATOM 12163 N N . THR D 1 221 ? -35.759 72.288 56.343 1.00 40.52 ? 280 THR D N 1 ATOM 12164 C CA . THR D 1 221 ? -36.365 71.914 57.617 1.00 40.73 ? 280 THR D CA 1 ATOM 12165 C C . THR D 1 221 ? -35.442 71.023 58.445 1.00 43.46 ? 280 THR D C 1 ATOM 12166 O O . THR D 1 221 ? -35.364 71.158 59.667 1.00 55.43 ? 280 THR D O 1 ATOM 12167 C CB . THR D 1 221 ? -37.710 71.185 57.399 1.00 42.36 ? 280 THR D CB 1 ATOM 12168 O OG1 . THR D 1 221 ? -38.588 72.017 56.631 1.00 41.31 ? 280 THR D OG1 1 ATOM 12169 C CG2 . THR D 1 221 ? -38.370 70.850 58.730 1.00 41.51 ? 280 THR D CG2 1 ATOM 12170 N N . HIS D 1 222 ? -34.729 70.125 57.772 1.00 40.82 ? 281 HIS D N 1 ATOM 12171 C CA . HIS D 1 222 ? -33.859 69.173 58.454 1.00 40.84 ? 281 HIS D CA 1 ATOM 12172 C C . HIS D 1 222 ? -32.381 69.493 58.243 1.00 40.38 ? 281 HIS D C 1 ATOM 12173 O O . HIS D 1 222 ? -31.533 68.600 58.271 1.00 40.41 ? 281 HIS D O 1 ATOM 12174 C CB . HIS D 1 222 ? -34.158 67.750 57.980 1.00 41.33 ? 281 HIS D CB 1 ATOM 12175 C CG . HIS D 1 222 ? -35.583 67.335 58.177 1.00 41.81 ? 281 HIS D CG 1 ATOM 12176 N ND1 . HIS D 1 222 ? -36.572 67.609 57.257 1.00 42.03 ? 281 HIS D ND1 1 ATOM 12177 C CD2 . HIS D 1 222 ? -36.187 66.669 59.189 1.00 42.13 ? 281 HIS D CD2 1 ATOM 12178 C CE1 . HIS D 1 222 ? -37.722 67.129 57.693 1.00 42.46 ? 281 HIS D CE1 1 ATOM 12179 N NE2 . HIS D 1 222 ? -37.516 66.553 58.863 1.00 51.06 ? 281 HIS D NE2 1 ATOM 12180 N N . ALA D 1 223 ? -32.078 70.770 58.030 1.00 39.96 ? 282 ALA D N 1 ATOM 12181 C CA . ALA D 1 223 ? -30.697 71.210 57.862 1.00 39.51 ? 282 ALA D CA 1 ATOM 12182 C C . ALA D 1 223 ? -29.878 70.944 59.120 1.00 39.33 ? 282 ALA D C 1 ATOM 12183 O O . ALA D 1 223 ? -30.408 70.955 60.230 1.00 46.48 ? 282 ALA D O 1 ATOM 12184 C CB . ALA D 1 223 ? -30.652 72.685 57.503 1.00 39.11 ? 282 ALA D CB 1 ATOM 12185 N N . ILE D 1 224 ? -28.583 70.706 58.940 1.00 42.52 ? 283 ILE D N 1 ATOM 12186 C CA . ILE D 1 224 ? -27.674 70.523 60.064 1.00 38.88 ? 283 ILE D CA 1 ATOM 12187 C C . ILE D 1 224 ? -27.167 71.881 60.535 1.00 38.38 ? 283 ILE D C 1 ATOM 12188 O O . ILE D 1 224 ? -26.652 72.662 59.738 1.00 43.38 ? 283 ILE D O 1 ATOM 12189 C CB . ILE D 1 224 ? -26.486 69.623 59.684 1.00 38.84 ? 283 ILE D CB 1 ATOM 12190 C CG1 . ILE D 1 224 ? -26.973 68.211 59.346 1.00 39.34 ? 283 ILE D CG1 1 ATOM 12191 C CG2 . ILE D 1 224 ? -25.457 69.592 60.799 1.00 38.56 ? 283 ILE D CG2 1 ATOM 12192 C CD1 . ILE D 1 224 ? -27.632 67.498 60.504 1.00 39.65 ? 283 ILE D CD1 1 ATOM 12193 N N . CYS D 1 225 ? -27.306 72.161 61.828 1.00 46.62 ? 284 CYS D N 1 ATOM 12194 C CA . CYS D 1 225 ? -27.020 73.496 62.344 1.00 37.86 ? 284 CYS D CA 1 ATOM 12195 C C . CYS D 1 225 ? -26.096 73.480 63.560 1.00 37.61 ? 284 CYS D C 1 ATOM 12196 O O . CYS D 1 225 ? -26.207 72.616 64.429 1.00 37.84 ? 284 CYS D O 1 ATOM 12197 C CB . CYS D 1 225 ? -28.326 74.209 62.707 1.00 37.96 ? 284 CYS D CB 1 ATOM 12198 S SG . CYS D 1 225 ? -29.452 74.495 61.317 1.00 38.20 ? 284 CYS D SG 1 ATOM 12199 N N . GLY D 1 226 ? -25.181 74.444 63.607 1.00 37.15 ? 285 GLY D N 1 ATOM 12200 C CA . GLY D 1 226 ? -24.274 74.597 64.730 1.00 36.87 ? 285 GLY D CA 1 ATOM 12201 C C . GLY D 1 226 ? -24.849 75.494 65.809 1.00 40.63 ? 285 GLY D C 1 ATOM 12202 O O . GLY D 1 226 ? -26.002 75.912 65.725 1.00 37.50 ? 285 GLY D O 1 ATOM 12203 N N . LEU D 1 227 ? -24.049 75.787 66.830 1.00 36.45 ? 286 LEU D N 1 ATOM 12204 C CA . LEU D 1 227 ? -24.478 76.697 67.891 1.00 45.26 ? 286 LEU D CA 1 ATOM 12205 C C . LEU D 1 227 ? -23.389 77.678 68.334 1.00 35.78 ? 286 LEU D C 1 ATOM 12206 O O . LEU D 1 227 ? -22.900 77.595 69.460 1.00 47.10 ? 286 LEU D O 1 ATOM 12207 C CB . LEU D 1 227 ? -24.967 75.904 69.102 1.00 36.55 ? 286 LEU D CB 1 ATOM 12208 C CG . LEU D 1 227 ? -26.428 75.458 69.073 1.00 55.39 ? 286 LEU D CG 1 ATOM 12209 C CD1 . LEU D 1 227 ? -26.803 74.758 70.368 1.00 52.68 ? 286 LEU D CD1 1 ATOM 12210 C CD2 . LEU D 1 227 ? -27.337 76.648 68.829 1.00 41.58 ? 286 LEU D CD2 1 ATOM 12211 N N . PRO D 1 228 ? -23.020 78.627 67.459 1.00 35.48 ? 287 PRO D N 1 ATOM 12212 C CA . PRO D 1 228 ? -23.595 78.826 66.127 1.00 35.60 ? 287 PRO D CA 1 ATOM 12213 C C . PRO D 1 228 ? -22.771 78.203 64.998 1.00 39.37 ? 287 PRO D C 1 ATOM 12214 O O . PRO D 1 228 ? -23.336 77.874 63.957 1.00 45.69 ? 287 PRO D O 1 ATOM 12215 C CB . PRO D 1 228 ? -23.615 80.347 65.997 1.00 35.22 ? 287 PRO D CB 1 ATOM 12216 C CG . PRO D 1 228 ? -22.389 80.769 66.731 1.00 34.84 ? 287 PRO D CG 1 ATOM 12217 C CD . PRO D 1 228 ? -22.228 79.796 67.884 1.00 35.10 ? 287 PRO D CD 1 ATOM 12218 N N . ASP D 1 229 ? -21.467 78.032 65.201 1.00 35.38 ? 288 ASP D N 1 ATOM 12219 C CA . ASP D 1 229 ? -20.575 77.699 64.092 1.00 37.49 ? 288 ASP D CA 1 ATOM 12220 C C . ASP D 1 229 ? -19.685 76.480 64.331 1.00 35.42 ? 288 ASP D C 1 ATOM 12221 O O . ASP D 1 229 ? -18.732 76.254 63.586 1.00 45.16 ? 288 ASP D O 1 ATOM 12222 C CB . ASP D 1 229 ? -19.692 78.905 63.761 1.00 34.85 ? 288 ASP D CB 1 ATOM 12223 C CG . ASP D 1 229 ? -18.832 79.337 64.932 1.00 41.64 ? 288 ASP D CG 1 ATOM 12224 O OD1 . ASP D 1 229 ? -19.195 79.023 66.085 1.00 47.17 ? 288 ASP D OD1 1 ATOM 12225 O OD2 . ASP D 1 229 ? -17.793 79.991 64.701 1.00 44.82 ? 288 ASP D OD2 1 HETATM 12226 N N . MSE D 1 230 ? -19.986 75.695 65.360 1.00 35.65 ? 289 MSE D N 1 HETATM 12227 C CA . MSE D 1 230 ? -19.265 74.442 65.567 1.00 35.79 ? 289 MSE D CA 1 HETATM 12228 C C . MSE D 1 230 ? -20.197 73.262 65.323 1.00 53.89 ? 289 MSE D C 1 HETATM 12229 O O . MSE D 1 230 ? -21.414 73.382 65.465 1.00 46.48 ? 289 MSE D O 1 HETATM 12230 C CB . MSE D 1 230 ? -18.662 74.369 66.974 1.00 35.64 ? 289 MSE D CB 1 HETATM 12231 C CG . MSE D 1 230 ? -19.622 73.899 68.057 1.00 80.06 ? 289 MSE D CG 1 HETATM 12232 SE SE . MSE D 1 230 ? -20.963 75.230 68.515 1.00 83.33 ? 289 MSE D SE 1 HETATM 12233 C CE . MSE D 1 230 ? -19.765 76.688 69.015 1.00 40.62 ? 289 MSE D CE 1 ATOM 12234 N N . LYS D 1 231 ? -19.624 72.125 64.945 1.00 37.50 ? 290 LYS D N 1 ATOM 12235 C CA . LYS D 1 231 ? -20.422 70.940 64.665 1.00 36.93 ? 290 LYS D CA 1 ATOM 12236 C C . LYS D 1 231 ? -19.640 69.656 64.904 1.00 37.06 ? 290 LYS D C 1 ATOM 12237 O O . LYS D 1 231 ? -18.685 69.353 64.189 1.00 37.04 ? 290 LYS D O 1 ATOM 12238 C CB . LYS D 1 231 ? -20.939 70.976 63.225 1.00 37.08 ? 290 LYS D CB 1 ATOM 12239 C CG . LYS D 1 231 ? -21.670 69.715 62.782 1.00 37.58 ? 290 LYS D CG 1 ATOM 12240 C CD . LYS D 1 231 ? -22.829 69.364 63.711 1.00 38.81 ? 290 LYS D CD 1 ATOM 12241 C CE . LYS D 1 231 ? -23.831 70.501 63.823 1.00 37.85 ? 290 LYS D CE 1 ATOM 12242 N NZ . LYS D 1 231 ? -25.073 70.072 64.520 1.00 38.23 ? 290 LYS D NZ 1 ATOM 12243 N N . GLU D 1 232 ? -20.058 68.905 65.917 1.00 47.30 ? 291 GLU D N 1 ATOM 12244 C CA . GLU D 1 232 ? -19.470 67.604 66.200 1.00 37.48 ? 291 GLU D CA 1 ATOM 12245 C C . GLU D 1 232 ? -19.889 66.623 65.112 1.00 37.85 ? 291 GLU D C 1 ATOM 12246 O O . GLU D 1 232 ? -20.945 66.781 64.501 1.00 51.48 ? 291 GLU D O 1 ATOM 12247 C CB . GLU D 1 232 ? -19.901 67.106 67.585 1.00 37.67 ? 291 GLU D CB 1 ATOM 12248 C CG . GLU D 1 232 ? -19.342 65.747 67.987 1.00 37.86 ? 291 GLU D CG 1 ATOM 12249 C CD . GLU D 1 232 ? -19.764 65.328 69.384 1.00 45.51 ? 291 GLU D CD 1 ATOM 12250 O OE1 . GLU D 1 232 ? -19.614 66.139 70.320 1.00 53.95 ? 291 GLU D OE1 1 ATOM 12251 O OE2 . GLU D 1 232 ? -20.245 64.188 69.548 1.00 43.45 ? 291 GLU D OE2 1 ATOM 12252 N N . GLY D 1 233 ? -19.057 65.622 64.859 1.00 45.02 ? 292 GLY D N 1 ATOM 12253 C CA . GLY D 1 233 ? -19.411 64.579 63.919 1.00 43.85 ? 292 GLY D CA 1 ATOM 12254 C C . GLY D 1 233 ? -18.577 63.331 64.101 1.00 38.37 ? 292 GLY D C 1 ATOM 12255 O O . GLY D 1 233 ? -17.599 63.327 64.849 1.00 43.70 ? 292 GLY D O 1 ATOM 12256 N N . SER D 1 234 ? -18.966 62.264 63.411 1.00 40.67 ? 293 SER D N 1 ATOM 12257 C CA . SER D 1 234 ? -18.183 61.038 63.411 1.00 38.84 ? 293 SER D CA 1 ATOM 12258 C C . SER D 1 234 ? -17.217 61.055 62.236 1.00 38.63 ? 293 SER D C 1 ATOM 12259 O O . SER D 1 234 ? -17.575 61.462 61.132 1.00 38.65 ? 293 SER D O 1 ATOM 12260 C CB . SER D 1 234 ? -19.094 59.809 63.347 1.00 39.37 ? 293 SER D CB 1 ATOM 12261 O OG . SER D 1 234 ? -19.707 59.690 62.075 1.00 39.58 ? 293 SER D OG 1 ATOM 12262 N N . VAL D 1 235 ? -15.987 60.623 62.482 1.00 38.42 ? 294 VAL D N 1 ATOM 12263 C CA . VAL D 1 235 ? -14.977 60.593 61.437 1.00 38.21 ? 294 VAL D CA 1 ATOM 12264 C C . VAL D 1 235 ? -14.442 59.178 61.281 1.00 41.18 ? 294 VAL D C 1 ATOM 12265 O O . VAL D 1 235 ? -13.801 58.643 62.185 1.00 38.35 ? 294 VAL D O 1 ATOM 12266 C CB . VAL D 1 235 ? -13.812 61.556 61.738 1.00 44.22 ? 294 VAL D CB 1 ATOM 12267 C CG1 . VAL D 1 235 ? -12.733 61.429 60.674 1.00 42.36 ? 294 VAL D CG1 1 ATOM 12268 C CG2 . VAL D 1 235 ? -14.316 62.990 61.827 1.00 37.49 ? 294 VAL D CG2 1 ATOM 12269 N N . GLN D 1 236 ? -14.718 58.576 60.131 1.00 38.64 ? 295 GLN D N 1 ATOM 12270 C CA . GLN D 1 236 ? -14.373 57.182 59.900 1.00 53.25 ? 295 GLN D CA 1 ATOM 12271 C C . GLN D 1 236 ? -13.389 57.054 58.748 1.00 54.29 ? 295 GLN D C 1 ATOM 12272 O O . GLN D 1 236 ? -13.629 57.572 57.659 1.00 44.32 ? 295 GLN D O 1 ATOM 12273 C CB . GLN D 1 236 ? -15.632 56.361 59.613 1.00 39.40 ? 295 GLN D CB 1 ATOM 12274 C CG . GLN D 1 236 ? -15.358 54.912 59.252 1.00 41.91 ? 295 GLN D CG 1 ATOM 12275 C CD . GLN D 1 236 ? -16.628 54.101 59.091 1.00 48.47 ? 295 GLN D CD 1 ATOM 12276 O OE1 . GLN D 1 236 ? -17.092 53.869 57.974 1.00 51.58 ? 295 GLN D OE1 1 ATOM 12277 N NE2 . GLN D 1 236 ? -17.196 53.663 60.208 1.00 48.28 ? 295 GLN D NE2 1 ATOM 12278 N N . VAL D 1 237 ? -12.284 56.359 58.999 1.00 43.13 ? 296 VAL D N 1 ATOM 12279 C CA . VAL D 1 237 ? -11.253 56.153 57.990 1.00 44.94 ? 296 VAL D CA 1 ATOM 12280 C C . VAL D 1 237 ? -11.824 55.445 56.762 1.00 42.44 ? 296 VAL D C 1 ATOM 12281 O O . VAL D 1 237 ? -12.613 54.507 56.881 1.00 46.94 ? 296 VAL D O 1 ATOM 12282 C CB . VAL D 1 237 ? -10.057 55.349 58.559 1.00 52.83 ? 296 VAL D CB 1 ATOM 12283 C CG1 . VAL D 1 237 ? -10.502 53.973 59.048 1.00 38.64 ? 296 VAL D CG1 1 ATOM 12284 C CG2 . VAL D 1 237 ? -8.943 55.232 57.526 1.00 42.66 ? 296 VAL D CG2 1 ATOM 12285 N N . PHE D 1 238 ? -11.445 55.926 55.583 1.00 48.97 ? 297 PHE D N 1 ATOM 12286 C CA . PHE D 1 238 ? -11.873 55.315 54.332 1.00 40.55 ? 297 PHE D CA 1 ATOM 12287 C C . PHE D 1 238 ? -11.387 53.873 54.244 1.00 47.52 ? 297 PHE D C 1 ATOM 12288 O O . PHE D 1 238 ? -10.279 53.558 54.678 1.00 57.26 ? 297 PHE D O 1 ATOM 12289 C CB . PHE D 1 238 ? -11.338 56.118 53.142 1.00 43.47 ? 297 PHE D CB 1 ATOM 12290 C CG . PHE D 1 238 ? -12.401 56.826 52.349 1.00 50.99 ? 297 PHE D CG 1 ATOM 12291 C CD1 . PHE D 1 238 ? -13.347 57.619 52.977 1.00 42.69 ? 297 PHE D CD1 1 ATOM 12292 C CD2 . PHE D 1 238 ? -12.438 56.714 50.969 1.00 42.97 ? 297 PHE D CD2 1 ATOM 12293 C CE1 . PHE D 1 238 ? -14.319 58.274 52.242 1.00 44.80 ? 297 PHE D CE1 1 ATOM 12294 C CE2 . PHE D 1 238 ? -13.405 57.367 50.230 1.00 46.39 ? 297 PHE D CE2 1 ATOM 12295 C CZ . PHE D 1 238 ? -14.347 58.148 50.867 1.00 44.02 ? 297 PHE D CZ 1 ATOM 12296 N N . LEU D 1 239 ? -12.219 52.996 53.692 1.00 53.75 ? 298 LEU D N 1 ATOM 12297 C CA . LEU D 1 239 ? -11.770 51.651 53.359 1.00 45.72 ? 298 LEU D CA 1 ATOM 12298 C C . LEU D 1 239 ? -10.774 51.772 52.215 1.00 49.58 ? 298 LEU D C 1 ATOM 12299 O O . LEU D 1 239 ? -10.844 52.727 51.441 1.00 51.69 ? 298 LEU D O 1 ATOM 12300 C CB . LEU D 1 239 ? -12.941 50.739 52.971 1.00 52.99 ? 298 LEU D CB 1 ATOM 12301 C CG . LEU D 1 239 ? -13.843 50.164 54.071 1.00 57.17 ? 298 LEU D CG 1 ATOM 12302 C CD1 . LEU D 1 239 ? -13.270 50.415 55.464 1.00 52.86 ? 298 LEU D CD1 1 ATOM 12303 C CD2 . LEU D 1 239 ? -15.268 50.691 53.955 1.00 56.02 ? 298 LEU D CD2 1 ATOM 12304 N N . PRO D 1 240 ? -9.831 50.821 52.111 1.00 52.11 ? 299 PRO D N 1 ATOM 12305 C CA . PRO D 1 240 ? -8.891 50.879 50.986 1.00 51.12 ? 299 PRO D CA 1 ATOM 12306 C C . PRO D 1 240 ? -9.624 50.840 49.649 1.00 52.53 ? 299 PRO D C 1 ATOM 12307 O O . PRO D 1 240 ? -10.732 50.306 49.579 1.00 59.30 ? 299 PRO D O 1 ATOM 12308 C CB . PRO D 1 240 ? -8.021 49.632 51.185 1.00 53.39 ? 299 PRO D CB 1 ATOM 12309 C CG . PRO D 1 240 ? -8.818 48.736 52.083 1.00 58.62 ? 299 PRO D CG 1 ATOM 12310 C CD . PRO D 1 240 ? -9.591 49.654 52.975 1.00 50.70 ? 299 PRO D CD 1 ATOM 12311 N N . ASP D 1 241 ? -9.015 51.410 48.613 1.00 57.91 ? 300 ASP D N 1 ATOM 12312 C CA . ASP D 1 241 ? -9.663 51.544 47.311 1.00 54.19 ? 300 ASP D CA 1 ATOM 12313 C C . ASP D 1 241 ? -10.124 50.192 46.775 1.00 65.45 ? 300 ASP D C 1 ATOM 12314 O O . ASP D 1 241 ? -9.448 49.178 46.953 1.00 71.71 ? 300 ASP D O 1 ATOM 12315 C CB . ASP D 1 241 ? -8.716 52.214 46.311 1.00 65.12 ? 300 ASP D CB 1 ATOM 12316 C CG . ASP D 1 241 ? -9.430 52.702 45.061 1.00 88.01 ? 300 ASP D CG 1 ATOM 12317 O OD1 . ASP D 1 241 ? -10.630 52.398 44.892 1.00 95.54 ? 300 ASP D OD1 1 ATOM 12318 O OD2 . ASP D 1 241 ? -8.786 53.391 44.242 1.00 103.07 ? 300 ASP D OD2 1 ATOM 12319 N N . GLU D 1 242 ? -11.285 50.190 46.127 1.00 62.73 ? 301 GLU D N 1 ATOM 12320 C CA . GLU D 1 242 ? -11.888 48.961 45.623 1.00 67.22 ? 301 GLU D CA 1 ATOM 12321 C C . GLU D 1 242 ? -11.029 48.332 44.534 1.00 80.92 ? 301 GLU D C 1 ATOM 12322 O O . GLU D 1 242 ? -10.979 47.109 44.402 1.00 84.60 ? 301 GLU D O 1 ATOM 12323 C CB . GLU D 1 242 ? -13.294 49.231 45.088 1.00 75.04 ? 301 GLU D CB 1 ATOM 12324 C CG . GLU D 1 242 ? -14.370 49.259 46.160 1.00 79.54 ? 301 GLU D CG 1 ATOM 12325 C CD . GLU D 1 242 ? -15.725 48.830 45.635 1.00 90.87 ? 301 GLU D CD 1 ATOM 12326 O OE1 . GLU D 1 242 ? -16.203 49.437 44.653 1.00 92.44 ? 301 GLU D OE1 1 ATOM 12327 O OE2 . GLU D 1 242 ? -16.313 47.885 46.202 1.00 101.34 ? 301 GLU D OE2 1 ATOM 12328 N N . SER D 1 243 ? -10.363 49.175 43.751 1.00 92.49 ? 302 SER D N 1 ATOM 12329 C CA . SER D 1 243 ? -9.481 48.702 42.691 1.00 85.83 ? 302 SER D CA 1 ATOM 12330 C C . SER D 1 243 ? -8.357 47.847 43.266 1.00 62.12 ? 302 SER D C 1 ATOM 12331 O O . SER D 1 243 ? -7.961 46.844 42.672 1.00 64.50 ? 302 SER D O 1 ATOM 12332 C CB . SER D 1 243 ? -8.901 49.881 41.907 1.00 87.53 ? 302 SER D CB 1 ATOM 12333 O OG . SER D 1 243 ? -8.158 50.741 42.754 1.00 92.31 ? 302 SER D OG 1 ATOM 12334 N N . ALA D 1 244 ? -7.850 48.248 44.428 1.00 60.88 ? 303 ALA D N 1 ATOM 12335 C CA . ALA D 1 244 ? -6.800 47.495 45.102 1.00 56.32 ? 303 ALA D CA 1 ATOM 12336 C C . ALA D 1 244 ? -7.401 46.410 45.988 1.00 64.77 ? 303 ALA D C 1 ATOM 12337 O O . ALA D 1 244 ? -7.008 45.245 45.914 1.00 77.64 ? 303 ALA D O 1 ATOM 12338 C CB . ALA D 1 244 ? -5.922 48.426 45.923 1.00 57.06 ? 303 ALA D CB 1 ATOM 12339 N N . VAL D 1 245 ? -8.353 46.801 46.830 1.00 69.21 ? 304 VAL D N 1 ATOM 12340 C CA . VAL D 1 245 ? -9.011 45.863 47.733 1.00 64.80 ? 304 VAL D CA 1 ATOM 12341 C C . VAL D 1 245 ? -10.522 45.838 47.497 1.00 71.62 ? 304 VAL D C 1 ATOM 12342 O O . VAL D 1 245 ? -11.265 46.595 48.124 1.00 77.43 ? 304 VAL D O 1 ATOM 12343 C CB . VAL D 1 245 ? -8.732 46.206 49.210 1.00 50.30 ? 304 VAL D CB 1 ATOM 12344 C CG1 . VAL D 1 245 ? -9.269 45.111 50.118 1.00 58.80 ? 304 VAL D CG1 1 ATOM 12345 C CG2 . VAL D 1 245 ? -7.242 46.395 49.441 1.00 55.99 ? 304 VAL D CG2 1 ATOM 12346 N N . PRO D 1 246 ? -10.977 44.971 46.580 1.00 70.35 ? 305 PRO D N 1 ATOM 12347 C CA . PRO D 1 246 ? -12.398 44.824 46.238 1.00 73.16 ? 305 PRO D CA 1 ATOM 12348 C C . PRO D 1 246 ? -13.229 44.325 47.422 1.00 73.10 ? 305 PRO D C 1 ATOM 12349 O O . PRO D 1 246 ? -12.688 43.703 48.338 1.00 58.69 ? 305 PRO D O 1 ATOM 12350 C CB . PRO D 1 246 ? -12.384 43.809 45.090 1.00 65.85 ? 305 PRO D CB 1 ATOM 12351 C CG . PRO D 1 246 ? -11.076 43.116 45.200 1.00 72.71 ? 305 PRO D CG 1 ATOM 12352 C CD . PRO D 1 246 ? -10.119 44.127 45.734 1.00 67.10 ? 305 PRO D CD 1 ATOM 12353 N N . ARG D 1 247 ? -14.530 44.597 47.389 1.00 72.16 ? 306 ARG D N 1 ATOM 12354 C CA . ARG D 1 247 ? -15.418 44.303 48.511 1.00 60.55 ? 306 ARG D CA 1 ATOM 12355 C C . ARG D 1 247 ? -16.682 43.536 48.111 1.00 58.94 ? 306 ARG D C 1 ATOM 12356 O O . ARG D 1 247 ? -17.112 43.578 46.959 1.00 61.29 ? 306 ARG D O 1 ATOM 12357 C CB . ARG D 1 247 ? -15.770 45.614 49.223 1.00 63.78 ? 306 ARG D CB 1 ATOM 12358 C CG . ARG D 1 247 ? -14.751 45.974 50.301 1.00 64.23 ? 306 ARG D CG 1 ATOM 12359 C CD . ARG D 1 247 ? -14.998 47.318 50.976 1.00 55.86 ? 306 ARG D CD 1 ATOM 12360 N NE . ARG D 1 247 ? -15.104 48.414 50.011 1.00 66.70 ? 306 ARG D NE 1 ATOM 12361 C CZ . ARG D 1 247 ? -16.229 49.037 49.682 1.00 73.63 ? 306 ARG D CZ 1 ATOM 12362 N NH1 . ARG D 1 247 ? -17.382 48.688 50.232 1.00 91.20 ? 306 ARG D NH1 1 ATOM 12363 N NH2 . ARG D 1 247 ? -16.192 50.017 48.797 1.00 62.44 ? 306 ARG D NH2 1 ATOM 12364 N N . LYS D 1 248 ? -17.266 42.841 49.086 1.00 60.14 ? 307 LYS D N 1 ATOM 12365 C CA . LYS D 1 248 ? -18.407 41.955 48.862 1.00 61.85 ? 307 LYS D CA 1 ATOM 12366 C C . LYS D 1 248 ? -19.727 42.461 49.447 1.00 57.18 ? 307 LYS D C 1 ATOM 12367 O O . LYS D 1 248 ? -19.760 43.020 50.543 1.00 62.32 ? 307 LYS D O 1 ATOM 12368 C CB . LYS D 1 248 ? -18.089 40.586 49.469 1.00 65.62 ? 307 LYS D CB 1 ATOM 12369 C CG . LYS D 1 248 ? -17.143 39.733 48.646 1.00 81.52 ? 307 LYS D CG 1 ATOM 12370 C CD . LYS D 1 248 ? -16.737 38.483 49.414 1.00 85.15 ? 307 LYS D CD 1 ATOM 12371 C CE . LYS D 1 248 ? -17.927 37.613 49.771 1.00 91.91 ? 307 LYS D CE 1 ATOM 12372 N NZ . LYS D 1 248 ? -17.524 36.526 50.707 1.00 87.88 ? 307 LYS D NZ 1 ATOM 12373 N N . HIS D 1 249 ? -20.813 42.256 48.704 1.00 68.40 ? 308 HIS D N 1 ATOM 12374 C CA . HIS D 1 249 ? -22.151 42.645 49.149 1.00 68.30 ? 308 HIS D CA 1 ATOM 12375 C C . HIS D 1 249 ? -23.118 41.462 49.199 1.00 67.88 ? 308 HIS D C 1 ATOM 12376 O O . HIS D 1 249 ? -23.539 40.957 48.159 1.00 66.55 ? 308 HIS D O 1 ATOM 12377 C CB . HIS D 1 249 ? -22.725 43.734 48.239 1.00 66.65 ? 308 HIS D CB 1 ATOM 12378 C CG . HIS D 1 249 ? -21.970 45.023 48.285 1.00 100.70 ? 308 HIS D CG 1 ATOM 12379 N ND1 . HIS D 1 249 ? -22.280 46.036 49.171 1.00 114.18 ? 308 HIS D ND1 1 ATOM 12380 C CD2 . HIS D 1 249 ? -20.919 45.473 47.560 1.00 109.96 ? 308 HIS D CD2 1 ATOM 12381 C CE1 . HIS D 1 249 ? -21.456 47.048 48.987 1.00 117.28 ? 308 HIS D CE1 1 ATOM 12382 N NE2 . HIS D 1 249 ? -20.617 46.732 48.014 1.00 110.99 ? 308 HIS D NE2 1 ATOM 12383 N N . ASN D 1 250 ? -23.467 41.023 50.404 1.00 64.69 ? 309 ASN D N 1 ATOM 12384 C CA . ASN D 1 250 ? -24.353 39.874 50.565 1.00 62.89 ? 309 ASN D CA 1 ATOM 12385 C C . ASN D 1 250 ? -25.637 40.224 51.311 1.00 60.81 ? 309 ASN D C 1 ATOM 12386 O O . ASN D 1 250 ? -25.595 40.806 52.395 1.00 70.38 ? 309 ASN D O 1 ATOM 12387 C CB . ASN D 1 250 ? -23.631 38.735 51.289 1.00 57.16 ? 309 ASN D CB 1 ATOM 12388 C CG . ASN D 1 250 ? -22.489 38.160 50.478 1.00 68.26 ? 309 ASN D CG 1 ATOM 12389 O OD1 . ASN D 1 250 ? -21.329 38.220 50.885 1.00 70.87 ? 309 ASN D OD1 1 ATOM 12390 N ND2 . ASN D 1 250 ? -22.814 37.593 49.322 1.00 63.43 ? 309 ASN D ND2 1 ATOM 12391 N N . ARG D 1 251 ? -26.775 39.867 50.724 1.00 54.92 ? 310 ARG D N 1 ATOM 12392 C CA . ARG D 1 251 ? -28.068 40.045 51.375 1.00 53.44 ? 310 ARG D CA 1 ATOM 12393 C C . ARG D 1 251 ? -28.161 39.192 52.632 1.00 56.70 ? 310 ARG D C 1 ATOM 12394 O O . ARG D 1 251 ? -27.790 38.019 52.625 1.00 56.91 ? 310 ARG D O 1 ATOM 12395 C CB . ARG D 1 251 ? -29.210 39.706 50.417 1.00 51.05 ? 310 ARG D CB 1 ATOM 12396 C CG . ARG D 1 251 ? -29.723 40.909 49.651 1.00 80.72 ? 310 ARG D CG 1 ATOM 12397 C CD . ARG D 1 251 ? -30.423 40.520 48.364 1.00 84.12 ? 310 ARG D CD 1 ATOM 12398 N NE . ARG D 1 251 ? -30.624 41.684 47.506 1.00 86.70 ? 310 ARG D NE 1 ATOM 12399 C CZ . ARG D 1 251 ? -29.678 42.213 46.736 1.00 84.61 ? 310 ARG D CZ 1 ATOM 12400 N NH1 . ARG D 1 251 ? -28.462 41.683 46.716 1.00 81.22 ? 310 ARG D NH1 1 ATOM 12401 N NH2 . ARG D 1 251 ? -29.945 43.275 45.988 1.00 80.37 ? 310 ARG D NH2 1 ATOM 12402 N N . SER D 1 252 ? -28.659 39.786 53.710 1.00 52.75 ? 311 SER D N 1 ATOM 12403 C CA . SER D 1 252 ? -28.809 39.063 54.965 1.00 55.05 ? 311 SER D CA 1 ATOM 12404 C C . SER D 1 252 ? -30.005 38.123 54.903 1.00 57.78 ? 311 SER D C 1 ATOM 12405 O O . SER D 1 252 ? -31.066 38.491 54.401 1.00 55.66 ? 311 SER D O 1 ATOM 12406 C CB . SER D 1 252 ? -28.965 40.040 56.133 1.00 48.56 ? 311 SER D CB 1 ATOM 12407 O OG . SER D 1 252 ? -29.103 39.352 57.364 1.00 48.06 ? 311 SER D OG 1 ATOM 12408 N N . PRO D 1 253 ? -29.832 36.895 55.413 1.00 52.17 ? 312 PRO D N 1 ATOM 12409 C CA . PRO D 1 253 ? -30.943 35.945 55.524 1.00 51.25 ? 312 PRO D CA 1 ATOM 12410 C C . PRO D 1 253 ? -31.967 36.417 56.549 1.00 63.48 ? 312 PRO D C 1 ATOM 12411 O O . PRO D 1 253 ? -33.105 35.949 56.553 1.00 49.89 ? 312 PRO D O 1 ATOM 12412 C CB . PRO D 1 253 ? -30.262 34.649 55.982 1.00 49.28 ? 312 PRO D CB 1 ATOM 12413 C CG . PRO D 1 253 ? -28.812 34.830 55.660 1.00 60.52 ? 312 PRO D CG 1 ATOM 12414 C CD . PRO D 1 253 ? -28.547 36.293 55.799 1.00 54.92 ? 312 PRO D CD 1 ATOM 12415 N N . TYR D 1 254 ? -31.551 37.339 57.413 1.00 48.96 ? 313 TYR D N 1 ATOM 12416 C CA . TYR D 1 254 ? -32.446 37.929 58.397 1.00 53.89 ? 313 TYR D CA 1 ATOM 12417 C C . TYR D 1 254 ? -32.773 39.374 58.034 1.00 48.80 ? 313 TYR D C 1 ATOM 12418 O O . TYR D 1 254 ? -33.072 40.192 58.905 1.00 50.73 ? 313 TYR D O 1 ATOM 12419 C CB . TYR D 1 254 ? -31.819 37.855 59.790 1.00 48.86 ? 313 TYR D CB 1 ATOM 12420 C CG . TYR D 1 254 ? -31.803 36.457 60.368 1.00 72.35 ? 313 TYR D CG 1 ATOM 12421 C CD1 . TYR D 1 254 ? -32.834 36.008 61.183 1.00 49.68 ? 313 TYR D CD1 1 ATOM 12422 C CD2 . TYR D 1 254 ? -30.758 35.584 60.092 1.00 49.11 ? 313 TYR D CD2 1 ATOM 12423 C CE1 . TYR D 1 254 ? -32.823 34.731 61.711 1.00 50.02 ? 313 TYR D CE1 1 ATOM 12424 C CE2 . TYR D 1 254 ? -30.740 34.304 60.614 1.00 57.92 ? 313 TYR D CE2 1 ATOM 12425 C CZ . TYR D 1 254 ? -31.774 33.884 61.423 1.00 54.45 ? 313 TYR D CZ 1 ATOM 12426 O OH . TYR D 1 254 ? -31.760 32.612 61.946 1.00 57.10 ? 313 TYR D OH 1 ATOM 12427 N N . ARG D 1 255 ? -32.695 39.684 56.744 1.00 49.41 ? 314 ARG D N 1 ATOM 12428 C CA . ARG D 1 255 ? -33.141 40.974 56.230 1.00 48.52 ? 314 ARG D CA 1 ATOM 12429 C C . ARG D 1 255 ? -34.621 41.196 56.524 1.00 55.02 ? 314 ARG D C 1 ATOM 12430 O O . ARG D 1 255 ? -35.432 40.282 56.379 1.00 59.55 ? 314 ARG D O 1 ATOM 12431 C CB . ARG D 1 255 ? -32.886 41.079 54.723 1.00 48.45 ? 314 ARG D CB 1 ATOM 12432 C CG . ARG D 1 255 ? -33.307 42.407 54.108 1.00 62.55 ? 314 ARG D CG 1 ATOM 12433 C CD . ARG D 1 255 ? -33.072 42.425 52.606 1.00 80.16 ? 314 ARG D CD 1 ATOM 12434 N NE . ARG D 1 255 ? -33.406 43.721 52.020 1.00 77.16 ? 314 ARG D NE 1 ATOM 12435 C CZ . ARG D 1 255 ? -34.619 44.060 51.599 1.00 78.98 ? 314 ARG D CZ 1 ATOM 12436 N NH1 . ARG D 1 255 ? -35.621 43.199 51.700 1.00 72.27 ? 314 ARG D NH1 1 ATOM 12437 N NH2 . ARG D 1 255 ? -34.832 45.262 51.080 1.00 88.90 ? 314 ARG D NH2 1 ATOM 12438 N N . ARG D 1 256 ? -34.966 42.412 56.935 1.00 48.70 ? 315 ARG D N 1 ATOM 12439 C CA . ARG D 1 256 ? -36.357 42.763 57.209 1.00 54.43 ? 315 ARG D CA 1 ATOM 12440 C C . ARG D 1 256 ? -37.114 43.111 55.929 1.00 56.36 ? 315 ARG D C 1 ATOM 12441 O O . ARG D 1 256 ? -36.536 43.152 54.841 1.00 53.44 ? 315 ARG D O 1 ATOM 12442 C CB . ARG D 1 256 ? -36.428 43.922 58.203 1.00 48.72 ? 315 ARG D CB 1 ATOM 12443 C CG . ARG D 1 256 ? -36.007 43.535 59.607 1.00 48.66 ? 315 ARG D CG 1 ATOM 12444 C CD . ARG D 1 256 ? -35.813 44.743 60.495 1.00 48.23 ? 315 ARG D CD 1 ATOM 12445 N NE . ARG D 1 256 ? -36.102 44.431 61.891 1.00 48.38 ? 315 ARG D NE 1 ATOM 12446 C CZ . ARG D 1 256 ? -35.188 44.056 62.779 1.00 48.17 ? 315 ARG D CZ 1 ATOM 12447 N NH1 . ARG D 1 256 ? -33.911 43.948 62.422 1.00 53.09 ? 315 ARG D NH1 1 ATOM 12448 N NH2 . ARG D 1 256 ? -35.551 43.788 64.027 1.00 59.39 ? 315 ARG D NH2 1 ATOM 12449 N N . THR D 1 257 ? -38.414 43.348 56.068 1.00 49.60 ? 316 THR D N 1 ATOM 12450 C CA . THR D 1 257 ? -39.282 43.553 54.915 1.00 49.86 ? 316 THR D CA 1 ATOM 12451 C C . THR D 1 257 ? -39.176 44.961 54.343 1.00 49.43 ? 316 THR D C 1 ATOM 12452 O O . THR D 1 257 ? -39.321 45.159 53.135 1.00 54.19 ? 316 THR D O 1 ATOM 12453 C CB . THR D 1 257 ? -40.755 43.283 55.268 1.00 50.43 ? 316 THR D CB 1 ATOM 12454 O OG1 . THR D 1 257 ? -41.189 44.223 56.257 1.00 75.24 ? 316 THR D OG1 1 ATOM 12455 C CG2 . THR D 1 257 ? -40.927 41.870 55.808 1.00 64.01 ? 316 THR D CG2 1 ATOM 12456 N N . TYR D 1 258 ? -38.934 45.930 55.223 1.00 49.05 ? 317 TYR D N 1 ATOM 12457 C CA . TYR D 1 258 ? -38.881 47.343 54.852 1.00 52.14 ? 317 TYR D CA 1 ATOM 12458 C C . TYR D 1 258 ? -40.182 47.792 54.196 1.00 48.94 ? 317 TYR D C 1 ATOM 12459 O O . TYR D 1 258 ? -40.180 48.495 53.185 1.00 48.76 ? 317 TYR D O 1 ATOM 12460 C CB . TYR D 1 258 ? -37.684 47.618 53.937 1.00 48.19 ? 317 TYR D CB 1 ATOM 12461 C CG . TYR D 1 258 ? -36.360 47.501 54.653 1.00 50.49 ? 317 TYR D CG 1 ATOM 12462 C CD1 . TYR D 1 258 ? -35.692 48.632 55.101 1.00 47.23 ? 317 TYR D CD1 1 ATOM 12463 C CD2 . TYR D 1 258 ? -35.786 46.259 54.900 1.00 47.94 ? 317 TYR D CD2 1 ATOM 12464 C CE1 . TYR D 1 258 ? -34.487 48.533 55.766 1.00 46.87 ? 317 TYR D CE1 1 ATOM 12465 C CE2 . TYR D 1 258 ? -34.581 46.150 55.565 1.00 47.57 ? 317 TYR D CE2 1 ATOM 12466 C CZ . TYR D 1 258 ? -33.936 47.290 55.995 1.00 50.04 ? 317 TYR D CZ 1 ATOM 12467 O OH . TYR D 1 258 ? -32.736 47.191 56.659 1.00 47.63 ? 317 TYR D OH 1 ATOM 12468 N N . SER D 1 259 ? -41.293 47.373 54.791 1.00 49.41 ? 318 SER D N 1 ATOM 12469 C CA . SER D 1 259 ? -42.618 47.791 54.358 1.00 49.73 ? 318 SER D CA 1 ATOM 12470 C C . SER D 1 259 ? -43.533 47.914 55.570 1.00 59.29 ? 318 SER D C 1 ATOM 12471 O O . SER D 1 259 ? -43.442 47.119 56.506 1.00 50.15 ? 318 SER D O 1 ATOM 12472 C CB . SER D 1 259 ? -43.197 46.801 53.345 1.00 50.26 ? 318 SER D CB 1 ATOM 12473 O OG . SER D 1 259 ? -44.614 46.845 53.333 1.00 50.72 ? 318 SER D OG 1 ATOM 12474 N N . LYS D 1 260 ? -44.410 48.912 55.557 1.00 53.64 ? 319 LYS D N 1 ATOM 12475 C CA . LYS D 1 260 ? -45.350 49.103 56.655 1.00 50.17 ? 319 LYS D CA 1 ATOM 12476 C C . LYS D 1 260 ? -46.623 48.290 56.442 1.00 50.85 ? 319 LYS D C 1 ATOM 12477 O O . LYS D 1 260 ? -47.432 48.143 57.357 1.00 65.23 ? 319 LYS D O 1 ATOM 12478 C CB . LYS D 1 260 ? -45.689 50.585 56.846 1.00 49.81 ? 319 LYS D CB 1 ATOM 12479 C CG . LYS D 1 260 ? -46.146 51.322 55.601 1.00 52.36 ? 319 LYS D CG 1 ATOM 12480 C CD . LYS D 1 260 ? -46.220 52.817 55.883 1.00 49.33 ? 319 LYS D CD 1 ATOM 12481 C CE . LYS D 1 260 ? -46.712 53.600 54.680 1.00 52.79 ? 319 LYS D CE 1 ATOM 12482 N NZ . LYS D 1 260 ? -45.765 53.527 53.536 1.00 69.71 ? 319 LYS D NZ 1 ATOM 12483 N N . LYS D 1 261 ? -46.799 47.764 55.233 1.00 52.14 ? 320 LYS D N 1 ATOM 12484 C CA . LYS D 1 261 ? -47.942 46.903 54.949 1.00 62.82 ? 320 LYS D CA 1 ATOM 12485 C C . LYS D 1 261 ? -47.671 45.525 55.542 1.00 60.96 ? 320 LYS D C 1 ATOM 12486 O O . LYS D 1 261 ? -48.303 45.120 56.518 1.00 69.74 ? 320 LYS D O 1 ATOM 12487 C CB . LYS D 1 261 ? -48.215 46.762 53.439 1.00 65.98 ? 320 LYS D CB 1 ATOM 12488 C CG . LYS D 1 261 ? -48.463 48.039 52.609 1.00 84.55 ? 320 LYS D CG 1 ATOM 12489 C CD . LYS D 1 261 ? -47.281 49.005 52.572 1.00 91.78 ? 320 LYS D CD 1 ATOM 12490 C CE . LYS D 1 261 ? -47.590 50.243 51.749 1.00 82.29 ? 320 LYS D CE 1 ATOM 12491 N NZ . LYS D 1 261 ? -46.432 51.179 51.716 1.00 74.82 ? 320 LYS D NZ 1 ATOM 12492 N N . ASN D 1 262 ? -46.725 44.809 54.941 1.00 63.17 ? 321 ASN D N 1 ATOM 12493 C CA . ASN D 1 262 ? -46.280 43.522 55.461 1.00 58.14 ? 321 ASN D CA 1 ATOM 12494 C C . ASN D 1 262 ? -45.044 43.692 56.337 1.00 51.74 ? 321 ASN D C 1 ATOM 12495 O O . ASN D 1 262 ? -43.922 43.752 55.834 1.00 63.93 ? 321 ASN D O 1 ATOM 12496 C CB . ASN D 1 262 ? -45.994 42.547 54.319 1.00 62.83 ? 321 ASN D CB 1 ATOM 12497 C CG . ASN D 1 262 ? -47.125 42.484 53.311 1.00 73.59 ? 321 ASN D CG 1 ATOM 12498 O OD1 . ASN D 1 262 ? -48.154 41.853 53.553 1.00 74.66 ? 321 ASN D OD1 1 ATOM 12499 N ND2 . ASN D 1 262 ? -46.938 43.136 52.169 1.00 60.01 ? 321 ASN D ND2 1 ATOM 12500 N N . GLN D 1 263 ? -45.251 43.772 57.647 1.00 51.75 ? 322 GLN D N 1 ATOM 12501 C CA . GLN D 1 263 ? -44.175 44.131 58.564 1.00 51.25 ? 322 GLN D CA 1 ATOM 12502 C C . GLN D 1 263 ? -43.473 42.916 59.163 1.00 51.36 ? 322 GLN D C 1 ATOM 12503 O O . GLN D 1 263 ? -42.566 43.060 59.983 1.00 50.99 ? 322 GLN D O 1 ATOM 12504 C CB . GLN D 1 263 ? -44.724 45.004 59.694 1.00 51.13 ? 322 GLN D CB 1 ATOM 12505 C CG . GLN D 1 263 ? -45.360 46.303 59.232 1.00 50.96 ? 322 GLN D CG 1 ATOM 12506 C CD . GLN D 1 263 ? -46.020 47.057 60.370 1.00 50.92 ? 322 GLN D CD 1 ATOM 12507 O OE1 . GLN D 1 263 ? -45.740 46.803 61.542 1.00 50.87 ? 322 GLN D OE1 1 ATOM 12508 N NE2 . GLN D 1 263 ? -46.909 47.983 60.031 1.00 50.94 ? 322 GLN D NE2 1 ATOM 12509 N N . VAL D 1 264 ? -43.887 41.722 58.755 1.00 51.88 ? 323 VAL D N 1 ATOM 12510 C CA . VAL D 1 264 ? -43.377 40.502 59.369 1.00 52.06 ? 323 VAL D CA 1 ATOM 12511 C C . VAL D 1 264 ? -42.695 39.583 58.361 1.00 52.12 ? 323 VAL D C 1 ATOM 12512 O O . VAL D 1 264 ? -43.356 38.939 57.546 1.00 68.23 ? 323 VAL D O 1 ATOM 12513 C CB . VAL D 1 264 ? -44.500 39.719 60.075 1.00 52.68 ? 323 VAL D CB 1 ATOM 12514 C CG1 . VAL D 1 264 ? -43.948 38.444 60.694 1.00 52.86 ? 323 VAL D CG1 1 ATOM 12515 C CG2 . VAL D 1 264 ? -45.167 40.584 61.133 1.00 52.62 ? 323 VAL D CG2 1 ATOM 12516 N N . ALA D 1 265 ? -41.368 39.532 58.420 1.00 51.67 ? 324 ALA D N 1 ATOM 12517 C CA . ALA D 1 265 ? -40.602 38.608 57.596 1.00 51.70 ? 324 ALA D CA 1 ATOM 12518 C C . ALA D 1 265 ? -40.760 37.183 58.116 1.00 52.17 ? 324 ALA D C 1 ATOM 12519 O O . ALA D 1 265 ? -41.150 36.975 59.267 1.00 52.34 ? 324 ALA D O 1 ATOM 12520 C CB . ALA D 1 265 ? -39.137 39.008 57.567 1.00 51.07 ? 324 ALA D CB 1 ATOM 12521 N N . GLU D 1 266 ? -40.473 36.208 57.258 1.00 53.63 ? 325 GLU D N 1 ATOM 12522 C CA . GLU D 1 266 ? -40.578 34.796 57.619 1.00 52.82 ? 325 GLU D CA 1 ATOM 12523 C C . GLU D 1 266 ? -39.772 34.439 58.869 1.00 55.25 ? 325 GLU D C 1 ATOM 12524 O O . GLU D 1 266 ? -40.259 33.720 59.741 1.00 52.98 ? 325 GLU D O 1 ATOM 12525 C CB . GLU D 1 266 ? -40.130 33.915 56.451 1.00 52.95 ? 325 GLU D CB 1 ATOM 12526 C CG . GLU D 1 266 ? -40.168 32.426 56.755 1.00 64.53 ? 325 GLU D CG 1 ATOM 12527 C CD . GLU D 1 266 ? -39.813 31.574 55.554 1.00 76.49 ? 325 GLU D CD 1 ATOM 12528 O OE1 . GLU D 1 266 ? -39.655 32.136 54.450 1.00 77.84 ? 325 GLU D OE1 1 ATOM 12529 O OE2 . GLU D 1 266 ? -39.694 30.341 55.714 1.00 75.66 ? 325 GLU D OE2 1 ATOM 12530 N N . TRP D 1 267 ? -38.547 34.952 58.957 1.00 52.02 ? 326 TRP D N 1 ATOM 12531 C CA . TRP D 1 267 ? -37.660 34.623 60.072 1.00 51.78 ? 326 TRP D CA 1 ATOM 12532 C C . TRP D 1 267 ? -38.148 35.207 61.394 1.00 55.95 ? 326 TRP D C 1 ATOM 12533 O O . TRP D 1 267 ? -37.688 34.809 62.462 1.00 51.68 ? 326 TRP D O 1 ATOM 12534 C CB . TRP D 1 267 ? -36.234 35.106 59.793 1.00 51.14 ? 326 TRP D CB 1 ATOM 12535 C CG . TRP D 1 267 ? -36.102 36.584 59.572 1.00 56.58 ? 326 TRP D CG 1 ATOM 12536 C CD1 . TRP D 1 267 ? -36.144 37.242 58.377 1.00 58.33 ? 326 TRP D CD1 1 ATOM 12537 C CD2 . TRP D 1 267 ? -35.894 37.587 60.574 1.00 50.30 ? 326 TRP D CD2 1 ATOM 12538 N NE1 . TRP D 1 267 ? -35.978 38.592 58.574 1.00 56.16 ? 326 TRP D NE1 1 ATOM 12539 C CE2 . TRP D 1 267 ? -35.824 38.830 59.914 1.00 49.93 ? 326 TRP D CE2 1 ATOM 12540 C CE3 . TRP D 1 267 ? -35.763 37.556 61.966 1.00 52.14 ? 326 TRP D CE3 1 ATOM 12541 C CZ2 . TRP D 1 267 ? -35.630 40.028 60.597 1.00 49.51 ? 326 TRP D CZ2 1 ATOM 12542 C CZ3 . TRP D 1 267 ? -35.568 38.747 62.642 1.00 49.81 ? 326 TRP D CZ3 1 ATOM 12543 C CH2 . TRP D 1 267 ? -35.504 39.966 61.957 1.00 49.46 ? 326 TRP D CH2 1 ATOM 12544 N N . GLN D 1 268 ? -39.084 36.145 61.315 1.00 51.81 ? 327 GLN D N 1 ATOM 12545 C CA . GLN D 1 268 ? -39.643 36.773 62.504 1.00 55.36 ? 327 GLN D CA 1 ATOM 12546 C C . GLN D 1 268 ? -40.802 35.947 63.043 1.00 61.79 ? 327 GLN D C 1 ATOM 12547 O O . GLN D 1 268 ? -41.195 36.085 64.202 1.00 52.52 ? 327 GLN D O 1 ATOM 12548 C CB . GLN D 1 268 ? -40.111 38.195 62.192 1.00 51.55 ? 327 GLN D CB 1 ATOM 12549 C CG . GLN D 1 268 ? -38.998 39.227 62.167 1.00 50.86 ? 327 GLN D CG 1 ATOM 12550 C CD . GLN D 1 268 ? -39.440 40.546 61.563 1.00 50.63 ? 327 GLN D CD 1 ATOM 12551 O OE1 . GLN D 1 268 ? -40.081 40.576 60.513 1.00 50.87 ? 327 GLN D OE1 1 ATOM 12552 N NE2 . GLN D 1 268 ? -39.099 41.645 62.227 1.00 50.18 ? 327 GLN D NE2 1 ATOM 12553 N N . SER D 1 269 ? -41.340 35.084 62.189 1.00 65.33 ? 328 SER D N 1 ATOM 12554 C CA . SER D 1 269 ? -42.493 34.266 62.539 1.00 68.71 ? 328 SER D CA 1 ATOM 12555 C C . SER D 1 269 ? -42.158 32.779 62.620 1.00 72.03 ? 328 SER D C 1 ATOM 12556 O O . SER D 1 269 ? -42.813 32.032 63.343 1.00 85.11 ? 328 SER D O 1 ATOM 12557 C CB . SER D 1 269 ? -43.624 34.487 61.530 1.00 53.93 ? 328 SER D CB 1 ATOM 12558 O OG . SER D 1 269 ? -43.176 34.273 60.204 1.00 70.48 ? 328 SER D OG 1 ATOM 12559 N N . SER D 1 270 ? -41.113 32.357 61.914 1.00 66.82 ? 329 SER D N 1 ATOM 12560 C CA . SER D 1 270 ? -40.780 30.937 61.852 1.00 60.99 ? 329 SER D CA 1 ATOM 12561 C C . SER D 1 270 ? -39.656 30.549 62.805 1.00 60.72 ? 329 SER D C 1 ATOM 12562 O O . SER D 1 270 ? -38.589 31.162 62.826 1.00 67.94 ? 329 SER D O 1 ATOM 12563 C CB . SER D 1 270 ? -40.400 30.547 60.421 1.00 60.17 ? 329 SER D CB 1 ATOM 12564 O OG . SER D 1 270 ? -39.782 29.273 60.384 1.00 79.06 ? 329 SER D OG 1 HETATM 12565 N N . MSE D 1 271 ? -39.923 29.508 63.588 1.00 62.42 ? 330 MSE D N 1 HETATM 12566 C CA . MSE D 1 271 ? -39.032 29.054 64.647 1.00 72.81 ? 330 MSE D CA 1 HETATM 12567 C C . MSE D 1 271 ? -37.887 28.193 64.115 1.00 83.13 ? 330 MSE D C 1 HETATM 12568 O O . MSE D 1 271 ? -36.745 28.325 64.556 1.00 72.43 ? 330 MSE D O 1 HETATM 12569 C CB . MSE D 1 271 ? -39.837 28.279 65.695 1.00 91.23 ? 330 MSE D CB 1 HETATM 12570 C CG . MSE D 1 271 ? -39.017 27.633 66.795 1.00 100.10 ? 330 MSE D CG 1 HETATM 12571 SE SE . MSE D 1 271 ? -40.139 26.604 68.018 1.00 244.94 ? 330 MSE D SE 1 HETATM 12572 C CE . MSE D 1 271 ? -40.973 25.395 66.732 1.00 70.16 ? 330 MSE D CE 1 ATOM 12573 N N . ASN D 1 272 ? -38.195 27.316 63.164 1.00 62.58 ? 331 ASN D N 1 ATOM 12574 C CA . ASN D 1 272 ? -37.198 26.419 62.588 1.00 59.77 ? 331 ASN D CA 1 ATOM 12575 C C . ASN D 1 272 ? -36.516 27.027 61.364 1.00 62.30 ? 331 ASN D C 1 ATOM 12576 O O . ASN D 1 272 ? -35.891 26.315 60.578 1.00 63.85 ? 331 ASN D O 1 ATOM 12577 C CB . ASN D 1 272 ? -37.838 25.083 62.209 1.00 67.27 ? 331 ASN D CB 1 ATOM 12578 C CG . ASN D 1 272 ? -38.616 24.461 63.351 1.00 71.84 ? 331 ASN D CG 1 ATOM 12579 O OD1 . ASN D 1 272 ? -38.049 24.083 64.376 1.00 54.91 ? 331 ASN D OD1 1 ATOM 12580 N ND2 . ASN D 1 272 ? -39.928 24.356 63.180 1.00 79.76 ? 331 ASN D ND2 1 ATOM 12581 N N . TYR D 1 273 ? -36.656 28.341 61.208 1.00 62.14 ? 332 TYR D N 1 ATOM 12582 C CA . TYR D 1 273 ? -36.106 29.067 60.063 1.00 66.56 ? 332 TYR D CA 1 ATOM 12583 C C . TYR D 1 273 ? -34.616 28.812 59.841 1.00 62.99 ? 332 TYR D C 1 ATOM 12584 O O . TYR D 1 273 ? -34.186 28.576 58.713 1.00 61.53 ? 332 TYR D O 1 ATOM 12585 C CB . TYR D 1 273 ? -36.353 30.569 60.226 1.00 54.50 ? 332 TYR D CB 1 ATOM 12586 C CG . TYR D 1 273 ? -35.832 31.406 59.078 1.00 52.07 ? 332 TYR D CG 1 ATOM 12587 C CD1 . TYR D 1 273 ? -36.552 31.524 57.897 1.00 53.66 ? 332 TYR D CD1 1 ATOM 12588 C CD2 . TYR D 1 273 ? -34.627 32.091 59.182 1.00 51.44 ? 332 TYR D CD2 1 ATOM 12589 C CE1 . TYR D 1 273 ? -36.081 32.291 56.845 1.00 51.95 ? 332 TYR D CE1 1 ATOM 12590 C CE2 . TYR D 1 273 ? -34.151 32.862 58.137 1.00 51.08 ? 332 TYR D CE2 1 ATOM 12591 C CZ . TYR D 1 273 ? -34.880 32.958 56.971 1.00 51.33 ? 332 TYR D CZ 1 ATOM 12592 O OH . TYR D 1 273 ? -34.405 33.725 55.931 1.00 50.97 ? 332 TYR D OH 1 ATOM 12593 N N . CYS D 1 274 ? -33.829 28.872 60.910 1.00 61.25 ? 333 CYS D N 1 ATOM 12594 C CA . CYS D 1 274 ? -32.387 28.673 60.798 1.00 64.03 ? 333 CYS D CA 1 ATOM 12595 C C . CYS D 1 274 ? -32.057 27.256 60.348 1.00 73.26 ? 333 CYS D C 1 ATOM 12596 O O . CYS D 1 274 ? -31.241 27.052 59.450 1.00 73.28 ? 333 CYS D O 1 ATOM 12597 C CB . CYS D 1 274 ? -31.701 28.967 62.129 1.00 51.48 ? 333 CYS D CB 1 ATOM 12598 S SG . CYS D 1 274 ? -29.897 28.968 62.077 1.00 64.88 ? 333 CYS D SG 1 ATOM 12599 N N . THR D 1 275 ? -32.701 26.284 60.985 1.00 66.89 ? 334 THR D N 1 ATOM 12600 C CA . THR D 1 275 ? -32.497 24.876 60.670 1.00 59.65 ? 334 THR D CA 1 ATOM 12601 C C . THR D 1 275 ? -32.875 24.542 59.229 1.00 60.61 ? 334 THR D C 1 ATOM 12602 O O . THR D 1 275 ? -32.113 23.894 58.511 1.00 63.36 ? 334 THR D O 1 ATOM 12603 C CB . THR D 1 275 ? -33.308 23.974 61.620 1.00 64.00 ? 334 THR D CB 1 ATOM 12604 O OG1 . THR D 1 275 ? -32.757 24.051 62.941 1.00 71.35 ? 334 THR D OG1 1 ATOM 12605 C CG2 . THR D 1 275 ? -33.284 22.526 61.144 1.00 53.59 ? 334 THR D CG2 1 ATOM 12606 N N . ASP D 1 276 ? -34.052 24.996 58.810 1.00 53.30 ? 335 ASP D N 1 ATOM 12607 C CA . ASP D 1 276 ? -34.590 24.630 57.504 1.00 53.56 ? 335 ASP D CA 1 ATOM 12608 C C . ASP D 1 276 ? -34.122 25.529 56.359 1.00 58.09 ? 335 ASP D C 1 ATOM 12609 O O . ASP D 1 276 ? -33.957 25.060 55.233 1.00 65.43 ? 335 ASP D O 1 ATOM 12610 C CB . ASP D 1 276 ? -36.122 24.630 57.547 1.00 54.13 ? 335 ASP D CB 1 ATOM 12611 C CG . ASP D 1 276 ? -36.678 23.751 58.651 1.00 63.78 ? 335 ASP D CG 1 ATOM 12612 O OD1 . ASP D 1 276 ? -36.026 22.744 58.998 1.00 83.16 ? 335 ASP D OD1 1 ATOM 12613 O OD2 . ASP D 1 276 ? -37.772 24.063 59.167 1.00 60.87 ? 335 ASP D OD2 1 ATOM 12614 N N . LYS D 1 277 ? -33.910 26.812 56.634 1.00 63.94 ? 336 LYS D N 1 ATOM 12615 C CA . LYS D 1 277 ? -33.700 27.766 55.546 1.00 59.03 ? 336 LYS D CA 1 ATOM 12616 C C . LYS D 1 277 ? -32.311 28.402 55.463 1.00 57.60 ? 336 LYS D C 1 ATOM 12617 O O . LYS D 1 277 ? -31.949 28.924 54.411 1.00 62.17 ? 336 LYS D O 1 ATOM 12618 C CB . LYS D 1 277 ? -34.741 28.887 55.636 1.00 54.45 ? 336 LYS D CB 1 ATOM 12619 C CG . LYS D 1 277 ? -36.186 28.422 55.571 1.00 55.24 ? 336 LYS D CG 1 ATOM 12620 C CD . LYS D 1 277 ? -36.544 27.952 54.170 1.00 59.94 ? 336 LYS D CD 1 ATOM 12621 C CE . LYS D 1 277 ? -37.967 27.420 54.105 1.00 68.73 ? 336 LYS D CE 1 ATOM 12622 N NZ . LYS D 1 277 ? -38.973 28.494 54.340 1.00 54.16 ? 336 LYS D NZ 1 ATOM 12623 N N . VAL D 1 278 ? -31.534 28.374 56.543 1.00 51.41 ? 337 VAL D N 1 ATOM 12624 C CA . VAL D 1 278 ? -30.217 29.019 56.516 1.00 50.77 ? 337 VAL D CA 1 ATOM 12625 C C . VAL D 1 278 ? -29.061 28.020 56.678 1.00 57.31 ? 337 VAL D C 1 ATOM 12626 O O . VAL D 1 278 ? -28.075 28.103 55.948 1.00 60.55 ? 337 VAL D O 1 ATOM 12627 C CB . VAL D 1 278 ? -30.119 30.177 57.568 1.00 56.91 ? 337 VAL D CB 1 ATOM 12628 C CG1 . VAL D 1 278 ? -31.501 30.659 57.958 1.00 51.35 ? 337 VAL D CG1 1 ATOM 12629 C CG2 . VAL D 1 278 ? -29.314 29.799 58.800 1.00 50.20 ? 337 VAL D CG2 1 ATOM 12630 N N . LYS D 1 279 ? -29.161 27.096 57.633 1.00 50.88 ? 338 LYS D N 1 ATOM 12631 C CA . LYS D 1 279 ? -28.126 26.084 57.819 1.00 50.78 ? 338 LYS D CA 1 ATOM 12632 C C . LYS D 1 279 ? -27.994 25.206 56.578 1.00 64.29 ? 338 LYS D C 1 ATOM 12633 O O . LYS D 1 279 ? -26.962 24.576 56.349 1.00 68.03 ? 338 LYS D O 1 ATOM 12634 C CB . LYS D 1 279 ? -28.419 25.225 59.051 1.00 54.80 ? 338 LYS D CB 1 ATOM 12635 C CG . LYS D 1 279 ? -27.965 25.855 60.360 1.00 56.16 ? 338 LYS D CG 1 ATOM 12636 C CD . LYS D 1 279 ? -28.324 24.988 61.556 1.00 51.08 ? 338 LYS D CD 1 ATOM 12637 C CE . LYS D 1 279 ? -27.696 25.529 62.830 1.00 53.88 ? 338 LYS D CE 1 ATOM 12638 N NZ . LYS D 1 279 ? -28.095 24.743 64.030 1.00 56.32 ? 338 LYS D NZ 1 ATOM 12639 N N . THR D 1 280 ? -29.057 25.179 55.782 1.00 62.08 ? 339 THR D N 1 ATOM 12640 C CA . THR D 1 280 ? -29.125 24.378 54.566 1.00 51.65 ? 339 THR D CA 1 ATOM 12641 C C . THR D 1 280 ? -28.654 25.171 53.346 1.00 62.57 ? 339 THR D C 1 ATOM 12642 O O . THR D 1 280 ? -28.606 24.642 52.236 1.00 74.17 ? 339 THR D O 1 ATOM 12643 C CB . THR D 1 280 ? -30.553 23.860 54.314 1.00 54.01 ? 339 THR D CB 1 ATOM 12644 O OG1 . THR D 1 280 ? -31.451 24.970 54.186 1.00 59.47 ? 339 THR D OG1 1 ATOM 12645 C CG2 . THR D 1 280 ? -31.010 22.975 55.464 1.00 52.70 ? 339 THR D CG2 1 ATOM 12646 N N . LYS D 1 281 ? -28.306 26.437 53.555 1.00 52.01 ? 340 LYS D N 1 ATOM 12647 C CA . LYS D 1 281 ? -27.852 27.291 52.459 1.00 70.22 ? 340 LYS D CA 1 ATOM 12648 C C . LYS D 1 281 ? -26.451 26.937 51.984 1.00 78.50 ? 340 LYS D C 1 ATOM 12649 O O . LYS D 1 281 ? -25.605 26.512 52.770 1.00 74.85 ? 340 LYS D O 1 ATOM 12650 C CB . LYS D 1 281 ? -27.860 28.763 52.880 1.00 61.92 ? 340 LYS D CB 1 ATOM 12651 C CG . LYS D 1 281 ? -29.228 29.396 53.026 1.00 69.70 ? 340 LYS D CG 1 ATOM 12652 C CD . LYS D 1 281 ? -29.096 30.854 53.448 1.00 77.87 ? 340 LYS D CD 1 ATOM 12653 C CE . LYS D 1 281 ? -30.384 31.628 53.224 1.00 88.15 ? 340 LYS D CE 1 ATOM 12654 N NZ . LYS D 1 281 ? -31.488 31.157 54.105 1.00 90.50 ? 340 LYS D NZ 1 ATOM 12655 N N . ARG D 1 282 ? -26.225 27.111 50.685 1.00 79.68 ? 341 ARG D N 1 ATOM 12656 C CA . ARG D 1 282 ? -24.932 26.848 50.065 1.00 72.99 ? 341 ARG D CA 1 ATOM 12657 C C . ARG D 1 282 ? -23.819 27.650 50.741 1.00 70.13 ? 341 ARG D C 1 ATOM 12658 O O . ARG D 1 282 ? -22.791 27.098 51.135 1.00 69.17 ? 341 ARG D O 1 ATOM 12659 C CB . ARG D 1 282 ? -24.999 27.187 48.572 1.00 86.64 ? 341 ARG D CB 1 ATOM 12660 C CG . ARG D 1 282 ? -23.837 26.680 47.738 1.00 101.54 ? 341 ARG D CG 1 ATOM 12661 C CD . ARG D 1 282 ? -23.903 27.240 46.323 1.00 112.58 ? 341 ARG D CD 1 ATOM 12662 N NE . ARG D 1 282 ? -23.366 28.596 46.251 1.00 125.62 ? 341 ARG D NE 1 ATOM 12663 C CZ . ARG D 1 282 ? -23.440 29.379 45.179 1.00 126.16 ? 341 ARG D CZ 1 ATOM 12664 N NH1 . ARG D 1 282 ? -24.043 28.950 44.079 1.00 133.18 ? 341 ARG D NH1 1 ATOM 12665 N NH2 . ARG D 1 282 ? -22.916 30.596 45.212 1.00 111.38 ? 341 ARG D NH2 1 ATOM 12666 N N . GLN D 1 283 ? -24.041 28.955 50.870 1.00 74.55 ? 342 GLN D N 1 ATOM 12667 C CA . GLN D 1 283 ? -23.064 29.870 51.459 1.00 68.27 ? 342 GLN D CA 1 ATOM 12668 C C . GLN D 1 283 ? -22.841 29.657 52.956 1.00 55.30 ? 342 GLN D C 1 ATOM 12669 O O . GLN D 1 283 ? -21.801 30.039 53.495 1.00 60.57 ? 342 GLN D O 1 ATOM 12670 C CB . GLN D 1 283 ? -23.494 31.321 51.216 1.00 81.68 ? 342 GLN D CB 1 ATOM 12671 C CG . GLN D 1 283 ? -23.727 31.662 49.754 1.00 98.94 ? 342 GLN D CG 1 ATOM 12672 C CD . GLN D 1 283 ? -24.144 33.108 49.542 1.00 101.42 ? 342 GLN D CD 1 ATOM 12673 O OE1 . GLN D 1 283 ? -24.220 33.893 50.487 1.00 94.84 ? 342 GLN D OE1 1 ATOM 12674 N NE2 . GLN D 1 283 ? -24.415 33.465 48.292 1.00 100.32 ? 342 GLN D NE2 1 ATOM 12675 N N . TYR D 1 284 ? -23.816 29.050 53.625 1.00 50.01 ? 343 TYR D N 1 ATOM 12676 C CA . TYR D 1 284 ? -23.792 28.962 55.082 1.00 54.61 ? 343 TYR D CA 1 ATOM 12677 C C . TYR D 1 284 ? -23.588 27.554 55.639 1.00 59.80 ? 343 TYR D C 1 ATOM 12678 O O . TYR D 1 284 ? -23.385 27.387 56.842 1.00 66.55 ? 343 TYR D O 1 ATOM 12679 C CB . TYR D 1 284 ? -25.093 29.544 55.645 1.00 66.43 ? 343 TYR D CB 1 ATOM 12680 C CG . TYR D 1 284 ? -25.229 31.039 55.457 1.00 61.31 ? 343 TYR D CG 1 ATOM 12681 C CD1 . TYR D 1 284 ? -25.681 31.570 54.254 1.00 58.84 ? 343 TYR D CD1 1 ATOM 12682 C CD2 . TYR D 1 284 ? -24.907 31.920 56.480 1.00 56.70 ? 343 TYR D CD2 1 ATOM 12683 C CE1 . TYR D 1 284 ? -25.806 32.936 54.077 1.00 54.43 ? 343 TYR D CE1 1 ATOM 12684 C CE2 . TYR D 1 284 ? -25.030 33.287 56.313 1.00 60.70 ? 343 TYR D CE2 1 ATOM 12685 C CZ . TYR D 1 284 ? -25.480 33.789 55.110 1.00 59.45 ? 343 TYR D CZ 1 ATOM 12686 O OH . TYR D 1 284 ? -25.602 35.149 54.942 1.00 66.31 ? 343 TYR D OH 1 ATOM 12687 N N . ALA D 1 285 ? -23.641 26.545 54.777 1.00 56.68 ? 344 ALA D N 1 ATOM 12688 C CA . ALA D 1 285 ? -23.541 25.162 55.235 1.00 60.09 ? 344 ALA D CA 1 ATOM 12689 C C . ALA D 1 285 ? -22.149 24.849 55.781 1.00 66.68 ? 344 ALA D C 1 ATOM 12690 O O . ALA D 1 285 ? -21.997 24.023 56.681 1.00 64.63 ? 344 ALA D O 1 ATOM 12691 C CB . ALA D 1 285 ? -23.892 24.202 54.109 1.00 54.61 ? 344 ALA D CB 1 ATOM 12692 N N . HIS D 1 286 ? -21.138 25.514 55.230 1.00 66.26 ? 345 HIS D N 1 ATOM 12693 C CA . HIS D 1 286 ? -19.752 25.305 55.643 1.00 48.05 ? 345 HIS D CA 1 ATOM 12694 C C . HIS D 1 286 ? -18.948 26.600 55.593 1.00 52.13 ? 345 HIS D C 1 ATOM 12695 O O . HIS D 1 286 ? -18.995 27.334 54.606 1.00 59.17 ? 345 HIS D O 1 ATOM 12696 C CB . HIS D 1 286 ? -19.083 24.241 54.770 1.00 56.07 ? 345 HIS D CB 1 ATOM 12697 C CG . HIS D 1 286 ? -19.724 22.891 54.861 1.00 62.34 ? 345 HIS D CG 1 ATOM 12698 N ND1 . HIS D 1 286 ? -19.392 21.975 55.835 1.00 59.93 ? 345 HIS D ND1 1 ATOM 12699 C CD2 . HIS D 1 286 ? -20.683 22.306 54.106 1.00 58.60 ? 345 HIS D CD2 1 ATOM 12700 C CE1 . HIS D 1 286 ? -20.113 20.880 55.671 1.00 75.68 ? 345 HIS D CE1 1 ATOM 12701 N NE2 . HIS D 1 286 ? -20.906 21.056 54.630 1.00 75.05 ? 345 HIS D NE2 1 ATOM 12702 N N . GLY D 1 287 ? -18.203 26.868 56.661 1.00 47.12 ? 346 GLY D N 1 ATOM 12703 C CA . GLY D 1 287 ? -17.346 28.038 56.727 1.00 55.35 ? 346 GLY D CA 1 ATOM 12704 C C . GLY D 1 287 ? -17.542 28.824 58.009 1.00 59.37 ? 346 GLY D C 1 ATOM 12705 O O . GLY D 1 287 ? -17.824 28.247 59.060 1.00 56.50 ? 346 GLY D O 1 ATOM 12706 N N . ARG D 1 288 ? -17.392 30.142 57.928 1.00 51.06 ? 347 ARG D N 1 ATOM 12707 C CA . ARG D 1 288 ? -17.483 30.995 59.109 1.00 63.11 ? 347 ARG D CA 1 ATOM 12708 C C . ARG D 1 288 ? -18.665 31.960 59.052 1.00 68.96 ? 347 ARG D C 1 ATOM 12709 O O . ARG D 1 288 ? -18.970 32.630 60.039 1.00 70.05 ? 347 ARG D O 1 ATOM 12710 C CB . ARG D 1 288 ? -16.183 31.782 59.291 1.00 50.59 ? 347 ARG D CB 1 ATOM 12711 C CG . ARG D 1 288 ? -15.859 32.703 58.130 1.00 46.73 ? 347 ARG D CG 1 ATOM 12712 C CD . ARG D 1 288 ? -14.680 33.611 58.442 1.00 47.51 ? 347 ARG D CD 1 ATOM 12713 N NE . ARG D 1 288 ? -14.989 34.568 59.499 1.00 56.56 ? 347 ARG D NE 1 ATOM 12714 C CZ . ARG D 1 288 ? -14.196 34.820 60.535 1.00 62.20 ? 347 ARG D CZ 1 ATOM 12715 N NH1 . ARG D 1 288 ? -13.035 34.189 60.654 1.00 65.27 ? 347 ARG D NH1 1 ATOM 12716 N NH2 . ARG D 1 288 ? -14.560 35.708 61.450 1.00 54.49 ? 347 ARG D NH2 1 ATOM 12717 N N . ARG D 1 289 ? -19.318 32.026 57.894 1.00 58.23 ? 348 ARG D N 1 ATOM 12718 C CA . ARG D 1 289 ? -20.409 32.972 57.664 1.00 53.92 ? 348 ARG D CA 1 ATOM 12719 C C . ARG D 1 289 ? -21.510 32.909 58.721 1.00 53.99 ? 348 ARG D C 1 ATOM 12720 O O . ARG D 1 289 ? -21.944 33.945 59.224 1.00 62.87 ? 348 ARG D O 1 ATOM 12721 C CB . ARG D 1 289 ? -21.018 32.763 56.275 1.00 49.29 ? 348 ARG D CB 1 ATOM 12722 C CG . ARG D 1 289 ? -20.136 33.255 55.139 1.00 60.50 ? 348 ARG D CG 1 ATOM 12723 C CD . ARG D 1 289 ? -20.936 33.456 53.863 1.00 66.30 ? 348 ARG D CD 1 ATOM 12724 N NE . ARG D 1 289 ? -20.086 33.842 52.740 1.00 79.18 ? 348 ARG D NE 1 ATOM 12725 C CZ . ARG D 1 289 ? -20.545 34.232 51.556 1.00 97.18 ? 348 ARG D CZ 1 ATOM 12726 N NH1 . ARG D 1 289 ? -21.851 34.299 51.339 1.00 113.38 ? 348 ARG D NH1 1 ATOM 12727 N NH2 . ARG D 1 289 ? -19.700 34.564 50.590 1.00 88.61 ? 348 ARG D NH2 1 ATOM 12728 N N . LEU D 1 290 ? -21.962 31.704 59.055 1.00 50.11 ? 349 LEU D N 1 ATOM 12729 C CA . LEU D 1 290 ? -23.036 31.554 60.033 1.00 49.14 ? 349 LEU D CA 1 ATOM 12730 C C . LEU D 1 290 ? -22.602 32.002 61.427 1.00 62.17 ? 349 LEU D C 1 ATOM 12731 O O . LEU D 1 290 ? -23.369 32.646 62.144 1.00 74.82 ? 349 LEU D O 1 ATOM 12732 C CB . LEU D 1 290 ? -23.521 30.103 60.085 1.00 51.85 ? 349 LEU D CB 1 ATOM 12733 C CG . LEU D 1 290 ? -24.791 29.778 59.298 1.00 61.80 ? 349 LEU D CG 1 ATOM 12734 C CD1 . LEU D 1 290 ? -25.188 28.321 59.485 1.00 64.90 ? 349 LEU D CD1 1 ATOM 12735 C CD2 . LEU D 1 290 ? -25.925 30.704 59.713 1.00 57.49 ? 349 LEU D CD2 1 ATOM 12736 N N . LEU D 1 291 ? -21.375 31.661 61.807 1.00 61.17 ? 350 LEU D N 1 ATOM 12737 C CA . LEU D 1 291 ? -20.822 32.106 63.082 1.00 52.74 ? 350 LEU D CA 1 ATOM 12738 C C . LEU D 1 291 ? -20.633 33.620 63.090 1.00 63.43 ? 350 LEU D C 1 ATOM 12739 O O . LEU D 1 291 ? -20.798 34.272 64.123 1.00 56.05 ? 350 LEU D O 1 ATOM 12740 C CB . LEU D 1 291 ? -19.499 31.397 63.371 1.00 46.37 ? 350 LEU D CB 1 ATOM 12741 C CG . LEU D 1 291 ? -19.639 29.951 63.851 1.00 63.91 ? 350 LEU D CG 1 ATOM 12742 C CD1 . LEU D 1 291 ? -18.283 29.268 63.896 1.00 56.75 ? 350 LEU D CD1 1 ATOM 12743 C CD2 . LEU D 1 291 ? -20.318 29.896 65.214 1.00 53.04 ? 350 LEU D CD2 1 ATOM 12744 N N . ASP D 1 292 ? -20.288 34.170 61.929 1.00 48.32 ? 351 ASP D N 1 ATOM 12745 C CA . ASP D 1 292 ? -20.160 35.614 61.769 1.00 52.42 ? 351 ASP D CA 1 ATOM 12746 C C . ASP D 1 292 ? -21.511 36.296 61.941 1.00 55.13 ? 351 ASP D C 1 ATOM 12747 O O . ASP D 1 292 ? -21.625 37.305 62.639 1.00 58.54 ? 351 ASP D O 1 ATOM 12748 C CB . ASP D 1 292 ? -19.573 35.958 60.397 1.00 45.34 ? 351 ASP D CB 1 ATOM 12749 C CG . ASP D 1 292 ? -18.116 35.560 60.265 1.00 57.18 ? 351 ASP D CG 1 ATOM 12750 O OD1 . ASP D 1 292 ? -17.459 35.337 61.304 1.00 45.45 ? 351 ASP D OD1 1 ATOM 12751 O OD2 . ASP D 1 292 ? -17.625 35.478 59.119 1.00 57.29 ? 351 ASP D OD2 1 ATOM 12752 N N . LEU D 1 293 ? -22.529 35.735 61.296 1.00 55.20 ? 352 LEU D N 1 ATOM 12753 C CA . LEU D 1 293 ? -23.885 36.268 61.356 1.00 47.74 ? 352 LEU D CA 1 ATOM 12754 C C . LEU D 1 293 ? -24.414 36.313 62.786 1.00 56.00 ? 352 LEU D C 1 ATOM 12755 O O . LEU D 1 293 ? -25.100 37.258 63.174 1.00 54.50 ? 352 LEU D O 1 ATOM 12756 C CB . LEU D 1 293 ? -24.819 35.439 60.475 1.00 47.16 ? 352 LEU D CB 1 ATOM 12757 C CG . LEU D 1 293 ? -26.246 35.961 60.309 1.00 47.50 ? 352 LEU D CG 1 ATOM 12758 C CD1 . LEU D 1 293 ? -26.636 35.958 58.844 1.00 55.03 ? 352 LEU D CD1 1 ATOM 12759 C CD2 . LEU D 1 293 ? -27.219 35.124 61.118 1.00 49.93 ? 352 LEU D CD2 1 ATOM 12760 N N . VAL D 1 294 ? -24.101 35.284 63.566 1.00 46.91 ? 353 VAL D N 1 ATOM 12761 C CA . VAL D 1 294 ? -24.504 35.247 64.966 1.00 56.44 ? 353 VAL D CA 1 ATOM 12762 C C . VAL D 1 294 ? -23.750 36.309 65.759 1.00 52.01 ? 353 VAL D C 1 ATOM 12763 O O . VAL D 1 294 ? -24.333 37.018 66.581 1.00 49.76 ? 353 VAL D O 1 ATOM 12764 C CB . VAL D 1 294 ? -24.254 33.860 65.591 1.00 47.29 ? 353 VAL D CB 1 ATOM 12765 C CG1 . VAL D 1 294 ? -24.488 33.898 67.094 1.00 47.34 ? 353 VAL D CG1 1 ATOM 12766 C CG2 . VAL D 1 294 ? -25.149 32.819 64.939 1.00 47.87 ? 353 VAL D CG2 1 ATOM 12767 N N . ASP D 1 295 ? -22.454 36.425 65.488 1.00 51.49 ? 354 ASP D N 1 ATOM 12768 C CA . ASP D 1 295 ? -21.607 37.406 66.159 1.00 50.12 ? 354 ASP D CA 1 ATOM 12769 C C . ASP D 1 295 ? -22.078 38.836 65.905 1.00 63.52 ? 354 ASP D C 1 ATOM 12770 O O . ASP D 1 295 ? -22.165 39.642 66.831 1.00 54.81 ? 354 ASP D O 1 ATOM 12771 C CB . ASP D 1 295 ? -20.154 37.244 65.709 1.00 45.12 ? 354 ASP D CB 1 ATOM 12772 C CG . ASP D 1 295 ? -19.367 36.315 66.612 1.00 60.99 ? 354 ASP D CG 1 ATOM 12773 O OD1 . ASP D 1 295 ? -19.895 35.934 67.679 1.00 53.91 ? 354 ASP D OD1 1 ATOM 12774 O OD2 . ASP D 1 295 ? -18.219 35.971 66.261 1.00 60.53 ? 354 ASP D OD2 1 ATOM 12775 N N . ILE D 1 296 ? -22.378 39.143 64.648 1.00 45.36 ? 355 ILE D N 1 ATOM 12776 C CA . ILE D 1 296 ? -22.772 40.493 64.266 1.00 52.68 ? 355 ILE D CA 1 ATOM 12777 C C . ILE D 1 296 ? -24.184 40.819 64.761 1.00 58.63 ? 355 ILE D C 1 ATOM 12778 O O . ILE D 1 296 ? -24.488 41.972 65.065 1.00 46.93 ? 355 ILE D O 1 ATOM 12779 C CB . ILE D 1 296 ? -22.680 40.691 62.731 1.00 47.70 ? 355 ILE D CB 1 ATOM 12780 C CG1 . ILE D 1 296 ? -22.804 42.169 62.361 1.00 48.73 ? 355 ILE D CG1 1 ATOM 12781 C CG2 . ILE D 1 296 ? -23.725 39.865 62.000 1.00 47.86 ? 355 ILE D CG2 1 ATOM 12782 C CD1 . ILE D 1 296 ? -22.572 42.437 60.891 1.00 49.03 ? 355 ILE D CD1 1 ATOM 12783 N N . HIS D 1 297 ? -25.040 39.803 64.851 1.00 46.03 ? 356 HIS D N 1 ATOM 12784 C CA . HIS D 1 297 ? -26.392 39.990 65.369 1.00 46.40 ? 356 HIS D CA 1 ATOM 12785 C C . HIS D 1 297 ? -26.393 40.109 66.888 1.00 46.34 ? 356 HIS D C 1 ATOM 12786 O O . HIS D 1 297 ? -27.285 40.728 67.469 1.00 56.28 ? 356 HIS D O 1 ATOM 12787 C CB . HIS D 1 297 ? -27.304 38.843 64.927 1.00 47.00 ? 356 HIS D CB 1 ATOM 12788 C CG . HIS D 1 297 ? -27.983 39.087 63.616 1.00 52.90 ? 356 HIS D CG 1 ATOM 12789 N ND1 . HIS D 1 297 ? -29.293 39.504 63.523 1.00 47.50 ? 356 HIS D ND1 1 ATOM 12790 C CD2 . HIS D 1 297 ? -27.530 38.984 62.344 1.00 47.09 ? 356 HIS D CD2 1 ATOM 12791 C CE1 . HIS D 1 297 ? -29.620 39.642 62.251 1.00 51.90 ? 356 HIS D CE1 1 ATOM 12792 N NE2 . HIS D 1 297 ? -28.567 39.334 61.515 1.00 49.09 ? 356 HIS D NE2 1 ATOM 12793 N N . ILE D 1 298 ? -25.391 39.514 67.527 1.00 46.73 ? 357 ILE D N 1 ATOM 12794 C CA . ILE D 1 298 ? -25.194 39.692 68.960 1.00 56.13 ? 357 ILE D CA 1 ATOM 12795 C C . ILE D 1 298 ? -24.814 41.146 69.210 1.00 54.68 ? 357 ILE D C 1 ATOM 12796 O O . ILE D 1 298 ? -25.290 41.778 70.153 1.00 48.49 ? 357 ILE D O 1 ATOM 12797 C CB . ILE D 1 298 ? -24.107 38.744 69.514 1.00 48.93 ? 357 ILE D CB 1 ATOM 12798 C CG1 . ILE D 1 298 ? -24.675 37.336 69.703 1.00 46.47 ? 357 ILE D CG1 1 ATOM 12799 C CG2 . ILE D 1 298 ? -23.564 39.256 70.840 1.00 53.31 ? 357 ILE D CG2 1 ATOM 12800 C CD1 . ILE D 1 298 ? -23.660 36.332 70.201 1.00 58.96 ? 357 ILE D CD1 1 ATOM 12801 N N . LEU D 1 299 ? -23.963 41.670 68.334 1.00 47.40 ? 358 LEU D N 1 ATOM 12802 C CA . LEU D 1 299 ? -23.547 43.064 68.388 1.00 47.46 ? 358 LEU D CA 1 ATOM 12803 C C . LEU D 1 299 ? -24.729 44.000 68.154 1.00 57.61 ? 358 LEU D C 1 ATOM 12804 O O . LEU D 1 299 ? -24.941 44.951 68.908 1.00 46.44 ? 358 LEU D O 1 ATOM 12805 C CB . LEU D 1 299 ? -22.455 43.331 67.350 1.00 44.28 ? 358 LEU D CB 1 ATOM 12806 C CG . LEU D 1 299 ? -21.901 44.753 67.260 1.00 43.76 ? 358 LEU D CG 1 ATOM 12807 C CD1 . LEU D 1 299 ? -21.123 45.103 68.515 1.00 43.42 ? 358 LEU D CD1 1 ATOM 12808 C CD2 . LEU D 1 299 ? -21.031 44.916 66.023 1.00 43.76 ? 358 LEU D CD2 1 ATOM 12809 N N . ASP D 1 300 ? -25.498 43.716 67.107 1.00 47.72 ? 359 ASP D N 1 ATOM 12810 C CA . ASP D 1 300 ? -26.644 44.541 66.737 1.00 45.26 ? 359 ASP D CA 1 ATOM 12811 C C . ASP D 1 300 ? -27.726 44.572 67.815 1.00 58.13 ? 359 ASP D C 1 ATOM 12812 O O . ASP D 1 300 ? -28.383 45.594 68.008 1.00 49.00 ? 359 ASP D O 1 ATOM 12813 C CB . ASP D 1 300 ? -27.241 44.045 65.419 1.00 45.60 ? 359 ASP D CB 1 ATOM 12814 C CG . ASP D 1 300 ? -26.378 44.393 64.223 1.00 45.27 ? 359 ASP D CG 1 ATOM 12815 O OD1 . ASP D 1 300 ? -25.525 45.297 64.348 1.00 44.77 ? 359 ASP D OD1 1 ATOM 12816 O OD2 . ASP D 1 300 ? -26.548 43.761 63.160 1.00 45.51 ? 359 ASP D OD2 1 ATOM 12817 N N . TYR D 1 301 ? -27.912 43.456 68.512 1.00 45.90 ? 360 TYR D N 1 ATOM 12818 C CA . TYR D 1 301 ? -28.908 43.388 69.577 1.00 46.21 ? 360 TYR D CA 1 ATOM 12819 C C . TYR D 1 301 ? -28.487 44.182 70.806 1.00 45.85 ? 360 TYR D C 1 ATOM 12820 O O . TYR D 1 301 ? -29.321 44.800 71.469 1.00 50.49 ? 360 TYR D O 1 ATOM 12821 C CB . TYR D 1 301 ? -29.187 41.939 69.972 1.00 50.26 ? 360 TYR D CB 1 ATOM 12822 C CG . TYR D 1 301 ? -30.122 41.817 71.154 1.00 55.94 ? 360 TYR D CG 1 ATOM 12823 C CD1 . TYR D 1 301 ? -31.467 42.136 71.036 1.00 52.84 ? 360 TYR D CD1 1 ATOM 12824 C CD2 . TYR D 1 301 ? -29.657 41.383 72.390 1.00 53.95 ? 360 TYR D CD2 1 ATOM 12825 C CE1 . TYR D 1 301 ? -32.326 42.029 72.114 1.00 47.63 ? 360 TYR D CE1 1 ATOM 12826 C CE2 . TYR D 1 301 ? -30.508 41.270 73.474 1.00 48.67 ? 360 TYR D CE2 1 ATOM 12827 C CZ . TYR D 1 301 ? -31.840 41.596 73.331 1.00 59.58 ? 360 TYR D CZ 1 ATOM 12828 O OH . TYR D 1 301 ? -32.691 41.485 74.406 1.00 61.42 ? 360 TYR D OH 1 ATOM 12829 N N . LEU D 1 302 ? -27.194 44.151 71.112 1.00 48.35 ? 361 LEU D N 1 ATOM 12830 C CA . LEU D 1 302 ? -26.660 44.899 72.243 1.00 45.07 ? 361 LEU D CA 1 ATOM 12831 C C . LEU D 1 302 ? -26.836 46.397 72.025 1.00 55.36 ? 361 LEU D C 1 ATOM 12832 O O . LEU D 1 302 ? -27.056 47.152 72.972 1.00 48.63 ? 361 LEU D O 1 ATOM 12833 C CB . LEU D 1 302 ? -25.182 44.567 72.461 1.00 44.70 ? 361 LEU D CB 1 ATOM 12834 C CG . LEU D 1 302 ? -24.867 43.208 73.091 1.00 60.06 ? 361 LEU D CG 1 ATOM 12835 C CD1 . LEU D 1 302 ? -23.388 42.881 72.948 1.00 44.59 ? 361 LEU D CD1 1 ATOM 12836 C CD2 . LEU D 1 302 ? -25.281 43.194 74.555 1.00 45.06 ? 361 LEU D CD2 1 ATOM 12837 N N . ILE D 1 303 ? -26.749 46.816 70.767 1.00 45.25 ? 362 ILE D N 1 ATOM 12838 C CA . ILE D 1 303 ? -26.855 48.227 70.417 1.00 44.27 ? 362 ILE D CA 1 ATOM 12839 C C . ILE D 1 303 ? -28.239 48.571 69.873 1.00 50.30 ? 362 ILE D C 1 ATOM 12840 O O . ILE D 1 303 ? -28.541 49.736 69.617 1.00 47.50 ? 362 ILE D O 1 ATOM 12841 C CB . ILE D 1 303 ? -25.790 48.622 69.381 1.00 43.88 ? 362 ILE D CB 1 ATOM 12842 C CG1 . ILE D 1 303 ? -26.079 47.945 68.041 1.00 44.17 ? 362 ILE D CG1 1 ATOM 12843 C CG2 . ILE D 1 303 ? -24.409 48.240 69.876 1.00 43.56 ? 362 ILE D CG2 1 ATOM 12844 C CD1 . ILE D 1 303 ? -24.935 48.027 67.052 1.00 43.83 ? 362 ILE D CD1 1 ATOM 12845 N N . GLY D 1 304 ? -29.075 47.552 69.698 1.00 45.13 ? 363 GLY D N 1 ATOM 12846 C CA . GLY D 1 304 ? -30.426 47.747 69.200 1.00 45.50 ? 363 GLY D CA 1 ATOM 12847 C C . GLY D 1 304 ? -30.499 48.112 67.728 1.00 45.45 ? 363 GLY D C 1 ATOM 12848 O O . GLY D 1 304 ? -31.441 48.775 67.295 1.00 45.62 ? 363 GLY D O 1 ATOM 12849 N N . ASN D 1 305 ? -29.508 47.678 66.955 1.00 45.50 ? 364 ASN D N 1 ATOM 12850 C CA . ASN D 1 305 ? -29.480 47.946 65.521 1.00 45.24 ? 364 ASN D CA 1 ATOM 12851 C C . ASN D 1 305 ? -30.376 46.988 64.742 1.00 46.16 ? 364 ASN D C 1 ATOM 12852 O O . ASN D 1 305 ? -30.140 45.781 64.723 1.00 46.05 ? 364 ASN D O 1 ATOM 12853 C CB . ASN D 1 305 ? -28.047 47.863 64.993 1.00 44.84 ? 364 ASN D CB 1 ATOM 12854 C CG . ASN D 1 305 ? -27.965 48.067 63.492 1.00 44.80 ? 364 ASN D CG 1 ATOM 12855 O OD1 . ASN D 1 305 ? -28.770 48.792 62.907 1.00 44.86 ? 364 ASN D OD1 1 ATOM 12856 N ND2 . ASN D 1 305 ? -26.990 47.425 62.861 1.00 44.69 ? 364 ASN D ND2 1 ATOM 12857 N N . GLN D 1 306 ? -31.402 47.534 64.096 1.00 45.97 ? 365 GLN D N 1 ATOM 12858 C CA . GLN D 1 306 ? -32.356 46.719 63.349 1.00 53.24 ? 365 GLN D CA 1 ATOM 12859 C C . GLN D 1 306 ? -32.081 46.705 61.849 1.00 46.46 ? 365 GLN D C 1 ATOM 12860 O O . GLN D 1 306 ? -32.673 45.915 61.113 1.00 59.63 ? 365 GLN D O 1 ATOM 12861 C CB . GLN D 1 306 ? -33.785 47.212 63.593 1.00 46.81 ? 365 GLN D CB 1 ATOM 12862 C CG . GLN D 1 306 ? -34.221 47.201 65.045 1.00 46.92 ? 365 GLN D CG 1 ATOM 12863 C CD . GLN D 1 306 ? -35.618 47.765 65.229 1.00 47.19 ? 365 GLN D CD 1 ATOM 12864 O OE1 . GLN D 1 306 ? -35.936 48.845 64.730 1.00 46.99 ? 365 GLN D OE1 1 ATOM 12865 N NE2 . GLN D 1 306 ? -36.463 47.032 65.944 1.00 47.65 ? 365 GLN D NE2 1 ATOM 12866 N N . ASP D 1 307 ? -31.188 47.577 61.396 1.00 45.96 ? 366 ASP D N 1 ATOM 12867 C CA . ASP D 1 307 ? -31.046 47.840 59.968 1.00 45.88 ? 366 ASP D CA 1 ATOM 12868 C C . ASP D 1 307 ? -29.947 46.998 59.321 1.00 45.78 ? 366 ASP D C 1 ATOM 12869 O O . ASP D 1 307 ? -29.255 47.460 58.416 1.00 63.63 ? 366 ASP D O 1 ATOM 12870 C CB . ASP D 1 307 ? -30.771 49.328 59.734 1.00 45.40 ? 366 ASP D CB 1 ATOM 12871 C CG . ASP D 1 307 ? -31.147 49.780 58.334 1.00 53.19 ? 366 ASP D CG 1 ATOM 12872 O OD1 . ASP D 1 307 ? -32.001 49.122 57.705 1.00 50.53 ? 366 ASP D OD1 1 ATOM 12873 O OD2 . ASP D 1 307 ? -30.590 50.794 57.862 1.00 53.76 ? 366 ASP D OD2 1 ATOM 12874 N N . ARG D 1 308 ? -29.788 45.762 59.786 1.00 49.17 ? 367 ARG D N 1 ATOM 12875 C CA . ARG D 1 308 ? -28.773 44.872 59.231 1.00 45.99 ? 367 ARG D CA 1 ATOM 12876 C C . ARG D 1 308 ? -29.348 44.070 58.066 1.00 54.47 ? 367 ARG D C 1 ATOM 12877 O O . ARG D 1 308 ? -29.706 42.900 58.214 1.00 46.84 ? 367 ARG D O 1 ATOM 12878 C CB . ARG D 1 308 ? -28.228 43.934 60.309 1.00 46.05 ? 367 ARG D CB 1 ATOM 12879 C CG . ARG D 1 308 ? -27.008 43.130 59.878 1.00 45.89 ? 367 ARG D CG 1 ATOM 12880 C CD . ARG D 1 308 ? -25.776 44.013 59.743 1.00 45.28 ? 367 ARG D CD 1 ATOM 12881 N NE . ARG D 1 308 ? -25.343 44.546 61.031 1.00 48.37 ? 367 ARG D NE 1 ATOM 12882 C CZ . ARG D 1 308 ? -24.297 45.349 61.192 1.00 46.74 ? 367 ARG D CZ 1 ATOM 12883 N NH1 . ARG D 1 308 ? -23.569 45.709 60.145 1.00 44.16 ? 367 ARG D NH1 1 ATOM 12884 N NH2 . ARG D 1 308 ? -23.975 45.787 62.402 1.00 44.22 ? 367 ARG D NH2 1 ATOM 12885 N N . HIS D 1 309 ? -29.447 44.715 56.909 1.00 46.71 ? 368 HIS D N 1 ATOM 12886 C CA . HIS D 1 309 ? -30.035 44.091 55.729 1.00 46.68 ? 368 HIS D CA 1 ATOM 12887 C C . HIS D 1 309 ? -28.989 43.465 54.809 1.00 46.54 ? 368 HIS D C 1 ATOM 12888 O O . HIS D 1 309 ? -29.282 42.514 54.086 1.00 53.20 ? 368 HIS D O 1 ATOM 12889 C CB . HIS D 1 309 ? -30.870 45.114 54.954 1.00 46.69 ? 368 HIS D CB 1 ATOM 12890 C CG . HIS D 1 309 ? -30.146 46.393 54.665 1.00 51.01 ? 368 HIS D CG 1 ATOM 12891 N ND1 . HIS D 1 309 ? -29.346 46.562 53.556 1.00 55.87 ? 368 HIS D ND1 1 ATOM 12892 C CD2 . HIS D 1 309 ? -30.104 47.565 55.341 1.00 45.78 ? 368 HIS D CD2 1 ATOM 12893 C CE1 . HIS D 1 309 ? -28.843 47.783 53.560 1.00 45.39 ? 368 HIS D CE1 1 ATOM 12894 N NE2 . HIS D 1 309 ? -29.287 48.413 54.633 1.00 56.56 ? 368 HIS D NE2 1 ATOM 12895 N N . HIS D 1 310 ? -27.774 44.004 54.832 1.00 62.30 ? 369 HIS D N 1 ATOM 12896 C CA . HIS D 1 310 ? -26.692 43.484 54.000 1.00 45.84 ? 369 HIS D CA 1 ATOM 12897 C C . HIS D 1 310 ? -25.406 43.296 54.796 1.00 45.46 ? 369 HIS D C 1 ATOM 12898 O O . HIS D 1 310 ? -25.230 43.885 55.863 1.00 49.69 ? 369 HIS D O 1 ATOM 12899 C CB . HIS D 1 310 ? -26.431 44.415 52.812 1.00 49.47 ? 369 HIS D CB 1 ATOM 12900 C CG . HIS D 1 310 ? -27.380 44.224 51.670 1.00 67.32 ? 369 HIS D CG 1 ATOM 12901 N ND1 . HIS D 1 310 ? -28.745 44.354 51.807 1.00 76.55 ? 369 HIS D ND1 1 ATOM 12902 C CD2 . HIS D 1 310 ? -27.159 43.936 50.365 1.00 74.06 ? 369 HIS D CD2 1 ATOM 12903 C CE1 . HIS D 1 310 ? -29.326 44.143 50.640 1.00 79.94 ? 369 HIS D CE1 1 ATOM 12904 N NE2 . HIS D 1 310 ? -28.386 43.888 49.748 1.00 82.17 ? 369 HIS D NE2 1 ATOM 12905 N N . PHE D 1 311 ? -24.511 42.467 54.269 1.00 55.12 ? 370 PHE D N 1 ATOM 12906 C CA . PHE D 1 311 ? -23.193 42.279 54.862 1.00 45.03 ? 370 PHE D CA 1 ATOM 12907 C C . PHE D 1 311 ? -22.092 42.782 53.938 1.00 52.12 ? 370 PHE D C 1 ATOM 12908 O O . PHE D 1 311 ? -22.226 42.748 52.715 1.00 50.13 ? 370 PHE D O 1 ATOM 12909 C CB . PHE D 1 311 ? -22.956 40.808 55.202 1.00 45.32 ? 370 PHE D CB 1 ATOM 12910 C CG . PHE D 1 311 ? -23.888 40.272 56.246 1.00 51.22 ? 370 PHE D CG 1 ATOM 12911 C CD1 . PHE D 1 311 ? -23.749 40.650 57.570 1.00 52.03 ? 370 PHE D CD1 1 ATOM 12912 C CD2 . PHE D 1 311 ? -24.896 39.385 55.908 1.00 49.69 ? 370 PHE D CD2 1 ATOM 12913 C CE1 . PHE D 1 311 ? -24.601 40.161 58.538 1.00 59.01 ? 370 PHE D CE1 1 ATOM 12914 C CE2 . PHE D 1 311 ? -25.750 38.889 56.874 1.00 46.65 ? 370 PHE D CE2 1 ATOM 12915 C CZ . PHE D 1 311 ? -25.603 39.279 58.190 1.00 52.37 ? 370 PHE D CZ 1 ATOM 12916 N N . GLU D 1 312 ? -21.006 43.253 54.538 1.00 51.75 ? 371 GLU D N 1 ATOM 12917 C CA . GLU D 1 312 ? -19.873 43.765 53.782 1.00 44.30 ? 371 GLU D CA 1 ATOM 12918 C C . GLU D 1 312 ? -18.622 42.951 54.092 1.00 51.46 ? 371 GLU D C 1 ATOM 12919 O O . GLU D 1 312 ? -18.357 42.631 55.248 1.00 48.99 ? 371 GLU D O 1 ATOM 12920 C CB . GLU D 1 312 ? -19.643 45.243 54.101 1.00 48.95 ? 371 GLU D CB 1 ATOM 12921 C CG . GLU D 1 312 ? -18.641 45.924 53.191 1.00 62.41 ? 371 GLU D CG 1 ATOM 12922 C CD . GLU D 1 312 ? -19.290 46.479 51.941 1.00 68.80 ? 371 GLU D CD 1 ATOM 12923 O OE1 . GLU D 1 312 ? -20.499 46.239 51.743 1.00 65.51 ? 371 GLU D OE1 1 ATOM 12924 O OE2 . GLU D 1 312 ? -18.594 47.152 51.156 1.00 76.27 ? 371 GLU D OE2 1 ATOM 12925 N N . SER D 1 313 ? -17.868 42.598 53.057 1.00 59.09 ? 372 SER D N 1 ATOM 12926 C CA . SER D 1 313 ? -16.671 41.783 53.237 1.00 51.01 ? 372 SER D CA 1 ATOM 12927 C C . SER D 1 313 ? -15.598 42.101 52.203 1.00 63.87 ? 372 SER D C 1 ATOM 12928 O O . SER D 1 313 ? -15.908 42.423 51.058 1.00 62.21 ? 372 SER D O 1 ATOM 12929 C CB . SER D 1 313 ? -17.026 40.297 53.169 1.00 48.07 ? 372 SER D CB 1 ATOM 12930 O OG . SER D 1 313 ? -17.787 39.903 54.298 1.00 60.06 ? 372 SER D OG 1 ATOM 12931 N N . PHE D 1 314 ? -14.336 42.009 52.612 1.00 65.61 ? 373 PHE D N 1 ATOM 12932 C CA . PHE D 1 314 ? -13.231 42.135 51.670 1.00 57.61 ? 373 PHE D CA 1 ATOM 12933 C C . PHE D 1 314 ? -13.161 40.913 50.757 1.00 70.05 ? 373 PHE D C 1 ATOM 12934 O O . PHE D 1 314 ? -13.429 39.792 51.187 1.00 65.04 ? 373 PHE D O 1 ATOM 12935 C CB . PHE D 1 314 ? -11.901 42.317 52.408 1.00 41.71 ? 373 PHE D CB 1 ATOM 12936 C CG . PHE D 1 314 ? -11.810 43.596 53.195 1.00 41.39 ? 373 PHE D CG 1 ATOM 12937 C CD1 . PHE D 1 314 ? -11.857 44.823 52.553 1.00 41.15 ? 373 PHE D CD1 1 ATOM 12938 C CD2 . PHE D 1 314 ? -11.661 43.571 54.573 1.00 41.32 ? 373 PHE D CD2 1 ATOM 12939 C CE1 . PHE D 1 314 ? -11.769 46.002 53.270 1.00 43.64 ? 373 PHE D CE1 1 ATOM 12940 C CE2 . PHE D 1 314 ? -11.572 44.748 55.296 1.00 41.02 ? 373 PHE D CE2 1 ATOM 12941 C CZ . PHE D 1 314 ? -11.627 45.964 54.644 1.00 46.24 ? 373 PHE D CZ 1 ATOM 12942 N N . ASN D 1 315 ? -12.812 41.138 49.496 1.00 75.93 ? 374 ASN D N 1 ATOM 12943 C CA . ASN D 1 315 ? -12.606 40.046 48.552 1.00 78.22 ? 374 ASN D CA 1 ATOM 12944 C C . ASN D 1 315 ? -11.258 40.211 47.866 1.00 69.82 ? 374 ASN D C 1 ATOM 12945 O O . ASN D 1 315 ? -11.191 40.477 46.669 1.00 64.18 ? 374 ASN D O 1 ATOM 12946 C CB . ASN D 1 315 ? -13.732 39.995 47.519 1.00 72.46 ? 374 ASN D CB 1 ATOM 12947 C CG . ASN D 1 315 ? -13.749 38.695 46.740 1.00 68.13 ? 374 ASN D CG 1 ATOM 12948 O OD1 . ASN D 1 315 ? -13.202 37.684 47.184 1.00 65.01 ? 374 ASN D OD1 1 ATOM 12949 N ND2 . ASN D 1 315 ? -14.380 38.712 45.572 1.00 63.65 ? 374 ASN D ND2 1 ATOM 12950 N N . VAL D 1 316 ? -10.186 40.014 48.623 1.00 58.96 ? 375 VAL D N 1 ATOM 12951 C CA . VAL D 1 316 ? -8.850 40.397 48.182 1.00 80.72 ? 375 VAL D CA 1 ATOM 12952 C C . VAL D 1 316 ? -7.862 39.262 48.430 1.00 80.02 ? 375 VAL D C 1 ATOM 12953 O O . VAL D 1 316 ? -6.843 39.141 47.748 1.00 82.33 ? 375 VAL D O 1 ATOM 12954 C CB . VAL D 1 316 ? -8.375 41.685 48.905 1.00 69.75 ? 375 VAL D CB 1 ATOM 12955 C CG1 . VAL D 1 316 ? -8.269 41.459 50.411 1.00 49.63 ? 375 VAL D CG1 1 ATOM 12956 C CG2 . VAL D 1 316 ? -7.056 42.184 48.326 1.00 76.56 ? 375 VAL D CG2 1 ATOM 12957 N N . PHE D 1 317 ? -8.184 38.422 49.404 1.00 68.59 ? 376 PHE D N 1 ATOM 12958 C CA . PHE D 1 317 ? -7.376 37.255 49.709 1.00 60.25 ? 376 PHE D CA 1 ATOM 12959 C C . PHE D 1 317 ? -7.800 36.122 48.784 1.00 86.34 ? 376 PHE D C 1 ATOM 12960 O O . PHE D 1 317 ? -8.887 35.564 48.934 1.00 93.47 ? 376 PHE D O 1 ATOM 12961 C CB . PHE D 1 317 ? -7.517 36.858 51.180 1.00 61.39 ? 376 PHE D CB 1 ATOM 12962 C CG . PHE D 1 317 ? -7.019 37.905 52.136 1.00 79.75 ? 376 PHE D CG 1 ATOM 12963 C CD1 . PHE D 1 317 ? -5.988 38.757 51.775 1.00 87.90 ? 376 PHE D CD1 1 ATOM 12964 C CD2 . PHE D 1 317 ? -7.586 38.044 53.392 1.00 76.97 ? 376 PHE D CD2 1 ATOM 12965 C CE1 . PHE D 1 317 ? -5.528 39.723 52.649 1.00 86.12 ? 376 PHE D CE1 1 ATOM 12966 C CE2 . PHE D 1 317 ? -7.131 39.011 54.271 1.00 78.67 ? 376 PHE D CE2 1 ATOM 12967 C CZ . PHE D 1 317 ? -6.100 39.851 53.899 1.00 88.95 ? 376 PHE D CZ 1 ATOM 12968 N N . ASN D 1 318 ? -6.942 35.811 47.814 1.00 102.99 ? 377 ASN D N 1 ATOM 12969 C CA . ASN D 1 318 ? -7.232 34.819 46.780 1.00 112.54 ? 377 ASN D CA 1 ATOM 12970 C C . ASN D 1 318 ? -7.690 33.477 47.350 1.00 108.75 ? 377 ASN D C 1 ATOM 12971 O O . ASN D 1 318 ? -8.395 32.718 46.685 1.00 97.34 ? 377 ASN D O 1 ATOM 12972 C CB . ASN D 1 318 ? -5.995 34.614 45.901 1.00 121.39 ? 377 ASN D CB 1 ATOM 12973 C CG . ASN D 1 318 ? -6.327 34.002 44.554 1.00 132.82 ? 377 ASN D CG 1 ATOM 12974 O OD1 . ASN D 1 318 ? -7.457 34.099 44.079 1.00 136.18 ? 377 ASN D OD1 1 ATOM 12975 N ND2 . ASN D 1 318 ? -5.337 33.374 43.929 1.00 132.49 ? 377 ASN D ND2 1 ATOM 12976 N N . ASP D 1 319 ? -7.290 33.195 48.585 1.00 114.30 ? 378 ASP D N 1 ATOM 12977 C CA . ASP D 1 319 ? -7.744 32.005 49.297 1.00 111.91 ? 378 ASP D CA 1 ATOM 12978 C C . ASP D 1 319 ? -8.304 32.437 50.647 1.00 103.88 ? 378 ASP D C 1 ATOM 12979 O O . ASP D 1 319 ? -8.511 33.630 50.870 1.00 108.05 ? 378 ASP D O 1 ATOM 12980 C CB . ASP D 1 319 ? -6.608 30.995 49.467 1.00 112.97 ? 378 ASP D CB 1 ATOM 12981 C CG . ASP D 1 319 ? -6.213 30.338 48.158 1.00 115.95 ? 378 ASP D CG 1 ATOM 12982 O OD1 . ASP D 1 319 ? -7.047 30.318 47.228 1.00 102.32 ? 378 ASP D OD1 1 ATOM 12983 O OD2 . ASP D 1 319 ? -5.073 29.836 48.058 1.00 130.46 ? 378 ASP D OD2 1 ATOM 12984 N N . LEU D 1 320 ? -8.560 31.471 51.528 1.00 89.56 ? 379 LEU D N 1 ATOM 12985 C CA . LEU D 1 320 ? -9.069 31.730 52.880 1.00 87.45 ? 379 LEU D CA 1 ATOM 12986 C C . LEU D 1 320 ? -10.496 32.301 52.882 1.00 77.05 ? 379 LEU D C 1 ATOM 12987 O O . LEU D 1 320 ? -10.912 32.966 51.933 1.00 70.39 ? 379 LEU D O 1 ATOM 12988 C CB . LEU D 1 320 ? -8.124 32.677 53.634 1.00 78.75 ? 379 LEU D CB 1 ATOM 12989 C CG . LEU D 1 320 ? -6.675 32.214 53.810 1.00 78.51 ? 379 LEU D CG 1 ATOM 12990 C CD1 . LEU D 1 320 ? -5.953 33.117 54.795 1.00 66.96 ? 379 LEU D CD1 1 ATOM 12991 C CD2 . LEU D 1 320 ? -6.619 30.764 54.262 1.00 70.56 ? 379 LEU D CD2 1 ATOM 12992 N N . PRO D 1 321 ? -11.256 32.031 53.957 1.00 67.29 ? 380 PRO D N 1 ATOM 12993 C CA . PRO D 1 321 ? -12.631 32.530 54.076 1.00 60.33 ? 380 PRO D CA 1 ATOM 12994 C C . PRO D 1 321 ? -12.702 34.002 54.472 1.00 64.79 ? 380 PRO D C 1 ATOM 12995 O O . PRO D 1 321 ? -11.905 34.456 55.293 1.00 67.77 ? 380 PRO D O 1 ATOM 12996 C CB . PRO D 1 321 ? -13.225 31.651 55.178 1.00 47.33 ? 380 PRO D CB 1 ATOM 12997 C CG . PRO D 1 321 ? -12.059 31.274 56.018 1.00 55.64 ? 380 PRO D CG 1 ATOM 12998 C CD . PRO D 1 321 ? -10.900 31.132 55.070 1.00 57.58 ? 380 PRO D CD 1 ATOM 12999 N N . SER D 1 322 ? -13.645 34.735 53.888 1.00 63.22 ? 381 SER D N 1 ATOM 13000 C CA . SER D 1 322 ? -13.842 36.138 54.234 1.00 51.26 ? 381 SER D CA 1 ATOM 13001 C C . SER D 1 322 ? -14.738 36.271 55.462 1.00 71.61 ? 381 SER D C 1 ATOM 13002 O O . SER D 1 322 ? -15.414 35.320 55.854 1.00 62.88 ? 381 SER D O 1 ATOM 13003 C CB . SER D 1 322 ? -14.445 36.904 53.054 1.00 44.98 ? 381 SER D CB 1 ATOM 13004 O OG . SER D 1 322 ? -15.618 36.268 52.578 1.00 62.02 ? 381 SER D OG 1 ATOM 13005 N N . TYR D 1 323 ? -14.741 37.457 56.061 1.00 71.30 ? 382 TYR D N 1 ATOM 13006 C CA . TYR D 1 323 ? -15.588 37.734 57.215 1.00 65.04 ? 382 TYR D CA 1 ATOM 13007 C C . TYR D 1 323 ? -16.402 39.001 56.983 1.00 52.95 ? 382 TYR D C 1 ATOM 13008 O O . TYR D 1 323 ? -16.029 39.846 56.171 1.00 61.11 ? 382 TYR D O 1 ATOM 13009 C CB . TYR D 1 323 ? -14.749 37.866 58.488 1.00 55.76 ? 382 TYR D CB 1 ATOM 13010 C CG . TYR D 1 323 ? -13.658 38.910 58.404 1.00 54.93 ? 382 TYR D CG 1 ATOM 13011 C CD1 . TYR D 1 323 ? -13.882 40.212 58.832 1.00 51.97 ? 382 TYR D CD1 1 ATOM 13012 C CD2 . TYR D 1 323 ? -12.404 38.593 57.899 1.00 58.69 ? 382 TYR D CD2 1 ATOM 13013 C CE1 . TYR D 1 323 ? -12.888 41.169 58.758 1.00 56.90 ? 382 TYR D CE1 1 ATOM 13014 C CE2 . TYR D 1 323 ? -11.404 39.543 57.820 1.00 67.79 ? 382 TYR D CE2 1 ATOM 13015 C CZ . TYR D 1 323 ? -11.651 40.829 58.251 1.00 61.84 ? 382 TYR D CZ 1 ATOM 13016 O OH . TYR D 1 323 ? -10.658 41.779 58.174 1.00 54.02 ? 382 TYR D OH 1 ATOM 13017 N N . ALA D 1 324 ? -17.511 39.133 57.703 1.00 53.56 ? 383 ALA D N 1 ATOM 13018 C CA . ALA D 1 324 ? -18.373 40.299 57.557 1.00 60.46 ? 383 ALA D CA 1 ATOM 13019 C C . ALA D 1 324 ? -17.773 41.529 58.231 1.00 55.97 ? 383 ALA D C 1 ATOM 13020 O O . ALA D 1 324 ? -17.445 41.502 59.417 1.00 53.92 ? 383 ALA D O 1 ATOM 13021 C CB . ALA D 1 324 ? -19.754 40.007 58.124 1.00 49.03 ? 383 ALA D CB 1 ATOM 13022 N N . ILE D 1 325 ? -17.634 42.607 57.465 1.00 53.02 ? 384 ILE D N 1 ATOM 13023 C CA . ILE D 1 325 ? -17.151 43.871 58.007 1.00 49.36 ? 384 ILE D CA 1 ATOM 13024 C C . ILE D 1 325 ? -18.265 44.565 58.780 1.00 48.74 ? 384 ILE D C 1 ATOM 13025 O O . ILE D 1 325 ? -19.337 44.832 58.237 1.00 60.38 ? 384 ILE D O 1 ATOM 13026 C CB . ILE D 1 325 ? -16.640 44.814 56.901 1.00 59.61 ? 384 ILE D CB 1 ATOM 13027 C CG1 . ILE D 1 325 ? -15.573 44.122 56.050 1.00 53.47 ? 384 ILE D CG1 1 ATOM 13028 C CG2 . ILE D 1 325 ? -16.096 46.097 57.505 1.00 50.25 ? 384 ILE D CG2 1 ATOM 13029 C CD1 . ILE D 1 325 ? -15.214 44.883 54.790 1.00 43.86 ? 384 ILE D CD1 1 ATOM 13030 N N . HIS D 1 326 ? -18.007 44.855 60.049 1.00 47.66 ? 385 HIS D N 1 ATOM 13031 C CA . HIS D 1 326 ? -18.995 45.508 60.897 1.00 50.10 ? 385 HIS D CA 1 ATOM 13032 C C . HIS D 1 326 ? -19.113 46.993 60.560 1.00 48.26 ? 385 HIS D C 1 ATOM 13033 O O . HIS D 1 326 ? -18.380 47.824 61.095 1.00 42.24 ? 385 HIS D O 1 ATOM 13034 C CB . HIS D 1 326 ? -18.640 45.312 62.372 1.00 42.76 ? 385 HIS D CB 1 ATOM 13035 C CG . HIS D 1 326 ? -18.639 43.878 62.802 1.00 53.01 ? 385 HIS D CG 1 ATOM 13036 N ND1 . HIS D 1 326 ? -18.177 43.468 64.034 1.00 54.06 ? 385 HIS D ND1 1 ATOM 13037 C CD2 . HIS D 1 326 ? -19.045 42.756 62.160 1.00 62.66 ? 385 HIS D CD2 1 ATOM 13038 C CE1 . HIS D 1 326 ? -18.298 42.156 64.133 1.00 43.85 ? 385 HIS D CE1 1 ATOM 13039 N NE2 . HIS D 1 326 ? -18.822 41.700 63.009 1.00 62.33 ? 385 HIS D NE2 1 ATOM 13040 N N . LEU D 1 327 ? -20.044 47.311 59.665 1.00 59.50 ? 386 LEU D N 1 ATOM 13041 C CA . LEU D 1 327 ? -20.227 48.675 59.177 1.00 48.32 ? 386 LEU D CA 1 ATOM 13042 C C . LEU D 1 327 ? -21.645 49.172 59.420 1.00 49.28 ? 386 LEU D C 1 ATOM 13043 O O . LEU D 1 327 ? -22.504 48.421 59.887 1.00 58.25 ? 386 LEU D O 1 ATOM 13044 C CB . LEU D 1 327 ? -19.924 48.755 57.678 1.00 47.47 ? 386 LEU D CB 1 ATOM 13045 C CG . LEU D 1 327 ? -18.490 48.948 57.191 1.00 59.45 ? 386 LEU D CG 1 ATOM 13046 C CD1 . LEU D 1 327 ? -18.408 48.655 55.701 1.00 67.09 ? 386 LEU D CD1 1 ATOM 13047 C CD2 . LEU D 1 327 ? -18.030 50.364 57.477 1.00 64.98 ? 386 LEU D CD2 1 ATOM 13048 N N . ASP D 1 328 ? -21.872 50.443 59.094 1.00 42.51 ? 387 ASP D N 1 ATOM 13049 C CA . ASP D 1 328 ? -23.203 51.050 59.124 1.00 42.74 ? 387 ASP D CA 1 ATOM 13050 C C . ASP D 1 328 ? -23.914 50.867 60.460 1.00 47.16 ? 387 ASP D C 1 ATOM 13051 O O . ASP D 1 328 ? -24.866 50.093 60.565 1.00 43.42 ? 387 ASP D O 1 ATOM 13052 C CB . ASP D 1 328 ? -24.061 50.478 57.994 1.00 43.16 ? 387 ASP D CB 1 ATOM 13053 C CG . ASP D 1 328 ? -23.517 50.821 56.623 1.00 56.05 ? 387 ASP D CG 1 ATOM 13054 O OD1 . ASP D 1 328 ? -22.720 51.777 56.522 1.00 65.48 ? 387 ASP D OD1 1 ATOM 13055 O OD2 . ASP D 1 328 ? -23.881 50.134 55.646 1.00 72.90 ? 387 ASP D OD2 1 ATOM 13056 N N . HIS D 1 329 ? -23.447 51.580 61.479 1.00 42.62 ? 388 HIS D N 1 ATOM 13057 C CA . HIS D 1 329 ? -24.037 51.470 62.807 1.00 42.78 ? 388 HIS D CA 1 ATOM 13058 C C . HIS D 1 329 ? -24.764 52.759 63.177 1.00 50.46 ? 388 HIS D C 1 ATOM 13059 O O . HIS D 1 329 ? -25.064 52.999 64.346 1.00 42.64 ? 388 HIS D O 1 ATOM 13060 C CB . HIS D 1 329 ? -22.958 51.158 63.844 1.00 42.53 ? 388 HIS D CB 1 ATOM 13061 C CG . HIS D 1 329 ? -22.147 49.940 63.526 1.00 46.01 ? 388 HIS D CG 1 ATOM 13062 N ND1 . HIS D 1 329 ? -22.644 48.659 63.647 1.00 43.07 ? 388 HIS D ND1 1 ATOM 13063 C CD2 . HIS D 1 329 ? -20.871 49.808 63.094 1.00 42.29 ? 388 HIS D CD2 1 ATOM 13064 C CE1 . HIS D 1 329 ? -21.709 47.792 63.302 1.00 53.49 ? 388 HIS D CE1 1 ATOM 13065 N NE2 . HIS D 1 329 ? -20.623 48.463 62.962 1.00 42.76 ? 388 HIS D NE2 1 ATOM 13066 N N . GLY D 1 330 ? -25.047 53.580 62.170 1.00 42.54 ? 389 GLY D N 1 ATOM 13067 C CA . GLY D 1 330 ? -25.704 54.860 62.371 1.00 42.39 ? 389 GLY D CA 1 ATOM 13068 C C . GLY D 1 330 ? -27.072 54.793 63.025 1.00 42.77 ? 389 GLY D C 1 ATOM 13069 O O . GLY D 1 330 ? -27.492 55.735 63.698 1.00 42.62 ? 389 GLY D O 1 ATOM 13070 N N . ARG D 1 331 ? -27.771 53.681 62.826 1.00 43.27 ? 390 ARG D N 1 ATOM 13071 C CA . ARG D 1 331 ? -29.114 53.519 63.369 1.00 43.68 ? 390 ARG D CA 1 ATOM 13072 C C . ARG D 1 331 ? -29.113 52.659 64.629 1.00 43.88 ? 390 ARG D C 1 ATOM 13073 O O . ARG D 1 331 ? -30.087 51.966 64.924 1.00 44.34 ? 390 ARG D O 1 ATOM 13074 C CB . ARG D 1 331 ? -30.044 52.923 62.312 1.00 44.14 ? 390 ARG D CB 1 ATOM 13075 C CG . ARG D 1 331 ? -30.704 53.980 61.441 1.00 44.07 ? 390 ARG D CG 1 ATOM 13076 C CD . ARG D 1 331 ? -31.249 53.406 60.148 1.00 46.26 ? 390 ARG D CD 1 ATOM 13077 N NE . ARG D 1 331 ? -31.941 54.428 59.368 1.00 47.97 ? 390 ARG D NE 1 ATOM 13078 C CZ . ARG D 1 331 ? -32.344 54.268 58.112 1.00 59.31 ? 390 ARG D CZ 1 ATOM 13079 N NH1 . ARG D 1 331 ? -32.123 53.123 57.482 1.00 59.88 ? 390 ARG D NH1 1 ATOM 13080 N NH2 . ARG D 1 331 ? -32.967 55.257 57.484 1.00 58.92 ? 390 ARG D NH2 1 ATOM 13081 N N . ALA D 1 332 ? -28.008 52.711 65.366 1.00 43.53 ? 391 ALA D N 1 ATOM 13082 C CA . ALA D 1 332 ? -27.897 52.014 66.642 1.00 43.65 ? 391 ALA D CA 1 ATOM 13083 C C . ALA D 1 332 ? -28.166 52.964 67.806 1.00 46.61 ? 391 ALA D C 1 ATOM 13084 O O . ALA D 1 332 ? -28.166 54.184 67.634 1.00 43.13 ? 391 ALA D O 1 ATOM 13085 C CB . ALA D 1 332 ? -26.524 51.380 66.782 1.00 43.42 ? 391 ALA D CB 1 ATOM 13086 N N . PHE D 1 333 ? -28.403 52.389 68.983 1.00 43.64 ? 392 PHE D N 1 ATOM 13087 C CA . PHE D 1 333 ? -28.597 53.147 70.220 1.00 46.81 ? 392 PHE D CA 1 ATOM 13088 C C . PHE D 1 333 ? -29.768 54.121 70.147 1.00 43.54 ? 392 PHE D C 1 ATOM 13089 O O . PHE D 1 333 ? -29.708 55.219 70.703 1.00 44.96 ? 392 PHE D O 1 ATOM 13090 C CB . PHE D 1 333 ? -27.320 53.911 70.578 1.00 42.89 ? 392 PHE D CB 1 ATOM 13091 C CG . PHE D 1 333 ? -26.147 53.024 70.863 1.00 42.79 ? 392 PHE D CG 1 ATOM 13092 C CD1 . PHE D 1 333 ? -26.010 52.414 72.097 1.00 52.59 ? 392 PHE D CD1 1 ATOM 13093 C CD2 . PHE D 1 333 ? -25.181 52.801 69.898 1.00 47.53 ? 392 PHE D CD2 1 ATOM 13094 C CE1 . PHE D 1 333 ? -24.933 51.598 72.362 1.00 42.79 ? 392 PHE D CE1 1 ATOM 13095 C CE2 . PHE D 1 333 ? -24.098 51.984 70.158 1.00 48.41 ? 392 PHE D CE2 1 ATOM 13096 C CZ . PHE D 1 333 ? -23.973 51.383 71.392 1.00 42.59 ? 392 PHE D CZ 1 ATOM 13097 N N . GLY D 1 334 ? -30.830 53.713 69.462 1.00 43.97 ? 393 GLY D N 1 ATOM 13098 C CA . GLY D 1 334 ? -32.017 54.537 69.331 1.00 44.09 ? 393 GLY D CA 1 ATOM 13099 C C . GLY D 1 334 ? -32.950 54.458 70.525 1.00 51.11 ? 393 GLY D C 1 ATOM 13100 O O . GLY D 1 334 ? -33.682 55.406 70.811 1.00 44.29 ? 393 GLY D O 1 ATOM 13101 N N . ARG D 1 335 ? -32.925 53.329 71.228 1.00 44.65 ? 394 ARG D N 1 ATOM 13102 C CA . ARG D 1 335 ? -33.835 53.108 72.348 1.00 44.96 ? 394 ARG D CA 1 ATOM 13103 C C . ARG D 1 335 ? -33.118 52.523 73.561 1.00 54.02 ? 394 ARG D C 1 ATOM 13104 O O . ARG D 1 335 ? -32.368 51.553 73.445 1.00 60.38 ? 394 ARG D O 1 ATOM 13105 C CB . ARG D 1 335 ? -34.974 52.170 71.933 1.00 45.57 ? 394 ARG D CB 1 ATOM 13106 C CG . ARG D 1 335 ? -35.815 52.640 70.751 1.00 49.93 ? 394 ARG D CG 1 ATOM 13107 C CD . ARG D 1 335 ? -37.002 53.486 71.194 1.00 45.82 ? 394 ARG D CD 1 ATOM 13108 N NE . ARG D 1 335 ? -38.265 52.970 70.667 1.00 51.97 ? 394 ARG D NE 1 ATOM 13109 C CZ . ARG D 1 335 ? -39.212 52.400 71.407 1.00 46.81 ? 394 ARG D CZ 1 ATOM 13110 N NH1 . ARG D 1 335 ? -39.050 52.279 72.717 1.00 62.33 ? 394 ARG D NH1 1 ATOM 13111 N NH2 . ARG D 1 335 ? -40.327 51.958 70.838 1.00 59.43 ? 394 ARG D NH2 1 ATOM 13112 N N . SER D 1 336 ? -33.352 53.122 74.724 1.00 48.35 ? 395 SER D N 1 ATOM 13113 C CA . SER D 1 336 ? -32.774 52.635 75.970 1.00 44.70 ? 395 SER D CA 1 ATOM 13114 C C . SER D 1 336 ? -33.808 51.829 76.748 1.00 50.38 ? 395 SER D C 1 ATOM 13115 O O . SER D 1 336 ? -33.475 51.122 77.698 1.00 58.65 ? 395 SER D O 1 ATOM 13116 C CB . SER D 1 336 ? -32.254 53.797 76.821 1.00 56.12 ? 395 SER D CB 1 ATOM 13117 O OG . SER D 1 336 ? -33.318 54.615 77.279 1.00 44.27 ? 395 SER D OG 1 ATOM 13118 N N . ASP D 1 337 ? -35.064 51.938 76.329 1.00 47.50 ? 396 ASP D N 1 ATOM 13119 C CA . ASP D 1 337 ? -36.169 51.320 77.051 1.00 50.25 ? 396 ASP D CA 1 ATOM 13120 C C . ASP D 1 337 ? -36.816 50.181 76.269 1.00 48.44 ? 396 ASP D C 1 ATOM 13121 O O . ASP D 1 337 ? -37.867 49.672 76.658 1.00 47.09 ? 396 ASP D O 1 ATOM 13122 C CB . ASP D 1 337 ? -37.223 52.374 77.395 1.00 46.08 ? 396 ASP D CB 1 ATOM 13123 C CG . ASP D 1 337 ? -37.824 53.022 76.160 1.00 66.79 ? 396 ASP D CG 1 ATOM 13124 O OD1 . ASP D 1 337 ? -37.178 52.979 75.092 1.00 65.70 ? 396 ASP D OD1 1 ATOM 13125 O OD2 . ASP D 1 337 ? -38.943 53.571 76.256 1.00 76.88 ? 396 ASP D OD2 1 ATOM 13126 N N . PHE D 1 338 ? -36.188 49.783 75.169 1.00 46.57 ? 397 PHE D N 1 ATOM 13127 C CA . PHE D 1 338 ? -36.738 48.723 74.332 1.00 47.07 ? 397 PHE D CA 1 ATOM 13128 C C . PHE D 1 338 ? -35.651 47.792 73.815 1.00 47.01 ? 397 PHE D C 1 ATOM 13129 O O . PHE D 1 338 ? -34.659 48.236 73.236 1.00 50.55 ? 397 PHE D O 1 ATOM 13130 C CB . PHE D 1 338 ? -37.518 49.309 73.154 1.00 53.21 ? 397 PHE D CB 1 ATOM 13131 C CG . PHE D 1 338 ? -37.900 48.289 72.116 1.00 47.60 ? 397 PHE D CG 1 ATOM 13132 C CD1 . PHE D 1 338 ? -38.745 47.239 72.437 1.00 62.50 ? 397 PHE D CD1 1 ATOM 13133 C CD2 . PHE D 1 338 ? -37.412 48.377 70.823 1.00 47.45 ? 397 PHE D CD2 1 ATOM 13134 C CE1 . PHE D 1 338 ? -39.099 46.297 71.488 1.00 48.59 ? 397 PHE D CE1 1 ATOM 13135 C CE2 . PHE D 1 338 ? -37.762 47.438 69.868 1.00 47.86 ? 397 PHE D CE2 1 ATOM 13136 C CZ . PHE D 1 338 ? -38.606 46.398 70.202 1.00 48.43 ? 397 PHE D CZ 1 ATOM 13137 N N . ASP D 1 339 ? -35.845 46.497 74.029 1.00 48.82 ? 398 ASP D N 1 ATOM 13138 C CA . ASP D 1 339 ? -34.952 45.489 73.476 1.00 51.09 ? 398 ASP D CA 1 ATOM 13139 C C . ASP D 1 339 ? -35.658 44.747 72.350 1.00 53.35 ? 398 ASP D C 1 ATOM 13140 O O . ASP D 1 339 ? -36.723 44.165 72.553 1.00 58.84 ? 398 ASP D O 1 ATOM 13141 C CB . ASP D 1 339 ? -34.495 44.507 74.557 1.00 47.58 ? 398 ASP D CB 1 ATOM 13142 C CG . ASP D 1 339 ? -34.004 45.204 75.811 1.00 61.02 ? 398 ASP D CG 1 ATOM 13143 O OD1 . ASP D 1 339 ? -33.466 46.327 75.698 1.00 51.93 ? 398 ASP D OD1 1 ATOM 13144 O OD2 . ASP D 1 339 ? -34.154 44.628 76.909 1.00 59.33 ? 398 ASP D OD2 1 ATOM 13145 N N . ASP D 1 340 ? -35.069 44.780 71.160 1.00 59.99 ? 399 ASP D N 1 ATOM 13146 C CA . ASP D 1 340 ? -35.658 44.095 70.019 1.00 49.10 ? 399 ASP D CA 1 ATOM 13147 C C . ASP D 1 340 ? -35.118 42.674 69.949 1.00 48.39 ? 399 ASP D C 1 ATOM 13148 O O . ASP D 1 340 ? -34.077 42.419 69.342 1.00 48.14 ? 399 ASP D O 1 ATOM 13149 C CB . ASP D 1 340 ? -35.366 44.847 68.719 1.00 50.60 ? 399 ASP D CB 1 ATOM 13150 C CG . ASP D 1 340 ? -36.042 44.218 67.517 1.00 51.97 ? 399 ASP D CG 1 ATOM 13151 O OD1 . ASP D 1 340 ? -37.018 43.462 67.709 1.00 60.97 ? 399 ASP D OD1 1 ATOM 13152 O OD2 . ASP D 1 340 ? -35.598 44.477 66.379 1.00 57.31 ? 399 ASP D OD2 1 ATOM 13153 N N . ASP D 1 341 ? -35.844 41.753 70.575 1.00 48.88 ? 400 ASP D N 1 ATOM 13154 C CA . ASP D 1 341 ? -35.429 40.358 70.673 1.00 60.08 ? 400 ASP D CA 1 ATOM 13155 C C . ASP D 1 341 ? -35.413 39.658 69.315 1.00 49.37 ? 400 ASP D C 1 ATOM 13156 O O . ASP D 1 341 ? -34.872 38.561 69.178 1.00 54.31 ? 400 ASP D O 1 ATOM 13157 C CB . ASP D 1 341 ? -36.344 39.608 71.643 1.00 54.03 ? 400 ASP D CB 1 ATOM 13158 C CG . ASP D 1 341 ? -36.269 40.157 73.057 1.00 67.77 ? 400 ASP D CG 1 ATOM 13159 O OD1 . ASP D 1 341 ? -35.167 40.565 73.481 1.00 70.16 ? 400 ASP D OD1 1 ATOM 13160 O OD2 . ASP D 1 341 ? -37.311 40.185 73.744 1.00 68.10 ? 400 ASP D OD2 1 ATOM 13161 N N . ASP D 1 342 ? -36.019 40.294 68.317 1.00 49.41 ? 401 ASP D N 1 ATOM 13162 C CA . ASP D 1 342 ? -35.992 39.794 66.946 1.00 49.57 ? 401 ASP D CA 1 ATOM 13163 C C . ASP D 1 342 ? -34.576 39.773 66.375 1.00 49.11 ? 401 ASP D C 1 ATOM 13164 O O . ASP D 1 342 ? -34.258 38.956 65.513 1.00 51.51 ? 401 ASP D O 1 ATOM 13165 C CB . ASP D 1 342 ? -36.903 40.640 66.055 1.00 49.65 ? 401 ASP D CB 1 ATOM 13166 C CG . ASP D 1 342 ? -38.347 40.183 66.100 1.00 56.76 ? 401 ASP D CG 1 ATOM 13167 O OD1 . ASP D 1 342 ? -38.706 39.439 67.037 1.00 50.59 ? 401 ASP D OD1 1 ATOM 13168 O OD2 . ASP D 1 342 ? -39.124 40.570 65.201 1.00 50.44 ? 401 ASP D OD2 1 ATOM 13169 N N . ILE D 1 343 ? -33.732 40.684 66.851 1.00 48.56 ? 402 ILE D N 1 ATOM 13170 C CA . ILE D 1 343 ? -32.363 40.797 66.359 1.00 48.09 ? 402 ILE D CA 1 ATOM 13171 C C . ILE D 1 343 ? -31.522 39.581 66.756 1.00 52.51 ? 402 ILE D C 1 ATOM 13172 O O . ILE D 1 343 ? -30.671 39.128 65.989 1.00 51.11 ? 402 ILE D O 1 ATOM 13173 C CB . ILE D 1 343 ? -31.688 42.087 66.874 1.00 47.81 ? 402 ILE D CB 1 ATOM 13174 C CG1 . ILE D 1 343 ? -32.484 43.316 66.431 1.00 61.85 ? 402 ILE D CG1 1 ATOM 13175 C CG2 . ILE D 1 343 ? -30.257 42.186 66.373 1.00 47.03 ? 402 ILE D CG2 1 ATOM 13176 C CD1 . ILE D 1 343 ? -32.062 44.596 67.121 1.00 46.92 ? 402 ILE D CD1 1 ATOM 13177 N N . ILE D 1 344 ? -31.768 39.048 67.950 1.00 48.35 ? 403 ILE D N 1 ATOM 13178 C CA . ILE D 1 344 ? -31.004 37.904 68.445 1.00 59.26 ? 403 ILE D CA 1 ATOM 13179 C C . ILE D 1 344 ? -31.615 36.575 68.024 1.00 48.99 ? 403 ILE D C 1 ATOM 13180 O O . ILE D 1 344 ? -31.209 35.520 68.510 1.00 68.73 ? 403 ILE D O 1 ATOM 13181 C CB . ILE D 1 344 ? -30.891 37.905 69.978 1.00 51.25 ? 403 ILE D CB 1 ATOM 13182 C CG1 . ILE D 1 344 ? -32.015 38.739 70.592 1.00 62.32 ? 403 ILE D CG1 1 ATOM 13183 C CG2 . ILE D 1 344 ? -29.525 38.411 70.411 1.00 54.56 ? 403 ILE D CG2 1 ATOM 13184 C CD1 . ILE D 1 344 ? -32.229 38.478 72.059 1.00 55.44 ? 403 ILE D CD1 1 ATOM 13185 N N . LEU D 1 345 ? -32.596 36.631 67.130 1.00 50.91 ? 404 LEU D N 1 ATOM 13186 C CA . LEU D 1 345 ? -33.223 35.421 66.608 1.00 65.22 ? 404 LEU D CA 1 ATOM 13187 C C . LEU D 1 345 ? -32.224 34.434 65.987 1.00 54.80 ? 404 LEU D C 1 ATOM 13188 O O . LEU D 1 345 ? -32.394 33.227 66.146 1.00 63.96 ? 404 LEU D O 1 ATOM 13189 C CB . LEU D 1 345 ? -34.304 35.782 65.587 1.00 50.17 ? 404 LEU D CB 1 ATOM 13190 C CG . LEU D 1 345 ? -35.684 36.024 66.200 1.00 55.27 ? 404 LEU D CG 1 ATOM 13191 C CD1 . LEU D 1 345 ? -36.710 36.332 65.126 1.00 50.85 ? 404 LEU D CD1 1 ATOM 13192 C CD2 . LEU D 1 345 ? -36.116 34.826 67.033 1.00 51.04 ? 404 LEU D CD2 1 ATOM 13193 N N . PRO D 1 346 ? -31.190 34.929 65.271 1.00 53.63 ? 405 PRO D N 1 ATOM 13194 C CA . PRO D 1 346 ? -30.191 33.960 64.805 1.00 52.36 ? 405 PRO D CA 1 ATOM 13195 C C . PRO D 1 346 ? -29.567 33.142 65.936 1.00 60.28 ? 405 PRO D C 1 ATOM 13196 O O . PRO D 1 346 ? -29.343 31.947 65.764 1.00 55.67 ? 405 PRO D O 1 ATOM 13197 C CB . PRO D 1 346 ? -29.142 34.847 64.138 1.00 48.69 ? 405 PRO D CB 1 ATOM 13198 C CG . PRO D 1 346 ? -29.930 35.978 63.603 1.00 48.66 ? 405 PRO D CG 1 ATOM 13199 C CD . PRO D 1 346 ? -30.983 36.249 64.643 1.00 48.92 ? 405 PRO D CD 1 ATOM 13200 N N . LEU D 1 347 ? -29.302 33.776 67.074 1.00 55.19 ? 406 LEU D N 1 ATOM 13201 C CA . LEU D 1 347 ? -28.791 33.061 68.240 1.00 48.99 ? 406 LEU D CA 1 ATOM 13202 C C . LEU D 1 347 ? -29.774 31.994 68.717 1.00 49.61 ? 406 LEU D C 1 ATOM 13203 O O . LEU D 1 347 ? -29.382 30.865 69.013 1.00 61.39 ? 406 LEU D O 1 ATOM 13204 C CB . LEU D 1 347 ? -28.486 34.035 69.379 1.00 48.60 ? 406 LEU D CB 1 ATOM 13205 C CG . LEU D 1 347 ? -28.039 33.403 70.700 1.00 52.44 ? 406 LEU D CG 1 ATOM 13206 C CD1 . LEU D 1 347 ? -26.769 32.584 70.503 1.00 48.40 ? 406 LEU D CD1 1 ATOM 13207 C CD2 . LEU D 1 347 ? -27.833 34.470 71.763 1.00 59.83 ? 406 LEU D CD2 1 ATOM 13208 N N . ARG D 1 348 ? -31.050 32.359 68.789 1.00 60.49 ? 407 ARG D N 1 ATOM 13209 C CA . ARG D 1 348 ? -32.077 31.453 69.292 1.00 62.00 ? 407 ARG D CA 1 ATOM 13210 C C . ARG D 1 348 ? -32.442 30.375 68.279 1.00 60.69 ? 407 ARG D C 1 ATOM 13211 O O . ARG D 1 348 ? -32.771 29.249 68.649 1.00 57.81 ? 407 ARG D O 1 ATOM 13212 C CB . ARG D 1 348 ? -33.338 32.230 69.682 1.00 53.88 ? 407 ARG D CB 1 ATOM 13213 C CG . ARG D 1 348 ? -33.152 33.199 70.835 1.00 69.17 ? 407 ARG D CG 1 ATOM 13214 C CD . ARG D 1 348 ? -34.323 34.163 70.924 1.00 82.03 ? 407 ARG D CD 1 ATOM 13215 N NE . ARG D 1 348 ? -35.590 33.453 71.083 1.00 98.80 ? 407 ARG D NE 1 ATOM 13216 C CZ . ARG D 1 348 ? -36.786 34.011 70.928 1.00 99.36 ? 407 ARG D CZ 1 ATOM 13217 N NH1 . ARG D 1 348 ? -36.885 35.294 70.606 1.00 97.14 ? 407 ARG D NH1 1 ATOM 13218 N NH2 . ARG D 1 348 ? -37.883 33.286 71.093 1.00 84.92 ? 407 ARG D NH2 1 ATOM 13219 N N . GLN D 1 349 ? -32.387 30.727 66.999 1.00 59.61 ? 408 GLN D N 1 ATOM 13220 C CA . GLN D 1 349 ? -32.765 29.801 65.939 1.00 51.30 ? 408 GLN D CA 1 ATOM 13221 C C . GLN D 1 349 ? -31.626 28.871 65.515 1.00 55.83 ? 408 GLN D C 1 ATOM 13222 O O . GLN D 1 349 ? -31.835 27.670 65.349 1.00 70.47 ? 408 GLN D O 1 ATOM 13223 C CB . GLN D 1 349 ? -33.283 30.580 64.728 1.00 51.29 ? 408 GLN D CB 1 ATOM 13224 C CG . GLN D 1 349 ? -34.636 31.239 64.944 1.00 54.95 ? 408 GLN D CG 1 ATOM 13225 C CD . GLN D 1 349 ? -35.122 31.995 63.721 1.00 57.38 ? 408 GLN D CD 1 ATOM 13226 O OE1 . GLN D 1 349 ? -34.553 31.876 62.635 1.00 58.77 ? 408 GLN D OE1 1 ATOM 13227 N NE2 . GLN D 1 349 ? -36.182 32.776 63.891 1.00 51.71 ? 408 GLN D NE2 1 ATOM 13228 N N . CYS D 1 350 ? -30.428 29.420 65.341 1.00 55.78 ? 409 CYS D N 1 ATOM 13229 C CA . CYS D 1 350 ? -29.294 28.626 64.867 1.00 62.82 ? 409 CYS D CA 1 ATOM 13230 C C . CYS D 1 350 ? -28.626 27.830 65.984 1.00 64.54 ? 409 CYS D C 1 ATOM 13231 O O . CYS D 1 350 ? -28.209 26.690 65.777 1.00 50.53 ? 409 CYS D O 1 ATOM 13232 C CB . CYS D 1 350 ? -28.256 29.522 64.186 1.00 49.81 ? 409 CYS D CB 1 ATOM 13233 S SG . CYS D 1 350 ? -28.903 30.558 62.853 1.00 67.03 ? 409 CYS D SG 1 ATOM 13234 N N . CYS D 1 351 ? -28.530 28.439 67.163 1.00 59.60 ? 410 CYS D N 1 ATOM 13235 C CA . CYS D 1 351 ? -27.895 27.812 68.319 1.00 50.08 ? 410 CYS D CA 1 ATOM 13236 C C . CYS D 1 351 ? -26.475 27.341 68.026 1.00 55.06 ? 410 CYS D C 1 ATOM 13237 O O . CYS D 1 351 ? -26.071 26.269 68.464 1.00 56.55 ? 410 CYS D O 1 ATOM 13238 C CB . CYS D 1 351 ? -28.731 26.636 68.828 1.00 50.69 ? 410 CYS D CB 1 ATOM 13239 S SG . CYS D 1 351 ? -30.076 27.102 69.941 1.00 73.65 ? 410 CYS D SG 1 ATOM 13240 N N . ILE D 1 352 ? -25.729 28.126 67.259 1.00 59.07 ? 411 ILE D N 1 ATOM 13241 C CA . ILE D 1 352 ? -24.288 27.933 67.173 1.00 56.00 ? 411 ILE D CA 1 ATOM 13242 C C . ILE D 1 352 ? -23.623 29.216 67.652 1.00 57.10 ? 411 ILE D C 1 ATOM 13243 O O . ILE D 1 352 ? -24.193 30.302 67.531 1.00 59.38 ? 411 ILE D O 1 ATOM 13244 C CB . ILE D 1 352 ? -23.821 27.571 65.746 1.00 56.16 ? 411 ILE D CB 1 ATOM 13245 C CG1 . ILE D 1 352 ? -23.948 28.769 64.804 1.00 56.95 ? 411 ILE D CG1 1 ATOM 13246 C CG2 . ILE D 1 352 ? -24.609 26.383 65.211 1.00 55.71 ? 411 ILE D CG2 1 ATOM 13247 C CD1 . ILE D 1 352 ? -23.328 28.538 63.445 1.00 48.96 ? 411 ILE D CD1 1 ATOM 13248 N N . LEU D 1 353 ? -22.428 29.091 68.215 1.00 52.28 ? 412 LEU D N 1 ATOM 13249 C CA . LEU D 1 353 ? -21.786 30.228 68.856 1.00 47.35 ? 412 LEU D CA 1 ATOM 13250 C C . LEU D 1 353 ? -20.276 30.045 68.930 1.00 51.95 ? 412 LEU D C 1 ATOM 13251 O O . LEU D 1 353 ? -19.787 29.059 69.481 1.00 63.46 ? 412 LEU D O 1 ATOM 13252 C CB . LEU D 1 353 ? -22.365 30.436 70.260 1.00 47.48 ? 412 LEU D CB 1 ATOM 13253 C CG . LEU D 1 353 ? -21.771 31.547 71.128 1.00 59.79 ? 412 LEU D CG 1 ATOM 13254 C CD1 . LEU D 1 353 ? -22.028 32.911 70.507 1.00 51.89 ? 412 LEU D CD1 1 ATOM 13255 C CD2 . LEU D 1 353 ? -22.334 31.480 72.539 1.00 55.81 ? 412 LEU D CD2 1 ATOM 13256 N N . ARG D 1 354 ? -19.550 31.003 68.365 1.00 54.18 ? 413 ARG D N 1 ATOM 13257 C CA . ARG D 1 354 ? -18.091 31.000 68.384 1.00 55.24 ? 413 ARG D CA 1 ATOM 13258 C C . ARG D 1 354 ? -17.562 30.974 69.816 1.00 62.19 ? 413 ARG D C 1 ATOM 13259 O O . ARG D 1 354 ? -17.958 31.796 70.638 1.00 63.26 ? 413 ARG D O 1 ATOM 13260 C CB . ARG D 1 354 ? -17.558 32.220 67.631 1.00 55.13 ? 413 ARG D CB 1 ATOM 13261 C CG . ARG D 1 354 ? -16.055 32.265 67.474 1.00 53.39 ? 413 ARG D CG 1 ATOM 13262 C CD . ARG D 1 354 ? -15.651 33.324 66.467 1.00 50.03 ? 413 ARG D CD 1 ATOM 13263 N NE . ARG D 1 354 ? -15.795 32.825 65.103 1.00 58.59 ? 413 ARG D NE 1 ATOM 13264 C CZ . ARG D 1 354 ? -16.427 33.470 64.128 1.00 53.21 ? 413 ARG D CZ 1 ATOM 13265 N NH1 . ARG D 1 354 ? -16.979 34.653 64.359 1.00 51.04 ? 413 ARG D NH1 1 ATOM 13266 N NH2 . ARG D 1 354 ? -16.505 32.929 62.921 1.00 58.76 ? 413 ARG D NH2 1 ATOM 13267 N N . PRO D 1 355 ? -16.664 30.019 70.113 1.00 67.89 ? 414 PRO D N 1 ATOM 13268 C CA . PRO D 1 355 ? -16.149 29.749 71.463 1.00 60.60 ? 414 PRO D CA 1 ATOM 13269 C C . PRO D 1 355 ? -15.531 30.965 72.147 1.00 60.75 ? 414 PRO D C 1 ATOM 13270 O O . PRO D 1 355 ? -15.703 31.141 73.355 1.00 63.31 ? 414 PRO D O 1 ATOM 13271 C CB . PRO D 1 355 ? -15.083 28.676 71.217 1.00 64.76 ? 414 PRO D CB 1 ATOM 13272 C CG . PRO D 1 355 ? -15.541 27.981 69.987 1.00 60.02 ? 414 PRO D CG 1 ATOM 13273 C CD . PRO D 1 355 ? -16.138 29.057 69.128 1.00 72.30 ? 414 PRO D CD 1 ATOM 13274 N N . SER D 1 356 ? -14.814 31.784 71.386 1.00 49.92 ? 415 SER D N 1 ATOM 13275 C CA . SER D 1 356 ? -14.204 32.991 71.931 1.00 57.65 ? 415 SER D CA 1 ATOM 13276 C C . SER D 1 356 ? -15.268 33.981 72.392 1.00 65.49 ? 415 SER D C 1 ATOM 13277 O O . SER D 1 356 ? -15.118 34.630 73.427 1.00 57.92 ? 415 SER D O 1 ATOM 13278 C CB . SER D 1 356 ? -13.294 33.646 70.893 1.00 43.77 ? 415 SER D CB 1 ATOM 13279 O OG . SER D 1 356 ? -14.017 33.956 69.715 1.00 69.43 ? 415 SER D OG 1 ATOM 13280 N N . THR D 1 357 ? -16.340 34.092 71.614 1.00 60.70 ? 416 THR D N 1 ATOM 13281 C CA . THR D 1 357 ? -17.447 34.980 71.951 1.00 53.14 ? 416 THR D CA 1 ATOM 13282 C C . THR D 1 357 ? -18.110 34.623 73.281 1.00 66.55 ? 416 THR D C 1 ATOM 13283 O O . THR D 1 357 ? -18.385 35.503 74.096 1.00 59.98 ? 416 THR D O 1 ATOM 13284 C CB . THR D 1 357 ? -18.522 34.974 70.843 1.00 52.81 ? 416 THR D CB 1 ATOM 13285 O OG1 . THR D 1 357 ? -17.928 35.346 69.593 1.00 55.07 ? 416 THR D OG1 1 ATOM 13286 C CG2 . THR D 1 357 ? -19.642 35.948 71.173 1.00 51.61 ? 416 THR D CG2 1 ATOM 13287 N N . PHE D 1 358 ? -18.354 33.332 73.502 1.00 63.36 ? 417 PHE D N 1 ATOM 13288 C CA . PHE D 1 358 ? -19.026 32.871 74.717 1.00 54.99 ? 417 PHE D CA 1 ATOM 13289 C C . PHE D 1 358 ? -18.250 33.198 75.985 1.00 57.80 ? 417 PHE D C 1 ATOM 13290 O O . PHE D 1 358 ? -18.822 33.677 76.965 1.00 58.51 ? 417 PHE D O 1 ATOM 13291 C CB . PHE D 1 358 ? -19.277 31.362 74.655 1.00 55.76 ? 417 PHE D CB 1 ATOM 13292 C CG . PHE D 1 358 ? -19.773 30.778 75.951 1.00 57.85 ? 417 PHE D CG 1 ATOM 13293 C CD1 . PHE D 1 358 ? -21.112 30.864 76.294 1.00 62.22 ? 417 PHE D CD1 1 ATOM 13294 C CD2 . PHE D 1 358 ? -18.903 30.137 76.821 1.00 54.46 ? 417 PHE D CD2 1 ATOM 13295 C CE1 . PHE D 1 358 ? -21.575 30.330 77.483 1.00 63.73 ? 417 PHE D CE1 1 ATOM 13296 C CE2 . PHE D 1 358 ? -19.360 29.600 78.012 1.00 52.73 ? 417 PHE D CE2 1 ATOM 13297 C CZ . PHE D 1 358 ? -20.699 29.695 78.341 1.00 64.17 ? 417 PHE D CZ 1 ATOM 13298 N N . GLN D 1 359 ? -16.950 32.922 75.966 1.00 59.54 ? 418 GLN D N 1 ATOM 13299 C CA . GLN D 1 359 ? -16.102 33.204 77.116 1.00 66.03 ? 418 GLN D CA 1 ATOM 13300 C C . GLN D 1 359 ? -16.098 34.695 77.404 1.00 64.17 ? 418 GLN D C 1 ATOM 13301 O O . GLN D 1 359 ? -16.250 35.115 78.550 1.00 52.07 ? 418 GLN D O 1 ATOM 13302 C CB . GLN D 1 359 ? -14.677 32.706 76.883 1.00 65.30 ? 418 GLN D CB 1 ATOM 13303 C CG . GLN D 1 359 ? -14.515 31.204 77.002 1.00 69.19 ? 418 GLN D CG 1 ATOM 13304 C CD . GLN D 1 359 ? -13.062 30.782 77.008 1.00 78.13 ? 418 GLN D CD 1 ATOM 13305 O OE1 . GLN D 1 359 ? -12.307 31.098 76.088 1.00 75.77 ? 418 GLN D OE1 1 ATOM 13306 N NE2 . GLN D 1 359 ? -12.657 30.075 78.057 1.00 71.91 ? 418 GLN D NE2 1 ATOM 13307 N N . THR D 1 360 ? -15.932 35.485 76.349 1.00 51.10 ? 419 THR D N 1 ATOM 13308 C CA . THR D 1 360 ? -15.996 36.936 76.447 1.00 43.77 ? 419 THR D CA 1 ATOM 13309 C C . THR D 1 360 ? -17.305 37.381 77.095 1.00 50.57 ? 419 THR D C 1 ATOM 13310 O O . THR D 1 360 ? -17.304 38.168 78.040 1.00 62.87 ? 419 THR D O 1 ATOM 13311 C CB . THR D 1 360 ? -15.860 37.593 75.061 1.00 54.52 ? 419 THR D CB 1 ATOM 13312 O OG1 . THR D 1 360 ? -14.631 37.177 74.449 1.00 52.45 ? 419 THR D OG1 1 ATOM 13313 C CG2 . THR D 1 360 ? -15.870 39.104 75.185 1.00 43.23 ? 419 THR D CG2 1 ATOM 13314 N N . LEU D 1 361 ? -18.417 36.860 76.587 1.00 44.90 ? 420 LEU D N 1 ATOM 13315 C CA . LEU D 1 361 ? -19.737 37.170 77.126 1.00 52.80 ? 420 LEU D CA 1 ATOM 13316 C C . LEU D 1 361 ? -19.930 36.668 78.557 1.00 58.78 ? 420 LEU D C 1 ATOM 13317 O O . LEU D 1 361 ? -20.503 37.367 79.393 1.00 68.43 ? 420 LEU D O 1 ATOM 13318 C CB . LEU D 1 361 ? -20.820 36.583 76.221 1.00 47.09 ? 420 LEU D CB 1 ATOM 13319 C CG . LEU D 1 361 ? -20.961 37.221 74.839 1.00 52.89 ? 420 LEU D CG 1 ATOM 13320 C CD1 . LEU D 1 361 ? -22.042 36.522 74.034 1.00 52.60 ? 420 LEU D CD1 1 ATOM 13321 C CD2 . LEU D 1 361 ? -21.262 38.706 74.968 1.00 45.72 ? 420 LEU D CD2 1 HETATM 13322 N N . MSE D 1 362 ? -19.461 35.455 78.836 1.00 86.57 ? 421 MSE D N 1 HETATM 13323 C CA . MSE D 1 362 ? -19.603 34.881 80.171 1.00 101.60 ? 421 MSE D CA 1 HETATM 13324 C C . MSE D 1 362 ? -18.735 35.619 81.185 1.00 76.99 ? 421 MSE D C 1 HETATM 13325 O O . MSE D 1 362 ? -19.112 35.761 82.348 1.00 67.15 ? 421 MSE D O 1 HETATM 13326 C CB . MSE D 1 362 ? -19.255 33.390 80.163 1.00 114.46 ? 421 MSE D CB 1 HETATM 13327 C CG . MSE D 1 362 ? -20.445 32.476 80.424 1.00 107.02 ? 421 MSE D CG 1 HETATM 13328 SE SE . MSE D 1 362 ? -21.181 32.647 82.225 1.00 263.97 ? 421 MSE D SE 1 HETATM 13329 C CE . MSE D 1 362 ? -19.683 31.919 83.240 1.00 137.58 ? 421 MSE D CE 1 ATOM 13330 N N . ASN D 1 363 ? -17.572 36.085 80.740 1.00 52.56 ? 422 ASN D N 1 ATOM 13331 C CA . ASN D 1 363 ? -16.686 36.866 81.596 1.00 53.61 ? 422 ASN D CA 1 ATOM 13332 C C . ASN D 1 363 ? -17.334 38.176 82.031 1.00 65.22 ? 422 ASN D C 1 ATOM 13333 O O . ASN D 1 363 ? -17.267 38.550 83.202 1.00 76.45 ? 422 ASN D O 1 ATOM 13334 C CB . ASN D 1 363 ? -15.357 37.145 80.890 1.00 47.93 ? 422 ASN D CB 1 ATOM 13335 C CG . ASN D 1 363 ? -14.475 35.914 80.801 1.00 67.99 ? 422 ASN D CG 1 ATOM 13336 O OD1 . ASN D 1 363 ? -14.650 34.956 81.554 1.00 63.02 ? 422 ASN D OD1 1 ATOM 13337 N ND2 . ASN D 1 363 ? -13.520 35.934 79.876 1.00 69.91 ? 422 ASN D ND2 1 ATOM 13338 N N . PHE D 1 364 ? -17.956 38.870 81.083 1.00 53.70 ? 423 PHE D N 1 ATOM 13339 C CA . PHE D 1 364 ? -18.636 40.126 81.382 1.00 59.04 ? 423 PHE D CA 1 ATOM 13340 C C . PHE D 1 364 ? -19.867 39.929 82.267 1.00 61.51 ? 423 PHE D C 1 ATOM 13341 O O . PHE D 1 364 ? -20.079 40.680 83.216 1.00 65.14 ? 423 PHE D O 1 ATOM 13342 C CB . PHE D 1 364 ? -19.051 40.838 80.089 1.00 52.30 ? 423 PHE D CB 1 ATOM 13343 C CG . PHE D 1 364 ? -17.903 41.436 79.322 1.00 52.22 ? 423 PHE D CG 1 ATOM 13344 C CD1 . PHE D 1 364 ? -16.995 42.274 79.948 1.00 52.78 ? 423 PHE D CD1 1 ATOM 13345 C CD2 . PHE D 1 364 ? -17.752 41.184 77.967 1.00 44.56 ? 423 PHE D CD2 1 ATOM 13346 C CE1 . PHE D 1 364 ? -15.944 42.832 79.243 1.00 49.62 ? 423 PHE D CE1 1 ATOM 13347 C CE2 . PHE D 1 364 ? -16.704 41.740 77.255 1.00 42.82 ? 423 PHE D CE2 1 ATOM 13348 C CZ . PHE D 1 364 ? -15.798 42.565 77.893 1.00 42.35 ? 423 PHE D CZ 1 ATOM 13349 N N . TYR D 1 365 ? -20.677 38.922 81.951 1.00 51.75 ? 424 TYR D N 1 ATOM 13350 C CA . TYR D 1 365 ? -21.919 38.675 82.685 1.00 56.96 ? 424 TYR D CA 1 ATOM 13351 C C . TYR D 1 365 ? -21.695 38.296 84.149 1.00 63.85 ? 424 TYR D C 1 ATOM 13352 O O . TYR D 1 365 ? -22.451 38.711 85.027 1.00 68.30 ? 424 TYR D O 1 ATOM 13353 C CB . TYR D 1 365 ? -22.739 37.583 81.998 1.00 45.65 ? 424 TYR D CB 1 ATOM 13354 C CG . TYR D 1 365 ? -24.051 37.305 82.695 1.00 63.13 ? 424 TYR D CG 1 ATOM 13355 C CD1 . TYR D 1 365 ? -24.970 38.324 82.911 1.00 50.54 ? 424 TYR D CD1 1 ATOM 13356 C CD2 . TYR D 1 365 ? -24.371 36.029 83.143 1.00 62.38 ? 424 TYR D CD2 1 ATOM 13357 C CE1 . TYR D 1 365 ? -26.170 38.081 83.550 1.00 48.83 ? 424 TYR D CE1 1 ATOM 13358 C CE2 . TYR D 1 365 ? -25.570 35.777 83.783 1.00 63.10 ? 424 TYR D CE2 1 ATOM 13359 C CZ . TYR D 1 365 ? -26.466 36.807 83.984 1.00 65.18 ? 424 TYR D CZ 1 ATOM 13360 O OH . TYR D 1 365 ? -27.660 36.561 84.620 1.00 66.31 ? 424 TYR D OH 1 ATOM 13361 N N . SER D 1 366 ? -20.654 37.509 84.404 1.00 64.26 ? 425 SER D N 1 ATOM 13362 C CA . SER D 1 366 ? -20.367 37.012 85.748 1.00 66.02 ? 425 SER D CA 1 ATOM 13363 C C . SER D 1 366 ? -19.918 38.132 86.682 1.00 72.55 ? 425 SER D C 1 ATOM 13364 O O . SER D 1 366 ? -19.898 37.968 87.903 1.00 75.61 ? 425 SER D O 1 ATOM 13365 C CB . SER D 1 366 ? -19.305 35.913 85.697 1.00 56.64 ? 425 SER D CB 1 ATOM 13366 O OG . SER D 1 366 ? -18.165 36.339 84.971 1.00 71.30 ? 425 SER D OG 1 ATOM 13367 N N . THR D 1 367 ? -19.560 39.269 86.098 1.00 61.66 ? 426 THR D N 1 ATOM 13368 C CA . THR D 1 367 ? -19.184 40.450 86.864 1.00 62.46 ? 426 THR D CA 1 ATOM 13369 C C . THR D 1 367 ? -20.103 41.612 86.508 1.00 67.56 ? 426 THR D C 1 ATOM 13370 O O . THR D 1 367 ? -19.938 42.236 85.463 1.00 58.53 ? 426 THR D O 1 ATOM 13371 C CB . THR D 1 367 ? -17.722 40.852 86.603 1.00 63.09 ? 426 THR D CB 1 ATOM 13372 O OG1 . THR D 1 367 ? -16.860 39.745 86.895 1.00 70.25 ? 426 THR D OG1 1 ATOM 13373 C CG2 . THR D 1 367 ? -17.334 42.039 87.471 1.00 64.31 ? 426 THR D CG2 1 ATOM 13374 N N . PRO D 1 368 ? -21.096 41.886 87.368 1.00 74.23 ? 427 PRO D N 1 ATOM 13375 C CA . PRO D 1 368 ? -22.094 42.932 87.117 1.00 77.20 ? 427 PRO D CA 1 ATOM 13376 C C . PRO D 1 368 ? -21.479 44.289 86.771 1.00 77.50 ? 427 PRO D C 1 ATOM 13377 O O . PRO D 1 368 ? -20.468 44.670 87.364 1.00 80.35 ? 427 PRO D O 1 ATOM 13378 C CB . PRO D 1 368 ? -22.851 43.012 88.447 1.00 77.26 ? 427 PRO D CB 1 ATOM 13379 C CG . PRO D 1 368 ? -22.716 41.649 89.030 1.00 75.76 ? 427 PRO D CG 1 ATOM 13380 C CD . PRO D 1 368 ? -21.342 41.181 88.638 1.00 77.02 ? 427 PRO D CD 1 ATOM 13381 N N . LYS D 1 369 ? -22.076 44.974 85.795 1.00 57.10 ? 428 LYS D N 1 ATOM 13382 C CA . LYS D 1 369 ? -21.661 46.309 85.351 1.00 49.27 ? 428 LYS D CA 1 ATOM 13383 C C . LYS D 1 369 ? -20.305 46.356 84.634 1.00 62.52 ? 428 LYS D C 1 ATOM 13384 O O . LYS D 1 369 ? -19.847 47.435 84.260 1.00 60.21 ? 428 LYS D O 1 ATOM 13385 C CB . LYS D 1 369 ? -21.640 47.288 86.533 1.00 51.24 ? 428 LYS D CB 1 ATOM 13386 C CG . LYS D 1 369 ? -22.960 47.412 87.280 1.00 43.56 ? 428 LYS D CG 1 ATOM 13387 C CD . LYS D 1 369 ? -22.799 48.249 88.541 1.00 63.49 ? 428 LYS D CD 1 ATOM 13388 C CE . LYS D 1 369 ? -24.122 48.399 89.271 1.00 72.00 ? 428 LYS D CE 1 ATOM 13389 N NZ . LYS D 1 369 ? -25.037 49.317 88.542 1.00 77.32 ? 428 LYS D NZ 1 ATOM 13390 N N . SER D 1 370 ? -19.669 45.203 84.439 1.00 61.77 ? 429 SER D N 1 ATOM 13391 C CA . SER D 1 370 ? -18.324 45.152 83.851 1.00 51.65 ? 429 SER D CA 1 ATOM 13392 C C . SER D 1 370 ? -18.278 45.430 82.351 1.00 48.04 ? 429 SER D C 1 ATOM 13393 O O . SER D 1 370 ? -17.321 46.029 81.855 1.00 62.14 ? 429 SER D O 1 ATOM 13394 C CB . SER D 1 370 ? -17.686 43.789 84.115 1.00 56.55 ? 429 SER D CB 1 ATOM 13395 O OG . SER D 1 370 ? -18.361 42.770 83.395 1.00 58.33 ? 429 SER D OG 1 ATOM 13396 N N . LEU D 1 371 ? -19.290 44.966 81.628 1.00 56.73 ? 430 LEU D N 1 ATOM 13397 C CA . LEU D 1 371 ? -19.364 45.206 80.192 1.00 66.02 ? 430 LEU D CA 1 ATOM 13398 C C . LEU D 1 371 ? -19.452 46.695 79.886 1.00 58.13 ? 430 LEU D C 1 ATOM 13399 O O . LEU D 1 371 ? -18.676 47.223 79.090 1.00 53.41 ? 430 LEU D O 1 ATOM 13400 C CB . LEU D 1 371 ? -20.561 44.482 79.580 1.00 66.17 ? 430 LEU D CB 1 ATOM 13401 C CG . LEU D 1 371 ? -20.767 44.778 78.094 1.00 53.78 ? 430 LEU D CG 1 ATOM 13402 C CD1 . LEU D 1 371 ? -19.589 44.269 77.271 1.00 43.04 ? 430 LEU D CD1 1 ATOM 13403 C CD2 . LEU D 1 371 ? -22.074 44.181 77.599 1.00 46.35 ? 430 LEU D CD2 1 ATOM 13404 N N . THR D 1 372 ? -20.404 47.367 80.524 1.00 46.24 ? 431 THR D N 1 ATOM 13405 C CA . THR D 1 372 ? -20.615 48.791 80.297 1.00 60.55 ? 431 THR D CA 1 ATOM 13406 C C . THR D 1 372 ? -19.483 49.654 80.865 1.00 62.69 ? 431 THR D C 1 ATOM 13407 O O . THR D 1 372 ? -19.224 50.745 80.358 1.00 72.03 ? 431 THR D O 1 ATOM 13408 C CB . THR D 1 372 ? -21.963 49.259 80.887 1.00 63.50 ? 431 THR D CB 1 ATOM 13409 O OG1 . THR D 1 372 ? -22.041 48.898 82.271 1.00 69.12 ? 431 THR D OG1 1 ATOM 13410 C CG2 . THR D 1 372 ? -23.119 48.610 80.141 1.00 42.92 ? 431 THR D CG2 1 ATOM 13411 N N . LYS D 1 373 ? -18.809 49.169 81.906 1.00 62.71 ? 432 LYS D N 1 ATOM 13412 C CA . LYS D 1 373 ? -17.645 49.870 82.452 1.00 57.30 ? 432 LYS D CA 1 ATOM 13413 C C . LYS D 1 373 ? -16.467 49.858 81.487 1.00 46.93 ? 432 LYS D C 1 ATOM 13414 O O . LYS D 1 373 ? -15.796 50.876 81.298 1.00 46.62 ? 432 LYS D O 1 ATOM 13415 C CB . LYS D 1 373 ? -17.220 49.256 83.788 1.00 67.34 ? 432 LYS D CB 1 ATOM 13416 C CG . LYS D 1 373 ? -17.936 49.852 84.985 1.00 65.08 ? 432 LYS D CG 1 ATOM 13417 C CD . LYS D 1 373 ? -17.716 49.048 86.252 1.00 71.34 ? 432 LYS D CD 1 ATOM 13418 C CE . LYS D 1 373 ? -18.447 49.683 87.426 1.00 71.00 ? 432 LYS D CE 1 ATOM 13419 N NZ . LYS D 1 373 ? -18.058 51.109 87.624 1.00 67.86 ? 432 LYS D NZ 1 ATOM 13420 N N . ALA D 1 374 ? -16.227 48.700 80.880 1.00 43.73 ? 433 ALA D N 1 ATOM 13421 C CA . ALA D 1 374 ? -15.168 48.544 79.891 1.00 49.21 ? 433 ALA D CA 1 ATOM 13422 C C . ALA D 1 374 ? -15.470 49.371 78.648 1.00 55.28 ? 433 ALA D C 1 ATOM 13423 O O . ALA D 1 374 ? -14.561 49.852 77.969 1.00 61.43 ? 433 ALA D O 1 ATOM 13424 C CB . ALA D 1 374 ? -15.003 47.076 79.526 1.00 41.03 ? 433 ALA D CB 1 ATOM 13425 N N . LEU D 1 375 ? -16.759 49.546 78.375 1.00 59.79 ? 434 LEU D N 1 ATOM 13426 C CA . LEU D 1 375 ? -17.218 50.362 77.260 1.00 60.57 ? 434 LEU D CA 1 ATOM 13427 C C . LEU D 1 375 ? -17.063 51.838 77.603 1.00 57.73 ? 434 LEU D C 1 ATOM 13428 O O . LEU D 1 375 ? -16.618 52.634 76.777 1.00 56.40 ? 434 LEU D O 1 ATOM 13429 C CB . LEU D 1 375 ? -18.674 50.046 76.918 1.00 49.05 ? 434 LEU D CB 1 ATOM 13430 C CG . LEU D 1 375 ? -19.292 50.921 75.825 1.00 55.22 ? 434 LEU D CG 1 ATOM 13431 C CD1 . LEU D 1 375 ? -18.600 50.684 74.490 1.00 41.22 ? 434 LEU D CD1 1 ATOM 13432 C CD2 . LEU D 1 375 ? -20.789 50.689 75.711 1.00 41.80 ? 434 LEU D CD2 1 ATOM 13433 N N . HIS D 1 376 ? -17.455 52.193 78.823 1.00 50.28 ? 435 HIS D N 1 ATOM 13434 C CA . HIS D 1 376 ? -17.354 53.565 79.305 1.00 50.90 ? 435 HIS D CA 1 ATOM 13435 C C . HIS D 1 376 ? -15.904 54.042 79.256 1.00 61.23 ? 435 HIS D C 1 ATOM 13436 O O . HIS D 1 376 ? -15.626 55.160 78.817 1.00 49.47 ? 435 HIS D O 1 ATOM 13437 C CB . HIS D 1 376 ? -17.908 53.670 80.730 1.00 53.94 ? 435 HIS D CB 1 ATOM 13438 C CG . HIS D 1 376 ? -17.958 55.069 81.262 1.00 62.97 ? 435 HIS D CG 1 ATOM 13439 N ND1 . HIS D 1 376 ? -17.663 56.171 80.490 1.00 67.58 ? 435 HIS D ND1 1 ATOM 13440 C CD2 . HIS D 1 376 ? -18.271 55.543 82.491 1.00 64.69 ? 435 HIS D CD2 1 ATOM 13441 C CE1 . HIS D 1 376 ? -17.789 57.265 81.222 1.00 66.58 ? 435 HIS D CE1 1 ATOM 13442 N NE2 . HIS D 1 376 ? -18.158 56.911 82.439 1.00 63.72 ? 435 HIS D NE2 1 ATOM 13443 N N . GLU D 1 377 ? -14.988 53.192 79.713 1.00 52.39 ? 436 GLU D N 1 ATOM 13444 C CA . GLU D 1 377 ? -13.564 53.516 79.710 1.00 57.14 ? 436 GLU D CA 1 ATOM 13445 C C . GLU D 1 377 ? -13.011 53.702 78.302 1.00 52.34 ? 436 GLU D C 1 ATOM 13446 O O . GLU D 1 377 ? -12.186 54.584 78.062 1.00 63.08 ? 436 GLU D O 1 ATOM 13447 C CB . GLU D 1 377 ? -12.766 52.428 80.436 1.00 63.22 ? 436 GLU D CB 1 ATOM 13448 C CG . GLU D 1 377 ? -11.279 52.740 80.586 1.00 80.20 ? 436 GLU D CG 1 ATOM 13449 C CD . GLU D 1 377 ? -10.985 53.805 81.629 1.00 103.10 ? 436 GLU D CD 1 ATOM 13450 O OE1 . GLU D 1 377 ? -11.933 54.317 82.260 1.00 103.11 ? 436 GLU D OE1 1 ATOM 13451 O OE2 . GLU D 1 377 ? -9.795 54.137 81.813 1.00 105.94 ? 436 GLU D OE2 1 ATOM 13452 N N . SER D 1 378 ? -13.469 52.870 77.373 1.00 54.03 ? 437 SER D N 1 ATOM 13453 C CA . SER D 1 378 ? -13.030 52.969 75.987 1.00 44.10 ? 437 SER D CA 1 ATOM 13454 C C . SER D 1 378 ? -13.549 54.250 75.349 1.00 55.80 ? 437 SER D C 1 ATOM 13455 O O . SER D 1 378 ? -12.803 54.972 74.686 1.00 52.73 ? 437 SER D O 1 ATOM 13456 C CB . SER D 1 378 ? -13.494 51.752 75.185 1.00 42.16 ? 437 SER D CB 1 ATOM 13457 O OG . SER D 1 378 ? -12.934 51.757 73.884 1.00 55.98 ? 437 SER D OG 1 ATOM 13458 N N . LEU D 1 379 ? -14.832 54.529 75.561 1.00 43.27 ? 438 LEU D N 1 ATOM 13459 C CA . LEU D 1 379 ? -15.468 55.722 75.015 1.00 51.39 ? 438 LEU D CA 1 ATOM 13460 C C . LEU D 1 379 ? -14.844 56.999 75.571 1.00 54.26 ? 438 LEU D C 1 ATOM 13461 O O . LEU D 1 379 ? -14.770 58.015 74.882 1.00 57.09 ? 438 LEU D O 1 ATOM 13462 C CB . LEU D 1 379 ? -16.971 55.707 75.307 1.00 52.25 ? 438 LEU D CB 1 ATOM 13463 C CG . LEU D 1 379 ? -17.803 54.639 74.593 1.00 45.80 ? 438 LEU D CG 1 ATOM 13464 C CD1 . LEU D 1 379 ? -19.252 54.690 75.057 1.00 43.16 ? 438 LEU D CD1 1 ATOM 13465 C CD2 . LEU D 1 379 ? -17.712 54.796 73.083 1.00 48.62 ? 438 LEU D CD2 1 ATOM 13466 N N . SER D 1 380 ? -14.404 56.934 76.824 1.00 56.38 ? 439 SER D N 1 ATOM 13467 C CA . SER D 1 380 ? -13.817 58.083 77.507 1.00 47.64 ? 439 SER D CA 1 ATOM 13468 C C . SER D 1 380 ? -12.571 58.630 76.813 1.00 51.44 ? 439 SER D C 1 ATOM 13469 O O . SER D 1 380 ? -12.270 59.820 76.917 1.00 56.83 ? 439 SER D O 1 ATOM 13470 C CB . SER D 1 380 ? -13.478 57.713 78.953 1.00 56.40 ? 439 SER D CB 1 ATOM 13471 O OG . SER D 1 380 ? -14.646 57.367 79.675 1.00 69.93 ? 439 SER D OG 1 ATOM 13472 N N . LYS D 1 381 ? -11.846 57.766 76.109 1.00 38.36 ? 440 LYS D N 1 ATOM 13473 C CA . LYS D 1 381 ? -10.633 58.189 75.414 1.00 43.01 ? 440 LYS D CA 1 ATOM 13474 C C . LYS D 1 381 ? -10.951 58.955 74.132 1.00 45.09 ? 440 LYS D C 1 ATOM 13475 O O . LYS D 1 381 ? -10.093 59.649 73.587 1.00 64.54 ? 440 LYS D O 1 ATOM 13476 C CB . LYS D 1 381 ? -9.738 56.987 75.100 1.00 47.20 ? 440 LYS D CB 1 ATOM 13477 C CG . LYS D 1 381 ? -9.218 56.263 76.333 1.00 59.14 ? 440 LYS D CG 1 ATOM 13478 C CD . LYS D 1 381 ? -8.108 55.284 75.978 1.00 65.30 ? 440 LYS D CD 1 ATOM 13479 C CE . LYS D 1 381 ? -8.528 54.338 74.867 1.00 66.43 ? 440 LYS D CE 1 ATOM 13480 N NZ . LYS D 1 381 ? -9.643 53.447 75.288 1.00 70.90 ? 440 LYS D NZ 1 ATOM 13481 N N . ASP D 1 382 ? -12.185 58.828 73.653 1.00 53.64 ? 441 ASP D N 1 ATOM 13482 C CA . ASP D 1 382 ? -12.619 59.572 72.476 1.00 42.24 ? 441 ASP D CA 1 ATOM 13483 C C . ASP D 1 382 ? -12.808 61.041 72.838 1.00 46.23 ? 441 ASP D C 1 ATOM 13484 O O . ASP D 1 382 ? -13.444 61.358 73.844 1.00 49.26 ? 441 ASP D O 1 ATOM 13485 C CB . ASP D 1 382 ? -13.913 58.985 71.905 1.00 44.26 ? 441 ASP D CB 1 ATOM 13486 C CG . ASP D 1 382 ? -14.296 59.604 70.573 1.00 47.60 ? 441 ASP D CG 1 ATOM 13487 O OD1 . ASP D 1 382 ? -14.853 60.723 70.571 1.00 54.87 ? 441 ASP D OD1 1 ATOM 13488 O OD2 . ASP D 1 382 ? -14.037 58.974 69.525 1.00 44.85 ? 441 ASP D OD2 1 ATOM 13489 N N . PRO D 1 383 ? -12.250 61.943 72.017 1.00 38.61 ? 442 PRO D N 1 ATOM 13490 C CA . PRO D 1 383 ? -12.258 63.389 72.280 1.00 36.66 ? 442 PRO D CA 1 ATOM 13491 C C . PRO D 1 383 ? -13.655 64.002 72.369 1.00 41.05 ? 442 PRO D C 1 ATOM 13492 O O . PRO D 1 383 ? -13.799 65.099 72.909 1.00 55.00 ? 442 PRO D O 1 ATOM 13493 C CB . PRO D 1 383 ? -11.502 63.970 71.078 1.00 36.38 ? 442 PRO D CB 1 ATOM 13494 C CG . PRO D 1 383 ? -10.697 62.840 70.540 1.00 39.82 ? 442 PRO D CG 1 ATOM 13495 C CD . PRO D 1 383 ? -11.498 61.606 70.796 1.00 36.92 ? 442 PRO D CD 1 ATOM 13496 N N . ALA D 1 384 ? -14.664 63.309 71.851 1.00 49.80 ? 443 ALA D N 1 ATOM 13497 C CA . ALA D 1 384 ? -16.022 63.843 71.830 1.00 37.44 ? 443 ALA D CA 1 ATOM 13498 C C . ALA D 1 384 ? -16.890 63.268 72.945 1.00 41.58 ? 443 ALA D C 1 ATOM 13499 O O . ALA D 1 384 ? -18.110 63.436 72.934 1.00 43.33 ? 443 ALA D O 1 ATOM 13500 C CB . ALA D 1 384 ? -16.667 63.583 70.477 1.00 37.69 ? 443 ALA D CB 1 ATOM 13501 N N . HIS D 1 385 ? -16.262 62.591 73.903 1.00 37.75 ? 444 HIS D N 1 ATOM 13502 C CA . HIS D 1 385 ? -16.991 61.990 75.017 1.00 40.13 ? 444 HIS D CA 1 ATOM 13503 C C . HIS D 1 385 ? -17.699 63.059 75.853 1.00 45.69 ? 444 HIS D C 1 ATOM 13504 O O . HIS D 1 385 ? -17.227 64.194 75.933 1.00 48.29 ? 444 HIS D O 1 ATOM 13505 C CB . HIS D 1 385 ? -16.045 61.157 75.890 1.00 48.10 ? 444 HIS D CB 1 ATOM 13506 C CG . HIS D 1 385 ? -15.126 61.975 76.742 1.00 67.35 ? 444 HIS D CG 1 ATOM 13507 N ND1 . HIS D 1 385 ? -14.010 62.608 76.239 1.00 83.82 ? 444 HIS D ND1 1 ATOM 13508 C CD2 . HIS D 1 385 ? -15.152 62.255 78.067 1.00 64.19 ? 444 HIS D CD2 1 ATOM 13509 C CE1 . HIS D 1 385 ? -13.390 63.246 77.216 1.00 70.74 ? 444 HIS D CE1 1 ATOM 13510 N NE2 . HIS D 1 385 ? -14.063 63.048 78.336 1.00 79.45 ? 444 HIS D NE2 1 ATOM 13511 N N . PRO D 1 386 ? -18.839 62.707 76.478 1.00 38.28 ? 445 PRO D N 1 ATOM 13512 C CA . PRO D 1 386 ? -19.513 61.399 76.475 1.00 51.23 ? 445 PRO D CA 1 ATOM 13513 C C . PRO D 1 386 ? -20.125 61.013 75.128 1.00 43.86 ? 445 PRO D C 1 ATOM 13514 O O . PRO D 1 386 ? -20.779 61.829 74.479 1.00 51.18 ? 445 PRO D O 1 ATOM 13515 C CB . PRO D 1 386 ? -20.611 61.574 77.529 1.00 38.98 ? 445 PRO D CB 1 ATOM 13516 C CG . PRO D 1 386 ? -20.897 63.030 77.527 1.00 38.68 ? 445 PRO D CG 1 ATOM 13517 C CD . PRO D 1 386 ? -19.572 63.695 77.289 1.00 38.20 ? 445 PRO D CD 1 ATOM 13518 N N . ILE D 1 387 ? -19.902 59.767 74.724 1.00 43.32 ? 446 ILE D N 1 ATOM 13519 C CA . ILE D 1 387 ? -20.407 59.262 73.454 1.00 48.71 ? 446 ILE D CA 1 ATOM 13520 C C . ILE D 1 387 ? -21.844 58.770 73.599 1.00 54.62 ? 446 ILE D C 1 ATOM 13521 O O . ILE D 1 387 ? -22.687 59.016 72.737 1.00 54.12 ? 446 ILE D O 1 ATOM 13522 C CB . ILE D 1 387 ? -19.528 58.115 72.915 1.00 43.81 ? 446 ILE D CB 1 ATOM 13523 C CG1 . ILE D 1 387 ? -18.067 58.559 72.814 1.00 40.34 ? 446 ILE D CG1 1 ATOM 13524 C CG2 . ILE D 1 387 ? -20.041 57.632 71.568 1.00 47.44 ? 446 ILE D CG2 1 ATOM 13525 C CD1 . ILE D 1 387 ? -17.862 59.803 71.976 1.00 42.16 ? 446 ILE D CD1 1 ATOM 13526 N N . LEU D 1 388 ? -22.115 58.079 74.701 1.00 43.75 ? 447 LEU D N 1 ATOM 13527 C CA . LEU D 1 388 ? -23.441 57.531 74.959 1.00 42.68 ? 447 LEU D CA 1 ATOM 13528 C C . LEU D 1 388 ? -24.069 58.117 76.215 1.00 40.78 ? 447 LEU D C 1 ATOM 13529 O O . LEU D 1 388 ? -23.381 58.369 77.204 1.00 51.01 ? 447 LEU D O 1 ATOM 13530 C CB . LEU D 1 388 ? -23.369 56.009 75.092 1.00 41.16 ? 447 LEU D CB 1 ATOM 13531 C CG . LEU D 1 388 ? -23.062 55.214 73.824 1.00 58.08 ? 447 LEU D CG 1 ATOM 13532 C CD1 . LEU D 1 388 ? -22.853 53.748 74.163 1.00 41.62 ? 447 LEU D CD1 1 ATOM 13533 C CD2 . LEU D 1 388 ? -24.180 55.382 72.808 1.00 48.09 ? 447 LEU D CD2 1 ATOM 13534 N N . ALA D 1 389 ? -25.379 58.337 76.169 1.00 45.52 ? 448 ALA D N 1 ATOM 13535 C CA . ALA D 1 389 ? -26.135 58.651 77.372 1.00 41.16 ? 448 ALA D CA 1 ATOM 13536 C C . ALA D 1 389 ? -26.071 57.456 78.316 1.00 55.89 ? 448 ALA D C 1 ATOM 13537 O O . ALA D 1 389 ? -26.131 56.307 77.875 1.00 63.20 ? 448 ALA D O 1 ATOM 13538 C CB . ALA D 1 389 ? -27.573 59.000 77.034 1.00 41.46 ? 448 ALA D CB 1 ATOM 13539 N N . TYR D 1 390 ? -25.945 57.729 79.610 1.00 53.28 ? 449 TYR D N 1 ATOM 13540 C CA . TYR D 1 390 ? -25.695 56.683 80.597 1.00 56.49 ? 449 TYR D CA 1 ATOM 13541 C C . TYR D 1 390 ? -26.854 55.698 80.722 1.00 60.85 ? 449 TYR D C 1 ATOM 13542 O O . TYR D 1 390 ? -26.671 54.573 81.188 1.00 57.94 ? 449 TYR D O 1 ATOM 13543 C CB . TYR D 1 390 ? -25.398 57.307 81.962 1.00 44.96 ? 449 TYR D CB 1 ATOM 13544 C CG . TYR D 1 390 ? -24.157 58.171 81.977 1.00 58.28 ? 449 TYR D CG 1 ATOM 13545 C CD1 . TYR D 1 390 ? -23.100 57.915 81.114 1.00 46.97 ? 449 TYR D CD1 1 ATOM 13546 C CD2 . TYR D 1 390 ? -24.045 59.245 82.850 1.00 52.84 ? 449 TYR D CD2 1 ATOM 13547 C CE1 . TYR D 1 390 ? -21.964 58.701 81.122 1.00 57.15 ? 449 TYR D CE1 1 ATOM 13548 C CE2 . TYR D 1 390 ? -22.913 60.038 82.866 1.00 40.14 ? 449 TYR D CE2 1 ATOM 13549 C CZ . TYR D 1 390 ? -21.876 59.762 81.999 1.00 54.34 ? 449 TYR D CZ 1 ATOM 13550 O OH . TYR D 1 390 ? -20.746 60.547 82.010 1.00 63.75 ? 449 TYR D OH 1 ATOM 13551 N N . LYS D 1 391 ? -28.042 56.123 80.303 1.00 42.30 ? 450 LYS D N 1 ATOM 13552 C CA . LYS D 1 391 ? -29.236 55.285 80.378 1.00 42.86 ? 450 LYS D CA 1 ATOM 13553 C C . LYS D 1 391 ? -29.147 54.037 79.499 1.00 45.88 ? 450 LYS D C 1 ATOM 13554 O O . LYS D 1 391 ? -29.914 53.091 79.678 1.00 53.02 ? 450 LYS D O 1 ATOM 13555 C CB . LYS D 1 391 ? -30.474 56.103 80.001 1.00 42.99 ? 450 LYS D CB 1 ATOM 13556 C CG . LYS D 1 391 ? -30.353 56.841 78.678 1.00 55.57 ? 450 LYS D CG 1 ATOM 13557 C CD . LYS D 1 391 ? -31.621 57.620 78.369 1.00 42.91 ? 450 LYS D CD 1 ATOM 13558 C CE . LYS D 1 391 ? -31.401 58.601 77.230 1.00 50.13 ? 450 LYS D CE 1 ATOM 13559 N NZ . LYS D 1 391 ? -32.667 59.280 76.836 1.00 43.50 ? 450 LYS D NZ 1 ATOM 13560 N N . HIS D 1 392 ? -28.217 54.039 78.549 1.00 47.43 ? 451 HIS D N 1 ATOM 13561 C CA . HIS D 1 392 ? -28.012 52.882 77.682 1.00 51.17 ? 451 HIS D CA 1 ATOM 13562 C C . HIS D 1 392 ? -27.216 51.784 78.378 1.00 52.80 ? 451 HIS D C 1 ATOM 13563 O O . HIS D 1 392 ? -27.260 50.623 77.968 1.00 54.62 ? 451 HIS D O 1 ATOM 13564 C CB . HIS D 1 392 ? -27.312 53.296 76.384 1.00 42.94 ? 451 HIS D CB 1 ATOM 13565 C CG . HIS D 1 392 ? -28.179 54.092 75.459 1.00 51.93 ? 451 HIS D CG 1 ATOM 13566 N ND1 . HIS D 1 392 ? -29.069 53.504 74.586 1.00 54.99 ? 451 HIS D ND1 1 ATOM 13567 C CD2 . HIS D 1 392 ? -28.296 55.428 75.274 1.00 52.50 ? 451 HIS D CD2 1 ATOM 13568 C CE1 . HIS D 1 392 ? -29.696 54.444 73.902 1.00 47.19 ? 451 HIS D CE1 1 ATOM 13569 N NE2 . HIS D 1 392 ? -29.246 55.620 74.300 1.00 51.56 ? 451 HIS D NE2 1 ATOM 13570 N N . TYR D 1 393 ? -26.482 52.151 79.425 1.00 54.94 ? 452 TYR D N 1 ATOM 13571 C CA . TYR D 1 393 ? -25.695 51.174 80.175 1.00 50.06 ? 452 TYR D CA 1 ATOM 13572 C C . TYR D 1 393 ? -26.565 50.108 80.860 1.00 50.46 ? 452 TYR D C 1 ATOM 13573 O O . TYR D 1 393 ? -26.301 48.916 80.698 1.00 46.35 ? 452 TYR D O 1 ATOM 13574 C CB . TYR D 1 393 ? -24.798 51.871 81.206 1.00 48.19 ? 452 TYR D CB 1 ATOM 13575 C CG . TYR D 1 393 ? -23.686 52.698 80.600 1.00 50.67 ? 452 TYR D CG 1 ATOM 13576 C CD1 . TYR D 1 393 ? -23.169 52.391 79.348 1.00 51.89 ? 452 TYR D CD1 1 ATOM 13577 C CD2 . TYR D 1 393 ? -23.145 53.779 81.285 1.00 61.38 ? 452 TYR D CD2 1 ATOM 13578 C CE1 . TYR D 1 393 ? -22.150 53.141 78.793 1.00 57.80 ? 452 TYR D CE1 1 ATOM 13579 C CE2 . TYR D 1 393 ? -22.125 54.535 80.738 1.00 53.41 ? 452 TYR D CE2 1 ATOM 13580 C CZ . TYR D 1 393 ? -21.632 54.211 79.491 1.00 49.39 ? 452 TYR D CZ 1 ATOM 13581 O OH . TYR D 1 393 ? -20.616 54.960 78.941 1.00 57.24 ? 452 TYR D OH 1 ATOM 13582 N N . PRO D 1 394 ? -27.599 50.516 81.629 1.00 57.12 ? 453 PRO D N 1 ATOM 13583 C CA . PRO D 1 394 ? -28.433 49.445 82.190 1.00 54.65 ? 453 PRO D CA 1 ATOM 13584 C C . PRO D 1 394 ? -29.178 48.670 81.106 1.00 60.71 ? 453 PRO D C 1 ATOM 13585 O O . PRO D 1 394 ? -29.476 47.490 81.286 1.00 75.33 ? 453 PRO D O 1 ATOM 13586 C CB . PRO D 1 394 ? -29.418 50.191 83.099 1.00 47.44 ? 453 PRO D CB 1 ATOM 13587 C CG . PRO D 1 394 ? -29.420 51.588 82.608 1.00 43.90 ? 453 PRO D CG 1 ATOM 13588 C CD . PRO D 1 394 ? -28.050 51.848 82.073 1.00 43.44 ? 453 PRO D CD 1 ATOM 13589 N N . ALA D 1 395 ? -29.470 49.339 79.995 1.00 75.20 ? 454 ALA D N 1 ATOM 13590 C CA . ALA D 1 395 ? -30.151 48.709 78.870 1.00 68.06 ? 454 ALA D CA 1 ATOM 13591 C C . ALA D 1 395 ? -29.285 47.614 78.260 1.00 64.70 ? 454 ALA D C 1 ATOM 13592 O O . ALA D 1 395 ? -29.782 46.559 77.872 1.00 80.46 ? 454 ALA D O 1 ATOM 13593 C CB . ALA D 1 395 ? -30.513 49.745 77.819 1.00 62.48 ? 454 ALA D CB 1 HETATM 13594 N N . MSE D 1 396 ? -27.985 47.875 78.182 1.00 56.26 ? 455 MSE D N 1 HETATM 13595 C CA . MSE D 1 396 ? -27.041 46.908 77.637 1.00 56.52 ? 455 MSE D CA 1 HETATM 13596 C C . MSE D 1 396 ? -26.857 45.730 78.580 1.00 78.16 ? 455 MSE D C 1 HETATM 13597 O O . MSE D 1 396 ? -26.756 44.582 78.146 1.00 80.69 ? 455 MSE D O 1 HETATM 13598 C CB . MSE D 1 396 ? -25.697 47.572 77.364 1.00 43.98 ? 455 MSE D CB 1 HETATM 13599 C CG . MSE D 1 396 ? -25.362 47.670 75.895 1.00 86.75 ? 455 MSE D CG 1 HETATM 13600 SE SE . MSE D 1 396 ? -23.800 48.776 75.575 1.00 109.64 ? 455 MSE D SE 1 HETATM 13601 C CE . MSE D 1 396 ? -23.773 48.645 73.639 1.00 65.19 ? 455 MSE D CE 1 ATOM 13602 N N . GLU D 1 397 ? -26.804 46.026 79.874 1.00 61.39 ? 456 GLU D N 1 ATOM 13603 C CA . GLU D 1 397 ? -26.712 44.992 80.893 1.00 58.63 ? 456 GLU D CA 1 ATOM 13604 C C . GLU D 1 397 ? -27.943 44.091 80.851 1.00 58.10 ? 456 GLU D C 1 ATOM 13605 O O . GLU D 1 397 ? -27.833 42.869 80.955 1.00 57.97 ? 456 GLU D O 1 ATOM 13606 C CB . GLU D 1 397 ? -26.554 45.620 82.279 1.00 58.14 ? 456 GLU D CB 1 ATOM 13607 C CG . GLU D 1 397 ? -25.262 46.403 82.471 1.00 50.20 ? 456 GLU D CG 1 ATOM 13608 C CD . GLU D 1 397 ? -24.030 45.516 82.443 1.00 53.74 ? 456 GLU D CD 1 ATOM 13609 O OE1 . GLU D 1 397 ? -24.145 44.324 82.798 1.00 63.65 ? 456 GLU D OE1 1 ATOM 13610 O OE2 . GLU D 1 397 ? -22.947 46.011 82.068 1.00 60.05 ? 456 GLU D OE2 1 ATOM 13611 N N . ARG D 1 398 ? -29.109 44.705 80.673 1.00 57.85 ? 457 ARG D N 1 ATOM 13612 C CA . ARG D 1 398 ? -30.370 43.974 80.596 1.00 61.45 ? 457 ARG D CA 1 ATOM 13613 C C . ARG D 1 398 ? -30.393 43.037 79.392 1.00 57.06 ? 457 ARG D C 1 ATOM 13614 O O . ARG D 1 398 ? -30.891 41.913 79.472 1.00 64.94 ? 457 ARG D O 1 ATOM 13615 C CB . ARG D 1 398 ? -31.548 44.948 80.515 1.00 46.43 ? 457 ARG D CB 1 ATOM 13616 C CG . ARG D 1 398 ? -32.908 44.273 80.446 1.00 47.05 ? 457 ARG D CG 1 ATOM 13617 C CD . ARG D 1 398 ? -34.033 45.288 80.310 1.00 53.63 ? 457 ARG D CD 1 ATOM 13618 N NE . ARG D 1 398 ? -33.943 46.035 79.057 1.00 61.65 ? 457 ARG D NE 1 ATOM 13619 C CZ . ARG D 1 398 ? -33.792 47.353 78.977 1.00 58.96 ? 457 ARG D CZ 1 ATOM 13620 N NH1 . ARG D 1 398 ? -33.721 48.085 80.080 1.00 56.11 ? 457 ARG D NH1 1 ATOM 13621 N NH2 . ARG D 1 398 ? -33.720 47.940 77.790 1.00 58.24 ? 457 ARG D NH2 1 ATOM 13622 N N . ARG D 1 399 ? -29.847 43.512 78.277 1.00 46.33 ? 458 ARG D N 1 ATOM 13623 C CA . ARG D 1 399 ? -29.813 42.741 77.041 1.00 57.67 ? 458 ARG D CA 1 ATOM 13624 C C . ARG D 1 399 ? -28.807 41.598 77.113 1.00 58.53 ? 458 ARG D C 1 ATOM 13625 O O . ARG D 1 399 ? -29.042 40.518 76.570 1.00 57.83 ? 458 ARG D O 1 ATOM 13626 C CB . ARG D 1 399 ? -29.484 43.653 75.858 1.00 48.53 ? 458 ARG D CB 1 ATOM 13627 C CG . ARG D 1 399 ? -30.601 44.616 75.497 1.00 56.33 ? 458 ARG D CG 1 ATOM 13628 C CD . ARG D 1 399 ? -30.093 45.750 74.625 1.00 50.42 ? 458 ARG D CD 1 ATOM 13629 N NE . ARG D 1 399 ? -31.027 46.873 74.601 1.00 50.28 ? 458 ARG D NE 1 ATOM 13630 C CZ . ARG D 1 399 ? -30.740 48.071 74.104 1.00 45.41 ? 458 ARG D CZ 1 ATOM 13631 N NH1 . ARG D 1 399 ? -29.542 48.308 73.589 1.00 48.04 ? 458 ARG D NH1 1 ATOM 13632 N NH2 . ARG D 1 399 ? -31.651 49.034 74.124 1.00 45.42 ? 458 ARG D NH2 1 ATOM 13633 N N . LEU D 1 400 ? -27.688 41.846 77.788 1.00 48.49 ? 459 LEU D N 1 ATOM 13634 C CA . LEU D 1 400 ? -26.651 40.838 77.975 1.00 55.35 ? 459 LEU D CA 1 ATOM 13635 C C . LEU D 1 400 ? -27.191 39.610 78.703 1.00 69.87 ? 459 LEU D C 1 ATOM 13636 O O . LEU D 1 400 ? -26.937 38.476 78.297 1.00 46.78 ? 459 LEU D O 1 ATOM 13637 C CB . LEU D 1 400 ? -25.468 41.430 78.744 1.00 51.31 ? 459 LEU D CB 1 ATOM 13638 C CG . LEU D 1 400 ? -24.301 40.495 79.063 1.00 53.75 ? 459 LEU D CG 1 ATOM 13639 C CD1 . LEU D 1 400 ? -23.658 39.980 77.784 1.00 45.36 ? 459 LEU D CD1 1 ATOM 13640 C CD2 . LEU D 1 400 ? -23.275 41.201 79.935 1.00 44.90 ? 459 LEU D CD2 1 ATOM 13641 N N . ALA D 1 401 ? -27.936 39.847 79.779 1.00 66.95 ? 460 ALA D N 1 ATOM 13642 C CA . ALA D 1 401 ? -28.546 38.772 80.555 1.00 56.05 ? 460 ALA D CA 1 ATOM 13643 C C . ALA D 1 401 ? -29.498 37.935 79.703 1.00 65.98 ? 460 ALA D C 1 ATOM 13644 O O . ALA D 1 401 ? -29.535 36.709 79.819 1.00 64.96 ? 460 ALA D O 1 ATOM 13645 C CB . ALA D 1 401 ? -29.278 39.342 81.760 1.00 51.42 ? 460 ALA D CB 1 ATOM 13646 N N . LYS D 1 402 ? -30.270 38.604 78.852 1.00 60.55 ? 461 LYS D N 1 ATOM 13647 C CA . LYS D 1 402 ? -31.204 37.922 77.963 1.00 59.54 ? 461 LYS D CA 1 ATOM 13648 C C . LYS D 1 402 ? -30.475 37.064 76.933 1.00 57.11 ? 461 LYS D C 1 ATOM 13649 O O . LYS D 1 402 ? -30.951 35.992 76.558 1.00 63.30 ? 461 LYS D O 1 ATOM 13650 C CB . LYS D 1 402 ? -32.106 38.934 77.254 1.00 48.35 ? 461 LYS D CB 1 ATOM 13651 C CG . LYS D 1 402 ? -33.035 39.699 78.182 1.00 54.05 ? 461 LYS D CG 1 ATOM 13652 C CD . LYS D 1 402 ? -33.860 40.720 77.415 1.00 56.03 ? 461 LYS D CD 1 ATOM 13653 C CE . LYS D 1 402 ? -35.022 41.231 78.250 1.00 61.49 ? 461 LYS D CE 1 ATOM 13654 N NZ . LYS D 1 402 ? -35.902 42.147 77.473 1.00 64.82 ? 461 LYS D NZ 1 ATOM 13655 N N . ILE D 1 403 ? -29.324 37.547 76.474 1.00 55.14 ? 462 ILE D N 1 ATOM 13656 C CA . ILE D 1 403 ? -28.508 36.804 75.520 1.00 52.14 ? 462 ILE D CA 1 ATOM 13657 C C . ILE D 1 403 ? -28.035 35.485 76.131 1.00 64.39 ? 462 ILE D C 1 ATOM 13658 O O . ILE D 1 403 ? -28.068 34.441 75.477 1.00 64.05 ? 462 ILE D O 1 ATOM 13659 C CB . ILE D 1 403 ? -27.291 37.630 75.055 1.00 47.16 ? 462 ILE D CB 1 ATOM 13660 C CG1 . ILE D 1 403 ? -27.745 38.791 74.168 1.00 47.01 ? 462 ILE D CG1 1 ATOM 13661 C CG2 . ILE D 1 403 ? -26.296 36.757 74.305 1.00 47.08 ? 462 ILE D CG2 1 ATOM 13662 C CD1 . ILE D 1 403 ? -26.718 39.891 74.036 1.00 50.14 ? 462 ILE D CD1 1 HETATM 13663 N N . MSE D 1 404 ? -27.611 35.543 77.391 1.00 74.22 ? 463 MSE D N 1 HETATM 13664 C CA . MSE D 1 404 ? -27.157 34.359 78.117 1.00 78.02 ? 463 MSE D CA 1 HETATM 13665 C C . MSE D 1 404 ? -28.248 33.298 78.194 1.00 75.37 ? 463 MSE D C 1 HETATM 13666 O O . MSE D 1 404 ? -27.989 32.110 77.995 1.00 67.48 ? 463 MSE D O 1 HETATM 13667 C CB . MSE D 1 404 ? -26.708 34.734 79.532 1.00 62.63 ? 463 MSE D CB 1 HETATM 13668 C CG . MSE D 1 404 ? -25.634 35.811 79.608 1.00 52.00 ? 463 MSE D CG 1 HETATM 13669 SE SE . MSE D 1 404 ? -23.895 35.248 78.927 1.00 121.76 ? 463 MSE D SE 1 HETATM 13670 C CE . MSE D 1 404 ? -24.113 35.757 77.060 1.00 55.05 ? 463 MSE D CE 1 ATOM 13671 N N . SER D 1 405 ? -29.466 33.741 78.486 1.00 49.80 ? 464 SER D N 1 ATOM 13672 C CA . SER D 1 405 ? -30.608 32.846 78.630 1.00 58.84 ? 464 SER D CA 1 ATOM 13673 C C . SER D 1 405 ? -30.886 32.072 77.347 1.00 66.10 ? 464 SER D C 1 ATOM 13674 O O . SER D 1 405 ? -31.205 30.885 77.387 1.00 71.00 ? 464 SER D O 1 ATOM 13675 C CB . SER D 1 405 ? -31.852 33.636 79.043 1.00 49.93 ? 464 SER D CB 1 ATOM 13676 O OG . SER D 1 405 ? -31.599 34.416 80.198 1.00 73.70 ? 464 SER D OG 1 ATOM 13677 N N . HIS D 1 406 ? -30.760 32.751 76.212 1.00 63.96 ? 465 HIS D N 1 ATOM 13678 C CA . HIS D 1 406 ? -30.966 32.116 74.916 1.00 61.11 ? 465 HIS D CA 1 ATOM 13679 C C . HIS D 1 406 ? -29.878 31.085 74.639 1.00 64.38 ? 465 HIS D C 1 ATOM 13680 O O . HIS D 1 406 ? -30.127 30.050 74.020 1.00 56.60 ? 465 HIS D O 1 ATOM 13681 C CB . HIS D 1 406 ? -30.982 33.168 73.808 1.00 49.63 ? 465 HIS D CB 1 ATOM 13682 C CG . HIS D 1 406 ? -32.068 34.186 73.960 1.00 56.60 ? 465 HIS D CG 1 ATOM 13683 N ND1 . HIS D 1 406 ? -33.298 33.888 74.506 1.00 62.42 ? 465 HIS D ND1 1 ATOM 13684 C CD2 . HIS D 1 406 ? -32.103 35.502 73.648 1.00 63.59 ? 465 HIS D CD2 1 ATOM 13685 C CE1 . HIS D 1 406 ? -34.047 34.977 74.517 1.00 64.60 ? 465 HIS D CE1 1 ATOM 13686 N NE2 . HIS D 1 406 ? -33.345 35.970 74.002 1.00 77.21 ? 465 HIS D NE2 1 ATOM 13687 N N . ILE D 1 407 ? -28.670 31.382 75.108 1.00 53.57 ? 466 ILE D N 1 ATOM 13688 C CA . ILE D 1 407 ? -27.532 30.484 74.949 1.00 55.40 ? 466 ILE D CA 1 ATOM 13689 C C . ILE D 1 407 ? -27.672 29.247 75.833 1.00 71.53 ? 466 ILE D C 1 ATOM 13690 O O . ILE D 1 407 ? -27.399 28.127 75.397 1.00 58.00 ? 466 ILE D O 1 ATOM 13691 C CB . ILE D 1 407 ? -26.212 31.208 75.269 1.00 48.52 ? 466 ILE D CB 1 ATOM 13692 C CG1 . ILE D 1 407 ? -25.956 32.310 74.240 1.00 48.15 ? 466 ILE D CG1 1 ATOM 13693 C CG2 . ILE D 1 407 ? -25.050 30.228 75.299 1.00 54.34 ? 466 ILE D CG2 1 ATOM 13694 C CD1 . ILE D 1 407 ? -24.794 33.211 74.583 1.00 51.28 ? 466 ILE D CD1 1 ATOM 13695 N N . LEU D 1 408 ? -28.101 29.456 77.075 1.00 67.45 ? 467 LEU D N 1 ATOM 13696 C CA . LEU D 1 408 ? -28.335 28.353 78.002 1.00 59.15 ? 467 LEU D CA 1 ATOM 13697 C C . LEU D 1 408 ? -29.396 27.401 77.455 1.00 66.64 ? 467 LEU D C 1 ATOM 13698 O O . LEU D 1 408 ? -29.305 26.187 77.635 1.00 70.05 ? 467 LEU D O 1 ATOM 13699 C CB . LEU D 1 408 ? -28.750 28.881 79.377 1.00 61.47 ? 467 LEU D CB 1 ATOM 13700 C CG . LEU D 1 408 ? -29.018 27.822 80.449 1.00 61.43 ? 467 LEU D CG 1 ATOM 13701 C CD1 . LEU D 1 408 ? -27.804 26.919 80.619 1.00 52.56 ? 467 LEU D CD1 1 ATOM 13702 C CD2 . LEU D 1 408 ? -29.392 28.477 81.769 1.00 55.66 ? 467 LEU D CD2 1 ATOM 13703 N N . GLU D 1 409 ? -30.400 27.960 76.787 1.00 64.39 ? 468 GLU D N 1 ATOM 13704 C CA . GLU D 1 409 ? -31.446 27.153 76.168 1.00 65.92 ? 468 GLU D CA 1 ATOM 13705 C C . GLU D 1 409 ? -30.854 26.351 75.017 1.00 65.24 ? 468 GLU D C 1 ATOM 13706 O O . GLU D 1 409 ? -31.236 25.205 74.785 1.00 72.83 ? 468 GLU D O 1 ATOM 13707 C CB . GLU D 1 409 ? -32.602 28.028 75.681 1.00 65.52 ? 468 GLU D CB 1 ATOM 13708 C CG . GLU D 1 409 ? -33.395 28.680 76.800 1.00 71.14 ? 468 GLU D CG 1 ATOM 13709 C CD . GLU D 1 409 ? -34.380 29.713 76.292 1.00 100.63 ? 468 GLU D CD 1 ATOM 13710 O OE1 . GLU D 1 409 ? -34.366 30.003 75.077 1.00 114.10 ? 468 GLU D OE1 1 ATOM 13711 O OE2 . GLU D 1 409 ? -35.170 30.234 77.107 1.00 103.82 ? 468 GLU D OE2 1 ATOM 13712 N N . CYS D 1 410 ? -29.920 26.966 74.298 1.00 57.50 ? 469 CYS D N 1 ATOM 13713 C CA . CYS D 1 410 ? -29.203 26.281 73.231 1.00 65.04 ? 469 CYS D CA 1 ATOM 13714 C C . CYS D 1 410 ? -28.373 25.149 73.826 1.00 71.40 ? 469 CYS D C 1 ATOM 13715 O O . CYS D 1 410 ? -28.240 24.083 73.225 1.00 75.59 ? 469 CYS D O 1 ATOM 13716 C CB . CYS D 1 410 ? -28.312 27.253 72.454 1.00 57.05 ? 469 CYS D CB 1 ATOM 13717 S SG . CYS D 1 410 ? -29.200 28.331 71.302 1.00 76.91 ? 469 CYS D SG 1 ATOM 13718 N N . PHE D 1 411 ? -27.816 25.391 75.011 1.00 74.87 ? 470 PHE D N 1 ATOM 13719 C CA . PHE D 1 411 ? -27.044 24.374 75.719 1.00 69.51 ? 470 PHE D CA 1 ATOM 13720 C C . PHE D 1 411 ? -27.927 23.195 76.116 1.00 71.06 ? 470 PHE D C 1 ATOM 13721 O O . PHE D 1 411 ? -27.515 22.040 76.023 1.00 74.18 ? 470 PHE D O 1 ATOM 13722 C CB . PHE D 1 411 ? -26.384 24.957 76.974 1.00 63.86 ? 470 PHE D CB 1 ATOM 13723 C CG . PHE D 1 411 ? -25.200 25.843 76.698 1.00 59.61 ? 470 PHE D CG 1 ATOM 13724 C CD1 . PHE D 1 411 ? -24.723 26.017 75.411 1.00 55.44 ? 470 PHE D CD1 1 ATOM 13725 C CD2 . PHE D 1 411 ? -24.551 26.488 77.739 1.00 55.24 ? 470 PHE D CD2 1 ATOM 13726 C CE1 . PHE D 1 411 ? -23.630 26.832 75.167 1.00 63.90 ? 470 PHE D CE1 1 ATOM 13727 C CE2 . PHE D 1 411 ? -23.458 27.298 77.499 1.00 64.81 ? 470 PHE D CE2 1 ATOM 13728 C CZ . PHE D 1 411 ? -22.997 27.469 76.213 1.00 68.06 ? 470 PHE D CZ 1 ATOM 13729 N N . GLU D 1 412 ? -29.143 23.492 76.561 1.00 58.94 ? 471 GLU D N 1 ATOM 13730 C CA . GLU D 1 412 ? -30.053 22.457 77.037 1.00 55.43 ? 471 GLU D CA 1 ATOM 13731 C C . GLU D 1 412 ? -30.730 21.722 75.885 1.00 59.12 ? 471 GLU D C 1 ATOM 13732 O O . GLU D 1 412 ? -31.038 20.535 75.991 1.00 74.78 ? 471 GLU D O 1 ATOM 13733 C CB . GLU D 1 412 ? -31.112 23.064 77.961 1.00 52.46 ? 471 GLU D CB 1 ATOM 13734 C CG . GLU D 1 412 ? -30.562 23.582 79.279 1.00 52.10 ? 471 GLU D CG 1 ATOM 13735 C CD . GLU D 1 412 ? -31.629 24.227 80.141 1.00 72.38 ? 471 GLU D CD 1 ATOM 13736 O OE1 . GLU D 1 412 ? -32.697 24.582 79.600 1.00 79.91 ? 471 GLU D OE1 1 ATOM 13737 O OE2 . GLU D 1 412 ? -31.400 24.377 81.360 1.00 69.67 ? 471 GLU D OE2 1 ATOM 13738 N N . SER D 1 413 ? -30.959 22.433 74.787 1.00 62.31 ? 472 SER D N 1 ATOM 13739 C CA . SER D 1 413 ? -31.631 21.856 73.629 1.00 63.48 ? 472 SER D CA 1 ATOM 13740 C C . SER D 1 413 ? -30.673 21.126 72.694 1.00 62.10 ? 472 SER D C 1 ATOM 13741 O O . SER D 1 413 ? -30.968 20.025 72.228 1.00 88.03 ? 472 SER D O 1 ATOM 13742 C CB . SER D 1 413 ? -32.377 22.942 72.851 1.00 63.54 ? 472 SER D CB 1 ATOM 13743 O OG . SER D 1 413 ? -33.045 22.394 71.728 1.00 84.20 ? 472 SER D OG 1 ATOM 13744 N N . ARG D 1 414 ? -29.526 21.739 72.423 1.00 62.22 ? 473 ARG D N 1 ATOM 13745 C CA . ARG D 1 414 ? -28.586 21.187 71.453 1.00 62.86 ? 473 ARG D CA 1 ATOM 13746 C C . ARG D 1 414 ? -27.317 20.600 72.069 1.00 68.38 ? 473 ARG D C 1 ATOM 13747 O O . ARG D 1 414 ? -26.615 19.832 71.421 1.00 66.42 ? 473 ARG D O 1 ATOM 13748 C CB . ARG D 1 414 ? -28.206 22.266 70.435 1.00 68.48 ? 473 ARG D CB 1 ATOM 13749 C CG . ARG D 1 414 ? -28.632 21.953 69.009 1.00 70.82 ? 473 ARG D CG 1 ATOM 13750 C CD . ARG D 1 414 ? -30.095 21.537 68.944 1.00 64.11 ? 473 ARG D CD 1 ATOM 13751 N NE . ARG D 1 414 ? -30.988 22.570 69.462 1.00 84.57 ? 473 ARG D NE 1 ATOM 13752 C CZ . ARG D 1 414 ? -31.528 23.532 68.721 1.00 99.58 ? 473 ARG D CZ 1 ATOM 13753 N NH1 . ARG D 1 414 ? -31.263 23.600 67.424 1.00 104.84 ? 473 ARG D NH1 1 ATOM 13754 N NH2 . ARG D 1 414 ? -32.331 24.429 69.277 1.00 97.29 ? 473 ARG D NH2 1 ATOM 13755 N N . GLY D 1 415 ? -27.013 20.949 73.313 1.00 64.36 ? 474 GLY D N 1 ATOM 13756 C CA . GLY D 1 415 ? -25.788 20.461 73.920 1.00 53.92 ? 474 GLY D CA 1 ATOM 13757 C C . GLY D 1 415 ? -24.590 21.327 73.584 1.00 70.26 ? 474 GLY D C 1 ATOM 13758 O O . GLY D 1 415 ? -24.539 21.949 72.523 1.00 78.98 ? 474 GLY D O 1 ATOM 13759 N N . VAL D 1 416 ? -23.617 21.353 74.489 1.00 66.02 ? 475 VAL D N 1 ATOM 13760 C CA . VAL D 1 416 ? -22.454 22.228 74.368 1.00 62.61 ? 475 VAL D CA 1 ATOM 13761 C C . VAL D 1 416 ? -21.477 21.884 73.241 1.00 61.41 ? 475 VAL D C 1 ATOM 13762 O O . VAL D 1 416 ? -20.767 22.764 72.753 1.00 57.62 ? 475 VAL D O 1 ATOM 13763 C CB . VAL D 1 416 ? -21.652 22.257 75.687 1.00 71.51 ? 475 VAL D CB 1 ATOM 13764 C CG1 . VAL D 1 416 ? -22.359 23.117 76.722 1.00 74.56 ? 475 VAL D CG1 1 ATOM 13765 C CG2 . VAL D 1 416 ? -21.426 20.845 76.207 1.00 69.32 ? 475 VAL D CG2 1 ATOM 13766 N N . ALA D 1 417 ? -21.426 20.620 72.832 1.00 65.21 ? 476 ALA D N 1 ATOM 13767 C CA . ALA D 1 417 ? -20.431 20.205 71.844 1.00 62.70 ? 476 ALA D CA 1 ATOM 13768 C C . ALA D 1 417 ? -20.733 20.615 70.399 1.00 56.23 ? 476 ALA D C 1 ATOM 13769 O O . ALA D 1 417 ? -19.825 20.644 69.568 1.00 67.66 ? 476 ALA D O 1 ATOM 13770 C CB . ALA D 1 417 ? -20.248 18.694 71.914 1.00 61.80 ? 476 ALA D CB 1 ATOM 13771 N N . GLU D 1 418 ? -21.987 20.928 70.087 1.00 61.78 ? 477 GLU D N 1 ATOM 13772 C CA . GLU D 1 418 ? -22.314 21.363 68.729 1.00 73.51 ? 477 GLU D CA 1 ATOM 13773 C C . GLU D 1 418 ? -22.616 22.858 68.651 1.00 71.38 ? 477 GLU D C 1 ATOM 13774 O O . GLU D 1 418 ? -22.621 23.436 67.564 1.00 74.99 ? 477 GLU D O 1 ATOM 13775 C CB . GLU D 1 418 ? -23.470 20.552 68.134 1.00 55.16 ? 477 GLU D CB 1 ATOM 13776 C CG . GLU D 1 418 ? -24.585 20.145 69.065 1.00 73.63 ? 477 GLU D CG 1 ATOM 13777 C CD . GLU D 1 418 ? -25.570 19.229 68.358 1.00 99.54 ? 477 GLU D CD 1 ATOM 13778 O OE1 . GLU D 1 418 ? -25.346 18.944 67.163 1.00 107.46 ? 477 GLU D OE1 1 ATOM 13779 O OE2 . GLU D 1 418 ? -26.559 18.791 68.980 1.00 93.87 ? 477 GLU D OE2 1 ATOM 13780 N N . VAL D 1 419 ? -22.867 23.483 69.797 1.00 62.82 ? 478 VAL D N 1 ATOM 13781 C CA . VAL D 1 419 ? -23.126 24.918 69.819 1.00 66.31 ? 478 VAL D CA 1 ATOM 13782 C C . VAL D 1 419 ? -21.806 25.704 69.806 1.00 71.97 ? 478 VAL D C 1 ATOM 13783 O O . VAL D 1 419 ? -21.615 26.577 68.959 1.00 72.07 ? 478 VAL D O 1 ATOM 13784 C CB . VAL D 1 419 ? -24.003 25.327 71.039 1.00 49.34 ? 478 VAL D CB 1 ATOM 13785 C CG1 . VAL D 1 419 ? -25.370 24.673 70.952 1.00 62.78 ? 478 VAL D CG1 1 ATOM 13786 C CG2 . VAL D 1 419 ? -23.357 24.946 72.350 1.00 51.09 ? 478 VAL D CG2 1 ATOM 13787 N N . LEU D 1 420 ? -20.902 25.405 70.737 1.00 59.19 ? 479 LEU D N 1 ATOM 13788 C CA . LEU D 1 420 ? -19.633 26.115 70.829 1.00 53.47 ? 479 LEU D CA 1 ATOM 13789 C C . LEU D 1 420 ? -18.619 25.509 69.864 1.00 59.80 ? 479 LEU D C 1 ATOM 13790 O O . LEU D 1 420 ? -17.742 24.744 70.268 1.00 73.41 ? 479 LEU D O 1 ATOM 13791 C CB . LEU D 1 420 ? -19.098 26.077 72.262 1.00 47.44 ? 479 LEU D CB 1 ATOM 13792 C CG . LEU D 1 420 ? -19.993 26.714 73.327 1.00 63.12 ? 479 LEU D CG 1 ATOM 13793 C CD1 . LEU D 1 420 ? -19.396 26.525 74.712 1.00 58.47 ? 479 LEU D CD1 1 ATOM 13794 C CD2 . LEU D 1 420 ? -20.215 28.190 73.030 1.00 65.88 ? 479 LEU D CD2 1 ATOM 13795 N N . VAL D 1 421 ? -18.745 25.857 68.588 1.00 63.74 ? 480 VAL D N 1 ATOM 13796 C CA . VAL D 1 421 ? -17.857 25.334 67.557 1.00 54.31 ? 480 VAL D CA 1 ATOM 13797 C C . VAL D 1 421 ? -17.142 26.472 66.819 1.00 65.73 ? 480 VAL D C 1 ATOM 13798 O O . VAL D 1 421 ? -17.694 27.561 66.654 1.00 72.90 ? 480 VAL D O 1 ATOM 13799 C CB . VAL D 1 421 ? -18.632 24.439 66.562 1.00 55.45 ? 480 VAL D CB 1 ATOM 13800 C CG1 . VAL D 1 421 ? -19.536 25.274 65.660 1.00 59.26 ? 480 VAL D CG1 1 ATOM 13801 C CG2 . VAL D 1 421 ? -17.671 23.587 65.750 1.00 65.29 ? 480 VAL D CG2 1 ATOM 13802 N N . ALA D 1 422 ? -15.903 26.220 66.404 1.00 61.89 ? 481 ALA D N 1 ATOM 13803 C CA . ALA D 1 422 ? -15.081 27.239 65.754 1.00 52.93 ? 481 ALA D CA 1 ATOM 13804 C C . ALA D 1 422 ? -15.350 27.359 64.259 1.00 63.68 ? 481 ALA D C 1 ATOM 13805 O O . ALA D 1 422 ? -15.096 28.400 63.652 1.00 75.16 ? 481 ALA D O 1 ATOM 13806 C CB . ALA D 1 422 ? -13.610 26.939 65.988 1.00 45.68 ? 481 ALA D CB 1 ATOM 13807 N N . GLU D 1 423 ? -15.872 26.293 63.670 1.00 66.64 ? 482 GLU D N 1 ATOM 13808 C CA . GLU D 1 423 ? -16.279 26.324 62.276 1.00 66.60 ? 482 GLU D CA 1 ATOM 13809 C C . GLU D 1 423 ? -17.569 25.526 62.129 1.00 61.48 ? 482 GLU D C 1 ATOM 13810 O O . GLU D 1 423 ? -17.750 24.520 62.808 1.00 68.00 ? 482 GLU D O 1 ATOM 13811 C CB . GLU D 1 423 ? -15.171 25.766 61.379 1.00 73.63 ? 482 GLU D CB 1 ATOM 13812 C CG . GLU D 1 423 ? -15.429 26.004 59.911 1.00 93.42 ? 482 GLU D CG 1 ATOM 13813 C CD . GLU D 1 423 ? -14.590 25.134 59.001 1.00 94.77 ? 482 GLU D CD 1 ATOM 13814 O OE1 . GLU D 1 423 ? -13.527 24.637 59.433 1.00 91.89 ? 482 GLU D OE1 1 ATOM 13815 O OE2 . GLU D 1 423 ? -15.023 24.921 57.851 1.00 96.09 ? 482 GLU D OE2 1 ATOM 13816 N N . TYR D 1 424 ? -18.461 25.951 61.241 1.00 68.03 ? 483 TYR D N 1 ATOM 13817 C CA . TYR D 1 424 ? -19.727 25.239 61.086 1.00 62.77 ? 483 TYR D CA 1 ATOM 13818 C C . TYR D 1 424 ? -19.695 24.257 59.921 1.00 64.68 ? 483 TYR D C 1 ATOM 13819 O O . TYR D 1 424 ? -19.244 24.589 58.826 1.00 63.91 ? 483 TYR D O 1 ATOM 13820 C CB . TYR D 1 424 ? -20.892 26.216 60.899 1.00 50.91 ? 483 TYR D CB 1 ATOM 13821 C CG . TYR D 1 424 ? -22.211 25.508 60.672 1.00 55.75 ? 483 TYR D CG 1 ATOM 13822 C CD1 . TYR D 1 424 ? -22.856 24.859 61.718 1.00 49.16 ? 483 TYR D CD1 1 ATOM 13823 C CD2 . TYR D 1 424 ? -22.797 25.465 59.413 1.00 49.01 ? 483 TYR D CD2 1 ATOM 13824 C CE1 . TYR D 1 424 ? -24.053 24.198 61.520 1.00 49.75 ? 483 TYR D CE1 1 ATOM 13825 C CE2 . TYR D 1 424 ? -23.997 24.804 59.206 1.00 49.61 ? 483 TYR D CE2 1 ATOM 13826 C CZ . TYR D 1 424 ? -24.620 24.174 60.264 1.00 58.61 ? 483 TYR D CZ 1 ATOM 13827 O OH . TYR D 1 424 ? -25.812 23.514 60.068 1.00 67.37 ? 483 TYR D OH 1 ATOM 13828 N N . ASN D 1 425 ? -20.183 23.044 60.165 1.00 67.89 ? 484 ASN D N 1 ATOM 13829 C CA . ASN D 1 425 ? -20.231 22.022 59.126 1.00 74.34 ? 484 ASN D CA 1 ATOM 13830 C C . ASN D 1 425 ? -21.603 21.352 59.048 1.00 75.15 ? 484 ASN D C 1 ATOM 13831 O O . ASN D 1 425 ? -22.084 20.789 60.029 1.00 58.30 ? 484 ASN D O 1 ATOM 13832 C CB . ASN D 1 425 ? -19.145 20.963 59.364 1.00 53.66 ? 484 ASN D CB 1 ATOM 13833 C CG . ASN D 1 425 ? -18.081 21.416 60.356 1.00 59.68 ? 484 ASN D CG 1 ATOM 13834 O OD1 . ASN D 1 425 ? -18.029 20.939 61.492 1.00 76.80 ? 484 ASN D OD1 1 ATOM 13835 N ND2 . ASN D 1 425 ? -17.232 22.346 59.932 1.00 63.05 ? 484 ASN D ND2 1 ATOM 13836 N N . ASN D 1 426 ? -22.234 21.424 57.878 1.00 80.96 ? 485 ASN D N 1 ATOM 13837 C CA . ASN D 1 426 ? -23.558 20.838 57.681 1.00 68.16 ? 485 ASN D CA 1 ATOM 13838 C C . ASN D 1 426 ? -23.487 19.442 57.066 1.00 83.24 ? 485 ASN D C 1 ATOM 13839 O O . ASN D 1 426 ? -23.030 19.285 55.933 1.00 84.52 ? 485 ASN D O 1 ATOM 13840 C CB . ASN D 1 426 ? -24.424 21.767 56.822 1.00 61.65 ? 485 ASN D CB 1 ATOM 13841 C CG . ASN D 1 426 ? -25.867 21.300 56.717 1.00 76.51 ? 485 ASN D CG 1 ATOM 13842 O OD1 . ASN D 1 426 ? -26.172 20.313 56.047 1.00 83.84 ? 485 ASN D OD1 1 ATOM 13843 N ND2 . ASN D 1 426 ? -26.756 21.983 57.431 1.00 70.43 ? 485 ASN D ND2 1 ATOM 13844 N N . PRO D 1 427 ? -23.905 18.418 57.831 1.00 89.14 ? 486 PRO D N 1 ATOM 13845 C CA . PRO D 1 427 ? -23.930 17.041 57.323 1.00 91.15 ? 486 PRO D CA 1 ATOM 13846 C C . PRO D 1 427 ? -24.640 16.924 55.974 1.00 84.42 ? 486 PRO D C 1 ATOM 13847 O O . PRO D 1 427 ? -25.862 17.061 55.912 1.00 68.93 ? 486 PRO D O 1 ATOM 13848 C CB . PRO D 1 427 ? -24.702 16.272 58.401 1.00 84.16 ? 486 PRO D CB 1 ATOM 13849 C CG . PRO D 1 427 ? -24.673 17.127 59.628 1.00 80.49 ? 486 PRO D CG 1 ATOM 13850 C CD . PRO D 1 427 ? -24.119 18.479 59.288 1.00 79.01 ? 486 PRO D CD 1 HETATM 13851 C C1 . NAG E 2 . ? 5.182 95.143 65.193 1.00 29.87 ? 601 NAG A C1 1 HETATM 13852 C C2 . NAG E 2 . ? 5.854 95.125 66.566 1.00 57.79 ? 601 NAG A C2 1 HETATM 13853 C C3 . NAG E 2 . ? 5.564 93.806 67.284 1.00 40.41 ? 601 NAG A C3 1 HETATM 13854 C C4 . NAG E 2 . ? 4.067 93.524 67.304 1.00 40.31 ? 601 NAG A C4 1 HETATM 13855 C C5 . NAG E 2 . ? 3.473 93.634 65.901 1.00 57.53 ? 601 NAG A C5 1 HETATM 13856 C C6 . NAG E 2 . ? 1.966 93.511 65.883 1.00 50.44 ? 601 NAG A C6 1 HETATM 13857 C C7 . NAG E 2 . ? 8.144 94.606 65.770 1.00 102.69 ? 601 NAG A C7 1 HETATM 13858 C C8 . NAG E 2 . ? 9.576 95.050 65.794 1.00 107.32 ? 601 NAG A C8 1 HETATM 13859 N N2 . NAG E 2 . ? 7.286 95.367 66.467 1.00 77.78 ? 601 NAG A N2 1 HETATM 13860 O O3 . NAG E 2 . ? 6.044 93.887 68.622 1.00 58.45 ? 601 NAG A O3 1 HETATM 13861 O O4 . NAG E 2 . ? 3.737 92.454 68.115 1.00 55.88 ? 601 NAG A O4 1 HETATM 13862 O O5 . NAG E 2 . ? 3.787 94.917 65.339 1.00 46.89 ? 601 NAG A O5 1 HETATM 13863 O O6 . NAG E 2 . ? 1.421 93.482 67.196 1.00 52.67 ? 601 NAG A O6 1 HETATM 13864 O O7 . NAG E 2 . ? 7.786 93.605 65.157 1.00 100.69 ? 601 NAG A O7 1 HETATM 13865 C C1 . NAG F 2 . ? 3.399 92.260 69.451 1.00 58.49 ? 602 NAG A C1 1 HETATM 13866 C C2 . NAG F 2 . ? 3.106 90.781 69.665 1.00 45.16 ? 602 NAG A C2 1 HETATM 13867 C C3 . NAG F 2 . ? 2.805 90.512 71.137 1.00 38.46 ? 602 NAG A C3 1 HETATM 13868 C C4 . NAG F 2 . ? 3.922 91.055 72.018 1.00 53.11 ? 602 NAG A C4 1 HETATM 13869 C C5 . NAG F 2 . ? 4.179 92.525 71.695 1.00 52.23 ? 602 NAG A C5 1 HETATM 13870 C C6 . NAG F 2 . ? 5.354 93.101 72.450 1.00 49.99 ? 602 NAG A C6 1 HETATM 13871 C C7 . NAG F 2 . ? 2.120 89.366 67.921 1.00 65.18 ? 602 NAG A C7 1 HETATM 13872 C C8 . NAG F 2 . ? 0.880 89.042 67.144 1.00 47.90 ? 602 NAG A C8 1 HETATM 13873 N N2 . NAG F 2 . ? 2.005 90.341 68.829 1.00 69.20 ? 602 NAG A N2 1 HETATM 13874 O O3 . NAG F 2 . ? 2.665 89.110 71.333 1.00 57.07 ? 602 NAG A O3 1 HETATM 13875 O O4 . NAG F 2 . ? 3.560 90.936 73.389 1.00 60.18 ? 602 NAG A O4 1 HETATM 13876 O O5 . NAG F 2 . ? 4.472 92.669 70.297 1.00 56.16 ? 602 NAG A O5 1 HETATM 13877 O O6 . NAG F 2 . ? 6.483 92.240 72.397 1.00 63.23 ? 602 NAG A O6 1 HETATM 13878 O O7 . NAG F 2 . ? 3.178 88.773 67.736 1.00 54.65 ? 602 NAG A O7 1 HETATM 13879 C C1 . BMA G 3 . ? 4.001 89.893 74.203 1.00 64.72 ? 603 BMA A C1 1 HETATM 13880 C C2 . BMA G 3 . ? 4.054 90.513 75.608 1.00 70.15 ? 603 BMA A C2 1 HETATM 13881 C C3 . BMA G 3 . ? 4.501 89.460 76.625 1.00 76.09 ? 603 BMA A C3 1 HETATM 13882 C C4 . BMA G 3 . ? 3.707 88.151 76.474 1.00 72.61 ? 603 BMA A C4 1 HETATM 13883 C C5 . BMA G 3 . ? 3.771 87.662 75.018 1.00 84.08 ? 603 BMA A C5 1 HETATM 13884 C C6 . BMA G 3 . ? 2.962 86.397 74.782 1.00 100.40 ? 603 BMA A C6 1 HETATM 13885 O O2 . BMA G 3 . ? 2.767 90.954 76.012 1.00 68.43 ? 603 BMA A O2 1 HETATM 13886 O O3 . BMA G 3 . ? 4.392 89.942 77.960 1.00 60.48 ? 603 BMA A O3 1 HETATM 13887 O O4 . BMA G 3 . ? 4.245 87.158 77.331 1.00 77.97 ? 603 BMA A O4 1 HETATM 13888 O O5 . BMA G 3 . ? 3.248 88.698 74.172 1.00 72.05 ? 603 BMA A O5 1 HETATM 13889 O O6 . BMA G 3 . ? 1.637 86.617 75.254 1.00 103.46 ? 603 BMA A O6 1 HETATM 13890 C C1 . NAG H 2 . ? 16.272 53.237 68.952 1.00 40.00 ? 604 NAG A C1 1 HETATM 13891 C C2 . NAG H 2 . ? 16.533 52.753 70.369 1.00 41.75 ? 604 NAG A C2 1 HETATM 13892 C C3 . NAG H 2 . ? 16.890 51.270 70.356 1.00 43.36 ? 604 NAG A C3 1 HETATM 13893 C C4 . NAG H 2 . ? 15.814 50.472 69.629 1.00 42.24 ? 604 NAG A C4 1 HETATM 13894 C C5 . NAG H 2 . ? 15.522 51.077 68.254 1.00 49.81 ? 604 NAG A C5 1 HETATM 13895 C C6 . NAG H 2 . ? 14.328 50.447 67.575 1.00 56.85 ? 604 NAG A C6 1 HETATM 13896 C C7 . NAG H 2 . ? 17.342 54.618 71.742 1.00 52.48 ? 604 NAG A C7 1 HETATM 13897 C C8 . NAG H 2 . ? 18.544 55.305 72.318 1.00 57.37 ? 604 NAG A C8 1 HETATM 13898 N N2 . NAG H 2 . ? 17.586 53.531 71.002 1.00 51.50 ? 604 NAG A N2 1 HETATM 13899 O O3 . NAG H 2 . ? 17.022 50.806 71.694 1.00 60.14 ? 604 NAG A O3 1 HETATM 13900 O O4 . NAG H 2 . ? 16.311 49.130 69.580 1.00 82.76 ? 604 NAG A O4 1 HETATM 13901 O O5 . NAG H 2 . ? 15.224 52.476 68.377 1.00 57.57 ? 604 NAG A O5 1 HETATM 13902 O O6 . NAG H 2 . ? 14.612 50.115 66.223 1.00 74.58 ? 604 NAG A O6 1 HETATM 13903 O O7 . NAG H 2 . ? 16.202 55.029 71.938 1.00 42.93 ? 604 NAG A O7 1 HETATM 13904 C C1 . NAG I 2 . ? 15.472 48.034 69.763 1.00 103.78 ? 605 NAG A C1 1 HETATM 13905 C C2 . NAG I 2 . ? 15.793 46.940 68.750 1.00 102.61 ? 605 NAG A C2 1 HETATM 13906 C C3 . NAG I 2 . ? 14.847 45.762 68.948 1.00 106.37 ? 605 NAG A C3 1 HETATM 13907 C C4 . NAG I 2 . ? 14.902 45.280 70.392 1.00 117.89 ? 605 NAG A C4 1 HETATM 13908 C C5 . NAG I 2 . ? 14.653 46.442 71.352 1.00 118.67 ? 605 NAG A C5 1 HETATM 13909 C C6 . NAG I 2 . ? 14.835 46.056 72.801 1.00 131.06 ? 605 NAG A C6 1 HETATM 13910 C C7 . NAG I 2 . ? 16.654 47.168 66.466 1.00 86.61 ? 605 NAG A C7 1 HETATM 13911 C C8 . NAG I 2 . ? 16.418 47.744 65.102 1.00 78.46 ? 605 NAG A C8 1 HETATM 13912 N N2 . NAG I 2 . ? 15.719 47.432 67.385 1.00 96.77 ? 605 NAG A N2 1 HETATM 13913 O O3 . NAG I 2 . ? 15.202 44.708 68.061 1.00 106.76 ? 605 NAG A O3 1 HETATM 13914 O O4 . NAG I 2 . ? 13.916 44.276 70.606 1.00 113.43 ? 605 NAG A O4 1 HETATM 13915 O O5 . NAG I 2 . ? 15.577 47.510 71.088 1.00 110.07 ? 605 NAG A O5 1 HETATM 13916 O O6 . NAG I 2 . ? 14.446 44.708 73.028 1.00 143.02 ? 605 NAG A O6 1 HETATM 13917 O O7 . NAG I 2 . ? 17.648 46.496 66.725 1.00 81.89 ? 605 NAG A O7 1 HETATM 13918 NI NI . NI J 4 . ? 39.902 65.705 60.429 1.00 47.19 ? 606 NI A NI 1 HETATM 13919 C C1 . NAG K 2 . ? 2.329 20.221 59.019 1.00 61.69 ? 601 NAG B C1 1 HETATM 13920 C C2 . NAG K 2 . ? 2.652 21.012 60.289 1.00 72.48 ? 601 NAG B C2 1 HETATM 13921 C C3 . NAG K 2 . ? 2.703 20.084 61.504 1.00 69.25 ? 601 NAG B C3 1 HETATM 13922 C C4 . NAG K 2 . ? 1.436 19.242 61.595 1.00 68.39 ? 601 NAG B C4 1 HETATM 13923 C C5 . NAG K 2 . ? 1.182 18.530 60.268 1.00 82.04 ? 601 NAG B C5 1 HETATM 13924 C C6 . NAG K 2 . ? -0.121 17.765 60.248 1.00 93.67 ? 601 NAG B C6 1 HETATM 13925 C C7 . NAG K 2 . ? 5.101 21.200 59.978 1.00 72.65 ? 601 NAG B C7 1 HETATM 13926 C C8 . NAG K 2 . ? 6.253 22.154 59.869 1.00 53.45 ? 601 NAG B C8 1 HETATM 13927 N N2 . NAG K 2 . ? 3.896 21.759 60.155 1.00 87.32 ? 601 NAG B N2 1 HETATM 13928 O O3 . NAG K 2 . ? 2.853 20.869 62.681 1.00 97.78 ? 601 NAG B O3 1 HETATM 13929 O O4 . NAG K 2 . ? 1.159 18.532 62.817 1.00 74.88 ? 601 NAG B O4 1 HETATM 13930 O O5 . NAG K 2 . ? 1.114 19.492 59.205 1.00 58.91 ? 601 NAG B O5 1 HETATM 13931 O O6 . NAG K 2 . ? -0.886 18.012 61.419 1.00 78.81 ? 601 NAG B O6 1 HETATM 13932 O O7 . NAG K 2 . ? 5.259 19.984 59.906 1.00 78.03 ? 601 NAG B O7 1 HETATM 13933 C C1 . NAG L 2 . ? 1.209 18.624 64.206 1.00 64.96 ? 602 NAG B C1 1 HETATM 13934 C C2 . NAG L 2 . ? 0.936 17.259 64.833 1.00 56.80 ? 602 NAG B C2 1 HETATM 13935 C C3 . NAG L 2 . ? 1.044 17.347 66.356 1.00 69.34 ? 602 NAG B C3 1 HETATM 13936 C C4 . NAG L 2 . ? 2.379 17.965 66.755 1.00 80.95 ? 602 NAG B C4 1 HETATM 13937 C C5 . NAG L 2 . ? 2.572 19.297 66.035 1.00 69.87 ? 602 NAG B C5 1 HETATM 13938 C C6 . NAG L 2 . ? 3.918 19.929 66.296 1.00 75.11 ? 602 NAG B C6 1 HETATM 13939 C C7 . NAG L 2 . ? -0.521 15.806 63.510 1.00 83.69 ? 602 NAG B C7 1 HETATM 13940 C C8 . NAG L 2 . ? -1.933 15.411 63.198 1.00 64.61 ? 602 NAG B C8 1 HETATM 13941 N N2 . NAG L 2 . ? -0.367 16.759 64.434 1.00 78.23 ? 602 NAG B N2 1 HETATM 13942 O O3 . NAG L 2 . ? 0.919 16.047 66.922 1.00 90.72 ? 602 NAG B O3 1 HETATM 13943 O O4 . NAG L 2 . ? 2.432 18.170 68.162 1.00 95.10 ? 602 NAG B O4 1 HETATM 13944 O O5 . NAG L 2 . ? 2.481 19.095 64.617 1.00 55.33 ? 602 NAG B O5 1 HETATM 13945 O O6 . NAG L 2 . ? 4.257 19.879 67.675 1.00 101.94 ? 602 NAG B O6 1 HETATM 13946 O O7 . NAG L 2 . ? 0.438 15.283 62.953 1.00 93.90 ? 602 NAG B O7 1 HETATM 13947 C C1 . BMA M 3 . ? 2.205 17.643 69.444 1.00 109.33 ? 603 BMA B C1 1 HETATM 13948 C C2 . BMA M 3 . ? 2.308 18.601 70.642 1.00 122.81 ? 603 BMA B C2 1 HETATM 13949 C C3 . BMA M 3 . ? 2.998 17.899 71.814 1.00 126.61 ? 603 BMA B C3 1 HETATM 13950 C C4 . BMA M 3 . ? 2.379 16.518 72.089 1.00 134.17 ? 603 BMA B C4 1 HETATM 13951 C C5 . BMA M 3 . ? 2.378 15.680 70.802 1.00 123.75 ? 603 BMA B C5 1 HETATM 13952 C C6 . BMA M 3 . ? 1.741 14.312 70.986 1.00 125.05 ? 603 BMA B C6 1 HETATM 13953 O O2 . BMA M 3 . ? 1.017 18.983 71.093 1.00 135.77 ? 603 BMA B O2 1 HETATM 13954 O O3 . BMA M 3 . ? 2.962 18.693 72.995 1.00 120.36 ? 603 BMA B O3 1 HETATM 13955 O O4 . BMA M 3 . ? 3.122 15.845 73.093 1.00 136.17 ? 603 BMA B O4 1 HETATM 13956 O O5 . BMA M 3 . ? 1.635 16.396 69.800 1.00 106.34 ? 603 BMA B O5 1 HETATM 13957 O O6 . BMA M 3 . ? 0.421 14.495 71.483 1.00 113.27 ? 603 BMA B O6 1 HETATM 13958 C C1 . NAG N 2 . ? 13.695 -19.963 68.317 1.00 54.80 ? 604 NAG B C1 1 HETATM 13959 C C2 . NAG N 2 . ? 14.049 -19.775 69.791 1.00 58.40 ? 604 NAG B C2 1 HETATM 13960 C C3 . NAG N 2 . ? 14.541 -21.090 70.391 1.00 53.24 ? 604 NAG B C3 1 HETATM 13961 C C4 . NAG N 2 . ? 13.527 -22.201 70.144 1.00 71.49 ? 604 NAG B C4 1 HETATM 13962 C C5 . NAG N 2 . ? 13.201 -22.286 68.655 1.00 71.40 ? 604 NAG B C5 1 HETATM 13963 C C6 . NAG N 2 . ? 12.119 -23.294 68.342 1.00 48.06 ? 604 NAG B C6 1 HETATM 13964 C C7 . NAG N 2 . ? 14.775 -17.527 70.462 1.00 52.01 ? 604 NAG B C7 1 HETATM 13965 C C8 . NAG N 2 . ? 15.928 -16.575 70.559 1.00 49.97 ? 604 NAG B C8 1 HETATM 13966 N N2 . NAG N 2 . ? 15.052 -18.732 69.955 1.00 46.16 ? 604 NAG B N2 1 HETATM 13967 O O3 . NAG N 2 . ? 14.754 -20.924 71.788 1.00 56.92 ? 604 NAG B O3 1 HETATM 13968 O O4 . NAG N 2 . ? 13.530 -23.224 71.139 1.00 94.90 ? 604 NAG B O4 1 HETATM 13969 O O5 . NAG N 2 . ? 12.731 -21.014 68.187 1.00 45.06 ? 604 NAG B O5 1 HETATM 13970 O O6 . NAG N 2 . ? 10.985 -22.675 67.750 1.00 68.38 ? 604 NAG B O6 1 HETATM 13971 O O7 . NAG N 2 . ? 13.644 -17.218 70.824 1.00 57.60 ? 604 NAG B O7 1 HETATM 13972 C C1 . NAG O 2 . ? 12.531 -23.729 71.976 1.00 111.24 ? 605 NAG B C1 1 HETATM 13973 C C2 . NAG O 2 . ? 12.506 -25.252 71.895 1.00 90.60 ? 605 NAG B C2 1 HETATM 13974 C C3 . NAG O 2 . ? 11.436 -25.800 72.838 1.00 96.76 ? 605 NAG B C3 1 HETATM 13975 C C4 . NAG O 2 . ? 11.636 -25.265 74.248 1.00 112.71 ? 605 NAG B C4 1 HETATM 13976 C C5 . NAG O 2 . ? 11.720 -23.740 74.233 1.00 125.72 ? 605 NAG B C5 1 HETATM 13977 C C6 . NAG O 2 . ? 12.063 -23.156 75.584 1.00 116.12 ? 605 NAG B C6 1 HETATM 13978 C C7 . NAG O 2 . ? 13.003 -26.681 69.962 1.00 99.85 ? 605 NAG B C7 1 HETATM 13979 C C8 . NAG O 2 . ? 14.104 -27.269 70.796 1.00 102.01 ? 605 NAG B C8 1 HETATM 13980 N N2 . NAG O 2 . ? 12.279 -25.715 70.543 1.00 86.86 ? 605 NAG B N2 1 HETATM 13981 O O3 . NAG O 2 . ? 11.496 -27.223 72.841 1.00 92.30 ? 605 NAG B O3 1 HETATM 13982 O O4 . NAG O 2 . ? 10.548 -25.664 75.073 1.00 115.69 ? 605 NAG B O4 1 HETATM 13983 O O5 . NAG O 2 . ? 12.750 -23.310 73.325 1.00 127.94 ? 605 NAG B O5 1 HETATM 13984 O O6 . NAG O 2 . ? 10.894 -22.849 76.332 1.00 96.56 ? 605 NAG B O6 1 HETATM 13985 O O7 . NAG O 2 . ? 12.785 -27.058 68.816 1.00 103.20 ? 605 NAG B O7 1 HETATM 13986 NI NI . NI P 4 . ? 37.235 -8.901 56.970 1.00 42.41 ? 606 NI B NI 1 HETATM 13987 C C1 . NAG Q 2 . ? 5.386 42.529 21.349 1.00 49.81 ? 601 NAG C C1 1 HETATM 13988 C C2 . NAG Q 2 . ? 6.131 42.736 20.044 1.00 48.90 ? 601 NAG C C2 1 HETATM 13989 C C3 . NAG Q 2 . ? 5.702 44.050 19.397 1.00 66.14 ? 601 NAG C C3 1 HETATM 13990 C C4 . NAG Q 2 . ? 4.181 44.128 19.298 1.00 83.86 ? 601 NAG C C4 1 HETATM 13991 C C5 . NAG Q 2 . ? 3.521 43.780 20.633 1.00 85.18 ? 601 NAG C C5 1 HETATM 13992 C C6 . NAG Q 2 . ? 2.019 43.645 20.541 1.00 75.22 ? 601 NAG C C6 1 HETATM 13993 C C7 . NAG Q 2 . ? 8.392 41.910 19.570 1.00 46.51 ? 601 NAG C C7 1 HETATM 13994 C C8 . NAG Q 2 . ? 7.750 41.054 18.520 1.00 51.57 ? 601 NAG C C8 1 HETATM 13995 N N2 . NAG Q 2 . ? 7.569 42.707 20.259 1.00 53.71 ? 601 NAG C N2 1 HETATM 13996 O O3 . NAG Q 2 . ? 6.273 44.136 18.095 1.00 73.44 ? 601 NAG C O3 1 HETATM 13997 O O4 . NAG Q 2 . ? 4.106 45.522 19.264 1.00 69.41 ? 601 NAG C O4 1 HETATM 13998 O O5 . NAG Q 2 . ? 4.009 42.517 21.105 1.00 93.03 ? 601 NAG C O5 1 HETATM 13999 O O6 . NAG Q 2 . ? 1.443 44.660 19.732 1.00 103.30 ? 601 NAG C O6 1 HETATM 14000 O O7 . NAG Q 2 . ? 9.601 41.886 19.778 1.00 61.06 ? 601 NAG C O7 1 HETATM 14001 C C1 . NAG R 2 . ? 3.716 45.959 17.999 1.00 57.46 ? 602 NAG C C1 1 HETATM 14002 C C2 . NAG R 2 . ? 3.244 47.393 18.126 1.00 48.61 ? 602 NAG C C2 1 HETATM 14003 C C3 . NAG R 2 . ? 2.803 47.919 16.763 1.00 60.64 ? 602 NAG C C3 1 HETATM 14004 C C4 . NAG R 2 . ? 3.905 47.717 15.732 1.00 74.63 ? 602 NAG C C4 1 HETATM 14005 C C5 . NAG R 2 . ? 4.376 46.265 15.731 1.00 77.63 ? 602 NAG C C5 1 HETATM 14006 C C6 . NAG R 2 . ? 5.566 46.030 14.830 1.00 86.97 ? 602 NAG C C6 1 HETATM 14007 C C7 . NAG R 2 . ? 2.249 48.262 20.184 1.00 64.60 ? 602 NAG C C7 1 HETATM 14008 C C8 . NAG R 2 . ? 1.060 48.235 21.093 1.00 70.42 ? 602 NAG C C8 1 HETATM 14009 N N2 . NAG R 2 . ? 2.171 47.495 19.092 1.00 51.22 ? 602 NAG C N2 1 HETATM 14010 O O3 . NAG R 2 . ? 2.495 49.303 16.884 1.00 57.14 ? 602 NAG C O3 1 HETATM 14011 O O4 . NAG R 2 . ? 3.421 48.040 14.434 1.00 90.00 ? 602 NAG C O4 1 HETATM 14012 O O5 . NAG R 2 . ? 4.776 45.878 17.055 1.00 73.88 ? 602 NAG C O5 1 HETATM 14013 O O6 . NAG R 2 . ? 5.206 46.157 13.461 1.00 98.31 ? 602 NAG C O6 1 HETATM 14014 O O7 . NAG R 2 . ? 3.234 48.953 20.420 1.00 73.95 ? 602 NAG C O7 1 HETATM 14015 C C1 . BMA S 3 . ? 3.255 48.884 13.352 1.00 97.84 ? 603 BMA C C1 1 HETATM 14016 C C2 . BMA S 3 . ? 3.609 48.669 11.868 1.00 91.53 ? 603 BMA C C2 1 HETATM 14017 C C3 . BMA S 3 . ? 3.843 50.017 11.178 1.00 76.44 ? 603 BMA C C3 1 HETATM 14018 C C4 . BMA S 3 . ? 2.727 51.021 11.507 1.00 92.46 ? 603 BMA C C4 1 HETATM 14019 C C5 . BMA S 3 . ? 2.585 51.147 13.028 1.00 86.32 ? 603 BMA C C5 1 HETATM 14020 C C6 . BMA S 3 . ? 1.503 52.127 13.446 1.00 73.24 ? 603 BMA C C6 1 HETATM 14021 O O2 . BMA S 3 . ? 2.542 48.032 11.180 1.00 80.82 ? 603 BMA C O2 1 HETATM 14022 O O3 . BMA S 3 . ? 3.967 49.869 9.769 1.00 68.47 ? 603 BMA C O3 1 HETATM 14023 O O4 . BMA S 3 . ? 3.032 52.289 10.951 1.00 92.24 ? 603 BMA C O4 1 HETATM 14024 O O5 . BMA S 3 . ? 2.244 49.853 13.541 1.00 80.06 ? 603 BMA C O5 1 HETATM 14025 O O6 . BMA S 3 . ? 1.835 52.635 14.733 1.00 60.94 ? 603 BMA C O6 1 HETATM 14026 C C1 . NAG T 2 . ? 17.156 83.552 27.548 1.00 56.15 ? 604 NAG C C1 1 HETATM 14027 C C2 . NAG T 2 . ? 16.969 84.200 26.179 1.00 42.33 ? 604 NAG C C2 1 HETATM 14028 C C3 . NAG T 2 . ? 17.106 85.716 26.290 1.00 51.84 ? 604 NAG C C3 1 HETATM 14029 C C4 . NAG T 2 . ? 16.170 86.256 27.365 1.00 52.34 ? 604 NAG C C4 1 HETATM 14030 C C5 . NAG T 2 . ? 16.387 85.508 28.678 1.00 47.66 ? 604 NAG C C5 1 HETATM 14031 C C6 . NAG T 2 . ? 15.409 85.908 29.760 1.00 40.75 ? 604 NAG C C6 1 HETATM 14032 C C7 . NAG T 2 . ? 17.570 82.913 24.175 1.00 40.78 ? 604 NAG C C7 1 HETATM 14033 C C8 . NAG T 2 . ? 18.686 82.451 23.288 1.00 53.11 ? 604 NAG C C8 1 HETATM 14034 N N2 . NAG T 2 . ? 17.926 83.669 25.218 1.00 31.96 ? 604 NAG C N2 1 HETATM 14035 O O3 . NAG T 2 . ? 16.803 86.311 25.034 1.00 54.53 ? 604 NAG C O3 1 HETATM 14036 O O4 . NAG T 2 . ? 16.508 87.602 27.571 1.00 72.73 ? 604 NAG C O4 1 HETATM 14037 O O5 . NAG T 2 . ? 16.216 84.100 28.466 1.00 46.44 ? 604 NAG C O5 1 HETATM 14038 O O6 . NAG T 2 . ? 14.068 85.849 29.296 1.00 50.57 ? 604 NAG C O6 1 HETATM 14039 O O7 . NAG T 2 . ? 16.400 82.614 23.957 1.00 45.81 ? 604 NAG C O7 1 HETATM 14040 C C1 . NAG U 2 . ? 15.487 88.524 27.348 1.00 51.22 ? 605 NAG C C1 1 HETATM 14041 C C2 . NAG U 2 . ? 15.823 89.835 28.049 1.00 52.26 ? 605 NAG C C2 1 HETATM 14042 C C3 . NAG U 2 . ? 14.728 90.865 27.778 1.00 80.70 ? 605 NAG C C3 1 HETATM 14043 C C4 . NAG U 2 . ? 14.479 91.002 26.283 1.00 88.47 ? 605 NAG C C4 1 HETATM 14044 C C5 . NAG U 2 . ? 14.219 89.632 25.661 1.00 66.08 ? 605 NAG C C5 1 HETATM 14045 C C6 . NAG U 2 . ? 14.091 89.680 24.156 1.00 62.16 ? 605 NAG C C6 1 HETATM 14046 C C7 . NAG U 2 . ? 17.200 89.594 30.066 1.00 68.89 ? 605 NAG C C7 1 HETATM 14047 C C8 . NAG U 2 . ? 17.195 89.386 31.550 1.00 71.87 ? 605 NAG C C8 1 HETATM 14048 N N2 . NAG U 2 . ? 16.000 89.640 29.475 1.00 55.19 ? 605 NAG C N2 1 HETATM 14049 O O3 . NAG U 2 . ? 15.120 92.121 28.323 1.00 74.42 ? 605 NAG C O3 1 HETATM 14050 O O4 . NAG U 2 . ? 13.354 91.842 26.051 1.00 83.98 ? 605 NAG C O4 1 HETATM 14051 O O5 . NAG U 2 . ? 15.313 88.749 25.954 1.00 71.36 ? 605 NAG C O5 1 HETATM 14052 O O6 . NAG U 2 . ? 12.993 90.489 23.757 1.00 81.44 ? 605 NAG C O6 1 HETATM 14053 O O7 . NAG U 2 . ? 18.242 89.715 29.429 1.00 64.63 ? 605 NAG C O7 1 HETATM 14054 C C1 . NAG V 2 . ? -3.557 37.375 64.414 1.00 65.64 ? 601 NAG D C1 1 HETATM 14055 C C2 . NAG V 2 . ? -3.819 37.513 65.908 1.00 77.70 ? 601 NAG D C2 1 HETATM 14056 C C3 . NAG V 2 . ? -3.564 38.951 66.349 1.00 75.65 ? 601 NAG D C3 1 HETATM 14057 C C4 . NAG V 2 . ? -2.166 39.395 65.939 1.00 57.99 ? 601 NAG D C4 1 HETATM 14058 C C5 . NAG V 2 . ? -1.962 39.164 64.442 1.00 54.28 ? 601 NAG D C5 1 HETATM 14059 C C6 . NAG V 2 . ? -0.552 39.455 63.984 1.00 66.02 ? 601 NAG D C6 1 HETATM 14060 C C7 . NAG V 2 . ? -5.461 36.306 67.280 1.00 103.38 ? 601 NAG D C7 1 HETATM 14061 C C8 . NAG V 2 . ? -4.293 35.831 68.095 1.00 95.07 ? 601 NAG D C8 1 HETATM 14062 N N2 . NAG V 2 . ? -5.170 37.106 66.247 1.00 92.50 ? 601 NAG D N2 1 HETATM 14063 O O3 . NAG V 2 . ? -3.724 39.043 67.761 1.00 75.91 ? 601 NAG D O3 1 HETATM 14064 O O4 . NAG V 2 . ? -1.407 40.373 66.655 1.00 64.09 ? 601 NAG D O4 1 HETATM 14065 O O5 . NAG V 2 . ? -2.225 37.790 64.116 1.00 68.66 ? 601 NAG D O5 1 HETATM 14066 O O6 . NAG V 2 . ? -0.136 40.756 64.375 1.00 67.15 ? 601 NAG D O6 1 HETATM 14067 O O7 . NAG V 2 . ? -6.613 35.980 67.545 1.00 103.20 ? 601 NAG D O7 1 HETATM 14068 C C1 . NAG W 2 . ? -1.120 40.744 67.966 1.00 60.91 ? 602 NAG D C1 1 HETATM 14069 C C2 . NAG W 2 . ? -0.674 42.202 68.011 1.00 46.50 ? 602 NAG D C2 1 HETATM 14070 C C3 . NAG W 2 . ? -0.436 42.634 69.456 1.00 69.02 ? 602 NAG D C3 1 HETATM 14071 C C4 . NAG W 2 . ? -1.667 42.350 70.306 1.00 70.26 ? 602 NAG D C4 1 HETATM 14072 C C5 . NAG W 2 . ? -2.084 40.889 70.163 1.00 65.10 ? 602 NAG D C5 1 HETATM 14073 C C6 . NAG W 2 . ? -3.380 40.574 70.876 1.00 52.05 ? 602 NAG D C6 1 HETATM 14074 C C7 . NAG W 2 . ? 0.518 43.136 66.079 1.00 74.01 ? 602 NAG D C7 1 HETATM 14075 C C8 . NAG W 2 . ? 1.839 43.265 65.383 1.00 70.00 ? 602 NAG D C8 1 HETATM 14076 N N2 . NAG W 2 . ? 0.518 42.420 67.210 1.00 73.12 ? 602 NAG D N2 1 HETATM 14077 O O3 . NAG W 2 . ? -0.132 44.024 69.492 1.00 77.62 ? 602 NAG D O3 1 HETATM 14078 O O4 . NAG W 2 . ? -1.385 42.624 71.674 1.00 69.29 ? 602 NAG D O4 1 HETATM 14079 O O5 . NAG W 2 . ? -2.287 40.570 68.778 1.00 53.10 ? 602 NAG D O5 1 HETATM 14080 O O6 . NAG W 2 . ? -4.392 41.519 70.557 1.00 81.72 ? 602 NAG D O6 1 HETATM 14081 O O7 . NAG W 2 . ? -0.504 43.648 65.635 1.00 69.66 ? 602 NAG D O7 1 HETATM 14082 C C1 . BMA X 3 . ? -1.220 43.194 72.940 1.00 97.90 ? 603 BMA D C1 1 HETATM 14083 C C2 . BMA X 3 . ? -1.015 42.121 74.023 1.00 126.11 ? 603 BMA D C2 1 HETATM 14084 C C3 . BMA X 3 . ? -1.549 42.624 75.368 1.00 135.97 ? 603 BMA D C3 1 HETATM 14085 C C4 . BMA X 3 . ? -1.036 44.038 75.687 1.00 138.08 ? 603 BMA D C4 1 HETATM 14086 C C5 . BMA X 3 . ? -1.353 44.983 74.518 1.00 125.43 ? 603 BMA D C5 1 HETATM 14087 C C6 . BMA X 3 . ? -0.840 46.395 74.745 1.00 119.01 ? 603 BMA D C6 1 HETATM 14088 O O2 . BMA X 3 . ? 0.367 41.850 74.206 1.00 139.47 ? 603 BMA D O2 1 HETATM 14089 O O3 . BMA X 3 . ? -1.213 41.736 76.428 1.00 147.63 ? 603 BMA D O3 1 HETATM 14090 O O4 . BMA X 3 . ? -1.651 44.523 76.870 1.00 136.46 ? 603 BMA D O4 1 HETATM 14091 O O5 . BMA X 3 . ? -0.727 44.459 73.335 1.00 117.01 ? 603 BMA D O5 1 HETATM 14092 O O6 . BMA X 3 . ? 0.559 46.329 74.989 1.00 123.44 ? 603 BMA D O6 1 HETATM 14093 C C1 . NAG Y 2 . ? -14.507 79.341 63.941 1.00 50.42 ? 604 NAG D C1 1 HETATM 14094 C C2 . NAG Y 2 . ? -14.211 79.853 65.351 1.00 33.50 ? 604 NAG D C2 1 HETATM 14095 C C3 . NAG Y 2 . ? -14.458 81.356 65.437 1.00 54.54 ? 604 NAG D C3 1 HETATM 14096 C C4 . NAG Y 2 . ? -13.690 82.087 64.342 1.00 39.94 ? 604 NAG D C4 1 HETATM 14097 C C5 . NAG Y 2 . ? -14.017 81.483 62.980 1.00 42.37 ? 604 NAG D C5 1 HETATM 14098 C C6 . NAG Y 2 . ? -13.207 82.088 61.858 1.00 32.92 ? 604 NAG D C6 1 HETATM 14099 C C7 . NAG Y 2 . ? -14.714 77.938 66.811 1.00 69.09 ? 604 NAG D C7 1 HETATM 14100 C C8 . NAG Y 2 . ? -15.664 77.368 67.822 1.00 73.65 ? 604 NAG D C8 1 HETATM 14101 N N2 . NAG Y 2 . ? -15.023 79.148 66.338 1.00 56.44 ? 604 NAG D N2 1 HETATM 14102 O O3 . NAG Y 2 . ? -14.050 81.831 66.714 1.00 59.49 ? 604 NAG D O3 1 HETATM 14103 O O4 . NAG Y 2 . ? -13.488 83.478 64.318 1.00 85.58 ? 604 NAG D O4 1 HETATM 14104 O O5 . NAG Y 2 . ? -13.725 80.079 62.994 1.00 43.73 ? 604 NAG D O5 1 HETATM 14105 O O6 . NAG Y 2 . ? -11.882 82.385 62.278 1.00 68.19 ? 604 NAG D O6 1 HETATM 14106 O O7 . NAG Y 2 . ? -13.716 77.328 66.441 1.00 84.77 ? 604 NAG D O7 1 HETATM 14107 C C1 . NAG Z 2 . ? -12.845 84.650 64.696 1.00 97.21 ? 605 NAG D C1 1 HETATM 14108 C C2 . NAG Z 2 . ? -13.486 85.838 63.981 1.00 97.47 ? 605 NAG D C2 1 HETATM 14109 C C3 . NAG Z 2 . ? -12.837 87.141 64.437 1.00 105.49 ? 605 NAG D C3 1 HETATM 14110 C C4 . NAG Z 2 . ? -12.869 87.249 65.956 1.00 112.83 ? 605 NAG D C4 1 HETATM 14111 C C5 . NAG Z 2 . ? -12.257 86.001 66.585 1.00 115.39 ? 605 NAG D C5 1 HETATM 14112 C C6 . NAG Z 2 . ? -12.362 85.986 68.093 1.00 98.62 ? 605 NAG D C6 1 HETATM 14113 C C7 . NAG Z 2 . ? -14.449 85.662 61.729 1.00 83.12 ? 605 NAG D C7 1 HETATM 14114 C C8 . NAG Z 2 . ? -14.158 85.518 60.266 1.00 64.48 ? 605 NAG D C8 1 HETATM 14115 N N2 . NAG Z 2 . ? -13.384 85.697 62.537 1.00 92.41 ? 605 NAG D N2 1 HETATM 14116 O O3 . NAG Z 2 . ? -13.526 88.243 63.856 1.00 106.48 ? 605 NAG D O3 1 HETATM 14117 O O4 . NAG Z 2 . ? -12.135 88.393 66.377 1.00 115.98 ? 605 NAG D O4 1 HETATM 14118 O O5 . NAG Z 2 . ? -12.942 84.832 66.110 1.00 114.93 ? 605 NAG D O5 1 HETATM 14119 O O6 . NAG Z 2 . ? -11.791 84.807 68.643 1.00 71.05 ? 605 NAG D O6 1 HETATM 14120 O O7 . NAG Z 2 . ? -15.595 85.740 62.161 1.00 76.24 ? 605 NAG D O7 1 HETATM 14121 O O . HOH AA 5 . ? 41.431 63.275 60.300 1.00 27.17 ? 701 HOH A O 1 HETATM 14122 O O . HOH AA 5 . ? 17.327 95.661 70.655 1.00 27.75 ? 702 HOH A O 1 HETATM 14123 O O . HOH AA 5 . ? 15.161 85.347 67.609 1.00 46.39 ? 703 HOH A O 1 HETATM 14124 O O . HOH AA 5 . ? 22.180 75.949 78.397 1.00 36.00 ? 704 HOH A O 1 HETATM 14125 O O . HOH AA 5 . ? 33.644 75.224 73.738 1.00 29.89 ? 705 HOH A O 1 HETATM 14126 O O . HOH AA 5 . ? 18.574 92.481 59.867 1.00 37.82 ? 706 HOH A O 1 HETATM 14127 O O . HOH AA 5 . ? 19.266 51.099 67.425 1.00 32.18 ? 707 HOH A O 1 HETATM 14128 O O . HOH AA 5 . ? 40.122 87.970 55.491 1.00 33.99 ? 708 HOH A O 1 HETATM 14129 O O . HOH AA 5 . ? 32.448 106.097 58.860 1.00 33.50 ? 709 HOH A O 1 HETATM 14130 O O . HOH AA 5 . ? 40.228 65.934 62.781 1.00 38.67 ? 710 HOH A O 1 HETATM 14131 O O . HOH AA 5 . ? 12.324 42.622 71.140 1.00 53.98 ? 711 HOH A O 1 HETATM 14132 O O . HOH AA 5 . ? 25.369 91.577 81.174 1.00 25.52 ? 712 HOH A O 1 HETATM 14133 O O . HOH AA 5 . ? 34.334 59.191 69.541 1.00 35.56 ? 713 HOH A O 1 HETATM 14134 O O . HOH AA 5 . ? 43.526 88.832 58.557 1.00 37.66 ? 714 HOH A O 1 HETATM 14135 O O . HOH AA 5 . ? 29.718 75.303 74.361 1.00 38.58 ? 715 HOH A O 1 HETATM 14136 O O . HOH AA 5 . ? 24.646 63.256 70.139 1.00 29.76 ? 716 HOH A O 1 HETATM 14137 O O . HOH AA 5 . ? 22.611 99.116 64.718 1.00 42.21 ? 717 HOH A O 1 HETATM 14138 O O . HOH AA 5 . ? 22.127 101.952 55.220 1.00 37.07 ? 718 HOH A O 1 HETATM 14139 O O . HOH AA 5 . ? 18.871 81.288 62.857 1.00 28.06 ? 719 HOH A O 1 HETATM 14140 O O . HOH AA 5 . ? 33.610 80.867 66.861 1.00 26.34 ? 720 HOH A O 1 HETATM 14141 O O . HOH AA 5 . ? 37.343 64.101 51.949 1.00 31.19 ? 721 HOH A O 1 HETATM 14142 O O . HOH AA 5 . ? 22.170 96.898 88.007 1.00 38.40 ? 722 HOH A O 1 HETATM 14143 O O . HOH AA 5 . ? 24.753 109.889 48.111 1.00 48.74 ? 723 HOH A O 1 HETATM 14144 O O . HOH AA 5 . ? 39.995 82.043 61.997 1.00 28.79 ? 724 HOH A O 1 HETATM 14145 O O . HOH AA 5 . ? 50.327 74.484 66.530 1.00 47.79 ? 725 HOH A O 1 HETATM 14146 O O . HOH AA 5 . ? 40.083 78.528 65.492 1.00 42.43 ? 726 HOH A O 1 HETATM 14147 O O . HOH AA 5 . ? 30.468 58.189 69.001 1.00 33.25 ? 727 HOH A O 1 HETATM 14148 O O . HOH AA 5 . ? 25.431 115.108 69.566 1.00 36.21 ? 728 HOH A O 1 HETATM 14149 O O . HOH AA 5 . ? 24.177 85.460 56.747 1.00 38.24 ? 729 HOH A O 1 HETATM 14150 O O . HOH AA 5 . ? 21.268 78.356 60.229 1.00 38.71 ? 730 HOH A O 1 HETATM 14151 O O . HOH AA 5 . ? 19.870 94.809 55.410 1.00 40.10 ? 731 HOH A O 1 HETATM 14152 O O . HOH AA 5 . ? 19.330 88.510 83.750 1.00 30.60 ? 732 HOH A O 1 HETATM 14153 O O . HOH AA 5 . ? 20.698 75.347 60.875 1.00 40.30 ? 733 HOH A O 1 HETATM 14154 O O . HOH AA 5 . ? 33.575 98.838 79.110 1.00 32.26 ? 734 HOH A O 1 HETATM 14155 O O . HOH AA 5 . ? 14.699 57.391 48.583 1.00 41.97 ? 735 HOH A O 1 HETATM 14156 O O . HOH AA 5 . ? 24.549 76.621 78.432 1.00 44.20 ? 736 HOH A O 1 HETATM 14157 O O . HOH AA 5 . ? 32.973 78.908 54.184 1.00 41.37 ? 737 HOH A O 1 HETATM 14158 O O . HOH AA 5 . ? 41.228 76.381 70.965 1.00 35.33 ? 738 HOH A O 1 HETATM 14159 O O . HOH AA 5 . ? 32.692 81.957 72.308 1.00 31.40 ? 739 HOH A O 1 HETATM 14160 O O . HOH AA 5 . ? 16.971 97.942 53.310 1.00 46.45 ? 740 HOH A O 1 HETATM 14161 O O . HOH AA 5 . ? 21.746 87.417 56.519 1.00 39.77 ? 741 HOH A O 1 HETATM 14162 O O . HOH AA 5 . ? 27.772 60.217 69.464 1.00 40.63 ? 742 HOH A O 1 HETATM 14163 O O . HOH AA 5 . ? 14.959 65.616 72.346 1.00 39.15 ? 743 HOH A O 1 HETATM 14164 O O . HOH AA 5 . ? 16.809 108.981 63.496 1.00 41.86 ? 744 HOH A O 1 HETATM 14165 O O . HOH AA 5 . ? 28.305 69.543 71.104 1.00 44.25 ? 745 HOH A O 1 HETATM 14166 O O . HOH AA 5 . ? 13.355 103.207 59.171 1.00 37.19 ? 746 HOH A O 1 HETATM 14167 O O . HOH AA 5 . ? 34.465 66.064 72.315 1.00 40.11 ? 747 HOH A O 1 HETATM 14168 O O . HOH AA 5 . ? 48.399 74.653 49.490 1.00 51.04 ? 748 HOH A O 1 HETATM 14169 O O . HOH AA 5 . ? 22.657 113.911 75.727 1.00 31.60 ? 749 HOH A O 1 HETATM 14170 O O . HOH AA 5 . ? 27.950 70.048 65.605 1.00 39.19 ? 750 HOH A O 1 HETATM 14171 O O . HOH AA 5 . ? 38.164 80.076 79.037 1.00 44.02 ? 751 HOH A O 1 HETATM 14172 O O . HOH AA 5 . ? 17.305 100.224 53.561 1.00 47.97 ? 752 HOH A O 1 HETATM 14173 O O . HOH AA 5 . ? 46.646 72.632 63.957 1.00 39.99 ? 753 HOH A O 1 HETATM 14174 O O . HOH AA 5 . ? 28.361 81.042 61.285 1.00 40.57 ? 754 HOH A O 1 HETATM 14175 O O . HOH AA 5 . ? 42.739 81.691 65.667 1.00 47.29 ? 755 HOH A O 1 HETATM 14176 O O . HOH AA 5 . ? 42.921 94.104 61.691 1.00 41.91 ? 756 HOH A O 1 HETATM 14177 O O . HOH AA 5 . ? 30.686 69.910 67.848 1.00 50.65 ? 757 HOH A O 1 HETATM 14178 O O . HOH AA 5 . ? 24.011 68.537 52.471 1.00 60.83 ? 758 HOH A O 1 HETATM 14179 O O . HOH AA 5 . ? 37.401 60.212 76.088 1.00 56.21 ? 759 HOH A O 1 HETATM 14180 O O . HOH AA 5 . ? 27.898 72.631 80.464 1.00 41.03 ? 760 HOH A O 1 HETATM 14181 O O . HOH AA 5 . ? 36.564 73.131 64.044 1.00 40.74 ? 761 HOH A O 1 HETATM 14182 O O . HOH AA 5 . ? 6.181 87.778 72.471 1.00 47.38 ? 762 HOH A O 1 HETATM 14183 O O . HOH AA 5 . ? 1.335 63.153 52.855 1.00 46.63 ? 763 HOH A O 1 HETATM 14184 O O . HOH AA 5 . ? 7.597 93.740 61.260 1.00 45.01 ? 764 HOH A O 1 HETATM 14185 O O . HOH AA 5 . ? 20.683 89.478 86.233 1.00 40.84 ? 765 HOH A O 1 HETATM 14186 O O . HOH AA 5 . ? 35.796 106.130 62.870 1.00 43.99 ? 766 HOH A O 1 HETATM 14187 O O . HOH AA 5 . ? 12.562 41.723 68.962 1.00 62.08 ? 767 HOH A O 1 HETATM 14188 O O . HOH AA 5 . ? 33.779 82.234 70.072 1.00 33.35 ? 768 HOH A O 1 HETATM 14189 O O . HOH AA 5 . ? 30.167 73.676 81.270 1.00 61.08 ? 769 HOH A O 1 HETATM 14190 O O . HOH AA 5 . ? 9.527 65.443 51.635 1.00 51.02 ? 770 HOH A O 1 HETATM 14191 O O . HOH AA 5 . ? 1.492 60.708 51.535 1.00 48.67 ? 771 HOH A O 1 HETATM 14192 O O . HOH AA 5 . ? 27.828 113.848 71.952 1.00 52.44 ? 772 HOH A O 1 HETATM 14193 O O . HOH AA 5 . ? 32.285 43.234 64.163 1.00 55.80 ? 773 HOH A O 1 HETATM 14194 O O . HOH AA 5 . ? 29.243 67.624 76.080 1.00 31.23 ? 774 HOH A O 1 HETATM 14195 O O . HOH AA 5 . ? 10.603 51.153 60.571 1.00 47.64 ? 775 HOH A O 1 HETATM 14196 O O . HOH AA 5 . ? 22.141 115.277 72.948 1.00 63.92 ? 776 HOH A O 1 HETATM 14197 O O . HOH BA 5 . ? 18.035 5.591 59.608 1.00 39.00 ? 701 HOH B O 1 HETATM 14198 O O . HOH BA 5 . ? 28.621 12.770 54.472 1.00 38.72 ? 702 HOH B O 1 HETATM 14199 O O . HOH BA 5 . ? 11.621 -10.868 66.022 1.00 44.96 ? 703 HOH B O 1 HETATM 14200 O O . HOH BA 5 . ? 27.595 2.366 69.582 1.00 37.14 ? 704 HOH B O 1 HETATM 14201 O O . HOH BA 5 . ? 37.467 13.262 55.310 1.00 32.24 ? 705 HOH B O 1 HETATM 14202 O O . HOH BA 5 . ? 17.140 -1.408 58.279 1.00 47.19 ? 706 HOH B O 1 HETATM 14203 O O . HOH BA 5 . ? 10.043 -10.665 51.410 1.00 49.96 ? 707 HOH B O 1 HETATM 14204 O O . HOH BA 5 . ? 25.930 -3.476 67.269 1.00 37.64 ? 708 HOH B O 1 HETATM 14205 O O . HOH BA 5 . ? 13.744 23.670 46.053 1.00 41.14 ? 709 HOH B O 1 HETATM 14206 O O . HOH BA 5 . ? 31.077 2.659 68.835 1.00 37.55 ? 710 HOH B O 1 HETATM 14207 O O . HOH BA 5 . ? 38.803 3.184 65.289 1.00 37.34 ? 711 HOH B O 1 HETATM 14208 O O . HOH BA 5 . ? 39.687 1.388 53.074 1.00 44.65 ? 712 HOH B O 1 HETATM 14209 O O . HOH BA 5 . ? 37.869 20.366 64.167 1.00 54.76 ? 713 HOH B O 1 HETATM 14210 O O . HOH BA 5 . ? 7.454 -13.817 62.241 1.00 57.09 ? 714 HOH B O 1 HETATM 14211 O O . HOH BA 5 . ? 14.597 22.615 61.170 1.00 37.57 ? 715 HOH B O 1 HETATM 14212 O O . HOH BA 5 . ? 21.482 34.252 51.681 1.00 43.45 ? 716 HOH B O 1 HETATM 14213 O O . HOH BA 5 . ? 37.154 7.433 55.333 1.00 34.51 ? 717 HOH B O 1 HETATM 14214 O O . HOH BA 5 . ? 28.926 2.736 66.840 1.00 35.91 ? 718 HOH B O 1 HETATM 14215 O O . HOH BA 5 . ? 37.334 12.590 48.762 1.00 32.34 ? 719 HOH B O 1 HETATM 14216 O O . HOH BA 5 . ? 25.427 -4.012 61.616 1.00 40.82 ? 720 HOH B O 1 HETATM 14217 O O . HOH BA 5 . ? 38.666 8.844 48.936 1.00 47.13 ? 721 HOH B O 1 HETATM 14218 O O . HOH BA 5 . ? 20.002 23.753 70.385 1.00 66.88 ? 722 HOH B O 1 HETATM 14219 O O . HOH BA 5 . ? 31.882 -6.994 68.982 1.00 49.35 ? 723 HOH B O 1 HETATM 14220 O O . HOH BA 5 . ? 30.010 8.814 66.741 1.00 38.78 ? 724 HOH B O 1 HETATM 14221 O O . HOH BA 5 . ? 38.707 14.781 68.179 1.00 50.44 ? 725 HOH B O 1 HETATM 14222 O O . HOH BA 5 . ? 27.196 -5.020 58.728 1.00 43.04 ? 726 HOH B O 1 HETATM 14223 O O . HOH BA 5 . ? 38.761 14.926 65.789 1.00 49.41 ? 727 HOH B O 1 HETATM 14224 O O . HOH BA 5 . ? 41.924 10.962 52.528 1.00 40.42 ? 728 HOH B O 1 HETATM 14225 O O . HOH BA 5 . ? 34.308 -1.332 59.034 1.00 43.56 ? 729 HOH B O 1 HETATM 14226 O O . HOH BA 5 . ? 30.448 11.078 49.181 1.00 41.95 ? 730 HOH B O 1 HETATM 14227 O O . HOH BA 5 . ? 33.055 10.833 62.490 1.00 39.84 ? 731 HOH B O 1 HETATM 14228 O O . HOH BA 5 . ? 22.127 -9.831 67.367 1.00 50.42 ? 732 HOH B O 1 HETATM 14229 O O . HOH BA 5 . ? 21.784 32.304 39.306 1.00 60.22 ? 733 HOH B O 1 HETATM 14230 O O . HOH BA 5 . ? 31.957 26.483 70.549 1.00 54.02 ? 734 HOH B O 1 HETATM 14231 O O . HOH BA 5 . ? 43.688 -1.756 59.002 1.00 38.59 ? 735 HOH B O 1 HETATM 14232 O O . HOH BA 5 . ? -7.475 10.598 38.298 1.00 61.62 ? 736 HOH B O 1 HETATM 14233 O O . HOH BA 5 . ? 19.133 -23.286 64.833 1.00 48.96 ? 737 HOH B O 1 HETATM 14234 O O . HOH BA 5 . ? 33.283 32.146 48.075 1.00 49.04 ? 738 HOH B O 1 HETATM 14235 O O . HOH BA 5 . ? 24.299 -7.103 44.799 1.00 71.05 ? 739 HOH B O 1 HETATM 14236 O O . HOH BA 5 . ? 39.596 20.282 53.113 1.00 44.49 ? 740 HOH B O 1 HETATM 14237 O O . HOH BA 5 . ? 38.751 -11.397 57.379 1.00 34.02 ? 741 HOH B O 1 HETATM 14238 O O . HOH BA 5 . ? 28.254 -3.853 63.653 1.00 47.28 ? 742 HOH B O 1 HETATM 14239 O O . HOH BA 5 . ? 31.420 8.803 63.724 1.00 46.43 ? 743 HOH B O 1 HETATM 14240 O O . HOH BA 5 . ? 30.326 13.634 51.090 1.00 45.74 ? 744 HOH B O 1 HETATM 14241 O O . HOH BA 5 . ? 31.039 7.475 60.875 1.00 49.97 ? 745 HOH B O 1 HETATM 14242 O O . HOH BA 5 . ? 18.184 26.355 49.458 1.00 63.18 ? 746 HOH B O 1 HETATM 14243 O O . HOH BA 5 . ? 29.109 -2.017 66.067 1.00 60.02 ? 747 HOH B O 1 HETATM 14244 O O . HOH BA 5 . ? 36.165 25.440 43.352 1.00 55.64 ? 748 HOH B O 1 HETATM 14245 O O . HOH BA 5 . ? 38.362 9.231 54.087 1.00 46.69 ? 749 HOH B O 1 HETATM 14246 O O . HOH BA 5 . ? 19.167 43.177 75.258 1.00 76.75 ? 750 HOH B O 1 HETATM 14247 O O . HOH BA 5 . ? 33.760 31.096 50.528 1.00 49.45 ? 751 HOH B O 1 HETATM 14248 O O . HOH BA 5 . ? 41.084 3.626 44.362 1.00 52.36 ? 752 HOH B O 1 HETATM 14249 O O . HOH BA 5 . ? 14.192 -6.788 72.485 1.00 54.73 ? 753 HOH B O 1 HETATM 14250 O O . HOH BA 5 . ? 28.478 6.240 85.919 1.00 61.12 ? 754 HOH B O 1 HETATM 14251 O O . HOH CA 5 . ? 19.956 43.563 24.102 1.00 33.94 ? 701 HOH C O 1 HETATM 14252 O O . HOH CA 5 . ? 20.762 71.785 16.545 1.00 39.42 ? 702 HOH C O 1 HETATM 14253 O O . HOH CA 5 . ? 30.729 63.221 15.558 1.00 30.03 ? 703 HOH C O 1 HETATM 14254 O O . HOH CA 5 . ? 21.855 43.642 21.830 1.00 33.56 ? 704 HOH C O 1 HETATM 14255 O O . HOH CA 5 . ? 36.446 32.637 19.265 1.00 34.49 ? 705 HOH C O 1 HETATM 14256 O O . HOH CA 5 . ? 19.929 55.064 24.152 1.00 32.54 ? 706 HOH C O 1 HETATM 14257 O O . HOH CA 5 . ? 27.628 68.748 18.361 1.00 29.88 ? 707 HOH C O 1 HETATM 14258 O O . HOH CA 5 . ? 20.011 85.166 28.487 1.00 34.86 ? 708 HOH C O 1 HETATM 14259 O O . HOH CA 5 . ? 34.903 55.321 21.328 1.00 37.84 ? 709 HOH C O 1 HETATM 14260 O O . HOH CA 5 . ? 27.813 77.623 22.528 1.00 31.84 ? 710 HOH C O 1 HETATM 14261 O O . HOH CA 5 . ? 30.886 79.677 23.142 1.00 35.62 ? 711 HOH C O 1 HETATM 14262 O O . HOH CA 5 . ? 16.125 67.615 39.013 1.00 35.21 ? 712 HOH C O 1 HETATM 14263 O O . HOH CA 5 . ? 33.079 69.224 31.354 1.00 28.54 ? 713 HOH C O 1 HETATM 14264 O O . HOH CA 5 . ? 22.577 64.212 10.056 1.00 33.92 ? 714 HOH C O 1 HETATM 14265 O O . HOH CA 5 . ? 36.013 54.316 16.765 1.00 34.36 ? 715 HOH C O 1 HETATM 14266 O O . HOH CA 5 . ? 35.717 50.842 32.912 1.00 44.57 ? 716 HOH C O 1 HETATM 14267 O O . HOH CA 5 . ? 28.677 66.945 23.975 1.00 29.67 ? 717 HOH C O 1 HETATM 14268 O O . HOH CA 5 . ? 21.948 40.181 27.307 1.00 33.93 ? 718 HOH C O 1 HETATM 14269 O O . HOH CA 5 . ? 27.102 74.788 15.043 1.00 45.21 ? 719 HOH C O 1 HETATM 14270 O O . HOH CA 5 . ? 23.958 47.917 28.065 1.00 37.95 ? 720 HOH C O 1 HETATM 14271 O O . HOH CA 5 . ? 22.697 50.787 3.376 1.00 37.15 ? 721 HOH C O 1 HETATM 14272 O O . HOH CA 5 . ? 21.707 56.764 23.150 1.00 33.17 ? 722 HOH C O 1 HETATM 14273 O O . HOH CA 5 . ? 14.151 74.705 25.956 1.00 30.97 ? 723 HOH C O 1 HETATM 14274 O O . HOH CA 5 . ? 32.403 64.832 13.128 1.00 29.72 ? 724 HOH C O 1 HETATM 14275 O O . HOH CA 5 . ? 12.248 60.212 38.183 1.00 38.58 ? 725 HOH C O 1 HETATM 14276 O O . HOH CA 5 . ? 29.021 51.966 25.347 1.00 35.60 ? 726 HOH C O 1 HETATM 14277 O O . HOH CA 5 . ? 30.182 66.440 6.804 1.00 52.88 ? 727 HOH C O 1 HETATM 14278 O O . HOH CA 5 . ? 39.482 79.121 38.126 1.00 44.52 ? 728 HOH C O 1 HETATM 14279 O O . HOH CA 5 . ? 31.855 62.494 38.278 1.00 37.26 ? 729 HOH C O 1 HETATM 14280 O O . HOH CA 5 . ? 24.776 45.997 -2.647 1.00 39.19 ? 730 HOH C O 1 HETATM 14281 O O . HOH CA 5 . ? 22.961 34.141 22.646 1.00 55.64 ? 731 HOH C O 1 HETATM 14282 O O . HOH CA 5 . ? 42.300 46.944 25.223 1.00 46.26 ? 732 HOH C O 1 HETATM 14283 O O . HOH CA 5 . ? 34.489 78.634 21.868 1.00 49.37 ? 733 HOH C O 1 HETATM 14284 O O . HOH CA 5 . ? 35.091 47.269 22.387 1.00 30.37 ? 734 HOH C O 1 HETATM 14285 O O . HOH CA 5 . ? 40.113 73.696 40.811 1.00 50.10 ? 735 HOH C O 1 HETATM 14286 O O . HOH CA 5 . ? 22.849 56.908 27.854 1.00 31.62 ? 736 HOH C O 1 HETATM 14287 O O . HOH CA 5 . ? 36.693 58.557 31.169 1.00 41.59 ? 737 HOH C O 1 HETATM 14288 O O . HOH CA 5 . ? 15.092 60.340 40.445 1.00 49.46 ? 738 HOH C O 1 HETATM 14289 O O . HOH CA 5 . ? 38.967 48.066 7.866 1.00 43.63 ? 739 HOH C O 1 HETATM 14290 O O . HOH CA 5 . ? 35.416 34.442 11.336 1.00 31.62 ? 740 HOH C O 1 HETATM 14291 O O . HOH CA 5 . ? 49.125 51.804 20.814 1.00 31.46 ? 741 HOH C O 1 HETATM 14292 O O . HOH CA 5 . ? 31.311 67.368 18.318 1.00 31.33 ? 742 HOH C O 1 HETATM 14293 O O . HOH CA 5 . ? 36.652 58.187 19.249 1.00 41.41 ? 743 HOH C O 1 HETATM 14294 O O . HOH CA 5 . ? 23.852 67.159 -5.833 1.00 54.68 ? 744 HOH C O 1 HETATM 14295 O O . HOH CA 5 . ? 12.539 93.944 25.657 1.00 65.24 ? 745 HOH C O 1 HETATM 14296 O O . HOH CA 5 . ? 35.327 48.410 26.480 1.00 30.12 ? 746 HOH C O 1 HETATM 14297 O O . HOH CA 5 . ? 40.774 54.694 21.435 1.00 31.20 ? 747 HOH C O 1 HETATM 14298 O O . HOH CA 5 . ? 35.599 75.910 27.584 1.00 34.96 ? 748 HOH C O 1 HETATM 14299 O O . HOH CA 5 . ? 46.937 53.629 31.730 1.00 39.81 ? 749 HOH C O 1 HETATM 14300 O O . HOH CA 5 . ? 25.143 74.520 22.126 1.00 39.34 ? 750 HOH C O 1 HETATM 14301 O O . HOH CA 5 . ? 33.418 56.748 15.071 1.00 30.15 ? 751 HOH C O 1 HETATM 14302 O O . HOH CA 5 . ? 43.803 50.401 25.691 1.00 38.91 ? 752 HOH C O 1 HETATM 14303 O O . HOH CA 5 . ? 17.673 48.542 -4.259 1.00 51.95 ? 753 HOH C O 1 HETATM 14304 O O . HOH CA 5 . ? 38.998 47.217 33.151 1.00 56.00 ? 754 HOH C O 1 HETATM 14305 O O . HOH CA 5 . ? 32.328 66.989 22.694 1.00 48.61 ? 755 HOH C O 1 HETATM 14306 O O . HOH CA 5 . ? 11.441 75.409 30.850 1.00 41.67 ? 756 HOH C O 1 HETATM 14307 O O . HOH CA 5 . ? 14.614 73.128 21.319 1.00 42.16 ? 757 HOH C O 1 HETATM 14308 O O . HOH CA 5 . ? 28.626 64.696 13.621 1.00 33.76 ? 758 HOH C O 1 HETATM 14309 O O . HOH CA 5 . ? 18.049 57.672 31.329 1.00 43.70 ? 759 HOH C O 1 HETATM 14310 O O . HOH CA 5 . ? 28.144 57.683 27.209 1.00 38.94 ? 760 HOH C O 1 HETATM 14311 O O . HOH CA 5 . ? 12.390 73.687 23.928 1.00 41.28 ? 761 HOH C O 1 HETATM 14312 O O . HOH CA 5 . ? 38.950 74.891 38.140 1.00 40.10 ? 762 HOH C O 1 HETATM 14313 O O . HOH CA 5 . ? 40.813 62.593 14.055 1.00 30.62 ? 763 HOH C O 1 HETATM 14314 O O . HOH CA 5 . ? 24.295 75.400 1.954 1.00 53.48 ? 764 HOH C O 1 HETATM 14315 O O . HOH CA 5 . ? 41.387 48.594 14.654 1.00 41.47 ? 765 HOH C O 1 HETATM 14316 O O . HOH CA 5 . ? 44.251 46.503 19.196 1.00 51.14 ? 766 HOH C O 1 HETATM 14317 O O . HOH CA 5 . ? 40.754 77.218 37.558 1.00 55.59 ? 767 HOH C O 1 HETATM 14318 O O . HOH CA 5 . ? 44.555 59.513 25.574 1.00 45.89 ? 768 HOH C O 1 HETATM 14319 O O . HOH CA 5 . ? 31.212 66.578 26.483 1.00 39.04 ? 769 HOH C O 1 HETATM 14320 O O . HOH CA 5 . ? 19.257 49.839 -5.409 1.00 56.55 ? 770 HOH C O 1 HETATM 14321 O O . HOH CA 5 . ? 32.759 80.955 21.821 1.00 37.60 ? 771 HOH C O 1 HETATM 14322 O O . HOH CA 5 . ? 31.577 57.686 12.869 1.00 40.84 ? 772 HOH C O 1 HETATM 14323 O O . HOH CA 5 . ? 42.161 52.095 21.128 1.00 37.02 ? 773 HOH C O 1 HETATM 14324 O O . HOH CA 5 . ? 27.862 66.886 36.258 1.00 44.11 ? 774 HOH C O 1 HETATM 14325 O O . HOH CA 5 . ? 11.239 25.779 10.535 1.00 52.97 ? 775 HOH C O 1 HETATM 14326 O O . HOH CA 5 . ? 28.099 74.384 22.061 1.00 29.66 ? 776 HOH C O 1 HETATM 14327 O O . HOH CA 5 . ? 31.908 65.365 16.414 1.00 32.64 ? 777 HOH C O 1 HETATM 14328 O O . HOH CA 5 . ? 33.629 56.901 18.061 1.00 32.37 ? 778 HOH C O 1 HETATM 14329 O O . HOH CA 5 . ? 23.222 43.407 32.643 1.00 43.62 ? 779 HOH C O 1 HETATM 14330 O O . HOH CA 5 . ? 35.039 54.273 14.070 1.00 46.05 ? 780 HOH C O 1 HETATM 14331 O O . HOH CA 5 . ? 22.587 72.422 45.599 1.00 41.45 ? 781 HOH C O 1 HETATM 14332 O O . HOH CA 5 . ? 45.808 56.413 31.908 1.00 40.25 ? 782 HOH C O 1 HETATM 14333 O O . HOH CA 5 . ? 30.859 65.633 28.614 1.00 35.84 ? 783 HOH C O 1 HETATM 14334 O O . HOH CA 5 . ? 40.978 48.857 11.839 1.00 43.19 ? 784 HOH C O 1 HETATM 14335 O O . HOH CA 5 . ? 34.183 33.598 -1.189 1.00 62.72 ? 785 HOH C O 1 HETATM 14336 O O . HOH CA 5 . ? 22.087 60.297 28.150 1.00 37.21 ? 786 HOH C O 1 HETATM 14337 O O . HOH CA 5 . ? 29.006 69.287 9.240 1.00 77.24 ? 787 HOH C O 1 HETATM 14338 O O . HOH CA 5 . ? 43.979 50.436 23.267 1.00 44.72 ? 788 HOH C O 1 HETATM 14339 O O . HOH CA 5 . ? 38.027 35.206 10.858 1.00 59.63 ? 789 HOH C O 1 HETATM 14340 O O . HOH CA 5 . ? 3.539 63.729 28.237 1.00 56.83 ? 790 HOH C O 1 HETATM 14341 O O . HOH CA 5 . ? 42.033 49.113 22.965 1.00 37.37 ? 791 HOH C O 1 HETATM 14342 O O . HOH CA 5 . ? 43.406 49.872 15.085 1.00 49.51 ? 792 HOH C O 1 HETATM 14343 O O . HOH CA 5 . ? 34.287 36.429 10.271 1.00 46.85 ? 793 HOH C O 1 HETATM 14344 O O . HOH CA 5 . ? 20.551 85.364 22.892 1.00 54.40 ? 794 HOH C O 1 HETATM 14345 O O . HOH CA 5 . ? 6.170 50.549 22.837 1.00 50.15 ? 795 HOH C O 1 HETATM 14346 O O . HOH CA 5 . ? 19.140 38.073 33.237 1.00 67.98 ? 796 HOH C O 1 HETATM 14347 O O . HOH CA 5 . ? 21.131 62.580 27.527 1.00 35.74 ? 797 HOH C O 1 HETATM 14348 O O . HOH CA 5 . ? 32.838 73.323 40.440 1.00 46.61 ? 798 HOH C O 1 HETATM 14349 O O . HOH CA 5 . ? 36.515 67.439 37.542 1.00 49.60 ? 799 HOH C O 1 HETATM 14350 O O . HOH DA 5 . ? -18.779 65.913 72.540 1.00 40.14 ? 701 HOH D O 1 HETATM 14351 O O . HOH DA 5 . ? -26.024 62.163 63.730 1.00 40.54 ? 702 HOH D O 1 HETATM 14352 O O . HOH DA 5 . ? -22.738 69.529 67.192 1.00 39.11 ? 703 HOH D O 1 HETATM 14353 O O . HOH DA 5 . ? -31.272 50.991 70.955 1.00 62.72 ? 704 HOH D O 1 HETATM 14354 O O . HOH DA 5 . ? -13.027 65.292 49.712 1.00 38.23 ? 705 HOH D O 1 HETATM 14355 O O . HOH DA 5 . ? -47.898 43.645 58.391 1.00 52.69 ? 706 HOH D O 1 HETATM 14356 O O . HOH DA 5 . ? -12.959 56.666 68.562 1.00 38.44 ? 707 HOH D O 1 HETATM 14357 O O . HOH DA 5 . ? -32.328 42.242 61.246 1.00 47.79 ? 708 HOH D O 1 HETATM 14358 O O . HOH DA 5 . ? -25.391 63.126 69.707 1.00 43.23 ? 709 HOH D O 1 HETATM 14359 O O . HOH DA 5 . ? -18.520 58.631 60.287 1.00 39.58 ? 710 HOH D O 1 HETATM 14360 O O . HOH DA 5 . ? -30.431 66.171 56.700 1.00 40.85 ? 711 HOH D O 1 HETATM 14361 O O . HOH DA 5 . ? -30.375 61.531 64.783 1.00 45.14 ? 712 HOH D O 1 HETATM 14362 O O . HOH DA 5 . ? -17.381 81.086 62.545 1.00 50.64 ? 713 HOH D O 1 HETATM 14363 O O . HOH DA 5 . ? -38.038 31.472 68.640 1.00 52.68 ? 714 HOH D O 1 HETATM 14364 O O . HOH DA 5 . ? -25.077 72.482 67.169 1.00 45.77 ? 715 HOH D O 1 HETATM 14365 O O . HOH DA 5 . ? -28.392 58.647 80.542 1.00 56.71 ? 716 HOH D O 1 HETATM 14366 O O . HOH DA 5 . ? -33.944 48.511 69.220 1.00 46.37 ? 717 HOH D O 1 HETATM 14367 O O . HOH DA 5 . ? -28.860 57.259 71.707 1.00 48.32 ? 718 HOH D O 1 HETATM 14368 O O . HOH DA 5 . ? -0.894 59.539 60.097 1.00 43.24 ? 719 HOH D O 1 HETATM 14369 O O . HOH DA 5 . ? -46.665 46.924 63.694 1.00 55.38 ? 720 HOH D O 1 HETATM 14370 O O . HOH DA 5 . ? -24.845 64.435 51.734 1.00 52.09 ? 721 HOH D O 1 HETATM 14371 O O . HOH DA 5 . ? -37.880 55.466 73.994 1.00 52.65 ? 722 HOH D O 1 HETATM 14372 O O . HOH DA 5 . ? -45.023 59.733 65.645 1.00 52.53 ? 723 HOH D O 1 HETATM 14373 O O . HOH DA 5 . ? -25.966 69.483 67.066 1.00 54.03 ? 724 HOH D O 1 HETATM 14374 O O . HOH DA 5 . ? -32.181 73.592 67.562 1.00 44.97 ? 725 HOH D O 1 HETATM 14375 O O . HOH DA 5 . ? -9.723 54.596 49.374 1.00 42.43 ? 726 HOH D O 1 HETATM 14376 O O . HOH DA 5 . ? -15.211 69.429 72.305 1.00 55.77 ? 727 HOH D O 1 HETATM 14377 O O . HOH DA 5 . ? -12.497 67.243 68.272 1.00 36.19 ? 728 HOH D O 1 HETATM 14378 O O . HOH DA 5 . ? 3.637 47.631 59.179 1.00 50.76 ? 729 HOH D O 1 HETATM 14379 O O . HOH DA 5 . ? -31.832 27.280 68.069 1.00 128.62 ? 730 HOH D O 1 HETATM 14380 O O . HOH DA 5 . ? -38.168 31.938 66.360 1.00 63.25 ? 731 HOH D O 1 HETATM 14381 O O . HOH DA 5 . ? -19.005 38.569 62.622 1.00 65.67 ? 732 HOH D O 1 HETATM 14382 O O . HOH DA 5 . ? -8.719 71.713 59.052 1.00 51.73 ? 733 HOH D O 1 HETATM 14383 O O . HOH DA 5 . ? -38.758 28.677 58.192 1.00 66.83 ? 734 HOH D O 1 HETATM 14384 O O . HOH DA 5 . ? -26.481 47.757 60.537 1.00 49.44 ? 735 HOH D O 1 HETATM 14385 O O . HOH DA 5 . ? 5.410 40.350 51.208 1.00 75.28 ? 736 HOH D O 1 HETATM 14386 O O . HOH DA 5 . ? -12.303 89.769 68.484 1.00 54.34 ? 737 HOH D O 1 HETATM 14387 O O . HOH DA 5 . ? -32.128 50.007 64.447 1.00 63.82 ? 738 HOH D O 1 HETATM 14388 O O . HOH DA 5 . ? -3.744 66.251 45.855 1.00 54.35 ? 739 HOH D O 1 HETATM 14389 O O . HOH DA 5 . ? -18.371 35.910 56.776 1.00 60.92 ? 740 HOH D O 1 HETATM 14390 O O . HOH DA 5 . ? -26.761 81.416 68.601 1.00 46.24 ? 741 HOH D O 1 HETATM 14391 O O . HOH DA 5 . ? -28.231 82.567 55.057 1.00 55.44 ? 742 HOH D O 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . PRO A 3 ? 0.6992 0.7680 0.7961 -0.0367 0.0684 0.0379 62 PRO A N 2 C CA . PRO A 3 ? 0.7420 0.8103 0.8398 -0.0382 0.0651 0.0358 62 PRO A CA 3 C C . PRO A 3 ? 0.7027 0.7706 0.7946 -0.0377 0.0639 0.0344 62 PRO A C 4 O O . PRO A 3 ? 0.6852 0.7542 0.7751 -0.0365 0.0653 0.0358 62 PRO A O 5 C CB . PRO A 3 ? 0.5832 0.6534 0.6890 -0.0385 0.0649 0.0374 62 PRO A CB 6 C CG . PRO A 3 ? 0.4539 0.5250 0.5637 -0.0378 0.0678 0.0400 62 PRO A CG 7 C CD . PRO A 3 ? 0.5708 0.6415 0.6745 -0.0361 0.0702 0.0407 62 PRO A CD 8 N N . HIS A 4 ? 0.6199 0.6859 0.7087 -0.0387 0.0613 0.0317 63 HIS A N 9 C CA . HIS A 4 ? 0.5599 0.6253 0.6430 -0.0383 0.0601 0.0301 63 HIS A CA 10 C C . HIS A 4 ? 0.6009 0.6678 0.6874 -0.0383 0.0590 0.0306 63 HIS A C 11 O O . HIS A 4 ? 0.6352 0.7027 0.7182 -0.0374 0.0593 0.0307 63 HIS A O 12 C CB . HIS A 4 ? 0.6405 0.7033 0.7197 -0.0392 0.0578 0.0272 63 HIS A CB 13 C CG . HIS A 4 ? 0.6374 0.6986 0.7121 -0.0392 0.0588 0.0265 63 HIS A CG 14 N ND1 . HIS A 4 ? 0.4970 0.5586 0.5737 -0.0390 0.0609 0.0280 63 HIS A ND1 15 C CD2 . HIS A 4 ? 0.6615 0.7206 0.7299 -0.0392 0.0581 0.0245 63 HIS A CD2 16 C CE1 . HIS A 4 ? 0.7036 0.7636 0.7753 -0.0390 0.0613 0.0269 63 HIS A CE1 17 N NE2 . HIS A 4 ? 0.6372 0.6955 0.7038 -0.0391 0.0597 0.0248 63 HIS A NE2 18 N N . GLN A 5 ? 0.5887 0.6563 0.6820 -0.0392 0.0577 0.0307 64 GLN A N 19 C CA . GLN A 5 ? 0.5377 0.6072 0.6356 -0.0391 0.0568 0.0314 64 GLN A CA 20 C C . GLN A 5 ? 0.6395 0.7114 0.7439 -0.0388 0.0591 0.0345 64 GLN A C 21 O O . GLN A 5 ? 0.5604 0.6326 0.6711 -0.0397 0.0588 0.0350 64 GLN A O 22 C CB . GLN A 5 ? 0.3925 0.4613 0.4939 -0.0402 0.0536 0.0292 64 GLN A CB 23 C CG . GLN A 5 ? 0.4910 0.5575 0.5863 -0.0402 0.0513 0.0263 64 GLN A CG 24 C CD . GLN A 5 ? 0.5634 0.6293 0.6623 -0.0408 0.0481 0.0242 64 GLN A CD 25 O OE1 . GLN A 5 ? 0.6015 0.6693 0.7059 -0.0409 0.0474 0.0248 64 GLN A OE1 26 N NE2 . GLN A 5 ? 0.4621 0.5255 0.5582 -0.0412 0.0461 0.0218 64 GLN A NE2 27 N N . PRO A 6 ? 0.6504 0.7237 0.7532 -0.0375 0.0613 0.0366 65 PRO A N 28 C CA . PRO A 6 ? 0.6130 0.6883 0.7211 -0.0368 0.0638 0.0398 65 PRO A CA 29 C C . PRO A 6 ? 0.3880 0.4654 0.5032 -0.0371 0.0631 0.0410 65 PRO A C 30 O O . PRO A 6 ? 0.4350 0.5126 0.5506 -0.0377 0.0607 0.0393 65 PRO A O 31 C CB . PRO A 6 ? 0.3019 0.3776 0.4044 -0.0350 0.0660 0.0414 65 PRO A CB 32 C CG . PRO A 6 ? 0.5745 0.6483 0.6689 -0.0350 0.0648 0.0389 65 PRO A CG 33 C CD . PRO A 6 ? 0.5428 0.6158 0.6382 -0.0364 0.0617 0.0362 65 PRO A CD 34 N N . ILE A 7 ? 0.5191 0.5981 0.6399 -0.0365 0.0654 0.0439 66 ILE A N 35 C CA . ILE A 7 ? 0.6648 0.7462 0.7926 -0.0366 0.0652 0.0455 66 ILE A CA 36 C C . ILE A 7 ? 0.5191 0.6017 0.6434 -0.0355 0.0651 0.0461 66 ILE A C 37 O O . ILE A 7 ? 0.4969 0.5788 0.6141 -0.0344 0.0660 0.0461 66 ILE A O 38 C CB . ILE A 7 ? 0.6596 0.7422 0.7936 -0.0360 0.0681 0.0487 66 ILE A CB 39 C CG1 . ILE A 7 ? 0.5252 0.6078 0.6545 -0.0339 0.0712 0.0509 66 ILE A CG1 40 C CG2 . ILE A 7 ? 0.6781 0.7597 0.8165 -0.0372 0.0681 0.0481 66 ILE A CG2 41 C CD1 . ILE A 7 ? 0.6816 0.7655 0.8165 -0.0328 0.0742 0.0544 66 ILE A CD1 42 N N . PRO A 8 ? 0.5989 0.6834 0.7284 -0.0358 0.0641 0.0466 67 PRO A N 43 C CA . PRO A 8 ? 0.4490 0.5350 0.5757 -0.0345 0.0645 0.0479 67 PRO A CA 44 C C . PRO A 8 ? 0.5962 0.6831 0.7218 -0.0327 0.0678 0.0513 67 PRO A C 45 O O . PRO A 8 ? 0.4611 0.5488 0.5925 -0.0324 0.0697 0.0537 67 PRO A O 46 C CB . PRO A 8 ? 0.4134 0.5015 0.5476 -0.0352 0.0632 0.0482 67 PRO A CB 47 C CG . PRO A 8 ? 0.4854 0.5723 0.6236 -0.0370 0.0609 0.0456 67 PRO A CG 48 C CD . PRO A 8 ? 0.5513 0.6365 0.6886 -0.0373 0.0622 0.0456 67 PRO A CD 49 N N . PRO A 9 ? 0.6505 0.7370 0.7685 -0.0313 0.0685 0.0516 68 PRO A N 50 C CA . PRO A 9 ? 0.6147 0.7017 0.7305 -0.0292 0.0714 0.0547 68 PRO A CA 51 C C . PRO A 9 ? 0.6093 0.6988 0.7316 -0.0283 0.0730 0.0582 68 PRO A C 52 O O . PRO A 9 ? 0.6627 0.7524 0.7861 -0.0267 0.0757 0.0610 68 PRO A O 53 C CB . PRO A 9 ? 0.5961 0.6827 0.7033 -0.0282 0.0709 0.0540 68 PRO A CB 54 C CG . PRO A 9 ? 0.6788 0.7653 0.7851 -0.0296 0.0679 0.0512 68 PRO A CG 55 C CD . PRO A 9 ? 0.5683 0.6539 0.6794 -0.0315 0.0664 0.0490 68 PRO A CD 56 N N . SER A 10 ? 0.4734 0.5644 0.5997 -0.0290 0.0714 0.0580 69 SER A N 57 C CA . SER A 10 ? 0.6229 0.7163 0.7559 -0.0283 0.0727 0.0611 69 SER A CA 58 C C . SER A 10 ? 0.6942 0.7877 0.8352 -0.0288 0.0743 0.0625 69 SER A C 59 O O . SER A 10 ? 0.7818 0.8767 0.9276 -0.0277 0.0766 0.0658 69 SER A O 60 C CB . SER A 10 ? 0.3827 0.4777 0.5185 -0.0293 0.0703 0.0600 69 SER A CB 61 O OG . SER A 10 ? 0.6309 0.7254 0.7715 -0.0314 0.0681 0.0573 69 SER A OG 62 N N . LEU A 11 ? 0.6099 0.7019 0.7524 -0.0305 0.0731 0.0600 70 LEU A N 63 C CA . LEU A 11 ? 0.5671 0.6590 0.7168 -0.0312 0.0745 0.0610 70 LEU A CA 64 C C . LEU A 11 ? 0.5641 0.6543 0.7105 -0.0300 0.0771 0.0621 70 LEU A C 65 O O . LEU A 11 ? 0.5641 0.6538 0.7153 -0.0303 0.0784 0.0627 70 LEU A O 66 C CB . LEU A 11 ? 0.5097 0.6008 0.6630 -0.0336 0.0718 0.0579 70 LEU A CB 67 C CG . LEU A 11 ? 0.6151 0.7078 0.7733 -0.0348 0.0692 0.0567 70 LEU A CG 68 C CD1 . LEU A 11 ? 0.3018 0.3932 0.4625 -0.0369 0.0664 0.0533 70 LEU A CD1 69 C CD2 . LEU A 11 ? 0.3007 0.3957 0.4674 -0.0344 0.0708 0.0597 70 LEU A CD2 70 N N . GLY A 12 ? 0.7013 0.7907 0.8397 -0.0284 0.0778 0.0622 71 GLY A N 71 C CA . GLY A 12 ? 0.6856 0.7734 0.8202 -0.0270 0.0801 0.0630 71 GLY A CA 72 C C . GLY A 12 ? 0.7679 0.8567 0.9020 -0.0243 0.0831 0.0667 71 GLY A C 73 O O . GLY A 12 ? 0.8093 0.9000 0.9467 -0.0236 0.0834 0.0689 71 GLY A O 74 N N . GLU A 13 ? 0.6577 0.7450 0.7876 -0.0226 0.0852 0.0674 72 GLU A N 75 C CA . GLU A 13 ? 0.8895 0.9774 1.0181 -0.0195 0.0879 0.0708 72 GLU A CA 76 C C . GLU A 13 ? 0.8790 0.9677 1.0020 -0.0184 0.0870 0.0713 72 GLU A C 77 O O . GLU A 13 ? 0.8011 0.8889 0.9174 -0.0189 0.0853 0.0689 72 GLU A O 78 C CB . GLU A 13 ? 1.0337 1.1196 1.1581 -0.0179 0.0900 0.0708 72 GLU A CB 79 C CG . GLU A 13 ? 1.2218 1.3067 1.3513 -0.0182 0.0917 0.0711 72 GLU A CG 80 C CD . GLU A 13 ? 1.3161 1.3993 1.4416 -0.0159 0.0943 0.0717 72 GLU A CD 81 O OE1 . GLU A 13 ? 1.3338 1.4165 1.4528 -0.0139 0.0947 0.0720 72 GLU A OE1 82 O OE2 . GLU A 13 ? 1.3253 1.4075 1.4539 -0.0160 0.0958 0.0717 72 GLU A OE2 83 N N . LYS A 14 ? 0.8505 0.9409 0.9765 -0.0168 0.0882 0.0745 73 LYS A N 84 C CA . LYS A 14 ? 0.8229 0.9143 0.9439 -0.0156 0.0874 0.0754 73 LYS A CA 85 C C . LYS A 14 ? 0.8934 0.9835 1.0065 -0.0133 0.0885 0.0758 73 LYS A C 86 O O . LYS A 14 ? 1.0077 1.0971 1.1209 -0.0109 0.0911 0.0780 73 LYS A O 87 C CB . LYS A 14 ? 0.7670 0.8605 0.8931 -0.0143 0.0885 0.0790 73 LYS A CB 88 C CG . LYS A 14 ? 0.9668 1.0621 1.0989 -0.0167 0.0865 0.0781 73 LYS A CG 89 C CD . LYS A 14 ? 1.1637 1.2591 1.2899 -0.0180 0.0835 0.0752 73 LYS A CD 90 C CE . LYS A 14 ? 1.2024 1.2989 1.3336 -0.0206 0.0810 0.0732 73 LYS A CE 91 N NZ . LYS A 14 ? 1.0010 1.0958 1.1285 -0.0227 0.0786 0.0689 73 LYS A NZ 92 N N . ASP A 15 ? 0.9477 1.0374 1.0540 -0.0138 0.0866 0.0737 74 ASP A N 93 C CA . ASP A 15 ? 0.9073 0.9958 1.0057 -0.0118 0.0872 0.0737 74 ASP A CA 94 C C . ASP A 15 ? 0.9431 1.0327 1.0403 -0.0089 0.0886 0.0774 74 ASP A C 95 O O . ASP A 15 ? 0.9627 1.0539 1.0600 -0.0090 0.0876 0.0783 74 ASP A O 96 C CB . ASP A 15 ? 0.7405 0.8282 0.8323 -0.0134 0.0846 0.0703 74 ASP A CB 97 C CG . ASP A 15 ? 0.8991 0.9854 0.9829 -0.0116 0.0852 0.0698 74 ASP A CG 98 O OD1 . ASP A 15 ? 1.0131 1.0989 1.0912 -0.0125 0.0834 0.0675 74 ASP A OD1 99 O OD2 . ASP A 15 ? 1.1423 1.2280 1.2257 -0.0093 0.0874 0.0716 74 ASP A OD2 100 N N . LEU A 16 ? 0.9098 0.9986 1.0058 -0.0060 0.0911 0.0795 75 LEU A N 101 C CA . LEU A 16 ? 0.9460 1.0356 1.0412 -0.0028 0.0927 0.0833 75 LEU A CA 102 C C . LEU A 16 ? 0.8319 0.9208 0.9185 -0.0011 0.0921 0.0830 75 LEU A C 103 O O . LEU A 16 ? 0.7635 0.8528 0.8480 0.0018 0.0931 0.0860 75 LEU A O 104 C CB . LEU A 16 ? 0.8997 0.9887 0.9989 -0.0003 0.0958 0.0861 75 LEU A CB 105 C CG . LEU A 16 ? 0.8568 0.9464 0.9649 -0.0016 0.0969 0.0869 75 LEU A CG 106 C CD1 . LEU A 16 ? 0.8113 0.8999 0.9221 0.0015 0.1002 0.0898 75 LEU A CD1 107 C CD2 . LEU A 16 ? 0.7098 0.8017 0.8231 -0.0027 0.0960 0.0884 75 LEU A CD2 108 N N . SER A 17 ? 0.7413 0.8289 0.8228 -0.0028 0.0905 0.0794 76 SER A N 109 C CA . SER A 17 ? 0.7789 0.8656 0.8523 -0.0014 0.0900 0.0786 76 SER A CA 110 C C . SER A 17 ? 0.7395 0.8275 0.8095 -0.0014 0.0884 0.0794 76 SER A C 111 O O . SER A 17 ? 0.7425 0.8319 0.8155 -0.0033 0.0871 0.0790 76 SER A O 112 C CB . SER A 17 ? 0.6585 0.7435 0.7278 -0.0035 0.0886 0.0744 76 SER A CB 113 O OG . SER A 17 ? 0.8962 0.9805 0.9578 -0.0026 0.0879 0.0734 76 SER A OG 114 N N . ASP A 18 ? 0.8645 0.9521 0.9283 0.0010 0.0887 0.0803 77 ASP A N 115 C CA . ASP A 18 ? 0.8040 0.8925 0.8633 0.0013 0.0873 0.0810 77 ASP A CA 116 C C . ASP A 18 ? 0.7127 0.8004 0.7672 -0.0013 0.0850 0.0770 77 ASP A C 117 O O . ASP A 18 ? 0.6279 0.7140 0.6776 -0.0013 0.0849 0.0748 77 ASP A O 118 C CB . ASP A 18 ? 0.8803 0.9684 0.9347 0.0050 0.0884 0.0836 77 ASP A CB 119 C CG . ASP A 18 ? 0.9333 1.0225 0.9831 0.0055 0.0870 0.0847 77 ASP A CG 120 O OD1 . ASP A 18 ? 0.9863 1.0768 1.0378 0.0034 0.0856 0.0840 77 ASP A OD1 121 O OD2 . ASP A 18 ? 0.9581 1.0468 1.0026 0.0082 0.0874 0.0862 77 ASP A OD2 122 N N . PRO A 19 ? 0.6562 0.7451 0.7119 -0.0035 0.0833 0.0759 78 PRO A N 123 C CA . PRO A 19 ? 0.5206 0.6086 0.5719 -0.0059 0.0812 0.0720 78 PRO A CA 124 C C . PRO A 19 ? 0.5270 0.6143 0.5698 -0.0047 0.0806 0.0715 78 PRO A C 125 O O . PRO A 19 ? 0.6812 0.7674 0.7195 -0.0064 0.0792 0.0684 78 PRO A O 126 C CB . PRO A 19 ? 0.6382 0.7278 0.6931 -0.0078 0.0797 0.0717 78 PRO A CB 127 C CG . PRO A 19 ? 0.6167 0.7078 0.6795 -0.0071 0.0811 0.0747 78 PRO A CG 128 C CD . PRO A 19 ? 0.6114 0.7024 0.6731 -0.0038 0.0832 0.0780 78 PRO A CD 129 N N . PHE A 20 ? 0.6125 0.7003 0.6530 -0.0018 0.0817 0.0747 79 PHE A N 130 C CA . PHE A 20 ? 0.8052 0.8923 0.8378 -0.0005 0.0812 0.0746 79 PHE A CA 131 C C . PHE A 20 ? 0.8157 0.9018 0.8454 0.0025 0.0827 0.0762 79 PHE A C 132 O O . PHE A 20 ? 0.7535 0.8396 0.7783 0.0047 0.0827 0.0780 79 PHE A O 133 C CB . PHE A 20 ? 0.6970 0.7858 0.7284 0.0003 0.0805 0.0769 79 PHE A CB 134 C CG . PHE A 20 ? 0.6367 0.7266 0.6708 -0.0023 0.0790 0.0753 79 PHE A CG 135 C CD1 . PHE A 20 ? 0.7077 0.7969 0.7369 -0.0041 0.0772 0.0721 79 PHE A CD1 136 C CD2 . PHE A 20 ? 0.4660 0.5575 0.5078 -0.0029 0.0793 0.0768 79 PHE A CD2 137 C CE1 . PHE A 20 ? 0.6026 0.6926 0.6343 -0.0063 0.0757 0.0704 79 PHE A CE1 138 C CE2 . PHE A 20 ? 0.5019 0.5944 0.5464 -0.0052 0.0777 0.0751 79 PHE A CE2 139 C CZ . PHE A 20 ? 0.6374 0.7291 0.6768 -0.0069 0.0759 0.0719 79 PHE A CZ 140 N N . ASN A 21 ? 0.9126 0.9977 0.9453 0.0026 0.0839 0.0755 80 ASN A N 141 C CA . ASN A 21 ? 0.8652 0.9491 0.8953 0.0053 0.0853 0.0764 80 ASN A CA 142 C C . ASN A 21 ? 0.8103 0.8924 0.8342 0.0046 0.0845 0.0730 80 ASN A C 143 O O . ASN A 21 ? 1.0747 1.1554 1.0980 0.0053 0.0853 0.0719 80 ASN A O 144 C CB . ASN A 21 ? 0.9685 1.0520 1.0044 0.0060 0.0871 0.0772 80 ASN A CB 145 C CG . ASN A 21 ? 1.0011 1.0835 1.0350 0.0095 0.0888 0.0787 80 ASN A CG 146 O OD1 . ASN A 21 ? 1.0481 1.1304 1.0774 0.0120 0.0887 0.0804 80 ASN A OD1 147 N ND2 . ASN A 21 ? 0.9942 1.0757 1.0314 0.0099 0.0902 0.0782 80 ASN A ND2 148 N N . PHE A 22 ? 0.6489 0.7310 0.6681 0.0031 0.0828 0.0713 81 PHE A N 149 C CA . PHE A 22 ? 0.7606 0.8410 0.7737 0.0024 0.0821 0.0683 81 PHE A CA 150 C C . PHE A 22 ? 0.8485 0.9289 0.8551 0.0042 0.0816 0.0694 81 PHE A C 151 O O . PHE A 22 ? 0.8929 0.9746 0.8990 0.0050 0.0812 0.0717 81 PHE A O 152 C CB . PHE A 22 ? 0.7346 0.8145 0.7475 -0.0011 0.0806 0.0646 81 PHE A CB 153 C CG . PHE A 22 ? 0.6890 0.7700 0.7014 -0.0024 0.0792 0.0647 81 PHE A CG 154 C CD1 . PHE A 22 ? 0.4757 0.5562 0.4817 -0.0027 0.0781 0.0635 81 PHE A CD1 155 C CD2 . PHE A 22 ? 0.5728 0.6553 0.5912 -0.0034 0.0791 0.0659 81 PHE A CD2 156 C CE1 . PHE A 22 ? 0.5190 0.6005 0.5242 -0.0037 0.0769 0.0634 81 PHE A CE1 157 C CE2 . PHE A 22 ? 0.5069 0.5905 0.5249 -0.0044 0.0778 0.0659 81 PHE A CE2 158 C CZ . PHE A 22 ? 0.5006 0.5837 0.5118 -0.0046 0.0767 0.0646 81 PHE A CZ 159 N N . LEU A 23 ? 0.9409 1.0198 0.9425 0.0049 0.0816 0.0677 82 LEU A N 160 C CA . LEU A 23 ? 0.8728 0.9514 0.8678 0.0066 0.0811 0.0684 82 LEU A CA 161 C C . LEU A 23 ? 0.8311 0.9090 0.8214 0.0041 0.0796 0.0655 82 LEU A C 162 O O . LEU A 23 ? 0.9854 1.0622 0.9756 0.0018 0.0792 0.0621 82 LEU A O 163 C CB . LEU A 23 ? 1.0251 1.1023 1.0173 0.0089 0.0819 0.0680 82 LEU A CB 164 C CG . LEU A 23 ? 1.1681 1.2455 1.1625 0.0125 0.0833 0.0713 82 LEU A CG 165 C CD1 . LEU A 23 ? 1.1555 1.2333 1.1568 0.0122 0.0846 0.0719 82 LEU A CD1 166 C CD2 . LEU A 23 ? 1.1757 1.2517 1.1660 0.0148 0.0837 0.0705 82 LEU A CD2 167 N N . PHE A 24 ? 0.9504 1.0290 0.9368 0.0048 0.0788 0.0669 83 PHE A N 168 C CA . PHE A 24 ? 0.9952 1.0732 0.9766 0.0029 0.0776 0.0643 83 PHE A CA 169 C C . PHE A 24 ? 1.0553 1.1328 1.0296 0.0047 0.0772 0.0652 83 PHE A C 170 O O . PHE A 24 ? 1.0637 1.1397 1.0337 0.0047 0.0772 0.0631 83 PHE A O 171 C CB . PHE A 24 ? 0.9117 0.9909 0.8953 0.0010 0.0767 0.0642 83 PHE A CB 172 C CG . PHE A 24 ? 0.8755 0.9536 0.8551 -0.0014 0.0755 0.0607 83 PHE A CG 173 C CD1 . PHE A 24 ? 0.6936 0.7703 0.6746 -0.0037 0.0753 0.0573 83 PHE A CD1 174 C CD2 . PHE A 24 ? 0.7232 0.8014 0.6972 -0.0011 0.0747 0.0609 83 PHE A CD2 175 C CE1 . PHE A 24 ? 0.7246 0.8000 0.7017 -0.0056 0.0743 0.0541 83 PHE A CE1 176 C CE2 . PHE A 24 ? 0.7387 0.8156 0.7087 -0.0031 0.0738 0.0576 83 PHE A CE2 177 C CZ . PHE A 24 ? 0.6738 0.7492 0.6454 -0.0053 0.0736 0.0542 83 PHE A CZ 178 N N . SER A 25 ? 1.1728 1.2518 1.1458 0.0061 0.0769 0.0681 84 SER A N 179 C CA . SER A 25 ? 1.2857 1.3645 1.2520 0.0080 0.0765 0.0695 84 SER A CA 180 C C . SER A 25 ? 1.2279 1.3057 1.1885 0.0060 0.0754 0.0666 84 SER A C 181 O O . SER A 25 ? 1.2527 1.3294 1.2138 0.0035 0.0752 0.0631 84 SER A O 182 C CB . SER A 25 ? 1.2498 1.3274 1.2137 0.0104 0.0771 0.0699 84 SER A CB 183 O OG . SER A 25 ? 1.1965 1.2738 1.1537 0.0122 0.0766 0.0710 84 SER A OG 184 N N . SER A 26 ? 1.1951 1.2733 1.1503 0.0072 0.0748 0.0680 85 SER A N 185 C CA . SER A 26 ? 1.2567 1.3339 1.2062 0.0054 0.0739 0.0654 85 SER A CA 186 C C . SER A 26 ? 1.2202 1.2959 1.1623 0.0065 0.0738 0.0647 85 SER A C 187 O O . SER A 26 ? 1.1946 1.2706 1.1343 0.0092 0.0739 0.0674 85 SER A O 188 C CB . SER A 26 ? 1.1460 1.2248 1.0947 0.0054 0.0732 0.0671 85 SER A CB 189 O OG . SER A 26 ? 1.0396 1.1175 0.9830 0.0038 0.0724 0.0644 85 SER A OG 190 N N . ASN A 27 ? 1.1051 1.1791 1.0436 0.0045 0.0736 0.0611 86 ASN A N 191 C CA . ASN A 27 ? 1.0229 1.0952 0.9543 0.0052 0.0735 0.0599 86 ASN A CA 192 C C . ASN A 27 ? 1.0213 1.0943 0.9469 0.0065 0.0728 0.0620 86 ASN A C 193 O O . ASN A 27 ? 1.1197 1.1931 1.0436 0.0053 0.0723 0.0613 86 ASN A O 194 C CB . ASN A 27 ? 0.9155 0.9858 0.8447 0.0026 0.0735 0.0555 86 ASN A CB 195 C CG . ASN A 27 ? 0.9945 1.0629 0.9170 0.0030 0.0736 0.0540 86 ASN A CG 196 O OD1 . ASN A 27 ? 0.9598 1.0282 0.8765 0.0042 0.0732 0.0552 86 ASN A OD1 197 N ND2 . ASN A 27 ? 1.1455 1.2123 1.0687 0.0021 0.0742 0.0515 86 ASN A ND2 198 N N . LYS A 28 ? 0.9245 0.9976 0.8468 0.0092 0.0728 0.0644 87 LYS A N 199 C CA . LYS A 28 ? 0.9099 0.9837 0.8268 0.0108 0.0722 0.0670 87 LYS A CA 200 C C . LYS A 28 ? 0.9047 0.9768 0.8136 0.0102 0.0719 0.0647 87 LYS A C 201 O O . LYS A 28 ? 0.7763 0.8488 0.6799 0.0109 0.0713 0.0660 87 LYS A O 202 C CB . LYS A 28 ? 0.8392 0.9140 0.7562 0.0142 0.0722 0.0710 87 LYS A CB 203 C CG . LYS A 28 ? 0.9396 1.0158 0.8644 0.0152 0.0729 0.0733 87 LYS A CG 204 C CD . LYS A 28 ? 1.0633 1.1413 0.9922 0.0141 0.0727 0.0744 87 LYS A CD 205 C CE . LYS A 28 ? 1.1987 1.2780 1.1355 0.0151 0.0735 0.0767 87 LYS A CE 206 N NZ . LYS A 28 ? 1.1517 1.2327 1.0933 0.0137 0.0733 0.0774 87 LYS A NZ 207 N N . ILE A 29 ? 0.8130 0.8831 0.7209 0.0089 0.0723 0.0615 88 ILE A N 208 C CA . ILE A 29 ? 0.9707 1.0389 0.8715 0.0082 0.0722 0.0590 88 ILE A CA 209 C C . ILE A 29 ? 1.0027 1.0705 0.9019 0.0059 0.0720 0.0567 88 ILE A C 210 O O . ILE A 29 ? 0.9285 0.9960 0.8215 0.0061 0.0716 0.0567 88 ILE A O 211 C CB . ILE A 29 ? 0.8591 0.9253 0.7598 0.0074 0.0729 0.0561 88 ILE A CB 212 C CG1 . ILE A 29 ? 0.7473 0.8137 0.6489 0.0099 0.0730 0.0582 88 ILE A CG1 213 C CG2 . ILE A 29 ? 0.4847 0.5487 0.3781 0.0063 0.0730 0.0534 88 ILE A CG2 214 C CD1 . ILE A 29 ? 0.8564 0.9233 0.7527 0.0126 0.0724 0.0614 88 ILE A CD1 215 N N . THR A 30 ? 1.0004 1.0682 0.9052 0.0039 0.0722 0.0547 89 THR A N 216 C CA . THR A 30 ? 0.9298 0.9973 0.8343 0.0018 0.0719 0.0524 89 THR A CA 217 C C . THR A 30 ? 0.8196 0.8891 0.7235 0.0026 0.0712 0.0549 89 THR A C 218 O O . THR A 30 ? 0.6473 0.7163 0.5463 0.0022 0.0708 0.0538 89 THR A O 219 C CB . THR A 30 ? 0.9191 0.9864 0.8306 -0.0002 0.0721 0.0504 89 THR A CB 220 O OG1 . THR A 30 ? 0.9325 0.9979 0.8441 -0.0010 0.0728 0.0478 89 THR A OG1 221 C CG2 . THR A 30 ? 0.9685 1.0355 0.8799 -0.0019 0.0716 0.0481 89 THR A CG2 222 N N . LEU A 31 ? 0.7202 0.7919 0.6291 0.0040 0.0711 0.0584 90 LEU A N 223 C CA . LEU A 31 ? 0.7197 0.7936 0.6291 0.0049 0.0704 0.0611 90 LEU A CA 224 C C . LEU A 31 ? 0.7547 0.8284 0.6556 0.0064 0.0700 0.0624 90 LEU A C 225 O O . LEU A 31 ? 0.6580 0.7323 0.5561 0.0061 0.0694 0.0624 90 LEU A O 226 C CB . LEU A 31 ? 0.7043 0.7803 0.6200 0.0065 0.0706 0.0649 90 LEU A CB 227 C CG . LEU A 31 ? 0.7408 0.8192 0.6578 0.0076 0.0701 0.0681 90 LEU A CG 228 C CD1 . LEU A 31 ? 0.5045 0.5834 0.4241 0.0054 0.0696 0.0660 90 LEU A CD1 229 C CD2 . LEU A 31 ? 0.8027 0.8828 0.7260 0.0094 0.0705 0.0718 90 LEU A CD2 230 N N . ARG A 32 ? 0.9434 1.0162 0.8403 0.0080 0.0702 0.0635 91 ARG A N 231 C CA . ARG A 32 ? 1.0460 1.1185 0.9346 0.0097 0.0697 0.0649 91 ARG A CA 232 C C . ARG A 32 ? 0.9728 1.0433 0.8546 0.0081 0.0697 0.0614 91 ARG A C 233 O O . ARG A 32 ? 0.8475 0.9181 0.7231 0.0088 0.0692 0.0621 91 ARG A O 234 C CB . ARG A 32 ? 1.0484 1.1203 0.9350 0.0118 0.0699 0.0667 91 ARG A CB 235 C CG . ARG A 32 ? 1.0352 1.1063 0.9129 0.0135 0.0695 0.0678 91 ARG A CG 236 C CD . ARG A 32 ? 1.0985 1.1689 0.9751 0.0155 0.0696 0.0691 91 ARG A CD 237 N NE . ARG A 32 ? 1.1325 1.2010 1.0113 0.0141 0.0703 0.0658 91 ARG A NE 238 C CZ . ARG A 32 ? 1.1959 1.2623 1.0699 0.0128 0.0707 0.0626 91 ARG A CZ 239 N NH1 . ARG A 32 ? 1.2937 1.3592 1.1599 0.0129 0.0704 0.0622 91 ARG A NH1 240 N NH2 . ARG A 32 ? 1.1005 1.1654 0.9772 0.0115 0.0714 0.0597 91 ARG A NH2 241 N N . LYS A 33 ? 0.7723 0.8408 0.6549 0.0062 0.0704 0.0577 92 LYS A N 242 C CA . LYS A 33 ? 0.6513 0.7176 0.5280 0.0048 0.0706 0.0541 92 LYS A CA 243 C C . LYS A 33 ? 0.8673 0.9343 0.7440 0.0037 0.0701 0.0530 92 LYS A C 244 O O . LYS A 33 ? 0.6825 0.7484 0.5524 0.0037 0.0700 0.0518 92 LYS A O 245 C CB . LYS A 33 ? 0.6001 0.6641 0.4785 0.0031 0.0714 0.0505 92 LYS A CB 246 C CG . LYS A 33 ? 0.5579 0.6208 0.4348 0.0041 0.0719 0.0509 92 LYS A CG 247 C CD . LYS A 33 ? 0.7540 0.8147 0.6325 0.0023 0.0728 0.0472 92 LYS A CD 248 C CE . LYS A 33 ? 0.8927 0.9522 0.7686 0.0034 0.0733 0.0473 92 LYS A CE 249 N NZ . LYS A 33 ? 1.0092 1.0669 0.8878 0.0018 0.0741 0.0440 92 LYS A NZ 250 N N . LEU A 34 ? 0.9814 1.0500 0.8657 0.0030 0.0698 0.0535 93 LEU A N 251 C CA . LEU A 34 ? 0.9238 0.9933 0.8090 0.0021 0.0692 0.0527 93 LEU A CA 252 C C . LEU A 34 ? 0.8732 0.9447 0.7550 0.0038 0.0684 0.0558 93 LEU A C 253 O O . LEU A 34 ? 0.7700 0.8414 0.6478 0.0036 0.0680 0.0547 93 LEU A O 254 C CB . LEU A 34 ? 0.8859 0.9568 0.7807 0.0009 0.0690 0.0525 93 LEU A CB 255 C CG . LEU A 34 ? 0.7703 0.8394 0.6687 -0.0013 0.0693 0.0487 93 LEU A CG 256 C CD1 . LEU A 34 ? 0.7791 0.8463 0.6725 -0.0023 0.0691 0.0452 93 LEU A CD1 257 C CD2 . LEU A 34 ? 0.7230 0.7904 0.6218 -0.0016 0.0702 0.0476 93 LEU A CD2 258 N N . TYR A 35 ? 0.9726 1.0458 0.8559 0.0057 0.0684 0.0598 94 TYR A N 259 C CA . TYR A 35 ? 1.0464 1.1215 0.9263 0.0075 0.0677 0.0633 94 TYR A CA 260 C C . TYR A 35 ? 0.9848 1.0584 0.8543 0.0082 0.0676 0.0625 94 TYR A C 261 O O . TYR A 35 ? 0.8448 0.9190 0.7101 0.0085 0.0670 0.0626 94 TYR A O 262 C CB . TYR A 35 ? 0.9655 1.0422 0.8484 0.0097 0.0677 0.0677 94 TYR A CB 263 C CG . TYR A 35 ? 0.9637 1.0426 0.8561 0.0096 0.0678 0.0696 94 TYR A CG 264 C CD1 . TYR A 35 ? 0.9180 0.9976 0.8156 0.0077 0.0676 0.0678 94 TYR A CD1 265 C CD2 . TYR A 35 ? 0.9506 1.0306 0.8466 0.0116 0.0680 0.0734 94 TYR A CD2 266 C CE1 . TYR A 35 ? 0.9056 0.9873 0.8121 0.0076 0.0677 0.0696 94 TYR A CE1 267 C CE2 . TYR A 35 ? 0.9222 1.0041 0.8269 0.0117 0.0683 0.0752 94 TYR A CE2 268 C CZ . TYR A 35 ? 0.9948 1.0776 0.9047 0.0095 0.0681 0.0733 94 TYR A CZ 269 O OH . TYR A 35 ? 1.0748 1.1594 0.9934 0.0095 0.0684 0.0752 94 TYR A OH 270 N N . ASP A 36 ? 0.9348 1.0063 0.8002 0.0086 0.0681 0.0616 95 ASP A N 271 C CA . ASP A 36 ? 0.9734 1.0433 0.8289 0.0093 0.0681 0.0610 95 ASP A CA 272 C C . ASP A 36 ? 0.8609 0.9291 0.7117 0.0078 0.0683 0.0571 95 ASP A C 273 O O . ASP A 36 ? 0.8996 0.9675 0.7429 0.0086 0.0680 0.0573 95 ASP A O 274 C CB . ASP A 36 ? 1.1802 1.2480 1.0335 0.0097 0.0688 0.0603 95 ASP A CB 275 C CG . ASP A 36 ? 1.3454 1.4117 1.1887 0.0108 0.0688 0.0602 95 ASP A CG 276 O OD1 . ASP A 36 ? 1.3925 1.4597 1.2306 0.0119 0.0681 0.0620 95 ASP A OD1 277 O OD2 . ASP A 36 ? 1.3633 1.4273 1.2038 0.0105 0.0694 0.0583 95 ASP A OD2 278 N N . LEU A 37 ? 0.7053 0.7723 0.5604 0.0058 0.0688 0.0536 96 LEU A N 279 C CA . LEU A 37 ? 0.7650 0.8299 0.6159 0.0045 0.0690 0.0497 96 LEU A CA 280 C C . LEU A 37 ? 0.7705 0.8370 0.6220 0.0043 0.0682 0.0496 96 LEU A C 281 O O . LEU A 37 ? 0.9293 0.9942 0.7768 0.0037 0.0683 0.0464 96 LEU A O 282 C CB . LEU A 37 ? 0.8373 0.9002 0.6927 0.0025 0.0698 0.0461 96 LEU A CB 283 C CG . LEU A 37 ? 0.8900 0.9504 0.7428 0.0023 0.0708 0.0446 96 LEU A CG 284 C CD1 . LEU A 37 ? 0.8508 0.9103 0.7106 0.0006 0.0713 0.0423 96 LEU A CD1 285 C CD2 . LEU A 37 ? 0.9396 0.9972 0.7832 0.0023 0.0715 0.0419 96 LEU A CD2 286 N N . THR A 38 ? 0.8217 0.8912 0.6782 0.0051 0.0674 0.0530 97 THR A N 287 C CA . THR A 38 ? 0.8779 0.9492 0.7367 0.0049 0.0666 0.0530 97 THR A CA 288 C C . THR A 38 ? 0.8622 0.9362 0.7193 0.0067 0.0658 0.0571 97 THR A C 289 O O . THR A 38 ? 0.8923 0.9682 0.7516 0.0067 0.0651 0.0576 97 THR A O 290 C CB . THR A 38 ? 0.6387 0.7113 0.5081 0.0035 0.0664 0.0525 97 THR A CB 291 O OG1 . THR A 38 ? 0.6811 0.7551 0.5565 0.0040 0.0666 0.0556 97 THR A OG1 292 C CG2 . THR A 38 ? 0.6396 0.7096 0.5104 0.0016 0.0669 0.0480 97 THR A CG2 293 N N . LYS A 39 ? 0.7766 0.8508 0.6298 0.0084 0.0660 0.0601 98 LYS A N 294 C CA . LYS A 39 ? 0.9673 1.0440 0.8189 0.0104 0.0653 0.0645 98 LYS A CA 295 C C . LYS A 39 ? 0.9314 1.0084 0.7755 0.0109 0.0647 0.0640 98 LYS A C 296 O O . LYS A 39 ? 1.0020 1.0813 0.8456 0.0123 0.0639 0.0673 98 LYS A O 297 C CB . LYS A 39 ? 1.0006 1.0769 0.8484 0.0123 0.0654 0.0675 98 LYS A CB 298 C CG . LYS A 39 ? 1.1031 1.1766 0.9413 0.0125 0.0658 0.0655 98 LYS A CG 299 C CD . LYS A 39 ? 1.1272 1.2005 0.9617 0.0146 0.0657 0.0687 98 LYS A CD 300 C CE . LYS A 39 ? 1.0803 1.1508 0.9056 0.0147 0.0662 0.0666 98 LYS A CE 301 N NZ . LYS A 39 ? 1.0000 1.0679 0.8266 0.0126 0.0672 0.0621 98 LYS A NZ 302 N N . ASN A 40 ? 0.9947 1.0692 0.8329 0.0100 0.0650 0.0600 99 ASN A N 303 C CA . ASN A 40 ? 1.0916 1.1660 0.9220 0.0105 0.0645 0.0591 99 ASN A CA 304 C C . ASN A 40 ? 0.9951 1.0695 0.8283 0.0092 0.0642 0.0556 99 ASN A C 305 O O . ASN A 40 ? 0.9716 1.0456 0.7986 0.0095 0.0639 0.0540 99 ASN A O 306 C CB . ASN A 40 ? 1.1479 1.2193 0.9678 0.0110 0.0652 0.0572 99 ASN A CB 307 C CG . ASN A 40 ? 1.0873 1.1588 0.8978 0.0121 0.0648 0.0572 99 ASN A CG 308 O OD1 . ASN A 40 ? 0.9383 1.0124 0.7493 0.0132 0.0638 0.0599 99 ASN A OD1 309 N ND2 . ASN A 40 ? 1.2335 1.3005 1.0371 0.0116 0.0649 0.0534 99 ASN A ND2 310 N N . VAL A 41 ? 0.9964 1.0712 0.8390 0.0077 0.0643 0.0544 100 VAL A N 311 C CA . VAL A 41 ? 0.9638 1.0387 0.8100 0.0064 0.0638 0.0512 100 VAL A CA 312 C C . VAL A 41 ? 0.9199 0.9983 0.7711 0.0068 0.0628 0.0536 100 VAL A C 313 O O . VAL A 41 ? 0.8419 0.9226 0.7007 0.0070 0.0626 0.0568 100 VAL A O 314 C CB . VAL A 41 ? 0.7750 0.8487 0.6290 0.0046 0.0642 0.0487 100 VAL A CB 315 C CG1 . VAL A 41 ? 0.6149 0.6887 0.4726 0.0035 0.0636 0.0454 100 VAL A CG1 316 C CG2 . VAL A 41 ? 0.7134 0.7837 0.5628 0.0041 0.0653 0.0462 100 VAL A CG2 317 N N . ASP A 42 ? 1.0325 1.1111 0.8795 0.0071 0.0621 0.0518 101 ASP A N 318 C CA . ASP A 42 ? 1.0209 1.1027 0.8727 0.0074 0.0611 0.0534 101 ASP A CA 319 C C . ASP A 42 ? 1.0029 1.0849 0.8636 0.0057 0.0607 0.0506 101 ASP A C 320 O O . ASP A 42 ? 1.1288 1.2097 0.9875 0.0053 0.0602 0.0468 101 ASP A O 321 C CB . ASP A 42 ? 1.1309 1.2130 0.9740 0.0086 0.0605 0.0528 101 ASP A CB 322 C CG . ASP A 42 ? 1.1546 1.2402 1.0023 0.0091 0.0594 0.0550 101 ASP A CG 323 O OD1 . ASP A 42 ? 1.0934 1.1813 0.9507 0.0086 0.0592 0.0574 101 ASP A OD1 324 O OD2 . ASP A 42 ? 1.2905 1.3767 1.1321 0.0100 0.0588 0.0542 101 ASP A OD2 325 N N . PHE A 43 ? 0.9714 1.0547 0.8418 0.0049 0.0608 0.0524 102 PHE A N 326 C CA . PHE A 43 ? 0.9364 1.0198 0.8156 0.0033 0.0604 0.0499 102 PHE A CA 327 C C . PHE A 43 ? 0.9221 1.0078 0.8049 0.0032 0.0592 0.0493 102 PHE A C 328 O O . PHE A 43 ? 1.0242 1.1090 0.9102 0.0022 0.0586 0.0457 102 PHE A O 329 C CB . PHE A 43 ? 0.9131 0.9976 0.8016 0.0025 0.0608 0.0523 102 PHE A CB 330 C CG . PHE A 43 ? 0.9392 1.0211 0.8260 0.0021 0.0619 0.0515 102 PHE A CG 331 C CD1 . PHE A 43 ? 0.9400 1.0192 0.8277 0.0007 0.0621 0.0474 102 PHE A CD1 332 C CD2 . PHE A 43 ? 0.8382 0.9203 0.7226 0.0032 0.0626 0.0548 102 PHE A CD2 333 C CE1 . PHE A 43 ? 0.7781 0.8551 0.6645 0.0002 0.0631 0.0466 102 PHE A CE1 334 C CE2 . PHE A 43 ? 0.7537 0.8334 0.6367 0.0028 0.0635 0.0540 102 PHE A CE2 335 C CZ . PHE A 43 ? 0.6882 0.7655 0.5723 0.0013 0.0638 0.0498 102 PHE A CZ 336 N N . ASP A 44 ? 0.9802 1.0687 0.8625 0.0044 0.0588 0.0529 103 ASP A N 337 C CA . ASP A 44 ? 0.9489 1.0399 0.8348 0.0045 0.0577 0.0528 103 ASP A CA 338 C C . ASP A 44 ? 0.8456 0.9349 0.7253 0.0046 0.0570 0.0482 103 ASP A C 339 O O . ASP A 44 ? 0.7386 0.8285 0.6236 0.0038 0.0561 0.0456 103 ASP A O 340 C CB . ASP A 44 ? 0.9821 1.0761 0.8665 0.0061 0.0575 0.0575 103 ASP A CB 341 C CG . ASP A 44 ? 1.0169 1.1130 0.9097 0.0062 0.0580 0.0620 103 ASP A CG 342 O OD1 . ASP A 44 ? 1.0746 1.1705 0.9760 0.0048 0.0582 0.0613 103 ASP A OD1 343 O OD2 . ASP A 44 ? 1.1646 1.2624 1.0552 0.0077 0.0581 0.0663 103 ASP A OD2 344 N N . GLN A 45 ? 0.8279 0.9151 0.6965 0.0056 0.0574 0.0471 104 GLN A N 345 C CA . GLN A 45 ? 0.8529 0.9381 0.7146 0.0059 0.0570 0.0427 104 GLN A CA 346 C C . GLN A 45 ? 0.9076 0.9896 0.7709 0.0047 0.0573 0.0381 104 GLN A C 347 O O . GLN A 45 ? 0.8853 0.9659 0.7473 0.0047 0.0567 0.0341 104 GLN A O 348 C CB . GLN A 45 ? 0.9235 1.0073 0.7725 0.0075 0.0576 0.0430 104 GLN A CB 349 C CG . GLN A 45 ? 1.3377 1.4182 1.1809 0.0074 0.0589 0.0424 104 GLN A CG 350 C CD . GLN A 45 ? 1.4431 1.5223 1.2740 0.0089 0.0594 0.0430 104 GLN A CD 351 O OE1 . GLN A 45 ? 1.3751 1.4563 1.2019 0.0102 0.0587 0.0447 104 GLN A OE1 352 N NE2 . GLN A 45 ? 1.4282 1.5042 1.2532 0.0089 0.0605 0.0417 104 GLN A NE2 353 N N . LEU A 46 ? 0.9255 1.0061 0.7913 0.0039 0.0582 0.0388 105 LEU A N 354 C CA . LEU A 46 ? 0.7688 0.8462 0.6363 0.0027 0.0586 0.0349 105 LEU A CA 355 C C . LEU A 46 ? 0.8439 0.9225 0.7219 0.0015 0.0576 0.0333 105 LEU A C 356 O O . LEU A 46 ? 0.7923 0.8687 0.6701 0.0012 0.0571 0.0291 105 LEU A O 357 C CB . LEU A 46 ? 0.6492 0.7253 0.5172 0.0021 0.0599 0.0365 105 LEU A CB 358 C CG . LEU A 46 ? 0.5883 0.6603 0.4532 0.0015 0.0607 0.0326 105 LEU A CG 359 C CD1 . LEU A 46 ? 0.5960 0.6653 0.4505 0.0025 0.0610 0.0293 105 LEU A CD1 360 C CD2 . LEU A 46 ? 0.5008 0.5719 0.3649 0.0012 0.0620 0.0347 105 LEU A CD2 361 N N . ARG A 47 ? 0.9126 0.9944 0.7995 0.0010 0.0572 0.0367 106 ARG A N 362 C CA . ARG A 47 ? 0.8651 0.9482 0.7626 -0.0003 0.0562 0.0358 106 ARG A CA 363 C C . ARG A 47 ? 0.8960 0.9798 0.7943 0.0000 0.0548 0.0328 106 ARG A C 364 O O . ARG A 47 ? 0.8484 0.9318 0.7535 -0.0009 0.0539 0.0304 106 ARG A O 365 C CB . ARG A 47 ? 0.7521 0.8387 0.6581 -0.0006 0.0563 0.0405 106 ARG A CB 366 C CG . ARG A 47 ? 0.8997 0.9860 0.8081 -0.0010 0.0575 0.0432 106 ARG A CG 367 C CD . ARG A 47 ? 1.0127 1.1025 0.9283 -0.0008 0.0576 0.0480 106 ARG A CD 368 N NE . ARG A 47 ? 1.0775 1.1692 1.0035 -0.0019 0.0568 0.0476 106 ARG A NE 369 C CZ . ARG A 47 ? 0.9604 1.0522 0.8950 -0.0031 0.0571 0.0480 106 ARG A CZ 370 N NH1 . ARG A 47 ? 0.8331 0.9233 0.7670 -0.0034 0.0582 0.0487 106 ARG A NH1 371 N NH2 . ARG A 47 ? 0.9142 1.0078 0.8580 -0.0041 0.0563 0.0476 106 ARG A NH2 372 N N . GLN A 48 ? 0.9729 1.0574 0.8641 0.0014 0.0545 0.0330 107 GLN A N 373 C CA . GLN A 48 ? 1.0482 1.1338 0.9404 0.0019 0.0530 0.0306 107 GLN A CA 374 C C . GLN A 48 ? 0.7976 0.8799 0.6866 0.0021 0.0525 0.0250 107 GLN A C 375 O O . GLN A 48 ? 0.8464 0.9293 0.7368 0.0025 0.0512 0.0224 107 GLN A O 376 C CB . GLN A 48 ? 1.2058 1.2931 1.0906 0.0035 0.0529 0.0324 107 GLN A CB 377 C CG . GLN A 48 ? 1.3020 1.3862 1.1739 0.0048 0.0535 0.0299 107 GLN A CG 378 C CD . GLN A 48 ? 1.2948 1.3807 1.1594 0.0064 0.0532 0.0312 107 GLN A CD 379 O OE1 . GLN A 48 ? 1.2922 1.3814 1.1615 0.0066 0.0522 0.0327 107 GLN A OE1 380 N NE2 . GLN A 48 ? 1.2498 1.3334 1.1028 0.0076 0.0540 0.0305 107 GLN A NE2 381 N N . ASN A 49 ? 0.7895 0.8682 0.6743 0.0018 0.0535 0.0230 108 ASN A N 382 C CA . ASN A 49 ? 0.8650 0.9401 0.7463 0.0022 0.0532 0.0177 108 ASN A CA 383 C C . ASN A 49 ? 0.7824 0.8560 0.6717 0.0008 0.0529 0.0159 108 ASN A C 384 O O . ASN A 49 ? 0.5975 0.6681 0.4852 0.0011 0.0525 0.0117 108 ASN A O 385 C CB . ASN A 49 ? 0.9545 1.0262 0.8239 0.0033 0.0546 0.0162 108 ASN A CB 386 C CG . ASN A 49 ? 1.0467 1.1188 0.9068 0.0050 0.0545 0.0161 108 ASN A CG 387 O OD1 . ASN A 49 ? 1.1336 1.2077 0.9905 0.0054 0.0550 0.0198 108 ASN A OD1 388 N ND2 . ASN A 49 ? 0.9083 0.9785 0.7640 0.0062 0.0539 0.0118 108 ASN A ND2 389 N N . GLU A 50 ? 0.8072 0.8828 0.7048 -0.0006 0.0532 0.0192 109 GLU A N 390 C CA . GLU A 50 ? 0.9185 0.9929 0.8236 -0.0020 0.0530 0.0179 109 GLU A CA 391 C C . GLU A 50 ? 0.8696 0.9446 0.7816 -0.0022 0.0511 0.0151 109 GLU A C 392 O O . GLU A 50 ? 0.7842 0.8568 0.6990 -0.0028 0.0507 0.0121 109 GLU A O 393 C CB . GLU A 50 ? 0.6516 0.7282 0.5640 -0.0033 0.0536 0.0221 109 GLU A CB 394 C CG . GLU A 50 ? 0.6527 0.7288 0.5592 -0.0031 0.0553 0.0249 109 GLU A CG 395 C CD . GLU A 50 ? 0.7495 0.8278 0.6634 -0.0041 0.0559 0.0289 109 GLU A CD 396 O OE1 . GLU A 50 ? 0.7603 0.8401 0.6837 -0.0051 0.0552 0.0293 109 GLU A OE1 397 O OE2 . GLU A 50 ? 0.7016 0.7798 0.6116 -0.0037 0.0571 0.0316 109 GLU A OE2 398 N N . CYS A 51 ? 0.7742 0.8522 0.6886 -0.0018 0.0501 0.0160 110 CYS A N 399 C CA . CYS A 51 ? 0.9121 0.9907 0.8326 -0.0017 0.0482 0.0132 110 CYS A CA 400 C C . CYS A 51 ? 0.8750 0.9534 0.7883 0.0001 0.0474 0.0108 110 CYS A C 401 O O . CYS A 51 ? 0.8846 0.9657 0.7955 0.0007 0.0475 0.0132 110 CYS A O 402 C CB . CYS A 51 ? 1.0377 1.1204 0.9696 -0.0030 0.0474 0.0163 110 CYS A CB 403 S SG . CYS A 51 ? 0.8045 0.8884 0.7454 -0.0031 0.0450 0.0130 110 CYS A SG 404 N N . LYS A 52 ? 0.8918 0.9670 0.8016 0.0010 0.0467 0.0060 111 LYS A N 405 C CA . LYS A 52 ? 1.0715 1.1461 0.9741 0.0030 0.0460 0.0030 111 LYS A CA 406 C C . LYS A 52 ? 1.0464 1.1247 0.9551 0.0032 0.0443 0.0035 111 LYS A C 407 O O . LYS A 52 ? 1.1274 1.2083 1.0328 0.0038 0.0445 0.0058 111 LYS A O 408 C CB . LYS A 52 ? 1.0594 1.1295 0.9582 0.0042 0.0455 -0.0024 111 LYS A CB 409 C CG . LYS A 52 ? 1.0439 1.1099 0.9327 0.0049 0.0473 -0.0036 111 LYS A CG 410 C CD . LYS A 52 ? 1.0597 1.1220 0.9399 0.0072 0.0471 -0.0086 111 LYS A CD 411 C CE . LYS A 52 ? 1.1201 1.1810 1.0064 0.0076 0.0452 -0.0126 111 LYS A CE 412 N NZ . LYS A 52 ? 1.1127 1.1692 0.9903 0.0101 0.0453 -0.0175 111 LYS A NZ 413 N N . LYS A 53 ? 1.0113 1.0901 0.9291 0.0026 0.0427 0.0015 112 LYS A N 414 C CA . LYS A 53 ? 0.9288 1.0113 0.8538 0.0026 0.0410 0.0018 112 LYS A CA 415 C C . LYS A 53 ? 0.9103 0.9952 0.8483 0.0005 0.0404 0.0041 112 LYS A C 416 O O . LYS A 53 ? 0.9681 1.0512 0.9114 -0.0003 0.0398 0.0021 112 LYS A O 417 C CB . LYS A 53 ? 0.8705 0.9513 0.7941 0.0042 0.0392 -0.0035 112 LYS A CB 418 C CG . LYS A 53 ? 0.9803 1.0648 0.9083 0.0047 0.0376 -0.0035 112 LYS A CG 419 C CD . LYS A 53 ? 1.0678 1.1505 0.9955 0.0064 0.0356 -0.0091 112 LYS A CD 420 C CE . LYS A 53 ? 1.0256 1.1119 0.9560 0.0071 0.0341 -0.0094 112 LYS A CE 421 N NZ . LYS A 53 ? 0.9396 1.0242 0.8711 0.0088 0.0320 -0.0149 112 LYS A NZ 422 N N . ASN A 54 ? 0.8430 0.9320 0.7860 -0.0003 0.0407 0.0084 113 ASN A N 423 C CA . ASN A 54 ? 0.7706 0.8622 0.7259 -0.0021 0.0404 0.0112 113 ASN A CA 424 C C . ASN A 54 ? 0.8033 0.8972 0.7674 -0.0022 0.0383 0.0093 113 ASN A C 425 O O . ASN A 54 ? 0.8136 0.9110 0.7802 -0.0020 0.0379 0.0112 113 ASN A O 426 C CB . ASN A 54 ? 0.6022 0.6969 0.5586 -0.0028 0.0420 0.0169 113 ASN A CB 427 C CG . ASN A 54 ? 0.6673 0.7640 0.6353 -0.0046 0.0423 0.0200 113 ASN A CG 428 O OD1 . ASN A 54 ? 0.4479 0.5446 0.4243 -0.0055 0.0410 0.0181 113 ASN A OD1 429 N ND2 . ASN A 54 ? 0.6476 0.7459 0.6158 -0.0050 0.0439 0.0248 113 ASN A ND2 430 N N . ILE A 55 ? 0.7833 0.8752 0.7521 -0.0025 0.0369 0.0056 114 ILE A N 431 C CA . ILE A 55 ? 0.8993 0.9931 0.8768 -0.0026 0.0347 0.0035 114 ILE A CA 432 C C . ILE A 55 ? 0.9305 1.0240 0.9188 -0.0043 0.0339 0.0033 114 ILE A C 433 O O . ILE A 55 ? 0.9141 1.0045 0.9011 -0.0048 0.0344 0.0023 114 ILE A O 434 C CB . ILE A 55 ? 0.7234 0.8147 0.6948 -0.0005 0.0331 -0.0020 114 ILE A CB 435 C CG1 . ILE A 55 ? 0.7613 0.8547 0.7418 -0.0004 0.0307 -0.0044 114 ILE A CG1 436 C CG2 . ILE A 55 ? 0.6879 0.7742 0.6540 0.0001 0.0332 -0.0056 114 ILE A CG2 437 C CD1 . ILE A 55 ? 0.8035 0.8946 0.7782 0.0020 0.0290 -0.0099 114 ILE A CD1 438 N N . THR A 56 ? 0.9177 1.0146 0.9168 -0.0052 0.0328 0.0044 115 THR A N 439 C CA . THR A 56 ? 0.7511 0.8481 0.7611 -0.0069 0.0319 0.0042 115 THR A CA 440 C C . THR A 56 ? 0.6483 0.7431 0.6603 -0.0060 0.0294 -0.0012 115 THR A C 441 O O . THR A 56 ? 0.6994 0.7929 0.7046 -0.0041 0.0285 -0.0047 115 THR A O 442 C CB . THR A 56 ? 0.7133 0.8149 0.7346 -0.0083 0.0320 0.0079 115 THR A CB 443 O OG1 . THR A 56 ? 0.7853 0.8891 0.8102 -0.0075 0.0301 0.0059 115 THR A OG1 444 C CG2 . THR A 56 ? 0.4618 0.5656 0.4802 -0.0086 0.0343 0.0132 115 THR A CG2 445 N N . LEU A 57 ? 0.8122 0.9067 0.8334 -0.0073 0.0284 -0.0019 116 LEU A N 446 C CA . LEU A 57 ? 0.8450 0.9372 0.8686 -0.0064 0.0259 -0.0069 116 LEU A CA 447 C C . LEU A 57 ? 0.9081 1.0032 0.9376 -0.0057 0.0238 -0.0087 116 LEU A C 448 O O . LEU A 57 ? 1.0259 1.1192 1.0534 -0.0040 0.0218 -0.0134 116 LEU A O 449 C CB . LEU A 57 ? 0.7069 0.7980 0.7387 -0.0080 0.0253 -0.0069 116 LEU A CB 450 C CG . LEU A 57 ? 0.8181 0.9055 0.8498 -0.0070 0.0231 -0.0119 116 LEU A CG 451 C CD1 . LEU A 57 ? 0.7350 0.8181 0.7543 -0.0051 0.0238 -0.0145 116 LEU A CD1 452 C CD2 . LEU A 57 ? 0.8505 0.9372 0.8906 -0.0088 0.0227 -0.0112 116 LEU A CD2 453 N N . SER A 58 ? 0.9317 1.0311 0.9683 -0.0070 0.0244 -0.0050 117 SER A N 454 C CA . SER A 58 ? 1.0301 1.1326 1.0732 -0.0066 0.0225 -0.0062 117 SER A CA 455 C C . SER A 58 ? 0.9774 1.0801 1.0115 -0.0044 0.0222 -0.0081 117 SER A C 456 O O . SER A 58 ? 1.0430 1.1457 1.0782 -0.0030 0.0200 -0.0122 117 SER A O 457 C CB . SER A 58 ? 0.9035 1.0105 0.9565 -0.0085 0.0235 -0.0013 117 SER A CB 458 O OG . SER A 58 ? 0.9655 1.0743 1.0126 -0.0084 0.0258 0.0028 117 SER A OG 459 N N . LYS A 59 ? 0.8128 0.9157 0.8378 -0.0040 0.0244 -0.0053 118 LYS A N 460 C CA . LYS A 59 ? 0.8934 0.9964 0.9089 -0.0019 0.0244 -0.0068 118 LYS A CA 461 C C . LYS A 59 ? 0.9285 1.0270 0.9351 0.0002 0.0233 -0.0123 118 LYS A C 462 O O . LYS A 59 ? 1.1506 1.2488 1.1514 0.0023 0.0223 -0.0153 118 LYS A O 463 C CB . LYS A 59 ? 0.9236 1.0276 0.9313 -0.0020 0.0270 -0.0023 118 LYS A CB 464 C CG . LYS A 59 ? 0.9853 1.0937 1.0009 -0.0037 0.0282 0.0032 118 LYS A CG 465 C CD . LYS A 59 ? 1.1018 1.2106 1.1092 -0.0036 0.0306 0.0076 118 LYS A CD 466 C CE . LYS A 59 ? 1.0654 1.1706 1.0672 -0.0040 0.0321 0.0080 118 LYS A CE 467 N NZ . LYS A 59 ? 0.9573 1.0632 0.9524 -0.0040 0.0345 0.0125 118 LYS A NZ 468 N N . PHE A 60 ? 0.9756 1.0705 0.9811 -0.0001 0.0236 -0.0135 119 PHE A N 469 C CA . PHE A 60 ? 0.9787 1.0689 0.9764 0.0019 0.0227 -0.0185 119 PHE A CA 470 C C . PHE A 60 ? 0.9516 1.0412 0.9557 0.0030 0.0197 -0.0232 119 PHE A C 471 O O . PHE A 60 ? 0.9209 1.0076 0.9185 0.0054 0.0185 -0.0278 119 PHE A O 472 C CB . PHE A 60 ? 1.0170 1.1036 1.0120 0.0011 0.0240 -0.0180 119 PHE A CB 473 C CG . PHE A 60 ? 1.0537 1.1352 1.0413 0.0032 0.0232 -0.0229 119 PHE A CG 474 C CD1 . PHE A 60 ? 1.0051 1.0840 0.9799 0.0052 0.0244 -0.0245 119 PHE A CD1 475 C CD2 . PHE A 60 ? 1.0840 1.1632 1.0773 0.0034 0.0213 -0.0260 119 PHE A CD2 476 C CE1 . PHE A 60 ? 0.9026 0.9766 0.8706 0.0074 0.0238 -0.0290 119 PHE A CE1 477 C CE2 . PHE A 60 ? 0.9995 1.0739 0.9861 0.0056 0.0206 -0.0304 119 PHE A CE2 478 C CZ . PHE A 60 ? 0.8816 0.9533 0.8555 0.0076 0.0220 -0.0320 119 PHE A CZ 479 N N . TRP A 61 ? 1.1291 1.2213 1.1459 0.0012 0.0184 -0.0220 120 TRP A N 480 C CA . TRP A 61 ? 1.1370 1.2288 1.1612 0.0020 0.0154 -0.0262 120 TRP A CA 481 C C . TRP A 61 ? 0.9987 1.0931 1.0235 0.0035 0.0139 -0.0283 120 TRP A C 482 O O . TRP A 61 ? 0.8435 0.9361 0.8681 0.0056 0.0115 -0.0333 120 TRP A O 483 C CB . TRP A 61 ? 1.1477 1.2416 1.1856 -0.0005 0.0147 -0.0241 120 TRP A CB 484 C CG . TRP A 61 ? 1.2006 1.2916 1.2396 -0.0017 0.0153 -0.0234 120 TRP A CG 485 C CD1 . TRP A 61 ? 1.1727 1.2652 1.2195 -0.0043 0.0163 -0.0195 120 TRP A CD1 486 C CD2 . TRP A 61 ? 1.0622 1.1480 1.0940 -0.0002 0.0150 -0.0268 120 TRP A CD2 487 N NE1 . TRP A 61 ? 0.9514 1.0403 0.9964 -0.0046 0.0166 -0.0203 120 TRP A NE1 488 C CE2 . TRP A 61 ? 1.0359 1.1207 1.0719 -0.0022 0.0157 -0.0246 120 TRP A CE2 489 C CE3 . TRP A 61 ? 0.9566 1.0386 0.9789 0.0026 0.0141 -0.0314 120 TRP A CE3 490 C CZ2 . TRP A 61 ? 0.9360 1.0161 0.9671 -0.0015 0.0157 -0.0268 120 TRP A CZ2 491 C CZ3 . TRP A 61 ? 1.0471 1.1244 1.0646 0.0034 0.0142 -0.0334 120 TRP A CZ3 492 C CH2 . TRP A 61 ? 1.0130 1.0894 1.0350 0.0014 0.0149 -0.0311 120 TRP A CH2 493 N N . GLU A 62 ? 0.6242 0.7227 0.6497 0.0026 0.0152 -0.0245 121 GLU A N 494 C CA . GLU A 62 ? 0.8474 0.9487 0.8731 0.0039 0.0140 -0.0259 121 GLU A CA 495 C C . GLU A 62 ? 0.9419 1.0401 0.9570 0.0072 0.0130 -0.0312 121 GLU A C 496 O O . GLU A 62 ? 0.8454 0.9428 0.8637 0.0087 0.0104 -0.0359 121 GLU A O 497 C CB . GLU A 62 ? 0.8746 0.9797 0.8983 0.0029 0.0162 -0.0208 121 GLU A CB 498 C CG . GLU A 62 ? 0.9695 1.0782 1.0043 0.0001 0.0172 -0.0156 121 GLU A CG 499 C CD . GLU A 62 ? 1.2630 1.3760 1.2978 -0.0004 0.0187 -0.0112 121 GLU A CD 500 O OE1 . GLU A 62 ? 1.2519 1.3644 1.2755 0.0010 0.0199 -0.0106 121 GLU A OE1 501 O OE2 . GLU A 62 ? 1.3700 1.4868 1.4158 -0.0020 0.0186 -0.0084 121 GLU A OE2 502 N N . PRO A 70 ? 1.1418 1.2597 1.2635 -0.0150 0.0153 -0.0034 129 PRO A N 503 C CA . PRO A 70 ? 1.0884 1.2053 1.2194 -0.0166 0.0144 -0.0039 129 PRO A CA 504 C C . PRO A 70 ? 1.1234 1.2424 1.2615 -0.0189 0.0170 0.0016 129 PRO A C 505 O O . PRO A 70 ? 1.4591 1.5791 1.6082 -0.0204 0.0163 0.0019 129 PRO A O 506 C CB . PRO A 70 ? 0.7941 0.9061 0.9164 -0.0158 0.0140 -0.0066 129 PRO A CB 507 C CG . PRO A 70 ? 0.9308 1.0412 1.0421 -0.0133 0.0132 -0.0099 129 PRO A CG 508 C CD . PRO A 70 ? 0.9409 1.0549 1.0498 -0.0131 0.0149 -0.0067 129 PRO A CD 509 N N . GLU A 71 ? 0.7875 0.9071 0.9191 -0.0189 0.0199 0.0057 130 GLU A N 510 C CA . GLU A 71 ? 0.7986 0.9198 0.9347 -0.0206 0.0227 0.0111 130 GLU A CA 511 C C . GLU A 71 ? 0.8240 0.9476 0.9743 -0.0225 0.0227 0.0129 130 GLU A C 512 O O . GLU A 71 ? 0.6312 0.7580 0.7869 -0.0232 0.0245 0.0171 130 GLU A O 513 C CB . GLU A 71 ? 0.8422 0.9660 0.9736 -0.0200 0.0250 0.0151 130 GLU A CB 514 C CG . GLU A 71 ? 0.8949 1.0182 1.0156 -0.0179 0.0242 0.0127 130 GLU A CG 515 C CD . GLU A 71 ? 0.9633 1.0831 1.0711 -0.0170 0.0252 0.0122 130 GLU A CD 516 O OE1 . GLU A 71 ? 1.0016 1.1219 1.1041 -0.0169 0.0277 0.0162 130 GLU A OE1 517 O OE2 . GLU A 71 ? 0.9378 1.0542 1.0408 -0.0161 0.0235 0.0078 130 GLU A OE2 518 N N . ASP A 72 ? 0.8658 0.9877 1.0222 -0.0233 0.0207 0.0100 131 ASP A N 519 C CA . ASP A 72 ? 0.8229 0.9467 0.9926 -0.0251 0.0207 0.0116 131 ASP A CA 520 C C . ASP A 72 ? 0.7881 0.9113 0.9588 -0.0265 0.0235 0.0159 131 ASP A C 521 O O . ASP A 72 ? 0.8278 0.9535 1.0074 -0.0278 0.0251 0.0194 131 ASP A O 522 C CB . ASP A 72 ? 0.8827 1.0050 1.0586 -0.0253 0.0174 0.0069 131 ASP A CB 523 C CG . ASP A 72 ? 0.9682 1.0916 1.1457 -0.0240 0.0145 0.0029 131 ASP A CG 524 O OD1 . ASP A 72 ? 0.8155 0.9424 0.9957 -0.0238 0.0152 0.0045 131 ASP A OD1 525 O OD2 . ASP A 72 ? 1.0270 1.1479 1.2031 -0.0230 0.0116 -0.0019 131 ASP A OD2 526 N N . ASP A 73 ? 0.8436 0.9635 1.0050 -0.0261 0.0242 0.0154 132 ASP A N 527 C CA . ASP A 73 ? 0.7900 0.9089 0.9509 -0.0272 0.0268 0.0190 132 ASP A CA 528 C C . ASP A 73 ? 0.7262 0.8433 0.8743 -0.0261 0.0285 0.0201 132 ASP A C 529 O O . ASP A 73 ? 0.6136 0.7297 0.7531 -0.0246 0.0275 0.0177 132 ASP A O 530 C CB . ASP A 73 ? 0.4135 0.5299 0.5788 -0.0284 0.0256 0.0170 132 ASP A CB 531 C CG . ASP A 73 ? 0.5042 0.6172 0.6634 -0.0273 0.0228 0.0118 132 ASP A CG 532 O OD1 . ASP A 73 ? 0.5700 0.6823 0.7355 -0.0276 0.0201 0.0086 132 ASP A OD1 533 O OD2 . ASP A 73 ? 0.5855 0.6963 0.7333 -0.0260 0.0232 0.0109 132 ASP A OD2 534 N N . ASN A 74 ? 0.5507 0.6672 0.6974 -0.0268 0.0312 0.0237 133 ASN A N 535 C CA . ASN A 74 ? 0.5029 0.6178 0.6381 -0.0258 0.0330 0.0252 133 ASN A CA 536 C C . ASN A 74 ? 0.6094 0.7203 0.7358 -0.0252 0.0317 0.0214 133 ASN A C 537 O O . ASN A 74 ? 0.5413 0.6507 0.6573 -0.0241 0.0327 0.0217 133 ASN A O 538 C CB . ASN A 74 ? 0.5332 0.6486 0.6701 -0.0266 0.0361 0.0300 133 ASN A CB 539 C CG . ASN A 74 ? 0.5457 0.6648 0.6886 -0.0267 0.0380 0.0344 133 ASN A CG 540 O OD1 . ASN A 74 ? 0.5475 0.6687 0.6888 -0.0257 0.0376 0.0347 133 ASN A OD1 541 N ND2 . ASN A 74 ? 0.5430 0.6629 0.6925 -0.0276 0.0400 0.0379 133 ASN A ND2 542 N N . TRP A 75 ? 0.5858 0.6948 0.7162 -0.0258 0.0295 0.0180 134 TRP A N 543 C CA . TRP A 75 ? 0.5972 0.7022 0.7195 -0.0249 0.0280 0.0140 134 TRP A CA 544 C C . TRP A 75 ? 0.7203 0.8251 0.8359 -0.0231 0.0265 0.0110 134 TRP A C 545 O O . TRP A 75 ? 0.5835 0.6861 0.6883 -0.0218 0.0270 0.0100 134 TRP A O 546 C CB . TRP A 75 ? 0.4578 0.5610 0.5864 -0.0257 0.0256 0.0109 134 TRP A CB 547 C CG . TRP A 75 ? 0.5894 0.6914 0.7210 -0.0272 0.0269 0.0128 134 TRP A CG 548 C CD1 . TRP A 75 ? 0.4353 0.5337 0.5614 -0.0272 0.0267 0.0112 134 TRP A CD1 549 C CD2 . TRP A 75 ? 0.5817 0.6859 0.7223 -0.0288 0.0285 0.0165 134 TRP A CD2 550 N NE1 . TRP A 75 ? 0.5168 0.6152 0.6478 -0.0287 0.0281 0.0137 134 TRP A NE1 551 C CE2 . TRP A 75 ? 0.5806 0.6824 0.7204 -0.0297 0.0293 0.0169 134 TRP A CE2 552 C CE3 . TRP A 75 ? 0.3626 0.4705 0.5117 -0.0295 0.0296 0.0195 134 TRP A CE3 553 C CZ2 . TRP A 75 ? 0.5869 0.6899 0.7339 -0.0312 0.0310 0.0201 134 TRP A CZ2 554 C CZ3 . TRP A 75 ? 0.4012 0.5102 0.5576 -0.0310 0.0314 0.0228 134 TRP A CZ3 555 C CH2 . TRP A 75 ? 0.4496 0.5561 0.6049 -0.0318 0.0321 0.0230 134 TRP A CH2 556 N N . GLU A 76 ? 0.7757 0.8827 0.8977 -0.0228 0.0247 0.0094 135 GLU A N 557 C CA . GLU A 76 ? 0.8026 0.9096 0.9192 -0.0210 0.0231 0.0064 135 GLU A CA 558 C C . GLU A 76 ? 0.6814 0.7901 0.7907 -0.0202 0.0252 0.0093 135 GLU A C 559 O O . GLU A 76 ? 0.5619 0.6692 0.6616 -0.0185 0.0249 0.0072 135 GLU A O 560 C CB . GLU A 76 ? 0.5172 0.6267 0.6437 -0.0211 0.0208 0.0045 135 GLU A CB 561 C CG . GLU A 76 ? 0.8198 0.9272 0.9520 -0.0214 0.0180 0.0006 135 GLU A CG 562 C CD . GLU A 76 ? 0.9023 1.0123 1.0451 -0.0216 0.0157 -0.0011 135 GLU A CD 563 O OE1 . GLU A 76 ? 0.9710 1.0847 1.1178 -0.0218 0.0166 0.0012 135 GLU A OE1 564 O OE2 . GLU A 76 ? 0.8822 0.9905 1.0294 -0.0214 0.0130 -0.0048 135 GLU A OE2 565 N N . ARG A 77 ? 0.5753 0.6868 0.6890 -0.0212 0.0275 0.0141 136 ARG A N 566 C CA . ARG A 77 ? 0.4993 0.6124 0.6064 -0.0205 0.0298 0.0176 136 ARG A CA 567 C C . ARG A 77 ? 0.7310 0.8410 0.8268 -0.0199 0.0313 0.0180 136 ARG A C 568 O O . ARG A 77 ? 0.7560 0.8660 0.8427 -0.0186 0.0321 0.0185 136 ARG A O 569 C CB . ARG A 77 ? 0.5124 0.6289 0.6275 -0.0216 0.0319 0.0228 136 ARG A CB 570 C CG . ARG A 77 ? 0.6464 0.7662 0.7606 -0.0207 0.0328 0.0254 136 ARG A CG 571 C CD . ARG A 77 ? 0.6338 0.7570 0.7590 -0.0219 0.0342 0.0296 136 ARG A CD 572 N NE . ARG A 77 ? 0.7999 0.9240 0.9366 -0.0231 0.0323 0.0274 136 ARG A NE 573 C CZ . ARG A 77 ? 0.9055 1.0321 1.0534 -0.0243 0.0332 0.0302 136 ARG A CZ 574 N NH1 . ARG A 77 ? 0.9604 1.0889 1.1096 -0.0244 0.0360 0.0354 136 ARG A NH1 575 N NH2 . ARG A 77 ? 0.8062 0.9334 0.9641 -0.0253 0.0313 0.0279 136 ARG A NH2 576 N N . PHE A 78 ? 0.6891 0.7967 0.7856 -0.0208 0.0316 0.0177 137 PHE A N 577 C CA . PHE A 78 ? 0.4257 0.5301 0.5122 -0.0203 0.0328 0.0176 137 PHE A CA 578 C C . PHE A 78 ? 0.5309 0.6323 0.6087 -0.0188 0.0311 0.0129 137 PHE A C 579 O O . PHE A 78 ? 0.5554 0.6555 0.6229 -0.0176 0.0321 0.0129 137 PHE A O 580 C CB . PHE A 78 ? 0.5346 0.6373 0.6248 -0.0217 0.0335 0.0183 137 PHE A CB 581 C CG . PHE A 78 ? 0.4821 0.5810 0.5629 -0.0213 0.0339 0.0167 137 PHE A CG 582 C CD1 . PHE A 78 ? 0.4670 0.5654 0.5396 -0.0207 0.0362 0.0191 137 PHE A CD1 583 C CD2 . PHE A 78 ? 0.3946 0.4903 0.4750 -0.0213 0.0321 0.0128 137 PHE A CD2 584 C CE1 . PHE A 78 ? 0.3806 0.4755 0.4449 -0.0203 0.0367 0.0176 137 PHE A CE1 585 C CE2 . PHE A 78 ? 0.4923 0.5845 0.5642 -0.0208 0.0326 0.0114 137 PHE A CE2 586 C CZ . PHE A 78 ? 0.4786 0.5704 0.5426 -0.0204 0.0349 0.0138 137 PHE A CZ 587 N N . TYR A 79 ? 0.5331 0.6333 0.6150 -0.0187 0.0285 0.0089 138 TYR A N 588 C CA . TYR A 79 ? 0.6200 0.7170 0.6943 -0.0170 0.0267 0.0041 138 TYR A CA 589 C C . TYR A 79 ? 0.6274 0.7254 0.6949 -0.0153 0.0266 0.0032 138 TYR A C 590 O O . TYR A 79 ? 0.7150 0.8104 0.7720 -0.0138 0.0268 0.0011 138 TYR A O 591 C CB . TYR A 79 ? 0.4504 0.5464 0.5318 -0.0170 0.0238 0.0001 138 TYR A CB 592 C CG . TYR A 79 ? 0.6797 0.7741 0.7666 -0.0184 0.0235 0.0002 138 TYR A CG 593 C CD1 . TYR A 79 ? 0.6607 0.7526 0.7420 -0.0189 0.0252 0.0015 138 TYR A CD1 594 C CD2 . TYR A 79 ? 0.6843 0.7796 0.7819 -0.0193 0.0215 -0.0010 138 TYR A CD2 595 C CE1 . TYR A 79 ? 0.5886 0.6790 0.6746 -0.0202 0.0250 0.0016 138 TYR A CE1 596 C CE2 . TYR A 79 ? 0.5794 0.6731 0.6816 -0.0206 0.0212 -0.0009 138 TYR A CE2 597 C CZ . TYR A 79 ? 0.6015 0.6927 0.6977 -0.0210 0.0230 0.0004 138 TYR A CZ 598 O OH . TYR A 79 ? 0.4997 0.5894 0.6003 -0.0223 0.0227 0.0005 138 TYR A OH 599 N N . SER A 80 ? 0.5347 0.6365 0.6081 -0.0154 0.0264 0.0047 139 SER A N 600 C CA . SER A 80 ? 0.7347 0.8379 0.8024 -0.0138 0.0261 0.0040 139 SER A CA 601 C C . SER A 80 ? 0.6945 0.7976 0.7520 -0.0132 0.0286 0.0068 139 SER A C 602 O O . SER A 80 ? 0.7203 0.8224 0.7687 -0.0115 0.0284 0.0049 139 SER A O 603 C CB . SER A 80 ? 0.6038 0.7114 0.6810 -0.0144 0.0255 0.0055 139 SER A CB 604 O OG . SER A 80 ? 0.6720 0.7795 0.7569 -0.0144 0.0227 0.0018 139 SER A OG 605 N N . ASN A 81 ? 0.5535 0.6575 0.6125 -0.0144 0.0308 0.0113 140 ASN A N 606 C CA . ASN A 81 ? 0.5926 0.6967 0.6427 -0.0138 0.0331 0.0144 140 ASN A CA 607 C C . ASN A 81 ? 0.6357 0.7358 0.6766 -0.0135 0.0341 0.0133 140 ASN A C 608 O O . ASN A 81 ? 0.6451 0.7451 0.6793 -0.0132 0.0361 0.0161 140 ASN A O 609 C CB . ASN A 81 ? 0.6783 0.7856 0.7344 -0.0150 0.0352 0.0199 140 ASN A CB 610 C CG . ASN A 81 ? 0.6849 0.7962 0.7473 -0.0149 0.0348 0.0217 140 ASN A CG 611 O OD1 . ASN A 81 ? 0.6477 0.7598 0.7148 -0.0147 0.0327 0.0188 140 ASN A OD1 612 N ND2 . ASN A 81 ? 0.6209 0.7346 0.6834 -0.0149 0.0368 0.0266 140 ASN A ND2 613 N N . ILE A 82 ? 0.4817 0.5788 0.5225 -0.0134 0.0327 0.0094 141 ILE A N 614 C CA . ILE A 82 ? 0.5899 0.6829 0.6216 -0.0129 0.0334 0.0078 141 ILE A CA 615 C C . ILE A 82 ? 0.6945 0.7863 0.7147 -0.0110 0.0337 0.0062 141 ILE A C 616 O O . ILE A 82 ? 0.7069 0.7979 0.7248 -0.0096 0.0320 0.0025 141 ILE A O 617 C CB . ILE A 82 ? 0.6372 0.7270 0.6712 -0.0130 0.0316 0.0038 141 ILE A CB 618 C CG1 . ILE A 82 ? 0.6320 0.7227 0.6764 -0.0150 0.0316 0.0056 141 ILE A CG1 619 C CG2 . ILE A 82 ? 0.6371 0.7226 0.6609 -0.0121 0.0324 0.0018 141 ILE A CG2 620 C CD1 . ILE A 82 ? 0.4982 0.5860 0.5455 -0.0151 0.0296 0.0018 141 ILE A CD1 621 N N . GLY A 83 ? 0.7062 0.7975 0.7188 -0.0108 0.0359 0.0088 142 GLY A N 622 C CA . GLY A 83 ? 0.6983 0.7889 0.7001 -0.0090 0.0364 0.0080 142 GLY A CA 623 C C . GLY A 83 ? 0.7322 0.8181 0.7243 -0.0080 0.0367 0.0047 142 GLY A C 624 O O . GLY A 83 ? 0.6901 0.7735 0.6839 -0.0086 0.0365 0.0032 142 GLY A O 625 N N . SER A 84 ? 0.7526 0.8376 0.7345 -0.0063 0.0372 0.0036 143 SER A N 626 C CA . SER A 84 ? 0.7399 0.8204 0.7120 -0.0050 0.0376 0.0003 143 SER A CA 627 C C . SER A 84 ? 0.7309 0.8099 0.6973 -0.0056 0.0399 0.0029 143 SER A C 628 O O . SER A 84 ? 0.8097 0.8849 0.7694 -0.0050 0.0405 0.0006 143 SER A O 629 C CB . SER A 84 ? 0.6157 0.6955 0.5790 -0.0029 0.0371 -0.0022 143 SER A CB 630 O OG . SER A 84 ? 0.7407 0.8233 0.7004 -0.0027 0.0384 0.0013 143 SER A OG 631 N N . CYS A 85 ? 0.6443 0.7263 0.6136 -0.0067 0.0412 0.0076 144 CYS A N 632 C CA . CYS A 85 ? 0.8514 0.9323 0.8158 -0.0072 0.0434 0.0102 144 CYS A CA 633 C C . CYS A 85 ? 0.7804 0.8633 0.7537 -0.0090 0.0441 0.0138 144 CYS A C 634 O O . CYS A 85 ? 0.8103 0.8930 0.7811 -0.0095 0.0458 0.0166 144 CYS A O 635 C CB . CYS A 85 ? 1.0701 1.1522 1.0264 -0.0061 0.0446 0.0125 144 CYS A CB 636 S SG . CYS A 85 ? 0.9406 1.0200 0.8847 -0.0039 0.0443 0.0084 144 CYS A SG 637 N N . SER A 86 ? 0.8231 0.9078 0.8066 -0.0100 0.0427 0.0137 145 SER A N 638 C CA . SER A 86 ? 0.6579 0.7445 0.6505 -0.0116 0.0433 0.0169 145 SER A CA 639 C C . SER A 86 ? 0.7256 0.8129 0.7284 -0.0126 0.0415 0.0152 145 SER A C 640 O O . SER A 86 ? 0.6638 0.7518 0.6684 -0.0119 0.0397 0.0128 145 SER A O 641 C CB . SER A 86 ? 0.6144 0.7045 0.6089 -0.0117 0.0446 0.0217 145 SER A CB 642 O OG . SER A 86 ? 0.8437 0.9356 0.8471 -0.0131 0.0453 0.0247 145 SER A OG 643 N N . VAL A 87 ? 0.6634 0.7505 0.6729 -0.0140 0.0418 0.0163 146 VAL A N 644 C CA . VAL A 87 ? 0.6190 0.7070 0.6387 -0.0151 0.0401 0.0150 146 VAL A CA 645 C C . VAL A 87 ? 0.4057 0.4979 0.4338 -0.0156 0.0400 0.0179 146 VAL A C 646 O O . VAL A 87 ? 0.5296 0.6230 0.5642 -0.0157 0.0382 0.0162 146 VAL A O 647 C CB . VAL A 87 ? 0.7453 0.8317 0.7692 -0.0165 0.0406 0.0154 146 VAL A CB 648 C CG1 . VAL A 87 ? 0.6421 0.7302 0.6777 -0.0178 0.0393 0.0155 146 VAL A CG1 649 C CG2 . VAL A 87 ? 0.6208 0.7029 0.6384 -0.0160 0.0401 0.0117 146 VAL A CG2 650 N N . TYR A 88 ? 0.4378 0.5322 0.4656 -0.0157 0.0419 0.0224 147 TYR A N 651 C CA . TYR A 88 ? 0.4665 0.5648 0.5015 -0.0160 0.0422 0.0257 147 TYR A CA 652 C C . TYR A 88 ? 0.6073 0.7072 0.6370 -0.0151 0.0442 0.0297 147 TYR A C 653 O O . TYR A 88 ? 0.5621 0.6602 0.5848 -0.0148 0.0456 0.0307 147 TYR A O 654 C CB . TYR A 88 ? 0.3144 0.4139 0.3604 -0.0176 0.0425 0.0275 147 TYR A CB 655 C CG . TYR A 88 ? 0.5097 0.6086 0.5552 -0.0182 0.0446 0.0306 147 TYR A CG 656 C CD1 . TYR A 88 ? 0.5991 0.6949 0.6425 -0.0188 0.0448 0.0288 147 TYR A CD1 657 C CD2 . TYR A 88 ? 0.3112 0.4126 0.3583 -0.0180 0.0466 0.0354 147 TYR A CD2 658 C CE1 . TYR A 88 ? 0.4613 0.5566 0.5043 -0.0193 0.0467 0.0315 147 TYR A CE1 659 C CE2 . TYR A 88 ? 0.5655 0.6663 0.6123 -0.0183 0.0485 0.0381 147 TYR A CE2 660 C CZ . TYR A 88 ? 0.3929 0.4907 0.4376 -0.0190 0.0485 0.0360 147 TYR A CZ 661 O OH . TYR A 88 ? 0.5204 0.6175 0.5645 -0.0192 0.0504 0.0385 147 TYR A OH 662 N N . SER A 89 ? 0.7580 0.8613 0.7908 -0.0147 0.0442 0.0320 148 SER A N 663 C CA . SER A 89 ? 0.6142 0.7191 0.6425 -0.0137 0.0459 0.0362 148 SER A CA 664 C C . SER A 89 ? 0.7389 0.8475 0.7760 -0.0140 0.0467 0.0405 148 SER A C 665 O O . SER A 89 ? 0.8962 1.0067 0.9304 -0.0130 0.0479 0.0440 148 SER A O 666 C CB . SER A 89 ? 0.5089 0.6139 0.5284 -0.0122 0.0452 0.0348 148 SER A CB 667 O OG . SER A 89 ? 0.5212 0.6270 0.5442 -0.0121 0.0432 0.0316 148 SER A OG 668 N N . ASP A 90 ? 0.6803 0.7899 0.7280 -0.0154 0.0463 0.0404 149 ASP A N 669 C CA . ASP A 90 ? 0.6001 0.7130 0.6570 -0.0157 0.0471 0.0443 149 ASP A CA 670 C C . ASP A 90 ? 0.6505 0.7629 0.7150 -0.0171 0.0482 0.0458 149 ASP A C 671 O O . ASP A 90 ? 0.6297 0.7418 0.7015 -0.0184 0.0470 0.0436 149 ASP A O 672 C CB . ASP A 90 ? 0.7159 0.8311 0.7794 -0.0160 0.0453 0.0426 149 ASP A CB 673 C CG . ASP A 90 ? 0.7880 0.9068 0.8606 -0.0162 0.0463 0.0468 149 ASP A CG 674 O OD1 . ASP A 90 ? 0.6833 0.8029 0.7562 -0.0158 0.0485 0.0512 149 ASP A OD1 675 O OD2 . ASP A 90 ? 0.5940 0.7148 0.6736 -0.0166 0.0449 0.0456 149 ASP A OD2 676 N N . ASP A 91 ? 0.4145 0.5269 0.4770 -0.0166 0.0504 0.0496 150 ASP A N 677 C CA . ASP A 91 ? 0.6192 0.7309 0.6872 -0.0175 0.0517 0.0512 150 ASP A CA 678 C C . ASP A 91 ? 0.6583 0.7724 0.7385 -0.0185 0.0519 0.0529 150 ASP A C 679 O O . ASP A 91 ? 0.5722 0.6853 0.6585 -0.0198 0.0519 0.0521 150 ASP A O 680 C CB . ASP A 91 ? 0.4849 0.5963 0.5478 -0.0164 0.0540 0.0551 150 ASP A CB 681 C CG . ASP A 91 ? 0.6222 0.7308 0.6736 -0.0156 0.0540 0.0533 150 ASP A CG 682 O OD1 . ASP A 91 ? 0.6151 0.7217 0.6630 -0.0162 0.0524 0.0490 150 ASP A OD1 683 O OD2 . ASP A 91 ? 0.6415 0.7499 0.6875 -0.0144 0.0556 0.0562 150 ASP A OD2 684 N N . GLN A 92 ? 0.6440 0.7610 0.7278 -0.0179 0.0520 0.0552 151 GLN A N 685 C CA . GLN A 92 ? 0.6047 0.7242 0.7003 -0.0187 0.0525 0.0573 151 GLN A CA 686 C C . GLN A 92 ? 0.6335 0.7527 0.7358 -0.0202 0.0502 0.0531 151 GLN A C 687 O O . GLN A 92 ? 0.5851 0.7045 0.6962 -0.0215 0.0504 0.0533 151 GLN A O 688 C CB . GLN A 92 ? 0.4998 0.6225 0.5973 -0.0176 0.0531 0.0607 151 GLN A CB 689 C CG . GLN A 92 ? 0.4972 0.6225 0.6071 -0.0183 0.0540 0.0632 151 GLN A CG 690 C CD . GLN A 92 ? 0.6958 0.8200 0.8102 -0.0187 0.0561 0.0658 151 GLN A CD 691 O OE1 . GLN A 92 ? 0.8013 0.9250 0.9112 -0.0174 0.0581 0.0691 151 GLN A OE1 692 N NE2 . GLN A 92 ? 0.6508 0.7748 0.7739 -0.0204 0.0556 0.0642 151 GLN A NE2 693 N N . MSE A 93 ? 0.3232 0.4420 0.4212 -0.0200 0.0480 0.0494 152 MSE A N 694 C CA . MSE A 93 ? 0.3854 0.5038 0.4886 -0.0211 0.0456 0.0450 152 MSE A CA 695 C C . MSE A 93 ? 0.5866 0.7018 0.6897 -0.0222 0.0452 0.0426 152 MSE A C 696 O O . MSE A 93 ? 0.5085 0.6236 0.6196 -0.0235 0.0440 0.0408 152 MSE A O 697 C CB . MSE A 93 ? 0.3103 0.4283 0.4070 -0.0202 0.0434 0.0414 152 MSE A CB 698 C CG . MSE A 93 ? 0.3467 0.4640 0.4480 -0.0209 0.0407 0.0365 152 MSE A CG 699 SE SE . MSE A 93 ? 1.0907 1.2030 1.1851 -0.0212 0.0393 0.0315 152 MSE A SE 700 C CE . MSE A 93 ? 2.1168 2.2274 2.1952 -0.0192 0.0399 0.0311 152 MSE A CE 701 N N . ILE A 94 ? 0.6645 0.7772 0.7585 -0.0216 0.0461 0.0426 153 ILE A N 702 C CA . ILE A 94 ? 0.4280 0.5376 0.5207 -0.0225 0.0459 0.0404 153 ILE A CA 703 C C . ILE A 94 ? 0.5009 0.6110 0.6013 -0.0235 0.0476 0.0433 153 ILE A C 704 O O . ILE A 94 ? 0.3455 0.4544 0.4510 -0.0248 0.0467 0.0415 153 ILE A O 705 C CB . ILE A 94 ? 0.4887 0.5957 0.5697 -0.0216 0.0466 0.0399 153 ILE A CB 706 C CG1 . ILE A 94 ? 0.3797 0.4854 0.4533 -0.0207 0.0447 0.0359 153 ILE A CG1 707 C CG2 . ILE A 94 ? 0.5550 0.6593 0.6354 -0.0224 0.0472 0.0390 153 ILE A CG2 708 C CD1 . ILE A 94 ? 0.4506 0.5546 0.5276 -0.0214 0.0422 0.0313 153 ILE A CD1 709 N N . ASP A 95 ? 0.3777 0.4896 0.4788 -0.0229 0.0499 0.0479 154 ASP A N 710 C CA . ASP A 95 ? 0.5623 0.6748 0.6709 -0.0235 0.0518 0.0510 154 ASP A CA 711 C C . ASP A 95 ? 0.4643 0.5785 0.5846 -0.0248 0.0509 0.0505 154 ASP A C 712 O O . ASP A 95 ? 0.6964 0.8102 0.8232 -0.0259 0.0516 0.0512 154 ASP A O 713 C CB . ASP A 95 ? 0.3565 0.4708 0.4639 -0.0222 0.0544 0.0560 154 ASP A CB 714 C CG . ASP A 95 ? 0.6627 0.7749 0.7600 -0.0210 0.0557 0.0569 154 ASP A CG 715 O OD1 . ASP A 95 ? 0.6894 0.7992 0.7795 -0.0212 0.0545 0.0536 154 ASP A OD1 716 O OD2 . ASP A 95 ? 0.6315 0.7444 0.7282 -0.0199 0.0579 0.0610 154 ASP A OD2 717 N N . ASN A 96 ? 0.3320 0.4482 0.4551 -0.0247 0.0493 0.0493 155 ASN A N 718 C CA . ASN A 96 ? 0.6207 0.7385 0.7548 -0.0260 0.0480 0.0483 155 ASN A CA 719 C C . ASN A 96 ? 0.5509 0.6663 0.6863 -0.0272 0.0457 0.0437 155 ASN A C 720 O O . ASN A 96 ? 0.5985 0.7140 0.7427 -0.0285 0.0454 0.0434 155 ASN A O 721 C CB . ASN A 96 ? 0.3917 0.5121 0.5278 -0.0254 0.0467 0.0478 155 ASN A CB 722 C CG . ASN A 96 ? 0.5047 0.6278 0.6411 -0.0243 0.0489 0.0526 155 ASN A CG 723 O OD1 . ASN A 96 ? 0.5081 0.6316 0.6470 -0.0241 0.0514 0.0566 155 ASN A OD1 724 N ND2 . ASN A 96 ? 0.5308 0.6558 0.6647 -0.0233 0.0480 0.0524 155 ASN A ND2 725 N N . LEU A 97 ? 0.5118 0.6248 0.6384 -0.0266 0.0442 0.0403 156 LEU A N 726 C CA . LEU A 97 ? 0.5560 0.6664 0.6824 -0.0274 0.0420 0.0360 156 LEU A CA 727 C C . LEU A 97 ? 0.5936 0.7019 0.7207 -0.0283 0.0433 0.0369 156 LEU A C 728 O O . LEU A 97 ? 0.6018 0.7090 0.7342 -0.0295 0.0421 0.0350 156 LEU A O 729 C CB . LEU A 97 ? 0.5462 0.6542 0.6619 -0.0263 0.0406 0.0325 156 LEU A CB 730 C CG . LEU A 97 ? 0.4311 0.5358 0.5448 -0.0267 0.0384 0.0281 156 LEU A CG 731 C CD1 . LEU A 97 ? 0.5495 0.6549 0.6725 -0.0275 0.0360 0.0255 156 LEU A CD1 732 C CD2 . LEU A 97 ? 0.5683 0.6706 0.6709 -0.0253 0.0375 0.0251 156 LEU A CD2 733 N N . LEU A 98 ? 0.3565 0.4644 0.4781 -0.0277 0.0458 0.0399 157 LEU A N 734 C CA . LEU A 98 ? 0.3189 0.4252 0.4409 -0.0283 0.0474 0.0412 157 LEU A CA 735 C C . LEU A 98 ? 0.4134 0.5212 0.5465 -0.0295 0.0482 0.0433 157 LEU A C 736 O O . LEU A 98 ? 0.4931 0.5994 0.6296 -0.0306 0.0479 0.0421 157 LEU A O 737 C CB . LEU A 98 ? 0.4787 0.5847 0.5934 -0.0272 0.0500 0.0444 157 LEU A CB 738 C CG . LEU A 98 ? 0.4140 0.5172 0.5179 -0.0266 0.0498 0.0425 157 LEU A CG 739 C CD1 . LEU A 98 ? 0.4442 0.5459 0.5434 -0.0264 0.0472 0.0381 157 LEU A CD1 740 C CD2 . LEU A 98 ? 0.4233 0.5270 0.5201 -0.0251 0.0519 0.0456 157 LEU A CD2 741 N N . HIS A 99 ? 0.5246 0.6354 0.6634 -0.0292 0.0494 0.0464 158 HIS A N 742 C CA . HIS A 99 ? 0.3876 0.5001 0.5375 -0.0302 0.0503 0.0485 158 HIS A CA 743 C C . HIS A 99 ? 0.4170 0.5292 0.5741 -0.0317 0.0477 0.0450 158 HIS A C 744 O O . HIS A 99 ? 0.3488 0.4606 0.5127 -0.0329 0.0480 0.0452 158 HIS A O 745 C CB . HIS A 99 ? 0.3908 0.5066 0.5453 -0.0294 0.0518 0.0521 158 HIS A CB 746 C CG . HIS A 99 ? 0.6059 0.7235 0.7723 -0.0304 0.0527 0.0541 158 HIS A CG 747 N ND1 . HIS A 99 ? 0.6731 0.7907 0.8431 -0.0304 0.0555 0.0575 158 HIS A ND1 748 C CD2 . HIS A 99 ? 0.5785 0.6980 0.7542 -0.0314 0.0513 0.0530 158 HIS A CD2 749 C CE1 . HIS A 99 ? 0.5174 0.6367 0.6983 -0.0314 0.0558 0.0586 158 HIS A CE1 750 N NE2 . HIS A 99 ? 0.5897 0.7101 0.7743 -0.0321 0.0533 0.0559 158 HIS A NE2 751 N N . ASP A 100 ? 0.3057 0.4180 0.4610 -0.0314 0.0451 0.0416 159 ASP A N 752 C CA . ASP A 100 ? 0.3975 0.5094 0.5591 -0.0325 0.0422 0.0380 159 ASP A CA 753 C C . ASP A 100 ? 0.3805 0.4890 0.5393 -0.0332 0.0410 0.0351 159 ASP A C 754 O O . ASP A 100 ? 0.5286 0.6366 0.6945 -0.0344 0.0398 0.0338 159 ASP A O 755 C CB . ASP A 100 ? 0.6012 0.7138 0.7605 -0.0317 0.0397 0.0349 159 ASP A CB 756 C CG . ASP A 100 ? 0.7148 0.8310 0.8791 -0.0313 0.0404 0.0373 159 ASP A CG 757 O OD1 . ASP A 100 ? 0.6758 0.7938 0.8439 -0.0314 0.0430 0.0416 159 ASP A OD1 758 O OD2 . ASP A 100 ? 0.5806 0.6978 0.7449 -0.0308 0.0383 0.0348 159 ASP A OD2 759 N N . LEU A 101 ? 0.6061 0.7122 0.7545 -0.0324 0.0414 0.0343 160 LEU A N 760 C CA . LEU A 101 ? 0.4881 0.5909 0.6330 -0.0329 0.0404 0.0318 160 LEU A CA 761 C C . LEU A 101 ? 0.5450 0.6475 0.6948 -0.0340 0.0423 0.0341 160 LEU A C 762 O O . LEU A 101 ? 0.4145 0.5150 0.5664 -0.0350 0.0410 0.0321 160 LEU A O 763 C CB . LEU A 101 ? 0.4319 0.5324 0.5647 -0.0318 0.0409 0.0309 160 LEU A CB 764 C CG . LEU A 101 ? 0.4715 0.5711 0.5979 -0.0306 0.0387 0.0275 160 LEU A CG 765 C CD1 . LEU A 101 ? 0.3104 0.4081 0.4252 -0.0295 0.0399 0.0275 160 LEU A CD1 766 C CD2 . LEU A 101 ? 0.3119 0.4094 0.4402 -0.0310 0.0356 0.0231 160 LEU A CD2 767 N N . ASN A 102 ? 0.3062 0.4105 0.4575 -0.0338 0.0452 0.0383 161 ASN A N 768 C CA . ASN A 102 ? 0.4805 0.5845 0.6362 -0.0346 0.0473 0.0408 161 ASN A CA 769 C C . ASN A 102 ? 0.5060 0.6116 0.6736 -0.0358 0.0470 0.0414 161 ASN A C 770 O O . ASN A 102 ? 0.4930 0.5975 0.6645 -0.0368 0.0475 0.0416 161 ASN A O 771 C CB . ASN A 102 ? 0.3041 0.4092 0.4568 -0.0335 0.0506 0.0451 161 ASN A CB 772 C CG . ASN A 102 ? 0.4322 0.5371 0.5897 -0.0340 0.0531 0.0479 161 ASN A CG 773 O OD1 . ASN A 102 ? 0.4519 0.5589 0.6177 -0.0342 0.0544 0.0504 161 ASN A OD1 774 N ND2 . ASN A 102 ? 0.4236 0.5261 0.5758 -0.0340 0.0538 0.0473 161 ASN A ND2 775 N N . THR A 103 ? 0.3636 0.4718 0.5371 -0.0358 0.0463 0.0417 162 THR A N 776 C CA . THR A 103 ? 0.4468 0.5570 0.6322 -0.0369 0.0466 0.0431 162 THR A CA 777 C C . THR A 103 ? 0.3404 0.4508 0.5322 -0.0379 0.0432 0.0395 162 THR A C 778 O O . THR A 103 ? 0.3494 0.4606 0.5509 -0.0391 0.0431 0.0398 162 THR A O 779 C CB . THR A 103 ? 0.4272 0.5405 0.6165 -0.0361 0.0488 0.0469 162 THR A CB 780 O OG1 . THR A 103 ? 0.4704 0.5852 0.6567 -0.0353 0.0471 0.0456 162 THR A OG1 781 C CG2 . THR A 103 ? 0.3031 0.4163 0.4871 -0.0350 0.0522 0.0509 162 THR A CG2 782 N N . SER A 104 ? 0.3254 0.4350 0.5122 -0.0373 0.0405 0.0360 163 SER A N 783 C CA . SER A 104 ? 0.3084 0.4182 0.5010 -0.0378 0.0372 0.0323 163 SER A CA 784 C C . SER A 104 ? 0.5707 0.6783 0.7673 -0.0391 0.0357 0.0303 163 SER A C 785 O O . SER A 104 ? 0.6429 0.7478 0.8333 -0.0391 0.0360 0.0297 163 SER A O 786 C CB . SER A 104 ? 0.4233 0.5320 0.6081 -0.0366 0.0347 0.0287 163 SER A CB 787 O OG . SER A 104 ? 0.7253 0.8339 0.9156 -0.0369 0.0313 0.0250 163 SER A OG 788 N N . PRO A 105 ? 0.6344 0.7433 0.8414 -0.0401 0.0341 0.0293 164 PRO A N 789 C CA . PRO A 105 ? 0.5348 0.6417 0.7463 -0.0413 0.0324 0.0274 164 PRO A CA 790 C C . PRO A 105 ? 0.4790 0.5828 0.6839 -0.0407 0.0292 0.0229 164 PRO A C 791 O O . PRO A 105 ? 0.4515 0.5553 0.6532 -0.0396 0.0271 0.0203 164 PRO A O 792 C CB . PRO A 105 ? 0.4078 0.5171 0.6317 -0.0423 0.0312 0.0271 164 PRO A CB 793 C CG . PRO A 105 ? 0.4872 0.5998 0.7138 -0.0419 0.0336 0.0304 164 PRO A CG 794 C CD . PRO A 105 ? 0.5651 0.6773 0.7806 -0.0403 0.0340 0.0303 164 PRO A CD 795 N N . ILE A 106 ? 0.3120 0.4130 0.5146 -0.0413 0.0288 0.0220 165 ILE A N 796 C CA . ILE A 106 ? 0.3134 0.4112 0.5095 -0.0405 0.0259 0.0180 165 ILE A CA 797 C C . ILE A 106 ? 0.3569 0.4538 0.5603 -0.0411 0.0224 0.0149 165 ILE A C 798 O O . ILE A 106 ? 0.3662 0.4634 0.5772 -0.0425 0.0226 0.0158 165 ILE A O 799 C CB . ILE A 106 ? 0.4934 0.5883 0.6820 -0.0407 0.0273 0.0186 165 ILE A CB 800 C CG1 . ILE A 106 ? 0.3694 0.4648 0.5498 -0.0398 0.0304 0.0212 165 ILE A CG1 801 C CG2 . ILE A 106 ? 0.5365 0.6279 0.7193 -0.0400 0.0243 0.0146 165 ILE A CG2 802 C CD1 . ILE A 106 ? 0.5064 0.6004 0.6833 -0.0403 0.0330 0.0236 165 ILE A CD1 803 N N . LYS A 107 ? 0.3739 0.4699 0.5749 -0.0399 0.0193 0.0110 166 LYS A N 804 C CA . LYS A 107 ? 0.4657 0.5607 0.6730 -0.0400 0.0155 0.0076 166 LYS A CA 805 C C . LYS A 107 ? 0.4806 0.5716 0.6826 -0.0396 0.0135 0.0050 166 LYS A C 806 O O . LYS A 107 ? 0.6076 0.6975 0.8152 -0.0405 0.0120 0.0043 166 LYS A O 807 C CB . LYS A 107 ? 0.6527 0.7489 0.8610 -0.0386 0.0131 0.0048 166 LYS A CB 808 C CG . LYS A 107 ? 0.7236 0.8190 0.9390 -0.0385 0.0091 0.0011 166 LYS A CG 809 C CD . LYS A 107 ? 0.7205 0.8163 0.9344 -0.0367 0.0065 -0.0023 166 LYS A CD 810 C CE . LYS A 107 ? 0.7514 0.8511 0.9683 -0.0368 0.0083 -0.0002 166 LYS A CE 811 N NZ . LYS A 107 ? 0.8248 0.9250 1.0402 -0.0349 0.0058 -0.0037 166 LYS A NZ 812 N N . HIS A 108 ? 0.3453 0.4339 0.5364 -0.0381 0.0135 0.0037 167 HIS A N 813 C CA . HIS A 108 ? 0.4049 0.4894 0.5899 -0.0375 0.0116 0.0011 167 HIS A CA 814 C C . HIS A 108 ? 0.4827 0.5655 0.6573 -0.0372 0.0141 0.0026 167 HIS A C 815 O O . HIS A 108 ? 0.5111 0.5951 0.6805 -0.0367 0.0164 0.0042 167 HIS A O 816 C CB . HIS A 108 ? 0.4472 0.5299 0.6295 -0.0355 0.0080 -0.0034 167 HIS A CB 817 C CG . HIS A 108 ? 0.7805 0.8645 0.9728 -0.0356 0.0049 -0.0054 167 HIS A CG 818 N ND1 . HIS A 108 ? 0.8627 0.9472 1.0555 -0.0340 0.0027 -0.0084 167 HIS A ND1 819 C CD2 . HIS A 108 ? 0.8025 0.8872 1.0047 -0.0370 0.0038 -0.0051 167 HIS A CD2 820 C CE1 . HIS A 108 ? 0.9208 1.0064 1.1236 -0.0344 0.0002 -0.0098 167 HIS A CE1 821 N NE2 . HIS A 108 ? 0.7741 0.8599 0.9829 -0.0363 0.0008 -0.0079 167 HIS A NE2 822 N N . VAL A 109 ? 0.5076 0.5874 0.6792 -0.0375 0.0137 0.0021 168 VAL A N 823 C CA . VAL A 109 ? 0.4785 0.5561 0.6399 -0.0370 0.0155 0.0027 168 VAL A CA 824 C C . VAL A 109 ? 0.3965 0.4700 0.5518 -0.0357 0.0128 -0.0009 168 VAL A C 825 O O . VAL A 109 ? 0.4693 0.5411 0.6282 -0.0361 0.0106 -0.0022 168 VAL A O 826 C CB . VAL A 109 ? 0.4403 0.5181 0.6027 -0.0387 0.0183 0.0060 168 VAL A CB 827 C CG1 . VAL A 109 ? 0.3772 0.4528 0.5292 -0.0381 0.0201 0.0064 168 VAL A CG1 828 C CG2 . VAL A 109 ? 0.4074 0.4891 0.5758 -0.0397 0.0212 0.0097 168 VAL A CG2 829 N N . HIS A 110 ? 0.4796 0.5514 0.6257 -0.0341 0.0129 -0.0024 169 HIS A N 830 C CA . HIS A 110 ? 0.5038 0.5716 0.6434 -0.0324 0.0105 -0.0058 169 HIS A CA 831 C C . HIS A 110 ? 0.5095 0.5750 0.6387 -0.0320 0.0127 -0.0051 169 HIS A C 832 O O . HIS A 110 ? 0.3833 0.4504 0.5089 -0.0323 0.0156 -0.0028 169 HIS A O 833 C CB . HIS A 110 ? 0.5251 0.5923 0.6634 -0.0304 0.0081 -0.0091 169 HIS A CB 834 C CG . HIS A 110 ? 0.6547 0.7233 0.8027 -0.0304 0.0052 -0.0107 169 HIS A CG 835 N ND1 . HIS A 110 ? 0.6908 0.7568 0.8408 -0.0294 0.0015 -0.0140 169 HIS A ND1 836 C CD2 . HIS A 110 ? 0.6065 0.6789 0.7631 -0.0314 0.0053 -0.0095 169 HIS A CD2 837 C CE1 . HIS A 110 ? 0.8051 0.8731 0.9644 -0.0297 -0.0005 -0.0148 169 HIS A CE1 838 N NE2 . HIS A 110 ? 0.7619 0.8338 0.9254 -0.0310 0.0018 -0.0121 169 HIS A NE2 839 N N . ILE A 111 ? 0.4928 0.5546 0.6174 -0.0312 0.0111 -0.0072 170 ILE A N 840 C CA . ILE A 111 ? 0.4788 0.5380 0.5934 -0.0305 0.0128 -0.0071 170 ILE A CA 841 C C . ILE A 111 ? 0.5020 0.5601 0.6094 -0.0284 0.0126 -0.0092 170 ILE A C 842 O O . ILE A 111 ? 0.5829 0.6396 0.6906 -0.0267 0.0098 -0.0123 170 ILE A O 843 C CB . ILE A 111 ? 0.4457 0.5011 0.5576 -0.0302 0.0111 -0.0086 170 ILE A CB 844 C CG1 . ILE A 111 ? 0.4412 0.4976 0.5595 -0.0323 0.0115 -0.0065 170 ILE A CG1 845 C CG2 . ILE A 111 ? 0.3353 0.3880 0.4368 -0.0293 0.0128 -0.0089 170 ILE A CG2 846 C CD1 . ILE A 111 ? 0.5672 0.6201 0.6834 -0.0321 0.0098 -0.0078 170 ILE A CD1 847 N N . MSE A 112 ? 0.6000 0.6586 0.7008 -0.0284 0.0155 -0.0076 171 MSE A N 848 C CA . MSE A 112 ? 0.7944 0.8522 0.8881 -0.0265 0.0157 -0.0092 171 MSE A CA 849 C C . MSE A 112 ? 1.0869 1.1404 1.1714 -0.0249 0.0153 -0.0115 171 MSE A C 850 O O . MSE A 112 ? 1.0710 1.1226 1.1528 -0.0255 0.0161 -0.0108 171 MSE A O 851 C CB . MSE A 112 ? 0.9308 0.9916 1.0223 -0.0272 0.0190 -0.0062 171 MSE A CB 852 C CG . MSE A 112 ? 0.8747 0.9352 0.9598 -0.0254 0.0192 -0.0077 171 MSE A CG 853 SE SE . MSE A 112 ? 1.5586 1.6234 1.6425 -0.0262 0.0228 -0.0039 171 MSE A SE 854 C CE . MSE A 112 ? 0.5210 0.5846 0.5971 -0.0235 0.0217 -0.0071 171 MSE A CE 855 N N . ASP A 113 ? 1.1573 1.2092 1.2369 -0.0227 0.0142 -0.0143 172 ASP A N 856 C CA . ASP A 113 ? 1.2702 1.3179 1.3405 -0.0208 0.0141 -0.0166 172 ASP A CA 857 C C . ASP A 113 ? 1.3531 1.4004 1.4164 -0.0215 0.0174 -0.0144 172 ASP A C 858 O O . ASP A 113 ? 1.3405 1.3903 1.4022 -0.0221 0.0197 -0.0125 172 ASP A O 859 C CB . ASP A 113 ? 1.2901 1.3365 1.3564 -0.0183 0.0128 -0.0196 172 ASP A CB 860 C CG . ASP A 113 ? 1.4036 1.4495 1.4758 -0.0171 0.0091 -0.0224 172 ASP A CG 861 O OD1 . ASP A 113 ? 1.4662 1.5119 1.5368 -0.0152 0.0079 -0.0248 172 ASP A OD1 862 O OD2 . ASP A 113 ? 1.2983 1.3440 1.3768 -0.0180 0.0074 -0.0223 172 ASP A OD2 863 N N . GLY A 114 ? 1.4742 1.5184 1.5332 -0.0214 0.0177 -0.0148 173 GLY A N 864 C CA . GLY A 114 ? 1.3978 1.4389 1.4584 -0.0206 0.0149 -0.0170 173 GLY A CA 865 C C . GLY A 114 ? 1.2453 1.2874 1.3121 -0.0227 0.0148 -0.0150 173 GLY A C 866 O O . GLY A 114 ? 1.0335 1.0737 1.0969 -0.0232 0.0156 -0.0144 173 GLY A O 867 N N . THR A 116 ? 0.8175 0.8570 0.8574 -0.0239 0.0259 -0.0100 175 THR A N 868 C CA . THR A 116 ? 0.6755 0.7188 0.7174 -0.0254 0.0285 -0.0069 175 THR A CA 869 C C . THR A 116 ? 0.6058 0.6512 0.6544 -0.0275 0.0289 -0.0044 175 THR A C 870 O O . THR A 116 ? 0.7212 0.7651 0.7727 -0.0279 0.0272 -0.0052 175 THR A O 871 C CB . THR A 116 ? 0.8792 0.9253 0.9238 -0.0250 0.0282 -0.0067 175 THR A CB 872 O OG1 . THR A 116 ? 1.0462 1.0927 1.0976 -0.0248 0.0253 -0.0080 175 THR A OG1 873 C CG2 . THR A 116 ? 0.8571 0.9014 0.8940 -0.0231 0.0286 -0.0086 175 THR A CG2 874 N N . GLN A 117 ? 0.5852 0.6340 0.6362 -0.0287 0.0311 -0.0015 176 GLN A N 875 C CA . GLN A 117 ? 0.4077 0.4586 0.4647 -0.0305 0.0319 0.0010 176 GLN A CA 876 C C . GLN A 117 ? 0.3970 0.4505 0.4630 -0.0311 0.0305 0.0016 176 GLN A C 877 O O . GLN A 117 ? 0.6633 0.7175 0.7306 -0.0302 0.0292 0.0004 176 GLN A O 878 C CB . GLN A 117 ? 0.3921 0.4450 0.4470 -0.0312 0.0352 0.0038 176 GLN A CB 879 C CG . GLN A 117 ? 0.4298 0.4803 0.4770 -0.0310 0.0367 0.0035 176 GLN A CG 880 C CD . GLN A 117 ? 0.5598 0.6122 0.6048 -0.0314 0.0398 0.0061 176 GLN A CD 881 O OE1 . GLN A 117 ? 0.4841 0.5388 0.5338 -0.0325 0.0410 0.0086 176 GLN A OE1 882 N NE2 . GLN A 117 ? 0.6184 0.6698 0.6562 -0.0305 0.0410 0.0056 176 GLN A NE2 883 N N . VAL A 118 ? 0.4870 0.5418 0.5591 -0.0326 0.0307 0.0033 177 VAL A N 884 C CA . VAL A 118 ? 0.3366 0.3936 0.4178 -0.0334 0.0293 0.0038 177 VAL A CA 885 C C . VAL A 118 ? 0.4354 0.4959 0.5198 -0.0333 0.0302 0.0054 177 VAL A C 886 O O . VAL A 118 ? 0.4114 0.4739 0.4947 -0.0337 0.0329 0.0080 177 VAL A O 887 C CB . VAL A 118 ? 0.4406 0.4986 0.5273 -0.0350 0.0301 0.0059 177 VAL A CB 888 C CG1 . VAL A 118 ? 0.3171 0.3767 0.4015 -0.0357 0.0335 0.0088 177 VAL A CG1 889 C CG2 . VAL A 118 ? 0.3186 0.3790 0.4150 -0.0359 0.0288 0.0066 177 VAL A CG2 890 N N . LYS A 119 ? 0.5024 0.5634 0.5905 -0.0327 0.0279 0.0037 178 LYS A N 891 C CA . LYS A 119 ? 0.4993 0.5635 0.5911 -0.0326 0.0284 0.0049 178 LYS A CA 892 C C . LYS A 119 ? 0.5311 0.5961 0.6306 -0.0325 0.0256 0.0033 178 LYS A C 893 O O . LYS A 119 ? 0.6126 0.6751 0.7113 -0.0316 0.0229 0.0002 178 LYS A O 894 C CB . LYS A 119 ? 0.3201 0.3841 0.4043 -0.0312 0.0294 0.0043 178 LYS A CB 895 C CG . LYS A 119 ? 0.4737 0.5345 0.5524 -0.0294 0.0272 0.0005 178 LYS A CG 896 C CD . LYS A 119 ? 0.6308 0.6912 0.7012 -0.0282 0.0287 0.0003 178 LYS A CD 897 C CE . LYS A 119 ? 0.8897 0.9469 0.9542 -0.0262 0.0268 -0.0034 178 LYS A CE 898 N NZ . LYS A 119 ? 0.9502 1.0071 1.0065 -0.0251 0.0285 -0.0035 178 LYS A NZ 899 N N . PHE A 120 ? 0.4398 0.5083 0.5466 -0.0334 0.0262 0.0053 179 PHE A N 900 C CA . PHE A 120 ? 0.4323 0.5021 0.5473 -0.0335 0.0237 0.0040 179 PHE A CA 901 C C . PHE A 120 ? 0.3827 0.4544 0.4980 -0.0325 0.0233 0.0034 179 PHE A C 902 O O . PHE A 120 ? 0.4252 0.4984 0.5364 -0.0321 0.0255 0.0052 179 PHE A O 903 C CB . PHE A 120 ? 0.3548 0.4270 0.4791 -0.0353 0.0246 0.0067 179 PHE A CB 904 C CG . PHE A 120 ? 0.3901 0.4605 0.5155 -0.0363 0.0245 0.0069 179 PHE A CG 905 C CD1 . PHE A 120 ? 0.3199 0.3866 0.4399 -0.0356 0.0227 0.0043 179 PHE A CD1 906 C CD2 . PHE A 120 ? 0.3170 0.3892 0.4483 -0.0379 0.0263 0.0098 179 PHE A CD2 907 C CE1 . PHE A 120 ? 0.4596 0.5246 0.5803 -0.0365 0.0226 0.0046 179 PHE A CE1 908 C CE2 . PHE A 120 ? 0.3418 0.4123 0.4738 -0.0388 0.0262 0.0100 179 PHE A CE2 909 C CZ . PHE A 120 ? 0.4233 0.4903 0.5499 -0.0382 0.0244 0.0075 179 PHE A CZ 910 N N . VAL A 121 ? 0.5559 0.6276 0.6759 -0.0319 0.0203 0.0009 180 VAL A N 911 C CA . VAL A 121 ? 0.5056 0.5798 0.6282 -0.0312 0.0198 0.0005 180 VAL A CA 912 C C . VAL A 121 ? 0.4100 0.4876 0.5438 -0.0326 0.0197 0.0024 180 VAL A C 913 O O . VAL A 121 ? 0.5633 0.6404 0.7039 -0.0333 0.0176 0.0012 180 VAL A O 914 C CB . VAL A 121 ? 0.4180 0.4901 0.5383 -0.0293 0.0166 -0.0038 180 VAL A CB 915 C CG1 . VAL A 121 ? 0.3240 0.3990 0.4488 -0.0288 0.0157 -0.0043 180 VAL A CG1 916 C CG2 . VAL A 121 ? 0.4653 0.5342 0.5742 -0.0276 0.0170 -0.0055 180 VAL A CG2 917 N N . PHE A 122 ? 0.5384 0.6193 0.6742 -0.0331 0.0220 0.0054 181 PHE A N 918 C CA . PHE A 122 ? 0.3180 0.4022 0.4643 -0.0343 0.0223 0.0074 181 PHE A CA 919 C C . PHE A 122 ? 0.5585 0.6444 0.7087 -0.0335 0.0202 0.0054 181 PHE A C 920 O O . PHE A 122 ? 0.4535 0.5400 0.5983 -0.0322 0.0205 0.0049 181 PHE A O 921 C CB . PHE A 122 ? 0.4248 0.5118 0.5718 -0.0351 0.0260 0.0118 181 PHE A CB 922 C CG . PHE A 122 ? 0.3359 0.4221 0.4830 -0.0363 0.0281 0.0142 181 PHE A CG 923 C CD1 . PHE A 122 ? 0.3763 0.4599 0.5241 -0.0368 0.0266 0.0125 181 PHE A CD1 924 C CD2 . PHE A 122 ? 0.3249 0.4128 0.4713 -0.0367 0.0315 0.0181 181 PHE A CD2 925 C CE1 . PHE A 122 ? 0.5659 0.6487 0.7135 -0.0379 0.0285 0.0146 181 PHE A CE1 926 C CE2 . PHE A 122 ? 0.3123 0.3995 0.4588 -0.0376 0.0334 0.0201 181 PHE A CE2 927 C CZ . PHE A 122 ? 0.4537 0.5383 0.6007 -0.0382 0.0319 0.0183 181 PHE A CZ 928 N N . THR A 123 ? 0.6945 0.7812 0.8540 -0.0341 0.0179 0.0041 182 THR A N 929 C CA . THR A 123 ? 0.4945 0.5834 0.6594 -0.0335 0.0161 0.0026 182 THR A CA 930 C C . THR A 123 ? 0.5150 0.6078 0.6900 -0.0351 0.0178 0.0059 182 THR A C 931 O O . THR A 123 ? 0.5301 0.6233 0.7130 -0.0365 0.0175 0.0068 182 THR A O 932 C CB . THR A 123 ? 0.4991 0.5861 0.6676 -0.0328 0.0121 -0.0017 182 THR A CB 933 O OG1 . THR A 123 ? 0.5556 0.6390 0.7145 -0.0310 0.0106 -0.0048 182 THR A OG1 934 C CG2 . THR A 123 ? 0.4971 0.5867 0.6723 -0.0323 0.0103 -0.0031 182 THR A CG2 935 N N . PHE A 124 ? 0.5571 0.6527 0.7315 -0.0347 0.0195 0.0079 183 PHE A N 936 C CA . PHE A 124 ? 0.4873 0.5865 0.6705 -0.0360 0.0214 0.0115 183 PHE A CA 937 C C . PHE A 124 ? 0.5864 0.6877 0.7793 -0.0361 0.0189 0.0096 183 PHE A C 938 O O . PHE A 124 ? 0.6429 0.7428 0.8349 -0.0351 0.0157 0.0055 183 PHE A O 939 C CB . PHE A 124 ? 0.3565 0.4578 0.5348 -0.0354 0.0244 0.0146 183 PHE A CB 940 C CG . PHE A 124 ? 0.4808 0.5804 0.6502 -0.0352 0.0269 0.0166 183 PHE A CG 941 C CD1 . PHE A 124 ? 0.3936 0.4934 0.5657 -0.0364 0.0294 0.0199 183 PHE A CD1 942 C CD2 . PHE A 124 ? 0.5136 0.6113 0.6719 -0.0338 0.0269 0.0152 183 PHE A CD2 943 C CE1 . PHE A 124 ? 0.4457 0.5439 0.6097 -0.0361 0.0317 0.0216 183 PHE A CE1 944 C CE2 . PHE A 124 ? 0.4190 0.5151 0.5694 -0.0336 0.0292 0.0169 183 PHE A CE2 945 C CZ . PHE A 124 ? 0.3711 0.4676 0.5244 -0.0348 0.0315 0.0201 183 PHE A CZ 946 N N . LYS A 125 ? 0.5334 0.6379 0.7358 -0.0374 0.0204 0.0125 184 LYS A N 947 C CA . LYS A 125 ? 0.5235 0.6303 0.7364 -0.0378 0.0183 0.0111 184 LYS A CA 948 C C . LYS A 125 ? 0.5764 0.6842 0.7864 -0.0361 0.0165 0.0085 184 LYS A C 949 O O . LYS A 125 ? 0.4863 0.5941 0.7010 -0.0357 0.0133 0.0050 184 LYS A O 950 C CB . LYS A 125 ? 0.5903 0.7005 0.8129 -0.0392 0.0209 0.0152 184 LYS A CB 951 C CG . LYS A 125 ? 0.6764 0.7896 0.9090 -0.0394 0.0194 0.0143 184 LYS A CG 952 C CD . LYS A 125 ? 0.5576 0.6737 0.8004 -0.0410 0.0220 0.0185 184 LYS A CD 953 C CE . LYS A 125 ? 0.6660 0.7835 0.9042 -0.0407 0.0261 0.0231 184 LYS A CE 954 N NZ . LYS A 125 ? 0.5505 0.6706 0.7986 -0.0419 0.0288 0.0272 184 LYS A NZ 955 N N . ASN A 126 ? 0.3548 0.4633 0.5568 -0.0351 0.0185 0.0101 185 ASN A N 956 C CA . ASN A 126 ? 0.4430 0.5523 0.6408 -0.0334 0.0170 0.0077 185 ASN A CA 957 C C . ASN A 126 ? 0.5721 0.6777 0.7613 -0.0318 0.0143 0.0031 185 ASN A C 958 O O . ASN A 126 ? 0.6906 0.7962 0.8739 -0.0301 0.0133 0.0010 185 ASN A O 959 C CB . ASN A 126 ? 0.3158 0.4269 0.5073 -0.0329 0.0200 0.0111 185 ASN A CB 960 C CG . ASN A 126 ? 0.6833 0.7920 0.8644 -0.0325 0.0222 0.0127 185 ASN A CG 961 O OD1 . ASN A 126 ? 0.5137 0.6192 0.6913 -0.0327 0.0214 0.0110 185 ASN A OD1 962 N ND2 . ASN A 126 ? 0.4522 0.5624 0.6282 -0.0321 0.0249 0.0160 185 ASN A ND2 963 N N . ASP A 127 ? 0.4611 0.5636 0.6493 -0.0321 0.0132 0.0016 186 ASP A N 964 C CA . ASP A 127 ? 0.5187 0.6172 0.6992 -0.0305 0.0107 -0.0026 186 ASP A CA 965 C C . ASP A 127 ? 0.5116 0.6084 0.6791 -0.0292 0.0123 -0.0024 186 ASP A C 966 O O . ASP A 127 ? 0.5147 0.6081 0.6748 -0.0276 0.0106 -0.0059 186 ASP A O 967 C CB . ASP A 127 ? 0.5095 0.6081 0.6933 -0.0291 0.0071 -0.0070 186 ASP A CB 968 C CG . ASP A 127 ? 0.7976 0.8967 0.9929 -0.0301 0.0046 -0.0084 186 ASP A CG 969 O OD1 . ASP A 127 ? 0.5562 0.6535 0.7536 -0.0313 0.0047 -0.0077 186 ASP A OD1 970 O OD2 . ASP A 127 ? 0.9447 1.0458 1.1470 -0.0298 0.0026 -0.0102 186 ASP A OD2 971 N N . LYS A 128 ? 0.3638 0.4624 0.5284 -0.0297 0.0157 0.0015 187 LYS A N 972 C CA . LYS A 128 ? 0.5934 0.6902 0.7460 -0.0287 0.0175 0.0022 187 LYS A CA 973 C C . LYS A 128 ? 0.6414 0.7353 0.7907 -0.0295 0.0185 0.0030 187 LYS A C 974 O O . LYS A 128 ? 0.4472 0.5412 0.6037 -0.0309 0.0183 0.0038 187 LYS A O 975 C CB . LYS A 128 ? 0.5232 0.6230 0.6740 -0.0289 0.0206 0.0062 187 LYS A CB 976 C CG . LYS A 128 ? 0.5105 0.6128 0.6619 -0.0278 0.0197 0.0053 187 LYS A CG 977 C CD . LYS A 128 ? 0.5330 0.6327 0.6754 -0.0257 0.0177 0.0010 187 LYS A CD 978 C CE . LYS A 128 ? 0.6134 0.7156 0.7554 -0.0245 0.0171 0.0002 187 LYS A CE 979 N NZ . LYS A 128 ? 0.6089 0.7143 0.7630 -0.0253 0.0157 0.0001 187 LYS A NZ 980 N N . GLN A 129 ? 0.6526 0.7442 0.7912 -0.0285 0.0196 0.0028 188 GLN A N 981 C CA . GLN A 129 ? 0.4486 0.5371 0.5833 -0.0290 0.0202 0.0028 188 GLN A CA 982 C C . GLN A 129 ? 0.5577 0.6458 0.6844 -0.0291 0.0235 0.0057 188 GLN A C 983 O O . GLN A 129 ? 0.5425 0.6319 0.6643 -0.0283 0.0249 0.0070 188 GLN A O 984 C CB . GLN A 129 ? 0.4221 0.5067 0.5516 -0.0276 0.0175 -0.0017 188 GLN A CB 985 C CG . GLN A 129 ? 0.3237 0.4080 0.4612 -0.0275 0.0140 -0.0048 188 GLN A CG 986 C CD . GLN A 129 ? 0.4707 0.5507 0.6028 -0.0258 0.0114 -0.0091 188 GLN A CD 987 O OE1 . GLN A 129 ? 0.5330 0.6112 0.6565 -0.0239 0.0111 -0.0112 188 GLN A OE1 988 N NE2 . GLN A 129 ? 0.3869 0.4652 0.5238 -0.0263 0.0095 -0.0103 188 GLN A NE2 989 N N . ALA A 130 ? 0.7071 0.7933 0.8325 -0.0300 0.0245 0.0067 189 ALA A N 990 C CA . ALA A 130 ? 0.5172 0.6028 0.6355 -0.0301 0.0274 0.0093 189 ALA A CA 991 C C . ALA A 130 ? 0.5649 0.6470 0.6790 -0.0303 0.0272 0.0081 189 ALA A C 992 O O . ALA A 130 ? 0.4703 0.5510 0.5887 -0.0308 0.0253 0.0063 189 ALA A O 993 C CB . ALA A 130 ? 0.3154 0.4042 0.4392 -0.0313 0.0301 0.0138 189 ALA A CB 994 N N . VAL A 131 ? 0.4915 0.5723 0.5972 -0.0300 0.0293 0.0092 190 VAL A N 995 C CA . VAL A 131 ? 0.3291 0.4067 0.4304 -0.0302 0.0296 0.0085 190 VAL A CA 996 C C . VAL A 131 ? 0.3759 0.4547 0.4803 -0.0317 0.0321 0.0121 190 VAL A C 997 O O . VAL A 131 ? 0.3493 0.4301 0.4526 -0.0318 0.0346 0.0152 190 VAL A O 998 C CB . VAL A 131 ? 0.4156 0.4908 0.5056 -0.0289 0.0304 0.0073 190 VAL A CB 999 C CG1 . VAL A 131 ? 0.3190 0.3912 0.4048 -0.0293 0.0310 0.0069 190 VAL A CG1 1000 C CG2 . VAL A 131 ? 0.3210 0.3945 0.4072 -0.0272 0.0280 0.0035 190 VAL A CG2 1001 N N . PHE A 132 ? 0.3799 0.4573 0.4880 -0.0327 0.0313 0.0116 191 PHE A N 1002 C CA . PHE A 132 ? 0.4538 0.5321 0.5648 -0.0340 0.0336 0.0147 191 PHE A CA 1003 C C . PHE A 132 ? 0.5657 0.6409 0.6699 -0.0340 0.0343 0.0141 191 PHE A C 1004 O O . PHE A 132 ? 0.3942 0.4666 0.4966 -0.0339 0.0323 0.0114 191 PHE A O 1005 C CB . PHE A 132 ? 0.3144 0.3938 0.4357 -0.0353 0.0325 0.0151 191 PHE A CB 1006 C CG . PHE A 132 ? 0.3131 0.3928 0.4371 -0.0365 0.0347 0.0179 191 PHE A CG 1007 C CD1 . PHE A 132 ? 0.3551 0.4374 0.4811 -0.0368 0.0376 0.0216 191 PHE A CD1 1008 C CD2 . PHE A 132 ? 0.3524 0.4298 0.4768 -0.0372 0.0338 0.0167 191 PHE A CD2 1009 C CE1 . PHE A 132 ? 0.3104 0.3928 0.4386 -0.0376 0.0397 0.0240 191 PHE A CE1 1010 C CE2 . PHE A 132 ? 0.3513 0.4290 0.4779 -0.0383 0.0359 0.0191 191 PHE A CE2 1011 C CZ . PHE A 132 ? 0.3109 0.3910 0.4393 -0.0384 0.0389 0.0227 191 PHE A CZ 1012 N N . LYS A 133 ? 0.3135 0.3893 0.4142 -0.0341 0.0372 0.0168 192 LYS A N 1013 C CA . LYS A 133 ? 0.3664 0.4397 0.4614 -0.0343 0.0382 0.0167 192 LYS A CA 1014 C C . LYS A 133 ? 0.3580 0.4327 0.4573 -0.0354 0.0405 0.0198 192 LYS A C 1015 O O . LYS A 133 ? 0.4734 0.5503 0.5736 -0.0352 0.0427 0.0227 192 LYS A O 1016 C CB . LYS A 133 ? 0.3136 0.3858 0.3990 -0.0332 0.0396 0.0165 192 LYS A CB 1017 C CG . LYS A 133 ? 0.3154 0.3856 0.3954 -0.0320 0.0375 0.0131 192 LYS A CG 1018 C CD . LYS A 133 ? 0.3155 0.3849 0.3863 -0.0309 0.0391 0.0132 192 LYS A CD 1019 C CE . LYS A 133 ? 0.4502 0.5169 0.5150 -0.0296 0.0373 0.0097 192 LYS A CE 1020 N NZ . LYS A 133 ? 0.4503 0.5159 0.5059 -0.0286 0.0389 0.0096 192 LYS A NZ 1021 N N . PRO A 134 ? 0.3726 0.4457 0.4740 -0.0363 0.0398 0.0191 193 PRO A N 1022 C CA . PRO A 134 ? 0.3202 0.3944 0.4261 -0.0373 0.0418 0.0217 193 PRO A CA 1023 C C . PRO A 134 ? 0.3534 0.4271 0.4533 -0.0369 0.0446 0.0235 193 PRO A C 1024 O O . PRO A 134 ? 0.3483 0.4200 0.4403 -0.0362 0.0446 0.0221 193 PRO A O 1025 C CB . PRO A 134 ? 0.3116 0.3837 0.4202 -0.0382 0.0398 0.0198 193 PRO A CB 1026 C CG . PRO A 134 ? 0.4145 0.4837 0.5164 -0.0374 0.0377 0.0165 193 PRO A CG 1027 C CD . PRO A 134 ? 0.3136 0.3837 0.4132 -0.0363 0.0372 0.0158 193 PRO A CD 1028 N N . MSE A 135 ? 0.4235 0.4990 0.5271 -0.0372 0.0469 0.0265 194 MSE A N 1029 C CA . MSE A 135 ? 0.3074 0.3825 0.4062 -0.0368 0.0496 0.0283 194 MSE A CA 1030 C C . MSE A 135 ? 0.3177 0.3904 0.4146 -0.0375 0.0494 0.0271 194 MSE A C 1031 O O . MSE A 135 ? 0.3083 0.3807 0.4105 -0.0385 0.0484 0.0266 194 MSE A O 1032 C CB . MSE A 135 ? 0.3748 0.4525 0.4784 -0.0366 0.0522 0.0320 194 MSE A CB 1033 C CG . MSE A 135 ? 0.4546 0.5319 0.5547 -0.0361 0.0549 0.0338 194 MSE A CG 1034 SE SE . MSE A 135 ? 0.7712 0.8515 0.8777 -0.0355 0.0582 0.0384 194 MSE A SE 1035 C CE . MSE A 135 ? 0.3604 0.4389 0.4613 -0.0348 0.0608 0.0393 194 MSE A CE 1036 N N . ARG A 136 ? 0.3076 0.3787 0.3969 -0.0370 0.0504 0.0265 195 ARG A N 1037 C CA . ARG A 136 ? 0.3078 0.3767 0.3947 -0.0375 0.0505 0.0256 195 ARG A CA 1038 C C . ARG A 136 ? 0.3951 0.4646 0.4808 -0.0372 0.0535 0.0280 195 ARG A C 1039 O O . ARG A 136 ? 0.6464 0.7167 0.7372 -0.0377 0.0545 0.0295 195 ARG A O 1040 C CB . ARG A 136 ? 0.3100 0.3761 0.3894 -0.0372 0.0491 0.0227 195 ARG A CB 1041 C CG . ARG A 136 ? 0.3733 0.4370 0.4506 -0.0378 0.0487 0.0215 195 ARG A CG 1042 C CD . ARG A 136 ? 0.3105 0.3714 0.3812 -0.0374 0.0471 0.0185 195 ARG A CD 1043 N NE . ARG A 136 ? 0.3996 0.4591 0.4728 -0.0378 0.0441 0.0163 195 ARG A NE 1044 C CZ . ARG A 136 ? 0.3374 0.3965 0.4098 -0.0371 0.0423 0.0146 195 ARG A CZ 1045 N NH1 . ARG A 136 ? 0.5946 0.6546 0.6634 -0.0362 0.0433 0.0150 195 ARG A NH1 1046 N NH2 . ARG A 136 ? 0.3975 0.4551 0.4724 -0.0372 0.0395 0.0125 195 ARG A NH2 1047 N N . PHE A 137 ? 0.4362 0.5053 0.5153 -0.0362 0.0549 0.0282 196 PHE A N 1048 C CA . PHE A 137 ? 0.3330 0.4025 0.4103 -0.0356 0.0576 0.0303 196 PHE A CA 1049 C C . PHE A 137 ? 0.4163 0.4884 0.4961 -0.0346 0.0596 0.0334 196 PHE A C 1050 O O . PHE A 137 ? 0.4822 0.5558 0.5641 -0.0344 0.0590 0.0339 196 PHE A O 1051 C CB . PHE A 137 ? 0.3050 0.3726 0.3740 -0.0351 0.0581 0.0289 196 PHE A CB 1052 C CG . PHE A 137 ? 0.5389 0.6038 0.6048 -0.0359 0.0562 0.0259 196 PHE A CG 1053 C CD1 . PHE A 137 ? 0.3434 0.4073 0.4119 -0.0368 0.0557 0.0253 196 PHE A CD1 1054 C CD2 . PHE A 137 ? 0.3071 0.3704 0.3674 -0.0355 0.0549 0.0237 196 PHE A CD2 1055 C CE1 . PHE A 137 ? 0.4186 0.4799 0.4840 -0.0374 0.0539 0.0227 196 PHE A CE1 1056 C CE2 . PHE A 137 ? 0.3241 0.3847 0.3814 -0.0361 0.0532 0.0211 196 PHE A CE2 1057 C CZ . PHE A 137 ? 0.3084 0.3681 0.3683 -0.0370 0.0526 0.0206 196 PHE A CZ 1058 N N . GLY A 138 ? 0.3377 0.4102 0.4167 -0.0338 0.0621 0.0354 197 GLY A N 1059 C CA . GLY A 138 ? 0.3948 0.4695 0.4755 -0.0325 0.0643 0.0385 197 GLY A CA 1060 C C . GLY A 138 ? 0.4001 0.4750 0.4747 -0.0313 0.0646 0.0387 197 GLY A C 1061 O O . GLY A 138 ? 0.4696 0.5430 0.5384 -0.0315 0.0634 0.0364 197 GLY A O 1062 N N . ARG A 139 ? 0.3009 0.3779 0.3770 -0.0300 0.0662 0.0416 198 ARG A N 1063 C CA . ARG A 139 ? 0.4599 0.5374 0.5306 -0.0287 0.0666 0.0423 198 ARG A CA 1064 C C . ARG A 139 ? 0.4293 0.5052 0.4926 -0.0278 0.0677 0.0417 198 ARG A C 1065 O O . ARG A 139 ? 0.3496 0.4252 0.4072 -0.0271 0.0675 0.0411 198 ARG A O 1066 C CB . ARG A 139 ? 0.2999 0.3798 0.3740 -0.0273 0.0682 0.0458 198 ARG A CB 1067 C CG . ARG A 139 ? 0.4205 0.5022 0.5021 -0.0280 0.0674 0.0467 198 ARG A CG 1068 C CD . ARG A 139 ? 0.3113 0.3930 0.3915 -0.0288 0.0649 0.0445 198 ARG A CD 1069 N NE . ARG A 139 ? 0.4493 0.5333 0.5355 -0.0288 0.0645 0.0460 198 ARG A NE 1070 C CZ . ARG A 139 ? 0.5677 0.6522 0.6603 -0.0302 0.0630 0.0450 198 ARG A CZ 1071 N NH1 . ARG A 139 ? 0.4685 0.5513 0.5623 -0.0315 0.0617 0.0426 198 ARG A NH1 1072 N NH2 . ARG A 139 ? 0.3853 0.4720 0.4834 -0.0301 0.0627 0.0465 198 ARG A NH2 1073 N N . ASP A 140 ? 0.3377 0.4128 0.4014 -0.0278 0.0689 0.0418 199 ASP A N 1074 C CA . ASP A 140 ? 0.3809 0.4546 0.4384 -0.0268 0.0701 0.0413 199 ASP A CA 1075 C C . ASP A 140 ? 0.3966 0.4680 0.4492 -0.0280 0.0687 0.0379 199 ASP A C 1076 O O . ASP A 140 ? 0.4976 0.5679 0.5444 -0.0273 0.0693 0.0371 199 ASP A O 1077 C CB . ASP A 140 ? 0.4190 0.4927 0.4787 -0.0260 0.0722 0.0428 199 ASP A CB 1078 C CG . ASP A 140 ? 0.6905 0.7662 0.7538 -0.0243 0.0741 0.0464 199 ASP A CG 1079 O OD1 . ASP A 140 ? 0.5611 0.6380 0.6226 -0.0232 0.0742 0.0478 199 ASP A OD1 1080 O OD2 . ASP A 140 ? 0.9494 1.0254 1.0170 -0.0239 0.0756 0.0479 199 ASP A OD2 1081 N N . TYR A 141 ? 0.3331 0.4038 0.3882 -0.0296 0.0667 0.0360 200 TYR A N 1082 C CA . TYR A 141 ? 0.3023 0.3705 0.3531 -0.0306 0.0652 0.0328 200 TYR A CA 1083 C C . TYR A 141 ? 0.4549 0.5223 0.4991 -0.0300 0.0647 0.0315 200 TYR A C 1084 O O . TYR A 141 ? 0.6539 0.7223 0.6981 -0.0297 0.0640 0.0320 200 TYR A O 1085 C CB . TYR A 141 ? 0.5026 0.5703 0.5576 -0.0321 0.0630 0.0312 200 TYR A CB 1086 C CG . TYR A 141 ? 0.5265 0.5915 0.5775 -0.0330 0.0614 0.0280 200 TYR A CG 1087 C CD1 . TYR A 141 ? 0.5417 0.6054 0.5929 -0.0337 0.0615 0.0272 200 TYR A CD1 1088 C CD2 . TYR A 141 ? 0.5470 0.6108 0.5939 -0.0330 0.0598 0.0260 200 TYR A CD2 1089 C CE1 . TYR A 141 ? 0.5101 0.5713 0.5577 -0.0344 0.0601 0.0245 200 TYR A CE1 1090 C CE2 . TYR A 141 ? 0.5854 0.6466 0.6287 -0.0336 0.0585 0.0232 200 TYR A CE2 1091 C CZ . TYR A 141 ? 0.7454 0.8053 0.7891 -0.0343 0.0586 0.0226 200 TYR A CZ 1092 O OH . TYR A 141 ? 0.9446 1.0019 0.9847 -0.0348 0.0572 0.0200 200 TYR A OH 1093 N N . GLU A 142 ? 0.3478 0.4133 0.3864 -0.0300 0.0650 0.0298 201 GLU A N 1094 C CA . GLU A 142 ? 0.4657 0.5300 0.4978 -0.0296 0.0646 0.0283 201 GLU A CA 1095 C C . GLU A 142 ? 0.4477 0.5094 0.4769 -0.0306 0.0630 0.0252 201 GLU A C 1096 O O . GLU A 142 ? 0.5387 0.5993 0.5692 -0.0314 0.0627 0.0242 201 GLU A O 1097 C CB . GLU A 142 ? 0.3338 0.3982 0.3613 -0.0283 0.0665 0.0293 201 GLU A CB 1098 C CG . GLU A 142 ? 0.5374 0.6041 0.5676 -0.0270 0.0682 0.0325 201 GLU A CG 1099 C CD . GLU A 142 ? 0.3403 0.4074 0.3654 -0.0255 0.0691 0.0334 201 GLU A CD 1100 O OE1 . GLU A 142 ? 0.5438 0.6094 0.5635 -0.0257 0.0685 0.0315 201 GLU A OE1 1101 O OE2 . GLU A 142 ? 0.4556 0.5243 0.4819 -0.0241 0.0705 0.0361 201 GLU A OE2 1102 N N . SER A 143 ? 0.5365 0.5971 0.5616 -0.0305 0.0620 0.0236 202 SER A N 1103 C CA . SER A 143 ? 0.4722 0.5302 0.4943 -0.0311 0.0605 0.0206 202 SER A CA 1104 C C . SER A 143 ? 0.4035 0.4595 0.4214 -0.0313 0.0613 0.0194 202 SER A C 1105 O O . SER A 143 ? 0.6206 0.6771 0.6355 -0.0306 0.0631 0.0202 202 SER A O 1106 C CB . SER A 143 ? 0.4338 0.4909 0.4517 -0.0306 0.0596 0.0192 202 SER A CB 1107 O OG . SER A 143 ? 0.6690 0.7277 0.6906 -0.0305 0.0585 0.0200 202 SER A OG 1108 N N . ASP A 144 ? 0.5455 0.5995 0.5635 -0.0321 0.0601 0.0174 203 ASP A N 1109 C CA . ASP A 144 ? 0.3312 0.3832 0.3451 -0.0323 0.0607 0.0159 203 ASP A CA 1110 C C . ASP A 144 ? 0.4500 0.5006 0.4573 -0.0316 0.0613 0.0148 203 ASP A C 1111 O O . ASP A 144 ? 0.3263 0.3758 0.3313 -0.0314 0.0603 0.0135 203 ASP A O 1112 C CB . ASP A 144 ? 0.3623 0.4121 0.3770 -0.0333 0.0589 0.0140 203 ASP A CB 1113 C CG . ASP A 144 ? 0.4882 0.5363 0.5000 -0.0336 0.0596 0.0129 203 ASP A CG 1114 O OD1 . ASP A 144 ? 0.5630 0.6104 0.5700 -0.0331 0.0609 0.0124 203 ASP A OD1 1115 O OD2 . ASP A 144 ? 0.5621 0.6094 0.5763 -0.0344 0.0587 0.0124 203 ASP A OD2 1116 N N . PRO A 145 ? 0.4682 0.5188 0.4723 -0.0312 0.0631 0.0151 204 PRO A N 1117 C CA . PRO A 145 ? 0.5505 0.5998 0.5485 -0.0306 0.0639 0.0140 204 PRO A CA 1118 C C . PRO A 145 ? 0.5217 0.5679 0.5159 -0.0310 0.0628 0.0113 204 PRO A C 1119 O O . PRO A 145 ? 0.4899 0.5347 0.4794 -0.0304 0.0631 0.0101 204 PRO A O 1120 C CB . PRO A 145 ? 0.3077 0.3575 0.3042 -0.0302 0.0657 0.0148 204 PRO A CB 1121 C CG . PRO A 145 ? 0.3537 0.4059 0.3556 -0.0302 0.0662 0.0171 204 PRO A CG 1122 C CD . PRO A 145 ? 0.3705 0.4225 0.3769 -0.0311 0.0646 0.0167 204 PRO A CD 1123 N N . ASN A 146 ? 0.3890 0.4340 0.3853 -0.0318 0.0617 0.0103 205 ASN A N 1124 C CA . ASN A 146 ? 0.4727 0.5146 0.4659 -0.0320 0.0606 0.0078 205 ASN A CA 1125 C C . ASN A 146 ? 0.3577 0.3987 0.3519 -0.0318 0.0586 0.0068 205 ASN A C 1126 O O . ASN A 146 ? 0.4408 0.4790 0.4318 -0.0315 0.0577 0.0047 205 ASN A O 1127 C CB . ASN A 146 ? 0.3544 0.3952 0.3488 -0.0328 0.0602 0.0071 205 ASN A CB 1128 C CG . ASN A 146 ? 0.3887 0.4298 0.3812 -0.0328 0.0621 0.0075 205 ASN A CG 1129 O OD1 . ASN A 146 ? 0.4310 0.4716 0.4192 -0.0323 0.0634 0.0070 205 ASN A OD1 1130 N ND2 . ASN A 146 ? 0.4199 0.4620 0.4156 -0.0334 0.0623 0.0082 205 ASN A ND2 1131 N N . HIS A 147 ? 0.4746 0.5178 0.4731 -0.0318 0.0580 0.0083 206 HIS A N 1132 C CA . HIS A 147 ? 0.3288 0.3715 0.3289 -0.0315 0.0560 0.0073 206 HIS A CA 1133 C C . HIS A 147 ? 0.3957 0.4378 0.3915 -0.0305 0.0562 0.0066 206 HIS A C 1134 O O . HIS A 147 ? 0.3903 0.4342 0.3850 -0.0301 0.0576 0.0081 206 HIS A O 1135 C CB . HIS A 147 ? 0.5018 0.5472 0.5088 -0.0320 0.0553 0.0091 206 HIS A CB 1136 C CG . HIS A 147 ? 0.5935 0.6386 0.6050 -0.0329 0.0541 0.0090 206 HIS A CG 1137 N ND1 . HIS A 147 ? 0.6051 0.6525 0.6231 -0.0335 0.0537 0.0107 206 HIS A ND1 1138 C CD2 . HIS A 147 ? 0.3869 0.4296 0.3972 -0.0333 0.0532 0.0074 206 HIS A CD2 1139 C CE1 . HIS A 147 ? 0.5191 0.5655 0.5396 -0.0342 0.0526 0.0101 206 HIS A CE1 1140 N NE2 . HIS A 147 ? 0.5256 0.5692 0.5415 -0.0341 0.0523 0.0082 206 HIS A NE2 1141 N N . PHE A 148 ? 0.4952 0.5347 0.4884 -0.0300 0.0548 0.0043 207 PHE A N 1142 C CA . PHE A 148 ? 0.3623 0.4010 0.3516 -0.0289 0.0547 0.0034 207 PHE A CA 1143 C C . PHE A 148 ? 0.5072 0.5483 0.5008 -0.0287 0.0536 0.0044 207 PHE A C 1144 O O . PHE A 148 ? 0.4030 0.4458 0.4027 -0.0294 0.0527 0.0054 207 PHE A O 1145 C CB . PHE A 148 ? 0.4082 0.4432 0.3936 -0.0281 0.0536 0.0005 207 PHE A CB 1146 C CG . PHE A 148 ? 0.5892 0.6217 0.5691 -0.0280 0.0550 -0.0006 207 PHE A CG 1147 C CD1 . PHE A 148 ? 0.3788 0.4105 0.3531 -0.0272 0.0567 -0.0009 207 PHE A CD1 1148 C CD2 . PHE A 148 ? 0.4156 0.4464 0.3960 -0.0285 0.0547 -0.0012 207 PHE A CD2 1149 C CE1 . PHE A 148 ? 0.4743 0.5037 0.4439 -0.0272 0.0580 -0.0019 207 PHE A CE1 1150 C CE2 . PHE A 148 ? 0.4091 0.4376 0.3847 -0.0284 0.0560 -0.0023 207 PHE A CE2 1151 C CZ . PHE A 148 ? 0.4637 0.4915 0.4341 -0.0278 0.0577 -0.0026 207 PHE A CZ 1152 N N . TYR A 149 ? 0.3746 0.4158 0.3650 -0.0277 0.0538 0.0041 208 TYR A N 1153 C CA . TYR A 149 ? 0.4902 0.5336 0.4841 -0.0274 0.0528 0.0048 208 TYR A CA 1154 C C . TYR A 149 ? 0.5502 0.5927 0.5482 -0.0275 0.0503 0.0033 208 TYR A C 1155 O O . TYR A 149 ? 0.6596 0.7044 0.6631 -0.0277 0.0492 0.0043 208 TYR A O 1156 C CB . TYR A 149 ? 0.3207 0.3637 0.3092 -0.0262 0.0533 0.0042 208 TYR A CB 1157 C CG . TYR A 149 ? 0.6075 0.6468 0.5892 -0.0253 0.0535 0.0015 208 TYR A CG 1158 C CD1 . TYR A 149 ? 0.4830 0.5210 0.4595 -0.0253 0.0554 0.0015 208 TYR A CD1 1159 C CD2 . TYR A 149 ? 0.3250 0.3618 0.3054 -0.0243 0.0517 -0.0010 208 TYR A CD2 1160 C CE1 . TYR A 149 ? 0.4847 0.5192 0.4551 -0.0244 0.0557 -0.0009 208 TYR A CE1 1161 C CE2 . TYR A 149 ? 0.5637 0.5969 0.5377 -0.0233 0.0520 -0.0033 208 TYR A CE2 1162 C CZ . TYR A 149 ? 0.7017 0.7337 0.6708 -0.0233 0.0541 -0.0032 208 TYR A CZ 1163 O OH . TYR A 149 ? 0.7452 0.7735 0.7082 -0.0223 0.0546 -0.0055 208 TYR A OH 1164 N N . PHE A 150 ? 0.6049 0.6441 0.6004 -0.0271 0.0493 0.0009 209 PHE A N 1165 C CA . PHE A 150 ? 0.5936 0.6315 0.5926 -0.0269 0.0467 -0.0007 209 PHE A CA 1166 C C . PHE A 150 ? 0.4647 0.5031 0.4691 -0.0281 0.0459 0.0001 209 PHE A C 1167 O O . PHE A 150 ? 0.4480 0.4852 0.4554 -0.0280 0.0438 -0.0012 209 PHE A O 1168 C CB . PHE A 150 ? 0.5688 0.6026 0.5623 -0.0255 0.0458 -0.0037 209 PHE A CB 1169 C CG . PHE A 150 ? 0.3776 0.4089 0.3661 -0.0255 0.0472 -0.0043 209 PHE A CG 1170 C CD1 . PHE A 150 ? 0.3273 0.3573 0.3092 -0.0248 0.0491 -0.0048 209 PHE A CD1 1171 C CD2 . PHE A 150 ? 0.3266 0.3566 0.3170 -0.0262 0.0466 -0.0045 209 PHE A CD2 1172 C CE1 . PHE A 150 ? 0.4470 0.4747 0.4247 -0.0249 0.0504 -0.0054 209 PHE A CE1 1173 C CE2 . PHE A 150 ? 0.4982 0.5259 0.4842 -0.0263 0.0478 -0.0051 209 PHE A CE2 1174 C CZ . PHE A 150 ? 0.4528 0.4793 0.4325 -0.0256 0.0498 -0.0056 209 PHE A CZ 1175 N N . SER A 151 ? 0.7075 0.7475 0.7129 -0.0292 0.0477 0.0021 210 SER A N 1176 C CA . SER A 151 ? 0.6430 0.6836 0.6533 -0.0304 0.0473 0.0030 210 SER A CA 1177 C C . SER A 151 ? 0.5187 0.5631 0.5350 -0.0312 0.0479 0.0057 210 SER A C 1178 O O . SER A 151 ? 0.4575 0.5028 0.4788 -0.0322 0.0475 0.0066 210 SER A O 1179 C CB . SER A 151 ? 0.7121 0.7513 0.7188 -0.0308 0.0488 0.0030 210 SER A CB 1180 O OG . SER A 151 ? 0.7923 0.8278 0.7939 -0.0301 0.0481 0.0006 210 SER A OG 1181 N N . ASP A 152 ? 0.5971 0.6435 0.6128 -0.0308 0.0490 0.0069 211 ASP A N 1182 C CA . ASP A 152 ? 0.6041 0.6541 0.6250 -0.0313 0.0499 0.0096 211 ASP A CA 1183 C C . ASP A 152 ? 0.7021 0.7536 0.7301 -0.0317 0.0481 0.0099 211 ASP A C 1184 O O . ASP A 152 ? 0.7561 0.8069 0.7842 -0.0310 0.0463 0.0083 211 ASP A O 1185 C CB . ASP A 152 ? 0.7136 0.7651 0.7312 -0.0305 0.0514 0.0108 211 ASP A CB 1186 C CG . ASP A 152 ? 0.8039 0.8585 0.8249 -0.0307 0.0532 0.0140 211 ASP A CG 1187 O OD1 . ASP A 152 ? 0.6910 0.7462 0.7152 -0.0315 0.0538 0.0151 211 ASP A OD1 1188 O OD2 . ASP A 152 ? 0.9388 0.9952 0.9589 -0.0301 0.0540 0.0154 211 ASP A OD2 1189 N N . PHE A 153 ? 0.6451 0.6985 0.6790 -0.0326 0.0485 0.0118 212 PHE A N 1190 C CA . PHE A 153 ? 0.3707 0.4260 0.4121 -0.0331 0.0471 0.0125 212 PHE A CA 1191 C C . PHE A 153 ? 0.3625 0.4204 0.4054 -0.0326 0.0478 0.0142 212 PHE A C 1192 O O . PHE A 153 ? 0.4639 0.5232 0.5044 -0.0322 0.0499 0.0160 212 PHE A O 1193 C CB . PHE A 153 ? 0.4473 0.5037 0.4942 -0.0342 0.0477 0.0142 212 PHE A CB 1194 C CG . PHE A 153 ? 0.4822 0.5368 0.5321 -0.0349 0.0455 0.0126 212 PHE A CG 1195 C CD1 . PHE A 153 ? 0.5317 0.5850 0.5825 -0.0346 0.0429 0.0104 212 PHE A CD1 1196 C CD2 . PHE A 153 ? 0.5573 0.6116 0.6090 -0.0358 0.0461 0.0132 212 PHE A CD2 1197 C CE1 . PHE A 153 ? 0.5021 0.5538 0.5557 -0.0350 0.0408 0.0089 212 PHE A CE1 1198 C CE2 . PHE A 153 ? 0.3139 0.3666 0.3682 -0.0364 0.0440 0.0118 212 PHE A CE2 1199 C CZ . PHE A 153 ? 0.5311 0.5824 0.5863 -0.0360 0.0413 0.0097 212 PHE A CZ 1200 N N . GLU A 154 ? 0.3140 0.3728 0.3610 -0.0325 0.0460 0.0135 213 GLU A N 1201 C CA . GLU A 154 ? 0.3316 0.3931 0.3806 -0.0320 0.0465 0.0151 213 GLU A CA 1202 C C . GLU A 154 ? 0.3115 0.3760 0.3661 -0.0326 0.0482 0.0184 213 GLU A C 1203 O O . GLU A 154 ? 0.5670 0.6317 0.6263 -0.0335 0.0483 0.0192 213 GLU A O 1204 C CB . GLU A 154 ? 0.3146 0.3763 0.3674 -0.0318 0.0440 0.0135 213 GLU A CB 1205 C CG . GLU A 154 ? 0.3802 0.4396 0.4269 -0.0306 0.0426 0.0106 213 GLU A CG 1206 C CD . GLU A 154 ? 0.6875 0.7478 0.7380 -0.0301 0.0404 0.0092 213 GLU A CD 1207 O OE1 . GLU A 154 ? 0.8004 0.8606 0.8570 -0.0307 0.0386 0.0084 213 GLU A OE1 1208 O OE2 . GLU A 154 ? 0.7212 0.7820 0.7685 -0.0291 0.0406 0.0089 213 GLU A OE2 1209 N N . ARG A 155 ? 0.4269 0.4935 0.4805 -0.0319 0.0497 0.0205 214 ARG A N 1210 C CA . ARG A 155 ? 0.3090 0.3785 0.3680 -0.0321 0.0514 0.0238 214 ARG A CA 1211 C C . ARG A 155 ? 0.3168 0.3887 0.3800 -0.0318 0.0507 0.0248 214 ARG A C 1212 O O . ARG A 155 ? 0.4276 0.5000 0.4867 -0.0309 0.0508 0.0247 214 ARG A O 1213 C CB . ARG A 155 ? 0.3079 0.3779 0.3623 -0.0314 0.0539 0.0259 214 ARG A CB 1214 C CG . ARG A 155 ? 0.3076 0.3757 0.3592 -0.0318 0.0548 0.0254 214 ARG A CG 1215 C CD . ARG A 155 ? 0.3375 0.4055 0.3831 -0.0308 0.0570 0.0267 214 ARG A CD 1216 N NE . ARG A 155 ? 0.5312 0.5965 0.5702 -0.0308 0.0568 0.0243 214 ARG A NE 1217 C CZ . ARG A 155 ? 0.4132 0.4770 0.4465 -0.0303 0.0560 0.0224 214 ARG A CZ 1218 N NH1 . ARG A 155 ? 0.6366 0.7014 0.6698 -0.0297 0.0553 0.0224 214 ARG A NH1 1219 N NH2 . ARG A 155 ? 0.5957 0.6569 0.6233 -0.0302 0.0561 0.0203 214 ARG A NH2 1220 N N . HIS A 156 ? 0.3087 0.3821 0.3801 -0.0326 0.0500 0.0256 215 HIS A N 1221 C CA . HIS A 156 ? 0.3874 0.4632 0.4638 -0.0325 0.0493 0.0264 215 HIS A CA 1222 C C . HIS A 156 ? 0.5373 0.6155 0.6126 -0.0315 0.0513 0.0294 215 HIS A C 1223 O O . HIS A 156 ? 0.4183 0.4979 0.4935 -0.0309 0.0508 0.0296 215 HIS A O 1224 C CB . HIS A 156 ? 0.3083 0.3855 0.3943 -0.0336 0.0486 0.0271 215 HIS A CB 1225 C CG . HIS A 156 ? 0.4402 0.5194 0.5307 -0.0337 0.0511 0.0307 215 HIS A CG 1226 N ND1 . HIS A 156 ? 0.3060 0.3844 0.3946 -0.0338 0.0530 0.0319 215 HIS A ND1 1227 C CD2 . HIS A 156 ? 0.3601 0.4421 0.4568 -0.0336 0.0520 0.0334 215 HIS A CD2 1228 C CE1 . HIS A 156 ? 0.3049 0.3853 0.3981 -0.0336 0.0550 0.0351 215 HIS A CE1 1229 N NE2 . HIS A 156 ? 0.5548 0.6374 0.6531 -0.0335 0.0545 0.0361 215 HIS A NE2 1230 N N . HIS A 157 ? 0.3063 0.3849 0.3804 -0.0312 0.0537 0.0319 216 HIS A N 1231 C CA . HIS A 157 ? 0.4618 0.5425 0.5349 -0.0301 0.0557 0.0350 216 HIS A CA 1232 C C . HIS A 157 ? 0.3993 0.4792 0.4637 -0.0290 0.0559 0.0344 216 HIS A C 1233 O O . HIS A 157 ? 0.6140 0.6956 0.6767 -0.0279 0.0571 0.0366 216 HIS A O 1234 C CB . HIS A 157 ? 0.3039 0.3850 0.3787 -0.0299 0.0581 0.0377 216 HIS A CB 1235 C CG . HIS A 157 ? 0.5112 0.5900 0.5800 -0.0299 0.0588 0.0365 216 HIS A CG 1236 N ND1 . HIS A 157 ? 0.4030 0.4813 0.4649 -0.0287 0.0603 0.0373 216 HIS A ND1 1237 C CD2 . HIS A 157 ? 0.3164 0.3931 0.3850 -0.0309 0.0582 0.0346 216 HIS A CD2 1238 C CE1 . HIS A 157 ? 0.3934 0.4695 0.4514 -0.0290 0.0606 0.0359 216 HIS A CE1 1239 N NE2 . HIS A 157 ? 0.4781 0.5532 0.5400 -0.0303 0.0594 0.0342 216 HIS A NE2 1240 N N . ALA A 158 ? 0.4736 0.5508 0.5323 -0.0292 0.0548 0.0313 217 ALA A N 1241 C CA . ALA A 158 ? 0.4865 0.5626 0.5368 -0.0282 0.0549 0.0303 217 ALA A CA 1242 C C . ALA A 158 ? 0.4393 0.5162 0.4894 -0.0277 0.0533 0.0290 217 ALA A C 1243 O O . ALA A 158 ? 0.5667 0.6442 0.6118 -0.0267 0.0538 0.0296 217 ALA A O 1244 C CB . ALA A 158 ? 0.4928 0.5657 0.5373 -0.0284 0.0544 0.0274 217 ALA A CB 1245 N N . GLU A 159 ? 0.4345 0.5114 0.4899 -0.0285 0.0513 0.0273 218 GLU A N 1246 C CA . GLU A 159 ? 0.5060 0.5838 0.5625 -0.0281 0.0496 0.0260 218 GLU A CA 1247 C C . GLU A 159 ? 0.3671 0.4482 0.4267 -0.0276 0.0507 0.0292 218 GLU A C 1248 O O . GLU A 159 ? 0.4787 0.5606 0.5346 -0.0266 0.0504 0.0291 218 GLU A O 1249 C CB . GLU A 159 ? 0.3915 0.4689 0.4545 -0.0290 0.0473 0.0239 218 GLU A CB 1250 C CG . GLU A 159 ? 0.5821 0.6560 0.6416 -0.0292 0.0457 0.0203 218 GLU A CG 1251 C CD . GLU A 159 ? 0.6950 0.7672 0.7481 -0.0281 0.0443 0.0173 218 GLU A CD 1252 O OE1 . GLU A 159 ? 0.5932 0.6661 0.6413 -0.0271 0.0452 0.0181 218 GLU A OE1 1253 O OE2 . GLU A 159 ? 0.6184 0.6884 0.6715 -0.0280 0.0423 0.0142 218 GLU A OE2 1254 N N . ILE A 160 ? 0.3076 0.3905 0.3737 -0.0281 0.0519 0.0321 219 ILE A N 1255 C CA . ILE A 160 ? 0.3064 0.3925 0.3762 -0.0275 0.0532 0.0355 219 ILE A CA 1256 C C . ILE A 160 ? 0.5252 0.6116 0.5879 -0.0261 0.0550 0.0376 219 ILE A C 1257 O O . ILE A 160 ? 0.4421 0.5300 0.5028 -0.0252 0.0550 0.0387 219 ILE A O 1258 C CB . ILE A 160 ? 0.4512 0.5387 0.5292 -0.0282 0.0544 0.0382 219 ILE A CB 1259 C CG1 . ILE A 160 ? 0.3145 0.4021 0.4003 -0.0296 0.0525 0.0363 219 ILE A CG1 1260 C CG2 . ILE A 160 ? 0.3041 0.3946 0.3853 -0.0273 0.0560 0.0420 219 ILE A CG2 1261 C CD1 . ILE A 160 ? 0.3050 0.3929 0.3974 -0.0305 0.0537 0.0380 219 ILE A CD1 1262 N N . ALA A 161 ? 0.4256 0.5106 0.4845 -0.0260 0.0565 0.0382 220 ALA A N 1263 C CA . ALA A 161 ? 0.3945 0.4795 0.4470 -0.0246 0.0583 0.0403 220 ALA A CA 1264 C C . ALA A 161 ? 0.3564 0.4406 0.4009 -0.0237 0.0575 0.0387 220 ALA A C 1265 O O . ALA A 161 ? 0.4426 0.5281 0.4837 -0.0225 0.0584 0.0409 220 ALA A O 1266 C CB . ALA A 161 ? 0.3042 0.3874 0.3539 -0.0247 0.0596 0.0403 220 ALA A CB 1267 N N . THR A 162 ? 0.3071 0.3891 0.3484 -0.0243 0.0559 0.0350 221 THR A N 1268 C CA . THR A 162 ? 0.5179 0.5987 0.5510 -0.0234 0.0553 0.0332 221 THR A CA 1269 C C . THR A 162 ? 0.4562 0.5389 0.4903 -0.0228 0.0543 0.0334 221 THR A C 1270 O O . THR A 162 ? 0.4307 0.5137 0.4586 -0.0217 0.0546 0.0338 221 THR A O 1271 C CB . THR A 162 ? 0.4454 0.5230 0.4748 -0.0239 0.0539 0.0291 221 THR A CB 1272 O OG1 . THR A 162 ? 0.3259 0.4018 0.3549 -0.0246 0.0548 0.0289 221 THR A OG1 1273 C CG2 . THR A 162 ? 0.3111 0.3871 0.3314 -0.0228 0.0538 0.0273 221 THR A CG2 1274 N N . PHE A 163 ? 0.4976 0.5817 0.5394 -0.0236 0.0530 0.0330 222 PHE A N 1275 C CA . PHE A 163 ? 0.5134 0.5997 0.5572 -0.0231 0.0520 0.0333 222 PHE A CA 1276 C C . PHE A 163 ? 0.4715 0.5603 0.5148 -0.0220 0.0537 0.0374 222 PHE A C 1277 O O . PHE A 163 ? 0.5503 0.6400 0.5893 -0.0210 0.0535 0.0376 222 PHE A O 1278 C CB . PHE A 163 ? 0.3091 0.3967 0.3626 -0.0241 0.0506 0.0327 222 PHE A CB 1279 C CG . PHE A 163 ? 0.4877 0.5783 0.5452 -0.0237 0.0501 0.0342 222 PHE A CG 1280 C CD1 . PHE A 163 ? 0.5101 0.6008 0.5639 -0.0229 0.0487 0.0320 222 PHE A CD1 1281 C CD2 . PHE A 163 ? 0.3710 0.4643 0.4362 -0.0240 0.0513 0.0377 222 PHE A CD2 1282 C CE1 . PHE A 163 ? 0.4544 0.5479 0.5118 -0.0225 0.0482 0.0333 222 PHE A CE1 1283 C CE2 . PHE A 163 ? 0.4456 0.5418 0.5147 -0.0236 0.0509 0.0391 222 PHE A CE2 1284 C CZ . PHE A 163 ? 0.4228 0.5191 0.4881 -0.0229 0.0493 0.0369 222 PHE A CZ 1285 N N . HIS A 164 ? 0.3172 0.4072 0.3648 -0.0222 0.0554 0.0405 223 HIS A N 1286 C CA . HIS A 164 ? 0.5602 0.6524 0.6074 -0.0210 0.0572 0.0446 223 HIS A CA 1287 C C . HIS A 164 ? 0.5606 0.6516 0.5979 -0.0197 0.0581 0.0450 223 HIS A C 1288 O O . HIS A 164 ? 0.4368 0.5293 0.4709 -0.0184 0.0585 0.0470 223 HIS A O 1289 C CB . HIS A 164 ? 0.3036 0.3967 0.3570 -0.0212 0.0589 0.0476 223 HIS A CB 1290 C CG . HIS A 164 ? 0.4491 0.5441 0.5126 -0.0221 0.0585 0.0485 223 HIS A CG 1291 N ND1 . HIS A 164 ? 0.3737 0.4713 0.4423 -0.0214 0.0597 0.0522 223 HIS A ND1 1292 C CD2 . HIS A 164 ? 0.4072 0.5019 0.4768 -0.0236 0.0570 0.0461 223 HIS A CD2 1293 C CE1 . HIS A 164 ? 0.4170 0.5159 0.4946 -0.0225 0.0591 0.0521 223 HIS A CE1 1294 N NE2 . HIS A 164 ? 0.4376 0.5347 0.5159 -0.0238 0.0573 0.0484 223 HIS A NE2 1295 N N . LEU A 165 ? 0.4606 0.5489 0.4931 -0.0200 0.0584 0.0432 224 LEU A N 1296 C CA . LEU A 165 ? 0.5208 0.6078 0.5441 -0.0188 0.0592 0.0433 224 LEU A CA 1297 C C . LEU A 165 ? 0.6249 0.7114 0.6419 -0.0183 0.0580 0.0412 224 LEU A C 1298 O O . LEU A 165 ? 0.3072 0.3939 0.3177 -0.0170 0.0587 0.0425 224 LEU A O 1299 C CB . LEU A 165 ? 0.3276 0.4118 0.3475 -0.0194 0.0597 0.0414 224 LEU A CB 1300 C CG . LEU A 165 ? 0.4965 0.5791 0.5070 -0.0184 0.0606 0.0412 224 LEU A CG 1301 C CD1 . LEU A 165 ? 0.4223 0.5066 0.4318 -0.0169 0.0622 0.0452 224 LEU A CD1 1302 C CD2 . LEU A 165 ? 0.4212 0.5010 0.4289 -0.0191 0.0609 0.0389 224 LEU A CD2 1303 N N . ASP A 166 ? 0.3084 0.3942 0.3273 -0.0191 0.0562 0.0380 225 ASP A N 1304 C CA . ASP A 166 ? 0.4941 0.5793 0.5075 -0.0184 0.0550 0.0357 225 ASP A CA 1305 C C . ASP A 166 ? 0.5550 0.6431 0.5691 -0.0175 0.0549 0.0381 225 ASP A C 1306 O O . ASP A 166 ? 0.5149 0.6028 0.5220 -0.0164 0.0547 0.0375 225 ASP A O 1307 C CB . ASP A 166 ? 0.5813 0.6651 0.5975 -0.0193 0.0530 0.0318 225 ASP A CB 1308 C CG . ASP A 166 ? 0.5242 0.6074 0.5350 -0.0184 0.0516 0.0292 225 ASP A CG 1309 O OD1 . ASP A 166 ? 0.4697 0.5551 0.4840 -0.0182 0.0507 0.0295 225 ASP A OD1 1310 O OD2 . ASP A 166 ? 0.4594 0.5398 0.4625 -0.0179 0.0516 0.0266 225 ASP A OD2 1311 N N . ARG A 167 ? 0.3703 0.4610 0.3926 -0.0178 0.0552 0.0408 226 ARG A N 1312 C CA . ARG A 167 ? 0.3833 0.4770 0.4069 -0.0169 0.0554 0.0436 226 ARG A CA 1313 C C . ARG A 167 ? 0.5325 0.6269 0.5513 -0.0155 0.0572 0.0473 226 ARG A C 1314 O O . ARG A 167 ? 0.4452 0.5405 0.4588 -0.0142 0.0573 0.0484 226 ARG A O 1315 C CB . ARG A 167 ? 0.4998 0.5960 0.5343 -0.0176 0.0551 0.0452 226 ARG A CB 1316 C CG . ARG A 167 ? 0.4320 0.5314 0.4685 -0.0166 0.0555 0.0484 226 ARG A CG 1317 C CD . ARG A 167 ? 0.4420 0.5437 0.4892 -0.0175 0.0548 0.0491 226 ARG A CD 1318 N NE . ARG A 167 ? 0.4752 0.5777 0.5302 -0.0181 0.0562 0.0517 226 ARG A NE 1319 C CZ . ARG A 167 ? 0.6722 0.7764 0.7371 -0.0191 0.0558 0.0521 226 ARG A CZ 1320 N NH1 . ARG A 167 ? 0.4636 0.5688 0.5318 -0.0196 0.0540 0.0500 226 ARG A NH1 1321 N NH2 . ARG A 167 ? 0.7322 0.8368 0.8035 -0.0195 0.0573 0.0545 226 ARG A NH2 1322 N N . VAL A 168 ? 0.3056 0.3994 0.3259 -0.0156 0.0587 0.0491 227 VAL A N 1323 C CA . VAL A 168 ? 0.3778 0.4720 0.3939 -0.0141 0.0604 0.0525 227 VAL A CA 1324 C C . VAL A 168 ? 0.4961 0.5886 0.5014 -0.0131 0.0603 0.0512 227 VAL A C 1325 O O . VAL A 168 ? 0.7010 0.7944 0.7018 -0.0116 0.0611 0.0538 227 VAL A O 1326 C CB . VAL A 168 ? 0.4953 0.5886 0.5142 -0.0143 0.0619 0.0538 227 VAL A CB 1327 C CG1 . VAL A 168 ? 0.5900 0.6832 0.6035 -0.0126 0.0635 0.0568 227 VAL A CG1 1328 C CG2 . VAL A 168 ? 0.5774 0.6725 0.6066 -0.0150 0.0623 0.0557 227 VAL A CG2 1329 N N . LEU A 169 ? 0.4337 0.5235 0.4350 -0.0140 0.0595 0.0472 228 LEU A N 1330 C CA . LEU A 169 ? 0.4367 0.5246 0.4278 -0.0132 0.0595 0.0456 228 LEU A CA 1331 C C . LEU A 169 ? 0.4870 0.5757 0.4744 -0.0125 0.0583 0.0445 228 LEU A C 1332 O O . LEU A 169 ? 0.3851 0.4725 0.3639 -0.0117 0.0583 0.0434 228 LEU A O 1333 C CB . LEU A 169 ? 0.3399 0.4246 0.3281 -0.0141 0.0592 0.0418 228 LEU A CB 1334 C CG . LEU A 169 ? 0.4650 0.5485 0.4546 -0.0146 0.0604 0.0424 228 LEU A CG 1335 C CD1 . LEU A 169 ? 0.3370 0.4173 0.3242 -0.0157 0.0599 0.0384 228 LEU A CD1 1336 C CD2 . LEU A 169 ? 0.3507 0.4341 0.3346 -0.0132 0.0619 0.0450 228 LEU A CD2 1337 N N . GLY A 170 ? 0.5662 0.6571 0.5603 -0.0129 0.0573 0.0448 229 GLY A N 1338 C CA . GLY A 170 ? 0.3100 0.4021 0.3015 -0.0122 0.0562 0.0441 229 GLY A CA 1339 C C . GLY A 170 ? 0.6238 0.7138 0.6122 -0.0127 0.0547 0.0393 229 GLY A C 1340 O O . GLY A 170 ? 0.6929 0.7832 0.6768 -0.0118 0.0538 0.0381 229 GLY A O 1341 N N . PHE A 171 ? 0.4642 0.5519 0.4547 -0.0138 0.0543 0.0365 230 PHE A N 1342 C CA . PHE A 171 ? 0.5000 0.5855 0.4880 -0.0140 0.0528 0.0319 230 PHE A CA 1343 C C . PHE A 171 ? 0.4318 0.5189 0.4270 -0.0144 0.0511 0.0306 230 PHE A C 1344 O O . PHE A 171 ? 0.5315 0.6184 0.5235 -0.0137 0.0498 0.0283 230 PHE A O 1345 C CB . PHE A 171 ? 0.7825 0.8649 0.7705 -0.0149 0.0529 0.0295 230 PHE A CB 1346 C CG . PHE A 171 ? 0.7471 0.8273 0.7271 -0.0145 0.0544 0.0298 230 PHE A CG 1347 C CD1 . PHE A 171 ? 0.4738 0.5539 0.4455 -0.0132 0.0551 0.0306 230 PHE A CD1 1348 C CD2 . PHE A 171 ? 0.6667 0.7449 0.6477 -0.0154 0.0551 0.0292 230 PHE A CD2 1349 C CE1 . PHE A 171 ? 0.6245 0.7026 0.5892 -0.0128 0.0564 0.0308 230 PHE A CE1 1350 C CE2 . PHE A 171 ? 0.6555 0.7318 0.6296 -0.0150 0.0564 0.0293 230 PHE A CE2 1351 C CZ . PHE A 171 ? 0.6264 0.7027 0.5925 -0.0137 0.0571 0.0301 230 PHE A CZ 1352 N N . ARG A 172 ? 0.6347 0.7235 0.6396 -0.0156 0.0510 0.0321 231 ARG A N 1353 C CA . ARG A 172 ? 0.5348 0.6252 0.5478 -0.0162 0.0493 0.0309 231 ARG A CA 1354 C C . ARG A 172 ? 0.4472 0.5350 0.4582 -0.0162 0.0474 0.0259 231 ARG A C 1355 O O . ARG A 172 ? 0.5118 0.6004 0.5244 -0.0158 0.0458 0.0241 231 ARG A O 1356 C CB . ARG A 172 ? 0.5041 0.5977 0.5187 -0.0154 0.0491 0.0330 231 ARG A CB 1357 C CG . ARG A 172 ? 0.6001 0.6966 0.6212 -0.0156 0.0505 0.0378 231 ARG A CG 1358 C CD . ARG A 172 ? 0.4178 0.5175 0.4395 -0.0147 0.0505 0.0404 231 ARG A CD 1359 N NE . ARG A 172 ? 0.5809 0.6826 0.6053 -0.0143 0.0524 0.0453 231 ARG A NE 1360 C CZ . ARG A 172 ? 0.5563 0.6579 0.5739 -0.0131 0.0538 0.0479 231 ARG A CZ 1361 N NH1 . ARG A 172 ? 0.6406 0.7400 0.6480 -0.0123 0.0537 0.0461 231 ARG A NH1 1362 N NH2 . ARG A 172 ? 0.5267 0.6301 0.5476 -0.0126 0.0554 0.0524 231 ARG A NH2 1363 N N . ARG A 173 ? 0.3832 0.4677 0.3907 -0.0165 0.0476 0.0238 232 ARG A N 1364 C CA . ARG A 173 ? 0.6262 0.7078 0.6318 -0.0163 0.0459 0.0192 232 ARG A CA 1365 C C . ARG A 173 ? 0.6300 0.7105 0.6422 -0.0177 0.0453 0.0182 232 ARG A C 1366 O O . ARG A 173 ? 0.4822 0.5597 0.4927 -0.0176 0.0442 0.0146 232 ARG A O 1367 C CB . ARG A 173 ? 0.4675 0.5460 0.4621 -0.0153 0.0466 0.0171 232 ARG A CB 1368 C CG . ARG A 173 ? 0.6334 0.7129 0.6207 -0.0139 0.0472 0.0180 232 ARG A CG 1369 C CD . ARG A 173 ? 0.5600 0.6360 0.5370 -0.0126 0.0472 0.0147 232 ARG A CD 1370 N NE . ARG A 173 ? 0.5778 0.6514 0.5493 -0.0128 0.0489 0.0151 232 ARG A NE 1371 C CZ . ARG A 173 ? 0.5112 0.5854 0.4778 -0.0125 0.0506 0.0180 232 ARG A CZ 1372 N NH1 . ARG A 173 ? 0.5643 0.6415 0.5307 -0.0119 0.0509 0.0208 232 ARG A NH1 1373 N NH2 . ARG A 173 ? 0.6445 0.7165 0.6067 -0.0127 0.0520 0.0180 232 ARG A NH2 1374 N N . ALA A 174 ? 0.4434 0.5260 0.4630 -0.0188 0.0462 0.0214 233 ALA A N 1375 C CA . ALA A 174 ? 0.4927 0.5745 0.5192 -0.0202 0.0457 0.0208 233 ALA A CA 1376 C C . ALA A 174 ? 0.5473 0.6313 0.5834 -0.0208 0.0440 0.0204 233 ALA A C 1377 O O . ALA A 174 ? 0.5653 0.6517 0.6033 -0.0203 0.0435 0.0213 233 ALA A O 1378 C CB . ALA A 174 ? 0.4015 0.4841 0.4301 -0.0209 0.0477 0.0243 233 ALA A CB 1379 N N . ILE A 175 ? 0.5607 0.6436 0.6026 -0.0219 0.0430 0.0191 234 ILE A N 1380 C CA . ILE A 175 ? 0.4495 0.5341 0.5009 -0.0226 0.0412 0.0184 234 ILE A CA 1381 C C . ILE A 175 ? 0.4829 0.5701 0.5429 -0.0238 0.0424 0.0221 234 ILE A C 1382 O O . ILE A 175 ? 0.5457 0.6319 0.6062 -0.0246 0.0437 0.0234 234 ILE A O 1383 C CB . ILE A 175 ? 0.4769 0.5586 0.5297 -0.0228 0.0391 0.0145 234 ILE A CB 1384 C CG1 . ILE A 175 ? 0.5387 0.6175 0.5825 -0.0213 0.0381 0.0108 234 ILE A CG1 1385 C CG2 . ILE A 175 ? 0.3754 0.4589 0.4379 -0.0234 0.0370 0.0135 234 ILE A CG2 1386 C CD1 . ILE A 175 ? 0.5574 0.6376 0.5980 -0.0200 0.0376 0.0102 234 ILE A CD1 1387 N N . PRO A 176 ? 0.5860 0.6764 0.6527 -0.0240 0.0422 0.0238 235 PRO A N 1388 C CA . PRO A 176 ? 0.4686 0.5616 0.5439 -0.0250 0.0435 0.0275 235 PRO A CA 1389 C C . PRO A 176 ? 0.6254 0.7172 0.7065 -0.0264 0.0433 0.0271 235 PRO A C 1390 O O . PRO A 176 ? 0.3697 0.4604 0.4546 -0.0269 0.0412 0.0242 235 PRO A O 1391 C CB . PRO A 176 ? 0.4249 0.5208 0.5069 -0.0249 0.0422 0.0275 235 PRO A CB 1392 C CG . PRO A 176 ? 0.4406 0.5362 0.5149 -0.0235 0.0414 0.0256 235 PRO A CG 1393 C CD . PRO A 176 ? 0.3451 0.4368 0.4109 -0.0230 0.0408 0.0224 235 PRO A CD 1394 N N . THR A 177 ? 0.3097 0.4017 0.3913 -0.0268 0.0455 0.0301 236 THR A N 1395 C CA . THR A 177 ? 0.3505 0.4413 0.4366 -0.0280 0.0457 0.0300 236 THR A CA 1396 C C . THR A 177 ? 0.3755 0.4685 0.4675 -0.0284 0.0480 0.0342 236 THR A C 1397 O O . THR A 177 ? 0.5194 0.6134 0.6081 -0.0276 0.0500 0.0371 236 THR A O 1398 C CB . THR A 177 ? 0.5293 0.6168 0.6077 -0.0279 0.0461 0.0284 236 THR A CB 1399 O OG1 . THR A 177 ? 0.4566 0.5418 0.5288 -0.0272 0.0443 0.0247 236 THR A OG1 1400 C CG2 . THR A 177 ? 0.3097 0.3958 0.3925 -0.0292 0.0459 0.0279 236 THR A CG2 1401 N N . VAL A 178 ? 0.3073 0.4009 0.4081 -0.0297 0.0476 0.0344 237 VAL A N 1402 C CA . VAL A 178 ? 0.3913 0.4867 0.4982 -0.0300 0.0498 0.0383 237 VAL A CA 1403 C C . VAL A 178 ? 0.3382 0.4321 0.4489 -0.0312 0.0501 0.0379 237 VAL A C 1404 O O . VAL A 178 ? 0.4371 0.5291 0.5485 -0.0320 0.0480 0.0347 237 VAL A O 1405 C CB . VAL A 178 ? 0.4869 0.5854 0.6027 -0.0302 0.0495 0.0398 237 VAL A CB 1406 C CG1 . VAL A 178 ? 0.3063 0.4046 0.4301 -0.0316 0.0474 0.0375 237 VAL A CG1 1407 C CG2 . VAL A 178 ? 0.3041 0.4047 0.4241 -0.0299 0.0524 0.0444 237 VAL A CG2 1408 N N . GLY A 179 ? 0.4484 0.5429 0.5610 -0.0311 0.0526 0.0411 238 GLY A N 1409 C CA . GLY A 179 ? 0.4340 0.5273 0.5507 -0.0322 0.0531 0.0412 238 GLY A CA 1410 C C . GLY A 179 ? 0.5237 0.6187 0.6511 -0.0333 0.0525 0.0417 238 GLY A C 1411 O O . GLY A 179 ? 0.4188 0.5163 0.5511 -0.0330 0.0528 0.0434 238 GLY A O 1412 N N . ARG A 180 ? 0.4498 0.5433 0.5809 -0.0345 0.0516 0.0401 239 ARG A N 1413 C CA . ARG A 180 ? 0.4212 0.5161 0.5627 -0.0357 0.0510 0.0405 239 ARG A CA 1414 C C . ARG A 180 ? 0.4892 0.5823 0.6333 -0.0368 0.0513 0.0401 239 ARG A C 1415 O O . ARG A 180 ? 0.4335 0.5241 0.5732 -0.0372 0.0499 0.0374 239 ARG A O 1416 C CB . ARG A 180 ? 0.3309 0.4261 0.4752 -0.0361 0.0478 0.0374 239 ARG A CB 1417 C CG . ARG A 180 ? 0.3381 0.4350 0.4936 -0.0373 0.0470 0.0376 239 ARG A CG 1418 C CD . ARG A 180 ? 0.3072 0.4043 0.4651 -0.0375 0.0437 0.0343 239 ARG A CD 1419 N NE . ARG A 180 ? 0.5199 0.6184 0.6887 -0.0387 0.0427 0.0342 239 ARG A NE 1420 C CZ . ARG A 180 ? 0.4071 0.5072 0.5810 -0.0387 0.0407 0.0328 239 ARG A CZ 1421 N NH1 . ARG A 180 ? 0.5038 0.6044 0.6727 -0.0376 0.0395 0.0314 239 ARG A NH1 1422 N NH2 . ARG A 180 ? 0.3423 0.4437 0.5264 -0.0398 0.0399 0.0328 239 ARG A NH2 1423 N N . VAL A 181 ? 0.3631 0.4576 0.5144 -0.0372 0.0533 0.0428 240 VAL A N 1424 C CA . VAL A 181 ? 0.3610 0.4540 0.5155 -0.0382 0.0536 0.0426 240 VAL A CA 1425 C C . VAL A 181 ? 0.3050 0.3985 0.4681 -0.0397 0.0513 0.0409 240 VAL A C 1426 O O . VAL A 181 ? 0.5065 0.6023 0.6775 -0.0399 0.0517 0.0424 240 VAL A O 1427 C CB . VAL A 181 ? 0.3346 0.4285 0.4919 -0.0378 0.0572 0.0464 240 VAL A CB 1428 C CG1 . VAL A 181 ? 0.3035 0.3957 0.4635 -0.0388 0.0576 0.0460 240 VAL A CG1 1429 C CG2 . VAL A 181 ? 0.3025 0.3961 0.4515 -0.0361 0.0593 0.0482 240 VAL A CG2 1430 N N . LEU A 182 ? 0.4061 0.4973 0.5676 -0.0405 0.0489 0.0377 241 LEU A N 1431 C CA . LEU A 182 ? 0.4121 0.5033 0.5810 -0.0417 0.0462 0.0355 241 LEU A CA 1432 C C . LEU A 182 ? 0.4361 0.5264 0.6103 -0.0429 0.0466 0.0359 241 LEU A C 1433 O O . LEU A 182 ? 0.6720 0.7604 0.8418 -0.0429 0.0478 0.0362 241 LEU A O 1434 C CB . LEU A 182 ? 0.3405 0.4297 0.5046 -0.0415 0.0428 0.0315 241 LEU A CB 1435 C CG . LEU A 182 ? 0.5708 0.6611 0.7317 -0.0405 0.0416 0.0304 241 LEU A CG 1436 C CD1 . LEU A 182 ? 0.5211 0.6102 0.6713 -0.0393 0.0428 0.0305 241 LEU A CD1 1437 C CD2 . LEU A 182 ? 0.7057 0.7949 0.8681 -0.0406 0.0378 0.0265 241 LEU A CD2 1438 N N . ASN A 183 ? 0.4840 0.5755 0.6677 -0.0439 0.0455 0.0357 242 ASN A N 1439 C CA . ASN A 183 ? 0.3079 0.3983 0.4970 -0.0452 0.0450 0.0353 242 ASN A CA 1440 C C . ASN A 183 ? 0.3091 0.3971 0.4955 -0.0456 0.0413 0.0314 242 ASN A C 1441 O O . ASN A 183 ? 0.5115 0.5998 0.7011 -0.0457 0.0384 0.0290 242 ASN A O 1442 C CB . ASN A 183 ? 0.3107 0.4035 0.5113 -0.0461 0.0453 0.0367 242 ASN A CB 1443 C CG . ASN A 183 ? 0.4473 0.5390 0.6537 -0.0474 0.0451 0.0366 242 ASN A CG 1444 O OD1 . ASN A 183 ? 0.4944 0.5845 0.7014 -0.0482 0.0421 0.0337 242 ASN A OD1 1445 N ND2 . ASN A 183 ? 0.5103 0.6029 0.7208 -0.0476 0.0484 0.0398 242 ASN A ND2 1446 N N . MSE A 184 ? 0.3093 0.3947 0.4897 -0.0457 0.0414 0.0306 243 MSE A N 1447 C CA . MSE A 184 ? 0.4511 0.5338 0.6276 -0.0458 0.0381 0.0270 243 MSE A CA 1448 C C . MSE A 184 ? 0.4723 0.5548 0.6569 -0.0469 0.0352 0.0252 243 MSE A C 1449 O O . MSE A 184 ? 0.5369 0.6178 0.7201 -0.0467 0.0318 0.0220 243 MSE A O 1450 C CB . MSE A 184 ? 0.4408 0.5209 0.6103 -0.0459 0.0391 0.0269 243 MSE A CB 1451 C CG . MSE A 184 ? 0.3096 0.3895 0.4706 -0.0448 0.0416 0.0283 243 MSE A CG 1452 SE SE . MSE A 184 ? 0.7496 0.8262 0.9020 -0.0448 0.0426 0.0277 243 MSE A SE 1453 C CE . MSE A 184 ? 0.4390 0.5126 0.5874 -0.0448 0.0378 0.0231 243 MSE A CE 1454 N N . THR A 185 ? 0.3865 0.4704 0.5795 -0.0479 0.0366 0.0272 244 THR A N 1455 C CA . THR A 185 ? 0.4705 0.5542 0.6717 -0.0490 0.0341 0.0258 244 THR A CA 1456 C C . THR A 185 ? 0.4435 0.5292 0.6510 -0.0489 0.0319 0.0245 244 THR A C 1457 O O . THR A 185 ? 0.3751 0.4596 0.5839 -0.0489 0.0282 0.0213 244 THR A O 1458 C CB . THR A 185 ? 0.4799 0.5645 0.6883 -0.0502 0.0365 0.0284 244 THR A CB 1459 O OG1 . THR A 185 ? 0.3113 0.3941 0.5137 -0.0502 0.0386 0.0294 244 THR A OG1 1460 C CG2 . THR A 185 ? 0.4696 0.5539 0.6863 -0.0514 0.0337 0.0267 244 THR A CG2 1461 N N . THR A 186 ? 0.3950 0.4836 0.6062 -0.0487 0.0341 0.0268 245 THR A N 1462 C CA . THR A 186 ? 0.4037 0.4945 0.6219 -0.0487 0.0324 0.0260 245 THR A CA 1463 C C . THR A 186 ? 0.3300 0.4210 0.5422 -0.0473 0.0306 0.0239 245 THR A C 1464 O O . THR A 186 ? 0.6351 0.7264 0.8506 -0.0471 0.0275 0.0213 245 THR A O 1465 C CB . THR A 186 ? 0.4159 0.5099 0.6414 -0.0490 0.0355 0.0296 245 THR A CB 1466 O OG1 . THR A 186 ? 0.4167 0.5114 0.6357 -0.0480 0.0387 0.0322 245 THR A OG1 1467 C CG2 . THR A 186 ? 0.3108 0.4049 0.5435 -0.0503 0.0371 0.0314 245 THR A CG2 1468 N N . GLU A 187 ? 0.5553 0.6458 0.7585 -0.0463 0.0326 0.0250 246 GLU A N 1469 C CA . GLU A 187 ? 0.4064 0.4972 0.6036 -0.0449 0.0316 0.0236 246 GLU A CA 1470 C C . GLU A 187 ? 0.3130 0.4005 0.5013 -0.0441 0.0292 0.0203 246 GLU A C 1471 O O . GLU A 187 ? 0.5148 0.6020 0.6991 -0.0430 0.0274 0.0180 246 GLU A O 1472 C CB . GLU A 187 ? 0.3583 0.4508 0.5512 -0.0442 0.0351 0.0267 246 GLU A CB 1473 C CG . GLU A 187 ? 0.3096 0.4053 0.5108 -0.0446 0.0374 0.0301 246 GLU A CG 1474 C CD . GLU A 187 ? 0.5454 0.6426 0.7419 -0.0435 0.0407 0.0333 246 GLU A CD 1475 O OE1 . GLU A 187 ? 0.4865 0.5857 0.6834 -0.0428 0.0406 0.0337 246 GLU A OE1 1476 O OE2 . GLU A 187 ? 0.4090 0.5052 0.6012 -0.0434 0.0432 0.0353 246 GLU A OE2 1477 N N . LEU A 188 ? 0.4485 0.5335 0.6335 -0.0446 0.0293 0.0200 247 LEU A N 1478 C CA . LEU A 188 ? 0.4570 0.5388 0.6336 -0.0438 0.0272 0.0170 247 LEU A CA 1479 C C . LEU A 188 ? 0.3566 0.4363 0.5368 -0.0443 0.0239 0.0144 247 LEU A C 1480 O O . LEU A 188 ? 0.5418 0.6204 0.7217 -0.0434 0.0207 0.0112 247 LEU A O 1481 C CB . LEU A 188 ? 0.3136 0.3937 0.4819 -0.0436 0.0298 0.0185 247 LEU A CB 1482 C CG . LEU A 188 ? 0.4468 0.5282 0.6091 -0.0427 0.0325 0.0204 247 LEU A CG 1483 C CD1 . LEU A 188 ? 0.3121 0.3915 0.4657 -0.0424 0.0343 0.0210 247 LEU A CD1 1484 C CD2 . LEU A 188 ? 0.3133 0.3949 0.4722 -0.0414 0.0307 0.0183 247 LEU A CD2 1485 N N . PHE A 189 ? 0.4176 0.4966 0.6009 -0.0455 0.0247 0.0156 248 PHE A N 1486 C CA . PHE A 189 ? 0.4953 0.5721 0.6815 -0.0460 0.0217 0.0134 248 PHE A CA 1487 C C . PHE A 189 ? 0.5277 0.6057 0.7227 -0.0461 0.0186 0.0115 248 PHE A C 1488 O O . PHE A 189 ? 0.4002 0.4761 0.5939 -0.0453 0.0151 0.0082 248 PHE A O 1489 C CB . PHE A 189 ? 0.5178 0.5944 0.7070 -0.0474 0.0236 0.0156 248 PHE A CB 1490 C CG . PHE A 189 ? 0.4172 0.4915 0.6090 -0.0480 0.0206 0.0136 248 PHE A CG 1491 C CD1 . PHE A 189 ? 0.3599 0.4308 0.5443 -0.0472 0.0186 0.0113 248 PHE A CD1 1492 C CD2 . PHE A 189 ? 0.3726 0.4481 0.5745 -0.0492 0.0199 0.0140 248 PHE A CD2 1493 C CE1 . PHE A 189 ? 0.4200 0.4887 0.6066 -0.0476 0.0158 0.0096 248 PHE A CE1 1494 C CE2 . PHE A 189 ? 0.4062 0.4795 0.6105 -0.0497 0.0171 0.0123 248 PHE A CE2 1495 C CZ . PHE A 189 ? 0.4150 0.4850 0.6115 -0.0489 0.0150 0.0101 248 PHE A CZ 1496 N N . GLU A 190 ? 0.5057 0.5867 0.7096 -0.0471 0.0200 0.0135 249 GLU A N 1497 C CA . GLU A 190 ? 0.5363 0.6186 0.7496 -0.0474 0.0173 0.0119 249 GLU A CA 1498 C C . GLU A 190 ? 0.4921 0.5750 0.7040 -0.0459 0.0151 0.0095 249 GLU A C 1499 O O . GLU A 190 ? 0.5347 0.6178 0.7525 -0.0457 0.0119 0.0070 249 GLU A O 1500 C CB . GLU A 190 ? 0.5215 0.6070 0.7447 -0.0488 0.0197 0.0150 249 GLU A CB 1501 C CG . GLU A 190 ? 0.4491 0.5339 0.6763 -0.0502 0.0210 0.0166 249 GLU A CG 1502 C CD . GLU A 190 ? 0.5637 0.6514 0.7988 -0.0513 0.0244 0.0203 249 GLU A CD 1503 O OE1 . GLU A 190 ? 0.6441 0.7345 0.8818 -0.0510 0.0257 0.0215 249 GLU A OE1 1504 O OE2 . GLU A 190 ? 0.6046 0.6918 0.8429 -0.0525 0.0259 0.0219 249 GLU A OE2 1505 N N . LYS A 191 ? 0.5172 0.6004 0.7212 -0.0448 0.0168 0.0101 250 LYS A N 1506 C CA . LYS A 191 ? 0.5168 0.6005 0.7182 -0.0433 0.0151 0.0078 250 LYS A CA 1507 C C . LYS A 191 ? 0.4427 0.5228 0.6343 -0.0417 0.0129 0.0047 250 LYS A C 1508 O O . LYS A 191 ? 0.4551 0.5351 0.6431 -0.0402 0.0115 0.0025 250 LYS A O 1509 C CB . LYS A 191 ? 0.4068 0.4932 0.6060 -0.0430 0.0183 0.0105 250 LYS A CB 1510 C CG . LYS A 191 ? 0.3993 0.4893 0.6081 -0.0443 0.0205 0.0136 250 LYS A CG 1511 C CD . LYS A 191 ? 0.5544 0.6459 0.7731 -0.0446 0.0177 0.0118 250 LYS A CD 1512 C CE . LYS A 191 ? 0.4534 0.5485 0.6821 -0.0459 0.0200 0.0150 250 LYS A CE 1513 N NZ . LYS A 191 ? 0.5228 0.6195 0.7614 -0.0462 0.0174 0.0132 250 LYS A NZ 1514 N N . ALA A 192 ? 0.3271 0.4044 0.5144 -0.0419 0.0127 0.0044 251 ALA A N 1515 C CA . ALA A 192 ? 0.5718 0.6456 0.7492 -0.0404 0.0113 0.0019 251 ALA A CA 1516 C C . ALA A 192 ? 0.3377 0.4091 0.5165 -0.0393 0.0068 -0.0021 251 ALA A C 1517 O O . ALA A 192 ? 0.4884 0.5600 0.6753 -0.0401 0.0049 -0.0027 251 ALA A O 1518 C CB . ALA A 192 ? 0.4805 0.5522 0.6521 -0.0410 0.0131 0.0033 251 ALA A CB 1519 N N . GLU A 193 ? 0.4551 0.5241 0.6261 -0.0373 0.0053 -0.0047 252 GLU A N 1520 C CA . GLU A 193 ? 0.3269 0.3929 0.4974 -0.0357 0.0012 -0.0086 252 GLU A CA 1521 C C . GLU A 193 ? 0.6604 0.7235 0.8300 -0.0363 0.0001 -0.0087 252 GLU A C 1522 O O . GLU A 193 ? 0.6012 0.6640 0.7678 -0.0375 0.0027 -0.0063 252 GLU A O 1523 C CB . GLU A 193 ? 0.4912 0.5549 0.6522 -0.0333 0.0004 -0.0111 252 GLU A CB 1524 C CG . GLU A 193 ? 0.5938 0.6553 0.7444 -0.0330 0.0027 -0.0102 252 GLU A CG 1525 C CD . GLU A 193 ? 0.6826 0.7413 0.8242 -0.0305 0.0017 -0.0130 252 GLU A CD 1526 O OE1 . GLU A 193 ? 0.7151 0.7719 0.8573 -0.0287 -0.0017 -0.0163 252 GLU A OE1 1527 O OE2 . GLU A 193 ? 0.6026 0.6611 0.7364 -0.0303 0.0043 -0.0119 252 GLU A OE2 1528 N N . LYS A 194 ? 0.7383 0.7992 0.9105 -0.0352 -0.0038 -0.0117 253 LYS A N 1529 C CA . LYS A 194 ? 0.6617 0.7199 0.8342 -0.0357 -0.0054 -0.0120 253 LYS A CA 1530 C C . LYS A 194 ? 0.6543 0.7095 0.8164 -0.0352 -0.0040 -0.0116 253 LYS A C 1531 O O . LYS A 194 ? 0.6669 0.7215 0.8286 -0.0365 -0.0029 -0.0098 253 LYS A O 1532 C CB . LYS A 194 ? 0.7820 0.8381 0.9581 -0.0340 -0.0102 -0.0156 253 LYS A CB 1533 C CG . LYS A 194 ? 0.9839 1.0369 1.1599 -0.0341 -0.0125 -0.0163 253 LYS A CG 1534 C CD . LYS A 194 ? 1.0777 1.1281 1.2554 -0.0318 -0.0173 -0.0202 253 LYS A CD 1535 C CE . LYS A 194 ? 1.1075 1.1549 1.2759 -0.0288 -0.0184 -0.0229 253 LYS A CE 1536 N NZ . LYS A 194 ? 1.1459 1.1903 1.3044 -0.0285 -0.0169 -0.0221 253 LYS A NZ 1537 N N . LYS A 195 ? 0.6780 0.7313 0.8317 -0.0332 -0.0041 -0.0133 254 LYS A N 1538 C CA . LYS A 195 ? 0.5905 0.6408 0.7342 -0.0325 -0.0029 -0.0132 254 LYS A CA 1539 C C . LYS A 195 ? 0.6339 0.6862 0.7748 -0.0343 0.0015 -0.0097 254 LYS A C 1540 O O . LYS A 195 ? 0.6665 0.7169 0.8021 -0.0347 0.0027 -0.0088 254 LYS A O 1541 C CB . LYS A 195 ? 0.5792 0.6273 0.7151 -0.0299 -0.0038 -0.0159 254 LYS A CB 1542 C CG . LYS A 195 ? 0.8127 0.8582 0.9381 -0.0292 -0.0019 -0.0155 254 LYS A CG 1543 C CD . LYS A 195 ? 0.7977 0.8411 0.9158 -0.0266 -0.0025 -0.0181 254 LYS A CD 1544 C CE . LYS A 195 ? 0.8823 0.9290 1.0022 -0.0266 -0.0011 -0.0178 254 LYS A CE 1545 N NZ . LYS A 195 ? 0.9951 1.0398 1.1080 -0.0239 -0.0018 -0.0205 254 LYS A NZ 1546 N N . LEU A 196 ? 0.6604 0.7163 0.8048 -0.0353 0.0039 -0.0077 255 LEU A N 1547 C CA . LEU A 196 ? 0.5271 0.5850 0.6696 -0.0368 0.0080 -0.0042 255 LEU A CA 1548 C C . LEU A 196 ? 0.4766 0.5360 0.6260 -0.0389 0.0091 -0.0018 255 LEU A C 1549 O O . LEU A 196 ? 0.4241 0.4834 0.5705 -0.0399 0.0116 0.0004 255 LEU A O 1550 C CB . LEU A 196 ? 0.4756 0.5368 0.6188 -0.0367 0.0101 -0.0029 255 LEU A CB 1551 C CG . LEU A 196 ? 0.3961 0.4597 0.5385 -0.0381 0.0143 0.0008 255 LEU A CG 1552 C CD1 . LEU A 196 ? 0.3220 0.3833 0.4550 -0.0379 0.0162 0.0014 255 LEU A CD1 1553 C CD2 . LEU A 196 ? 0.4196 0.4862 0.5628 -0.0378 0.0159 0.0019 255 LEU A CD2 1554 N N . LYS A 197 ? 0.3920 0.4528 0.5508 -0.0396 0.0071 -0.0022 256 LYS A N 1555 C CA . LYS A 197 ? 0.3634 0.4258 0.5297 -0.0416 0.0081 0.0001 256 LYS A CA 1556 C C . LYS A 197 ? 0.5156 0.5753 0.6788 -0.0422 0.0079 0.0003 256 LYS A C 1557 O O . LYS A 197 ? 0.5017 0.5624 0.6668 -0.0437 0.0103 0.0029 256 LYS A O 1558 C CB . LYS A 197 ? 0.5119 0.5757 0.6886 -0.0420 0.0054 -0.0010 256 LYS A CB 1559 C CG . LYS A 197 ? 0.6123 0.6788 0.7978 -0.0441 0.0073 0.0018 256 LYS A CG 1560 C CD . LYS A 197 ? 0.5329 0.6011 0.7288 -0.0444 0.0048 0.0006 256 LYS A CD 1561 C CE . LYS A 197 ? 0.6474 0.7192 0.8519 -0.0462 0.0077 0.0038 256 LYS A CE 1562 N NZ . LYS A 197 ? 0.8683 0.9417 1.0839 -0.0468 0.0054 0.0028 256 LYS A NZ 1563 N N . LYS A 198 ? 0.5306 0.5869 0.6892 -0.0408 0.0049 -0.0024 257 LYS A N 1564 C CA . LYS A 198 ? 0.3260 0.3795 0.4818 -0.0411 0.0040 -0.0025 257 LYS A CA 1565 C C . LYS A 198 ? 0.5347 0.5872 0.6821 -0.0414 0.0071 -0.0009 257 LYS A C 1566 O O . LYS A 198 ? 0.4689 0.5197 0.6143 -0.0421 0.0072 -0.0003 257 LYS A O 1567 C CB . LYS A 198 ? 0.4429 0.4927 0.5959 -0.0392 -0.0002 -0.0059 257 LYS A CB 1568 C CG . LYS A 198 ? 0.7064 0.7543 0.8508 -0.0371 -0.0004 -0.0078 257 LYS A CG 1569 C CD . LYS A 198 ? 0.9939 1.0380 1.1355 -0.0350 -0.0045 -0.0111 257 LYS A CD 1570 C CE . LYS A 198 ? 1.0734 1.1146 1.2044 -0.0331 -0.0040 -0.0124 257 LYS A CE 1571 N NZ . LYS A 198 ? 1.0576 1.1007 1.1863 -0.0324 -0.0021 -0.0124 257 LYS A NZ 1572 N N . THR A 199 ? 0.5502 0.6038 0.6928 -0.0409 0.0096 -0.0001 258 THR A N 1573 C CA . THR A 199 ? 0.4352 0.4881 0.5698 -0.0410 0.0125 0.0013 258 THR A CA 1574 C C . THR A 199 ? 0.4609 0.5166 0.5984 -0.0427 0.0163 0.0047 258 THR A C 1575 O O . THR A 199 ? 0.4526 0.5082 0.5842 -0.0428 0.0190 0.0061 258 THR A O 1576 C CB . THR A 199 ? 0.4238 0.4761 0.5509 -0.0395 0.0133 0.0003 258 THR A CB 1577 O OG1 . THR A 199 ? 0.4840 0.5397 0.6145 -0.0397 0.0151 0.0016 258 THR A OG1 1578 C CG2 . THR A 199 ? 0.3258 0.3753 0.4502 -0.0375 0.0097 -0.0032 258 THR A CG2 1579 N N . PHE A 200 ? 0.4472 0.5052 0.5937 -0.0439 0.0163 0.0059 259 PHE A N 1580 C CA . PHE A 200 ? 0.3959 0.4565 0.5458 -0.0453 0.0199 0.0092 259 PHE A CA 1581 C C . PHE A 200 ? 0.4717 0.5309 0.6222 -0.0464 0.0202 0.0100 259 PHE A C 1582 O O . PHE A 200 ? 0.5241 0.5814 0.6763 -0.0465 0.0173 0.0084 259 PHE A O 1583 C CB . PHE A 200 ? 0.3581 0.4219 0.5176 -0.0460 0.0202 0.0103 259 PHE A CB 1584 C CG . PHE A 200 ? 0.3179 0.3839 0.4764 -0.0452 0.0215 0.0108 259 PHE A CG 1585 C CD1 . PHE A 200 ? 0.4021 0.4674 0.5586 -0.0438 0.0190 0.0083 259 PHE A CD1 1586 C CD2 . PHE A 200 ? 0.3163 0.3849 0.4758 -0.0456 0.0252 0.0139 259 PHE A CD2 1587 C CE1 . PHE A 200 ? 0.5014 0.5686 0.6567 -0.0431 0.0202 0.0087 259 PHE A CE1 1588 C CE2 . PHE A 200 ? 0.4730 0.5436 0.6314 -0.0448 0.0263 0.0144 259 PHE A CE2 1589 C CZ . PHE A 200 ? 0.3168 0.3868 0.4731 -0.0436 0.0238 0.0119 259 PHE A CZ 1590 N N . PHE A 201 ? 0.4389 0.4992 0.5879 -0.0471 0.0238 0.0126 260 PHE A N 1591 C CA . PHE A 201 ? 0.3893 0.4485 0.5384 -0.0481 0.0246 0.0136 260 PHE A CA 1592 C C . PHE A 201 ? 0.4206 0.4817 0.5700 -0.0487 0.0289 0.0167 260 PHE A C 1593 O O . PHE A 201 ? 0.4817 0.5448 0.6304 -0.0482 0.0312 0.0180 260 PHE A O 1594 C CB . PHE A 201 ? 0.3184 0.3742 0.4589 -0.0475 0.0233 0.0119 260 PHE A CB 1595 C CG . PHE A 201 ? 0.4611 0.5165 0.5930 -0.0467 0.0256 0.0123 260 PHE A CG 1596 C CD1 . PHE A 201 ? 0.3180 0.3731 0.4456 -0.0454 0.0249 0.0109 260 PHE A CD1 1597 C CD2 . PHE A 201 ? 0.4286 0.4839 0.5567 -0.0471 0.0286 0.0140 260 PHE A CD2 1598 C CE1 . PHE A 201 ? 0.3350 0.3896 0.4548 -0.0447 0.0270 0.0112 260 PHE A CE1 1599 C CE2 . PHE A 201 ? 0.3740 0.4289 0.4944 -0.0463 0.0306 0.0142 260 PHE A CE2 1600 C CZ . PHE A 201 ? 0.3339 0.3885 0.4504 -0.0452 0.0298 0.0129 260 PHE A CZ 1601 N N . PHE A 202 ? 0.3638 0.4243 0.5141 -0.0496 0.0299 0.0177 261 PHE A N 1602 C CA . PHE A 202 ? 0.3795 0.4414 0.5295 -0.0499 0.0340 0.0205 261 PHE A CA 1603 C C . PHE A 202 ? 0.3578 0.4176 0.4989 -0.0496 0.0353 0.0203 261 PHE A C 1604 O O . PHE A 202 ? 0.4535 0.5109 0.5916 -0.0498 0.0334 0.0189 261 PHE A O 1605 C CB . PHE A 202 ? 0.3369 0.3997 0.4949 -0.0511 0.0349 0.0220 261 PHE A CB 1606 C CG . PHE A 202 ? 0.3143 0.3797 0.4814 -0.0515 0.0349 0.0230 261 PHE A CG 1607 C CD1 . PHE A 202 ? 0.4787 0.5441 0.6514 -0.0518 0.0314 0.0211 261 PHE A CD1 1608 C CD2 . PHE A 202 ? 0.4877 0.5556 0.6580 -0.0514 0.0385 0.0257 261 PHE A CD2 1609 C CE1 . PHE A 202 ? 0.3584 0.4263 0.5397 -0.0522 0.0314 0.0219 261 PHE A CE1 1610 C CE2 . PHE A 202 ? 0.3129 0.3834 0.4919 -0.0517 0.0386 0.0267 261 PHE A CE2 1611 C CZ . PHE A 202 ? 0.3139 0.3844 0.4984 -0.0522 0.0351 0.0247 261 PHE A CZ 1612 N N . SER A 203 ? 0.3573 0.4182 0.4944 -0.0489 0.0385 0.0219 262 SER A N 1613 C CA . SER A 203 ? 0.3978 0.4571 0.5268 -0.0485 0.0401 0.0219 262 SER A CA 1614 C C . SER A 203 ? 0.3992 0.4581 0.5297 -0.0493 0.0417 0.0231 262 SER A C 1615 O O . SER A 203 ? 0.3651 0.4252 0.5029 -0.0500 0.0422 0.0244 262 SER A O 1616 C CB . SER A 203 ? 0.3788 0.4396 0.5039 -0.0475 0.0431 0.0233 262 SER A CB 1617 O OG . SER A 203 ? 0.4931 0.5557 0.6218 -0.0476 0.0464 0.0260 262 SER A OG 1618 N N . PRO A 204 ? 0.5584 0.6154 0.6818 -0.0491 0.0425 0.0227 263 PRO A N 1619 C CA . PRO A 204 ? 0.4964 0.5529 0.6204 -0.0496 0.0443 0.0238 263 PRO A CA 1620 C C . PRO A 204 ? 0.3957 0.4545 0.5240 -0.0494 0.0481 0.0266 263 PRO A C 1621 O O . PRO A 204 ? 0.5725 0.6313 0.7038 -0.0499 0.0495 0.0277 263 PRO A O 1622 C CB . PRO A 204 ? 0.3123 0.3669 0.4272 -0.0491 0.0449 0.0229 263 PRO A CB 1623 C CG . PRO A 204 ? 0.4869 0.5400 0.5975 -0.0487 0.0420 0.0207 263 PRO A CG 1624 C CD . PRO A 204 ? 0.4214 0.4765 0.5362 -0.0484 0.0415 0.0209 263 PRO A CD 1625 N N . ALA A 205 ? 0.3653 0.4259 0.4935 -0.0486 0.0497 0.0277 264 ALA A N 1626 C CA . ALA A 205 ? 0.3491 0.4119 0.4814 -0.0481 0.0532 0.0304 264 ALA A CA 1627 C C . ALA A 205 ? 0.4554 0.5202 0.5971 -0.0487 0.0526 0.0314 264 ALA A C 1628 O O . ALA A 205 ? 0.4727 0.5394 0.6184 -0.0482 0.0553 0.0337 264 ALA A O 1629 C CB . ALA A 205 ? 0.3649 0.4287 0.4923 -0.0467 0.0553 0.0313 264 ALA A CB 1630 N N . LYS A 206 ? 0.4120 0.4762 0.5569 -0.0496 0.0491 0.0295 265 LYS A N 1631 C CA . LYS A 206 ? 0.5322 0.5981 0.6862 -0.0502 0.0480 0.0300 265 LYS A CA 1632 C C . LYS A 206 ? 0.6478 0.7159 0.8032 -0.0495 0.0484 0.0307 265 LYS A C 1633 O O . LYS A 206 ? 0.6351 0.7051 0.7980 -0.0498 0.0488 0.0320 265 LYS A O 1634 C CB . LYS A 206 ? 0.4204 0.4873 0.5816 -0.0509 0.0503 0.0322 265 LYS A CB 1635 C CG . LYS A 206 ? 0.4646 0.5298 0.6285 -0.0521 0.0486 0.0312 265 LYS A CG 1636 C CD . LYS A 206 ? 0.6352 0.6990 0.7951 -0.0520 0.0509 0.0320 265 LYS A CD 1637 C CE . LYS A 206 ? 0.8574 0.9188 1.0162 -0.0531 0.0480 0.0301 265 LYS A CE 1638 N NZ . LYS A 206 ? 0.8605 0.9202 1.0134 -0.0529 0.0445 0.0274 265 LYS A NZ 1639 N N . ASN A 207 ? 0.4603 0.5279 0.6083 -0.0485 0.0483 0.0299 266 ASN A N 1640 C CA . ASN A 207 ? 0.3267 0.3960 0.4750 -0.0478 0.0483 0.0302 266 ASN A CA 1641 C C . ASN A 207 ? 0.3575 0.4262 0.5071 -0.0481 0.0443 0.0276 266 ASN A C 1642 O O . ASN A 207 ? 0.3115 0.3780 0.4580 -0.0484 0.0417 0.0253 266 ASN A O 1643 C CB . ASN A 207 ? 0.3088 0.3778 0.4486 -0.0465 0.0500 0.0305 266 ASN A CB 1644 C CG . ASN A 207 ? 0.3578 0.4276 0.4965 -0.0458 0.0539 0.0331 266 ASN A CG 1645 O OD1 . ASN A 207 ? 0.4398 0.5113 0.5847 -0.0458 0.0560 0.0354 266 ASN A OD1 1646 N ND2 . ASN A 207 ? 0.4218 0.4902 0.5527 -0.0451 0.0550 0.0327 266 ASN A ND2 1647 N N . PHE A 208 ? 0.3898 0.4606 0.5440 -0.0479 0.0438 0.0280 267 PHE A N 1648 C CA . PHE A 208 ? 0.3114 0.3819 0.4674 -0.0480 0.0401 0.0255 267 PHE A CA 1649 C C . PHE A 208 ? 0.3589 0.4281 0.5064 -0.0469 0.0391 0.0237 267 PHE A C 1650 O O . PHE A 208 ? 0.4177 0.4879 0.5612 -0.0460 0.0412 0.0250 267 PHE A O 1651 C CB . PHE A 208 ? 0.3791 0.4524 0.5435 -0.0482 0.0400 0.0265 267 PHE A CB 1652 C CG . PHE A 208 ? 0.4534 0.5262 0.6225 -0.0486 0.0362 0.0240 267 PHE A CG 1653 C CD1 . PHE A 208 ? 0.3136 0.3840 0.4823 -0.0491 0.0334 0.0218 267 PHE A CD1 1654 C CD2 . PHE A 208 ? 0.4525 0.5275 0.6265 -0.0483 0.0353 0.0239 267 PHE A CD2 1655 C CE1 . PHE A 208 ? 0.4277 0.4977 0.6008 -0.0492 0.0297 0.0194 267 PHE A CE1 1656 C CE2 . PHE A 208 ? 0.3878 0.4625 0.5662 -0.0485 0.0316 0.0214 267 PHE A CE2 1657 C CZ . PHE A 208 ? 0.4176 0.4897 0.5956 -0.0489 0.0288 0.0191 267 PHE A CZ 1658 N N . CYS A 209 ? 0.3129 0.3798 0.4576 -0.0468 0.0358 0.0208 268 CYS A N 1659 C CA . CYS A 209 ? 0.5068 0.5720 0.6430 -0.0457 0.0349 0.0190 268 CYS A CA 1660 C C . CYS A 209 ? 0.4302 0.4942 0.5669 -0.0452 0.0311 0.0160 268 CYS A C 1661 O O . CYS A 209 ? 0.4297 0.4933 0.5721 -0.0458 0.0286 0.0149 268 CYS A O 1662 C CB . CYS A 209 ? 0.3135 0.3761 0.4425 -0.0457 0.0354 0.0184 268 CYS A CB 1663 S SG . CYS A 209 ? 0.3544 0.4180 0.4815 -0.0459 0.0398 0.0214 268 CYS A SG 1664 N N . PHE A 210 ? 0.4545 0.5179 0.5855 -0.0440 0.0305 0.0147 269 PHE A N 1665 C CA . PHE A 210 ? 0.4028 0.4644 0.5326 -0.0431 0.0270 0.0116 269 PHE A CA 1666 C C . PHE A 210 ? 0.3571 0.4160 0.4770 -0.0419 0.0267 0.0099 269 PHE A C 1667 O O . PHE A 210 ? 0.3936 0.4530 0.5081 -0.0416 0.0293 0.0110 269 PHE A O 1668 C CB . PHE A 210 ? 0.4261 0.4900 0.5606 -0.0427 0.0261 0.0113 269 PHE A CB 1669 C CG . PHE A 210 ? 0.3354 0.4010 0.4660 -0.0419 0.0286 0.0126 269 PHE A CG 1670 C CD1 . PHE A 210 ? 0.3144 0.3831 0.4491 -0.0425 0.0314 0.0156 269 PHE A CD1 1671 C CD2 . PHE A 210 ? 0.3167 0.3807 0.4394 -0.0406 0.0280 0.0108 269 PHE A CD2 1672 C CE1 . PHE A 210 ? 0.3650 0.4352 0.4960 -0.0417 0.0334 0.0169 269 PHE A CE1 1673 C CE2 . PHE A 210 ? 0.3749 0.4405 0.4939 -0.0399 0.0302 0.0120 269 PHE A CE2 1674 C CZ . PHE A 210 ? 0.3340 0.4026 0.4571 -0.0405 0.0328 0.0151 269 PHE A CZ 1675 N N . VAL A 211 ? 0.5104 0.5665 0.6280 -0.0412 0.0236 0.0071 270 VAL A N 1676 C CA . VAL A 211 ? 0.3201 0.3733 0.4286 -0.0400 0.0232 0.0053 270 VAL A CA 1677 C C . VAL A 211 ? 0.3953 0.4483 0.5015 -0.0384 0.0219 0.0034 270 VAL A C 1678 O O . VAL A 211 ? 0.5709 0.6230 0.6698 -0.0375 0.0231 0.0030 270 VAL A O 1679 C CB . VAL A 211 ? 0.6091 0.6589 0.7158 -0.0398 0.0206 0.0034 270 VAL A CB 1680 C CG1 . VAL A 211 ? 0.3227 0.3694 0.4203 -0.0382 0.0200 0.0014 270 VAL A CG1 1681 C CG2 . VAL A 211 ? 0.3206 0.3704 0.4282 -0.0412 0.0220 0.0052 270 VAL A CG2 1682 N N . SER A 212 ? 0.3881 0.4419 0.5004 -0.0382 0.0195 0.0022 271 SER A N 1683 C CA . SER A 212 ? 0.4428 0.4961 0.5532 -0.0366 0.0179 0.0000 271 SER A CA 1684 C C . SER A 212 ? 0.4777 0.5270 0.5805 -0.0349 0.0160 -0.0028 271 SER A C 1685 O O . SER A 212 ? 0.5981 0.6450 0.6985 -0.0350 0.0154 -0.0032 271 SER A O 1686 C CB . SER A 212 ? 0.3679 0.4236 0.4760 -0.0363 0.0205 0.0015 271 SER A CB 1687 O OG . SER A 212 ? 0.4632 0.5188 0.5700 -0.0348 0.0189 -0.0007 271 SER A OG 1688 N N . ARG A 213 ? 0.4313 0.4799 0.5303 -0.0332 0.0153 -0.0047 272 ARG A N 1689 C CA . ARG A 213 ? 0.4839 0.5285 0.5751 -0.0313 0.0139 -0.0073 272 ARG A CA 1690 C C . ARG A 213 ? 0.4258 0.4704 0.5100 -0.0301 0.0158 -0.0076 272 ARG A C 1691 O O . ARG A 213 ? 0.7700 0.8165 0.8559 -0.0296 0.0158 -0.0079 272 ARG A O 1692 C CB . ARG A 213 ? 0.4250 0.4675 0.5187 -0.0298 0.0099 -0.0104 272 ARG A CB 1693 C CG . ARG A 213 ? 0.7383 0.7800 0.8378 -0.0306 0.0077 -0.0105 272 ARG A CG 1694 C CD . ARG A 213 ? 1.0508 1.0908 1.1534 -0.0289 0.0036 -0.0135 272 ARG A CD 1695 N NE . ARG A 213 ? 1.1435 1.1818 1.2498 -0.0292 0.0011 -0.0140 272 ARG A NE 1696 C CZ . ARG A 213 ? 1.1262 1.1616 1.2331 -0.0273 -0.0026 -0.0168 272 ARG A CZ 1697 N NH1 . ARG A 213 ? 1.1972 1.2312 1.3013 -0.0249 -0.0041 -0.0194 272 ARG A NH1 1698 N NH2 . ARG A 213 ? 1.0802 1.1142 1.1903 -0.0277 -0.0048 -0.0170 272 ARG A NH2 1699 N N . CYS A 214 ? 0.4575 0.4998 0.5338 -0.0297 0.0173 -0.0077 273 CYS A N 1700 C CA . CYS A 214 ? 0.4645 0.5063 0.5334 -0.0285 0.0191 -0.0081 273 CYS A CA 1701 C C . CYS A 214 ? 0.5396 0.5779 0.6005 -0.0278 0.0198 -0.0089 273 CYS A C 1702 O O . CYS A 214 ? 0.5973 0.6339 0.6583 -0.0284 0.0191 -0.0088 273 CYS A O 1703 C CB . CYS A 214 ? 0.4154 0.4609 0.4852 -0.0298 0.0222 -0.0052 273 CYS A CB 1704 S SG . CYS A 214 ? 0.4689 0.5151 0.5370 -0.0316 0.0254 -0.0023 273 CYS A SG 1705 N N . ASP A 215 ? 0.6343 0.6715 0.6879 -0.0267 0.0213 -0.0096 274 ASP A N 1706 C CA . ASP A 215 ? 0.6871 0.7209 0.7329 -0.0258 0.0221 -0.0105 274 ASP A CA 1707 C C . ASP A 215 ? 0.5129 0.5477 0.5568 -0.0275 0.0250 -0.0081 274 ASP A C 1708 O O . ASP A 215 ? 0.5197 0.5520 0.5598 -0.0275 0.0252 -0.0084 274 ASP A O 1709 C CB . ASP A 215 ? 0.8564 0.8884 0.8951 -0.0239 0.0227 -0.0123 274 ASP A CB 1710 C CG . ASP A 215 ? 0.9706 1.0008 1.0099 -0.0218 0.0199 -0.0152 274 ASP A CG 1711 O OD1 . ASP A 215 ? 0.7238 0.7526 0.7669 -0.0214 0.0171 -0.0163 274 ASP A OD1 1712 O OD2 . ASP A 215 ? 1.0779 1.1080 1.1137 -0.0203 0.0202 -0.0164 274 ASP A OD2 1713 N N . TYR A 216 ? 0.5938 0.6322 0.6402 -0.0288 0.0272 -0.0056 275 TYR A N 1714 C CA . TYR A 216 ? 0.4452 0.4846 0.4890 -0.0299 0.0301 -0.0034 275 TYR A CA 1715 C C . TYR A 216 ? 0.4179 0.4596 0.4680 -0.0318 0.0306 -0.0011 275 TYR A C 1716 O O . TYR A 216 ? 0.5717 0.6167 0.6262 -0.0327 0.0319 0.0010 275 TYR A O 1717 C CB . TYR A 216 ? 0.6141 0.6555 0.6550 -0.0298 0.0325 -0.0022 275 TYR A CB 1718 C CG . TYR A 216 ? 0.9096 0.9512 0.9460 -0.0304 0.0354 -0.0006 275 TYR A CG 1719 C CD1 . TYR A 216 ? 0.9863 1.0249 1.0151 -0.0295 0.0361 -0.0020 275 TYR A CD1 1720 C CD2 . TYR A 216 ? 1.0581 1.1027 1.0978 -0.0318 0.0374 0.0022 275 TYR A CD2 1721 C CE1 . TYR A 216 ? 1.0152 1.0540 1.0402 -0.0301 0.0387 -0.0007 275 TYR A CE1 1722 C CE2 . TYR A 216 ? 0.8532 0.8979 0.8889 -0.0322 0.0399 0.0035 275 TYR A CE2 1723 C CZ . TYR A 216 ? 0.9473 0.9892 0.9757 -0.0314 0.0405 0.0020 275 TYR A CZ 1724 O OH . TYR A 216 ? 1.0185 1.0605 1.0431 -0.0318 0.0429 0.0031 275 TYR A OH 1725 N N . TYR A 217 ? 0.4860 0.5257 0.5363 -0.0323 0.0297 -0.0016 276 TYR A N 1726 C CA . TYR A 217 ? 0.3770 0.4183 0.4316 -0.0339 0.0305 0.0004 276 TYR A CA 1727 C C . TYR A 217 ? 0.5325 0.5765 0.5960 -0.0349 0.0296 0.0016 276 TYR A C 1728 O O . TYR A 217 ? 0.4180 0.4645 0.4853 -0.0362 0.0313 0.0040 276 TYR A O 1729 C CB . TYR A 217 ? 0.4532 0.4960 0.5049 -0.0346 0.0339 0.0026 276 TYR A CB 1730 C CG . TYR A 217 ? 0.5944 0.6346 0.6382 -0.0340 0.0349 0.0016 276 TYR A CG 1731 C CD1 . TYR A 217 ? 0.4036 0.4413 0.4455 -0.0343 0.0341 0.0008 276 TYR A CD1 1732 C CD2 . TYR A 217 ? 0.3318 0.3719 0.3699 -0.0332 0.0367 0.0015 276 TYR A CD2 1733 C CE1 . TYR A 217 ? 0.6218 0.6571 0.6567 -0.0337 0.0351 -0.0001 276 TYR A CE1 1734 C CE2 . TYR A 217 ? 0.5900 0.6276 0.6212 -0.0327 0.0377 0.0005 276 TYR A CE2 1735 C CZ . TYR A 217 ? 0.5373 0.5725 0.5670 -0.0330 0.0369 -0.0003 276 TYR A CZ 1736 O OH . TYR A 217 ? 0.5588 0.5915 0.5818 -0.0324 0.0380 -0.0012 276 TYR A OH 1737 N N . CYS A 218 ? 0.3230 0.3665 0.3898 -0.0341 0.0268 -0.0001 277 CYS A N 1738 C CA . CYS A 218 ? 0.3226 0.3680 0.3981 -0.0351 0.0253 0.0005 277 CYS A CA 1739 C C . CYS A 218 ? 0.5750 0.6185 0.6520 -0.0357 0.0237 0.0001 277 CYS A C 1740 O O . CYS A 218 ? 0.5658 0.6071 0.6440 -0.0349 0.0207 -0.0020 277 CYS A O 1741 C CB . CYS A 218 ? 0.3599 0.4055 0.4386 -0.0340 0.0229 -0.0013 277 CYS A CB 1742 S SG . CYS A 218 ? 0.4904 0.5393 0.5700 -0.0337 0.0246 -0.0002 277 CYS A SG 1743 N N . ASP A 219 ? 0.3219 0.3658 0.3984 -0.0369 0.0258 0.0019 278 ASP A N 1744 C CA . ASP A 219 ? 0.3222 0.3645 0.3998 -0.0376 0.0246 0.0018 278 ASP A CA 1745 C C . ASP A 219 ? 0.3204 0.3653 0.4032 -0.0393 0.0264 0.0044 278 ASP A C 1746 O O . ASP A 219 ? 0.6088 0.6565 0.6939 -0.0398 0.0288 0.0063 278 ASP A O 1747 C CB . ASP A 219 ? 0.3229 0.3621 0.3924 -0.0370 0.0249 0.0008 278 ASP A CB 1748 C CG . ASP A 219 ? 0.5540 0.5942 0.6184 -0.0371 0.0283 0.0022 278 ASP A CG 1749 O OD1 . ASP A 219 ? 0.4955 0.5335 0.5529 -0.0361 0.0287 0.0009 278 ASP A OD1 1750 O OD2 . ASP A 219 ? 0.4521 0.4950 0.5193 -0.0382 0.0307 0.0044 278 ASP A OD2 1751 N N . THR A 220 ? 0.3436 0.3872 0.4279 -0.0401 0.0254 0.0044 279 THR A N 1752 C CA . THR A 220 ? 0.3969 0.4425 0.4860 -0.0416 0.0270 0.0067 279 THR A CA 1753 C C . THR A 220 ? 0.5543 0.6013 0.6399 -0.0419 0.0308 0.0086 279 THR A C 1754 O O . THR A 220 ? 0.5723 0.6220 0.6622 -0.0427 0.0329 0.0108 279 THR A O 1755 C CB . THR A 220 ? 0.4641 0.5076 0.5536 -0.0421 0.0253 0.0061 279 THR A CB 1756 O OG1 . THR A 220 ? 0.5505 0.5925 0.6431 -0.0416 0.0217 0.0042 279 THR A OG1 1757 C CG2 . THR A 220 ? 0.3188 0.3643 0.4135 -0.0436 0.0271 0.0084 279 THR A CG2 1758 N N . THR A 221 ? 0.3629 0.4079 0.4408 -0.0413 0.0316 0.0079 280 THR A N 1759 C CA . THR A 221 ? 0.4821 0.5281 0.5561 -0.0415 0.0349 0.0094 280 THR A CA 1760 C C . THR A 221 ? 0.4624 0.5111 0.5373 -0.0412 0.0370 0.0108 280 THR A C 1761 O O . THR A 221 ? 0.5264 0.5771 0.6022 -0.0415 0.0397 0.0129 280 THR A O 1762 C CB . THR A 221 ? 0.5960 0.6393 0.6615 -0.0408 0.0351 0.0080 280 THR A CB 1763 O OG1 . THR A 221 ? 0.3432 0.3840 0.4077 -0.0410 0.0332 0.0069 280 THR A OG1 1764 C CG2 . THR A 221 ? 0.3156 0.3600 0.3774 -0.0410 0.0384 0.0095 280 THR A CG2 1765 N N . HIS A 222 ? 0.4506 0.4992 0.5252 -0.0403 0.0357 0.0096 281 HIS A N 1766 C CA . HIS A 222 ? 0.3738 0.4248 0.4486 -0.0399 0.0375 0.0109 281 HIS A CA 1767 C C . HIS A 222 ? 0.3685 0.4218 0.4508 -0.0401 0.0365 0.0115 281 HIS A C 1768 O O . HIS A 222 ? 0.4205 0.4751 0.5029 -0.0395 0.0367 0.0116 281 HIS A O 1769 C CB . HIS A 222 ? 0.3162 0.3656 0.3841 -0.0386 0.0372 0.0091 281 HIS A CB 1770 C CG . HIS A 222 ? 0.5362 0.5834 0.5968 -0.0383 0.0382 0.0085 281 HIS A CG 1771 N ND1 . HIS A 222 ? 0.5162 0.5603 0.5736 -0.0381 0.0364 0.0065 281 HIS A ND1 1772 C CD2 . HIS A 222 ? 0.3326 0.3802 0.3885 -0.0382 0.0409 0.0095 281 HIS A CD2 1773 C CE1 . HIS A 222 ? 0.5004 0.5431 0.5515 -0.0379 0.0380 0.0064 281 HIS A CE1 1774 N NE2 . HIS A 222 ? 0.6779 0.7227 0.7281 -0.0380 0.0407 0.0081 281 HIS A NE2 1775 N N . ALA A 223 ? 0.4040 0.4578 0.4928 -0.0411 0.0354 0.0119 282 ALA A N 1776 C CA . ALA A 223 ? 0.3755 0.4315 0.4723 -0.0414 0.0345 0.0126 282 ALA A CA 1777 C C . ALA A 223 ? 0.3736 0.4329 0.4732 -0.0416 0.0375 0.0154 282 ALA A C 1778 O O . ALA A 223 ? 0.4356 0.4954 0.5329 -0.0417 0.0401 0.0171 282 ALA A O 1779 C CB . ALA A 223 ? 0.3155 0.3712 0.4184 -0.0425 0.0330 0.0126 282 ALA A CB 1780 N N . ILE A 224 ? 0.3880 0.4493 0.4925 -0.0415 0.0369 0.0157 283 ILE A N 1781 C CA . ILE A 224 ? 0.3121 0.3765 0.4201 -0.0415 0.0394 0.0185 283 ILE A CA 1782 C C . ILE A 224 ? 0.3558 0.4218 0.4720 -0.0426 0.0401 0.0203 283 ILE A C 1783 O O . ILE A 224 ? 0.4019 0.4678 0.5240 -0.0433 0.0379 0.0193 283 ILE A O 1784 C CB . ILE A 224 ? 0.3686 0.4347 0.4780 -0.0408 0.0387 0.0182 283 ILE A CB 1785 C CG1 . ILE A 224 ? 0.3127 0.3775 0.4135 -0.0396 0.0388 0.0169 283 ILE A CG1 1786 C CG2 . ILE A 224 ? 0.3109 0.3803 0.4253 -0.0409 0.0411 0.0212 283 ILE A CG2 1787 C CD1 . ILE A 224 ? 0.6085 0.6703 0.7051 -0.0390 0.0360 0.0136 283 ILE A CD1 1788 N N . CYS A 225 ? 0.4638 0.5311 0.5805 -0.0428 0.0432 0.0230 284 CYS A N 1789 C CA . CYS A 225 ? 0.3299 0.3982 0.4535 -0.0437 0.0443 0.0247 284 CYS A CA 1790 C C . CYS A 225 ? 0.3700 0.4412 0.4976 -0.0434 0.0472 0.0279 284 CYS A C 1791 O O . CYS A 225 ? 0.3084 0.3803 0.4315 -0.0424 0.0493 0.0292 284 CYS A O 1792 C CB . CYS A 225 ? 0.3097 0.3761 0.4298 -0.0441 0.0452 0.0247 284 CYS A CB 1793 S SG . CYS A 225 ? 0.4241 0.4870 0.5399 -0.0445 0.0419 0.0214 284 CYS A SG 1794 N N . GLY A 226 ? 0.3084 0.3813 0.4447 -0.0442 0.0473 0.0292 285 GLY A N 1795 C CA . GLY A 226 ? 0.3074 0.3828 0.4482 -0.0438 0.0502 0.0323 285 GLY A CA 1796 C C . GLY A 226 ? 0.5320 0.6071 0.6730 -0.0438 0.0531 0.0344 285 GLY A C 1797 O O . GLY A 226 ? 0.4097 0.4828 0.5467 -0.0441 0.0529 0.0333 285 GLY A O 1798 N N . LEU A 227 ? 0.3060 0.3832 0.4516 -0.0434 0.0558 0.0373 286 LEU A N 1799 C CA . LEU A 227 ? 0.3588 0.4358 0.5051 -0.0431 0.0588 0.0394 286 LEU A CA 1800 C C . LEU A 227 ? 0.3544 0.4332 0.5100 -0.0434 0.0605 0.0418 286 LEU A C 1801 O O . LEU A 227 ? 0.3908 0.4710 0.5477 -0.0423 0.0634 0.0446 286 LEU A O 1802 C CB . LEU A 227 ? 0.3844 0.4615 0.5241 -0.0415 0.0615 0.0409 286 LEU A CB 1803 C CG . LEU A 227 ? 0.6047 0.6804 0.7413 -0.0410 0.0639 0.0417 286 LEU A CG 1804 C CD1 . LEU A 227 ? 0.4328 0.5061 0.5660 -0.0422 0.0618 0.0389 286 LEU A CD1 1805 C CD2 . LEU A 227 ? 0.5219 0.5976 0.6517 -0.0393 0.0662 0.0428 286 LEU A CD2 1806 N N . PRO A 228 ? 0.3672 0.4459 0.5293 -0.0449 0.0586 0.0408 287 PRO A N 1807 C CA . PRO A 228 ? 0.3861 0.4629 0.5470 -0.0460 0.0550 0.0376 287 PRO A CA 1808 C C . PRO A 228 ? 0.4288 0.5064 0.5923 -0.0464 0.0517 0.0357 287 PRO A C 1809 O O . PRO A 228 ? 0.4067 0.4825 0.5664 -0.0467 0.0488 0.0329 287 PRO A O 1810 C CB . PRO A 228 ? 0.3555 0.4318 0.5226 -0.0472 0.0551 0.0379 287 PRO A CB 1811 C CG . PRO A 228 ? 0.3073 0.3860 0.4823 -0.0470 0.0575 0.0408 287 PRO A CG 1812 C CD . PRO A 228 ? 0.3811 0.4610 0.5521 -0.0453 0.0603 0.0429 287 PRO A CD 1813 N N . ASP A 229 ? 0.3463 0.4263 0.5159 -0.0462 0.0523 0.0373 288 ASP A N 1814 C CA . ASP A 229 ? 0.4886 0.5696 0.6624 -0.0467 0.0492 0.0355 288 ASP A CA 1815 C C . ASP A 229 ? 0.4086 0.4916 0.5815 -0.0457 0.0496 0.0362 288 ASP A C 1816 O O . ASP A 229 ? 0.5221 0.6062 0.6993 -0.0459 0.0475 0.0351 288 ASP A O 1817 C CB . ASP A 229 ? 0.3515 0.4335 0.5358 -0.0479 0.0487 0.0360 288 ASP A CB 1818 C CG . ASP A 229 ? 0.4357 0.5200 0.6259 -0.0476 0.0523 0.0396 288 ASP A CG 1819 O OD1 . ASP A 229 ? 0.4603 0.5447 0.6461 -0.0466 0.0554 0.0417 288 ASP A OD1 1820 O OD2 . ASP A 229 ? 0.4873 0.5731 0.6866 -0.0484 0.0520 0.0402 288 ASP A OD2 1821 N N . MSE A 230 ? 0.3065 0.3899 0.4738 -0.0444 0.0522 0.0381 289 MSE A N 1822 C CA . MSE A 230 ? 0.3945 0.4795 0.5595 -0.0434 0.0525 0.0388 289 MSE A CA 1823 C C . MSE A 230 ? 0.5261 0.6094 0.6808 -0.0425 0.0517 0.0370 289 MSE A C 1824 O O . MSE A 230 ? 0.4119 0.4933 0.5610 -0.0424 0.0524 0.0366 289 MSE A O 1825 C CB . MSE A 230 ? 0.3050 0.3921 0.4724 -0.0424 0.0561 0.0426 289 MSE A CB 1826 C CG . MSE A 230 ? 0.5964 0.6827 0.7563 -0.0411 0.0588 0.0442 289 MSE A CG 1827 SE SE . MSE A 230 ? 0.9490 1.0328 1.1073 -0.0417 0.0602 0.0440 289 MSE A SE 1828 C CE . MSE A 230 ? 1.0197 1.1052 1.1905 -0.0425 0.0619 0.0465 289 MSE A CE 1829 N N . LYS A 231 ? 0.4659 0.5500 0.6183 -0.0419 0.0503 0.0360 290 LYS A N 1830 C CA . LYS A 231 ? 0.3066 0.3890 0.4494 -0.0411 0.0495 0.0342 290 LYS A CA 1831 C C . LYS A 231 ? 0.3980 0.4821 0.5383 -0.0400 0.0497 0.0347 290 LYS A C 1832 O O . LYS A 231 ? 0.3068 0.3920 0.4504 -0.0401 0.0478 0.0336 290 LYS A O 1833 C CB . LYS A 231 ? 0.3406 0.4207 0.4815 -0.0417 0.0461 0.0304 290 LYS A CB 1834 C CG . LYS A 231 ? 0.3160 0.3943 0.4474 -0.0408 0.0451 0.0283 290 LYS A CG 1835 C CD . LYS A 231 ? 0.4885 0.5657 0.6126 -0.0402 0.0476 0.0294 290 LYS A CD 1836 C CE . LYS A 231 ? 0.3076 0.3832 0.4322 -0.0410 0.0481 0.0295 290 LYS A CE 1837 N NZ . LYS A 231 ? 0.3923 0.4665 0.5091 -0.0403 0.0500 0.0299 290 LYS A NZ 1838 N N . GLU A 232 ? 0.4704 0.5546 0.6046 -0.0388 0.0520 0.0365 291 GLU A N 1839 C CA . GLU A 232 ? 0.3218 0.4073 0.4522 -0.0377 0.0523 0.0371 291 GLU A CA 1840 C C . GLU A 232 ? 0.3063 0.3900 0.4302 -0.0375 0.0497 0.0336 291 GLU A C 1841 O O . GLU A 232 ? 0.6132 0.6944 0.7334 -0.0379 0.0486 0.0313 291 GLU A O 1842 C CB . GLU A 232 ? 0.3342 0.4201 0.4596 -0.0364 0.0554 0.0398 291 GLU A CB 1843 C CG . GLU A 232 ? 0.3038 0.3909 0.4246 -0.0351 0.0558 0.0406 291 GLU A CG 1844 C CD . GLU A 232 ? 0.4006 0.4880 0.5167 -0.0337 0.0587 0.0434 291 GLU A CD 1845 O OE1 . GLU A 232 ? 0.4998 0.5882 0.6200 -0.0334 0.0609 0.0462 291 GLU A OE1 1846 O OE2 . GLU A 232 ? 0.4335 0.5200 0.5417 -0.0328 0.0587 0.0427 291 GLU A OE2 1847 N N . GLY A 233 ? 0.4343 0.5192 0.5570 -0.0367 0.0489 0.0332 292 GLY A N 1848 C CA . GLY A 233 ? 0.5207 0.6039 0.6366 -0.0362 0.0469 0.0301 292 GLY A CA 1849 C C . GLY A 233 ? 0.3585 0.4432 0.4714 -0.0351 0.0470 0.0307 292 GLY A C 1850 O O . GLY A 233 ? 0.3775 0.4649 0.4945 -0.0348 0.0484 0.0334 292 GLY A O 1851 N N . SER A 234 ? 0.3671 0.4502 0.4727 -0.0343 0.0457 0.0282 293 SER A N 1852 C CA . SER A 234 ? 0.3087 0.3930 0.4108 -0.0332 0.0456 0.0282 293 SER A CA 1853 C C . SER A 234 ? 0.3431 0.4279 0.4493 -0.0333 0.0428 0.0258 293 SER A C 1854 O O . SER A 234 ? 0.4135 0.4963 0.5206 -0.0337 0.0405 0.0228 293 SER A O 1855 C CB . SER A 234 ? 0.3093 0.3914 0.4009 -0.0322 0.0458 0.0268 293 SER A CB 1856 O OG . SER A 234 ? 0.4053 0.4846 0.4938 -0.0323 0.0435 0.0230 293 SER A OG 1857 N N . VAL A 235 ? 0.3095 0.3969 0.4184 -0.0328 0.0430 0.0271 294 VAL A N 1858 C CA . VAL A 235 ? 0.3106 0.3988 0.4234 -0.0327 0.0405 0.0249 294 VAL A CA 1859 C C . VAL A 235 ? 0.3414 0.4301 0.4478 -0.0313 0.0402 0.0241 294 VAL A C 1860 O O . VAL A 235 ? 0.3101 0.4010 0.4158 -0.0308 0.0420 0.0269 294 VAL A O 1861 C CB . VAL A 235 ? 0.4712 0.5625 0.5949 -0.0336 0.0407 0.0269 294 VAL A CB 1862 C CG1 . VAL A 235 ? 0.4144 0.5066 0.5419 -0.0333 0.0380 0.0244 294 VAL A CG1 1863 C CG2 . VAL A 235 ? 0.3094 0.4001 0.4395 -0.0349 0.0409 0.0275 294 VAL A CG2 1864 N N . GLN A 236 ? 0.3693 0.4557 0.4708 -0.0306 0.0381 0.0204 295 GLN A N 1865 C CA . GLN A 236 ? 0.4686 0.5547 0.5625 -0.0292 0.0379 0.0192 295 GLN A CA 1866 C C . GLN A 236 ? 0.5305 0.6170 0.6272 -0.0286 0.0352 0.0163 295 GLN A C 1867 O O . GLN A 236 ? 0.3755 0.4602 0.4744 -0.0288 0.0328 0.0133 295 GLN A O 1868 C CB . GLN A 236 ? 0.3145 0.3972 0.3984 -0.0285 0.0381 0.0173 295 GLN A CB 1869 C CG . GLN A 236 ? 0.5466 0.6285 0.6222 -0.0269 0.0378 0.0157 295 GLN A CG 1870 C CD . GLN A 236 ? 0.4881 0.5667 0.5541 -0.0263 0.0384 0.0142 295 GLN A CD 1871 O OE1 . GLN A 236 ? 0.4321 0.5078 0.4947 -0.0256 0.0366 0.0107 295 GLN A OE1 1872 N NE2 . GLN A 236 ? 0.5918 0.6706 0.6536 -0.0263 0.0408 0.0168 295 GLN A NE2 1873 N N . VAL A 237 ? 0.4751 0.5640 0.5715 -0.0279 0.0354 0.0172 296 VAL A N 1874 C CA . VAL A 237 ? 0.4371 0.5268 0.5361 -0.0272 0.0330 0.0145 296 VAL A CA 1875 C C . VAL A 237 ? 0.3515 0.4377 0.4435 -0.0259 0.0309 0.0101 296 VAL A C 1876 O O . VAL A 237 ? 0.5299 0.6140 0.6126 -0.0251 0.0318 0.0095 296 VAL A O 1877 C CB . VAL A 237 ? 0.5891 0.6818 0.6873 -0.0264 0.0338 0.0164 296 VAL A CB 1878 C CG1 . VAL A 237 ? 0.4569 0.5485 0.5439 -0.0252 0.0354 0.0169 296 VAL A CG1 1879 C CG2 . VAL A 237 ? 0.4677 0.5614 0.5694 -0.0257 0.0313 0.0136 296 VAL A CG2 1880 N N . PHE A 238 ? 0.3861 0.4716 0.4829 -0.0258 0.0281 0.0069 297 PHE A N 1881 C CA . PHE A 238 ? 0.4419 0.5241 0.5329 -0.0243 0.0259 0.0025 297 PHE A CA 1882 C C . PHE A 238 ? 0.4503 0.5325 0.5333 -0.0225 0.0261 0.0013 297 PHE A C 1883 O O . PHE A 238 ? 0.5492 0.6344 0.6341 -0.0224 0.0266 0.0028 297 PHE A O 1884 C CB . PHE A 238 ? 0.4030 0.4850 0.5017 -0.0243 0.0228 -0.0004 297 PHE A CB 1885 C CG . PHE A 238 ? 0.4744 0.5529 0.5730 -0.0243 0.0212 -0.0028 297 PHE A CG 1886 C CD1 . PHE A 238 ? 0.5352 0.6132 0.6362 -0.0259 0.0224 -0.0006 297 PHE A CD1 1887 C CD2 . PHE A 238 ? 0.3719 0.4475 0.4679 -0.0227 0.0185 -0.0071 297 PHE A CD2 1888 C CE1 . PHE A 238 ? 0.4772 0.5520 0.5778 -0.0259 0.0210 -0.0027 297 PHE A CE1 1889 C CE2 . PHE A 238 ? 0.6062 0.6785 0.7019 -0.0225 0.0170 -0.0092 297 PHE A CE2 1890 C CZ . PHE A 238 ? 0.5088 0.5807 0.6068 -0.0243 0.0182 -0.0069 297 PHE A CZ 1891 N N . LEU A 239 ? 0.5377 0.6163 0.6117 -0.0211 0.0257 -0.0014 298 LEU A N 1892 C CA . LEU A 239 ? 0.5647 0.6426 0.6308 -0.0192 0.0255 -0.0034 298 LEU A CA 1893 C C . LEU A 239 ? 0.5709 0.6495 0.6417 -0.0182 0.0226 -0.0065 298 LEU A C 1894 O O . LEU A 239 ? 0.7055 0.7835 0.7832 -0.0185 0.0205 -0.0083 298 LEU A O 1895 C CB . LEU A 239 ? 0.5983 0.6720 0.6540 -0.0178 0.0258 -0.0058 298 LEU A CB 1896 C CG . LEU A 239 ? 0.6431 0.7160 0.6916 -0.0182 0.0287 -0.0033 298 LEU A CG 1897 C CD1 . LEU A 239 ? 0.5012 0.5775 0.5488 -0.0186 0.0308 0.0003 298 LEU A CD1 1898 C CD2 . LEU A 239 ? 0.7268 0.7989 0.7788 -0.0199 0.0295 -0.0016 298 LEU A CD2 1899 N N . PRO A 240 ? 0.6341 0.7140 0.7014 -0.0168 0.0225 -0.0073 299 PRO A N 1900 C CA . PRO A 240 ? 0.5116 0.5921 0.5829 -0.0156 0.0197 -0.0107 299 PRO A CA 1901 C C . PRO A 240 ? 0.5380 0.6141 0.6061 -0.0140 0.0174 -0.0153 299 PRO A C 1902 O O . PRO A 240 ? 0.6474 0.7201 0.7077 -0.0133 0.0183 -0.0161 299 PRO A O 1903 C CB . PRO A 240 ? 0.4831 0.5650 0.5480 -0.0142 0.0205 -0.0107 299 PRO A CB 1904 C CG . PRO A 240 ? 0.6877 0.7682 0.7429 -0.0141 0.0232 -0.0087 299 PRO A CG 1905 C CD . PRO A 240 ? 0.6451 0.7261 0.7046 -0.0162 0.0248 -0.0053 299 PRO A CD 1906 N N . ASP A 241 ? 0.5791 0.6553 0.6535 -0.0133 0.0145 -0.0183 300 ASP A N 1907 C CA . ASP A 241 ? 0.5709 0.6430 0.6436 -0.0116 0.0120 -0.0226 300 ASP A CA 1908 C C . ASP A 241 ? 0.7782 0.8467 0.8386 -0.0091 0.0124 -0.0253 300 ASP A C 1909 O O . ASP A 241 ? 0.7657 0.8352 0.8208 -0.0080 0.0132 -0.0255 300 ASP A O 1910 C CB . ASP A 241 ? 0.8245 0.8976 0.9054 -0.0108 0.0087 -0.0255 300 ASP A CB 1911 C CG . ASP A 241 ? 1.0837 1.1528 1.1651 -0.0094 0.0059 -0.0294 300 ASP A CG 1912 O OD1 . ASP A 241 ? 1.1843 1.2496 1.2588 -0.0088 0.0066 -0.0300 300 ASP A OD1 1913 O OD2 . ASP A 241 ? 1.2211 1.2908 1.3100 -0.0089 0.0031 -0.0317 300 ASP A OD2 1914 N N . GLU A 242 ? 0.7893 0.8534 0.8452 -0.0081 0.0119 -0.0274 301 GLU A N 1915 C CA . GLU A 242 ? 0.8040 0.8642 0.8482 -0.0057 0.0126 -0.0298 301 GLU A CA 1916 C C . GLU A 242 ? 0.9176 0.9767 0.9590 -0.0028 0.0105 -0.0341 301 GLU A C 1917 O O . GLU A 242 ? 1.0499 1.1075 1.0820 -0.0010 0.0116 -0.0355 301 GLU A O 1918 C CB . GLU A 242 ? 0.9532 1.0090 0.9943 -0.0053 0.0123 -0.0311 301 GLU A CB 1919 C CG . GLU A 242 ? 0.9730 1.0289 1.0116 -0.0074 0.0152 -0.0274 301 GLU A CG 1920 C CD . GLU A 242 ? 1.1139 1.1648 1.1445 -0.0061 0.0158 -0.0290 301 GLU A CD 1921 O OE1 . GLU A 242 ? 1.1443 1.1923 1.1768 -0.0052 0.0136 -0.0315 301 GLU A OE1 1922 O OE2 . GLU A 242 ? 1.2049 1.2549 1.2275 -0.0061 0.0183 -0.0278 301 GLU A OE2 1923 N N . SER A 243 ? 1.0488 1.1086 1.0984 -0.0023 0.0075 -0.0363 302 SER A N 1924 C CA . SER A 243 ? 1.0223 1.0812 1.0705 0.0005 0.0051 -0.0406 302 SER A CA 1925 C C . SER A 243 ? 0.8035 0.8658 0.8493 0.0007 0.0063 -0.0397 302 SER A C 1926 O O . SER A 243 ? 0.8985 0.9592 0.9372 0.0033 0.0059 -0.0428 302 SER A O 1927 C CB . SER A 243 ? 1.0595 1.1193 1.1185 0.0005 0.0017 -0.0426 302 SER A CB 1928 O OG . SER A 243 ? 1.1110 1.1757 1.1802 -0.0023 0.0020 -0.0393 302 SER A OG 1929 N N . ALA A 244 ? 0.7205 0.7873 0.7719 -0.0020 0.0079 -0.0355 303 ALA A N 1930 C CA . ALA A 244 ? 0.6436 0.7139 0.6931 -0.0021 0.0091 -0.0339 303 ALA A CA 1931 C C . ALA A 244 ? 0.7736 0.8431 0.8126 -0.0021 0.0124 -0.0316 303 ALA A C 1932 O O . ALA A 244 ? 0.9141 0.9834 0.9453 -0.0004 0.0130 -0.0329 303 ALA A O 1933 C CB . ALA A 244 ? 0.5690 0.6444 0.6296 -0.0047 0.0093 -0.0304 303 ALA A CB 1934 N N . VAL A 245 ? 0.8777 0.9470 0.9167 -0.0041 0.0144 -0.0283 304 VAL A N 1935 C CA . VAL A 245 ? 0.7927 0.8613 0.8225 -0.0044 0.0174 -0.0259 304 VAL A CA 1936 C C . VAL A 245 ? 0.8244 0.8884 0.8483 -0.0040 0.0182 -0.0269 304 VAL A C 1937 O O . VAL A 245 ? 0.9538 1.0179 0.9811 -0.0059 0.0191 -0.0244 304 VAL A O 1938 C CB . VAL A 245 ? 0.5709 0.6436 0.6052 -0.0071 0.0196 -0.0205 304 VAL A CB 1939 C CG1 . VAL A 245 ? 0.7114 0.7836 0.7359 -0.0070 0.0226 -0.0182 304 VAL A CG1 1940 C CG2 . VAL A 245 ? 0.5396 0.6169 0.5813 -0.0076 0.0188 -0.0193 304 VAL A CG2 1941 N N . PRO A 246 ? 0.8222 0.8822 0.8372 -0.0013 0.0178 -0.0306 305 PRO A N 1942 C CA . PRO A 246 ? 0.9438 0.9991 0.9528 -0.0006 0.0184 -0.0319 305 PRO A CA 1943 C C . PRO A 246 ? 0.8643 0.9196 0.8679 -0.0021 0.0216 -0.0284 305 PRO A C 1944 O O . PRO A 246 ? 0.6999 0.7579 0.7009 -0.0028 0.0234 -0.0258 305 PRO A O 1945 C CB . PRO A 246 ? 0.8052 0.8568 0.8052 0.0029 0.0177 -0.0364 305 PRO A CB 1946 C CG . PRO A 246 ? 0.8337 0.8878 0.8377 0.0040 0.0156 -0.0382 305 PRO A CG 1947 C CD . PRO A 246 ? 0.8334 0.8930 0.8436 0.0013 0.0167 -0.0340 305 PRO A CD 1948 N N . ARG A 247 ? 0.8791 0.9314 0.8813 -0.0026 0.0222 -0.0283 306 ARG A N 1949 C CA . ARG A 247 ? 0.7246 0.7768 0.7226 -0.0041 0.0251 -0.0251 306 ARG A CA 1950 C C . ARG A 247 ? 0.6542 0.7014 0.6436 -0.0027 0.0260 -0.0272 306 ARG A C 1951 O O . ARG A 247 ? 0.6960 0.7397 0.6849 -0.0010 0.0242 -0.0305 306 ARG A O 1952 C CB . ARG A 247 ? 0.7535 0.8083 0.7605 -0.0070 0.0253 -0.0217 306 ARG A CB 1953 C CG . ARG A 247 ? 0.7691 0.8290 0.7812 -0.0087 0.0263 -0.0179 306 ARG A CG 1954 C CD . ARG A 247 ? 0.6565 0.7189 0.6779 -0.0113 0.0266 -0.0145 306 ARG A CD 1955 N NE . ARG A 247 ? 0.8088 0.8707 0.8383 -0.0116 0.0241 -0.0163 306 ARG A NE 1956 C CZ . ARG A 247 ? 0.8787 0.9381 0.9096 -0.0123 0.0237 -0.0167 306 ARG A CZ 1957 N NH1 . ARG A 247 ? 1.1152 1.1727 1.1404 -0.0127 0.0258 -0.0155 306 ARG A NH1 1958 N NH2 . ARG A 247 ? 0.8012 0.8603 0.8396 -0.0125 0.0213 -0.0182 306 ARG A NH2 1959 N N . LYS A 248 ? 0.7776 0.8244 0.7603 -0.0033 0.0288 -0.0251 307 LYS A N 1960 C CA . LYS A 248 ? 0.6985 0.7406 0.6726 -0.0020 0.0301 -0.0267 307 LYS A CA 1961 C C . LYS A 248 ? 0.6018 0.6436 0.5775 -0.0041 0.0316 -0.0241 307 LYS A C 1962 O O . LYS A 248 ? 0.6550 0.7001 0.6344 -0.0064 0.0328 -0.0204 307 LYS A O 1963 C CB . LYS A 248 ? 0.8354 0.8767 0.7993 -0.0007 0.0321 -0.0270 307 LYS A CB 1964 C CG . LYS A 248 ? 1.0291 1.0688 0.9883 0.0022 0.0308 -0.0308 307 LYS A CG 1965 C CD . LYS A 248 ? 1.0767 1.1159 1.0259 0.0033 0.0330 -0.0306 307 LYS A CD 1966 C CE . LYS A 248 ? 1.0786 1.1224 1.0294 0.0012 0.0345 -0.0263 307 LYS A CE 1967 N NZ . LYS A 248 ? 1.0541 1.0974 0.9948 0.0022 0.0367 -0.0260 307 LYS A NZ 1968 N N . HIS A 249 ? 0.7996 0.8371 0.7721 -0.0033 0.0315 -0.0261 308 HIS A N 1969 C CA . HIS A 249 ? 0.8976 0.9343 0.8708 -0.0050 0.0329 -0.0241 308 HIS A CA 1970 C C . HIS A 249 ? 0.8150 0.8479 0.7782 -0.0039 0.0351 -0.0250 308 HIS A C 1971 O O . HIS A 249 ? 0.7653 0.7940 0.7240 -0.0017 0.0345 -0.0283 308 HIS A O 1972 C CB . HIS A 249 ? 0.9091 0.9444 0.8887 -0.0053 0.0308 -0.0252 308 HIS A CB 1973 C CG . HIS A 249 ? 1.2753 1.3113 1.2585 -0.0077 0.0318 -0.0224 308 HIS A CG 1974 N ND1 . HIS A 249 ? 1.3942 1.4344 1.3835 -0.0102 0.0326 -0.0188 308 HIS A ND1 1975 C CD2 . HIS A 249 ? 1.3908 1.4237 1.3722 -0.0079 0.0323 -0.0228 308 HIS A CD2 1976 C CE1 . HIS A 249 ? 1.4571 1.4969 1.4481 -0.0117 0.0335 -0.0171 308 HIS A CE1 1977 N NE2 . HIS A 249 ? 1.3749 1.4104 1.3612 -0.0105 0.0333 -0.0195 308 HIS A NE2 1978 N N . ASN A 250 ? 0.8422 0.8766 0.8021 -0.0052 0.0376 -0.0223 309 ASN A N 1979 C CA . ASN A 250 ? 0.7274 0.7586 0.6778 -0.0042 0.0399 -0.0230 309 ASN A CA 1980 C C . ASN A 250 ? 0.5983 0.6288 0.5485 -0.0059 0.0416 -0.0209 309 ASN A C 1981 O O . ASN A 250 ? 0.7839 0.8178 0.7386 -0.0081 0.0424 -0.0177 309 ASN A O 1982 C CB . ASN A 250 ? 0.6984 0.7314 0.6431 -0.0038 0.0415 -0.0219 309 ASN A CB 1983 C CG . ASN A 250 ? 0.8403 0.8734 0.7833 -0.0017 0.0400 -0.0244 309 ASN A CG 1984 O OD1 . ASN A 250 ? 0.9423 0.9715 0.8793 0.0007 0.0397 -0.0278 309 ASN A OD1 1985 N ND2 . ASN A 250 ? 0.7752 0.8125 0.7232 -0.0025 0.0391 -0.0226 309 ASN A ND2 1986 N N . ARG A 251 ? 0.6182 0.6444 0.5633 -0.0048 0.0423 -0.0230 310 ARG A N 1987 C CA . ARG A 251 ? 0.6115 0.6367 0.5554 -0.0062 0.0442 -0.0214 310 ARG A CA 1988 C C . ARG A 251 ? 0.5956 0.6224 0.5349 -0.0071 0.0468 -0.0190 310 ARG A C 1989 O O . ARG A 251 ? 0.6484 0.6743 0.5809 -0.0057 0.0478 -0.0200 310 ARG A O 1990 C CB . ARG A 251 ? 0.6599 0.6797 0.5985 -0.0046 0.0445 -0.0242 310 ARG A CB 1991 C CG . ARG A 251 ? 0.9242 0.9430 0.8618 -0.0060 0.0463 -0.0227 310 ARG A CG 1992 C CD . ARG A 251 ? 1.0251 1.0385 0.9566 -0.0042 0.0470 -0.0254 310 ARG A CD 1993 N NE . ARG A 251 ? 1.1335 1.1444 1.0676 -0.0027 0.0446 -0.0278 310 ARG A NE 1994 C CZ . ARG A 251 ? 1.1149 1.1208 1.0443 -0.0007 0.0447 -0.0304 310 ARG A CZ 1995 N NH1 . ARG A 251 ? 1.0813 1.0845 1.0034 0.0000 0.0473 -0.0308 310 ARG A NH1 1996 N NH2 . ARG A 251 ? 1.0297 1.0334 0.9617 0.0008 0.0423 -0.0325 310 ARG A NH2 1997 N N . SER A 252 ? 0.5535 0.5827 0.4964 -0.0093 0.0478 -0.0160 311 SER A N 1998 C CA . SER A 252 ? 0.4691 0.4998 0.4080 -0.0101 0.0502 -0.0136 311 SER A CA 1999 C C . SER A 252 ? 0.7070 0.7338 0.6384 -0.0094 0.0522 -0.0148 311 SER A C 2000 O O . SER A 252 ? 0.6406 0.6648 0.5726 -0.0095 0.0521 -0.0160 311 SER A O 2001 C CB . SER A 252 ? 0.4829 0.5173 0.4284 -0.0124 0.0506 -0.0101 311 SER A CB 2002 O OG . SER A 252 ? 0.4940 0.5298 0.4357 -0.0129 0.0527 -0.0078 311 SER A OG 2003 N N . PRO A 253 ? 0.6125 0.6391 0.5369 -0.0087 0.0540 -0.0146 312 PRO A N 2004 C CA . PRO A 253 ? 0.4712 0.4945 0.3886 -0.0083 0.0562 -0.0154 312 PRO A CA 2005 C C . PRO A 253 ? 0.7064 0.7310 0.6264 -0.0103 0.0575 -0.0129 312 PRO A C 2006 O O . PRO A 253 ? 0.6035 0.6253 0.5196 -0.0102 0.0591 -0.0137 312 PRO A O 2007 C CB . PRO A 253 ? 0.3796 0.4032 0.2899 -0.0072 0.0575 -0.0152 312 PRO A CB 2008 C CG . PRO A 253 ? 0.5898 0.6180 0.5046 -0.0079 0.0565 -0.0129 312 PRO A CG 2009 C CD . PRO A 253 ? 0.6262 0.6555 0.5488 -0.0082 0.0540 -0.0136 312 PRO A CD 2010 N N . TYR A 254 ? 0.4727 0.5014 0.3994 -0.0119 0.0569 -0.0101 313 TYR A N 2011 C CA . TYR A 254 ? 0.5291 0.5591 0.4590 -0.0137 0.0579 -0.0078 313 TYR A CA 2012 C C . TYR A 254 ? 0.4324 0.4629 0.3698 -0.0148 0.0564 -0.0077 313 TYR A C 2013 O O . TYR A 254 ? 0.4338 0.4668 0.3763 -0.0164 0.0566 -0.0053 313 TYR A O 2014 C CB . TYR A 254 ? 0.3336 0.3677 0.2649 -0.0145 0.0587 -0.0045 313 TYR A CB 2015 C CG . TYR A 254 ? 0.7619 0.7953 0.6854 -0.0137 0.0605 -0.0042 313 TYR A CG 2016 C CD1 . TYR A 254 ? 0.6491 0.6826 0.5681 -0.0124 0.0604 -0.0049 313 TYR A CD1 2017 C CD2 . TYR A 254 ? 0.3579 0.3907 0.2786 -0.0143 0.0624 -0.0033 313 TYR A CD2 2018 C CE1 . TYR A 254 ? 0.6379 0.6707 0.5494 -0.0116 0.0621 -0.0047 313 TYR A CE1 2019 C CE2 . TYR A 254 ? 0.6539 0.6860 0.5676 -0.0136 0.0641 -0.0030 313 TYR A CE2 2020 C CZ . TYR A 254 ? 0.7305 0.7626 0.6395 -0.0123 0.0639 -0.0037 313 TYR A CZ 2021 O OH . TYR A 254 ? 0.5677 0.5991 0.4695 -0.0116 0.0655 -0.0034 313 TYR A OH 2022 N N . ARG A 255 ? 0.4585 0.4865 0.3966 -0.0138 0.0548 -0.0103 314 ARG A N 2023 C CA . ARG A 255 ? 0.4337 0.4614 0.3780 -0.0147 0.0534 -0.0106 314 ARG A CA 2024 C C . ARG A 255 ? 0.5954 0.6216 0.5387 -0.0157 0.0548 -0.0101 314 ARG A C 2025 O O . ARG A 255 ? 0.7346 0.7581 0.6717 -0.0150 0.0564 -0.0112 314 ARG A O 2026 C CB . ARG A 255 ? 0.5352 0.5595 0.4787 -0.0130 0.0515 -0.0138 314 ARG A CB 2027 C CG . ARG A 255 ? 0.7864 0.8100 0.7358 -0.0137 0.0498 -0.0143 314 ARG A CG 2028 C CD . ARG A 255 ? 0.9929 1.0130 0.9409 -0.0117 0.0480 -0.0175 314 ARG A CD 2029 N NE . ARG A 255 ? 0.9630 0.9823 0.9166 -0.0122 0.0461 -0.0179 314 ARG A NE 2030 C CZ . ARG A 255 ? 0.9152 0.9317 0.8675 -0.0123 0.0465 -0.0186 314 ARG A CZ 2031 N NH1 . ARG A 255 ? 0.8318 0.8460 0.7778 -0.0119 0.0488 -0.0189 314 ARG A NH1 2032 N NH2 . ARG A 255 ? 1.1017 1.1177 1.0590 -0.0127 0.0446 -0.0188 314 ARG A NH2 2033 N N . ARG A 256 ? 0.3978 0.4259 0.3475 -0.0173 0.0543 -0.0084 315 ARG A N 2034 C CA . ARG A 256 ? 0.6380 0.6649 0.5874 -0.0183 0.0555 -0.0080 315 ARG A CA 2035 C C . ARG A 256 ? 0.6261 0.6492 0.5747 -0.0176 0.0545 -0.0105 315 ARG A C 2036 O O . ARG A 256 ? 0.5919 0.6135 0.5408 -0.0163 0.0528 -0.0124 315 ARG A O 2037 C CB . ARG A 256 ? 0.4947 0.5252 0.4508 -0.0201 0.0555 -0.0052 315 ARG A CB 2038 C CG . ARG A 256 ? 0.4826 0.5165 0.4387 -0.0205 0.0568 -0.0026 315 ARG A CG 2039 C CD . ARG A 256 ? 0.3820 0.4195 0.3451 -0.0220 0.0566 0.0002 315 ARG A CD 2040 N NE . ARG A 256 ? 0.4478 0.4877 0.4098 -0.0223 0.0583 0.0027 315 ARG A NE 2041 C CZ . ARG A 256 ? 0.4394 0.4797 0.4015 -0.0230 0.0597 0.0039 315 ARG A CZ 2042 N NH1 . ARG A 256 ? 0.6711 0.7097 0.6344 -0.0237 0.0597 0.0029 315 ARG A NH1 2043 N NH2 . ARG A 256 ? 0.6022 0.6447 0.5633 -0.0230 0.0611 0.0061 315 ARG A NH2 2044 N N . THR A 257 ? 0.4505 0.4719 0.3982 -0.0182 0.0555 -0.0106 316 THR A N 2045 C CA . THR A 257 ? 0.5038 0.5212 0.4499 -0.0173 0.0548 -0.0129 316 THR A CA 2046 C C . THR A 257 ? 0.5759 0.5937 0.5284 -0.0178 0.0524 -0.0130 316 THR A C 2047 O O . THR A 257 ? 0.6639 0.6786 0.6157 -0.0165 0.0509 -0.0152 316 THR A O 2048 C CB . THR A 257 ? 0.3531 0.3684 0.2958 -0.0178 0.0567 -0.0130 316 THR A CB 2049 O OG1 . THR A 257 ? 0.7926 0.8106 0.7400 -0.0198 0.0570 -0.0109 316 THR A OG1 2050 C CG2 . THR A 257 ? 0.7575 0.7722 0.6939 -0.0173 0.0591 -0.0131 316 THR A CG2 2051 N N . TYR A 258 ? 0.4150 0.4363 0.3735 -0.0196 0.0521 -0.0107 317 TYR A N 2052 C CA . TYR A 258 ? 0.6486 0.6706 0.6135 -0.0204 0.0500 -0.0105 317 TYR A CA 2053 C C . TYR A 258 ? 0.5549 0.5735 0.5184 -0.0202 0.0497 -0.0118 317 TYR A C 2054 O O . TYR A 258 ? 0.5744 0.5912 0.5399 -0.0196 0.0476 -0.0132 317 TYR A O 2055 C CB . TYR A 258 ? 0.4703 0.4924 0.4380 -0.0193 0.0476 -0.0117 317 TYR A CB 2056 C CG . TYR A 258 ? 0.5937 0.6197 0.5644 -0.0198 0.0476 -0.0100 317 TYR A CG 2057 C CD1 . TYR A 258 ? 0.5137 0.5430 0.4919 -0.0211 0.0465 -0.0082 317 TYR A CD1 2058 C CD2 . TYR A 258 ? 0.5094 0.5357 0.4753 -0.0188 0.0488 -0.0101 317 TYR A CD2 2059 C CE1 . TYR A 258 ? 0.5300 0.5628 0.5110 -0.0214 0.0465 -0.0065 317 TYR A CE1 2060 C CE2 . TYR A 258 ? 0.5761 0.6059 0.5445 -0.0192 0.0488 -0.0085 317 TYR A CE2 2061 C CZ . TYR A 258 ? 0.6250 0.6582 0.6012 -0.0204 0.0476 -0.0067 317 TYR A CZ 2062 O OH . TYR A 258 ? 0.5797 0.6163 0.5585 -0.0207 0.0477 -0.0049 317 TYR A OH 2063 N N . SER A 259 ? 0.4494 0.4672 0.4095 -0.0208 0.0518 -0.0114 318 SER A N 2064 C CA . SER A 259 ? 0.5628 0.5777 0.5216 -0.0208 0.0519 -0.0123 318 SER A CA 2065 C C . SER A 259 ? 0.6681 0.6846 0.6270 -0.0224 0.0539 -0.0106 318 SER A C 2066 O O . SER A 259 ? 0.5416 0.5598 0.4986 -0.0228 0.0557 -0.0095 318 SER A O 2067 C CB . SER A 259 ? 0.4757 0.4862 0.4279 -0.0189 0.0524 -0.0147 318 SER A CB 2068 O OG . SER A 259 ? 0.6539 0.6620 0.6035 -0.0192 0.0536 -0.0151 318 SER A OG 2069 N N . LYS A 260 ? 0.6082 0.6242 0.5694 -0.0233 0.0534 -0.0104 319 LYS A N 2070 C CA . LYS A 260 ? 0.6032 0.6204 0.5645 -0.0247 0.0552 -0.0090 319 LYS A CA 2071 C C . LYS A 260 ? 0.5820 0.5962 0.5376 -0.0242 0.0569 -0.0103 319 LYS A C 2072 O O . LYS A 260 ? 0.7217 0.7369 0.6766 -0.0251 0.0587 -0.0094 319 LYS A O 2073 C CB . LYS A 260 ? 0.4333 0.4518 0.3999 -0.0260 0.0540 -0.0081 319 LYS A CB 2074 C CG . LYS A 260 ? 0.5639 0.5795 0.5311 -0.0254 0.0519 -0.0096 319 LYS A CG 2075 C CD . LYS A 260 ? 0.5903 0.6076 0.5632 -0.0267 0.0506 -0.0083 319 LYS A CD 2076 C CE . LYS A 260 ? 0.6524 0.6669 0.6260 -0.0261 0.0484 -0.0097 319 LYS A CE 2077 N NZ . LYS A 260 ? 0.9277 0.9387 0.8963 -0.0255 0.0491 -0.0110 319 LYS A NZ 2078 N N . LYS A 261 ? 0.5203 0.5306 0.4720 -0.0226 0.0564 -0.0124 320 LYS A N 2079 C CA . LYS A 261 ? 0.7134 0.7206 0.6594 -0.0220 0.0583 -0.0137 320 LYS A CA 2080 C C . LYS A 261 ? 0.7054 0.7128 0.6471 -0.0214 0.0603 -0.0138 320 LYS A C 2081 O O . LYS A 261 ? 0.8840 0.8927 0.8244 -0.0223 0.0623 -0.0129 320 LYS A O 2082 C CB . LYS A 261 ? 0.7461 0.7488 0.6894 -0.0203 0.0572 -0.0158 320 LYS A CB 2083 C CG . LYS A 261 ? 1.0579 1.0590 1.0026 -0.0207 0.0564 -0.0159 320 LYS A CG 2084 C CD . LYS A 261 ? 1.1741 1.1780 1.1251 -0.0221 0.0545 -0.0145 320 LYS A CD 2085 C CE . LYS A 261 ? 1.0619 1.0640 1.0134 -0.0225 0.0539 -0.0147 320 LYS A CE 2086 N NZ . LYS A 261 ? 1.0037 1.0083 0.9609 -0.0238 0.0521 -0.0134 320 LYS A NZ 2087 N N . ASN A 262 ? 0.7487 0.7549 0.6881 -0.0199 0.0597 -0.0149 321 ASN A N 2088 C CA . ASN A 262 ? 0.7821 0.7886 0.7172 -0.0193 0.0614 -0.0149 321 ASN A CA 2089 C C . ASN A 262 ? 0.5505 0.5613 0.4890 -0.0200 0.0609 -0.0131 321 ASN A C 2090 O O . ASN A 262 ? 0.7231 0.7344 0.6628 -0.0192 0.0594 -0.0135 321 ASN A O 2091 C CB . ASN A 262 ? 0.8299 0.8326 0.7598 -0.0171 0.0614 -0.0172 321 ASN A CB 2092 C CG . ASN A 262 ? 1.0198 1.0208 0.9518 -0.0159 0.0588 -0.0185 321 ASN A CG 2093 O OD1 . ASN A 262 ? 1.0266 1.0302 0.9640 -0.0166 0.0569 -0.0175 321 ASN A OD1 2094 N ND2 . ASN A 262 ? 0.8859 0.8825 0.8138 -0.0139 0.0588 -0.0207 321 ASN A ND2 2095 N N . GLN A 263 ? 0.5498 0.5636 0.4899 -0.0214 0.0622 -0.0111 322 GLN A N 2096 C CA . GLN A 263 ? 0.5668 0.5848 0.5109 -0.0222 0.0618 -0.0090 322 GLN A CA 2097 C C . GLN A 263 ? 0.6161 0.6350 0.5563 -0.0216 0.0630 -0.0085 322 GLN A C 2098 O O . GLN A 263 ? 0.4441 0.4665 0.3869 -0.0221 0.0629 -0.0066 322 GLN A O 2099 C CB . GLN A 263 ? 0.4254 0.4461 0.3734 -0.0239 0.0624 -0.0070 322 GLN A CB 2100 C CG . GLN A 263 ? 0.4551 0.4751 0.4070 -0.0246 0.0611 -0.0073 322 GLN A CG 2101 C CD . GLN A 263 ? 0.4312 0.4535 0.3860 -0.0260 0.0620 -0.0056 322 GLN A CD 2102 O OE1 . GLN A 263 ? 0.4223 0.4472 0.3777 -0.0264 0.0632 -0.0040 322 GLN A OE1 2103 N NE2 . GLN A 263 ? 0.3618 0.3829 0.3184 -0.0266 0.0614 -0.0061 322 GLN A NE2 2104 N N . VAL A 264 ? 0.5461 0.5620 0.4801 -0.0205 0.0643 -0.0102 323 VAL A N 2105 C CA . VAL A 264 ? 0.4592 0.4757 0.3887 -0.0199 0.0657 -0.0098 323 VAL A CA 2106 C C . VAL A 264 ? 0.5494 0.5636 0.4746 -0.0181 0.0654 -0.0117 323 VAL A C 2107 O O . VAL A 264 ? 0.6715 0.6817 0.5921 -0.0169 0.0661 -0.0139 323 VAL A O 2108 C CB . VAL A 264 ? 0.6029 0.6182 0.5284 -0.0202 0.0681 -0.0100 323 VAL A CB 2109 C CG1 . VAL A 264 ? 0.5422 0.5581 0.4629 -0.0195 0.0695 -0.0096 323 VAL A CG1 2110 C CG2 . VAL A 264 ? 0.5145 0.5323 0.4441 -0.0217 0.0686 -0.0082 323 VAL A CG2 2111 N N . ALA A 265 ? 0.6172 0.6336 0.5436 -0.0177 0.0643 -0.0110 324 ALA A N 2112 C CA . ALA A 265 ? 0.6425 0.6570 0.5644 -0.0159 0.0640 -0.0127 324 ALA A CA 2113 C C . ALA A 265 ? 0.5331 0.5466 0.4482 -0.0153 0.0662 -0.0129 324 ALA A C 2114 O O . ALA A 265 ? 0.6454 0.6606 0.5602 -0.0163 0.0677 -0.0113 324 ALA A O 2115 C CB . ALA A 265 ? 0.3379 0.3555 0.2636 -0.0158 0.0622 -0.0118 324 ALA A CB 2116 N N . GLU A 266 ? 0.5421 0.5527 0.4517 -0.0135 0.0665 -0.0150 325 GLU A N 2117 C CA . GLU A 266 ? 0.6047 0.6139 0.5072 -0.0126 0.0687 -0.0155 325 GLU A CA 2118 C C . GLU A 266 ? 0.6126 0.6257 0.5152 -0.0134 0.0692 -0.0130 325 GLU A C 2119 O O . GLU A 266 ? 0.5998 0.6129 0.4991 -0.0138 0.0710 -0.0123 325 GLU A O 2120 C CB . GLU A 266 ? 0.7089 0.7149 0.6059 -0.0104 0.0685 -0.0181 325 GLU A CB 2121 C CG . GLU A 266 ? 0.8091 0.8134 0.6983 -0.0094 0.0708 -0.0187 325 GLU A CG 2122 C CD . GLU A 266 ? 0.8550 0.8556 0.7384 -0.0070 0.0708 -0.0214 325 GLU A CD 2123 O OE1 . GLU A 266 ? 0.9139 0.9130 0.7992 -0.0059 0.0691 -0.0230 325 GLU A OE1 2124 O OE2 . GLU A 266 ? 0.8528 0.8521 0.7295 -0.0060 0.0726 -0.0220 325 GLU A OE2 2125 N N . TRP A 267 ? 0.5417 0.5579 0.4481 -0.0136 0.0675 -0.0118 326 TRP A N 2126 C CA . TRP A 267 ? 0.5005 0.5204 0.4070 -0.0141 0.0678 -0.0093 326 TRP A CA 2127 C C . TRP A 267 ? 0.6170 0.6397 0.5275 -0.0157 0.0685 -0.0067 326 TRP A C 2128 O O . TRP A 267 ? 0.5151 0.5404 0.4249 -0.0160 0.0691 -0.0046 326 TRP A O 2129 C CB . TRP A 267 ? 0.4075 0.4300 0.3176 -0.0137 0.0658 -0.0086 326 TRP A CB 2130 C CG . TRP A 267 ? 0.5922 0.6163 0.5102 -0.0147 0.0639 -0.0081 326 TRP A CG 2131 C CD1 . TRP A 267 ? 0.5994 0.6216 0.5196 -0.0141 0.0623 -0.0101 326 TRP A CD1 2132 C CD2 . TRP A 267 ? 0.5461 0.5741 0.4708 -0.0162 0.0634 -0.0053 326 TRP A CD2 2133 N NE1 . TRP A 267 ? 0.5520 0.5766 0.4799 -0.0154 0.0608 -0.0088 326 TRP A NE1 2134 C CE2 . TRP A 267 ? 0.5453 0.5734 0.4761 -0.0167 0.0615 -0.0058 326 TRP A CE2 2135 C CE3 . TRP A 267 ? 0.4607 0.4918 0.3869 -0.0171 0.0643 -0.0024 326 TRP A CE3 2136 C CZ2 . TRP A 267 ? 0.3309 0.3622 0.2690 -0.0181 0.0607 -0.0036 326 TRP A CZ2 2137 C CZ3 . TRP A 267 ? 0.5425 0.5766 0.4759 -0.0184 0.0635 -0.0002 326 TRP A CZ3 2138 C CH2 . TRP A 267 ? 0.3286 0.3629 0.2679 -0.0189 0.0618 -0.0008 326 TRP A CH2 2139 N N . GLN A 268 ? 0.5697 0.5918 0.4842 -0.0167 0.0682 -0.0069 327 GLN A N 2140 C CA . GLN A 268 ? 0.5615 0.5860 0.4797 -0.0181 0.0689 -0.0047 327 GLN A CA 2141 C C . GLN A 268 ? 0.7546 0.7773 0.6684 -0.0183 0.0710 -0.0052 327 GLN A C 2142 O O . GLN A 268 ? 0.6689 0.6935 0.5842 -0.0191 0.0718 -0.0034 327 GLN A O 2143 C CB . GLN A 268 ? 0.3374 0.3624 0.2622 -0.0192 0.0676 -0.0046 327 GLN A CB 2144 C CG . GLN A 268 ? 0.3731 0.4013 0.3040 -0.0196 0.0658 -0.0030 327 GLN A CG 2145 C CD . GLN A 268 ? 0.4639 0.4919 0.4006 -0.0204 0.0644 -0.0034 327 GLN A CD 2146 O OE1 . GLN A 268 ? 0.5755 0.6004 0.5110 -0.0200 0.0639 -0.0057 327 GLN A OE1 2147 N NE2 . GLN A 268 ? 0.4107 0.4419 0.3535 -0.0215 0.0637 -0.0012 327 GLN A NE2 2148 N N . SER A 269 ? 0.7440 0.7628 0.6525 -0.0174 0.0719 -0.0076 328 SER A N 2149 C CA . SER A 269 ? 0.8392 0.8559 0.7436 -0.0175 0.0740 -0.0083 328 SER A CA 2150 C C . SER A 269 ? 0.8654 0.8806 0.7625 -0.0163 0.0755 -0.0090 328 SER A C 2151 O O . SER A 269 ? 0.9962 1.0109 0.8902 -0.0165 0.0772 -0.0087 328 SER A O 2152 C CB . SER A 269 ? 0.6204 0.6335 0.5245 -0.0174 0.0743 -0.0105 328 SER A CB 2153 O OG . SER A 269 ? 0.8291 0.8394 0.7308 -0.0160 0.0735 -0.0126 328 SER A OG 2154 N N . SER A 270 ? 0.8699 0.8844 0.7644 -0.0150 0.0747 -0.0099 329 SER A N 2155 C CA . SER A 270 ? 0.6737 0.6866 0.5609 -0.0138 0.0760 -0.0107 329 SER A CA 2156 C C . SER A 270 ? 0.7000 0.7164 0.5869 -0.0137 0.0754 -0.0085 329 SER A C 2157 O O . SER A 270 ? 0.8674 0.8857 0.7573 -0.0134 0.0737 -0.0080 329 SER A O 2158 C CB . SER A 270 ? 0.5039 0.5131 0.3871 -0.0121 0.0758 -0.0135 329 SER A CB 2159 O OG . SER A 270 ? 0.8104 0.8186 0.6868 -0.0108 0.0768 -0.0142 329 SER A OG 2160 N N . MSE A 271 ? 0.5157 0.5330 0.3993 -0.0138 0.0768 -0.0073 330 MSE A N 2161 C CA . MSE A 271 ? 0.7899 0.8106 0.6733 -0.0136 0.0763 -0.0048 330 MSE A CA 2162 C C . MSE A 271 ? 0.8198 0.8398 0.6978 -0.0122 0.0761 -0.0057 330 MSE A C 2163 O O . MSE A 271 ? 0.9329 0.9558 0.8126 -0.0120 0.0748 -0.0040 330 MSE A O 2164 C CB . MSE A 271 ? 0.7604 0.7819 0.6414 -0.0140 0.0779 -0.0033 330 MSE A CB 2165 C CG . MSE A 271 ? 0.9060 0.9318 0.7894 -0.0142 0.0771 0.0000 330 MSE A CG 2166 SE SE . MSE A 271 ? 2.2830 2.3122 2.1759 -0.0157 0.0763 0.0024 330 MSE A SE 2167 C CE . MSE A 271 ? 0.3301 0.3604 0.2294 -0.0160 0.0740 0.0021 330 MSE A CE 2168 N N . ASN A 272 ? 0.7722 0.7883 0.6440 -0.0110 0.0773 -0.0083 331 ASN A N 2169 C CA . ASN A 272 ? 0.7457 0.7607 0.6116 -0.0094 0.0772 -0.0095 331 ASN A CA 2170 C C . ASN A 272 ? 0.6592 0.6732 0.5270 -0.0086 0.0755 -0.0113 331 ASN A C 2171 O O . ASN A 272 ? 0.7161 0.7281 0.5787 -0.0069 0.0756 -0.0132 331 ASN A O 2172 C CB . ASN A 272 ? 0.7937 0.8046 0.6514 -0.0084 0.0795 -0.0115 331 ASN A CB 2173 C CG . ASN A 272 ? 0.9860 0.9933 0.8440 -0.0086 0.0806 -0.0135 331 ASN A CG 2174 O OD1 . ASN A 272 ? 0.9863 0.9913 0.8452 -0.0079 0.0800 -0.0156 331 ASN A OD1 2175 N ND2 . ASN A 272 ? 1.0988 1.1057 0.9561 -0.0095 0.0823 -0.0130 331 ASN A ND2 2176 N N . TYR A 273 ? 0.7016 0.7170 0.5769 -0.0096 0.0740 -0.0108 332 TYR A N 2177 C CA . TYR A 273 ? 0.7656 0.7803 0.6438 -0.0089 0.0722 -0.0125 332 TYR A CA 2178 C C . TYR A 273 ? 0.7663 0.7825 0.6429 -0.0077 0.0710 -0.0125 332 TYR A C 2179 O O . TYR A 273 ? 0.7254 0.7392 0.5992 -0.0061 0.0704 -0.0150 332 TYR A O 2180 C CB . TYR A 273 ? 0.5261 0.5430 0.4131 -0.0104 0.0706 -0.0113 332 TYR A CB 2181 C CG . TYR A 273 ? 0.4916 0.5078 0.3822 -0.0097 0.0686 -0.0129 332 TYR A CG 2182 C CD1 . TYR A 273 ? 0.6195 0.6319 0.5092 -0.0089 0.0685 -0.0155 332 TYR A CD1 2183 C CD2 . TYR A 273 ? 0.4541 0.4736 0.3491 -0.0099 0.0666 -0.0117 332 TYR A CD2 2184 C CE1 . TYR A 273 ? 0.6166 0.6283 0.5097 -0.0081 0.0664 -0.0170 332 TYR A CE1 2185 C CE2 . TYR A 273 ? 0.5021 0.5211 0.4007 -0.0093 0.0646 -0.0132 332 TYR A CE2 2186 C CZ . TYR A 273 ? 0.5861 0.6011 0.4836 -0.0084 0.0645 -0.0159 332 TYR A CZ 2187 O OH . TYR A 273 ? 0.5041 0.5185 0.4052 -0.0076 0.0623 -0.0175 332 TYR A OH 2188 N N . CYS A 274 ? 0.6727 0.6930 0.5513 -0.0085 0.0705 -0.0096 333 CYS A N 2189 C CA . CYS A 274 ? 0.7993 0.8216 0.6771 -0.0076 0.0693 -0.0092 333 CYS A CA 2190 C C . CYS A 274 ? 0.8984 0.9181 0.7668 -0.0057 0.0704 -0.0111 333 CYS A C 2191 O O . CYS A 274 ? 0.7110 0.7300 0.5774 -0.0043 0.0695 -0.0129 333 CYS A O 2192 C CB . CYS A 274 ? 0.7587 0.7857 0.6401 -0.0086 0.0688 -0.0055 333 CYS A CB 2193 S SG . CYS A 274 ? 0.5944 0.6246 0.4767 -0.0077 0.0671 -0.0047 333 CYS A SG 2194 N N . THR A 275 ? 0.7932 0.8117 0.6562 -0.0058 0.0725 -0.0107 334 THR A N 2195 C CA . THR A 275 ? 0.7166 0.7325 0.5702 -0.0041 0.0739 -0.0123 334 THR A CA 2196 C C . THR A 275 ? 0.6545 0.6657 0.5043 -0.0024 0.0743 -0.0161 334 THR A C 2197 O O . THR A 275 ? 0.6671 0.6770 0.5117 -0.0006 0.0741 -0.0179 334 THR A O 2198 C CB . THR A 275 ? 0.7130 0.7279 0.5621 -0.0046 0.0762 -0.0113 334 THR A CB 2199 O OG1 . THR A 275 ? 0.7449 0.7639 0.5959 -0.0056 0.0758 -0.0079 334 THR A OG1 2200 C CG2 . THR A 275 ? 0.6185 0.6299 0.4576 -0.0028 0.0779 -0.0134 334 THR A CG2 2201 N N . ASP A 276 ? 0.4820 0.4906 0.3341 -0.0028 0.0748 -0.0174 335 ASP A N 2202 C CA . ASP A 276 ? 0.5219 0.5257 0.3700 -0.0010 0.0754 -0.0209 335 ASP A CA 2203 C C . ASP A 276 ? 0.6817 0.6851 0.5342 -0.0002 0.0731 -0.0226 335 ASP A C 2204 O O . ASP A 276 ? 0.8005 0.8005 0.6486 0.0020 0.0731 -0.0255 335 ASP A O 2205 C CB . ASP A 276 ? 0.5739 0.5747 0.4219 -0.0017 0.0771 -0.0216 335 ASP A CB 2206 C CG . ASP A 276 ? 0.8063 0.8072 0.6502 -0.0025 0.0794 -0.0202 335 ASP A CG 2207 O OD1 . ASP A 276 ? 0.9652 0.9664 0.8031 -0.0017 0.0801 -0.0199 335 ASP A OD1 2208 O OD2 . ASP A 276 ? 0.8596 0.8602 0.7061 -0.0038 0.0803 -0.0195 335 ASP A OD2 2209 N N . LYS A 277 ? 0.7255 0.7322 0.5865 -0.0018 0.0712 -0.0209 336 LYS A N 2210 C CA . LYS A 277 ? 0.7384 0.7444 0.6044 -0.0012 0.0691 -0.0224 336 LYS A CA 2211 C C . LYS A 277 ? 0.7286 0.7383 0.5993 -0.0013 0.0667 -0.0215 336 LYS A C 2212 O O . LYS A 277 ? 0.7107 0.7196 0.5842 -0.0003 0.0649 -0.0233 336 LYS A O 2213 C CB . LYS A 277 ? 0.7083 0.7143 0.5808 -0.0029 0.0687 -0.0217 336 LYS A CB 2214 C CG . LYS A 277 ? 0.7345 0.7367 0.6031 -0.0028 0.0709 -0.0228 336 LYS A CG 2215 C CD . LYS A 277 ? 0.7690 0.7660 0.6327 -0.0003 0.0714 -0.0263 336 LYS A CD 2216 C CE . LYS A 277 ? 0.8725 0.8657 0.7320 -0.0002 0.0738 -0.0272 336 LYS A CE 2217 N NZ . LYS A 277 ? 0.8151 0.8087 0.6807 -0.0019 0.0736 -0.0262 336 LYS A NZ 2218 N N . VAL A 278 ? 0.5931 0.6069 0.4647 -0.0024 0.0667 -0.0187 337 VAL A N 2219 C CA . VAL A 278 ? 0.5985 0.6161 0.4750 -0.0026 0.0645 -0.0176 337 VAL A CA 2220 C C . VAL A 278 ? 0.6572 0.6757 0.5278 -0.0013 0.0647 -0.0177 337 VAL A C 2221 O O . VAL A 278 ? 0.6060 0.6247 0.4767 0.0000 0.0632 -0.0192 337 VAL A O 2222 C CB . VAL A 278 ? 0.6952 0.7174 0.5794 -0.0049 0.0640 -0.0139 337 VAL A CB 2223 C CG1 . VAL A 278 ? 0.5281 0.5542 0.4170 -0.0051 0.0620 -0.0125 337 VAL A CG1 2224 C CG2 . VAL A 278 ? 0.5796 0.6012 0.4701 -0.0063 0.0635 -0.0138 337 VAL A CG2 2225 N N . LYS A 279 ? 0.6108 0.6298 0.4761 -0.0015 0.0666 -0.0161 338 LYS A N 2226 C CA . LYS A 279 ? 0.5893 0.6090 0.4481 -0.0002 0.0669 -0.0160 338 LYS A CA 2227 C C . LYS A 279 ? 0.7623 0.7777 0.6135 0.0023 0.0674 -0.0199 338 LYS A C 2228 O O . LYS A 279 ? 0.8139 0.8299 0.6605 0.0037 0.0671 -0.0205 338 LYS A O 2229 C CB . LYS A 279 ? 0.6506 0.6712 0.5048 -0.0009 0.0689 -0.0137 338 LYS A CB 2230 C CG . LYS A 279 ? 0.5914 0.6169 0.4511 -0.0026 0.0682 -0.0096 338 LYS A CG 2231 C CD . LYS A 279 ? 0.5128 0.5388 0.3679 -0.0031 0.0700 -0.0074 338 LYS A CD 2232 C CE . LYS A 279 ? 0.5140 0.5448 0.3740 -0.0042 0.0693 -0.0034 338 LYS A CE 2233 N NZ . LYS A 279 ? 0.6063 0.6376 0.4621 -0.0046 0.0709 -0.0012 338 LYS A NZ 2234 N N . THR A 280 ? 0.7269 0.7381 0.5766 0.0030 0.0682 -0.0224 339 THR A N 2235 C CA . THR A 280 ? 0.6462 0.6528 0.4885 0.0056 0.0689 -0.0261 339 THR A CA 2236 C C . THR A 280 ? 0.7168 0.7224 0.5624 0.0071 0.0667 -0.0287 339 THR A C 2237 O O . THR A 280 ? 0.8510 0.8530 0.6908 0.0096 0.0669 -0.0319 339 THR A O 2238 C CB . THR A 280 ? 0.6249 0.6269 0.4630 0.0060 0.0712 -0.0277 339 THR A CB 2239 O OG1 . THR A 280 ? 0.7105 0.7121 0.5557 0.0049 0.0704 -0.0276 339 THR A OG1 2240 C CG2 . THR A 280 ? 0.4540 0.4565 0.2880 0.0049 0.0734 -0.0255 339 THR A CG2 2241 N N . LYS A 281 ? 0.7033 0.7120 0.5583 0.0056 0.0645 -0.0274 340 LYS A N 2242 C CA . LYS A 281 ? 0.8219 0.8300 0.6808 0.0069 0.0621 -0.0297 340 LYS A CA 2243 C C . LYS A 281 ? 0.9015 0.9121 0.7594 0.0080 0.0608 -0.0300 340 LYS A C 2244 O O . LYS A 281 ? 0.8597 0.8740 0.7179 0.0068 0.0609 -0.0273 340 LYS A O 2245 C CB . LYS A 281 ? 0.8335 0.8440 0.7029 0.0049 0.0603 -0.0281 340 LYS A CB 2246 C CG . LYS A 281 ? 0.9328 0.9402 0.8035 0.0044 0.0612 -0.0286 340 LYS A CG 2247 C CD . LYS A 281 ? 1.0320 1.0417 0.9126 0.0024 0.0593 -0.0271 340 LYS A CD 2248 C CE . LYS A 281 ? 1.0971 1.1063 0.9819 0.0038 0.0566 -0.0294 340 LYS A CE 2249 N NZ . LYS A 281 ? 1.0788 1.0898 0.9731 0.0020 0.0549 -0.0282 340 LYS A NZ 2250 N N . ARG A 282 ? 0.9490 0.9572 0.8056 0.0103 0.0594 -0.0334 341 ARG A N 2251 C CA . ARG A 282 ? 0.9134 0.9235 0.7689 0.0117 0.0580 -0.0343 341 ARG A CA 2252 C C . ARG A 282 ? 0.7872 0.8031 0.6514 0.0095 0.0561 -0.0313 341 ARG A C 2253 O O . ARG A 282 ? 0.8588 0.8778 0.7213 0.0094 0.0560 -0.0298 341 ARG A O 2254 C CB . ARG A 282 ? 1.0874 1.0942 0.9421 0.0145 0.0564 -0.0385 341 ARG A CB 2255 C CG . ARG A 282 ? 1.3240 1.3250 1.1689 0.0174 0.0583 -0.0419 341 ARG A CG 2256 C CD . ARG A 282 ? 1.4697 1.4676 1.3141 0.0204 0.0565 -0.0460 341 ARG A CD 2257 N NE . ARG A 282 ? 1.6475 1.6396 1.4878 0.0225 0.0576 -0.0487 341 ARG A NE 2258 C CZ . ARG A 282 ? 1.6682 1.6567 1.5082 0.0253 0.0562 -0.0523 341 ARG A CZ 2259 N NH1 . ARG A 282 ? 1.7807 1.7710 1.6244 0.0264 0.0535 -0.0537 341 ARG A NH1 2260 N NH2 . ARG A 282 ? 1.4939 1.4771 1.3301 0.0272 0.0575 -0.0544 341 ARG A NH2 2261 N N . GLN A 283 ? 0.9656 0.9829 0.8390 0.0080 0.0546 -0.0303 342 GLN A N 2262 C CA . GLN A 283 ? 0.8843 0.9067 0.7667 0.0060 0.0528 -0.0276 342 GLN A CA 2263 C C . GLN A 283 ? 0.6738 0.7000 0.5567 0.0039 0.0541 -0.0234 342 GLN A C 2264 O O . GLN A 283 ? 0.7069 0.7375 0.5949 0.0028 0.0531 -0.0210 342 GLN A O 2265 C CB . GLN A 283 ? 0.9723 0.9948 0.8638 0.0047 0.0512 -0.0275 342 GLN A CB 2266 C CG . GLN A 283 ? 1.2209 1.2395 1.1126 0.0069 0.0497 -0.0315 342 GLN A CG 2267 C CD . GLN A 283 ? 1.2877 1.3081 1.1839 0.0079 0.0470 -0.0330 342 GLN A CD 2268 O OE1 . GLN A 283 ? 1.2137 1.2360 1.1072 0.0087 0.0468 -0.0331 342 GLN A OE1 2269 N NE2 . GLN A 283 ? 1.2632 1.2830 1.1662 0.0080 0.0449 -0.0343 342 GLN A NE2 2270 N N . TYR A 284 ? 0.5134 0.5379 0.3913 0.0034 0.0564 -0.0224 343 TYR A N 2271 C CA . TYR A 284 ? 0.5788 0.6065 0.4572 0.0015 0.0577 -0.0184 343 TYR A CA 2272 C C . TYR A 284 ? 0.6139 0.6409 0.4826 0.0024 0.0596 -0.0181 343 TYR A C 2273 O O . TYR A 284 ? 0.6529 0.6827 0.5213 0.0013 0.0605 -0.0148 343 TYR A O 2274 C CB . TYR A 284 ? 0.7091 0.7361 0.5909 -0.0003 0.0587 -0.0170 343 TYR A CB 2275 C CG . TYR A 284 ? 0.7703 0.7991 0.6624 -0.0018 0.0569 -0.0163 343 TYR A CG 2276 C CD1 . TYR A 284 ? 0.7409 0.7741 0.6402 -0.0037 0.0564 -0.0127 343 TYR A CD1 2277 C CD2 . TYR A 284 ? 0.6851 0.7109 0.5795 -0.0010 0.0558 -0.0191 343 TYR A CD2 2278 C CE1 . TYR A 284 ? 0.7060 0.7407 0.6145 -0.0050 0.0548 -0.0121 343 TYR A CE1 2279 C CE2 . TYR A 284 ? 0.6669 0.6942 0.5705 -0.0024 0.0541 -0.0184 343 TYR A CE2 2280 C CZ . TYR A 284 ? 0.6405 0.6723 0.5511 -0.0044 0.0537 -0.0149 343 TYR A CZ 2281 O OH . TYR A 284 ? 0.7834 0.8166 0.7029 -0.0057 0.0521 -0.0143 343 TYR A OH 2282 N N . ALA A 285 ? 0.7401 0.7633 0.6007 0.0047 0.0603 -0.0214 344 ALA A N 2283 C CA . ALA A 285 ? 0.7467 0.7687 0.5975 0.0058 0.0623 -0.0214 344 ALA A CA 2284 C C . ALA A 285 ? 0.7468 0.7725 0.5961 0.0060 0.0616 -0.0196 344 ALA A C 2285 O O . ALA A 285 ? 0.5706 0.5971 0.4143 0.0059 0.0630 -0.0177 344 ALA A O 2286 C CB . ALA A 285 ? 0.6440 0.6607 0.4866 0.0084 0.0632 -0.0256 344 ALA A CB 2287 N N . HIS A 286 ? 0.6549 0.6829 0.5095 0.0063 0.0594 -0.0202 345 HIS A N 2288 C CA . HIS A 286 ? 0.5806 0.6122 0.4344 0.0066 0.0585 -0.0186 345 HIS A CA 2289 C C . HIS A 286 ? 0.7284 0.7640 0.5927 0.0054 0.0562 -0.0171 345 HIS A C 2290 O O . HIS A 286 ? 0.7365 0.7712 0.6060 0.0058 0.0546 -0.0194 345 HIS A O 2291 C CB . HIS A 286 ? 0.6714 0.7006 0.5166 0.0093 0.0585 -0.0220 345 HIS A CB 2292 C CG . HIS A 286 ? 0.8075 0.8327 0.6419 0.0106 0.0610 -0.0235 345 HIS A CG 2293 N ND1 . HIS A 286 ? 0.8091 0.8352 0.6365 0.0106 0.0625 -0.0214 345 HIS A ND1 2294 C CD2 . HIS A 286 ? 0.7010 0.7210 0.5302 0.0121 0.0622 -0.0268 345 HIS A CD2 2295 C CE1 . HIS A 286 ? 0.9481 0.9700 0.7667 0.0119 0.0646 -0.0234 345 HIS A CE1 2296 N NE2 . HIS A 286 ? 0.9303 0.9484 0.7498 0.0128 0.0645 -0.0267 345 HIS A NE2 2297 N N . GLY A 287 ? 0.5486 0.5887 0.4161 0.0041 0.0560 -0.0133 346 GLY A N 2298 C CA . GLY A 287 ? 0.6792 0.7233 0.5565 0.0030 0.0540 -0.0116 346 GLY A CA 2299 C C . GLY A 287 ? 0.6757 0.7233 0.5603 0.0007 0.0543 -0.0072 346 GLY A C 2300 O O . GLY A 287 ? 0.6329 0.6812 0.5139 0.0002 0.0558 -0.0045 346 GLY A O 2301 N N . ARG A 288 ? 0.6183 0.6680 0.5130 -0.0005 0.0527 -0.0065 347 ARG A N 2302 C CA . ARG A 288 ? 0.7354 0.7886 0.6379 -0.0025 0.0528 -0.0024 347 ARG A CA 2303 C C . ARG A 288 ? 0.7571 0.8089 0.6657 -0.0039 0.0528 -0.0026 347 ARG A C 2304 O O . ARG A 288 ? 0.7090 0.7631 0.6233 -0.0055 0.0532 0.0005 347 ARG A O 2305 C CB . ARG A 288 ? 0.5844 0.6418 0.4944 -0.0029 0.0512 -0.0007 347 ARG A CB 2306 C CG . ARG A 288 ? 0.3949 0.4518 0.3110 -0.0027 0.0491 -0.0038 347 ARG A CG 2307 C CD . ARG A 288 ? 0.5947 0.6560 0.5198 -0.0035 0.0475 -0.0018 347 ARG A CD 2308 N NE . ARG A 288 ? 0.6323 0.6960 0.5654 -0.0055 0.0479 0.0019 347 ARG A NE 2309 C CZ . ARG A 288 ? 0.6487 0.7164 0.5861 -0.0062 0.0481 0.0058 347 ARG A CZ 2310 N NH1 . ARG A 288 ? 0.6542 0.7241 0.5888 -0.0052 0.0479 0.0066 347 ARG A NH1 2311 N NH2 . ARG A 288 ? 0.5323 0.6018 0.4767 -0.0078 0.0486 0.0088 347 ARG A NH2 2312 N N . ARG A 289 ? 0.5925 0.6407 0.4999 -0.0032 0.0523 -0.0064 348 ARG A N 2313 C CA . ARG A 289 ? 0.6075 0.6542 0.5206 -0.0043 0.0520 -0.0070 348 ARG A CA 2314 C C . ARG A 289 ? 0.6373 0.6837 0.5499 -0.0057 0.0539 -0.0046 348 ARG A C 2315 O O . ARG A 289 ? 0.6563 0.7042 0.5763 -0.0073 0.0536 -0.0027 348 ARG A O 2316 C CB . ARG A 289 ? 0.6065 0.6486 0.5160 -0.0028 0.0515 -0.0115 348 ARG A CB 2317 C CG . ARG A 289 ? 0.6831 0.7255 0.5959 -0.0016 0.0492 -0.0141 348 ARG A CG 2318 C CD . ARG A 289 ? 0.8413 0.8794 0.7534 -0.0004 0.0484 -0.0180 348 ARG A CD 2319 N NE . ARG A 289 ? 1.0079 1.0460 0.9226 0.0010 0.0461 -0.0208 348 ARG A NE 2320 C CZ . ARG A 289 ? 1.2547 1.2896 1.1705 0.0023 0.0447 -0.0242 348 ARG A CZ 2321 N NH1 . ARG A 289 ? 1.4564 1.4879 1.3709 0.0023 0.0454 -0.0252 348 ARG A NH1 2322 N NH2 . ARG A 289 ? 1.2540 1.2892 1.1722 0.0037 0.0425 -0.0266 348 ARG A NH2 2323 N N . LEU A 290 ? 0.6603 0.7046 0.5642 -0.0050 0.0557 -0.0047 349 LEU A N 2324 C CA . LEU A 290 ? 0.6073 0.6512 0.5102 -0.0061 0.0575 -0.0027 349 LEU A CA 2325 C C . LEU A 290 ? 0.6300 0.6782 0.5373 -0.0074 0.0578 0.0017 349 LEU A C 2326 O O . LEU A 290 ? 0.8392 0.8882 0.7508 -0.0087 0.0584 0.0036 349 LEU A O 2327 C CB . LEU A 290 ? 0.6754 0.7162 0.5679 -0.0050 0.0594 -0.0040 349 LEU A CB 2328 C CG . LEU A 290 ? 0.6713 0.7107 0.5624 -0.0060 0.0612 -0.0029 349 LEU A CG 2329 C CD1 . LEU A 290 ? 0.7219 0.7596 0.6186 -0.0070 0.0608 -0.0042 349 LEU A CD1 2330 C CD2 . LEU A 290 ? 0.7465 0.7826 0.6275 -0.0048 0.0630 -0.0045 349 LEU A CD2 2331 N N . LEU A 291 ? 0.5579 0.6088 0.4641 -0.0067 0.0573 0.0032 350 LEU A N 2332 C CA . LEU A 291 ? 0.5303 0.5853 0.4407 -0.0076 0.0575 0.0075 350 LEU A CA 2333 C C . LEU A 291 ? 0.7155 0.7728 0.6368 -0.0089 0.0563 0.0088 350 LEU A C 2334 O O . LEU A 291 ? 0.5579 0.6175 0.4839 -0.0099 0.0568 0.0120 350 LEU A O 2335 C CB . LEU A 291 ? 0.3536 0.4108 0.2605 -0.0064 0.0571 0.0087 350 LEU A CB 2336 C CG . LEU A 291 ? 0.6675 0.7234 0.5640 -0.0053 0.0586 0.0089 350 LEU A CG 2337 C CD1 . LEU A 291 ? 0.4778 0.5357 0.3707 -0.0040 0.0579 0.0095 350 LEU A CD1 2338 C CD2 . LEU A 291 ? 0.4632 0.5200 0.3591 -0.0059 0.0600 0.0123 350 LEU A CD2 2339 N N . ASP A 292 ? 0.6300 0.6867 0.5552 -0.0088 0.0546 0.0061 351 ASP A N 2340 C CA . ASP A 292 ? 0.6139 0.6723 0.5493 -0.0101 0.0534 0.0068 351 ASP A CA 2341 C C . ASP A 292 ? 0.5111 0.5678 0.4492 -0.0113 0.0541 0.0068 351 ASP A C 2342 O O . ASP A 292 ? 0.5551 0.6140 0.5001 -0.0126 0.0542 0.0093 351 ASP A O 2343 C CB . ASP A 292 ? 0.3992 0.4569 0.3375 -0.0095 0.0514 0.0036 351 ASP A CB 2344 C CG . ASP A 292 ? 0.5772 0.6373 0.5151 -0.0085 0.0504 0.0039 351 ASP A CG 2345 O OD1 . ASP A 292 ? 0.3992 0.4623 0.3370 -0.0087 0.0511 0.0072 351 ASP A OD1 2346 O OD2 . ASP A 292 ? 0.6379 0.6969 0.5756 -0.0075 0.0489 0.0007 351 ASP A OD2 2347 N N . LEU A 293 ? 0.4780 0.5308 0.4104 -0.0108 0.0547 0.0040 352 LEU A N 2348 C CA . LEU A 293 ? 0.5218 0.5727 0.4558 -0.0118 0.0554 0.0037 352 LEU A CA 2349 C C . LEU A 293 ? 0.5264 0.5789 0.4606 -0.0127 0.0571 0.0071 352 LEU A C 2350 O O . LEU A 293 ? 0.4458 0.4988 0.3853 -0.0140 0.0573 0.0082 352 LEU A O 2351 C CB . LEU A 293 ? 0.5409 0.5873 0.4677 -0.0108 0.0560 0.0002 352 LEU A CB 2352 C CG . LEU A 293 ? 0.5259 0.5697 0.4540 -0.0117 0.0566 -0.0007 352 LEU A CG 2353 C CD1 . LEU A 293 ? 0.6220 0.6621 0.5486 -0.0107 0.0556 -0.0046 352 LEU A CD1 2354 C CD2 . LEU A 293 ? 0.4771 0.5197 0.3992 -0.0118 0.0588 0.0002 352 LEU A CD2 2355 N N . VAL A 294 ? 0.4670 0.5203 0.3953 -0.0120 0.0582 0.0086 353 VAL A N 2356 C CA . VAL A 294 ? 0.5534 0.6084 0.4817 -0.0125 0.0596 0.0120 353 VAL A CA 2357 C C . VAL A 294 ? 0.5244 0.5833 0.4609 -0.0132 0.0590 0.0153 353 VAL A C 2358 O O . VAL A 294 ? 0.5417 0.6016 0.4822 -0.0141 0.0597 0.0174 353 VAL A O 2359 C CB . VAL A 294 ? 0.5014 0.5563 0.4212 -0.0113 0.0608 0.0129 353 VAL A CB 2360 C CG1 . VAL A 294 ? 0.3243 0.3812 0.2448 -0.0116 0.0619 0.0166 353 VAL A CG1 2361 C CG2 . VAL A 294 ? 0.4341 0.4848 0.3458 -0.0107 0.0617 0.0098 353 VAL A CG2 2362 N N . ASP A 295 ? 0.5214 0.5824 0.4604 -0.0128 0.0578 0.0157 354 ASP A N 2363 C CA . ASP A 295 ? 0.5251 0.5898 0.4720 -0.0134 0.0573 0.0188 354 ASP A CA 2364 C C . ASP A 295 ? 0.7154 0.7803 0.6708 -0.0148 0.0567 0.0187 354 ASP A C 2365 O O . ASP A 295 ? 0.5416 0.6086 0.5024 -0.0155 0.0573 0.0215 354 ASP A O 2366 C CB . ASP A 295 ? 0.5438 0.6105 0.4919 -0.0127 0.0559 0.0186 354 ASP A CB 2367 C CG . ASP A 295 ? 0.6740 0.7426 0.6172 -0.0116 0.0566 0.0211 354 ASP A CG 2368 O OD1 . ASP A 295 ? 0.4652 0.5340 0.4052 -0.0114 0.0580 0.0234 354 ASP A OD1 2369 O OD2 . ASP A 295 ? 0.5169 0.5868 0.4595 -0.0109 0.0556 0.0208 354 ASP A OD2 2370 N N . ILE A 296 ? 0.4662 0.5289 0.4228 -0.0150 0.0555 0.0153 355 ILE A N 2371 C CA . ILE A 296 ? 0.5051 0.5679 0.4696 -0.0163 0.0547 0.0149 355 ILE A CA 2372 C C . ILE A 296 ? 0.7034 0.7646 0.6677 -0.0171 0.0560 0.0153 355 ILE A C 2373 O O . ILE A 296 ? 0.3896 0.4519 0.3607 -0.0182 0.0559 0.0165 355 ILE A O 2374 C CB . ILE A 296 ? 0.4005 0.4611 0.3659 -0.0161 0.0529 0.0110 355 ILE A CB 2375 C CG1 . ILE A 296 ? 0.5500 0.6113 0.5245 -0.0173 0.0517 0.0110 355 ILE A CG1 2376 C CG2 . ILE A 296 ? 0.5368 0.5932 0.4947 -0.0154 0.0534 0.0079 355 ILE A CG2 2377 C CD1 . ILE A 296 ? 0.6121 0.6716 0.5882 -0.0169 0.0496 0.0074 355 ILE A CD1 2378 N N . HIS A 297 ? 0.5113 0.5701 0.4680 -0.0166 0.0572 0.0142 356 HIS A N 2379 C CA . HIS A 297 ? 0.4401 0.4975 0.3961 -0.0173 0.0585 0.0145 356 HIS A CA 2380 C C . HIS A 297 ? 0.5323 0.5923 0.4898 -0.0174 0.0598 0.0183 356 HIS A C 2381 O O . HIS A 297 ? 0.4242 0.4841 0.3843 -0.0182 0.0606 0.0192 356 HIS A O 2382 C CB . HIS A 297 ? 0.4342 0.4880 0.3817 -0.0166 0.0594 0.0121 356 HIS A CB 2383 C CG . HIS A 297 ? 0.5865 0.6371 0.5338 -0.0168 0.0585 0.0086 356 HIS A CG 2384 N ND1 . HIS A 297 ? 0.3933 0.4418 0.3412 -0.0175 0.0591 0.0077 356 HIS A ND1 2385 C CD2 . HIS A 297 ? 0.4154 0.4643 0.3619 -0.0161 0.0571 0.0058 356 HIS A CD2 2386 C CE1 . HIS A 297 ? 0.5120 0.5578 0.4595 -0.0173 0.0581 0.0046 356 HIS A CE1 2387 N NE2 . HIS A 297 ? 0.5548 0.6007 0.5014 -0.0163 0.0569 0.0034 356 HIS A NE2 2388 N N . ILE A 298 ? 0.4917 0.5538 0.4473 -0.0165 0.0600 0.0204 357 ILE A N 2389 C CA . ILE A 298 ? 0.6034 0.6680 0.5609 -0.0164 0.0611 0.0243 357 ILE A CA 2390 C C . ILE A 298 ? 0.6155 0.6825 0.5825 -0.0172 0.0606 0.0261 357 ILE A C 2391 O O . ILE A 298 ? 0.5012 0.5691 0.4713 -0.0175 0.0615 0.0282 357 ILE A O 2392 C CB . ILE A 298 ? 0.4930 0.5595 0.4465 -0.0151 0.0612 0.0262 357 ILE A CB 2393 C CG1 . ILE A 298 ? 0.4544 0.5188 0.3984 -0.0142 0.0622 0.0253 357 ILE A CG1 2394 C CG2 . ILE A 298 ? 0.4516 0.5213 0.4094 -0.0148 0.0619 0.0304 357 ILE A CG2 2395 C CD1 . ILE A 298 ? 0.5292 0.5950 0.4683 -0.0129 0.0624 0.0271 357 ILE A CD1 2396 N N . LEU A 299 ? 0.4219 0.4898 0.3934 -0.0176 0.0591 0.0251 358 LEU A N 2397 C CA . LEU A 299 ? 0.5134 0.5833 0.4941 -0.0185 0.0585 0.0265 358 LEU A CA 2398 C C . LEU A 299 ? 0.6078 0.6760 0.5917 -0.0196 0.0586 0.0252 358 LEU A C 2399 O O . LEU A 299 ? 0.3611 0.4305 0.3500 -0.0202 0.0592 0.0272 358 LEU A O 2400 C CB . LEU A 299 ? 0.3303 0.4012 0.3148 -0.0186 0.0567 0.0252 358 LEU A CB 2401 C CG . LEU A 299 ? 0.3542 0.4271 0.3486 -0.0196 0.0559 0.0263 358 LEU A CG 2402 C CD1 . LEU A 299 ? 0.4338 0.5100 0.4320 -0.0192 0.0570 0.0305 358 LEU A CD1 2403 C CD2 . LEU A 299 ? 0.3408 0.4140 0.3381 -0.0196 0.0539 0.0241 358 LEU A CD2 2404 N N . ASP A 300 ? 0.4008 0.4659 0.3812 -0.0199 0.0579 0.0217 359 ASP A N 2405 C CA . ASP A 300 ? 0.3151 0.3783 0.2978 -0.0209 0.0578 0.0202 359 ASP A CA 2406 C C . ASP A 300 ? 0.5194 0.5822 0.5001 -0.0210 0.0596 0.0216 359 ASP A C 2407 O O . ASP A 300 ? 0.4398 0.5024 0.4247 -0.0219 0.0598 0.0219 359 ASP A O 2408 C CB . ASP A 300 ? 0.3173 0.3771 0.2958 -0.0208 0.0569 0.0163 359 ASP A CB 2409 C CG . ASP A 300 ? 0.4776 0.5375 0.4597 -0.0207 0.0548 0.0145 359 ASP A CG 2410 O OD1 . ASP A 300 ? 0.3731 0.4355 0.3624 -0.0213 0.0541 0.0161 359 ASP A OD1 2411 O OD2 . ASP A 300 ? 0.4468 0.5042 0.4248 -0.0201 0.0540 0.0114 359 ASP A OD2 2412 N N . TYR A 301 ? 0.4063 0.4688 0.3806 -0.0201 0.0608 0.0223 360 TYR A N 2413 C CA . TYR A 301 ? 0.4170 0.4791 0.3892 -0.0200 0.0624 0.0236 360 TYR A CA 2414 C C . TYR A 301 ? 0.4429 0.5079 0.4205 -0.0199 0.0631 0.0272 360 TYR A C 2415 O O . TYR A 301 ? 0.4253 0.4902 0.4047 -0.0203 0.0640 0.0279 360 TYR A O 2416 C CB . TYR A 301 ? 0.5226 0.5837 0.4865 -0.0190 0.0634 0.0234 360 TYR A CB 2417 C CG . TYR A 301 ? 0.5948 0.6557 0.5566 -0.0188 0.0649 0.0247 360 TYR A CG 2418 C CD1 . TYR A 301 ? 0.5049 0.5635 0.4660 -0.0195 0.0655 0.0230 360 TYR A CD1 2419 C CD2 . TYR A 301 ? 0.5548 0.6176 0.5154 -0.0177 0.0658 0.0277 360 TYR A CD2 2420 C CE1 . TYR A 301 ? 0.3119 0.3704 0.2713 -0.0192 0.0668 0.0240 360 TYR A CE1 2421 C CE2 . TYR A 301 ? 0.5063 0.5688 0.4650 -0.0173 0.0672 0.0288 360 TYR A CE2 2422 C CZ . TYR A 301 ? 0.5547 0.6152 0.5130 -0.0181 0.0677 0.0269 360 TYR A CZ 2423 O OH . TYR A 301 ? 0.6350 0.6952 0.5916 -0.0176 0.0689 0.0278 360 TYR A OH 2424 N N . LEU A 302 ? 0.5457 0.6132 0.5256 -0.0193 0.0628 0.0293 361 LEU A N 2425 C CA . LEU A 302 ? 0.4091 0.4794 0.3943 -0.0190 0.0636 0.0329 361 LEU A CA 2426 C C . LEU A 302 ? 0.5248 0.5955 0.5178 -0.0201 0.0632 0.0329 361 LEU A C 2427 O O . LEU A 302 ? 0.4538 0.5257 0.4504 -0.0200 0.0643 0.0351 361 LEU A O 2428 C CB . LEU A 302 ? 0.4065 0.4793 0.3927 -0.0181 0.0632 0.0350 361 LEU A CB 2429 C CG . LEU A 302 ? 0.5483 0.6213 0.5274 -0.0167 0.0638 0.0363 361 LEU A CG 2430 C CD1 . LEU A 302 ? 0.3085 0.3838 0.2887 -0.0160 0.0630 0.0376 361 LEU A CD1 2431 C CD2 . LEU A 302 ? 0.3069 0.3808 0.2852 -0.0156 0.0653 0.0392 361 LEU A CD2 2432 N N . ILE A 303 ? 0.3724 0.4422 0.3679 -0.0212 0.0618 0.0304 362 ILE A N 2433 C CA . ILE A 303 ? 0.5054 0.5755 0.5082 -0.0223 0.0612 0.0302 362 ILE A CA 2434 C C . ILE A 303 ? 0.6246 0.6920 0.6263 -0.0232 0.0611 0.0277 362 ILE A C 2435 O O . ILE A 303 ? 0.5021 0.5695 0.5091 -0.0242 0.0607 0.0275 362 ILE A O 2436 C CB . ILE A 303 ? 0.4240 0.4950 0.4315 -0.0228 0.0594 0.0293 362 ILE A CB 2437 C CG1 . ILE A 303 ? 0.3785 0.4469 0.3816 -0.0230 0.0580 0.0255 362 ILE A CG1 2438 C CG2 . ILE A 303 ? 0.3282 0.4019 0.3368 -0.0219 0.0595 0.0317 362 ILE A CG2 2439 C CD1 . ILE A 303 ? 0.4951 0.5643 0.5013 -0.0230 0.0562 0.0244 362 ILE A CD1 2440 N N . GLY A 304 ? 0.3445 0.4096 0.3391 -0.0229 0.0615 0.0259 363 GLY A N 2441 C CA . GLY A 304 ? 0.3105 0.3729 0.3033 -0.0237 0.0615 0.0235 363 GLY A CA 2442 C C . GLY A 304 ? 0.4124 0.4730 0.4068 -0.0244 0.0597 0.0206 363 GLY A C 2443 O O . GLY A 304 ? 0.4360 0.4951 0.4318 -0.0252 0.0594 0.0191 363 GLY A O 2444 N N . ASN A 305 ? 0.4642 0.5251 0.4582 -0.0240 0.0584 0.0197 364 ASN A N 2445 C CA . ASN A 305 ? 0.3146 0.3738 0.3098 -0.0244 0.0565 0.0168 364 ASN A CA 2446 C C . ASN A 305 ? 0.5049 0.5605 0.4929 -0.0239 0.0565 0.0138 364 ASN A C 2447 O O . ASN A 305 ? 0.4970 0.5520 0.4790 -0.0229 0.0570 0.0132 364 ASN A O 2448 C CB . ASN A 305 ? 0.4590 0.5198 0.4568 -0.0239 0.0552 0.0168 364 ASN A CB 2449 C CG . ASN A 305 ? 0.3411 0.4000 0.3398 -0.0240 0.0531 0.0137 364 ASN A CG 2450 O OD1 . ASN A 305 ? 0.3601 0.4172 0.3607 -0.0247 0.0524 0.0122 364 ASN A OD1 2451 N ND2 . ASN A 305 ? 0.4767 0.5358 0.4738 -0.0231 0.0521 0.0126 364 ASN A ND2 2452 N N . GLN A 306 ? 0.4151 0.4684 0.4037 -0.0245 0.0560 0.0119 365 GLN A N 2453 C CA . GLN A 306 ? 0.4987 0.5485 0.4809 -0.0240 0.0561 0.0091 365 GLN A CA 2454 C C . GLN A 306 ? 0.4083 0.4560 0.3903 -0.0235 0.0541 0.0062 365 GLN A C 2455 O O . GLN A 306 ? 0.4104 0.4549 0.3866 -0.0227 0.0541 0.0038 365 GLN A O 2456 C CB . GLN A 306 ? 0.3186 0.3668 0.3008 -0.0249 0.0568 0.0087 365 GLN A CB 2457 C CG . GLN A 306 ? 0.3725 0.4224 0.3547 -0.0252 0.0587 0.0112 365 GLN A CG 2458 C CD . GLN A 306 ? 0.4795 0.5279 0.4620 -0.0260 0.0593 0.0106 365 GLN A CD 2459 O OE1 . GLN A 306 ? 0.3672 0.4152 0.3540 -0.0267 0.0583 0.0101 365 GLN A OE1 2460 N NE2 . GLN A 306 ? 0.3629 0.4105 0.3408 -0.0258 0.0610 0.0108 365 GLN A NE2 2461 N N . ASP A 307 ? 0.4747 0.5239 0.4628 -0.0238 0.0524 0.0064 366 ASP A N 2462 C CA . ASP A 307 ? 0.4792 0.5265 0.4685 -0.0234 0.0503 0.0037 366 ASP A CA 2463 C C . ASP A 307 ? 0.4481 0.4953 0.4349 -0.0221 0.0493 0.0023 366 ASP A C 2464 O O . ASP A 307 ? 0.7396 0.7868 0.7301 -0.0218 0.0473 0.0010 366 ASP A O 2465 C CB . ASP A 307 ? 0.5497 0.5984 0.5474 -0.0245 0.0488 0.0043 366 ASP A CB 2466 C CG . ASP A 307 ? 0.5427 0.5886 0.5414 -0.0241 0.0467 0.0014 366 ASP A CG 2467 O OD1 . ASP A 307 ? 0.6100 0.6525 0.6029 -0.0233 0.0468 -0.0008 366 ASP A OD1 2468 O OD2 . ASP A 307 ? 0.6637 0.7107 0.6690 -0.0246 0.0449 0.0014 366 ASP A OD2 2469 N N . ARG A 308 ? 0.3586 0.4057 0.3391 -0.0212 0.0507 0.0026 367 ARG A N 2470 C CA . ARG A 308 ? 0.3817 0.4287 0.3589 -0.0198 0.0500 0.0013 367 ARG A CA 2471 C C . ARG A 308 ? 0.5911 0.6339 0.5618 -0.0184 0.0496 -0.0023 367 ARG A C 2472 O O . ARG A 308 ? 0.5262 0.5674 0.4896 -0.0176 0.0510 -0.0028 367 ARG A O 2473 C CB . ARG A 308 ? 0.3928 0.4420 0.3665 -0.0195 0.0516 0.0035 367 ARG A CB 2474 C CG . ARG A 308 ? 0.4291 0.4789 0.4003 -0.0182 0.0508 0.0026 367 ARG A CG 2475 C CD . ARG A 308 ? 0.4424 0.4952 0.4215 -0.0186 0.0491 0.0034 367 ARG A CD 2476 N NE . ARG A 308 ? 0.5218 0.5782 0.5057 -0.0196 0.0500 0.0072 367 ARG A NE 2477 C CZ . ARG A 308 ? 0.4337 0.4931 0.4250 -0.0202 0.0490 0.0087 367 ARG A CZ 2478 N NH1 . ARG A 308 ? 0.4725 0.5318 0.4673 -0.0199 0.0470 0.0067 367 ARG A NH1 2479 N NH2 . ARG A 308 ? 0.4445 0.5070 0.4397 -0.0209 0.0502 0.0122 367 ARG A NH2 2480 N N . HIS A 309 ? 0.5896 0.6305 0.5630 -0.0181 0.0477 -0.0045 368 HIS A N 2481 C CA . HIS A 309 ? 0.5823 0.6189 0.5500 -0.0165 0.0472 -0.0079 368 HIS A CA 2482 C C . HIS A 309 ? 0.5337 0.5695 0.4991 -0.0147 0.0459 -0.0102 368 HIS A C 2483 O O . HIS A 309 ? 0.5435 0.5760 0.5020 -0.0130 0.0463 -0.0126 368 HIS A O 2484 C CB . HIS A 309 ? 0.4600 0.4943 0.4310 -0.0169 0.0459 -0.0093 368 HIS A CB 2485 C CG . HIS A 309 ? 0.5309 0.5674 0.5105 -0.0177 0.0437 -0.0088 368 HIS A CG 2486 N ND1 . HIS A 309 ? 0.5524 0.5881 0.5340 -0.0164 0.0414 -0.0110 368 HIS A ND1 2487 C CD2 . HIS A 309 ? 0.3788 0.4180 0.3656 -0.0194 0.0435 -0.0065 368 HIS A CD2 2488 C CE1 . HIS A 309 ? 0.4828 0.5208 0.4726 -0.0176 0.0398 -0.0100 368 HIS A CE1 2489 N NE2 . HIS A 309 ? 0.5811 0.6212 0.5741 -0.0194 0.0411 -0.0072 368 HIS A NE2 2490 N N . HIS A 310 ? 0.6641 0.7029 0.6352 -0.0150 0.0444 -0.0094 369 HIS A N 2491 C CA . HIS A 310 ? 0.4273 0.4658 0.3968 -0.0133 0.0430 -0.0116 369 HIS A CA 2492 C C . HIS A 310 ? 0.5057 0.5483 0.4776 -0.0137 0.0432 -0.0094 369 HIS A C 2493 O O . HIS A 310 ? 0.4650 0.5109 0.4419 -0.0153 0.0438 -0.0062 369 HIS A O 2494 C CB . HIS A 310 ? 0.6088 0.6460 0.5834 -0.0127 0.0403 -0.0139 369 HIS A CB 2495 C CG . HIS A 310 ? 0.8852 0.9175 0.8553 -0.0112 0.0398 -0.0170 369 HIS A CG 2496 N ND1 . HIS A 310 ? 1.0490 1.0792 1.0171 -0.0118 0.0409 -0.0167 369 HIS A ND1 2497 C CD2 . HIS A 310 ? 0.9016 0.9308 0.8688 -0.0089 0.0382 -0.0204 369 HIS A CD2 2498 C CE1 . HIS A 310 ? 0.9884 1.0142 0.9525 -0.0100 0.0402 -0.0197 369 HIS A CE1 2499 N NE2 . HIS A 310 ? 0.9137 0.9388 0.8772 -0.0081 0.0386 -0.0220 369 HIS A NE2 2500 N N . PHE A 311 ? 0.6902 0.7327 0.6585 -0.0120 0.0426 -0.0110 370 PHE A N 2501 C CA . PHE A 311 ? 0.5663 0.6126 0.5368 -0.0122 0.0425 -0.0092 370 PHE A CA 2502 C C . PHE A 311 ? 0.4883 0.5355 0.4640 -0.0115 0.0399 -0.0110 370 PHE A C 2503 O O . PHE A 311 ? 0.5258 0.5700 0.4998 -0.0099 0.0384 -0.0145 370 PHE A O 2504 C CB . PHE A 311 ? 0.4771 0.5230 0.4388 -0.0110 0.0441 -0.0092 370 PHE A CB 2505 C CG . PHE A 311 ? 0.5686 0.6143 0.5258 -0.0118 0.0466 -0.0071 370 PHE A CG 2506 C CD1 . PHE A 311 ? 0.5819 0.6310 0.5428 -0.0133 0.0477 -0.0032 370 PHE A CD1 2507 C CD2 . PHE A 311 ? 0.5302 0.5721 0.4793 -0.0108 0.0479 -0.0089 370 PHE A CD2 2508 C CE1 . PHE A 311 ? 0.6826 0.7313 0.6394 -0.0139 0.0499 -0.0014 370 PHE A CE1 2509 C CE2 . PHE A 311 ? 0.4416 0.4832 0.3868 -0.0115 0.0501 -0.0071 370 PHE A CE2 2510 C CZ . PHE A 311 ? 0.5723 0.6174 0.5213 -0.0130 0.0510 -0.0034 370 PHE A CZ 2511 N N . GLU A 312 ? 0.5424 0.5937 0.5244 -0.0124 0.0394 -0.0087 371 GLU A N 2512 C CA . GLU A 312 ? 0.5081 0.5608 0.4958 -0.0119 0.0370 -0.0102 371 GLU A CA 2513 C C . GLU A 312 ? 0.5801 0.6355 0.5658 -0.0112 0.0373 -0.0094 371 GLU A C 2514 O O . GLU A 312 ? 0.6342 0.6923 0.6196 -0.0121 0.0390 -0.0061 371 GLU A O 2515 C CB . GLU A 312 ? 0.6203 0.6756 0.6188 -0.0138 0.0360 -0.0084 371 GLU A CB 2516 C CG . GLU A 312 ? 0.6923 0.7485 0.6975 -0.0133 0.0332 -0.0103 371 GLU A CG 2517 C CD . GLU A 312 ? 0.7926 0.8451 0.7985 -0.0125 0.0312 -0.0137 371 GLU A CD 2518 O OE1 . GLU A 312 ? 0.7792 0.8322 0.7911 -0.0121 0.0288 -0.0154 371 GLU A OE1 2519 O OE2 . GLU A 312 ? 0.9363 0.9855 0.9369 -0.0121 0.0321 -0.0146 371 GLU A OE2 2520 N N . SER A 313 ? 0.5746 0.6291 0.5588 -0.0094 0.0356 -0.0124 372 SER A N 2521 C CA . SER A 313 ? 0.6682 0.7250 0.6496 -0.0085 0.0358 -0.0120 372 SER A CA 2522 C C . SER A 313 ? 0.7039 0.7615 0.6895 -0.0074 0.0332 -0.0147 372 SER A C 2523 O O . SER A 313 ? 0.5963 0.6511 0.5827 -0.0063 0.0314 -0.0181 372 SER A O 2524 C CB . SER A 313 ? 0.6006 0.6548 0.5704 -0.0069 0.0374 -0.0133 372 SER A CB 2525 O OG . SER A 313 ? 0.7524 0.8020 0.7175 -0.0051 0.0366 -0.0173 372 SER A OG 2526 N N . PHE A 314 ? 0.7292 0.7905 0.7174 -0.0075 0.0330 -0.0131 373 PHE A N 2527 C CA . PHE A 314 ? 0.5832 0.6454 0.5746 -0.0063 0.0307 -0.0157 373 PHE A CA 2528 C C . PHE A 314 ? 0.7225 0.7814 0.7040 -0.0035 0.0304 -0.0196 373 PHE A C 2529 O O . PHE A 314 ? 0.7380 0.7956 0.7105 -0.0029 0.0324 -0.0191 373 PHE A O 2530 C CB . PHE A 314 ? 0.4619 0.5289 0.4580 -0.0071 0.0308 -0.0129 373 PHE A CB 2531 C CG . PHE A 314 ? 0.5887 0.6590 0.5950 -0.0095 0.0310 -0.0093 373 PHE A CG 2532 C CD1 . PHE A 314 ? 0.4672 0.5378 0.4828 -0.0103 0.0290 -0.0103 373 PHE A CD1 2533 C CD2 . PHE A 314 ? 0.4752 0.5484 0.4819 -0.0108 0.0331 -0.0048 373 PHE A CD2 2534 C CE1 . PHE A 314 ? 0.4192 0.4927 0.4440 -0.0125 0.0294 -0.0070 373 PHE A CE1 2535 C CE2 . PHE A 314 ? 0.3865 0.4626 0.4024 -0.0128 0.0335 -0.0015 373 PHE A CE2 2536 C CZ . PHE A 314 ? 0.4200 0.4962 0.4450 -0.0137 0.0316 -0.0026 373 PHE A CZ 2537 N N . ASN A 315 ? 0.8596 0.9170 0.8430 -0.0019 0.0280 -0.0235 374 ASN A N 2538 C CA . ASN A 315 ? 0.8694 0.9236 0.8440 0.0010 0.0276 -0.0274 374 ASN A CA 2539 C C . ASN A 315 ? 0.7992 0.8556 0.7775 0.0022 0.0254 -0.0295 374 ASN A C 2540 O O . ASN A 315 ? 0.6564 0.7107 0.6364 0.0040 0.0231 -0.0333 374 ASN A O 2541 C CB . ASN A 315 ? 0.8660 0.9151 0.8373 0.0026 0.0269 -0.0309 374 ASN A CB 2542 C CG . ASN A 315 ? 0.8170 0.8622 0.7773 0.0056 0.0273 -0.0345 374 ASN A CG 2543 O OD1 . ASN A 315 ? 0.8495 0.8956 0.8031 0.0063 0.0288 -0.0339 374 ASN A OD1 2544 N ND2 . ASN A 315 ? 0.6442 0.6850 0.6026 0.0077 0.0260 -0.0383 374 ASN A ND2 2545 N N . VAL A 316 ? 0.7590 0.8194 0.7384 0.0014 0.0260 -0.0269 375 VAL A N 2546 C CA . VAL A 316 ? 0.9953 1.0587 0.9803 0.0020 0.0240 -0.0281 375 VAL A CA 2547 C C . VAL A 316 ? 0.9828 1.0480 0.9611 0.0031 0.0249 -0.0277 375 VAL A C 2548 O O . VAL A 316 ? 1.0640 1.1300 1.0425 0.0048 0.0233 -0.0303 375 VAL A O 2549 C CB . VAL A 316 ? 0.7534 0.8211 0.7509 -0.0006 0.0233 -0.0248 375 VAL A CB 2550 C CG1 . VAL A 316 ? 0.6487 0.7196 0.6464 -0.0027 0.0258 -0.0195 375 VAL A CG1 2551 C CG2 . VAL A 316 ? 0.8264 0.8970 0.8308 0.0000 0.0209 -0.0264 375 VAL A CG2 2552 N N . PHE A 317 ? 0.8301 0.8958 0.8020 0.0024 0.0275 -0.0245 376 PHE A N 2553 C CA . PHE A 317 ? 0.8129 0.8801 0.7774 0.0035 0.0286 -0.0239 376 PHE A CA 2554 C C . PHE A 317 ? 1.0999 1.1626 1.0522 0.0062 0.0292 -0.0276 376 PHE A C 2555 O O . PHE A 317 ? 1.2409 1.3008 1.1863 0.0062 0.0311 -0.0270 376 PHE A O 2556 C CB . PHE A 317 ? 0.8262 0.8959 0.7892 0.0016 0.0310 -0.0187 376 PHE A CB 2557 C CG . PHE A 317 ? 1.0058 1.0801 0.9800 -0.0007 0.0308 -0.0147 376 PHE A CG 2558 C CD1 . PHE A 317 ? 1.0096 1.0840 0.9894 -0.0028 0.0316 -0.0120 376 PHE A CD1 2559 C CD2 . PHE A 317 ? 0.9916 1.0698 0.9704 -0.0008 0.0299 -0.0137 376 PHE A CD2 2560 C CE1 . PHE A 317 ? 0.9577 1.0362 0.9477 -0.0048 0.0316 -0.0084 376 PHE A CE1 2561 C CE2 . PHE A 317 ? 0.9758 1.0581 0.9650 -0.0028 0.0298 -0.0100 376 PHE A CE2 2562 C CZ . PHE A 317 ? 1.0302 1.1125 1.0249 -0.0048 0.0307 -0.0074 376 PHE A CZ 2563 N N . ASN A 318 ? 1.2929 1.3549 1.2430 0.0086 0.0275 -0.0315 377 ASN A N 2564 C CA . ASN A 318 ? 1.4199 1.4775 1.3587 0.0115 0.0279 -0.0355 377 ASN A CA 2565 C C . ASN A 318 ? 1.3596 1.4168 1.2878 0.0116 0.0307 -0.0334 377 ASN A C 2566 O O . ASN A 318 ? 1.2719 1.3330 1.2010 0.0102 0.0316 -0.0296 377 ASN A O 2567 C CB . ASN A 318 ? 1.5617 1.6193 1.4999 0.0140 0.0257 -0.0396 377 ASN A CB 2568 C CG . ASN A 318 ? 1.6808 1.7380 1.6286 0.0143 0.0229 -0.0423 377 ASN A CG 2569 O OD1 . ASN A 318 ? 1.7055 1.7604 1.6568 0.0137 0.0225 -0.0427 377 ASN A OD1 2570 N ND2 . ASN A 318 ? 1.6895 1.7489 1.6414 0.0154 0.0207 -0.0444 377 ASN A ND2 2571 N N . ASP A 319 ? 1.4036 1.4561 1.3219 0.0134 0.0320 -0.0357 378 ASP A N 2572 C CA . ASP A 319 ? 1.4302 1.4816 1.3375 0.0138 0.0346 -0.0343 378 ASP A CA 2573 C C . ASP A 319 ? 1.3400 1.3933 1.2491 0.0110 0.0366 -0.0293 378 ASP A C 2574 O O . ASP A 319 ? 1.4673 1.5175 1.3724 0.0108 0.0382 -0.0291 378 ASP A O 2575 C CB . ASP A 319 ? 1.4588 1.5127 1.3612 0.0151 0.0345 -0.0344 378 ASP A CB 2576 C CG . ASP A 319 ? 1.4757 1.5269 1.3730 0.0184 0.0331 -0.0398 378 ASP A CG 2577 O OD1 . ASP A 319 ? 1.3112 1.3577 1.2052 0.0201 0.0331 -0.0433 378 ASP A OD1 2578 O OD2 . ASP A 319 ? 1.6681 1.7218 1.5646 0.0194 0.0322 -0.0405 378 ASP A OD2 2579 N N . LEU A 320 ? 1.1016 1.1598 1.0164 0.0092 0.0365 -0.0253 379 LEU A N 2580 C CA . LEU A 320 ? 1.0733 1.1337 0.9906 0.0067 0.0382 -0.0203 379 LEU A CA 2581 C C . LEU A 320 ? 0.9284 0.9864 0.8483 0.0054 0.0390 -0.0198 379 LEU A C 2582 O O . LEU A 320 ? 0.8175 0.8736 0.7424 0.0055 0.0376 -0.0223 379 LEU A O 2583 C CB . LEU A 320 ? 0.8793 0.9450 0.8067 0.0049 0.0373 -0.0168 379 LEU A CB 2584 C CG . LEU A 320 ? 0.9154 0.9845 0.8414 0.0058 0.0366 -0.0163 379 LEU A CG 2585 C CD1 . LEU A 320 ? 0.8497 0.9238 0.7856 0.0037 0.0363 -0.0119 379 LEU A CD1 2586 C CD2 . LEU A 320 ? 0.9781 1.0462 0.8919 0.0070 0.0385 -0.0156 379 LEU A CD2 2587 N N . PRO A 321 ? 0.8047 0.8629 0.7217 0.0040 0.0412 -0.0164 380 PRO A N 2588 C CA . PRO A 321 ? 0.8241 0.8800 0.7432 0.0028 0.0421 -0.0158 380 PRO A CA 2589 C C . PRO A 321 ? 0.6495 0.7082 0.5805 0.0005 0.0411 -0.0133 380 PRO A C 2590 O O . PRO A 321 ? 0.6351 0.6980 0.5715 -0.0007 0.0410 -0.0100 380 PRO A O 2591 C CB . PRO A 321 ? 0.6232 0.6787 0.5348 0.0023 0.0446 -0.0131 380 PRO A CB 2592 C CG . PRO A 321 ? 0.5758 0.6353 0.4864 0.0023 0.0448 -0.0103 380 PRO A CG 2593 C CD . PRO A 321 ? 0.6435 0.7035 0.5541 0.0040 0.0429 -0.0133 380 PRO A CD 2594 N N . SER A 322 ? 0.7358 0.7922 0.6708 -0.0001 0.0406 -0.0148 381 SER A N 2595 C CA . SER A 322 ? 0.6748 0.7334 0.6206 -0.0022 0.0398 -0.0127 381 SER A CA 2596 C C . SER A 322 ? 0.8139 0.8731 0.7598 -0.0040 0.0419 -0.0089 381 SER A C 2597 O O . SER A 322 ? 0.7341 0.7913 0.6717 -0.0035 0.0438 -0.0086 381 SER A O 2598 C CB . SER A 322 ? 0.6021 0.6578 0.5521 -0.0019 0.0381 -0.0160 381 SER A CB 2599 O OG . SER A 322 ? 0.7590 0.8100 0.7015 -0.0008 0.0392 -0.0182 381 SER A OG 2600 N N . TYR A 323 ? 0.7605 0.8224 0.7157 -0.0060 0.0416 -0.0061 382 TYR A N 2601 C CA . TYR A 323 ? 0.7505 0.8130 0.7066 -0.0076 0.0435 -0.0027 382 TYR A CA 2602 C C . TYR A 323 ? 0.5702 0.6319 0.5339 -0.0090 0.0428 -0.0028 382 TYR A C 2603 O O . TYR A 323 ? 0.6613 0.7233 0.6317 -0.0092 0.0409 -0.0044 382 TYR A O 2604 C CB . TYR A 323 ? 0.6538 0.7208 0.6133 -0.0085 0.0442 0.0017 382 TYR A CB 2605 C CG . TYR A 323 ? 0.6293 0.6997 0.5988 -0.0092 0.0426 0.0026 382 TYR A CG 2606 C CD1 . TYR A 323 ? 0.5310 0.6028 0.5100 -0.0110 0.0423 0.0045 382 TYR A CD1 2607 C CD2 . TYR A 323 ? 0.7101 0.7822 0.6796 -0.0081 0.0413 0.0016 382 TYR A CD2 2608 C CE1 . TYR A 323 ? 0.7707 0.8456 0.7591 -0.0117 0.0409 0.0053 382 TYR A CE1 2609 C CE2 . TYR A 323 ? 0.7633 0.8386 0.7423 -0.0088 0.0398 0.0024 382 TYR A CE2 2610 C CZ . TYR A 323 ? 0.7543 0.8309 0.7428 -0.0106 0.0397 0.0043 382 TYR A CZ 2611 O OH . TYR A 323 ? 0.6540 0.7337 0.6522 -0.0113 0.0383 0.0050 382 TYR A OH 2612 N N . ALA A 324 ? 0.5951 0.6558 0.5576 -0.0101 0.0445 -0.0011 383 ALA A N 2613 C CA . ALA A 324 ? 0.6695 0.7294 0.6384 -0.0114 0.0441 -0.0010 383 ALA A CA 2614 C C . ALA A 324 ? 0.5158 0.5797 0.4946 -0.0131 0.0437 0.0022 383 ALA A C 2615 O O . ALA A 324 ? 0.5540 0.6205 0.5334 -0.0137 0.0451 0.0058 383 ALA A O 2616 C CB . ALA A 324 ? 0.5442 0.6018 0.5083 -0.0119 0.0460 -0.0004 383 ALA A CB 2617 N N . ILE A 325 ? 0.6066 0.6707 0.5932 -0.0137 0.0419 0.0010 384 ILE A N 2618 C CA . ILE A 325 ? 0.6360 0.7035 0.6326 -0.0153 0.0416 0.0038 384 ILE A CA 2619 C C . ILE A 325 ? 0.6181 0.6853 0.6169 -0.0168 0.0430 0.0060 384 ILE A C 2620 O O . ILE A 325 ? 0.5894 0.6536 0.5872 -0.0170 0.0427 0.0041 384 ILE A O 2621 C CB . ILE A 325 ? 0.6814 0.7492 0.6858 -0.0155 0.0391 0.0017 384 ILE A CB 2622 C CG1 . ILE A 325 ? 0.4819 0.5500 0.4842 -0.0138 0.0376 -0.0008 384 ILE A CG1 2623 C CG2 . ILE A 325 ? 0.5573 0.6286 0.5721 -0.0171 0.0390 0.0047 384 ILE A CG2 2624 C CD1 . ILE A 325 ? 0.4757 0.5432 0.4843 -0.0136 0.0349 -0.0038 384 ILE A CD1 2625 N N . HIS A 326 ? 0.5479 0.6179 0.5494 -0.0176 0.0445 0.0100 385 HIS A N 2626 C CA . HIS A 326 ? 0.4708 0.5408 0.4744 -0.0188 0.0459 0.0122 385 HIS A CA 2627 C C . HIS A 326 ? 0.4676 0.5381 0.4805 -0.0201 0.0448 0.0120 385 HIS A C 2628 O O . HIS A 326 ? 0.5268 0.6003 0.5472 -0.0209 0.0447 0.0144 385 HIS A O 2629 C CB . HIS A 326 ? 0.4097 0.4826 0.4134 -0.0190 0.0479 0.0164 385 HIS A CB 2630 C CG . HIS A 326 ? 0.5993 0.6715 0.5935 -0.0178 0.0491 0.0167 385 HIS A CG 2631 N ND1 . HIS A 326 ? 0.6155 0.6901 0.6084 -0.0174 0.0506 0.0203 385 HIS A ND1 2632 C CD2 . HIS A 326 ? 0.6042 0.6736 0.5899 -0.0167 0.0491 0.0140 385 HIS A CD2 2633 C CE1 . HIS A 326 ? 0.4628 0.5362 0.4468 -0.0163 0.0513 0.0198 385 HIS A CE1 2634 N NE2 . HIS A 326 ? 0.5281 0.5983 0.5075 -0.0158 0.0505 0.0159 385 HIS A NE2 2635 N N . LEU A 327 ? 0.6267 0.6941 0.6389 -0.0203 0.0438 0.0092 386 LEU A N 2636 C CA . LEU A 327 ? 0.5340 0.6013 0.5542 -0.0213 0.0423 0.0085 386 LEU A CA 2637 C C . LEU A 327 ? 0.5218 0.5869 0.5412 -0.0222 0.0432 0.0086 386 LEU A C 2638 O O . LEU A 327 ? 0.4871 0.5507 0.4998 -0.0219 0.0448 0.0088 386 LEU A O 2639 C CB . LEU A 327 ? 0.5522 0.6177 0.5728 -0.0204 0.0398 0.0046 386 LEU A CB 2640 C CG . LEU A 327 ? 0.7285 0.7941 0.7577 -0.0211 0.0376 0.0033 386 LEU A CG 2641 C CD1 . LEU A 327 ? 0.8907 0.9603 0.9290 -0.0224 0.0378 0.0064 386 LEU A CD1 2642 C CD2 . LEU A 327 ? 0.6618 0.7259 0.6901 -0.0197 0.0352 -0.0005 386 LEU A CD2 2643 N N . ASP A 328 ? 0.5138 0.5789 0.5402 -0.0233 0.0421 0.0083 387 ASP A N 2644 C CA . ASP A 328 ? 0.5221 0.5850 0.5482 -0.0241 0.0425 0.0079 387 ASP A CA 2645 C C . ASP A 328 ? 0.4305 0.4941 0.4541 -0.0247 0.0451 0.0107 387 ASP A C 2646 O O . ASP A 328 ? 0.4488 0.5101 0.4653 -0.0242 0.0462 0.0099 387 ASP A O 2647 C CB . ASP A 328 ? 0.5125 0.5713 0.5322 -0.0231 0.0416 0.0043 387 ASP A CB 2648 C CG . ASP A 328 ? 0.6846 0.7423 0.7072 -0.0224 0.0388 0.0013 387 ASP A CG 2649 O OD1 . ASP A 328 ? 0.8190 0.8788 0.8496 -0.0231 0.0375 0.0019 387 ASP A OD1 2650 O OD2 . ASP A 328 ? 0.9093 0.9638 0.9261 -0.0210 0.0380 -0.0017 387 ASP A OD2 2651 N N . HIS A 329 ? 0.3805 0.4470 0.4098 -0.0255 0.0461 0.0140 388 HIS A N 2652 C CA . HIS A 329 ? 0.4506 0.5179 0.4780 -0.0258 0.0485 0.0167 388 HIS A CA 2653 C C . HIS A 329 ? 0.5612 0.6285 0.5938 -0.0271 0.0490 0.0178 388 HIS A C 2654 O O . HIS A 329 ? 0.3707 0.4393 0.4039 -0.0273 0.0509 0.0205 388 HIS A O 2655 C CB . HIS A 329 ? 0.3136 0.3842 0.3422 -0.0254 0.0498 0.0199 388 HIS A CB 2656 C CG . HIS A 329 ? 0.4479 0.5187 0.4712 -0.0242 0.0494 0.0191 388 HIS A CG 2657 N ND1 . HIS A 329 ? 0.3926 0.4658 0.4194 -0.0238 0.0486 0.0199 388 HIS A ND1 2658 C CD2 . HIS A 329 ? 0.3933 0.4621 0.4078 -0.0231 0.0499 0.0176 388 HIS A CD2 2659 C CE1 . HIS A 329 ? 0.5563 0.6290 0.5765 -0.0226 0.0485 0.0188 388 HIS A CE1 2660 N NE2 . HIS A 329 ? 0.4730 0.5430 0.4856 -0.0222 0.0493 0.0175 388 HIS A NE2 2661 N N . GLY A 330 ? 0.4584 0.5243 0.4945 -0.0277 0.0472 0.0157 389 GLY A N 2662 C CA . GLY A 330 ? 0.3138 0.3795 0.3548 -0.0289 0.0474 0.0165 389 GLY A CA 2663 C C . GLY A 330 ? 0.4295 0.4937 0.4660 -0.0291 0.0492 0.0170 389 GLY A C 2664 O O . GLY A 330 ? 0.3966 0.4616 0.4367 -0.0299 0.0502 0.0187 389 GLY A O 2665 N N . ARG A 331 ? 0.3142 0.3762 0.3428 -0.0283 0.0496 0.0154 390 ARG A N 2666 C CA . ARG A 331 ? 0.4057 0.4661 0.4296 -0.0284 0.0512 0.0156 390 ARG A CA 2667 C C . ARG A 331 ? 0.4869 0.5487 0.5068 -0.0278 0.0534 0.0178 390 ARG A C 2668 O O . ARG A 331 ? 0.5132 0.5733 0.5271 -0.0274 0.0545 0.0172 390 ARG A O 2669 C CB . ARG A 331 ? 0.3157 0.3725 0.3337 -0.0280 0.0503 0.0123 390 ARG A CB 2670 C CG . ARG A 331 ? 0.3164 0.3712 0.3373 -0.0288 0.0488 0.0106 390 ARG A CG 2671 C CD . ARG A 331 ? 0.4763 0.5277 0.4923 -0.0280 0.0474 0.0073 390 ARG A CD 2672 N NE . ARG A 331 ? 0.5297 0.5791 0.5481 -0.0286 0.0460 0.0058 390 ARG A NE 2673 C CZ . ARG A 331 ? 0.6140 0.6602 0.6298 -0.0279 0.0444 0.0030 390 ARG A CZ 2674 N NH1 . ARG A 331 ? 0.5870 0.6316 0.5975 -0.0265 0.0440 0.0011 390 ARG A NH1 2675 N NH2 . ARG A 331 ? 0.6674 0.7120 0.6856 -0.0284 0.0431 0.0020 390 ARG A NH2 2676 N N . ALA A 332 ? 0.4285 0.4932 0.4518 -0.0275 0.0540 0.0204 391 ALA A N 2677 C CA . ALA A 332 ? 0.3105 0.3766 0.3306 -0.0267 0.0560 0.0229 391 ALA A CA 2678 C C . ALA A 332 ? 0.4415 0.5092 0.4658 -0.0271 0.0575 0.0256 391 ALA A C 2679 O O . ALA A 332 ? 0.3518 0.4200 0.3823 -0.0280 0.0571 0.0259 391 ALA A O 2680 C CB . ALA A 332 ? 0.3104 0.3788 0.3310 -0.0259 0.0557 0.0242 391 ALA A CB 2681 N N . PHE A 333 ? 0.3078 0.3761 0.3284 -0.0262 0.0594 0.0275 392 PHE A N 2682 C CA . PHE A 333 ? 0.5510 0.6207 0.5748 -0.0261 0.0611 0.0302 392 PHE A CA 2683 C C . PHE A 333 ? 0.4141 0.4824 0.4397 -0.0271 0.0613 0.0292 392 PHE A C 2684 O O . PHE A 333 ? 0.5416 0.6111 0.5726 -0.0274 0.0620 0.0309 392 PHE A O 2685 C CB . PHE A 333 ? 0.3909 0.4635 0.4217 -0.0260 0.0612 0.0329 392 PHE A CB 2686 C CG . PHE A 333 ? 0.4282 0.5026 0.4574 -0.0249 0.0613 0.0345 392 PHE A CG 2687 C CD1 . PHE A 333 ? 0.5048 0.5802 0.5310 -0.0236 0.0630 0.0371 392 PHE A CD1 2688 C CD2 . PHE A 333 ? 0.4871 0.5621 0.5178 -0.0251 0.0597 0.0335 392 PHE A CD2 2689 C CE1 . PHE A 333 ? 0.3824 0.4594 0.4067 -0.0225 0.0631 0.0387 392 PHE A CE1 2690 C CE2 . PHE A 333 ? 0.4549 0.5317 0.4839 -0.0241 0.0598 0.0350 392 PHE A CE2 2691 C CZ . PHE A 333 ? 0.3543 0.4320 0.3800 -0.0228 0.0615 0.0377 392 PHE A CZ 2692 N N . GLY A 334 ? 0.5021 0.5677 0.5231 -0.0275 0.0607 0.0265 393 GLY A N 2693 C CA . GLY A 334 ? 0.3069 0.3710 0.3289 -0.0283 0.0608 0.0253 393 GLY A CA 2694 C C . GLY A 334 ? 0.5526 0.6166 0.5721 -0.0278 0.0628 0.0265 393 GLY A C 2695 O O . GLY A 334 ? 0.4490 0.5126 0.4709 -0.0283 0.0633 0.0266 393 GLY A O 2696 N N . ARG A 335 ? 0.3056 0.3699 0.3201 -0.0267 0.0639 0.0273 394 ARG A N 2697 C CA . ARG A 335 ? 0.3677 0.4318 0.3793 -0.0260 0.0656 0.0282 394 ARG A CA 2698 C C . ARG A 335 ? 0.4646 0.5307 0.4752 -0.0245 0.0669 0.0310 394 ARG A C 2699 O O . ARG A 335 ? 0.5642 0.6306 0.5718 -0.0239 0.0665 0.0312 394 ARG A O 2700 C CB . ARG A 335 ? 0.4930 0.5545 0.4981 -0.0261 0.0657 0.0257 394 ARG A CB 2701 C CG . ARG A 335 ? 0.5972 0.6565 0.6027 -0.0274 0.0645 0.0230 394 ARG A CG 2702 C CD . ARG A 335 ? 0.5240 0.5827 0.5309 -0.0278 0.0653 0.0230 394 ARG A CD 2703 N NE . ARG A 335 ? 0.5884 0.6465 0.5906 -0.0271 0.0669 0.0229 394 ARG A NE 2704 C CZ . ARG A 335 ? 0.4502 0.5060 0.4473 -0.0273 0.0669 0.0206 394 ARG A CZ 2705 N NH1 . ARG A 335 ? 0.6507 0.7045 0.6464 -0.0281 0.0655 0.0183 394 ARG A NH1 2706 N NH2 . ARG A 335 ? 0.6555 0.7109 0.6489 -0.0267 0.0683 0.0207 394 ARG A NH2 2707 N N . SER A 336 ? 0.3310 0.3981 0.3437 -0.0237 0.0684 0.0332 395 SER A N 2708 C CA . SER A 336 ? 0.4832 0.5520 0.4949 -0.0220 0.0696 0.0360 395 SER A CA 2709 C C . SER A 336 ? 0.4753 0.5431 0.4811 -0.0209 0.0708 0.0357 395 SER A C 2710 O O . SER A 336 ? 0.4867 0.5555 0.4902 -0.0194 0.0716 0.0377 395 SER A O 2711 C CB . SER A 336 ? 0.5538 0.6245 0.5717 -0.0213 0.0707 0.0388 395 SER A CB 2712 O OG . SER A 336 ? 0.3963 0.4662 0.4151 -0.0213 0.0717 0.0384 395 SER A OG 2713 N N . ASP A 337 ? 0.5191 0.5849 0.5226 -0.0218 0.0708 0.0333 396 ASP A N 2714 C CA . ASP A 337 ? 0.4933 0.5580 0.4919 -0.0209 0.0718 0.0327 396 ASP A CA 2715 C C . ASP A 337 ? 0.5987 0.6613 0.5913 -0.0215 0.0712 0.0300 396 ASP A C 2716 O O . ASP A 337 ? 0.5769 0.6383 0.5656 -0.0212 0.0720 0.0290 396 ASP A O 2717 C CB . ASP A 337 ? 0.4877 0.5518 0.4883 -0.0211 0.0727 0.0322 396 ASP A CB 2718 C CG . ASP A 337 ? 0.6643 0.7268 0.6662 -0.0230 0.0716 0.0296 396 ASP A CG 2719 O OD1 . ASP A 337 ? 0.8140 0.8762 0.8170 -0.0240 0.0702 0.0287 396 ASP A OD1 2720 O OD2 . ASP A 337 ? 0.8327 0.8942 0.8342 -0.0233 0.0722 0.0284 396 ASP A OD2 2721 N N . PHE A 338 ? 0.4488 0.5109 0.4409 -0.0223 0.0699 0.0289 397 PHE A N 2722 C CA . PHE A 338 ? 0.3872 0.4472 0.3738 -0.0228 0.0694 0.0262 397 PHE A CA 2723 C C . PHE A 338 ? 0.4179 0.4782 0.4022 -0.0225 0.0686 0.0263 397 PHE A C 2724 O O . PHE A 338 ? 0.5131 0.5743 0.5009 -0.0228 0.0675 0.0267 397 PHE A O 2725 C CB . PHE A 338 ? 0.4543 0.5122 0.4421 -0.0243 0.0684 0.0236 397 PHE A CB 2726 C CG . PHE A 338 ? 0.4914 0.5469 0.4741 -0.0247 0.0677 0.0208 397 PHE A CG 2727 C CD1 . PHE A 338 ? 0.6522 0.7062 0.6291 -0.0243 0.0687 0.0197 397 PHE A CD1 2728 C CD2 . PHE A 338 ? 0.3250 0.3796 0.3089 -0.0254 0.0662 0.0193 397 PHE A CD2 2729 C CE1 . PHE A 338 ? 0.3216 0.3731 0.2938 -0.0245 0.0682 0.0172 397 PHE A CE1 2730 C CE2 . PHE A 338 ? 0.4065 0.4587 0.3856 -0.0255 0.0656 0.0168 397 PHE A CE2 2731 C CZ . PHE A 338 ? 0.4443 0.4948 0.4175 -0.0250 0.0667 0.0158 397 PHE A CZ 2732 N N . ASP A 339 ? 0.5229 0.5822 0.5010 -0.0217 0.0691 0.0258 398 ASP A N 2733 C CA . ASP A 339 ? 0.4138 0.4731 0.3884 -0.0213 0.0684 0.0254 398 ASP A CA 2734 C C . ASP A 339 ? 0.5347 0.5910 0.5043 -0.0219 0.0680 0.0222 398 ASP A C 2735 O O . ASP A 339 ? 0.7202 0.7749 0.6857 -0.0218 0.0689 0.0210 398 ASP A O 2736 C CB . ASP A 339 ? 0.3073 0.3678 0.2783 -0.0198 0.0693 0.0276 398 ASP A CB 2737 C CG . ASP A 339 ? 0.5570 0.6200 0.5324 -0.0189 0.0700 0.0309 398 ASP A CG 2738 O OD1 . ASP A 339 ? 0.5849 0.6493 0.5664 -0.0194 0.0695 0.0319 398 ASP A OD1 2739 O OD2 . ASP A 339 ? 0.4812 0.5448 0.4540 -0.0176 0.0710 0.0326 398 ASP A OD2 2740 N N . ASP A 340 ? 0.4976 0.5532 0.4678 -0.0224 0.0667 0.0206 399 ASP A N 2741 C CA . ASP A 340 ? 0.3741 0.4266 0.3396 -0.0227 0.0663 0.0175 399 ASP A CA 2742 C C . ASP A 340 ? 0.4651 0.5171 0.4245 -0.0217 0.0665 0.0172 399 ASP A C 2743 O O . ASP A 340 ? 0.3869 0.4394 0.3464 -0.0214 0.0655 0.0170 399 ASP A O 2744 C CB . ASP A 340 ? 0.5029 0.5546 0.4721 -0.0235 0.0647 0.0158 399 ASP A CB 2745 C CG . ASP A 340 ? 0.5869 0.6352 0.5514 -0.0235 0.0643 0.0126 399 ASP A CG 2746 O OD1 . ASP A 340 ? 0.7456 0.7920 0.7051 -0.0233 0.0655 0.0116 399 ASP A OD1 2747 O OD2 . ASP A 340 ? 0.5409 0.5882 0.5068 -0.0237 0.0628 0.0110 399 ASP A OD2 2748 N N . ASP A 341 ? 0.5249 0.5759 0.4790 -0.0212 0.0678 0.0170 400 ASP A N 2749 C CA . ASP A 341 ? 0.6018 0.6523 0.5496 -0.0202 0.0682 0.0169 400 ASP A CA 2750 C C . ASP A 341 ? 0.5283 0.5760 0.4722 -0.0201 0.0676 0.0139 400 ASP A C 2751 O O . ASP A 341 ? 0.6052 0.6525 0.5441 -0.0193 0.0677 0.0136 400 ASP A O 2752 C CB . ASP A 341 ? 0.5326 0.5824 0.4759 -0.0197 0.0698 0.0172 400 ASP A CB 2753 C CG . ASP A 341 ? 0.7749 0.8272 0.7213 -0.0192 0.0704 0.0202 400 ASP A CG 2754 O OD1 . ASP A 341 ? 0.7167 0.7715 0.6664 -0.0187 0.0699 0.0226 400 ASP A OD1 2755 O OD2 . ASP A 341 ? 0.9107 0.9624 0.8562 -0.0192 0.0714 0.0201 400 ASP A OD2 2756 N N . ASP A 342 ? 0.3184 0.3643 0.2644 -0.0209 0.0669 0.0118 401 ASP A N 2757 C CA . ASP A 342 ? 0.4353 0.4785 0.3781 -0.0206 0.0662 0.0089 401 ASP A CA 2758 C C . ASP A 342 ? 0.4682 0.5127 0.4124 -0.0201 0.0648 0.0092 401 ASP A C 2759 O O . ASP A 342 ? 0.4907 0.5334 0.4307 -0.0193 0.0644 0.0072 401 ASP A O 2760 C CB . ASP A 342 ? 0.4009 0.4419 0.3463 -0.0215 0.0656 0.0069 401 ASP A CB 2761 C CG . ASP A 342 ? 0.5737 0.6120 0.5151 -0.0216 0.0670 0.0054 401 ASP A CG 2762 O OD1 . ASP A 342 ? 0.5847 0.6233 0.5226 -0.0213 0.0684 0.0062 401 ASP A OD1 2763 O OD2 . ASP A 342 ? 0.5215 0.5574 0.4632 -0.0220 0.0665 0.0033 401 ASP A OD2 2764 N N . ILE A 343 ? 0.3804 0.4280 0.3309 -0.0205 0.0641 0.0114 402 ILE A N 2765 C CA . ILE A 343 ? 0.5289 0.5781 0.4817 -0.0201 0.0627 0.0118 402 ILE A CA 2766 C C . ILE A 343 ? 0.5706 0.6207 0.5182 -0.0190 0.0631 0.0127 402 ILE A C 2767 O O . ILE A 343 ? 0.4620 0.5118 0.4079 -0.0183 0.0622 0.0116 402 ILE A O 2768 C CB . ILE A 343 ? 0.5674 0.6197 0.5283 -0.0208 0.0620 0.0142 402 ILE A CB 2769 C CG1 . ILE A 343 ? 0.6680 0.7195 0.6339 -0.0220 0.0614 0.0133 402 ILE A CG1 2770 C CG2 . ILE A 343 ? 0.4687 0.5229 0.4325 -0.0205 0.0606 0.0146 402 ILE A CG2 2771 C CD1 . ILE A 343 ? 0.3155 0.3698 0.2890 -0.0227 0.0613 0.0158 402 ILE A CD1 2772 N N . ILE A 344 ? 0.4129 0.4640 0.3580 -0.0187 0.0645 0.0148 403 ILE A N 2773 C CA . ILE A 344 ? 0.6180 0.6701 0.5580 -0.0175 0.0650 0.0160 403 ILE A CA 2774 C C . ILE A 344 ? 0.5509 0.6000 0.4826 -0.0168 0.0660 0.0138 403 ILE A C 2775 O O . ILE A 344 ? 0.6370 0.6864 0.5633 -0.0159 0.0666 0.0146 403 ILE A O 2776 C CB . ILE A 344 ? 0.4248 0.4796 0.3663 -0.0172 0.0660 0.0196 403 ILE A CB 2777 C CG1 . ILE A 344 ? 0.6034 0.6601 0.5420 -0.0161 0.0659 0.0216 403 ILE A CG1 2778 C CG2 . ILE A 344 ? 0.4358 0.4890 0.3739 -0.0173 0.0674 0.0194 403 ILE A CG2 2779 C CD1 . ILE A 344 ? 0.4247 0.4829 0.3666 -0.0160 0.0644 0.0216 403 ILE A CD1 2780 N N . LEU A 345 ? 0.5433 0.5893 0.4737 -0.0173 0.0661 0.0110 404 LEU A N 2781 C CA . LEU A 345 ? 0.6575 0.7002 0.5801 -0.0166 0.0671 0.0086 404 LEU A CA 2782 C C . LEU A 345 ? 0.6942 0.7361 0.6115 -0.0154 0.0667 0.0074 404 LEU A C 2783 O O . LEU A 345 ? 0.7110 0.7514 0.6212 -0.0146 0.0679 0.0069 404 LEU A O 2784 C CB . LEU A 345 ? 0.5200 0.5595 0.4430 -0.0171 0.0671 0.0058 404 LEU A CB 2785 C CG . LEU A 345 ? 0.6355 0.6741 0.5589 -0.0180 0.0683 0.0060 404 LEU A CG 2786 C CD1 . LEU A 345 ? 0.4406 0.4759 0.3639 -0.0183 0.0682 0.0032 404 LEU A CD1 2787 C CD2 . LEU A 345 ? 0.4256 0.4636 0.3430 -0.0174 0.0700 0.0066 404 LEU A CD2 2788 N N . PRO A 346 ? 0.6278 0.6706 0.5481 -0.0151 0.0651 0.0069 405 PRO A N 2789 C CA . PRO A 346 ? 0.5240 0.5662 0.4389 -0.0138 0.0648 0.0058 405 PRO A CA 2790 C C . PRO A 346 ? 0.6738 0.7181 0.5848 -0.0132 0.0655 0.0083 405 PRO A C 2791 O O . PRO A 346 ? 0.6780 0.7208 0.5817 -0.0121 0.0662 0.0072 405 PRO A O 2792 C CB . PRO A 346 ? 0.5103 0.5541 0.4310 -0.0139 0.0628 0.0055 405 PRO A CB 2793 C CG . PRO A 346 ? 0.4992 0.5421 0.4257 -0.0150 0.0622 0.0046 405 PRO A CG 2794 C CD . PRO A 346 ? 0.4836 0.5272 0.4114 -0.0159 0.0635 0.0065 405 PRO A CD 2795 N N . LEU A 347 ? 0.5624 0.6101 0.4780 -0.0137 0.0655 0.0116 406 LEU A N 2796 C CA . LEU A 347 ? 0.4879 0.5374 0.3998 -0.0129 0.0662 0.0143 406 LEU A CA 2797 C C . LEU A 347 ? 0.5471 0.5945 0.4522 -0.0125 0.0679 0.0138 406 LEU A C 2798 O O . LEU A 347 ? 0.5831 0.6302 0.4816 -0.0115 0.0684 0.0141 406 LEU A O 2799 C CB . LEU A 347 ? 0.3744 0.4275 0.2929 -0.0134 0.0660 0.0179 406 LEU A CB 2800 C CG . LEU A 347 ? 0.4112 0.4663 0.3264 -0.0124 0.0667 0.0210 406 LEU A CG 2801 C CD1 . LEU A 347 ? 0.3848 0.4408 0.2957 -0.0113 0.0661 0.0212 406 LEU A CD1 2802 C CD2 . LEU A 347 ? 0.5735 0.6318 0.4957 -0.0127 0.0666 0.0245 406 LEU A CD2 2803 N N . ARG A 348 ? 0.7535 0.7994 0.6602 -0.0134 0.0686 0.0130 407 ARG A N 2804 C CA . ARG A 348 ? 0.7157 0.7597 0.6171 -0.0132 0.0702 0.0126 407 ARG A CA 2805 C C . ARG A 348 ? 0.6730 0.7132 0.5672 -0.0126 0.0710 0.0094 407 ARG A C 2806 O O . ARG A 348 ? 0.5406 0.5795 0.4284 -0.0120 0.0722 0.0092 407 ARG A O 2807 C CB . ARG A 348 ? 0.4824 0.5260 0.3883 -0.0144 0.0708 0.0127 407 ARG A CB 2808 C CG . ARG A 348 ? 0.8000 0.8470 0.7122 -0.0147 0.0704 0.0159 407 ARG A CG 2809 C CD . ARG A 348 ? 0.9943 1.0410 0.9119 -0.0159 0.0706 0.0155 407 ARG A CD 2810 N NE . ARG A 348 ? 1.2303 1.2745 1.1443 -0.0161 0.0720 0.0140 407 ARG A NE 2811 C CZ . ARG A 348 ? 1.2516 1.2947 1.1687 -0.0170 0.0723 0.0129 407 ARG A CZ 2812 N NH1 . ARG A 348 ? 1.2097 1.2538 1.1334 -0.0179 0.0713 0.0130 407 ARG A NH1 2813 N NH2 . ARG A 348 ? 1.1156 1.1565 1.0293 -0.0172 0.0735 0.0115 407 ARG A NH2 2814 N N . GLN A 349 ? 0.6919 0.7303 0.5871 -0.0127 0.0702 0.0068 408 GLN A N 2815 C CA . GLN A 349 ? 0.5699 0.6044 0.4585 -0.0119 0.0709 0.0035 408 GLN A CA 2816 C C . GLN A 349 ? 0.7147 0.7491 0.5976 -0.0104 0.0706 0.0030 408 GLN A C 2817 O O . GLN A 349 ? 0.7197 0.7517 0.5950 -0.0095 0.0719 0.0017 408 GLN A O 2818 C CB . GLN A 349 ? 0.5070 0.5392 0.3989 -0.0122 0.0702 0.0009 408 GLN A CB 2819 C CG . GLN A 349 ? 0.5377 0.5690 0.4332 -0.0134 0.0708 0.0007 408 GLN A CG 2820 C CD . GLN A 349 ? 0.6582 0.6871 0.5565 -0.0136 0.0700 -0.0018 408 GLN A CD 2821 O OE1 . GLN A 349 ? 0.7041 0.7315 0.6008 -0.0126 0.0691 -0.0038 408 GLN A OE1 2822 N NE2 . GLN A 349 ? 0.5484 0.5770 0.4508 -0.0147 0.0702 -0.0018 408 GLN A NE2 2823 N N . CYS A 350 ? 0.6694 0.7063 0.5560 -0.0103 0.0690 0.0039 409 CYS A N 2824 C CA . CYS A 350 ? 0.6995 0.7365 0.5812 -0.0089 0.0685 0.0032 409 CYS A CA 2825 C C . CYS A 350 ? 0.6736 0.7129 0.5515 -0.0084 0.0690 0.0060 409 CYS A C 2826 O O . CYS A 350 ? 0.6027 0.6409 0.4731 -0.0072 0.0696 0.0052 409 CYS A O 2827 C CB . CYS A 350 ? 0.3773 0.4161 0.2647 -0.0089 0.0665 0.0029 409 CYS A CB 2828 S SG . CYS A 350 ? 0.5372 0.5735 0.4297 -0.0093 0.0655 -0.0002 409 CYS A SG 2829 N N . CYS A 351 ? 0.5317 0.5742 0.4147 -0.0092 0.0688 0.0093 410 CYS A N 2830 C CA . CYS A 351 ? 0.5178 0.5627 0.3981 -0.0086 0.0692 0.0125 410 CYS A CA 2831 C C . CYS A 351 ? 0.6195 0.6659 0.4967 -0.0075 0.0683 0.0130 410 CYS A C 2832 O O . CYS A 351 ? 0.5742 0.6208 0.4449 -0.0065 0.0689 0.0141 410 CYS A O 2833 C CB . CYS A 351 ? 0.4305 0.4733 0.3037 -0.0082 0.0709 0.0122 410 CYS A CB 2834 S SG . CYS A 351 ? 0.6706 0.7136 0.5480 -0.0094 0.0719 0.0136 410 CYS A SG 2835 N N . ILE A 352 ? 0.6984 0.7458 0.5802 -0.0076 0.0668 0.0121 411 ILE A N 2836 C CA . ILE A 352 ? 0.6728 0.7226 0.5538 -0.0067 0.0658 0.0132 411 ILE A CA 2837 C C . ILE A 352 ? 0.5898 0.6433 0.4802 -0.0075 0.0645 0.0157 411 ILE A C 2838 O O . ILE A 352 ? 0.5827 0.6362 0.4801 -0.0086 0.0641 0.0154 411 ILE A O 2839 C CB . ILE A 352 ? 0.6834 0.7310 0.5606 -0.0057 0.0651 0.0096 411 ILE A CB 2840 C CG1 . ILE A 352 ? 0.6557 0.7031 0.5403 -0.0064 0.0638 0.0076 411 ILE A CG1 2841 C CG2 . ILE A 352 ? 0.6459 0.6894 0.5141 -0.0049 0.0666 0.0068 411 ILE A CG2 2842 C CD1 . ILE A 352 ? 0.4895 0.5351 0.3713 -0.0053 0.0628 0.0043 411 ILE A CD1 2843 N N . LEU A 353 ? 0.5617 0.6182 0.4524 -0.0069 0.0639 0.0183 412 LEU A N 2844 C CA . LEU A 353 ? 0.3734 0.4336 0.2728 -0.0075 0.0630 0.0213 412 LEU A CA 2845 C C . LEU A 353 ? 0.5586 0.6216 0.4578 -0.0066 0.0620 0.0229 412 LEU A C 2846 O O . LEU A 353 ? 0.7424 0.8058 0.6350 -0.0055 0.0625 0.0243 412 LEU A O 2847 C CB . LEU A 353 ? 0.3233 0.3848 0.2248 -0.0078 0.0640 0.0247 412 LEU A CB 2848 C CG . LEU A 353 ? 0.5745 0.6397 0.4846 -0.0082 0.0634 0.0282 412 LEU A CG 2849 C CD1 . LEU A 353 ? 0.4577 0.5230 0.3763 -0.0095 0.0626 0.0268 412 LEU A CD1 2850 C CD2 . LEU A 353 ? 0.5106 0.5766 0.4209 -0.0080 0.0645 0.0314 412 LEU A CD2 2851 N N . ARG A 354 ? 0.5240 0.5887 0.4303 -0.0071 0.0607 0.0226 413 ARG A N 2852 C CA . ARG A 354 ? 0.6287 0.6962 0.5361 -0.0064 0.0597 0.0240 413 ARG A CA 2853 C C . ARG A 354 ? 0.6758 0.7463 0.5839 -0.0059 0.0602 0.0287 413 ARG A C 2854 O O . ARG A 354 ? 0.5727 0.6445 0.4866 -0.0066 0.0607 0.0312 413 ARG A O 2855 C CB . ARG A 354 ? 0.6160 0.6850 0.5326 -0.0072 0.0582 0.0231 413 ARG A CB 2856 C CG . ARG A 354 ? 0.5656 0.6374 0.4838 -0.0065 0.0570 0.0240 413 ARG A CG 2857 C CD . ARG A 354 ? 0.4096 0.4822 0.3361 -0.0073 0.0554 0.0221 413 ARG A CD 2858 N NE . ARG A 354 ? 0.5560 0.6257 0.4787 -0.0068 0.0546 0.0175 413 ARG A NE 2859 C CZ . ARG A 354 ? 0.5124 0.5801 0.4393 -0.0075 0.0538 0.0147 413 ARG A CZ 2860 N NH1 . ARG A 354 ? 0.4516 0.5202 0.3866 -0.0089 0.0538 0.0159 413 ARG A NH1 2861 N NH2 . ARG A 354 ? 0.5178 0.5827 0.4407 -0.0066 0.0531 0.0105 413 ARG A NH2 2862 N N . PRO A 355 ? 0.6227 0.6942 0.5245 -0.0046 0.0602 0.0300 414 PRO A N 2863 C CA . PRO A 355 ? 0.4949 0.5688 0.3955 -0.0038 0.0607 0.0344 414 PRO A CA 2864 C C . PRO A 355 ? 0.5937 0.6711 0.5041 -0.0042 0.0603 0.0379 414 PRO A C 2865 O O . PRO A 355 ? 0.4929 0.5714 0.4047 -0.0039 0.0611 0.0413 414 PRO A O 2866 C CB . PRO A 355 ? 0.6240 0.6985 0.5172 -0.0024 0.0603 0.0343 414 PRO A CB 2867 C CG . PRO A 355 ? 0.6713 0.7424 0.5585 -0.0023 0.0602 0.0296 414 PRO A CG 2868 C CD . PRO A 355 ? 0.7442 0.8144 0.6390 -0.0037 0.0597 0.0270 414 PRO A CD 2869 N N . SER A 356 ? 0.3483 0.4272 0.2652 -0.0048 0.0591 0.0369 415 SER A N 2870 C CA . SER A 356 ? 0.6259 0.7078 0.5525 -0.0053 0.0588 0.0400 415 SER A CA 2871 C C . SER A 356 ? 0.6989 0.7802 0.6317 -0.0065 0.0595 0.0404 415 SER A C 2872 O O . SER A 356 ? 0.5030 0.5862 0.4408 -0.0064 0.0601 0.0440 415 SER A O 2873 C CB . SER A 356 ? 0.3173 0.4008 0.2497 -0.0058 0.0574 0.0383 415 SER A CB 2874 O OG . SER A 356 ? 0.6589 0.7399 0.5926 -0.0068 0.0567 0.0340 415 SER A OG 2875 N N . THR A 357 ? 0.4555 0.5339 0.3877 -0.0074 0.0595 0.0368 416 THR A N 2876 C CA . THR A 357 ? 0.6286 0.7061 0.5659 -0.0086 0.0601 0.0368 416 THR A CA 2877 C C . THR A 357 ? 0.7040 0.7813 0.6380 -0.0079 0.0616 0.0395 416 THR A C 2878 O O . THR A 357 ? 0.5736 0.6519 0.5132 -0.0082 0.0622 0.0418 416 THR A O 2879 C CB . THR A 357 ? 0.5369 0.6110 0.4726 -0.0095 0.0599 0.0324 416 THR A CB 2880 O OG1 . THR A 357 ? 0.5148 0.5889 0.4533 -0.0098 0.0584 0.0297 416 THR A OG1 2881 C CG2 . THR A 357 ? 0.3797 0.4530 0.3208 -0.0107 0.0605 0.0325 416 THR A CG2 2882 N N . PHE A 358 ? 0.5829 0.6587 0.5076 -0.0069 0.0621 0.0391 417 PHE A N 2883 C CA . PHE A 358 ? 0.5558 0.6313 0.4768 -0.0061 0.0633 0.0415 417 PHE A CA 2884 C C . PHE A 358 ? 0.6340 0.7126 0.5585 -0.0051 0.0635 0.0462 417 PHE A C 2885 O O . PHE A 358 ? 0.5471 0.6261 0.4745 -0.0049 0.0643 0.0483 417 PHE A O 2886 C CB . PHE A 358 ? 0.6843 0.7579 0.5946 -0.0051 0.0637 0.0403 417 PHE A CB 2887 C CG . PHE A 358 ? 0.6244 0.6979 0.5305 -0.0040 0.0647 0.0430 417 PHE A CG 2888 C CD1 . PHE A 358 ? 0.4713 0.5428 0.3768 -0.0045 0.0656 0.0422 417 PHE A CD1 2889 C CD2 . PHE A 358 ? 0.6006 0.6760 0.5032 -0.0025 0.0646 0.0463 417 PHE A CD2 2890 C CE1 . PHE A 358 ? 0.5155 0.5870 0.4174 -0.0034 0.0664 0.0446 417 PHE A CE1 2891 C CE2 . PHE A 358 ? 0.6025 0.6778 0.5013 -0.0013 0.0654 0.0488 417 PHE A CE2 2892 C CZ . PHE A 358 ? 0.7020 0.7753 0.6004 -0.0017 0.0663 0.0479 417 PHE A CZ 2893 N N . GLN A 359 ? 0.4675 0.5483 0.3918 -0.0043 0.0628 0.0477 418 GLN A N 2894 C CA . GLN A 359 ? 0.7065 0.7903 0.6343 -0.0032 0.0629 0.0523 418 GLN A CA 2895 C C . GLN A 359 ? 0.6928 0.7781 0.6310 -0.0040 0.0631 0.0538 418 GLN A C 2896 O O . GLN A 359 ? 0.4466 0.5329 0.3875 -0.0031 0.0640 0.0572 418 GLN A O 2897 C CB . GLN A 359 ? 0.7714 0.8572 0.6974 -0.0023 0.0620 0.0533 418 GLN A CB 2898 C CG . GLN A 359 ? 0.8018 0.8868 0.7172 -0.0010 0.0621 0.0534 418 GLN A CG 2899 C CD . GLN A 359 ? 0.8049 0.8923 0.7190 0.0001 0.0612 0.0552 418 GLN A CD 2900 O OE1 . GLN A 359 ? 0.7779 0.8661 0.6950 -0.0006 0.0603 0.0533 418 GLN A OE1 2901 N NE2 . GLN A 359 ? 0.6552 0.7438 0.5649 0.0018 0.0616 0.0588 418 GLN A NE2 2902 N N . THR A 360 ? 0.5314 0.6167 0.4754 -0.0055 0.0624 0.0513 419 THR A N 2903 C CA . THR A 360 ? 0.4426 0.5291 0.3966 -0.0065 0.0625 0.0522 419 THR A CA 2904 C C . THR A 360 ? 0.5561 0.6410 0.5109 -0.0067 0.0636 0.0525 419 THR A C 2905 O O . THR A 360 ? 0.5624 0.6487 0.5224 -0.0062 0.0644 0.0555 419 THR A O 2906 C CB . THR A 360 ? 0.5574 0.6433 0.5162 -0.0081 0.0614 0.0487 419 THR A CB 2907 O OG1 . THR A 360 ? 0.3617 0.4491 0.3200 -0.0078 0.0603 0.0483 419 THR A OG1 2908 C CG2 . THR A 360 ? 0.4320 0.5191 0.4010 -0.0091 0.0615 0.0498 419 THR A CG2 2909 N N . LEU A 361 ? 0.4156 0.4977 0.3653 -0.0073 0.0638 0.0493 420 LEU A N 2910 C CA . LEU A 361 ? 0.4599 0.5403 0.4097 -0.0076 0.0648 0.0491 420 LEU A CA 2911 C C . LEU A 361 ? 0.5038 0.5848 0.4500 -0.0058 0.0658 0.0525 420 LEU A C 2912 O O . LEU A 361 ? 0.5373 0.6186 0.4871 -0.0055 0.0666 0.0544 420 LEU A O 2913 C CB . LEU A 361 ? 0.5313 0.6085 0.4759 -0.0085 0.0647 0.0450 420 LEU A CB 2914 C CG . LEU A 361 ? 0.5196 0.5957 0.4679 -0.0101 0.0638 0.0414 420 LEU A CG 2915 C CD1 . LEU A 361 ? 0.4220 0.4947 0.3643 -0.0107 0.0640 0.0377 420 LEU A CD1 2916 C CD2 . LEU A 361 ? 0.4215 0.4985 0.3790 -0.0112 0.0639 0.0421 420 LEU A CD2 2917 N N . MSE A 362 ? 0.3722 0.4532 0.3110 -0.0045 0.0656 0.0533 421 MSE A N 2918 C CA . MSE A 362 ? 0.3619 0.4434 0.2966 -0.0026 0.0663 0.0566 421 MSE A CA 2919 C C . MSE A 362 ? 0.3058 0.3900 0.2465 -0.0014 0.0666 0.0609 421 MSE A C 2920 O O . MSE A 362 ? 0.4114 0.4958 0.3527 -0.0001 0.0675 0.0634 421 MSE A O 2921 C CB . MSE A 362 ? 0.4425 0.5236 0.3681 -0.0015 0.0660 0.0566 421 MSE A CB 2922 C CG . MSE A 362 ? 0.4206 0.5025 0.3420 0.0007 0.0664 0.0603 421 MSE A CG 2923 SE SE . MSE A 362 ? 1.2734 1.3532 1.1928 0.0012 0.0676 0.0604 421 MSE A SE 2924 C CE . MSE A 362 ? 0.3404 0.4167 0.2522 -0.0004 0.0676 0.0550 421 MSE A CE 2925 N N . ASN A 363 ? 0.4240 0.5104 0.3692 -0.0017 0.0660 0.0618 422 ASN A N 2926 C CA . ASN A 363 ? 0.4255 0.5145 0.3767 -0.0005 0.0663 0.0659 422 ASN A CA 2927 C C . ASN A 363 ? 0.4613 0.5503 0.4201 -0.0009 0.0673 0.0667 422 ASN A C 2928 O O . ASN A 363 ? 0.5805 0.6703 0.5411 0.0008 0.0682 0.0702 422 ASN A O 2929 C CB . ASN A 363 ? 0.4642 0.5553 0.4196 -0.0011 0.0654 0.0661 422 ASN A CB 2930 C CG . ASN A 363 ? 0.5914 0.6851 0.5543 -0.0002 0.0660 0.0702 422 ASN A CG 2931 O OD1 . ASN A 363 ? 0.4294 0.5244 0.3901 0.0019 0.0663 0.0739 422 ASN A OD1 2932 N ND2 . ASN A 363 ? 0.7115 0.8058 0.6831 -0.0016 0.0660 0.0695 422 ASN A ND2 2933 N N . PHE A 364 ? 0.5224 0.6103 0.4853 -0.0030 0.0670 0.0635 423 PHE A N 2934 C CA . PHE A 364 ? 0.6791 0.7668 0.6488 -0.0035 0.0679 0.0638 423 PHE A CA 2935 C C . PHE A 364 ? 0.6130 0.6988 0.5787 -0.0027 0.0688 0.0638 423 PHE A C 2936 O O . PHE A 364 ? 0.6803 0.7665 0.6496 -0.0016 0.0698 0.0661 423 PHE A O 2937 C CB . PHE A 364 ? 0.6082 0.6950 0.5825 -0.0059 0.0672 0.0602 423 PHE A CB 2938 C CG . PHE A 364 ? 0.4051 0.4940 0.3858 -0.0067 0.0664 0.0605 423 PHE A CG 2939 C CD1 . PHE A 364 ? 0.5298 0.6210 0.5169 -0.0058 0.0670 0.0642 423 PHE A CD1 2940 C CD2 . PHE A 364 ? 0.3964 0.4847 0.3768 -0.0082 0.0651 0.0571 423 PHE A CD2 2941 C CE1 . PHE A 364 ? 0.3885 0.4817 0.3818 -0.0066 0.0663 0.0644 423 PHE A CE1 2942 C CE2 . PHE A 364 ? 0.3041 0.3943 0.2906 -0.0089 0.0642 0.0572 423 PHE A CE2 2943 C CZ . PHE A 364 ? 0.4546 0.5473 0.4476 -0.0082 0.0648 0.0609 423 PHE A CZ 2944 N N . TYR A 365 ? 0.5019 0.5857 0.4604 -0.0030 0.0685 0.0612 424 TYR A N 2945 C CA . TYR A 365 ? 0.5900 0.6719 0.5446 -0.0024 0.0693 0.0607 424 TYR A CA 2946 C C . TYR A 365 ? 0.6605 0.7433 0.6125 0.0002 0.0700 0.0646 424 TYR A C 2947 O O . TYR A 365 ? 0.4854 0.5675 0.4384 0.0012 0.0708 0.0655 424 TYR A O 2948 C CB . TYR A 365 ? 0.6330 0.7126 0.5801 -0.0033 0.0689 0.0572 424 TYR A CB 2949 C CG . TYR A 365 ? 0.7251 0.8027 0.6683 -0.0027 0.0697 0.0566 424 TYR A CG 2950 C CD1 . TYR A 365 ? 0.6630 0.7399 0.6106 -0.0033 0.0704 0.0558 424 TYR A CD1 2951 C CD2 . TYR A 365 ? 0.5875 0.6641 0.5225 -0.0016 0.0698 0.0566 424 TYR A CD2 2952 C CE1 . TYR A 365 ? 0.5149 0.5901 0.4591 -0.0027 0.0711 0.0551 424 TYR A CE1 2953 C CE2 . TYR A 365 ? 0.7314 0.8063 0.6632 -0.0011 0.0705 0.0560 424 TYR A CE2 2954 C CZ . TYR A 365 ? 0.7803 0.8545 0.7168 -0.0016 0.0711 0.0551 424 TYR A CZ 2955 O OH . TYR A 365 ? 0.7510 0.8236 0.6844 -0.0011 0.0718 0.0543 424 TYR A OH 2956 N N . SER A 366 ? 0.5949 0.6789 0.5434 0.0015 0.0695 0.0668 425 SER A N 2957 C CA . SER A 366 ? 0.6917 0.7764 0.6368 0.0043 0.0699 0.0705 425 SER A CA 2958 C C . SER A 366 ? 0.7749 0.8612 0.7270 0.0058 0.0707 0.0742 425 SER A C 2959 O O . SER A 366 ? 0.7610 0.8475 0.7114 0.0082 0.0713 0.0772 425 SER A O 2960 C CB . SER A 366 ? 0.5619 0.6476 0.5014 0.0052 0.0691 0.0719 425 SER A CB 2961 O OG . SER A 366 ? 0.7863 0.8739 0.7303 0.0043 0.0685 0.0722 425 SER A OG 2962 N N . THR A 367 ? 0.7377 0.8252 0.6976 0.0044 0.0708 0.0740 426 THR A N 2963 C CA . THR A 367 ? 0.7433 0.8321 0.7104 0.0056 0.0718 0.0770 426 THR A CA 2964 C C . THR A 367 ? 0.7316 0.8195 0.7048 0.0037 0.0723 0.0746 426 THR A C 2965 O O . THR A 367 ? 0.5778 0.6664 0.5560 0.0017 0.0719 0.0730 426 THR A O 2966 C CB . THR A 367 ? 0.7558 0.8471 0.7274 0.0060 0.0717 0.0798 426 THR A CB 2967 O OG1 . THR A 367 ? 0.6245 0.7166 0.5900 0.0077 0.0711 0.0820 426 THR A OG1 2968 C CG2 . THR A 367 ? 0.7381 0.8306 0.7170 0.0075 0.0729 0.0832 426 THR A CG2 2969 N N . PRO A 368 ? 0.6892 0.7756 0.6619 0.0045 0.0732 0.0743 427 PRO A N 2970 C CA . PRO A 368 ? 0.8108 0.8963 0.7885 0.0028 0.0737 0.0719 427 PRO A CA 2971 C C . PRO A 368 ? 0.6913 0.7782 0.6778 0.0022 0.0742 0.0731 427 PRO A C 2972 O O . PRO A 368 ? 0.7717 0.8602 0.7614 0.0040 0.0748 0.0768 427 PRO A O 2973 C CB . PRO A 368 ? 0.8087 0.8930 0.7845 0.0048 0.0747 0.0728 427 PRO A CB 2974 C CG . PRO A 368 ? 0.6741 0.7579 0.6419 0.0064 0.0743 0.0736 427 PRO A CG 2975 C CD . PRO A 368 ? 0.7225 0.8082 0.6896 0.0070 0.0736 0.0759 427 PRO A CD 2976 N N . LYS A 369 ? 0.4827 0.5690 0.4731 -0.0004 0.0738 0.0700 428 LYS A N 2977 C CA . LYS A 369 ? 0.5024 0.5898 0.5013 -0.0014 0.0742 0.0705 428 LYS A CA 2978 C C . LYS A 369 ? 0.6901 0.7796 0.6924 -0.0020 0.0734 0.0717 428 LYS A C 2979 O O . LYS A 369 ? 0.6543 0.7449 0.6640 -0.0028 0.0737 0.0723 428 LYS A O 2980 C CB . LYS A 369 ? 0.4393 0.5271 0.4426 0.0006 0.0758 0.0736 428 LYS A CB 2981 C CG . LYS A 369 ? 0.4183 0.5042 0.4192 0.0013 0.0766 0.0725 428 LYS A CG 2982 C CD . LYS A 369 ? 0.6888 0.7752 0.6933 0.0039 0.0783 0.0758 428 LYS A CD 2983 C CE . LYS A 369 ? 0.8749 0.9594 0.8771 0.0048 0.0791 0.0745 428 LYS A CE 2984 N NZ . LYS A 369 ? 0.9085 0.9933 0.9139 0.0076 0.0808 0.0777 428 LYS A NZ 2985 N N . SER A 370 ? 0.6724 0.7624 0.6694 -0.0015 0.0725 0.0720 429 SER A N 2986 C CA . SER A 370 ? 0.5992 0.6913 0.5990 -0.0018 0.0718 0.0732 429 SER A CA 2987 C C . SER A 370 ? 0.4796 0.5715 0.4825 -0.0046 0.0705 0.0695 429 SER A C 2988 O O . SER A 370 ? 0.5550 0.6486 0.5641 -0.0053 0.0702 0.0702 429 SER A O 2989 C CB . SER A 370 ? 0.5096 0.6022 0.5022 -0.0004 0.0712 0.0744 429 SER A CB 2990 O OG . SER A 370 ? 0.5866 0.6776 0.5724 -0.0016 0.0701 0.0709 429 SER A OG 2991 N N . LEU A 371 ? 0.4522 0.5420 0.4509 -0.0060 0.0698 0.0657 430 LEU A N 2992 C CA . LEU A 371 ? 0.6249 0.7140 0.6258 -0.0084 0.0686 0.0621 430 LEU A CA 2993 C C . LEU A 371 ? 0.5979 0.6875 0.6077 -0.0097 0.0689 0.0618 430 LEU A C 2994 O O . LEU A 371 ? 0.4477 0.5385 0.4629 -0.0108 0.0680 0.0613 430 LEU A O 2995 C CB . LEU A 371 ? 0.6662 0.7526 0.6607 -0.0093 0.0681 0.0583 430 LEU A CB 2996 C CG . LEU A 371 ? 0.4337 0.5190 0.4301 -0.0116 0.0668 0.0543 430 LEU A CG 2997 C CD1 . LEU A 371 ? 0.3559 0.4423 0.3521 -0.0119 0.0654 0.0535 430 LEU A CD1 2998 C CD2 . LEU A 371 ? 0.4435 0.5260 0.4339 -0.0122 0.0666 0.0510 430 LEU A CD2 2999 N N . THR A 372 ? 0.5068 0.5953 0.5180 -0.0094 0.0700 0.0621 431 THR A N 3000 C CA . THR A 372 ? 0.6936 0.7823 0.7127 -0.0106 0.0704 0.0619 431 THR A CA 3001 C C . THR A 372 ? 0.5922 0.6832 0.6184 -0.0097 0.0713 0.0655 431 THR A C 3002 O O . THR A 372 ? 0.7380 0.8296 0.7714 -0.0109 0.0712 0.0652 431 THR A O 3003 C CB . THR A 372 ? 0.6568 0.7437 0.6750 -0.0104 0.0715 0.0612 431 THR A CB 3004 O OG1 . THR A 372 ? 0.8054 0.8924 0.8205 -0.0080 0.0729 0.0641 431 THR A OG1 3005 C CG2 . THR A 372 ? 0.3514 0.4359 0.3639 -0.0117 0.0706 0.0573 431 THR A CG2 3006 N N . LYS A 373 ? 0.4762 0.5683 0.5003 -0.0074 0.0722 0.0690 432 LYS A N 3007 C CA . LYS A 373 ? 0.5155 0.6099 0.5460 -0.0063 0.0731 0.0727 432 LYS A CA 3008 C C . LYS A 373 ? 0.4981 0.5943 0.5321 -0.0075 0.0718 0.0723 432 LYS A C 3009 O O . LYS A 373 ? 0.4244 0.5219 0.4662 -0.0081 0.0721 0.0734 432 LYS A O 3010 C CB . LYS A 373 ? 0.6784 0.7734 0.7053 -0.0033 0.0743 0.0766 432 LYS A CB 3011 C CG . LYS A 373 ? 0.6756 0.7696 0.7033 -0.0016 0.0761 0.0784 432 LYS A CG 3012 C CD . LYS A 373 ? 0.7138 0.8079 0.7364 0.0016 0.0769 0.0817 432 LYS A CD 3013 C CE . LYS A 373 ? 0.6834 0.7765 0.7069 0.0036 0.0787 0.0833 432 LYS A CE 3014 N NZ . LYS A 373 ? 0.5836 0.6768 0.6024 0.0069 0.0794 0.0867 432 LYS A NZ 3015 N N . ALA A 374 ? 0.5302 0.6262 0.5581 -0.0077 0.0704 0.0707 433 ALA A N 3016 C CA . ALA A 374 ? 0.3997 0.4972 0.4300 -0.0088 0.0690 0.0698 433 ALA A CA 3017 C C . ALA A 374 ? 0.4729 0.5698 0.5083 -0.0113 0.0678 0.0662 433 ALA A C 3018 O O . ALA A 374 ? 0.6506 0.7490 0.6916 -0.0123 0.0670 0.0659 433 ALA A O 3019 C CB . ALA A 374 ? 0.3720 0.4692 0.3939 -0.0084 0.0678 0.0686 433 ALA A CB 3020 N N . LEU A 375 ? 0.6829 0.7775 0.7163 -0.0123 0.0678 0.0636 434 LEU A N 3021 C CA . LEU A 375 ? 0.6023 0.6959 0.6401 -0.0145 0.0667 0.0603 434 LEU A CA 3022 C C . LEU A 375 ? 0.5490 0.6436 0.5960 -0.0149 0.0677 0.0619 434 LEU A C 3023 O O . LEU A 375 ? 0.4210 0.5163 0.4744 -0.0164 0.0668 0.0608 434 LEU A O 3024 C CB . LEU A 375 ? 0.4355 0.5263 0.4679 -0.0153 0.0664 0.0570 434 LEU A CB 3025 C CG . LEU A 375 ? 0.4983 0.5878 0.5348 -0.0174 0.0653 0.0537 434 LEU A CG 3026 C CD1 . LEU A 375 ? 0.3021 0.3920 0.3396 -0.0184 0.0633 0.0512 434 LEU A CD1 3027 C CD2 . LEU A 375 ? 0.3014 0.3882 0.3325 -0.0178 0.0654 0.0511 434 LEU A CD2 3028 N N . HIS A 376 ? 0.3495 0.4440 0.3969 -0.0136 0.0696 0.0646 435 HIS A N 3029 C CA . HIS A 376 ? 0.4271 0.5221 0.4824 -0.0137 0.0709 0.0663 435 HIS A CA 3030 C C . HIS A 376 ? 0.6035 0.7012 0.6660 -0.0136 0.0710 0.0687 435 HIS A C 3031 O O . HIS A 376 ? 0.5478 0.6460 0.6179 -0.0150 0.0708 0.0683 435 HIS A O 3032 C CB . HIS A 376 ? 0.5192 0.6138 0.5731 -0.0117 0.0731 0.0692 435 HIS A CB 3033 C CG . HIS A 376 ? 0.6296 0.7244 0.6909 -0.0118 0.0745 0.0705 435 HIS A CG 3034 N ND1 . HIS A 376 ? 0.7155 0.8087 0.7790 -0.0135 0.0743 0.0679 435 HIS A ND1 3035 C CD2 . HIS A 376 ? 0.6478 0.7439 0.7148 -0.0104 0.0763 0.0741 435 HIS A CD2 3036 C CE1 . HIS A 376 ? 0.6443 0.7380 0.7143 -0.0131 0.0759 0.0698 435 HIS A CE1 3037 N NE2 . HIS A 376 ? 0.6654 0.7607 0.7377 -0.0112 0.0772 0.0736 435 HIS A NE2 3038 N N . GLU A 377 ? 0.5291 0.6282 0.5888 -0.0121 0.0711 0.0711 436 GLU A N 3039 C CA . GLU A 377 ? 0.6050 0.7067 0.6707 -0.0117 0.0713 0.0736 436 GLU A CA 3040 C C . GLU A 377 ? 0.4497 0.5521 0.5194 -0.0138 0.0692 0.0708 436 GLU A C 3041 O O . GLU A 377 ? 0.6211 0.7252 0.6990 -0.0145 0.0693 0.0718 436 GLU A O 3042 C CB . GLU A 377 ? 0.7115 0.8144 0.7720 -0.0095 0.0716 0.0764 436 GLU A CB 3043 C CG . GLU A 377 ? 0.9471 1.0527 1.0135 -0.0088 0.0720 0.0797 436 GLU A CG 3044 C CD . GLU A 377 ? 1.2149 1.3217 1.2754 -0.0070 0.0718 0.0818 436 GLU A CD 3045 O OE1 . GLU A 377 ? 1.2426 1.3482 1.2946 -0.0068 0.0707 0.0799 436 GLU A OE1 3046 O OE2 . GLU A 377 ? 1.2479 1.3567 1.3122 -0.0056 0.0727 0.0854 436 GLU A OE2 3047 N N . SER A 378 ? 0.5006 0.6017 0.5644 -0.0148 0.0674 0.0671 437 SER A N 3048 C CA . SER A 378 ? 0.3584 0.4598 0.4252 -0.0166 0.0653 0.0639 437 SER A CA 3049 C C . SER A 378 ? 0.6127 0.7132 0.6863 -0.0185 0.0649 0.0620 437 SER A C 3050 O O . SER A 378 ? 0.5175 0.6194 0.5985 -0.0196 0.0641 0.0614 437 SER A O 3051 C CB . SER A 378 ? 0.3021 0.4019 0.3603 -0.0169 0.0636 0.0605 437 SER A CB 3052 O OG . SER A 378 ? 0.5102 0.6104 0.5709 -0.0182 0.0615 0.0575 437 SER A OG 3053 N N . LEU A 379 ? 0.4213 0.5197 0.4923 -0.0187 0.0656 0.0609 438 LEU A N 3054 C CA . LEU A 379 ? 0.5279 0.6252 0.6042 -0.0204 0.0653 0.0590 438 LEU A CA 3055 C C . LEU A 379 ? 0.5694 0.6683 0.6550 -0.0204 0.0667 0.0619 438 LEU A C 3056 O O . LEU A 379 ? 0.6199 0.7188 0.7121 -0.0220 0.0660 0.0605 438 LEU A O 3057 C CB . LEU A 379 ? 0.5830 0.6777 0.6541 -0.0204 0.0660 0.0578 438 LEU A CB 3058 C CG . LEU A 379 ? 0.4499 0.5425 0.5126 -0.0207 0.0646 0.0543 438 LEU A CG 3059 C CD1 . LEU A 379 ? 0.4252 0.5155 0.4834 -0.0206 0.0656 0.0536 438 LEU A CD1 3060 C CD2 . LEU A 379 ? 0.4365 0.5283 0.5012 -0.0225 0.0622 0.0506 438 LEU A CD2 3061 N N . SER A 380 ? 0.6001 0.7003 0.6861 -0.0186 0.0688 0.0659 439 SER A N 3062 C CA . SER A 380 ? 0.4847 0.5862 0.5790 -0.0182 0.0706 0.0690 439 SER A CA 3063 C C . SER A 380 ? 0.5569 0.6605 0.6596 -0.0194 0.0696 0.0689 439 SER A C 3064 O O . SER A 380 ? 0.5801 0.6843 0.6909 -0.0199 0.0705 0.0701 439 SER A O 3065 C CB . SER A 380 ? 0.5217 0.6242 0.6141 -0.0156 0.0728 0.0733 439 SER A CB 3066 O OG . SER A 380 ? 0.7972 0.8978 0.8828 -0.0143 0.0738 0.0734 439 SER A OG 3067 N N . LYS A 381 ? 0.3580 0.4625 0.4587 -0.0197 0.0677 0.0675 440 LYS A N 3068 C CA . LYS A 381 ? 0.5326 0.6391 0.6410 -0.0208 0.0665 0.0672 440 LYS A CA 3069 C C . LYS A 381 ? 0.4669 0.5725 0.5800 -0.0231 0.0647 0.0635 440 LYS A C 3070 O O . LYS A 381 ? 0.5915 0.6985 0.7126 -0.0241 0.0640 0.0633 440 LYS A O 3071 C CB . LYS A 381 ? 0.4872 0.5951 0.5917 -0.0203 0.0651 0.0667 440 LYS A CB 3072 C CG . LYS A 381 ? 0.6033 0.7126 0.7039 -0.0180 0.0667 0.0706 440 LYS A CG 3073 C CD . LYS A 381 ? 0.8213 0.9323 0.9199 -0.0177 0.0652 0.0703 440 LYS A CD 3074 C CE . LYS A 381 ? 0.8226 0.9321 0.9146 -0.0186 0.0628 0.0657 440 LYS A CE 3075 N NZ . LYS A 381 ? 0.8073 0.9145 0.8892 -0.0177 0.0632 0.0651 440 LYS A NZ 3076 N N . ASP A 382 ? 0.4473 0.5503 0.5552 -0.0238 0.0639 0.0606 441 ASP A N 3077 C CA . ASP A 382 ? 0.3907 0.4924 0.5024 -0.0257 0.0621 0.0571 441 ASP A CA 3078 C C . ASP A 382 ? 0.5061 0.6079 0.6255 -0.0264 0.0636 0.0586 441 ASP A C 3079 O O . ASP A 382 ? 0.4745 0.5755 0.5923 -0.0255 0.0658 0.0608 441 ASP A O 3080 C CB . ASP A 382 ? 0.3827 0.4815 0.4863 -0.0261 0.0610 0.0538 441 ASP A CB 3081 C CG . ASP A 382 ? 0.4783 0.5757 0.5850 -0.0279 0.0588 0.0500 441 ASP A CG 3082 O OD1 . ASP A 382 ? 0.6267 0.7233 0.7377 -0.0288 0.0593 0.0500 441 ASP A OD1 3083 O OD2 . ASP A 382 ? 0.3636 0.4606 0.4681 -0.0283 0.0565 0.0470 441 ASP A OD2 3084 N N . PRO A 383 ? 0.3486 0.4511 0.4762 -0.0279 0.0624 0.0575 442 PRO A N 3085 C CA . PRO A 383 ? 0.3627 0.4654 0.4985 -0.0287 0.0637 0.0588 442 PRO A CA 3086 C C . PRO A 383 ? 0.4915 0.5916 0.6246 -0.0292 0.0643 0.0576 442 PRO A C 3087 O O . PRO A 383 ? 0.5628 0.6627 0.7008 -0.0293 0.0660 0.0593 442 PRO A O 3088 C CB . PRO A 383 ? 0.3006 0.4042 0.4442 -0.0303 0.0615 0.0567 442 PRO A CB 3089 C CG . PRO A 383 ? 0.3799 0.4847 0.5207 -0.0299 0.0597 0.0555 442 PRO A CG 3090 C CD . PRO A 383 ? 0.4097 0.5130 0.5394 -0.0288 0.0597 0.0547 442 PRO A CD 3091 N N . ALA A 384 ? 0.4977 0.5957 0.6230 -0.0294 0.0629 0.0547 443 ALA A N 3092 C CA . ALA A 384 ? 0.3385 0.4340 0.4609 -0.0299 0.0631 0.0532 443 ALA A CA 3093 C C . ALA A 384 ? 0.3979 0.4924 0.5128 -0.0283 0.0652 0.0548 443 ALA A C 3094 O O . ALA A 384 ? 0.5325 0.6248 0.6432 -0.0286 0.0653 0.0533 443 ALA A O 3095 C CB . ALA A 384 ? 0.3016 0.3952 0.4208 -0.0312 0.0603 0.0489 443 ALA A CB 3096 N N . HIS A 385 ? 0.4257 0.5217 0.5390 -0.0266 0.0667 0.0578 444 HIS A N 3097 C CA . HIS A 385 ? 0.4541 0.5493 0.5605 -0.0249 0.0686 0.0594 444 HIS A CA 3098 C C . HIS A 385 ? 0.4426 0.5368 0.5512 -0.0245 0.0708 0.0609 444 HIS A C 3099 O O . HIS A 385 ? 0.5672 0.6622 0.6835 -0.0250 0.0716 0.0622 444 HIS A O 3100 C CB . HIS A 385 ? 0.5139 0.6110 0.6189 -0.0230 0.0698 0.0627 444 HIS A CB 3101 C CG . HIS A 385 ? 0.7525 0.8515 0.8649 -0.0221 0.0719 0.0665 444 HIS A CG 3102 N ND1 . HIS A 385 ? 0.9399 1.0407 1.0608 -0.0231 0.0713 0.0670 444 HIS A ND1 3103 C CD2 . HIS A 385 ? 0.7152 0.8143 0.8279 -0.0202 0.0746 0.0700 444 HIS A CD2 3104 C CE1 . HIS A 385 ? 0.6917 0.7937 0.8178 -0.0219 0.0737 0.0707 444 HIS A CE1 3105 N NE2 . HIS A 385 ? 0.8012 0.9022 0.9224 -0.0200 0.0757 0.0726 444 HIS A NE2 3106 N N . PRO A 386 ? 0.4282 0.5208 0.5302 -0.0236 0.0718 0.0607 445 PRO A N 3107 C CA . PRO A 386 ? 0.4800 0.5714 0.5727 -0.0229 0.0711 0.0592 445 PRO A CA 3108 C C . PRO A 386 ? 0.4721 0.5619 0.5615 -0.0247 0.0685 0.0550 445 PRO A C 3109 O O . PRO A 386 ? 0.6076 0.6961 0.6992 -0.0261 0.0678 0.0530 445 PRO A O 3110 C CB . PRO A 386 ? 0.3789 0.4688 0.4677 -0.0216 0.0731 0.0602 445 PRO A CB 3111 C CG . PRO A 386 ? 0.3966 0.4861 0.4915 -0.0225 0.0740 0.0603 445 PRO A CG 3112 C CD . PRO A 386 ? 0.2976 0.3891 0.4011 -0.0230 0.0739 0.0619 445 PRO A CD 3113 N N . ILE A 387 ? 0.5184 0.6082 0.6024 -0.0244 0.0672 0.0538 446 ILE A N 3114 C CA . ILE A 387 ? 0.5193 0.6074 0.5996 -0.0257 0.0648 0.0499 446 ILE A CA 3115 C C . ILE A 387 ? 0.4080 0.4937 0.4807 -0.0255 0.0651 0.0482 446 ILE A C 3116 O O . ILE A 387 ? 0.3770 0.4608 0.4486 -0.0268 0.0638 0.0452 446 ILE A O 3117 C CB . ILE A 387 ? 0.3626 0.4518 0.4402 -0.0254 0.0633 0.0492 446 ILE A CB 3118 C CG1 . ILE A 387 ? 0.4151 0.5068 0.5003 -0.0255 0.0631 0.0510 446 ILE A CG1 3119 C CG2 . ILE A 387 ? 0.3122 0.3994 0.3861 -0.0265 0.0610 0.0451 446 ILE A CG2 3120 C CD1 . ILE A 387 ? 0.3779 0.4697 0.4712 -0.0272 0.0620 0.0497 446 ILE A CD1 3121 N N . LEU A 388 ? 0.3815 0.4673 0.4491 -0.0239 0.0667 0.0501 447 LEU A N 3122 C CA . LEU A 388 ? 0.4951 0.5787 0.5556 -0.0235 0.0672 0.0486 447 LEU A CA 3123 C C . LEU A 388 ? 0.3828 0.4663 0.4437 -0.0224 0.0695 0.0508 447 LEU A C 3124 O O . LEU A 388 ? 0.4516 0.5368 0.5154 -0.0210 0.0710 0.0541 447 LEU A O 3125 C CB . LEU A 388 ? 0.3349 0.4183 0.3878 -0.0225 0.0669 0.0484 447 LEU A CB 3126 C CG . LEU A 388 ? 0.5385 0.6213 0.5884 -0.0233 0.0647 0.0455 447 LEU A CG 3127 C CD1 . LEU A 388 ? 0.3539 0.4368 0.3965 -0.0220 0.0649 0.0460 447 LEU A CD1 3128 C CD2 . LEU A 388 ? 0.4806 0.5608 0.5283 -0.0247 0.0634 0.0419 447 LEU A CD2 3129 N N . ALA A 389 ? 0.4252 0.5067 0.4831 -0.0228 0.0697 0.0490 448 ALA A N 3130 C CA . ALA A 389 ? 0.4565 0.5375 0.5129 -0.0215 0.0718 0.0506 448 ALA A CA 3131 C C . ALA A 389 ? 0.4348 0.5162 0.4853 -0.0195 0.0726 0.0522 448 ALA A C 3132 O O . ALA A 389 ? 0.5246 0.6055 0.5698 -0.0197 0.0715 0.0507 448 ALA A O 3133 C CB . ALA A 389 ? 0.2986 0.3774 0.3523 -0.0224 0.0716 0.0480 448 ALA A CB 3134 N N . TYR A 390 ? 0.3425 0.4248 0.3941 -0.0175 0.0746 0.0552 449 TYR A N 3135 C CA . TYR A 390 ? 0.4958 0.5787 0.5426 -0.0154 0.0754 0.0573 449 TYR A CA 3136 C C . TYR A 390 ? 0.5532 0.6343 0.5921 -0.0150 0.0752 0.0554 449 TYR A C 3137 O O . TYR A 390 ? 0.5695 0.6508 0.6034 -0.0137 0.0752 0.0562 449 TYR A O 3138 C CB . TYR A 390 ? 0.4635 0.5474 0.5133 -0.0131 0.0776 0.0610 449 TYR A CB 3139 C CG . TYR A 390 ? 0.5812 0.6669 0.6387 -0.0132 0.0781 0.0634 449 TYR A CG 3140 C CD1 . TYR A 390 ? 0.5062 0.5932 0.5662 -0.0145 0.0765 0.0630 449 TYR A CD1 3141 C CD2 . TYR A 390 ? 0.5767 0.6629 0.6389 -0.0118 0.0801 0.0659 449 TYR A CD2 3142 C CE1 . TYR A 390 ? 0.5980 0.6868 0.6654 -0.0146 0.0770 0.0651 449 TYR A CE1 3143 C CE2 . TYR A 390 ? 0.4152 0.5030 0.4847 -0.0118 0.0807 0.0682 449 TYR A CE2 3144 C CZ . TYR A 390 ? 0.5635 0.6527 0.6358 -0.0133 0.0791 0.0678 449 TYR A CZ 3145 O OH . TYR A 390 ? 0.6063 0.6972 0.6861 -0.0134 0.0796 0.0699 449 TYR A OH 3146 N N . LYS A 391 ? 0.2972 0.3765 0.3350 -0.0162 0.0750 0.0528 450 LYS A N 3147 C CA . LYS A 391 ? 0.3811 0.4586 0.4120 -0.0160 0.0750 0.0507 450 LYS A CA 3148 C C . LYS A 391 ? 0.4665 0.5434 0.4923 -0.0169 0.0733 0.0487 450 LYS A C 3149 O O . LYS A 391 ? 0.6512 0.7268 0.6707 -0.0164 0.0734 0.0475 450 LYS A O 3150 C CB . LYS A 391 ? 0.2975 0.3733 0.3289 -0.0173 0.0750 0.0483 450 LYS A CB 3151 C CG . LYS A 391 ? 0.5581 0.6335 0.5933 -0.0196 0.0735 0.0462 450 LYS A CG 3152 C CD . LYS A 391 ? 0.3367 0.4103 0.3718 -0.0207 0.0736 0.0440 450 LYS A CD 3153 C CE . LYS A 391 ? 0.4227 0.4960 0.4627 -0.0227 0.0722 0.0425 450 LYS A CE 3154 N NZ . LYS A 391 ? 0.4294 0.5008 0.4686 -0.0238 0.0721 0.0402 450 LYS A NZ 3155 N N . HIS A 392 ? 0.3919 0.4696 0.4204 -0.0181 0.0720 0.0482 451 HIS A N 3156 C CA . HIS A 392 ? 0.4611 0.5381 0.4848 -0.0187 0.0705 0.0462 451 HIS A CA 3157 C C . HIS A 392 ? 0.6059 0.6842 0.6261 -0.0170 0.0708 0.0484 451 HIS A C 3158 O O . HIS A 392 ? 0.5555 0.6331 0.5700 -0.0171 0.0700 0.0469 451 HIS A O 3159 C CB . HIS A 392 ? 0.3310 0.4083 0.3589 -0.0204 0.0688 0.0446 451 HIS A CB 3160 C CG . HIS A 392 ? 0.4638 0.5394 0.4936 -0.0221 0.0680 0.0419 451 HIS A CG 3161 N ND1 . HIS A 392 ? 0.4830 0.5563 0.5078 -0.0230 0.0670 0.0386 451 HIS A ND1 3162 C CD2 . HIS A 392 ? 0.5293 0.6051 0.5651 -0.0231 0.0681 0.0419 451 HIS A CD2 3163 C CE1 . HIS A 392 ? 0.3997 0.4718 0.4274 -0.0243 0.0664 0.0369 451 HIS A CE1 3164 N NE2 . HIS A 392 ? 0.6132 0.6868 0.6475 -0.0244 0.0670 0.0388 451 HIS A NE2 3165 N N . TYR A 393 ? 0.5418 0.6220 0.5652 -0.0155 0.0720 0.0519 452 TYR A N 3166 C CA . TYR A 393 ? 0.4263 0.5077 0.4464 -0.0137 0.0723 0.0543 452 TYR A CA 3167 C C . TYR A 393 ? 0.4061 0.4862 0.4186 -0.0124 0.0729 0.0541 452 TYR A C 3168 O O . TYR A 393 ? 0.3983 0.4783 0.4055 -0.0120 0.0722 0.0537 452 TYR A O 3169 C CB . TYR A 393 ? 0.4726 0.5560 0.4979 -0.0121 0.0736 0.0583 452 TYR A CB 3170 C CG . TYR A 393 ? 0.4598 0.5448 0.4924 -0.0131 0.0731 0.0590 452 TYR A CG 3171 C CD1 . TYR A 393 ? 0.5046 0.5898 0.5375 -0.0148 0.0713 0.0568 452 TYR A CD1 3172 C CD2 . TYR A 393 ? 0.6012 0.6876 0.6404 -0.0123 0.0744 0.0618 452 TYR A CD2 3173 C CE1 . TYR A 393 ? 0.5648 0.6515 0.6046 -0.0158 0.0706 0.0573 452 TYR A CE1 3174 C CE2 . TYR A 393 ? 0.6143 0.7022 0.6605 -0.0134 0.0739 0.0625 452 TYR A CE2 3175 C CZ . TYR A 393 ? 0.5106 0.5988 0.5572 -0.0151 0.0720 0.0602 452 TYR A CZ 3176 O OH . TYR A 393 ? 0.5494 0.6392 0.6033 -0.0162 0.0714 0.0607 452 TYR A OH 3177 N N . PRO A 394 ? 0.5689 0.6480 0.5808 -0.0116 0.0741 0.0542 453 PRO A N 3178 C CA . PRO A 394 ? 0.6518 0.7297 0.6566 -0.0104 0.0744 0.0537 453 PRO A CA 3179 C C . PRO A 394 ? 0.6834 0.7594 0.6831 -0.0121 0.0733 0.0500 453 PRO A C 3180 O O . PRO A 394 ? 0.9026 0.9779 0.8960 -0.0113 0.0732 0.0495 453 PRO A O 3181 C CB . PRO A 394 ? 0.4800 0.5572 0.4860 -0.0095 0.0758 0.0540 453 PRO A CB 3182 C CG . PRO A 394 ? 0.4049 0.4822 0.4175 -0.0109 0.0759 0.0534 453 PRO A CG 3183 C CD . PRO A 394 ? 0.4599 0.5390 0.4770 -0.0116 0.0752 0.0547 453 PRO A CD 3184 N N . ALA A 395 ? 0.5359 0.6111 0.5384 -0.0142 0.0724 0.0474 454 ALA A N 3185 C CA . ALA A 395 ? 0.3007 0.3739 0.2988 -0.0156 0.0714 0.0439 454 ALA A CA 3186 C C . ALA A 395 ? 0.6158 0.6894 0.6103 -0.0156 0.0703 0.0436 454 ALA A C 3187 O O . ALA A 395 ? 0.5526 0.6247 0.5407 -0.0155 0.0701 0.0420 454 ALA A O 3188 C CB . ALA A 395 ? 0.3814 0.4537 0.3836 -0.0176 0.0705 0.0415 454 ALA A CB 3189 N N . MSE A 396 ? 0.3280 0.4034 0.3267 -0.0156 0.0698 0.0452 455 MSE A N 3190 C CA . MSE A 396 ? 0.4827 0.5588 0.4785 -0.0155 0.0688 0.0451 455 MSE A CA 3191 C C . MSE A 396 ? 0.6704 0.7469 0.6603 -0.0136 0.0694 0.0471 455 MSE A C 3192 O O . MSE A 396 ? 0.5318 0.6077 0.5161 -0.0134 0.0688 0.0459 455 MSE A O 3193 C CB . MSE A 396 ? 0.3684 0.4467 0.3707 -0.0158 0.0681 0.0466 455 MSE A CB 3194 C CG . MSE A 396 ? 0.5081 0.5856 0.5136 -0.0177 0.0666 0.0437 455 MSE A CG 3195 SE SE . MSE A 396 ? 0.8248 0.9052 0.8394 -0.0181 0.0658 0.0455 455 MSE A SE 3196 C CE . MSE A 396 ? 0.6971 0.7783 0.7193 -0.0181 0.0674 0.0480 455 MSE A CE 3197 N N . GLU A 397 ? 0.6654 0.7430 0.6567 -0.0120 0.0707 0.0501 456 GLU A N 3198 C CA . GLU A 397 ? 0.6086 0.6864 0.5944 -0.0100 0.0713 0.0521 456 GLU A CA 3199 C C . GLU A 397 ? 0.5651 0.6406 0.5441 -0.0101 0.0714 0.0497 456 GLU A C 3200 O O . GLU A 397 ? 0.5244 0.5995 0.4972 -0.0093 0.0712 0.0496 456 GLU A O 3201 C CB . GLU A 397 ? 0.6827 0.7618 0.6717 -0.0080 0.0726 0.0557 456 GLU A CB 3202 C CG . GLU A 397 ? 0.6184 0.6999 0.6139 -0.0076 0.0727 0.0585 456 GLU A CG 3203 C CD . GLU A 397 ? 0.5866 0.6696 0.5798 -0.0068 0.0720 0.0602 456 GLU A CD 3204 O OE1 . GLU A 397 ? 0.7419 0.8244 0.7282 -0.0057 0.0719 0.0604 456 GLU A OE1 3205 O OE2 . GLU A 397 ? 0.4291 0.5138 0.4273 -0.0073 0.0716 0.0612 456 GLU A OE2 3206 N N . ARG A 398 ? 0.6546 0.7287 0.6350 -0.0111 0.0718 0.0477 457 ARG A N 3207 C CA . ARG A 398 ? 0.6088 0.6807 0.5836 -0.0113 0.0721 0.0453 457 ARG A CA 3208 C C . ARG A 398 ? 0.5265 0.5968 0.4966 -0.0126 0.0711 0.0423 457 ARG A C 3209 O O . ARG A 398 ? 0.6115 0.6804 0.5752 -0.0121 0.0713 0.0413 457 ARG A O 3210 C CB . ARG A 398 ? 0.4727 0.5433 0.4504 -0.0122 0.0726 0.0436 457 ARG A CB 3211 C CG . ARG A 398 ? 0.4464 0.5147 0.4188 -0.0126 0.0729 0.0411 457 ARG A CG 3212 C CD . ARG A 398 ? 0.4655 0.5328 0.4410 -0.0135 0.0734 0.0395 457 ARG A CD 3213 N NE . ARG A 398 ? 0.6025 0.6694 0.5820 -0.0155 0.0725 0.0376 457 ARG A NE 3214 C CZ . ARG A 398 ? 0.6191 0.6869 0.6048 -0.0159 0.0726 0.0385 457 ARG A CZ 3215 N NH1 . ARG A 398 ? 0.5249 0.5942 0.5138 -0.0145 0.0736 0.0412 457 ARG A NH1 3216 N NH2 . ARG A 398 ? 0.5261 0.5934 0.5150 -0.0177 0.0716 0.0367 457 ARG A NH2 3217 N N . ARG A 399 ? 0.4696 0.5400 0.4431 -0.0140 0.0701 0.0410 458 ARG A N 3218 C CA . ARG A 399 ? 0.4783 0.5472 0.4478 -0.0150 0.0691 0.0381 458 ARG A CA 3219 C C . ARG A 399 ? 0.5673 0.6370 0.5322 -0.0139 0.0687 0.0391 458 ARG A C 3220 O O . ARG A 399 ? 0.4902 0.5581 0.4489 -0.0140 0.0685 0.0371 458 ARG A O 3221 C CB . ARG A 399 ? 0.3756 0.4444 0.3503 -0.0165 0.0680 0.0364 458 ARG A CB 3222 C CG . ARG A 399 ? 0.5384 0.6057 0.5162 -0.0178 0.0682 0.0346 458 ARG A CG 3223 C CD . ARG A 399 ? 0.5078 0.5757 0.4922 -0.0190 0.0671 0.0339 458 ARG A CD 3224 N NE . ARG A 399 ? 0.3811 0.4482 0.3691 -0.0199 0.0675 0.0332 458 ARG A NE 3225 C CZ . ARG A 399 ? 0.3301 0.3977 0.3244 -0.0209 0.0669 0.0330 458 ARG A CZ 3226 N NH1 . ARG A 399 ? 0.3915 0.4605 0.3897 -0.0212 0.0658 0.0335 458 ARG A NH1 3227 N NH2 . ARG A 399 ? 0.4856 0.5523 0.4824 -0.0216 0.0673 0.0324 458 ARG A NH2 3228 N N . LEU A 400 ? 0.6120 0.6841 0.5798 -0.0129 0.0687 0.0423 459 LEU A N 3229 C CA . LEU A 400 ? 0.6340 0.7072 0.5977 -0.0117 0.0684 0.0437 459 LEU A CA 3230 C C . LEU A 400 ? 0.6894 0.7616 0.6457 -0.0104 0.0692 0.0442 459 LEU A C 3231 O O . LEU A 400 ? 0.4700 0.5413 0.4199 -0.0101 0.0688 0.0431 459 LEU A O 3232 C CB . LEU A 400 ? 0.5896 0.6657 0.5581 -0.0107 0.0685 0.0474 459 LEU A CB 3233 C CG . LEU A 400 ? 0.5017 0.5791 0.4661 -0.0093 0.0681 0.0494 459 LEU A CG 3234 C CD1 . LEU A 400 ? 0.3487 0.4256 0.3105 -0.0102 0.0669 0.0469 459 LEU A CD1 3235 C CD2 . LEU A 400 ? 0.3965 0.4768 0.3662 -0.0082 0.0684 0.0534 459 LEU A CD2 3236 N N . ALA A 401 ? 0.6491 0.7213 0.6061 -0.0096 0.0702 0.0457 460 ALA A N 3237 C CA . ALA A 401 ? 0.5957 0.6669 0.5463 -0.0083 0.0708 0.0461 460 ALA A CA 3238 C C . ALA A 401 ? 0.6072 0.6757 0.5522 -0.0093 0.0708 0.0425 460 ALA A C 3239 O O . ALA A 401 ? 0.6322 0.6998 0.5704 -0.0085 0.0710 0.0423 460 ALA A O 3240 C CB . ALA A 401 ? 0.4463 0.5179 0.3996 -0.0072 0.0718 0.0479 460 ALA A CB 3241 N N . LYS A 402 ? 0.3371 0.4042 0.2848 -0.0110 0.0707 0.0398 461 LYS A N 3242 C CA . LYS A 402 ? 0.6524 0.7166 0.5953 -0.0120 0.0708 0.0363 461 LYS A CA 3243 C C . LYS A 402 ? 0.6543 0.7177 0.5927 -0.0122 0.0701 0.0347 461 LYS A C 3244 O O . LYS A 402 ? 0.6642 0.7255 0.5962 -0.0121 0.0704 0.0328 461 LYS A O 3245 C CB . LYS A 402 ? 0.4686 0.5316 0.4159 -0.0136 0.0708 0.0339 461 LYS A CB 3246 C CG . LYS A 402 ? 0.5205 0.5837 0.4711 -0.0134 0.0716 0.0349 461 LYS A CG 3247 C CD . LYS A 402 ? 0.5286 0.5907 0.4833 -0.0150 0.0715 0.0326 461 LYS A CD 3248 C CE . LYS A 402 ? 0.6560 0.7179 0.6124 -0.0148 0.0725 0.0329 461 LYS A CE 3249 N NZ . LYS A 402 ? 0.7467 0.8072 0.7063 -0.0164 0.0724 0.0305 461 LYS A NZ 3250 N N . ILE A 403 ? 0.6392 0.7042 0.5810 -0.0124 0.0692 0.0354 462 ILE A N 3251 C CA . ILE A 403 ? 0.5595 0.6240 0.4973 -0.0124 0.0684 0.0339 462 ILE A CA 3252 C C . ILE A 403 ? 0.6675 0.7323 0.5984 -0.0109 0.0687 0.0354 462 ILE A C 3253 O O . ILE A 403 ? 0.5100 0.5730 0.4345 -0.0108 0.0687 0.0334 462 ILE A O 3254 C CB . ILE A 403 ? 0.3840 0.4505 0.3275 -0.0128 0.0672 0.0347 462 ILE A CB 3255 C CG1 . ILE A 403 ? 0.4435 0.5093 0.3928 -0.0143 0.0666 0.0325 462 ILE A CG1 3256 C CG2 . ILE A 403 ? 0.4695 0.5360 0.4085 -0.0123 0.0664 0.0338 462 ILE A CG2 3257 C CD1 . ILE A 403 ? 0.4961 0.5642 0.4529 -0.0147 0.0657 0.0339 462 ILE A CD1 3258 N N . MSE A 404 ? 0.3103 0.3772 0.2423 -0.0096 0.0690 0.0389 463 MSE A N 3259 C CA . MSE A 404 ? 0.5554 0.6228 0.4811 -0.0080 0.0693 0.0408 463 MSE A CA 3260 C C . MSE A 404 ? 0.6562 0.7212 0.5754 -0.0078 0.0701 0.0393 463 MSE A C 3261 O O . MSE A 404 ? 0.5709 0.6352 0.4830 -0.0069 0.0702 0.0393 463 MSE A O 3262 C CB . MSE A 404 ? 0.3265 0.3965 0.2553 -0.0065 0.0694 0.0451 463 MSE A CB 3263 C CG . MSE A 404 ? 0.4212 0.4936 0.3571 -0.0067 0.0688 0.0468 463 MSE A CG 3264 SE SE . MSE A 404 ? 1.0068 1.0799 0.9409 -0.0072 0.0675 0.0454 463 MSE A SE 3265 C CE . MSE A 404 ? 0.6618 0.7349 0.5856 -0.0052 0.0677 0.0472 463 MSE A CE 3266 N N . SER A 405 ? 0.5707 0.6343 0.4921 -0.0086 0.0707 0.0379 464 SER A N 3267 C CA . SER A 405 ? 0.5230 0.5843 0.4390 -0.0085 0.0716 0.0362 464 SER A CA 3268 C C . SER A 405 ? 0.6498 0.7085 0.5609 -0.0094 0.0716 0.0327 464 SER A C 3269 O O . SER A 405 ? 0.6703 0.7273 0.5745 -0.0089 0.0722 0.0317 464 SER A O 3270 C CB . SER A 405 ? 0.5150 0.5757 0.4352 -0.0091 0.0723 0.0356 464 SER A CB 3271 O OG . SER A 405 ? 0.8038 0.8668 0.7288 -0.0081 0.0723 0.0387 464 SER A OG 3272 N N . HIS A 406 ? 0.6599 0.7181 0.5744 -0.0107 0.0710 0.0307 465 HIS A N 3273 C CA . HIS A 406 ? 0.5655 0.6211 0.4756 -0.0113 0.0709 0.0273 465 HIS A CA 3274 C C . HIS A 406 ? 0.5853 0.6413 0.4898 -0.0103 0.0705 0.0276 465 HIS A C 3275 O O . HIS A 406 ? 0.7519 0.8055 0.6499 -0.0101 0.0709 0.0253 465 HIS A O 3276 C CB . HIS A 406 ? 0.4193 0.4745 0.3349 -0.0126 0.0701 0.0253 465 HIS A CB 3277 C CG . HIS A 406 ? 0.6869 0.7415 0.6074 -0.0136 0.0705 0.0246 465 HIS A CG 3278 N ND1 . HIS A 406 ? 0.8141 0.8671 0.7322 -0.0137 0.0716 0.0239 465 HIS A ND1 3279 C CD2 . HIS A 406 ? 0.7670 0.8222 0.6945 -0.0146 0.0699 0.0244 465 HIS A CD2 3280 C CE1 . HIS A 406 ? 0.7714 0.8242 0.6948 -0.0147 0.0717 0.0233 465 HIS A CE1 3281 N NE2 . HIS A 406 ? 0.8825 0.9366 0.8115 -0.0153 0.0707 0.0236 465 HIS A NE2 3282 N N . ILE A 407 ? 0.5298 0.5886 0.4367 -0.0095 0.0698 0.0305 466 ILE A N 3283 C CA . ILE A 407 ? 0.6486 0.7080 0.5502 -0.0085 0.0693 0.0312 466 ILE A CA 3284 C C . ILE A 407 ? 0.7214 0.7802 0.6156 -0.0073 0.0701 0.0323 466 ILE A C 3285 O O . ILE A 407 ? 0.4812 0.5386 0.3683 -0.0067 0.0703 0.0310 466 ILE A O 3286 C CB . ILE A 407 ? 0.5140 0.5769 0.4206 -0.0079 0.0684 0.0343 466 ILE A CB 3287 C CG1 . ILE A 407 ? 0.4897 0.5532 0.4032 -0.0091 0.0674 0.0329 466 ILE A CG1 3288 C CG2 . ILE A 407 ? 0.5927 0.6565 0.4933 -0.0067 0.0680 0.0353 466 ILE A CG2 3289 C CD1 . ILE A 407 ? 0.4851 0.5519 0.4047 -0.0088 0.0667 0.0359 466 ILE A CD1 3290 N N . LEU A 408 ? 0.6844 0.7441 0.5803 -0.0068 0.0707 0.0346 467 LEU A N 3291 C CA . LEU A 408 ? 0.6647 0.7237 0.5541 -0.0056 0.0714 0.0356 467 LEU A CA 3292 C C . LEU A 408 ? 0.7277 0.7832 0.6112 -0.0062 0.0723 0.0322 467 LEU A C 3293 O O . LEU A 408 ? 0.7000 0.7544 0.5761 -0.0053 0.0727 0.0321 467 LEU A O 3294 C CB . LEU A 408 ? 0.5799 0.6402 0.4729 -0.0049 0.0717 0.0382 467 LEU A CB 3295 C CG . LEU A 408 ? 0.5999 0.6595 0.4869 -0.0035 0.0723 0.0395 467 LEU A CG 3296 C CD1 . LEU A 408 ? 0.5972 0.6577 0.4782 -0.0021 0.0718 0.0414 467 LEU A CD1 3297 C CD2 . LEU A 408 ? 0.6173 0.6782 0.5087 -0.0026 0.0725 0.0419 467 LEU A CD2 3298 N N . GLU A 409 ? 0.6983 0.7521 0.5850 -0.0076 0.0727 0.0295 468 GLU A N 3299 C CA . GLU A 409 ? 0.7186 0.7690 0.6004 -0.0081 0.0737 0.0262 468 GLU A CA 3300 C C . GLU A 409 ? 0.8012 0.8500 0.6774 -0.0079 0.0736 0.0241 468 GLU A C 3301 O O . GLU A 409 ? 0.8499 0.8963 0.7191 -0.0076 0.0745 0.0224 468 GLU A O 3302 C CB . GLU A 409 ? 0.7246 0.7736 0.6116 -0.0096 0.0740 0.0241 468 GLU A CB 3303 C CG . GLU A 409 ? 1.0110 1.0611 0.9025 -0.0097 0.0744 0.0256 468 GLU A CG 3304 C CD . GLU A 409 ? 1.2828 1.3321 1.1801 -0.0111 0.0745 0.0237 468 GLU A CD 3305 O OE1 . GLU A 409 ? 1.4542 1.5022 1.3524 -0.0120 0.0741 0.0215 468 GLU A OE1 3306 O OE2 . GLU A 409 ? 1.1975 1.2472 1.0980 -0.0113 0.0749 0.0245 468 GLU A OE2 3307 N N . CYS A 410 ? 0.6847 0.7347 0.5639 -0.0081 0.0725 0.0240 469 CYS A N 3308 C CA . CYS A 410 ? 0.7030 0.7517 0.5772 -0.0077 0.0722 0.0220 469 CYS A CA 3309 C C . CYS A 410 ? 0.7666 0.8160 0.6337 -0.0062 0.0722 0.0236 469 CYS A C 3310 O O . CYS A 410 ? 0.8786 0.9258 0.7384 -0.0057 0.0728 0.0216 469 CYS A O 3311 C CB . CYS A 410 ? 0.5617 0.6120 0.4416 -0.0081 0.0708 0.0217 469 CYS A CB 3312 S SG . CYS A 410 ? 0.5360 0.5843 0.4217 -0.0096 0.0706 0.0185 469 CYS A SG 3313 N N . PHE A 411 ? 0.7923 0.8447 0.6613 -0.0055 0.0717 0.0273 470 PHE A N 3314 C CA . PHE A 411 ? 0.7628 0.8161 0.6251 -0.0041 0.0717 0.0294 470 PHE A CA 3315 C C . PHE A 411 ? 0.7938 0.8448 0.6490 -0.0035 0.0729 0.0288 470 PHE A C 3316 O O . PHE A 411 ? 0.6786 0.7285 0.5259 -0.0026 0.0732 0.0284 470 PHE A O 3317 C CB . PHE A 411 ? 0.6729 0.7298 0.5394 -0.0032 0.0709 0.0337 470 PHE A CB 3318 C CG . PHE A 411 ? 0.6026 0.6620 0.4742 -0.0033 0.0697 0.0347 470 PHE A CG 3319 C CD1 . PHE A 411 ? 0.5488 0.6072 0.4207 -0.0040 0.0692 0.0318 470 PHE A CD1 3320 C CD2 . PHE A 411 ? 0.6173 0.6799 0.4935 -0.0026 0.0690 0.0386 470 PHE A CD2 3321 C CE1 . PHE A 411 ? 0.7476 0.8084 0.6245 -0.0041 0.0680 0.0327 470 PHE A CE1 3322 C CE2 . PHE A 411 ? 0.6840 0.7490 0.5653 -0.0027 0.0680 0.0396 470 PHE A CE2 3323 C CZ . PHE A 411 ? 0.7008 0.7649 0.5825 -0.0035 0.0675 0.0366 470 PHE A CZ 3324 N N . GLU A 412 ? 0.7538 0.8041 0.6118 -0.0041 0.0736 0.0288 471 GLU A N 3325 C CA . GLU A 412 ? 0.6448 0.6931 0.4970 -0.0037 0.0747 0.0284 471 GLU A CA 3326 C C . GLU A 412 ? 0.7090 0.7536 0.5562 -0.0043 0.0759 0.0245 471 GLU A C 3327 O O . GLU A 412 ? 0.7686 0.8113 0.6086 -0.0037 0.0768 0.0238 471 GLU A O 3328 C CB . GLU A 412 ? 0.4595 0.5086 0.3169 -0.0040 0.0750 0.0297 471 GLU A CB 3329 C CG . GLU A 412 ? 0.5826 0.6350 0.4436 -0.0028 0.0741 0.0338 471 GLU A CG 3330 C CD . GLU A 412 ? 0.7550 0.8079 0.6212 -0.0029 0.0744 0.0348 471 GLU A CD 3331 O OE1 . GLU A 412 ? 0.8721 0.9232 0.7407 -0.0042 0.0751 0.0323 471 GLU A OE1 3332 O OE2 . GLU A 412 ? 0.6900 0.7449 0.5576 -0.0015 0.0739 0.0381 471 GLU A OE2 3333 N N . SER A 413 ? 0.5478 0.5911 0.3986 -0.0054 0.0759 0.0218 472 SER A N 3334 C CA . SER A 413 ? 0.7129 0.7525 0.5594 -0.0059 0.0771 0.0181 472 SER A CA 3335 C C . SER A 413 ? 0.8005 0.8387 0.6406 -0.0051 0.0771 0.0163 472 SER A C 3336 O O . SER A 413 ? 1.0742 1.1095 0.9070 -0.0046 0.0783 0.0144 472 SER A O 3337 C CB . SER A 413 ? 0.7476 0.7862 0.6007 -0.0072 0.0771 0.0160 472 SER A CB 3338 O OG . SER A 413 ? 0.9733 1.0131 0.8303 -0.0074 0.0759 0.0156 472 SER A OG 3339 N N . ARG A 414 ? 0.7453 0.7855 0.5881 -0.0049 0.0757 0.0170 473 ARG A N 3340 C CA . ARG A 414 ? 0.6544 0.6933 0.4917 -0.0040 0.0756 0.0150 473 ARG A CA 3341 C C . ARG A 414 ? 0.6884 0.7296 0.5216 -0.0028 0.0747 0.0175 473 ARG A C 3342 O O . ARG A 414 ? 0.7279 0.7682 0.5557 -0.0019 0.0746 0.0159 473 ARG A O 3343 C CB . ARG A 414 ? 0.6961 0.7350 0.5390 -0.0046 0.0746 0.0131 473 ARG A CB 3344 C CG . ARG A 414 ? 0.8328 0.8696 0.6803 -0.0058 0.0752 0.0110 473 ARG A CG 3345 C CD . ARG A 414 ? 0.8591 0.8943 0.7088 -0.0060 0.0746 0.0080 473 ARG A CD 3346 N NE . ARG A 414 ? 1.0434 1.0757 0.8949 -0.0068 0.0755 0.0056 473 ARG A NE 3347 C CZ . ARG A 414 ? 1.2589 1.2895 1.1134 -0.0070 0.0749 0.0031 473 ARG A CZ 3348 N NH1 . ARG A 414 ? 1.3934 1.4251 1.2496 -0.0065 0.0735 0.0026 473 ARG A NH1 3349 N NH2 . ARG A 414 ? 1.2680 1.2961 1.1239 -0.0077 0.0758 0.0012 473 ARG A NH2 3350 N N . GLY A 415 ? 0.6744 0.7187 0.5102 -0.0025 0.0742 0.0212 474 GLY A N 3351 C CA . GLY A 415 ? 0.6480 0.6947 0.4805 -0.0013 0.0733 0.0239 474 GLY A CA 3352 C C . GLY A 415 ? 0.7996 0.8494 0.6383 -0.0014 0.0717 0.0252 474 GLY A C 3353 O O . GLY A 415 ? 0.7675 0.8167 0.6105 -0.0021 0.0713 0.0230 474 GLY A O 3354 N N . VAL A 416 ? 0.7654 0.8182 0.6044 -0.0005 0.0709 0.0288 475 VAL A N 3355 C CA . VAL A 416 ? 0.7438 0.7998 0.5892 -0.0005 0.0695 0.0306 475 VAL A CA 3356 C C . VAL A 416 ? 0.6954 0.7512 0.5379 -0.0001 0.0688 0.0285 475 VAL A C 3357 O O . VAL A 416 ? 0.7515 0.8088 0.6002 -0.0006 0.0678 0.0281 475 VAL A O 3358 C CB . VAL A 416 ? 0.7618 0.8210 0.6078 0.0006 0.0689 0.0354 475 VAL A CB 3359 C CG1 . VAL A 416 ? 0.8412 0.9029 0.6864 0.0015 0.0678 0.0368 475 VAL A CG1 3360 C CG2 . VAL A 416 ? 0.7358 0.7969 0.5908 0.0000 0.0688 0.0377 475 VAL A CG2 3361 N N . ALA A 417 ? 0.7750 0.8287 0.6079 0.0008 0.0695 0.0268 476 ALA A N 3362 C CA . ALA A 417 ? 0.7014 0.7546 0.5303 0.0016 0.0689 0.0247 476 ALA A CA 3363 C C . ALA A 417 ? 0.6385 0.6891 0.4694 0.0009 0.0690 0.0204 476 ALA A C 3364 O O . ALA A 417 ? 0.8309 0.8814 0.6607 0.0014 0.0683 0.0184 476 ALA A O 3365 C CB . ALA A 417 ? 0.6816 0.7332 0.4990 0.0029 0.0697 0.0243 476 ALA A CB 3366 N N . GLU A 418 ? 0.6370 0.6855 0.4708 -0.0002 0.0699 0.0190 477 GLU A N 3367 C CA . GLU A 418 ? 0.8811 0.9269 0.7166 -0.0007 0.0701 0.0150 477 GLU A CA 3368 C C . GLU A 418 ? 0.7361 0.7836 0.5825 -0.0021 0.0690 0.0154 477 GLU A C 3369 O O . GLU A 418 ? 0.7744 0.8205 0.6236 -0.0024 0.0685 0.0125 477 GLU A O 3370 C CB . GLU A 418 ? 0.7899 0.8318 0.6208 -0.0010 0.0718 0.0128 477 GLU A CB 3371 C CG . GLU A 418 ? 0.9729 1.0128 0.7931 0.0003 0.0731 0.0124 477 GLU A CG 3372 C CD . GLU A 418 ? 1.2929 1.3320 1.1066 0.0017 0.0727 0.0104 477 GLU A CD 3373 O OE1 . GLU A 418 ? 1.3737 1.4110 1.1883 0.0019 0.0725 0.0072 477 GLU A OE1 3374 O OE2 . GLU A 418 ? 1.2475 1.2877 1.0551 0.0027 0.0727 0.0122 477 GLU A OE2 3375 N N . VAL A 419 ? 0.6267 0.6771 0.4790 -0.0027 0.0687 0.0189 478 VAL A N 3376 C CA . VAL A 419 ? 0.7912 0.8435 0.6539 -0.0039 0.0678 0.0196 478 VAL A CA 3377 C C . VAL A 419 ? 0.7774 0.8329 0.6449 -0.0037 0.0662 0.0211 478 VAL A C 3378 O O . VAL A 419 ? 0.7581 0.8137 0.6308 -0.0043 0.0652 0.0193 478 VAL A O 3379 C CB . VAL A 419 ? 0.5855 0.6393 0.4528 -0.0046 0.0682 0.0227 478 VAL A CB 3380 C CG1 . VAL A 419 ? 0.7298 0.7853 0.6074 -0.0058 0.0674 0.0232 478 VAL A CG1 3381 C CG2 . VAL A 419 ? 0.5128 0.5635 0.3759 -0.0049 0.0698 0.0213 478 VAL A CG2 3382 N N . LEU A 420 ? 0.6959 0.7541 0.5615 -0.0029 0.0659 0.0243 479 LEU A N 3383 C CA . LEU A 420 ? 0.6421 0.7037 0.5126 -0.0026 0.0646 0.0263 479 LEU A CA 3384 C C . LEU A 420 ? 0.6383 0.6995 0.5041 -0.0017 0.0638 0.0240 479 LEU A C 3385 O O . LEU A 420 ? 0.8281 0.8903 0.6880 -0.0005 0.0637 0.0254 479 LEU A O 3386 C CB . LEU A 420 ? 0.4049 0.4694 0.2753 -0.0019 0.0646 0.0309 479 LEU A CB 3387 C CG . LEU A 420 ? 0.5374 0.6027 0.4128 -0.0025 0.0652 0.0336 479 LEU A CG 3388 C CD1 . LEU A 420 ? 0.5573 0.6252 0.4314 -0.0013 0.0653 0.0381 479 LEU A CD1 3389 C CD2 . LEU A 420 ? 0.7267 0.7932 0.6126 -0.0038 0.0647 0.0335 479 LEU A CD2 3390 N N . VAL A 421 ? 0.6447 0.7044 0.5131 -0.0021 0.0632 0.0205 480 VAL A N 3391 C CA . VAL A 421 ? 0.6420 0.7011 0.5064 -0.0011 0.0624 0.0179 480 VAL A CA 3392 C C . VAL A 421 ? 0.7492 0.8104 0.6223 -0.0016 0.0607 0.0174 480 VAL A C 3393 O O . VAL A 421 ? 0.5901 0.6516 0.4713 -0.0029 0.0603 0.0172 480 VAL A O 3394 C CB . VAL A 421 ? 0.6251 0.6797 0.4828 -0.0006 0.0632 0.0134 480 VAL A CB 3395 C CG1 . VAL A 421 ? 0.6726 0.7251 0.5212 0.0000 0.0649 0.0138 480 VAL A CG1 3396 C CG2 . VAL A 421 ? 0.5255 0.5781 0.3892 -0.0017 0.0631 0.0112 480 VAL A CG2 3397 N N . ALA A 422 ? 0.7603 0.8231 0.6316 -0.0006 0.0597 0.0171 481 ALA A N 3398 C CA . ALA A 422 ? 0.5282 0.5932 0.4076 -0.0010 0.0580 0.0167 481 ALA A CA 3399 C C . ALA A 422 ? 0.6129 0.6750 0.4920 -0.0007 0.0573 0.0118 481 ALA A C 3400 O O . ALA A 422 ? 0.7275 0.7905 0.6144 -0.0013 0.0559 0.0107 481 ALA A O 3401 C CB . ALA A 422 ? 0.4179 0.4860 0.2958 0.0000 0.0572 0.0185 481 ALA A CB 3402 N N . GLU A 423 ? 0.7421 0.8005 0.6122 0.0003 0.0583 0.0089 482 GLU A N 3403 C CA . GLU A 423 ? 0.7525 0.8074 0.6211 0.0009 0.0579 0.0042 482 GLU A CA 3404 C C . GLU A 423 ? 0.7161 0.7668 0.5780 0.0011 0.0597 0.0026 482 GLU A C 3405 O O . GLU A 423 ? 0.8041 0.8543 0.6589 0.0015 0.0611 0.0040 482 GLU A O 3406 C CB . GLU A 423 ? 0.9051 0.9595 0.7684 0.0027 0.0571 0.0016 482 GLU A CB 3407 C CG . GLU A 423 ? 1.1769 1.2279 1.0396 0.0036 0.0564 -0.0033 482 GLU A CG 3408 C CD . GLU A 423 ? 1.2045 1.2541 1.0590 0.0059 0.0561 -0.0063 482 GLU A CD 3409 O OE1 . GLU A 423 ? 1.2212 1.2734 1.0726 0.0064 0.0559 -0.0044 482 GLU A OE1 3410 O OE2 . GLU A 423 ? 1.2393 1.2851 1.0901 0.0072 0.0561 -0.0104 482 GLU A OE2 3411 N N . TYR A 424 ? 0.7132 0.7610 0.5774 0.0008 0.0597 -0.0003 483 TYR A N 3412 C CA . TYR A 424 ? 0.7794 0.8231 0.6375 0.0010 0.0615 -0.0020 483 TYR A CA 3413 C C . TYR A 424 ? 0.7860 0.8257 0.6361 0.0030 0.0618 -0.0064 483 TYR A C 3414 O O . TYR A 424 ? 0.7312 0.7700 0.5837 0.0038 0.0605 -0.0092 483 TYR A O 3415 C CB . TYR A 424 ? 0.6628 0.7054 0.5277 -0.0005 0.0616 -0.0023 483 TYR A CB 3416 C CG . TYR A 424 ? 0.6147 0.6530 0.4737 -0.0002 0.0634 -0.0043 483 TYR A CG 3417 C CD1 . TYR A 424 ? 0.3442 0.3822 0.1985 -0.0006 0.0652 -0.0023 483 TYR A CD1 3418 C CD2 . TYR A 424 ? 0.4763 0.5107 0.3342 0.0005 0.0634 -0.0081 483 TYR A CD2 3419 C CE1 . TYR A 424 ? 0.4274 0.4616 0.2765 -0.0004 0.0670 -0.0041 483 TYR A CE1 3420 C CE2 . TYR A 424 ? 0.6262 0.6567 0.4788 0.0008 0.0652 -0.0098 483 TYR A CE2 3421 C CZ . TYR A 424 ? 0.7047 0.7350 0.5529 0.0003 0.0670 -0.0078 483 TYR A CZ 3422 O OH . TYR A 424 ? 0.7068 0.7332 0.5499 0.0006 0.0689 -0.0095 483 TYR A OH 3423 N N . ASN A 425 ? 0.8209 0.8582 0.6616 0.0038 0.0637 -0.0069 484 ASN A N 3424 C CA . ASN A 425 ? 0.9207 0.9537 0.7527 0.0059 0.0645 -0.0109 484 ASN A CA 3425 C C . ASN A 425 ? 0.9003 0.9295 0.7268 0.0058 0.0668 -0.0118 484 ASN A C 3426 O O . ASN A 425 ? 0.6800 0.7099 0.5029 0.0052 0.0681 -0.0093 484 ASN A O 3427 C CB . ASN A 425 ? 0.8062 0.8401 0.6306 0.0075 0.0644 -0.0110 484 ASN A CB 3428 C CG . ASN A 425 ? 0.7071 0.7446 0.5368 0.0077 0.0622 -0.0105 484 ASN A CG 3429 O OD1 . ASN A 425 ? 0.8529 0.8944 0.6847 0.0070 0.0616 -0.0071 484 ASN A OD1 3430 N ND2 . ASN A 425 ? 0.5189 0.5551 0.3511 0.0087 0.0609 -0.0139 484 ASN A ND2 3431 N N . ASN A 426 ? 0.9943 1.0195 0.8202 0.0065 0.0672 -0.0152 485 ASN A N 3432 C CA . ASN A 426 ? 0.9354 0.9566 0.7563 0.0065 0.0695 -0.0163 485 ASN A CA 3433 C C . ASN A 426 ? 1.0620 1.0794 0.8717 0.0088 0.0710 -0.0192 485 ASN A C 3434 O O . ASN A 426 ? 1.0688 1.0835 0.8760 0.0107 0.0706 -0.0226 485 ASN A O 3435 C CB . ASN A 426 ? 0.8739 0.8928 0.7006 0.0060 0.0692 -0.0181 485 ASN A CB 3436 C CG . ASN A 426 ? 1.0261 1.0412 0.8489 0.0058 0.0716 -0.0189 485 ASN A CG 3437 O OD1 . ASN A 426 ? 1.1161 1.1312 0.9338 0.0054 0.0732 -0.0173 485 ASN A OD1 3438 N ND2 . ASN A 426 ? 0.9739 0.9860 0.7993 0.0060 0.0716 -0.0212 485 ASN A ND2 3439 N N . PRO A 427 ? 1.1333 1.1501 0.9359 0.0088 0.0729 -0.0178 486 PRO A N 3440 C CA . PRO A 427 ? 1.2258 1.2390 1.0170 0.0109 0.0747 -0.0202 486 PRO A CA 3441 C C . PRO A 427 ? 1.1701 1.1778 0.9582 0.0124 0.0759 -0.0243 486 PRO A C 3442 O O . PRO A 427 ? 1.0972 1.1019 0.8776 0.0147 0.0766 -0.0273 486 PRO A O 3443 C CB . PRO A 427 ? 1.1141 1.1275 0.9012 0.0099 0.0765 -0.0176 486 PRO A CB 3444 C CG . PRO A 427 ? 1.0267 1.0449 0.8223 0.0076 0.0753 -0.0135 486 PRO A CG 3445 C CD . PRO A 427 ? 0.9719 0.9924 0.7771 0.0070 0.0730 -0.0135 486 PRO A CD 3446 N N . ASP A 428 ? 1.0221 1.0285 0.8160 0.0112 0.0762 -0.0245 487 ASP A N 3447 C CA . ASP A 428 ? 0.8908 0.8919 0.6818 0.0126 0.0776 -0.0280 487 ASP A CA 3448 C C . ASP A 428 ? 0.9335 0.9334 0.7278 0.0141 0.0757 -0.0309 487 ASP A C 3449 O O . ASP A 428 ? 1.1004 1.1037 0.8991 0.0140 0.0735 -0.0302 487 ASP A O 3450 C CB . ASP A 428 ? 1.0808 1.0809 0.8764 0.0107 0.0786 -0.0269 487 ASP A CB 3451 C CG . ASP A 428 ? 1.1039 1.1049 0.8963 0.0094 0.0804 -0.0244 487 ASP A CG 3452 O OD1 . ASP A 428 ? 0.9239 0.9265 0.7222 0.0073 0.0805 -0.0222 487 ASP A OD1 3453 O OD2 . ASP A 428 ? 1.1540 1.1540 0.9378 0.0105 0.0818 -0.0247 487 ASP A OD2 3454 N N . PRO B 3 ? 0.7284 0.7115 0.9543 -0.0891 0.0821 0.0443 62 PRO B N 3455 C CA . PRO B 3 ? 0.7262 0.7099 0.9590 -0.0913 0.0743 0.0433 62 PRO B CA 3456 C C . PRO B 3 ? 0.7827 0.7691 1.0150 -0.0912 0.0686 0.0422 62 PRO B C 3457 O O . PRO B 3 ? 0.7650 0.7539 1.0005 -0.0902 0.0710 0.0427 62 PRO B O 3458 C CB . PRO B 3 ? 0.6432 0.6281 0.8933 -0.0929 0.0763 0.0443 62 PRO B CB 3459 C CG . PRO B 3 ? 0.5153 0.4988 0.7650 -0.0917 0.0850 0.0459 62 PRO B CG 3460 C CD . PRO B 3 ? 0.5206 0.5041 0.7578 -0.0892 0.0887 0.0460 62 PRO B CD 3461 N N . HIS B 4 ? 0.6049 0.5904 0.8330 -0.0919 0.0611 0.0408 63 HIS B N 3462 C CA . HIS B 4 ? 0.4974 0.4851 0.7247 -0.0917 0.0554 0.0397 63 HIS B CA 3463 C C . HIS B 4 ? 0.6397 0.6303 0.8833 -0.0930 0.0532 0.0397 63 HIS B C 3464 O O . HIS B 4 ? 0.6181 0.6114 0.8643 -0.0925 0.0520 0.0394 63 HIS B O 3465 C CB . HIS B 4 ? 0.5849 0.5705 0.8032 -0.0920 0.0481 0.0382 63 HIS B CB 3466 C CG . HIS B 4 ? 0.6609 0.6441 0.8623 -0.0906 0.0495 0.0380 63 HIS B CG 3467 N ND1 . HIS B 4 ? 0.5341 0.5155 0.7298 -0.0898 0.0562 0.0390 63 HIS B ND1 3468 C CD2 . HIS B 4 ? 0.6634 0.6455 0.8522 -0.0897 0.0451 0.0370 63 HIS B CD2 3469 C CE1 . HIS B 4 ? 0.6379 0.6172 0.8182 -0.0886 0.0558 0.0384 63 HIS B CE1 3470 N NE2 . HIS B 4 ? 0.6023 0.5821 0.7783 -0.0885 0.0492 0.0372 63 HIS B NE2 3471 N N . GLN B 5 ? 0.5647 0.5548 0.8193 -0.0948 0.0525 0.0399 64 GLN B N 3472 C CA . GLN B 5 ? 0.5740 0.5668 0.8452 -0.0960 0.0516 0.0401 64 GLN B CA 3473 C C . GLN B 5 ? 0.5561 0.5494 0.8360 -0.0962 0.0595 0.0419 64 GLN B C 3474 O O . GLN B 5 ? 0.5758 0.5674 0.8608 -0.0973 0.0613 0.0425 64 GLN B O 3475 C CB . GLN B 5 ? 0.3858 0.3779 0.6649 -0.0979 0.0449 0.0390 64 GLN B CB 3476 C CG . GLN B 5 ? 0.5163 0.5082 0.7897 -0.0976 0.0366 0.0372 64 GLN B CG 3477 C CD . GLN B 5 ? 0.5814 0.5729 0.8645 -0.0992 0.0300 0.0360 64 GLN B CD 3478 O OE1 . GLN B 5 ? 0.6050 0.5985 0.9030 -0.1004 0.0302 0.0361 64 GLN B OE1 3479 N NE2 . GLN B 5 ? 0.4167 0.4058 0.6917 -0.0990 0.0241 0.0349 64 GLN B NE2 3480 N N . PRO B 6 ? 0.6045 0.6000 0.8857 -0.0949 0.0642 0.0429 65 PRO B N 3481 C CA . PRO B 6 ? 0.6124 0.6083 0.9002 -0.0945 0.0723 0.0448 65 PRO B CA 3482 C C . PRO B 6 ? 0.4608 0.4589 0.7667 -0.0962 0.0726 0.0455 65 PRO B C 3483 O O . PRO B 6 ? 0.4602 0.4600 0.7739 -0.0975 0.0664 0.0443 65 PRO B O 3484 C CB . PRO B 6 ? 0.3826 0.3802 0.6640 -0.0924 0.0761 0.0454 65 PRO B CB 3485 C CG . PRO B 6 ? 0.5361 0.5358 0.8166 -0.0925 0.0695 0.0440 65 PRO B CG 3486 C CD . PRO B 6 ? 0.4654 0.4632 0.7416 -0.0937 0.0623 0.0423 65 PRO B CD 3487 N N . ILE B 7 ? 0.5656 0.5637 0.8781 -0.0959 0.0797 0.0473 66 ILE B N 3488 C CA . ILE B 7 ? 0.6446 0.6449 0.9744 -0.0972 0.0812 0.0482 66 ILE B CA 3489 C C . ILE B 7 ? 0.5185 0.5227 0.8540 -0.0968 0.0797 0.0482 66 ILE B C 3490 O O . ILE B 7 ? 0.5784 0.5833 0.9043 -0.0951 0.0798 0.0479 66 ILE B O 3491 C CB . ILE B 7 ? 0.7156 0.7149 1.0500 -0.0966 0.0899 0.0504 66 ILE B CB 3492 C CG1 . ILE B 7 ? 0.5659 0.5652 0.8908 -0.0938 0.0960 0.0516 66 ILE B CG1 3493 C CG2 . ILE B 7 ? 0.6794 0.6750 1.0107 -0.0973 0.0914 0.0505 66 ILE B CG2 3494 C CD1 . ILE B 7 ? 0.7194 0.7180 1.0495 -0.0928 0.1047 0.0539 66 ILE B CD1 3495 N N . PRO B 8 ? 0.6347 0.6413 0.9859 -0.0983 0.0784 0.0483 67 PRO B N 3496 C CA . PRO B 8 ? 0.4613 0.4715 0.8188 -0.0977 0.0786 0.0487 67 PRO B CA 3497 C C . PRO B 8 ? 0.6080 0.6186 0.9622 -0.0956 0.0866 0.0508 67 PRO B C 3498 O O . PRO B 8 ? 0.5495 0.5588 0.9075 -0.0954 0.0928 0.0525 67 PRO B O 3499 C CB . PRO B 8 ? 0.4668 0.4790 0.8423 -0.0998 0.0772 0.0487 67 PRO B CB 3500 C CG . PRO B 8 ? 0.5714 0.5813 0.9482 -0.1015 0.0726 0.0474 67 PRO B CG 3501 C CD . PRO B 8 ? 0.6420 0.6482 1.0054 -0.1006 0.0758 0.0478 67 PRO B CD 3502 N N . PRO B 9 ? 0.5859 0.5982 0.9330 -0.0940 0.0865 0.0507 68 PRO B N 3503 C CA . PRO B 9 ? 0.6145 0.6270 0.9569 -0.0916 0.0937 0.0526 68 PRO B CA 3504 C C . PRO B 9 ? 0.6565 0.6704 1.0124 -0.0916 0.0996 0.0549 68 PRO B C 3505 O O . PRO B 9 ? 0.7049 0.7177 1.0580 -0.0898 0.1067 0.0567 68 PRO B O 3506 C CB . PRO B 9 ? 0.4566 0.4716 0.7935 -0.0905 0.0906 0.0518 68 PRO B CB 3507 C CG . PRO B 9 ? 0.5635 0.5801 0.9067 -0.0925 0.0827 0.0499 68 PRO B CG 3508 C CD . PRO B 9 ? 0.5351 0.5492 0.8789 -0.0942 0.0795 0.0488 68 PRO B CD 3509 N N . SER B 10 ? 0.5293 0.5455 0.8995 -0.0935 0.0967 0.0546 69 SER B N 3510 C CA . SER B 10 ? 0.6349 0.6525 1.0191 -0.0938 0.1018 0.0567 69 SER B CA 3511 C C . SER B 10 ? 0.6370 0.6517 1.0239 -0.0940 0.1072 0.0580 69 SER B C 3512 O O . SER B 10 ? 0.8208 0.8357 1.2146 -0.0932 0.1137 0.0603 69 SER B O 3513 C CB . SER B 10 ? 0.4575 0.4781 0.8564 -0.0960 0.0967 0.0558 69 SER B CB 3514 O OG . SER B 10 ? 0.6668 0.6859 1.0697 -0.0982 0.0921 0.0542 69 SER B OG 3515 N N . LEU B 11 ? 0.4331 0.4450 0.8143 -0.0951 0.1044 0.0567 70 LEU B N 3516 C CA . LEU B 11 ? 0.5085 0.5172 0.8911 -0.0953 0.1092 0.0578 70 LEU B CA 3517 C C . LEU B 11 ? 0.6145 0.6202 0.9822 -0.0929 0.1145 0.0585 70 LEU B C 3518 O O . LEU B 11 ? 0.6235 0.6261 0.9896 -0.0927 0.1187 0.0593 70 LEU B O 3519 C CB . LEU B 11 ? 0.5139 0.5210 0.8987 -0.0978 0.1035 0.0560 70 LEU B CB 3520 C CG . LEU B 11 ? 0.6306 0.6401 1.0313 -0.1003 0.0985 0.0551 70 LEU B CG 3521 C CD1 . LEU B 11 ? 0.3889 0.3964 0.7890 -0.1023 0.0926 0.0532 70 LEU B CD1 3522 C CD2 . LEU B 11 ? 0.3925 0.4031 0.8084 -0.1009 0.1042 0.0571 70 LEU B CD2 3523 N N . GLY B 12 ? 0.6967 0.7031 1.0535 -0.0908 0.1144 0.0583 71 GLY B N 3524 C CA . GLY B 12 ? 0.6242 0.6280 0.9665 -0.0883 0.1191 0.0587 71 GLY B CA 3525 C C . GLY B 12 ? 0.7045 0.7089 1.0468 -0.0856 0.1264 0.0610 71 GLY B C 3526 O O . GLY B 12 ? 0.8038 0.8106 1.1583 -0.0857 0.1286 0.0624 71 GLY B O 3527 N N . GLU B 13 ? 0.6817 0.6840 1.0104 -0.0830 0.1303 0.0611 72 GLU B N 3528 C CA . GLU B 13 ? 0.8773 0.8799 1.2041 -0.0799 0.1371 0.0631 72 GLU B CA 3529 C C . GLU B 13 ? 0.8523 0.8586 1.1816 -0.0795 0.1346 0.0632 72 GLU B C 3530 O O . GLU B 13 ? 0.8328 0.8402 1.1544 -0.0798 0.1292 0.0614 72 GLU B O 3531 C CB . GLU B 13 ? 1.0196 1.0191 1.3300 -0.0772 0.1406 0.0628 72 GLU B CB 3532 C CG . GLU B 13 ? 1.1576 1.1576 1.4636 -0.0737 0.1465 0.0643 72 GLU B CG 3533 C CD . GLU B 13 ? 1.2627 1.2591 1.5541 -0.0709 0.1510 0.0641 72 GLU B CD 3534 O OE1 . GLU B 13 ? 1.2730 1.2671 1.5560 -0.0717 0.1486 0.0624 72 GLU B OE1 3535 O OE2 . GLU B 13 ? 1.3219 1.3179 1.6100 -0.0677 0.1568 0.0655 72 GLU B OE2 3536 N N . LYS B 14 ? 0.8200 0.8283 1.1600 -0.0788 0.1386 0.0653 73 LYS B N 3537 C CA . LYS B 14 ? 0.7981 0.8100 1.1414 -0.0784 0.1365 0.0655 73 LYS B CA 3538 C C . LYS B 14 ? 0.8439 0.8557 1.1739 -0.0754 0.1383 0.0655 73 LYS B C 3539 O O . LYS B 14 ? 0.9882 0.9982 1.3132 -0.0726 0.1448 0.0670 73 LYS B O 3540 C CB . LYS B 14 ? 0.7918 0.8058 1.1499 -0.0782 0.1407 0.0680 73 LYS B CB 3541 C CG . LYS B 14 ? 0.9185 0.9365 1.2815 -0.0782 0.1379 0.0682 73 LYS B CG 3542 C CD . LYS B 14 ? 1.0911 1.1111 1.4559 -0.0810 0.1292 0.0656 73 LYS B CD 3543 C CE . LYS B 14 ? 1.1236 1.1474 1.4914 -0.0808 0.1263 0.0656 73 LYS B CE 3544 N NZ . LYS B 14 ? 0.9176 0.9430 1.2859 -0.0832 0.1178 0.0629 73 LYS B NZ 3545 N N . ASP B 15 ? 0.8712 0.8849 1.1955 -0.0759 0.1324 0.0638 74 ASP B N 3546 C CA . ASP B 15 ? 0.8140 0.8280 1.1264 -0.0733 0.1334 0.0636 74 ASP B CA 3547 C C . ASP B 15 ? 0.9149 0.9314 1.2336 -0.0715 0.1370 0.0656 74 ASP B C 3548 O O . ASP B 15 ? 1.0457 1.0654 1.3733 -0.0730 0.1336 0.0657 74 ASP B O 3549 C CB . ASP B 15 ? 0.7138 0.7289 1.0184 -0.0745 0.1260 0.0610 74 ASP B CB 3550 C CG . ASP B 15 ? 0.8570 0.8719 1.1482 -0.0719 0.1269 0.0606 74 ASP B CG 3551 O OD1 . ASP B 15 ? 0.9730 0.9891 1.2584 -0.0726 0.1213 0.0588 74 ASP B OD1 3552 O OD2 . ASP B 15 ? 0.9989 1.0123 1.2853 -0.0691 0.1332 0.0620 74 ASP B OD2 3553 N N . LEU B 16 ? 0.9326 0.9477 1.2464 -0.0683 0.1437 0.0673 75 LEU B N 3554 C CA . LEU B 16 ? 0.9301 0.9471 1.2494 -0.0663 0.1477 0.0696 75 LEU B CA 3555 C C . LEU B 16 ? 0.9346 0.9528 1.2435 -0.0641 0.1468 0.0691 75 LEU B C 3556 O O . LEU B 16 ? 0.9109 0.9307 1.2225 -0.0621 0.1497 0.0708 75 LEU B O 3557 C CB . LEU B 16 ? 0.8533 0.8680 1.1753 -0.0638 0.1560 0.0721 75 LEU B CB 3558 C CG . LEU B 16 ? 0.8950 0.9085 1.2282 -0.0657 0.1579 0.0730 75 LEU B CG 3559 C CD1 . LEU B 16 ? 0.8851 0.8962 1.2202 -0.0627 0.1666 0.0756 75 LEU B CD1 3560 C CD2 . LEU B 16 ? 0.7756 0.7925 1.1237 -0.0686 0.1542 0.0733 75 LEU B CD2 3561 N N . SER B 17 ? 0.7590 0.7762 1.0560 -0.0644 0.1427 0.0667 76 SER B N 3562 C CA . SER B 17 ? 0.7106 0.7287 0.9968 -0.0625 0.1417 0.0659 76 SER B CA 3563 C C . SER B 17 ? 0.7434 0.7653 1.0352 -0.0635 0.1374 0.0658 76 SER B C 3564 O O . SER B 17 ? 0.7983 0.8221 1.0999 -0.0663 0.1333 0.0654 76 SER B O 3565 C CB . SER B 17 ? 0.7285 0.7447 1.0014 -0.0629 0.1380 0.0633 76 SER B CB 3566 O OG . SER B 17 ? 0.9055 0.9227 1.1812 -0.0662 0.1310 0.0615 76 SER B OG 3567 N N . ASP B 18 ? 0.9609 0.9839 1.2462 -0.0612 0.1383 0.0661 77 ASP B N 3568 C CA . ASP B 18 ? 0.8695 0.8960 1.1586 -0.0619 0.1346 0.0660 77 ASP B CA 3569 C C . ASP B 18 ? 0.8742 0.9015 1.1578 -0.0640 0.1271 0.0631 77 ASP B C 3570 O O . ASP B 18 ? 0.8570 0.8830 1.1283 -0.0631 0.1259 0.0616 77 ASP B O 3571 C CB . ASP B 18 ? 0.9309 0.9581 1.2145 -0.0585 0.1383 0.0673 77 ASP B CB 3572 C CG . ASP B 18 ? 1.0771 1.1079 1.3648 -0.0590 0.1349 0.0674 77 ASP B CG 3573 O OD1 . ASP B 18 ? 1.1107 1.1421 1.3922 -0.0566 0.1365 0.0679 77 ASP B OD1 3574 O OD2 . ASP B 18 ? 1.0841 1.1170 1.3810 -0.0617 0.1307 0.0669 77 ASP B OD2 3575 N N . PRO B 19 ? 0.7276 0.7571 1.0205 -0.0669 0.1221 0.0624 78 PRO B N 3576 C CA . PRO B 19 ? 0.6160 0.6462 0.9051 -0.0689 0.1148 0.0598 78 PRO B CA 3577 C C . PRO B 19 ? 0.5847 0.6166 0.8665 -0.0677 0.1126 0.0590 78 PRO B C 3578 O O . PRO B 19 ? 0.7717 0.8040 1.0484 -0.0689 0.1069 0.0568 78 PRO B O 3579 C CB . PRO B 19 ? 0.7042 0.7365 1.0072 -0.0716 0.1112 0.0597 78 PRO B CB 3580 C CG . PRO B 19 ? 0.6670 0.6988 0.9800 -0.0714 0.1167 0.0620 78 PRO B CG 3581 C CD . PRO B 19 ? 0.7011 0.7321 1.0090 -0.0681 0.1233 0.0640 78 PRO B CD 3582 N N . PHE B 20 ? 0.5962 0.6291 0.8775 -0.0652 0.1172 0.0609 79 PHE B N 3583 C CA . PHE B 20 ? 0.8302 0.8649 1.1056 -0.0640 0.1156 0.0604 79 PHE B CA 3584 C C . PHE B 20 ? 0.7973 0.8305 1.0624 -0.0607 0.1205 0.0612 79 PHE B C 3585 O O . PHE B 20 ? 0.8379 0.8725 1.1008 -0.0588 0.1219 0.0621 79 PHE B O 3586 C CB . PHE B 20 ? 0.6588 0.6967 0.9447 -0.0642 0.1153 0.0618 79 PHE B CB 3587 C CG . PHE B 20 ? 0.6253 0.6648 0.9217 -0.0673 0.1105 0.0609 79 PHE B CG 3588 C CD1 . PHE B 20 ? 0.7246 0.7654 1.0190 -0.0688 0.1039 0.0586 79 PHE B CD1 3589 C CD2 . PHE B 20 ? 0.4894 0.5291 0.7977 -0.0685 0.1124 0.0622 79 PHE B CD2 3590 C CE1 . PHE B 20 ? 0.5978 0.6401 0.9018 -0.0714 0.0994 0.0575 79 PHE B CE1 3591 C CE2 . PHE B 20 ? 0.6121 0.6533 0.9302 -0.0712 0.1078 0.0611 79 PHE B CE2 3592 C CZ . PHE B 20 ? 0.7138 0.7562 1.0296 -0.0726 0.1012 0.0588 79 PHE B CZ 3593 N N . ASN B 21 ? 0.9026 0.9327 1.1612 -0.0599 0.1231 0.0609 80 ASN B N 3594 C CA . ASN B 21 ? 0.8407 0.8690 1.0885 -0.0568 0.1275 0.0612 80 ASN B CA 3595 C C . ASN B 21 ? 0.8196 0.8473 1.0549 -0.0568 0.1235 0.0587 80 ASN B C 3596 O O . ASN B 21 ? 1.0862 1.1115 1.3112 -0.0553 0.1253 0.0579 80 ASN B O 3597 C CB . ASN B 21 ? 0.9123 0.9374 1.1589 -0.0558 0.1324 0.0620 80 ASN B CB 3598 C CG . ASN B 21 ? 0.9693 0.9924 1.2064 -0.0520 0.1379 0.0626 80 ASN B CG 3599 O OD1 . ASN B 21 ? 1.0164 1.0408 1.2508 -0.0499 0.1392 0.0633 80 ASN B OD1 3600 N ND2 . ASN B 21 ? 0.9797 0.9997 1.2118 -0.0510 0.1411 0.0624 80 ASN B ND2 3601 N N . PHE B 22 ? 0.6796 0.7096 0.9158 -0.0583 0.1180 0.0575 81 PHE B N 3602 C CA . PHE B 22 ? 0.7397 0.7696 0.9649 -0.0583 0.1141 0.0553 81 PHE B CA 3603 C C . PHE B 22 ? 0.8462 0.8784 1.0698 -0.0569 0.1139 0.0556 81 PHE B C 3604 O O . PHE B 22 ? 0.8699 0.9043 1.1024 -0.0570 0.1146 0.0572 81 PHE B O 3605 C CB . PHE B 22 ? 0.7266 0.7567 0.9529 -0.0614 0.1073 0.0532 81 PHE B CB 3606 C CG . PHE B 22 ? 0.7012 0.7340 0.9384 -0.0633 0.1037 0.0534 81 PHE B CG 3607 C CD1 . PHE B 22 ? 0.5475 0.5824 0.7830 -0.0635 0.1000 0.0525 81 PHE B CD1 3608 C CD2 . PHE B 22 ? 0.5690 0.6023 0.8181 -0.0650 0.1040 0.0544 81 PHE B CD2 3609 C CE1 . PHE B 22 ? 0.5736 0.6110 0.8188 -0.0651 0.0967 0.0525 81 PHE B CE1 3610 C CE2 . PHE B 22 ? 0.5363 0.5722 0.7955 -0.0667 0.1007 0.0544 81 PHE B CE2 3611 C CZ . PHE B 22 ? 0.4584 0.4963 0.7154 -0.0667 0.0970 0.0534 81 PHE B CZ 3612 N N . LEU B 23 ? 0.8754 0.9071 1.0876 -0.0556 0.1129 0.0543 82 LEU B N 3613 C CA . LEU B 23 ? 0.9377 0.9714 1.1476 -0.0542 0.1126 0.0545 82 LEU B CA 3614 C C . LEU B 23 ? 0.9046 0.9401 1.1155 -0.0564 0.1062 0.0528 82 LEU B C 3615 O O . LEU B 23 ? 1.0248 1.0593 1.2296 -0.0578 0.1021 0.0507 82 LEU B O 3616 C CB . LEU B 23 ? 1.0629 1.0951 1.2604 -0.0516 0.1150 0.0538 82 LEU B CB 3617 C CG . LEU B 23 ? 1.1054 1.1361 1.3010 -0.0485 0.1218 0.0555 82 LEU B CG 3618 C CD1 . LEU B 23 ? 1.0226 1.0515 1.2050 -0.0463 0.1230 0.0541 82 LEU B CD1 3619 C CD2 . LEU B 23 ? 1.0859 1.1185 1.2882 -0.0467 0.1250 0.0579 82 LEU B CD2 3620 N N . PHE B 24 ? 0.9189 0.9572 1.1372 -0.0567 0.1054 0.0538 83 PHE B N 3621 C CA . PHE B 24 ? 0.9187 0.9587 1.1375 -0.0583 0.0997 0.0522 83 PHE B CA 3622 C C . PHE B 24 ? 1.0010 1.0435 1.2207 -0.0570 0.1003 0.0531 83 PHE B C 3623 O O . PHE B 24 ? 0.9492 0.9929 1.1754 -0.0558 0.1041 0.0554 83 PHE B O 3624 C CB . PHE B 24 ? 0.9571 0.9979 1.1861 -0.0611 0.0960 0.0519 83 PHE B CB 3625 C CG . PHE B 24 ? 0.9160 0.9577 1.1436 -0.0628 0.0895 0.0496 83 PHE B CG 3626 C CD1 . PHE B 24 ? 0.7327 0.7726 0.9546 -0.0641 0.0857 0.0475 83 PHE B CD1 3627 C CD2 . PHE B 24 ? 0.7629 0.8072 0.9945 -0.0630 0.0873 0.0496 83 PHE B CD2 3628 C CE1 . PHE B 24 ? 0.7740 0.8144 0.9943 -0.0654 0.0798 0.0455 83 PHE B CE1 3629 C CE2 . PHE B 24 ? 0.7236 0.7684 0.9535 -0.0643 0.0815 0.0475 83 PHE B CE2 3630 C CZ . PHE B 24 ? 0.7583 0.8011 0.9827 -0.0655 0.0778 0.0455 83 PHE B CZ 3631 N N . SER B 25 ? 1.1572 1.2003 1.3703 -0.0571 0.0967 0.0514 84 SER B N 3632 C CA . SER B 25 ? 1.2298 1.2751 1.4429 -0.0560 0.0967 0.0520 84 SER B CA 3633 C C . SER B 25 ? 1.1812 1.2276 1.3932 -0.0577 0.0906 0.0499 84 SER B C 3634 O O . SER B 25 ? 1.1994 1.2443 1.4063 -0.0589 0.0871 0.0479 84 SER B O 3635 C CB . SER B 25 ? 1.1755 1.2201 1.3791 -0.0532 0.1001 0.0524 84 SER B CB 3636 O OG . SER B 25 ? 1.1181 1.1648 1.3214 -0.0521 0.0999 0.0529 84 SER B OG 3637 N N . SER B 26 ? 1.0986 1.1475 1.3151 -0.0577 0.0895 0.0504 85 SER B N 3638 C CA . SER B 26 ? 1.1343 1.1842 1.3503 -0.0591 0.0839 0.0484 85 SER B CA 3639 C C . SER B 26 ? 1.1029 1.1538 1.3119 -0.0577 0.0835 0.0480 85 SER B C 3640 O O . SER B 26 ? 1.0889 1.1408 1.2975 -0.0558 0.0872 0.0497 85 SER B O 3641 C CB . SER B 26 ? 1.0738 1.1257 1.3016 -0.0607 0.0819 0.0489 85 SER B CB 3642 O OG . SER B 26 ? 1.0289 1.0831 1.2614 -0.0595 0.0847 0.0509 85 SER B OG 3643 N N . ASN B 27 ? 1.0098 1.0603 1.2133 -0.0585 0.0789 0.0457 86 ASN B N 3644 C CA . ASN B 27 ? 0.9397 0.9910 1.1364 -0.0575 0.0779 0.0449 86 ASN B CA 3645 C C . ASN B 27 ? 0.9204 0.9744 1.1236 -0.0572 0.0779 0.0460 86 ASN B C 3646 O O . ASN B 27 ? 1.0253 1.0805 1.2355 -0.0587 0.0748 0.0455 86 ASN B O 3647 C CB . ASN B 27 ? 0.8415 0.8916 1.0320 -0.0586 0.0728 0.0422 86 ASN B CB 3648 C CG . ASN B 27 ? 0.9572 1.0078 1.1398 -0.0574 0.0719 0.0413 86 ASN B CG 3649 O OD1 . ASN B 27 ? 0.8753 0.9279 1.0605 -0.0569 0.0719 0.0419 86 ASN B OD1 3650 N ND2 . ASN B 27 ? 1.1263 1.1750 1.2991 -0.0570 0.0712 0.0399 86 ASN B ND2 3651 N N . LYS B 28 ? 0.9059 0.9608 1.1066 -0.0552 0.0814 0.0476 87 LYS B N 3652 C CA . LYS B 28 ? 0.8656 0.9231 1.0725 -0.0547 0.0821 0.0490 87 LYS B CA 3653 C C . LYS B 28 ? 0.7811 0.8396 0.9837 -0.0548 0.0786 0.0475 87 LYS B C 3654 O O . LYS B 28 ? 0.7389 0.7995 0.9466 -0.0549 0.0778 0.0481 87 LYS B O 3655 C CB . LYS B 28 ? 0.8118 0.8697 1.0183 -0.0523 0.0876 0.0516 87 LYS B CB 3656 C CG . LYS B 28 ? 0.8445 0.9010 1.0535 -0.0518 0.0916 0.0531 87 LYS B CG 3657 C CD . LYS B 28 ? 0.9521 1.0092 1.1627 -0.0493 0.0969 0.0559 87 LYS B CD 3658 C CE . LYS B 28 ? 1.1168 1.1719 1.3274 -0.0483 0.1011 0.0570 87 LYS B CE 3659 N NZ . LYS B 28 ? 1.0390 1.0936 1.2574 -0.0504 0.1002 0.0569 87 LYS B NZ 3660 N N . ILE B 29 ? 0.7524 0.8093 0.9456 -0.0547 0.0767 0.0455 88 ILE B N 3661 C CA . ILE B 29 ? 0.9179 0.9755 1.1064 -0.0548 0.0733 0.0438 88 ILE B CA 3662 C C . ILE B 29 ? 0.9487 1.0066 1.1424 -0.0567 0.0685 0.0422 88 ILE B C 3663 O O . ILE B 29 ? 0.8947 0.9543 1.0913 -0.0569 0.0666 0.0419 88 ILE B O 3664 C CB . ILE B 29 ? 0.7920 0.8476 0.9691 -0.0541 0.0725 0.0421 88 ILE B CB 3665 C CG1 . ILE B 29 ? 0.7439 0.7992 0.9154 -0.0519 0.0771 0.0435 88 ILE B CG1 3666 C CG2 . ILE B 29 ? 0.4739 0.5299 0.6467 -0.0544 0.0688 0.0402 88 ILE B CG2 3667 C CD1 . ILE B 29 ? 0.7866 0.8403 0.9575 -0.0515 0.0803 0.0443 88 ILE B CD1 3668 N N . THR B 30 ? 0.9822 1.0384 1.1767 -0.0580 0.0665 0.0411 89 THR B N 3669 C CA . THR B 30 ? 0.9133 0.9695 1.1132 -0.0598 0.0619 0.0395 89 THR B CA 3670 C C . THR B 30 ? 0.8980 0.9566 1.1094 -0.0604 0.0624 0.0409 89 THR B C 3671 O O . THR B 30 ? 0.8894 0.9491 1.1050 -0.0611 0.0591 0.0398 89 THR B O 3672 C CB . THR B 30 ? 0.9576 1.0116 1.1570 -0.0610 0.0603 0.0385 89 THR B CB 3673 O OG1 . THR B 30 ? 1.0449 1.0968 1.2336 -0.0605 0.0593 0.0371 89 THR B OG1 3674 C CG2 . THR B 30 ? 0.9236 0.9776 1.1293 -0.0626 0.0555 0.0369 89 THR B CG2 3675 N N . LEU B 31 ? 0.6680 0.7271 0.8843 -0.0599 0.0667 0.0432 90 LEU B N 3676 C CA . LEU B 31 ? 0.6791 0.7403 0.9067 -0.0605 0.0678 0.0448 90 LEU B CA 3677 C C . LEU B 31 ? 0.8031 0.8668 1.0330 -0.0599 0.0673 0.0452 90 LEU B C 3678 O O . LEU B 31 ? 0.7728 0.8380 1.0101 -0.0609 0.0646 0.0446 90 LEU B O 3679 C CB . LEU B 31 ? 0.6351 0.6963 0.8659 -0.0596 0.0732 0.0475 90 LEU B CB 3680 C CG . LEU B 31 ? 0.7140 0.7771 0.9564 -0.0599 0.0754 0.0496 90 LEU B CG 3681 C CD1 . LEU B 31 ? 0.5884 0.6516 0.8392 -0.0621 0.0719 0.0484 90 LEU B CD1 3682 C CD2 . LEU B 31 ? 0.7666 0.8290 1.0101 -0.0587 0.0810 0.0522 90 LEU B CD2 3683 N N . ARG B 32 ? 0.8546 0.9188 1.0784 -0.0581 0.0698 0.0462 91 ARG B N 3684 C CA . ARG B 32 ? 0.9990 1.0654 1.2240 -0.0574 0.0695 0.0467 91 ARG B CA 3685 C C . ARG B 32 ? 0.9181 0.9845 1.1388 -0.0579 0.0647 0.0440 91 ARG B C 3686 O O . ARG B 32 ? 0.7218 0.7900 0.9464 -0.0580 0.0630 0.0438 91 ARG B O 3687 C CB . ARG B 32 ? 0.9996 1.0666 1.2195 -0.0552 0.0737 0.0487 91 ARG B CB 3688 C CG . ARG B 32 ? 1.0030 1.0707 1.2292 -0.0543 0.0785 0.0518 91 ARG B CG 3689 C CD . ARG B 32 ? 1.0128 1.0808 1.2338 -0.0518 0.0827 0.0538 91 ARG B CD 3690 N NE . ARG B 32 ? 1.0499 1.1183 1.2770 -0.0508 0.0873 0.0567 91 ARG B NE 3691 C CZ . ARG B 32 ? 1.0790 1.1478 1.3041 -0.0484 0.0914 0.0591 91 ARG B CZ 3692 N NH1 . ARG B 32 ? 1.1629 1.2320 1.3805 -0.0469 0.0912 0.0588 91 ARG B NH1 3693 N NH2 . ARG B 32 ? 0.9558 1.0248 1.1869 -0.0474 0.0955 0.0617 91 ARG B NH2 3694 N N . LYS B 33 ? 0.7704 0.8345 0.9830 -0.0581 0.0626 0.0420 92 LYS B N 3695 C CA . LYS B 33 ? 0.7022 0.7659 0.9107 -0.0585 0.0580 0.0394 92 LYS B CA 3696 C C . LYS B 33 ? 0.9089 0.9732 1.1260 -0.0600 0.0543 0.0382 92 LYS B C 3697 O O . LYS B 33 ? 0.7120 0.7771 0.9299 -0.0601 0.0512 0.0368 92 LYS B O 3698 C CB . LYS B 33 ? 0.5062 0.5673 0.7053 -0.0585 0.0564 0.0376 92 LYS B CB 3699 C CG . LYS B 33 ? 0.6499 0.7102 0.8441 -0.0586 0.0520 0.0350 92 LYS B CG 3700 C CD . LYS B 33 ? 0.7657 0.8251 0.9491 -0.0574 0.0528 0.0345 92 LYS B CD 3701 C CE . LYS B 33 ? 0.8907 0.9492 1.0694 -0.0573 0.0486 0.0320 92 LYS B CE 3702 N NZ . LYS B 33 ? 0.8739 0.9345 1.0579 -0.0573 0.0471 0.0318 92 LYS B NZ 3703 N N . LEU B 34 ? 0.9508 1.0147 1.1742 -0.0611 0.0547 0.0387 93 LEU B N 3704 C CA . LEU B 34 ? 0.8787 0.9432 1.1115 -0.0625 0.0515 0.0378 93 LEU B CA 3705 C C . LEU B 34 ? 0.7915 0.8590 1.0327 -0.0624 0.0529 0.0393 93 LEU B C 3706 O O . LEU B 34 ? 0.6960 0.7646 0.9425 -0.0630 0.0497 0.0379 93 LEU B O 3707 C CB . LEU B 34 ? 0.8148 0.8780 1.0521 -0.0637 0.0521 0.0382 93 LEU B CB 3708 C CG . LEU B 34 ? 0.6442 0.7045 0.8754 -0.0642 0.0492 0.0362 93 LEU B CG 3709 C CD1 . LEU B 34 ? 0.6726 0.7317 0.9070 -0.0651 0.0511 0.0372 93 LEU B CD1 3710 C CD2 . LEU B 34 ? 0.5574 0.6173 0.7907 -0.0650 0.0435 0.0335 93 LEU B CD2 3711 N N . TYR B 35 ? 0.9157 0.9843 1.1580 -0.0614 0.0577 0.0420 94 TYR B N 3712 C CA . TYR B 35 ? 1.0081 1.0795 1.2576 -0.0610 0.0597 0.0439 94 TYR B CA 3713 C C . TYR B 35 ? 0.9586 1.0313 1.2046 -0.0603 0.0577 0.0429 94 TYR B C 3714 O O . TYR B 35 ? 0.8483 0.9228 1.1007 -0.0607 0.0558 0.0425 94 TYR B O 3715 C CB . TYR B 35 ? 0.8572 0.9290 1.1067 -0.0598 0.0654 0.0471 94 TYR B CB 3716 C CG . TYR B 35 ? 0.9204 0.9949 1.1766 -0.0590 0.0679 0.0494 94 TYR B CG 3717 C CD1 . TYR B 35 ? 0.8932 0.9691 1.1605 -0.0598 0.0694 0.0510 94 TYR B CD1 3718 C CD2 . TYR B 35 ? 0.9333 1.0091 1.1849 -0.0576 0.0687 0.0501 94 TYR B CD2 3719 C CE1 . TYR B 35 ? 0.8895 0.9678 1.1629 -0.0591 0.0717 0.0533 94 TYR B CE1 3720 C CE2 . TYR B 35 ? 0.8659 0.9442 1.1232 -0.0568 0.0710 0.0524 94 TYR B CE2 3721 C CZ . TYR B 35 ? 0.9315 1.0110 1.1997 -0.0576 0.0724 0.0540 94 TYR B CZ 3722 O OH . TYR B 35 ? 1.0021 1.0841 1.2762 -0.0567 0.0747 0.0564 94 TYR B OH 3723 N N . ASP B 36 ? 0.8504 0.9221 1.0860 -0.0591 0.0581 0.0425 95 ASP B N 3724 C CA . ASP B 36 ? 0.9379 1.0106 1.1689 -0.0582 0.0567 0.0416 95 ASP B CA 3725 C C . ASP B 36 ? 0.8596 0.9320 1.0916 -0.0591 0.0514 0.0386 95 ASP B C 3726 O O . ASP B 36 ? 0.8289 0.9030 1.0628 -0.0588 0.0500 0.0382 95 ASP B O 3727 C CB . ASP B 36 ? 1.0379 1.1091 1.2573 -0.0569 0.0580 0.0415 95 ASP B CB 3728 C CG . ASP B 36 ? 1.1779 1.2496 1.3959 -0.0556 0.0632 0.0444 95 ASP B CG 3729 O OD1 . ASP B 36 ? 1.2369 1.3101 1.4625 -0.0555 0.0658 0.0467 95 ASP B OD1 3730 O OD2 . ASP B 36 ? 1.1702 1.2405 1.3793 -0.0545 0.0646 0.0443 95 ASP B OD2 3731 N N . LEU B 37 ? 0.7801 0.8503 1.0105 -0.0600 0.0485 0.0366 96 LEU B N 3732 C CA . LEU B 37 ? 0.7344 0.8039 0.9650 -0.0605 0.0434 0.0336 96 LEU B CA 3733 C C . LEU B 37 ? 0.8017 0.8729 1.0436 -0.0615 0.0414 0.0332 96 LEU B C 3734 O O . LEU B 37 ? 0.9316 1.0025 1.1749 -0.0617 0.0371 0.0308 96 LEU B O 3735 C CB . LEU B 37 ? 0.7803 0.8468 1.0054 -0.0610 0.0409 0.0317 96 LEU B CB 3736 C CG . LEU B 37 ? 0.8563 0.9209 1.0695 -0.0600 0.0411 0.0310 96 LEU B CG 3737 C CD1 . LEU B 37 ? 0.8410 0.9029 1.0501 -0.0605 0.0400 0.0301 96 LEU B CD1 3738 C CD2 . LEU B 37 ? 0.8409 0.9053 1.0495 -0.0593 0.0377 0.0287 96 LEU B CD2 3739 N N . THR B 38 ? 0.7286 0.8013 0.9787 -0.0621 0.0444 0.0356 97 THR B N 3740 C CA . THR B 38 ? 0.8148 0.8890 1.0764 -0.0632 0.0427 0.0352 97 THR B CA 3741 C C . THR B 38 ? 0.8760 0.9532 1.1455 -0.0631 0.0459 0.0377 97 THR B C 3742 O O . THR B 38 ? 0.9306 1.0092 1.2101 -0.0640 0.0448 0.0376 97 THR B O 3743 C CB . THR B 38 ? 0.7130 0.7856 0.9792 -0.0645 0.0423 0.0351 97 THR B CB 3744 O OG1 . THR B 38 ? 0.6298 0.7018 0.8939 -0.0643 0.0470 0.0377 97 THR B OG1 3745 C CG2 . THR B 38 ? 0.6330 0.7028 0.8933 -0.0648 0.0381 0.0323 97 THR B CG2 3746 N N . LYS B 39 ? 0.7116 0.7896 0.9768 -0.0618 0.0499 0.0401 98 LYS B N 3747 C CA . LYS B 39 ? 0.8742 0.9549 1.1465 -0.0614 0.0532 0.0428 98 LYS B CA 3748 C C . LYS B 39 ? 0.8727 0.9558 1.1490 -0.0614 0.0507 0.0417 98 LYS B C 3749 O O . LYS B 39 ? 0.8962 0.9817 1.1804 -0.0614 0.0524 0.0435 98 LYS B O 3750 C CB . LYS B 39 ? 0.9413 1.0223 1.2074 -0.0598 0.0578 0.0455 98 LYS B CB 3751 C CG . LYS B 39 ? 1.0271 1.1076 1.2827 -0.0585 0.0570 0.0445 98 LYS B CG 3752 C CD . LYS B 39 ? 1.0009 1.0819 1.2518 -0.0569 0.0616 0.0474 98 LYS B CD 3753 C CE . LYS B 39 ? 0.9351 1.0156 1.1755 -0.0556 0.0609 0.0464 98 LYS B CE 3754 N NZ . LYS B 39 ? 0.8382 0.9194 1.0748 -0.0538 0.0652 0.0493 98 LYS B NZ 3755 N N . ASN B 40 ? 0.9451 1.0273 1.2157 -0.0611 0.0467 0.0388 99 ASN B N 3756 C CA . ASN B 40 ? 1.0200 1.1041 1.2931 -0.0609 0.0441 0.0375 99 ASN B CA 3757 C C . ASN B 40 ? 0.8881 0.9717 1.1669 -0.0619 0.0393 0.0344 99 ASN B C 3758 O O . ASN B 40 ? 0.8790 0.9638 1.1592 -0.0616 0.0364 0.0326 99 ASN B O 3759 C CB . ASN B 40 ? 1.0481 1.1316 1.3104 -0.0595 0.0434 0.0365 99 ASN B CB 3760 C CG . ASN B 40 ? 0.9827 1.0669 1.2398 -0.0582 0.0480 0.0395 99 ASN B CG 3761 O OD1 . ASN B 40 ? 0.8569 0.9430 1.1197 -0.0580 0.0513 0.0422 99 ASN B OD1 3762 N ND2 . ASN B 40 ? 1.0598 1.1423 1.3062 -0.0573 0.0482 0.0389 99 ASN B ND2 3763 N N . VAL B 41 ? 0.8778 0.9598 1.1598 -0.0630 0.0383 0.0338 100 VAL B N 3764 C CA . VAL B 41 ? 0.8436 0.9250 1.1314 -0.0640 0.0337 0.0310 100 VAL B CA 3765 C C . VAL B 41 ? 0.8537 0.9377 1.1547 -0.0650 0.0341 0.0319 100 VAL B C 3766 O O . VAL B 41 ? 0.9010 0.9857 1.2075 -0.0656 0.0377 0.0345 100 VAL B O 3767 C CB . VAL B 41 ? 0.7281 0.8065 1.0135 -0.0647 0.0322 0.0299 100 VAL B CB 3768 C CG1 . VAL B 41 ? 0.7236 0.8014 1.0154 -0.0655 0.0273 0.0271 100 VAL B CG1 3769 C CG2 . VAL B 41 ? 0.6350 0.7110 0.9076 -0.0637 0.0316 0.0290 100 VAL B CG2 3770 N N . ASP B 42 ? 0.8681 0.9532 1.1740 -0.0650 0.0304 0.0295 101 ASP B N 3771 C CA . ASP B 42 ? 0.9153 1.0029 1.2340 -0.0659 0.0303 0.0300 101 ASP B CA 3772 C C . ASP B 42 ? 0.9411 1.0274 1.2669 -0.0674 0.0280 0.0287 101 ASP B C 3773 O O . ASP B 42 ? 1.0461 1.1317 1.3745 -0.0675 0.0233 0.0256 101 ASP B O 3774 C CB . ASP B 42 ? 0.9740 1.0635 1.2952 -0.0653 0.0272 0.0279 101 ASP B CB 3775 C CG . ASP B 42 ? 1.0702 1.1626 1.4046 -0.0662 0.0275 0.0285 101 ASP B CG 3776 O OD1 . ASP B 42 ? 0.9469 1.0400 1.2885 -0.0672 0.0306 0.0309 101 ASP B OD1 3777 O OD2 . ASP B 42 ? 1.1828 1.2767 1.5203 -0.0657 0.0247 0.0265 101 ASP B OD2 3778 N N . PHE B 43 ? 0.8259 0.9116 1.1545 -0.0683 0.0314 0.0311 102 PHE B N 3779 C CA . PHE B 43 ? 0.8781 0.9625 1.2128 -0.0697 0.0297 0.0303 102 PHE B CA 3780 C C . PHE B 43 ? 0.8819 0.9684 1.2301 -0.0707 0.0280 0.0295 102 PHE B C 3781 O O . PHE B 43 ? 0.9825 1.0680 1.3356 -0.0715 0.0243 0.0272 102 PHE B O 3782 C CB . PHE B 43 ? 0.8636 0.9469 1.1978 -0.0702 0.0343 0.0332 102 PHE B CB 3783 C CG . PHE B 43 ? 0.8621 0.9427 1.1838 -0.0695 0.0351 0.0333 102 PHE B CG 3784 C CD1 . PHE B 43 ? 0.7905 0.8682 1.1078 -0.0698 0.0317 0.0310 102 PHE B CD1 3785 C CD2 . PHE B 43 ? 0.8328 0.9136 1.1471 -0.0684 0.0393 0.0356 102 PHE B CD2 3786 C CE1 . PHE B 43 ? 0.7746 0.8499 1.0805 -0.0692 0.0324 0.0311 102 PHE B CE1 3787 C CE2 . PHE B 43 ? 0.8095 0.8879 1.1126 -0.0677 0.0400 0.0356 102 PHE B CE2 3788 C CZ . PHE B 43 ? 0.7579 0.8336 1.0568 -0.0681 0.0366 0.0333 102 PHE B CZ 3789 N N . ASP B 44 ? 0.8880 0.9775 1.2421 -0.0706 0.0307 0.0314 103 ASP B N 3790 C CA . ASP B 44 ? 0.8665 0.9584 1.2339 -0.0715 0.0296 0.0310 103 ASP B CA 3791 C C . ASP B 44 ? 0.7356 0.8275 1.1054 -0.0714 0.0235 0.0269 103 ASP B C 3792 O O . ASP B 44 ? 0.6853 0.7773 1.0645 -0.0725 0.0210 0.0254 103 ASP B O 3793 C CB . ASP B 44 ? 0.8667 0.9619 1.2380 -0.0710 0.0333 0.0336 103 ASP B CB 3794 C CG . ASP B 44 ? 0.9917 1.0872 1.3646 -0.0712 0.0393 0.0378 103 ASP B CG 3795 O OD1 . ASP B 44 ? 1.0376 1.1351 1.4099 -0.0703 0.0428 0.0403 103 ASP B OD1 3796 O OD2 . ASP B 44 ? 1.0783 1.1720 1.4528 -0.0721 0.0405 0.0385 103 ASP B OD2 3797 N N . GLN B 45 ? 0.7374 0.8289 1.0987 -0.0700 0.0213 0.0250 104 GLN B N 3798 C CA . GLN B 45 ? 0.7345 0.8256 1.0967 -0.0694 0.0155 0.0210 104 GLN B CA 3799 C C . GLN B 45 ? 0.7768 0.8645 1.1352 -0.0695 0.0116 0.0185 104 GLN B C 3800 O O . GLN B 45 ? 0.6770 0.7642 1.0404 -0.0695 0.0070 0.0154 104 GLN B O 3801 C CB . GLN B 45 ? 0.8369 0.9285 1.1907 -0.0677 0.0146 0.0198 104 GLN B CB 3802 C CG . GLN B 45 ? 1.1421 1.2339 1.4981 -0.0668 0.0092 0.0158 104 GLN B CG 3803 C CD . GLN B 45 ? 1.2845 1.3791 1.6544 -0.0677 0.0082 0.0152 104 GLN B CD 3804 O OE1 . GLN B 45 ? 1.2614 1.3553 1.6384 -0.0684 0.0048 0.0131 104 GLN B OE1 3805 N NE2 . GLN B 45 ? 1.2535 1.3513 1.6272 -0.0677 0.0111 0.0172 104 GLN B NE2 3806 N N . LEU B 46 ? 0.7951 0.8804 1.1446 -0.0694 0.0135 0.0198 105 LEU B N 3807 C CA . LEU B 46 ? 0.6717 0.7535 1.0164 -0.0695 0.0102 0.0177 105 LEU B CA 3808 C C . LEU B 46 ? 0.7261 0.8074 1.0805 -0.0711 0.0091 0.0176 105 LEU B C 3809 O O . LEU B 46 ? 0.7234 0.8030 1.0795 -0.0710 0.0043 0.0147 105 LEU B O 3810 C CB . LEU B 46 ? 0.5198 0.5995 0.8527 -0.0691 0.0129 0.0194 105 LEU B CB 3811 C CG . LEU B 46 ? 0.5170 0.5957 0.8377 -0.0673 0.0123 0.0184 105 LEU B CG 3812 C CD1 . LEU B 46 ? 0.5176 0.5948 0.8285 -0.0671 0.0160 0.0207 105 LEU B CD1 3813 C CD2 . LEU B 46 ? 0.4170 0.4933 0.7338 -0.0663 0.0065 0.0146 105 LEU B CD2 3814 N N . ARG B 47 ? 0.6631 0.7457 1.0236 -0.0723 0.0135 0.0207 106 ARG B N 3815 C CA . ARG B 47 ? 0.7521 0.8343 1.1221 -0.0740 0.0132 0.0209 106 ARG B CA 3816 C C . ARG B 47 ? 0.8125 0.8961 1.1939 -0.0744 0.0090 0.0183 106 ARG B C 3817 O O . ARG B 47 ? 0.7789 0.8612 1.1659 -0.0754 0.0063 0.0170 106 ARG B O 3818 C CB . ARG B 47 ? 0.7056 0.7893 1.0806 -0.0750 0.0193 0.0248 106 ARG B CB 3819 C CG . ARG B 47 ? 0.8183 0.9003 1.1827 -0.0745 0.0234 0.0273 106 ARG B CG 3820 C CD . ARG B 47 ? 0.8941 0.9778 1.2631 -0.0751 0.0296 0.0312 106 ARG B CD 3821 N NE . ARG B 47 ? 1.0123 1.0959 1.3917 -0.0767 0.0306 0.0320 106 ARG B NE 3822 C CZ . ARG B 47 ? 0.9025 0.9839 1.2797 -0.0773 0.0327 0.0333 106 ARG B CZ 3823 N NH1 . ARG B 47 ? 0.6819 0.7611 1.0471 -0.0764 0.0341 0.0339 106 ARG B NH1 3824 N NH2 . ARG B 47 ? 0.7998 0.8812 1.1869 -0.0787 0.0336 0.0340 106 ARG B NH2 3825 N N . GLN B 48 ? 0.8905 0.9767 1.2755 -0.0738 0.0084 0.0176 107 GLN B N 3826 C CA . GLN B 48 ? 0.9181 1.0059 1.3143 -0.0741 0.0047 0.0151 107 GLN B CA 3827 C C . GLN B 48 ? 0.7145 0.8002 1.1077 -0.0730 -0.0018 0.0108 107 GLN B C 3828 O O . GLN B 48 ? 0.8063 0.8929 1.2085 -0.0730 -0.0056 0.0083 107 GLN B O 3829 C CB . GLN B 48 ? 1.0029 1.0944 1.4038 -0.0737 0.0064 0.0158 107 GLN B CB 3830 C CG . GLN B 48 ? 1.0799 1.1735 1.4840 -0.0745 0.0127 0.0202 107 GLN B CG 3831 C CD . GLN B 48 ? 1.0751 1.1725 1.4882 -0.0746 0.0139 0.0208 107 GLN B CD 3832 O OE1 . GLN B 48 ? 1.0645 1.1632 1.4743 -0.0733 0.0121 0.0193 107 GLN B OE1 3833 N NE2 . GLN B 48 ? 1.0467 1.1460 1.4712 -0.0760 0.0168 0.0229 107 GLN B NE2 3834 N N . ASN B 49 ? 0.7093 0.7921 1.0901 -0.0718 -0.0031 0.0100 108 ASN B N 3835 C CA . ASN B 49 ? 0.7193 0.7997 1.0961 -0.0704 -0.0091 0.0061 108 ASN B CA 3836 C C . ASN B 49 ? 0.7297 0.8066 1.1038 -0.0708 -0.0112 0.0055 108 ASN B C 3837 O O . ASN B 49 ? 0.7301 0.8046 1.1017 -0.0697 -0.0163 0.0024 108 ASN B O 3838 C CB . ASN B 49 ? 0.7932 0.8727 1.1576 -0.0684 -0.0096 0.0051 108 ASN B CB 3839 C CG . ASN B 49 ? 0.9102 0.9887 1.2739 -0.0665 -0.0153 0.0010 108 ASN B CG 3840 O OD1 . ASN B 49 ? 0.9994 1.0768 1.3691 -0.0665 -0.0197 -0.0015 108 ASN B OD1 3841 N ND2 . ASN B 49 ? 0.7903 0.8693 1.1469 -0.0649 -0.0153 0.0002 108 ASN B ND2 3842 N N . GLU B 50 ? 0.6717 0.7483 1.0464 -0.0724 -0.0072 0.0085 109 GLU B N 3843 C CA . GLU B 50 ? 0.7845 0.8580 1.1563 -0.0730 -0.0085 0.0084 109 GLU B CA 3844 C C . GLU B 50 ? 0.7652 0.8382 1.1476 -0.0737 -0.0127 0.0063 109 GLU B C 3845 O O . GLU B 50 ? 0.6353 0.7053 1.0149 -0.0735 -0.0162 0.0048 109 GLU B O 3846 C CB . GLU B 50 ? 0.5921 0.6656 0.9624 -0.0744 -0.0028 0.0122 109 GLU B CB 3847 C CG . GLU B 50 ? 0.4992 0.5729 0.8588 -0.0736 0.0014 0.0144 109 GLU B CG 3848 C CD . GLU B 50 ? 0.6877 0.7612 1.0460 -0.0747 0.0070 0.0179 109 GLU B CD 3849 O OE1 . GLU B 50 ? 0.7203 0.7943 1.0710 -0.0740 0.0109 0.0200 109 GLU B OE1 3850 O OE2 . GLU B 50 ? 0.6271 0.7001 0.9919 -0.0761 0.0075 0.0186 109 GLU B OE2 3851 N N . CYS B 51 ? 0.7307 0.8067 1.1255 -0.0746 -0.0123 0.0063 110 CYS B N 3852 C CA . CYS B 51 ? 0.7952 0.8713 1.2016 -0.0754 -0.0162 0.0042 110 CYS B CA 3853 C C . CYS B 51 ? 0.7374 0.8151 1.1494 -0.0742 -0.0202 0.0010 110 CYS B C 3854 O O . CYS B 51 ? 0.7153 0.7962 1.1317 -0.0742 -0.0180 0.0018 110 CYS B O 3855 C CB . CYS B 51 ? 0.9343 1.0124 1.3519 -0.0777 -0.0121 0.0069 110 CYS B CB 3856 S SG . CYS B 51 ? 0.8486 0.9268 1.2812 -0.0789 -0.0165 0.0046 110 CYS B SG 3857 N N . LYS B 52 ? 0.7688 0.8443 1.1803 -0.0729 -0.0263 -0.0025 111 LYS B N 3858 C CA . LYS B 52 ? 0.8832 0.9597 1.2991 -0.0713 -0.0307 -0.0061 111 LYS B CA 3859 C C . LYS B 52 ? 0.8382 0.9183 1.2695 -0.0727 -0.0302 -0.0061 111 LYS B C 3860 O O . LYS B 52 ? 0.8296 0.9128 1.2639 -0.0727 -0.0279 -0.0055 111 LYS B O 3861 C CB . LYS B 52 ? 0.8598 0.9330 1.2735 -0.0697 -0.0374 -0.0098 111 LYS B CB 3862 C CG . LYS B 52 ? 0.8441 0.9141 1.2429 -0.0674 -0.0392 -0.0109 111 LYS B CG 3863 C CD . LYS B 52 ? 0.9132 0.9843 1.3083 -0.0653 -0.0405 -0.0130 111 LYS B CD 3864 C CE . LYS B 52 ? 0.9461 1.0137 1.3270 -0.0629 -0.0427 -0.0144 111 LYS B CE 3865 N NZ . LYS B 52 ? 0.9407 1.0090 1.3178 -0.0606 -0.0442 -0.0167 111 LYS B NZ 3866 N N . LYS B 53 ? 0.8640 0.9436 1.3050 -0.0740 -0.0324 -0.0069 112 LYS B N 3867 C CA . LYS B 53 ? 0.8356 0.9185 1.2919 -0.0755 -0.0319 -0.0070 112 LYS B CA 3868 C C . LYS B 53 ? 0.8674 0.9501 1.3308 -0.0780 -0.0289 -0.0043 112 LYS B C 3869 O O . LYS B 53 ? 0.8717 0.9515 1.3344 -0.0782 -0.0316 -0.0052 112 LYS B O 3870 C CB . LYS B 53 ? 0.7252 0.8078 1.1887 -0.0742 -0.0384 -0.0115 112 LYS B CB 3871 C CG . LYS B 53 ? 0.8118 0.8984 1.2899 -0.0751 -0.0382 -0.0121 112 LYS B CG 3872 C CD . LYS B 53 ? 0.8766 0.9627 1.3619 -0.0738 -0.0450 -0.0168 112 LYS B CD 3873 C CE . LYS B 53 ? 0.7911 0.8813 1.2895 -0.0743 -0.0449 -0.0179 112 LYS B CE 3874 N NZ . LYS B 53 ? 0.6748 0.7676 1.1852 -0.0772 -0.0406 -0.0149 112 LYS B NZ 3875 N N . ASN B 54 ? 0.7691 0.8547 1.2391 -0.0797 -0.0234 -0.0011 113 ASN B N 3876 C CA . ASN B 54 ? 0.6604 0.7459 1.1374 -0.0820 -0.0200 0.0016 113 ASN B CA 3877 C C . ASN B 54 ? 0.7203 0.8073 1.2132 -0.0832 -0.0224 -0.0001 113 ASN B C 3878 O O . ASN B 54 ? 0.8072 0.8978 1.3104 -0.0842 -0.0200 0.0009 113 ASN B O 3879 C CB . ASN B 54 ? 0.4732 0.5609 0.9497 -0.0830 -0.0126 0.0060 113 ASN B CB 3880 C CG . ASN B 54 ? 0.5125 0.5994 0.9932 -0.0851 -0.0086 0.0090 113 ASN B CG 3881 O OD1 . ASN B 54 ? 0.4485 0.5339 0.9354 -0.0861 -0.0111 0.0078 113 ASN B OD1 3882 N ND2 . ASN B 54 ? 0.4363 0.5240 0.9136 -0.0856 -0.0022 0.0129 113 ASN B ND2 3883 N N . ILE B 55 ? 0.7000 0.7845 1.1951 -0.0832 -0.0273 -0.0025 114 ILE B N 3884 C CA . ILE B 55 ? 0.7861 0.8717 1.2963 -0.0845 -0.0299 -0.0042 114 ILE B CA 3885 C C . ILE B 55 ? 0.7591 0.8420 1.2708 -0.0859 -0.0302 -0.0033 114 ILE B C 3886 O O . ILE B 55 ? 0.7896 0.8690 1.2902 -0.0851 -0.0315 -0.0034 114 ILE B O 3887 C CB . ILE B 55 ? 0.6216 0.7071 1.1355 -0.0826 -0.0371 -0.0090 114 ILE B CB 3888 C CG1 . ILE B 55 ? 0.6331 0.7144 1.1406 -0.0813 -0.0428 -0.0117 114 ILE B CG1 3889 C CG2 . ILE B 55 ? 0.6807 0.7680 1.1891 -0.0807 -0.0373 -0.0102 114 ILE B CG2 3890 C CD1 . ILE B 55 ? 0.5463 0.6252 1.0378 -0.0789 -0.0443 -0.0125 114 ILE B CD1 3891 N N . THR B 56 ? 0.7576 0.8420 1.2828 -0.0879 -0.0287 -0.0025 115 THR B N 3892 C CA . THR B 56 ? 0.6709 0.7529 1.1990 -0.0894 -0.0289 -0.0018 115 THR B CA 3893 C C . THR B 56 ? 0.5721 0.6523 1.1051 -0.0887 -0.0363 -0.0059 115 THR B C 3894 O O . THR B 56 ? 0.5324 0.6133 1.0673 -0.0871 -0.0411 -0.0093 115 THR B O 3895 C CB . THR B 56 ? 0.6282 0.7124 1.1688 -0.0920 -0.0236 0.0012 115 THR B CB 3896 O OG1 . THR B 56 ? 0.6762 0.7630 1.2321 -0.0926 -0.0263 -0.0011 115 THR B OG1 3897 C CG2 . THR B 56 ? 0.3459 0.4323 0.8833 -0.0923 -0.0165 0.0050 115 THR B CG2 3898 N N . LEU B 57 ? 0.7165 0.7941 1.2514 -0.0899 -0.0374 -0.0056 116 LEU B N 3899 C CA . LEU B 57 ? 0.7484 0.8240 1.2878 -0.0892 -0.0444 -0.0093 116 LEU B CA 3900 C C . LEU B 57 ? 0.8005 0.8791 1.3572 -0.0901 -0.0462 -0.0112 116 LEU B C 3901 O O . LEU B 57 ? 0.8697 0.9478 1.4312 -0.0888 -0.0526 -0.0151 116 LEU B O 3902 C CB . LEU B 57 ? 0.6305 0.7026 1.1671 -0.0902 -0.0448 -0.0082 116 LEU B CB 3903 C CG . LEU B 57 ? 0.7401 0.8081 1.2617 -0.0883 -0.0485 -0.0093 116 LEU B CG 3904 C CD1 . LEU B 57 ? 0.6071 0.6720 1.1266 -0.0896 -0.0482 -0.0079 116 LEU B CD1 3905 C CD2 . LEU B 57 ? 0.7319 0.7988 1.2536 -0.0858 -0.0562 -0.0138 116 LEU B CD2 3906 N N . SER B 58 ? 0.7318 0.8134 1.2979 -0.0923 -0.0405 -0.0084 117 SER B N 3907 C CA . SER B 58 ? 0.8140 0.8988 1.3972 -0.0934 -0.0414 -0.0097 117 SER B CA 3908 C C . SER B 58 ? 0.8166 0.9041 1.4020 -0.0917 -0.0438 -0.0123 117 SER B C 3909 O O . SER B 58 ? 0.8346 0.9231 1.4296 -0.0912 -0.0488 -0.0159 117 SER B O 3910 C CB . SER B 58 ? 0.7545 0.8416 1.3463 -0.0960 -0.0341 -0.0057 117 SER B CB 3911 O OG . SER B 58 ? 0.7657 0.8569 1.3714 -0.0967 -0.0335 -0.0064 117 SER B OG 3912 N N . LYS B 59 ? 0.7523 0.8411 1.3286 -0.0908 -0.0402 -0.0105 118 LYS B N 3913 C CA . LYS B 59 ? 0.7719 0.8632 1.3488 -0.0891 -0.0421 -0.0127 118 LYS B CA 3914 C C . LYS B 59 ? 0.7829 0.8719 1.3528 -0.0864 -0.0493 -0.0172 118 LYS B C 3915 O O . LYS B 59 ? 0.9688 1.0593 1.5430 -0.0849 -0.0530 -0.0204 118 LYS B O 3916 C CB . LYS B 59 ? 0.7387 0.8316 1.3065 -0.0888 -0.0363 -0.0095 118 LYS B CB 3917 C CG . LYS B 59 ? 0.7807 0.8763 1.3481 -0.0871 -0.0377 -0.0114 118 LYS B CG 3918 C CD . LYS B 59 ? 0.8809 0.9803 1.4650 -0.0880 -0.0384 -0.0129 118 LYS B CD 3919 C CE . LYS B 59 ? 0.8349 0.9377 1.4261 -0.0900 -0.0313 -0.0087 118 LYS B CE 3920 N NZ . LYS B 59 ? 0.7714 0.8732 1.3680 -0.0925 -0.0273 -0.0056 118 LYS B NZ 3921 N N . PHE B 60 ? 0.8006 0.8854 1.3594 -0.0855 -0.0514 -0.0173 119 PHE B N 3922 C CA . PHE B 60 ? 0.8154 0.8974 1.3668 -0.0827 -0.0582 -0.0212 119 PHE B CA 3923 C C . PHE B 60 ? 0.7388 0.8200 1.3013 -0.0824 -0.0645 -0.0249 119 PHE B C 3924 O O . PHE B 60 ? 0.6739 0.7543 1.2360 -0.0799 -0.0704 -0.0290 119 PHE B O 3925 C CB . PHE B 60 ? 0.8664 0.9443 1.4023 -0.0819 -0.0582 -0.0199 119 PHE B CB 3926 C CG . PHE B 60 ? 0.8852 0.9597 1.4131 -0.0789 -0.0651 -0.0237 119 PHE B CG 3927 C CD1 . PHE B 60 ? 0.7853 0.8598 1.3045 -0.0763 -0.0667 -0.0255 119 PHE B CD1 3928 C CD2 . PHE B 60 ? 0.9203 0.9915 1.4492 -0.0785 -0.0699 -0.0254 119 PHE B CD2 3929 C CE1 . PHE B 60 ? 0.7248 0.7960 1.2367 -0.0733 -0.0729 -0.0289 119 PHE B CE1 3930 C CE2 . PHE B 60 ? 0.8453 0.9133 1.3669 -0.0755 -0.0763 -0.0288 119 PHE B CE2 3931 C CZ . PHE B 60 ? 0.7481 0.8160 1.2612 -0.0728 -0.0777 -0.0305 119 PHE B CZ 3932 N N . TRP B 61 ? 0.7631 0.8443 1.3354 -0.0848 -0.0633 -0.0236 120 TRP B N 3933 C CA . TRP B 61 ? 1.1175 1.1978 1.7010 -0.0848 -0.0690 -0.0269 120 TRP B CA 3934 C C . TRP B 61 ? 1.1985 1.2826 1.7967 -0.0848 -0.0708 -0.0295 120 TRP B C 3935 O O . TRP B 61 ? 1.2834 1.3667 1.8872 -0.0832 -0.0773 -0.0337 120 TRP B O 3936 C CB . TRP B 61 ? 1.1888 1.2680 1.7780 -0.0875 -0.0668 -0.0245 120 TRP B CB 3937 C CG . TRP B 61 ? 0.9964 1.0711 1.5727 -0.0869 -0.0678 -0.0234 120 TRP B CG 3938 C CD1 . TRP B 61 ? 0.8200 0.8917 1.3818 -0.0843 -0.0709 -0.0247 120 TRP B CD1 3939 C CD2 . TRP B 61 ? 1.1128 1.1855 1.6897 -0.0890 -0.0656 -0.0209 120 TRP B CD2 3940 N NE1 . TRP B 61 ? 0.9120 0.9801 1.4652 -0.0847 -0.0709 -0.0231 120 TRP B NE1 3941 C CE2 . TRP B 61 ? 1.1454 1.2140 1.7075 -0.0876 -0.0676 -0.0208 120 TRP B CE2 3942 C CE3 . TRP B 61 ? 1.3636 1.4375 1.9520 -0.0920 -0.0619 -0.0187 120 TRP B CE3 3943 C CZ2 . TRP B 61 ? 1.2984 1.3642 1.8566 -0.0889 -0.0662 -0.0186 120 TRP B CZ2 3944 C CZ3 . TRP B 61 ? 1.4758 1.5468 2.0602 -0.0933 -0.0605 -0.0166 120 TRP B CZ3 3945 C CH2 . TRP B 61 ? 1.4117 1.4787 1.9811 -0.0918 -0.0627 -0.0166 120 TRP B CH2 3946 N N . GLU B 62 ? 1.0500 1.1381 1.6544 -0.0866 -0.0651 -0.0270 121 GLU B N 3947 C CA . GLU B 62 ? 1.0347 1.1268 1.6529 -0.0867 -0.0661 -0.0291 121 GLU B CA 3948 C C . GLU B 62 ? 1.1571 1.2491 1.7731 -0.0835 -0.0723 -0.0339 121 GLU B C 3949 O O . GLU B 62 ? 1.0904 1.1852 1.7060 -0.0827 -0.0709 -0.0343 121 GLU B O 3950 C CB . GLU B 62 ? 0.9753 1.0712 1.5957 -0.0883 -0.0588 -0.0254 121 GLU B CB 3951 C CG . GLU B 62 ? 1.0133 1.1098 1.6393 -0.0915 -0.0525 -0.0209 121 GLU B CG 3952 C CD . GLU B 62 ? 1.1171 1.2180 1.7505 -0.0930 -0.0464 -0.0181 121 GLU B CD 3953 O OE1 . GLU B 62 ? 1.1080 1.2104 1.7532 -0.0954 -0.0428 -0.0159 121 GLU B OE1 3954 O OE2 . GLU B 62 ? 0.9366 1.0393 1.5639 -0.0916 -0.0450 -0.0179 121 GLU B OE2 3955 N N . LYS B 63 ? 1.4057 1.4944 2.0202 -0.0816 -0.0791 -0.0375 122 LYS B N 3956 C CA . LYS B 63 ? 1.4624 1.5505 2.0750 -0.0782 -0.0856 -0.0425 122 LYS B CA 3957 C C . LYS B 63 ? 1.6081 1.6921 2.2206 -0.0765 -0.0926 -0.0457 122 LYS B C 3958 O O . LYS B 63 ? 1.5143 1.5984 2.1342 -0.0747 -0.0985 -0.0502 122 LYS B O 3959 C CB . LYS B 63 ? 1.2960 1.3832 1.8926 -0.0758 -0.0847 -0.0422 122 LYS B CB 3960 C CG . LYS B 63 ? 1.1784 1.2619 1.7596 -0.0757 -0.0827 -0.0394 122 LYS B CG 3961 C CD . LYS B 63 ? 1.1755 1.2569 1.7416 -0.0724 -0.0847 -0.0410 122 LYS B CD 3962 C CE . LYS B 63 ? 1.1666 1.2446 1.7176 -0.0723 -0.0826 -0.0381 122 LYS B CE 3963 N NZ . LYS B 63 ? 1.0308 1.1053 1.5824 -0.0729 -0.0854 -0.0381 122 LYS B NZ 3964 N N . SER B 64 ? 1.7866 1.8671 2.3906 -0.0771 -0.0920 -0.0436 123 SER B N 3965 C CA . SER B 64 ? 1.8200 1.8962 2.4212 -0.0752 -0.0986 -0.0463 123 SER B CA 3966 C C . SER B 64 ? 1.9268 2.0013 2.5323 -0.0777 -0.0976 -0.0440 123 SER B C 3967 O O . SER B 64 ? 2.0965 2.1714 2.6991 -0.0803 -0.0914 -0.0396 123 SER B O 3968 C CB . SER B 64 ? 1.7062 1.7786 2.2893 -0.0722 -0.1005 -0.0467 123 SER B CB 3969 O OG . SER B 64 ? 1.7602 1.8322 2.3325 -0.0738 -0.0944 -0.0421 123 SER B OG 3970 N N . GLU B 65 ? 1.7508 1.8232 2.3632 -0.0768 -0.1038 -0.0472 124 GLU B N 3971 C CA . GLU B 65 ? 1.4627 1.5327 2.0782 -0.0786 -0.1046 -0.0459 124 GLU B CA 3972 C C . GLU B 65 ? 1.3224 1.3951 1.9497 -0.0828 -0.0987 -0.0425 124 GLU B C 3973 O O . GLU B 65 ? 1.2489 1.3204 1.8838 -0.0843 -0.1003 -0.0425 124 GLU B O 3974 C CB . GLU B 65 ? 1.4798 1.5455 2.0782 -0.0778 -0.1040 -0.0436 124 GLU B CB 3975 C CG . GLU B 65 ? 1.5257 1.5921 2.1187 -0.0808 -0.0961 -0.0384 124 GLU B CG 3976 C CD . GLU B 65 ? 1.4779 1.5431 2.0537 -0.0793 -0.0934 -0.0365 124 GLU B CD 3977 O OE1 . GLU B 65 ? 1.3228 1.3871 1.8918 -0.0762 -0.0971 -0.0393 124 GLU B OE1 3978 O OE2 . GLU B 65 ? 1.5675 1.6325 2.1366 -0.0812 -0.0875 -0.0324 124 GLU B OE2 3979 N N . GLN B 66 ? 1.3601 1.4365 1.9892 -0.0846 -0.0921 -0.0397 125 GLN B N 3980 C CA . GLN B 66 ? 1.4410 1.5203 2.0823 -0.0883 -0.0864 -0.0367 125 GLN B CA 3981 C C . GLN B 66 ? 1.3622 1.4460 2.0062 -0.0893 -0.0803 -0.0345 125 GLN B C 3982 O O . GLN B 66 ? 1.0476 1.1313 1.6793 -0.0888 -0.0766 -0.0322 125 GLN B O 3983 C CB . GLN B 66 ? 1.5889 1.6658 2.2245 -0.0904 -0.0824 -0.0327 125 GLN B CB 3984 C CG . GLN B 66 ? 1.6454 1.7198 2.2623 -0.0893 -0.0798 -0.0302 125 GLN B CG 3985 C CD . GLN B 66 ? 1.5797 1.6504 2.1899 -0.0904 -0.0791 -0.0280 125 GLN B CD 3986 O OE1 . GLN B 66 ? 1.5029 1.5697 2.1039 -0.0884 -0.0840 -0.0296 125 GLN B OE1 3987 N NE2 . GLN B 66 ? 1.5566 1.6283 2.1714 -0.0934 -0.0729 -0.0243 125 GLN B NE2 3988 N N . ARG B 67 ? 1.5702 1.6576 2.2303 -0.0909 -0.0794 -0.0352 126 ARG B N 3989 C CA . ARG B 67 ? 1.5181 1.6098 2.1828 -0.0922 -0.0735 -0.0329 126 ARG B CA 3990 C C . ARG B 67 ? 1.3413 1.4337 2.0056 -0.0951 -0.0655 -0.0275 126 ARG B C 3991 O O . ARG B 67 ? 1.1888 1.2833 1.8488 -0.0956 -0.0597 -0.0245 126 ARG B O 3992 C CB . ARG B 67 ? 1.4160 1.5115 2.0988 -0.0929 -0.0754 -0.0356 126 ARG B CB 3993 C CG . ARG B 67 ? 1.2946 1.3920 1.9772 -0.0902 -0.0792 -0.0394 126 ARG B CG 3994 C CD . ARG B 67 ? 1.2822 1.3773 1.9668 -0.0876 -0.0880 -0.0448 126 ARG B CD 3995 N NE . ARG B 67 ? 1.3880 1.4783 2.0582 -0.0858 -0.0912 -0.0452 126 ARG B NE 3996 C CZ . ARG B 67 ? 1.2722 1.3606 1.9269 -0.0831 -0.0922 -0.0456 126 ARG B CZ 3997 N NH1 . ARG B 67 ? 1.1033 1.1943 1.7547 -0.0821 -0.0902 -0.0458 126 ARG B NH1 3998 N NH2 . ARG B 67 ? 1.1872 1.2712 1.8298 -0.0816 -0.0951 -0.0458 126 ARG B NH2 3999 N N . ASN B 68 ? 1.2554 1.3458 1.9240 -0.0970 -0.0651 -0.0263 127 ASN B N 4000 C CA . ASN B 68 ? 1.2052 1.2961 1.8762 -0.0998 -0.0576 -0.0215 127 ASN B CA 4001 C C . ASN B 68 ? 1.2800 1.3670 1.9374 -0.1000 -0.0555 -0.0188 127 ASN B C 4002 O O . ASN B 68 ? 1.1288 1.2123 1.7824 -0.0994 -0.0602 -0.0205 127 ASN B O 4003 C CB . ASN B 68 ? 1.1488 1.2411 1.8379 -0.1023 -0.0574 -0.0218 127 ASN B CB 4004 C CG . ASN B 68 ? 1.2024 1.2989 1.9062 -0.1024 -0.0587 -0.0241 127 ASN B CG 4005 O OD1 . ASN B 68 ? 1.2318 1.3318 1.9428 -0.1040 -0.0529 -0.0215 127 ASN B OD1 4006 N ND2 . ASN B 68 ? 1.0358 1.1321 1.7441 -0.1006 -0.0662 -0.0291 127 ASN B ND2 4007 N N . VAL B 69 ? 1.3449 1.4325 1.9949 -0.1009 -0.0484 -0.0146 128 VAL B N 4008 C CA . VAL B 69 ? 1.3060 1.3904 1.9460 -0.1017 -0.0449 -0.0113 128 VAL B CA 4009 C C . VAL B 69 ? 1.2866 1.3718 1.9386 -0.1047 -0.0400 -0.0086 128 VAL B C 4010 O O . VAL B 69 ? 1.4737 1.5620 2.1319 -0.1060 -0.0340 -0.0058 128 VAL B O 4011 C CB . VAL B 69 ? 1.1247 1.2089 1.7497 -0.1009 -0.0399 -0.0082 128 VAL B CB 4012 C CG1 . VAL B 69 ? 1.3007 1.3823 1.9108 -0.0981 -0.0448 -0.0106 128 VAL B CG1 4013 C CG2 . VAL B 69 ? 0.6471 0.7357 1.2773 -0.1011 -0.0354 -0.0068 128 VAL B CG2 4014 N N . PRO B 70 ? 0.9459 1.0284 1.6015 -0.1056 -0.0427 -0.0094 129 PRO B N 4015 C CA . PRO B 70 ? 0.9676 1.0507 1.6364 -0.1084 -0.0391 -0.0076 129 PRO B CA 4016 C C . PRO B 70 ? 0.8403 0.9243 1.5076 -0.1100 -0.0300 -0.0026 129 PRO B C 4017 O O . PRO B 70 ? 0.9765 1.0628 1.6571 -0.1120 -0.0259 -0.0009 129 PRO B O 4018 C CB . PRO B 70 ? 1.0343 1.1131 1.6993 -0.1086 -0.0431 -0.0086 129 PRO B CB 4019 C CG . PRO B 70 ? 0.8229 0.9000 1.4805 -0.1058 -0.0511 -0.0127 129 PRO B CG 4020 C CD . PRO B 70 ? 0.8525 0.9311 1.4996 -0.1040 -0.0495 -0.0122 129 PRO B CD 4021 N N . GLU B 71 ? 0.4742 0.5567 1.1255 -0.1089 -0.0269 -0.0002 130 GLU B N 4022 C CA . GLU B 71 ? 0.6812 0.7640 1.3283 -0.1099 -0.0184 0.0045 130 GLU B CA 4023 C C . GLU B 71 ? 0.6871 0.7701 1.3460 -0.1125 -0.0135 0.0070 130 GLU B C 4024 O O . GLU B 71 ? 0.4672 0.5526 1.1330 -0.1135 -0.0073 0.0098 130 GLU B O 4025 C CB . GLU B 71 ? 0.6440 0.7305 1.2913 -0.1092 -0.0148 0.0058 130 GLU B CB 4026 C CG . GLU B 71 ? 0.7172 0.8032 1.3496 -0.1067 -0.0173 0.0046 130 GLU B CG 4027 C CD . GLU B 71 ? 0.8611 0.9503 1.4917 -0.1061 -0.0125 0.0068 130 GLU B CD 4028 O OE1 . GLU B 71 ? 0.9680 1.0598 1.6090 -0.1075 -0.0072 0.0093 130 GLU B OE1 4029 O OE2 . GLU B 71 ? 0.8018 0.8909 1.4205 -0.1041 -0.0139 0.0061 130 GLU B OE2 4030 N N . ASP B 72 ? 0.6891 0.7691 1.3500 -0.1134 -0.0164 0.0059 131 ASP B N 4031 C CA . ASP B 72 ? 0.7259 0.8056 1.3975 -0.1158 -0.0121 0.0080 131 ASP B CA 4032 C C . ASP B 72 ? 0.6992 0.7767 1.3608 -0.1162 -0.0050 0.0123 131 ASP B C 4033 O O . ASP B 72 ? 0.7161 0.7944 1.3853 -0.1178 0.0014 0.0153 131 ASP B O 4034 C CB . ASP B 72 ? 0.8384 0.9157 1.5159 -0.1165 -0.0182 0.0051 131 ASP B CB 4035 C CG . ASP B 72 ? 0.8768 0.9564 1.5672 -0.1163 -0.0247 0.0010 131 ASP B CG 4036 O OD1 . ASP B 72 ? 0.7289 0.8124 1.4302 -0.1168 -0.0226 0.0011 131 ASP B OD1 4037 O OD2 . ASP B 72 ? 0.9091 0.9866 1.5985 -0.1155 -0.0319 -0.0024 131 ASP B OD2 4038 N N . ASP B 73 ? 0.6489 0.7236 1.2934 -0.1146 -0.0061 0.0124 132 ASP B N 4039 C CA . ASP B 73 ? 0.6947 0.7671 1.3278 -0.1147 0.0001 0.0161 132 ASP B CA 4040 C C . ASP B 73 ? 0.6256 0.6978 1.2425 -0.1126 0.0010 0.0169 132 ASP B C 4041 O O . ASP B 73 ? 0.5310 0.6046 1.1450 -0.1111 -0.0036 0.0145 132 ASP B O 4042 C CB . ASP B 73 ? 0.4370 0.5052 1.0655 -0.1153 -0.0021 0.0156 132 ASP B CB 4043 C CG . ASP B 73 ? 0.5117 0.5779 1.1338 -0.1140 -0.0109 0.0118 132 ASP B CG 4044 O OD1 . ASP B 73 ? 0.4790 0.5438 1.1081 -0.1148 -0.0155 0.0097 132 ASP B OD1 4045 O OD2 . ASP B 73 ? 0.4335 0.4995 1.0435 -0.1120 -0.0132 0.0109 132 ASP B OD2 4046 N N . ASN B 74 ? 0.5192 0.5897 1.1257 -0.1124 0.0069 0.0202 133 ASN B N 4047 C CA . ASN B 74 ? 0.5029 0.5733 1.0945 -0.1105 0.0087 0.0213 133 ASN B CA 4048 C C . ASN B 74 ? 0.5487 0.6166 1.1269 -0.1089 0.0022 0.0186 133 ASN B C 4049 O O . ASN B 74 ? 0.5003 0.5685 1.0674 -0.1072 0.0020 0.0186 133 ASN B O 4050 C CB . ASN B 74 ? 0.4601 0.5290 1.0441 -0.1106 0.0165 0.0254 133 ASN B CB 4051 C CG . ASN B 74 ? 0.4501 0.5217 1.0451 -0.1116 0.0236 0.0284 133 ASN B CG 4052 O OD1 . ASN B 74 ? 0.4792 0.5534 1.0737 -0.1106 0.0264 0.0297 133 ASN B OD1 4053 N ND2 . ASN B 74 ? 0.4465 0.5173 1.0515 -0.1133 0.0265 0.0296 133 ASN B ND2 4054 N N . TRP B 75 ? 0.4759 0.5413 1.0551 -0.1094 -0.0030 0.0164 134 TRP B N 4055 C CA . TRP B 75 ? 0.4565 0.5195 1.0249 -0.1077 -0.0099 0.0135 134 TRP B CA 4056 C C . TRP B 75 ? 0.5656 0.6312 1.1380 -0.1064 -0.0152 0.0104 134 TRP B C 4057 O O . TRP B 75 ? 0.4297 0.4950 0.9910 -0.1045 -0.0172 0.0095 134 TRP B O 4058 C CB . TRP B 75 ? 0.4747 0.5346 1.0450 -0.1085 -0.0147 0.0118 134 TRP B CB 4059 C CG . TRP B 75 ? 0.4394 0.4959 1.0000 -0.1090 -0.0115 0.0141 134 TRP B CG 4060 C CD1 . TRP B 75 ? 0.3672 0.4202 0.9134 -0.1078 -0.0145 0.0134 134 TRP B CD1 4061 C CD2 . TRP B 75 ? 0.4400 0.4961 1.0045 -0.1107 -0.0046 0.0173 134 TRP B CD2 4062 N NE1 . TRP B 75 ? 0.5315 0.5820 1.0722 -0.1087 -0.0100 0.0160 134 TRP B NE1 4063 C CE2 . TRP B 75 ? 0.4793 0.5316 1.0310 -0.1104 -0.0038 0.0183 134 TRP B CE2 4064 C CE3 . TRP B 75 ? 0.4000 0.4584 0.9774 -0.1123 0.0012 0.0193 134 TRP B CE3 4065 C CZ2 . TRP B 75 ? 0.4859 0.5367 1.0370 -0.1117 0.0024 0.0212 134 TRP B CZ2 4066 C CZ3 . TRP B 75 ? 0.3906 0.4473 0.9676 -0.1135 0.0074 0.0224 134 TRP B CZ3 4067 C CH2 . TRP B 75 ? 0.4312 0.4842 0.9951 -0.1131 0.0080 0.0232 134 TRP B CH2 4068 N N . GLU B 76 ? 0.6584 0.7263 1.2468 -0.1075 -0.0172 0.0088 135 GLU B N 4069 C CA . GLU B 76 ? 0.7232 0.7934 1.3170 -0.1063 -0.0225 0.0055 135 GLU B CA 4070 C C . GLU B 76 ? 0.5846 0.6579 1.1757 -0.1053 -0.0192 0.0066 135 GLU B C 4071 O O . GLU B 76 ? 0.4626 0.5365 1.0485 -0.1034 -0.0234 0.0042 135 GLU B O 4072 C CB . GLU B 76 ? 0.3631 0.4352 0.9755 -0.1078 -0.0247 0.0037 135 GLU B CB 4073 C CG . GLU B 76 ? 0.7826 0.8517 1.3983 -0.1083 -0.0302 0.0015 135 GLU B CG 4074 C CD . GLU B 76 ? 0.8640 0.9352 1.4986 -0.1099 -0.0321 -0.0002 135 GLU B CD 4075 O OE1 . GLU B 76 ? 0.8998 0.9745 1.5452 -0.1109 -0.0282 0.0009 135 GLU B OE1 4076 O OE2 . GLU B 76 ? 0.8753 0.9444 1.5141 -0.1101 -0.0375 -0.0026 135 GLU B OE2 4077 N N . ARG B 77 ? 0.5530 0.6282 1.1474 -0.1064 -0.0117 0.0102 136 ARG B N 4078 C CA . ARG B 77 ? 0.4354 0.5135 1.0265 -0.1054 -0.0082 0.0116 136 ARG B CA 4079 C C . ARG B 77 ? 0.6093 0.6854 1.1820 -0.1036 -0.0078 0.0123 136 ARG B C 4080 O O . ARG B 77 ? 0.6517 0.7293 1.2189 -0.1020 -0.0083 0.0118 136 ARG B O 4081 C CB . ARG B 77 ? 0.5352 0.6156 1.1343 -0.1068 -0.0002 0.0154 136 ARG B CB 4082 C CG . ARG B 77 ? 0.5679 0.6458 1.1606 -0.1076 0.0059 0.0190 136 ARG B CG 4083 C CD . ARG B 77 ? 0.6138 0.6941 1.2161 -0.1088 0.0134 0.0226 136 ARG B CD 4084 N NE . ARG B 77 ? 0.6634 0.7466 1.2834 -0.1101 0.0120 0.0213 136 ARG B NE 4085 C CZ . ARG B 77 ? 0.7978 0.8805 1.4298 -0.1119 0.0122 0.0212 136 ARG B CZ 4086 N NH1 . ARG B 77 ? 0.8187 0.8981 1.4466 -0.1127 0.0138 0.0224 136 ARG B NH1 4087 N NH2 . ARG B 77 ? 0.6508 0.7364 1.2989 -0.1130 0.0109 0.0199 136 ARG B NH2 4088 N N . PHE B 78 ? 0.6289 0.7015 1.1921 -0.1037 -0.0069 0.0135 137 PHE B N 4089 C CA . PHE B 78 ? 0.4433 0.5136 0.9890 -0.1020 -0.0072 0.0138 137 PHE B CA 4090 C C . PHE B 78 ? 0.4794 0.5487 1.0199 -0.1002 -0.0150 0.0099 137 PHE B C 4091 O O . PHE B 78 ? 0.5386 0.6083 1.0698 -0.0985 -0.0159 0.0093 137 PHE B O 4092 C CB . PHE B 78 ? 0.5078 0.5745 1.0450 -0.1026 -0.0048 0.0157 137 PHE B CB 4093 C CG . PHE B 78 ? 0.4226 0.4864 0.9428 -0.1008 -0.0074 0.0149 137 PHE B CG 4094 C CD1 . PHE B 78 ? 0.3955 0.4598 0.9041 -0.0995 -0.0043 0.0165 137 PHE B CD1 4095 C CD2 . PHE B 78 ? 0.3581 0.4187 0.8738 -0.1005 -0.0131 0.0128 137 PHE B CD2 4096 C CE1 . PHE B 78 ? 0.3546 0.4162 0.8479 -0.0979 -0.0066 0.0158 137 PHE B CE1 4097 C CE2 . PHE B 78 ? 0.4304 0.4883 0.9306 -0.0989 -0.0154 0.0122 137 PHE B CE2 4098 C CZ . PHE B 78 ? 0.3911 0.4495 0.8802 -0.0976 -0.0121 0.0136 137 PHE B CZ 4099 N N . TYR B 79 ? 0.3839 0.4516 0.9302 -0.1005 -0.0207 0.0072 138 TYR B N 4100 C CA . TYR B 79 ? 0.5171 0.5836 1.0596 -0.0987 -0.0285 0.0033 138 TYR B CA 4101 C C . TYR B 79 ? 0.6195 0.6892 1.1671 -0.0975 -0.0305 0.0013 138 TYR B C 4102 O O . TYR B 79 ? 0.6101 0.6793 1.1487 -0.0954 -0.0340 -0.0006 138 TYR B O 4103 C CB . TYR B 79 ? 0.3908 0.4553 0.9410 -0.0993 -0.0341 0.0009 138 TYR B CB 4104 C CG . TYR B 79 ? 0.6111 0.6719 1.1545 -0.1000 -0.0333 0.0023 138 TYR B CG 4105 C CD1 . TYR B 79 ? 0.6125 0.6709 1.1397 -0.0991 -0.0315 0.0040 138 TYR B CD1 4106 C CD2 . TYR B 79 ? 0.4951 0.5549 1.0483 -0.1017 -0.0345 0.0021 138 TYR B CD2 4107 C CE1 . TYR B 79 ? 0.5115 0.5666 1.0321 -0.0997 -0.0308 0.0053 138 TYR B CE1 4108 C CE2 . TYR B 79 ? 0.4818 0.5381 1.0283 -0.1024 -0.0338 0.0034 138 TYR B CE2 4109 C CZ . TYR B 79 ? 0.5981 0.6520 1.1282 -0.1014 -0.0319 0.0050 138 TYR B CZ 4110 O OH . TYR B 79 ? 0.4999 0.5504 1.0230 -0.1020 -0.0312 0.0063 138 TYR B OH 4111 N N . SER B 80 ? 0.5073 0.5804 1.0693 -0.0989 -0.0282 0.0017 139 SER B N 4112 C CA . SER B 80 ? 0.5678 0.6442 1.1359 -0.0980 -0.0299 -0.0002 139 SER B CA 4113 C C . SER B 80 ? 0.5186 0.5965 1.0766 -0.0968 -0.0261 0.0016 139 SER B C 4114 O O . SER B 80 ? 0.5962 0.6753 1.1515 -0.0950 -0.0291 -0.0006 139 SER B O 4115 C CB . SER B 80 ? 0.4644 0.5442 1.0504 -0.0999 -0.0277 0.0003 139 SER B CB 4116 O OG . SER B 80 ? 0.6214 0.7027 1.2088 -0.1013 -0.0197 0.0045 139 SER B OG 4117 N N . ASN B 81 ? 0.4631 0.5408 1.0155 -0.0976 -0.0193 0.0056 140 ASN B N 4118 C CA . ASN B 81 ? 0.5347 0.6138 1.0782 -0.0966 -0.0150 0.0077 140 ASN B CA 4119 C C . ASN B 81 ? 0.5279 0.6041 1.0537 -0.0949 -0.0162 0.0076 140 ASN B C 4120 O O . ASN B 81 ? 0.5369 0.6137 1.0537 -0.0941 -0.0122 0.0097 140 ASN B O 4121 C CB . ASN B 81 ? 0.5592 0.6398 1.1062 -0.0981 -0.0069 0.0120 140 ASN B CB 4122 C CG . ASN B 81 ? 0.5397 0.6241 1.1031 -0.0994 -0.0049 0.0125 140 ASN B CG 4123 O OD1 . ASN B 81 ? 0.4606 0.5479 1.0257 -0.0988 -0.0031 0.0131 140 ASN B OD1 4124 N ND2 . ASN B 81 ? 0.4647 0.5488 1.0401 -0.1012 -0.0054 0.0122 140 ASN B ND2 4125 N N . ILE B 82 ? 0.4161 0.4890 0.9370 -0.0943 -0.0216 0.0053 141 ILE B N 4126 C CA . ILE B 82 ? 0.5455 0.6155 1.0502 -0.0924 -0.0236 0.0047 141 ILE B CA 4127 C C . ILE B 82 ? 0.5828 0.6544 1.0834 -0.0904 -0.0262 0.0026 141 ILE B C 4128 O O . ILE B 82 ? 0.6070 0.6792 1.1135 -0.0894 -0.0317 -0.0008 141 ILE B O 4129 C CB . ILE B 82 ? 0.5734 0.6396 1.0745 -0.0919 -0.0295 0.0024 141 ILE B CB 4130 C CG1 . ILE B 82 ? 0.5203 0.5847 1.0230 -0.0938 -0.0266 0.0046 141 ILE B CG1 4131 C CG2 . ILE B 82 ? 0.5542 0.6178 1.0392 -0.0897 -0.0321 0.0014 141 ILE B CG2 4132 C CD1 . ILE B 82 ? 0.3625 0.4233 0.8626 -0.0935 -0.0323 0.0025 141 ILE B CD1 4133 N N . GLY B 83 ? 0.6046 0.6767 1.0950 -0.0895 -0.0223 0.0046 142 GLY B N 4134 C CA . GLY B 83 ? 0.6342 0.7082 1.1212 -0.0878 -0.0237 0.0031 142 GLY B CA 4135 C C . GLY B 83 ? 0.6090 0.6801 1.0828 -0.0855 -0.0283 0.0008 142 GLY B C 4136 O O . GLY B 83 ? 0.6003 0.6681 1.0668 -0.0852 -0.0304 0.0005 142 GLY B O 4137 N N . SER B 84 ? 0.5686 0.6411 1.0394 -0.0838 -0.0300 -0.0009 143 SER B N 4138 C CA . SER B 84 ? 0.6250 0.6950 1.0841 -0.0813 -0.0345 -0.0034 143 SER B CA 4139 C C . SER B 84 ? 0.5845 0.6532 1.0286 -0.0806 -0.0309 -0.0011 143 SER B C 4140 O O . SER B 84 ? 0.6660 0.7321 1.0991 -0.0788 -0.0340 -0.0026 143 SER B O 4141 C CB . SER B 84 ? 0.5632 0.6352 1.0257 -0.0796 -0.0380 -0.0064 143 SER B CB 4142 O OG . SER B 84 ? 0.6452 0.7208 1.1098 -0.0800 -0.0332 -0.0045 143 SER B OG 4143 N N . CYS B 85 ? 0.5313 0.6020 0.9754 -0.0819 -0.0243 0.0025 144 CYS B N 4144 C CA . CYS B 85 ? 0.6889 0.7586 1.1195 -0.0813 -0.0204 0.0047 144 CYS B CA 4145 C C . CYS B 85 ? 0.6644 0.7334 1.0938 -0.0830 -0.0151 0.0083 144 CYS B C 4146 O O . CYS B 85 ? 0.6389 0.7074 1.0587 -0.0827 -0.0109 0.0106 144 CYS B O 4147 C CB . CYS B 85 ? 0.8721 0.9448 1.3014 -0.0806 -0.0175 0.0056 144 CYS B CB 4148 S SG . CYS B 85 ? 0.8192 0.8924 1.2471 -0.0782 -0.0233 0.0014 144 CYS B SG 4149 N N . SER B 86 ? 0.7328 0.8016 1.1720 -0.0847 -0.0153 0.0085 145 SER B N 4150 C CA . SER B 86 ? 0.5912 0.6591 1.0303 -0.0863 -0.0103 0.0117 145 SER B CA 4151 C C . SER B 86 ? 0.6457 0.7124 1.0945 -0.0877 -0.0127 0.0108 145 SER B C 4152 O O . SER B 86 ? 0.6832 0.7513 1.1430 -0.0880 -0.0164 0.0086 145 SER B O 4153 C CB . SER B 86 ? 0.5376 0.6086 0.9816 -0.0872 -0.0035 0.0149 145 SER B CB 4154 O OG . SER B 86 ? 0.7842 0.8542 1.2287 -0.0885 0.0013 0.0179 145 SER B OG 4155 N N . VAL B 87 ? 0.5197 0.5841 0.9645 -0.0886 -0.0106 0.0125 146 VAL B N 4156 C CA . VAL B 87 ? 0.5164 0.5796 0.9700 -0.0901 -0.0124 0.0120 146 VAL B CA 4157 C C . VAL B 87 ? 0.3599 0.4259 0.8275 -0.0920 -0.0080 0.0139 146 VAL B C 4158 O O . VAL B 87 ? 0.4562 0.5228 0.9359 -0.0931 -0.0106 0.0126 146 VAL B O 4159 C CB . VAL B 87 ? 0.5475 0.6071 0.9918 -0.0905 -0.0113 0.0134 146 VAL B CB 4160 C CG1 . VAL B 87 ? 0.4490 0.5079 0.9031 -0.0924 -0.0108 0.0139 146 VAL B CG1 4161 C CG2 . VAL B 87 ? 0.4813 0.5378 0.9145 -0.0888 -0.0171 0.0109 146 VAL B CG2 4162 N N . TYR B 88 ? 0.3588 0.4266 0.8250 -0.0923 -0.0015 0.0171 147 TYR B N 4163 C CA . TYR B 88 ? 0.3473 0.4177 0.8265 -0.0938 0.0031 0.0191 147 TYR B CA 4164 C C . TYR B 88 ? 0.5810 0.6541 1.0588 -0.0933 0.0086 0.0217 147 TYR B C 4165 O O . TYR B 88 ? 0.5148 0.5872 0.9804 -0.0920 0.0107 0.0228 147 TYR B O 4166 C CB . TYR B 88 ? 0.3487 0.4173 0.8302 -0.0954 0.0068 0.0214 147 TYR B CB 4167 C CG . TYR B 88 ? 0.4873 0.5545 0.9575 -0.0949 0.0126 0.0245 147 TYR B CG 4168 C CD1 . TYR B 88 ? 0.4764 0.5455 0.9495 -0.0952 0.0196 0.0278 147 TYR B CD1 4169 C CD2 . TYR B 88 ? 0.3486 0.4124 0.8052 -0.0942 0.0112 0.0241 147 TYR B CD2 4170 C CE1 . TYR B 88 ? 0.3805 0.4482 0.8434 -0.0946 0.0249 0.0305 147 TYR B CE1 4171 C CE2 . TYR B 88 ? 0.4925 0.5551 0.9390 -0.0937 0.0165 0.0268 147 TYR B CE2 4172 C CZ . TYR B 88 ? 0.3473 0.4119 0.7970 -0.0939 0.0233 0.0299 147 TYR B CZ 4173 O OH . TYR B 88 ? 0.5782 0.6413 1.0177 -0.0932 0.0285 0.0324 147 TYR B OH 4174 N N . SER B 89 ? 0.6304 0.7066 1.1212 -0.0942 0.0109 0.0226 148 SER B N 4175 C CA . SER B 89 ? 0.4895 0.5684 0.9813 -0.0939 0.0167 0.0255 148 SER B CA 4176 C C . SER B 89 ? 0.6884 0.7684 1.1928 -0.0956 0.0214 0.0279 148 SER B C 4177 O O . SER B 89 ? 0.7547 0.8335 1.2664 -0.0970 0.0194 0.0269 148 SER B O 4178 C CB . SER B 89 ? 0.3425 0.4245 0.8375 -0.0929 0.0143 0.0238 148 SER B CB 4179 O OG . SER B 89 ? 0.5936 0.6765 1.0992 -0.0935 0.0088 0.0206 148 SER B OG 4180 N N . ASP B 90 ? 0.6141 0.6962 1.1206 -0.0954 0.0275 0.0311 149 ASP B N 4181 C CA . ASP B 90 ? 0.6375 0.7204 1.1552 -0.0968 0.0328 0.0339 149 ASP B CA 4182 C C . ASP B 90 ? 0.5679 0.6474 1.0813 -0.0975 0.0356 0.0354 149 ASP B C 4183 O O . ASP B 90 ? 0.5096 0.5874 1.0267 -0.0987 0.0323 0.0337 149 ASP B O 4184 C CB . ASP B 90 ? 0.5273 0.6123 1.0614 -0.0983 0.0299 0.0321 149 ASP B CB 4185 C CG . ASP B 90 ? 0.6520 0.7382 1.1985 -0.0997 0.0355 0.0350 149 ASP B CG 4186 O OD1 . ASP B 90 ? 0.5670 0.6527 1.1095 -0.0992 0.0420 0.0386 149 ASP B OD1 4187 O OD2 . ASP B 90 ? 0.6529 0.7405 1.2132 -0.1011 0.0335 0.0337 149 ASP B OD2 4188 N N . ASP B 91 ? 0.3502 0.4288 0.8557 -0.0966 0.0415 0.0386 150 ASP B N 4189 C CA . ASP B 91 ? 0.4776 0.5530 0.9773 -0.0969 0.0447 0.0401 150 ASP B CA 4190 C C . ASP B 91 ? 0.5274 0.6026 1.0397 -0.0987 0.0474 0.0413 150 ASP B C 4191 O O . ASP B 91 ? 0.5799 0.6522 1.0903 -0.0994 0.0472 0.0411 150 ASP B O 4192 C CB . ASP B 91 ? 0.4009 0.4757 0.8901 -0.0953 0.0508 0.0433 150 ASP B CB 4193 C CG . ASP B 91 ? 0.4984 0.5726 0.9732 -0.0937 0.0483 0.0421 150 ASP B CG 4194 O OD1 . ASP B 91 ? 0.3804 0.4540 0.8522 -0.0937 0.0419 0.0388 150 ASP B OD1 4195 O OD2 . ASP B 91 ? 0.5850 0.6593 1.0517 -0.0922 0.0527 0.0443 150 ASP B OD2 4196 N N . GLN B 92 ? 0.5715 0.6496 1.0967 -0.0992 0.0500 0.0427 151 GLN B N 4197 C CA . GLN B 92 ? 0.4250 0.5031 0.9627 -0.1008 0.0536 0.0443 151 GLN B CA 4198 C C . GLN B 92 ? 0.5936 0.6706 1.1395 -0.1026 0.0484 0.0415 151 GLN B C 4199 O O . GLN B 92 ? 0.5812 0.6562 1.1310 -0.1038 0.0507 0.0424 151 GLN B O 4200 C CB . GLN B 92 ? 0.3495 0.4312 0.8993 -0.1009 0.0571 0.0462 151 GLN B CB 4201 C CG . GLN B 92 ? 0.4735 0.5553 1.0366 -0.1023 0.0617 0.0483 151 GLN B CG 4202 C CD . GLN B 92 ? 0.6799 0.7584 1.2365 -0.1020 0.0674 0.0510 151 GLN B CD 4203 O OE1 . GLN B 92 ? 0.8203 0.8968 1.3814 -0.1033 0.0677 0.0508 151 GLN B OE1 4204 N NE2 . GLN B 92 ? 0.6488 0.7268 1.1949 -0.1000 0.0720 0.0535 151 GLN B NE2 4205 N N . MSE B 93 ? 0.3514 0.4296 0.8997 -0.1028 0.0415 0.0380 152 MSE B N 4206 C CA . MSE B 93 ? 0.5782 0.6555 1.1347 -0.1043 0.0362 0.0351 152 MSE B CA 4207 C C . MSE B 93 ? 0.6937 0.7671 1.2388 -0.1042 0.0328 0.0336 152 MSE B C 4208 O O . MSE B 93 ? 0.7747 0.8464 1.3249 -0.1055 0.0303 0.0324 152 MSE B O 4209 C CB . MSE B 93 ? 0.3522 0.4322 0.9161 -0.1043 0.0300 0.0318 152 MSE B CB 4210 C CG . MSE B 93 ? 0.9572 1.0363 1.5096 -0.1029 0.0238 0.0288 152 MSE B CG 4211 SE SE . MSE B 93 ? 1.0434 1.1190 1.5949 -0.1035 0.0154 0.0247 152 MSE B SE 4212 C CE . MSE B 93 ? 1.7792 1.8545 2.3163 -0.1010 0.0091 0.0216 152 MSE B CE 4213 N N . ILE B 94 ? 0.6836 0.7557 1.2134 -0.1025 0.0326 0.0338 153 ILE B N 4214 C CA . ILE B 94 ? 0.3903 0.4587 0.9080 -0.1022 0.0300 0.0327 153 ILE B CA 4215 C C . ILE B 94 ? 0.4729 0.5389 0.9881 -0.1028 0.0358 0.0355 153 ILE B C 4216 O O . ILE B 94 ? 0.5177 0.5809 1.0316 -0.1036 0.0340 0.0347 153 ILE B O 4217 C CB . ILE B 94 ? 0.5308 0.5985 1.0328 -0.1002 0.0285 0.0321 153 ILE B CB 4218 C CG1 . ILE B 94 ? 0.4121 0.4809 0.9147 -0.0996 0.0212 0.0285 153 ILE B CG1 4219 C CG2 . ILE B 94 ? 0.4412 0.5050 0.9298 -0.0998 0.0282 0.0322 153 ILE B CG2 4220 C CD1 . ILE B 94 ? 0.4249 0.4917 0.9307 -0.1003 0.0147 0.0255 153 ILE B CD1 4221 N N . ASP B 95 ? 0.3545 0.4214 0.8690 -0.1022 0.0429 0.0388 154 ASP B N 4222 C CA . ASP B 95 ? 0.6013 0.6661 1.1148 -0.1025 0.0492 0.0417 154 ASP B CA 4223 C C . ASP B 95 ? 0.5225 0.5871 1.0500 -0.1046 0.0495 0.0417 154 ASP B C 4224 O O . ASP B 95 ? 0.6618 0.7237 1.1876 -0.1052 0.0521 0.0427 154 ASP B O 4225 C CB . ASP B 95 ? 0.3548 0.4212 0.8676 -0.1013 0.0566 0.0452 154 ASP B CB 4226 C CG . ASP B 95 ? 0.6830 0.7488 1.1801 -0.0992 0.0575 0.0458 154 ASP B CG 4227 O OD1 . ASP B 95 ? 0.7300 0.7951 1.2185 -0.0988 0.0520 0.0432 154 ASP B OD1 4228 O OD2 . ASP B 95 ? 0.7209 0.7868 1.2142 -0.0980 0.0638 0.0487 154 ASP B OD2 4229 N N . ASN B 96 ? 0.3578 0.4251 0.8990 -0.1056 0.0467 0.0403 155 ASN B N 4230 C CA . ASN B 96 ? 0.5493 0.6165 1.1047 -0.1076 0.0460 0.0397 155 ASN B CA 4231 C C . ASN B 96 ? 0.5491 0.6137 1.1018 -0.1084 0.0395 0.0367 155 ASN B C 4232 O O . ASN B 96 ? 0.5123 0.5749 1.0695 -0.1098 0.0403 0.0370 155 ASN B O 4233 C CB . ASN B 96 ? 0.3590 0.4301 0.9297 -0.1084 0.0444 0.0388 155 ASN B CB 4234 C CG . ASN B 96 ? 0.5206 0.5943 1.0961 -0.1078 0.0512 0.0421 155 ASN B CG 4235 O OD1 . ASN B 96 ? 0.4093 0.4817 0.9807 -0.1073 0.0579 0.0454 155 ASN B OD1 4236 N ND2 . ASN B 96 ? 0.5677 0.6450 1.1517 -0.1078 0.0495 0.0413 155 ASN B ND2 4237 N N . LEU B 97 ? 0.4864 0.5508 1.0315 -0.1074 0.0331 0.0339 156 LEU B N 4238 C CA . LEU B 97 ? 0.5164 0.5782 1.0573 -0.1077 0.0266 0.0311 156 LEU B CA 4239 C C . LEU B 97 ? 0.5394 0.5973 1.0678 -0.1075 0.0291 0.0325 156 LEU B C 4240 O O . LEU B 97 ? 0.4463 0.5017 0.9755 -0.1085 0.0267 0.0316 156 LEU B O 4241 C CB . LEU B 97 ? 0.4742 0.5365 1.0082 -0.1063 0.0199 0.0281 156 LEU B CB 4242 C CG . LEU B 97 ? 0.4195 0.4788 0.9471 -0.1061 0.0129 0.0252 156 LEU B CG 4243 C CD1 . LEU B 97 ? 0.4211 0.4800 0.9619 -0.1078 0.0093 0.0235 156 LEU B CD1 4244 C CD2 . LEU B 97 ? 0.4826 0.5424 1.0031 -0.1044 0.0070 0.0225 156 LEU B CD2 4245 N N . LEU B 98 ? 0.3612 0.4187 0.8782 -0.1061 0.0338 0.0347 157 LEU B N 4246 C CA . LEU B 98 ? 0.3621 0.4162 0.8669 -0.1057 0.0370 0.0362 157 LEU B CA 4247 C C . LEU B 98 ? 0.4419 0.4947 0.9544 -0.1071 0.0417 0.0382 157 LEU B C 4248 O O . LEU B 98 ? 0.4866 0.5362 0.9947 -0.1077 0.0408 0.0378 157 LEU B O 4249 C CB . LEU B 98 ? 0.3605 0.4149 0.8539 -0.1039 0.0420 0.0385 157 LEU B CB 4250 C CG . LEU B 98 ? 0.3584 0.4138 0.8419 -0.1022 0.0381 0.0369 157 LEU B CG 4251 C CD1 . LEU B 98 ? 0.3883 0.4434 0.8597 -0.1005 0.0434 0.0392 157 LEU B CD1 4252 C CD2 . LEU B 98 ? 0.4143 0.4673 0.8901 -0.1021 0.0309 0.0339 157 LEU B CD2 4253 N N . HIS B 99 ? 0.5449 0.6000 1.0688 -0.1077 0.0469 0.0402 158 HIS B N 4254 C CA . HIS B 99 ? 0.3663 0.4204 0.8993 -0.1090 0.0518 0.0422 158 HIS B CA 4255 C C . HIS B 99 ? 0.5023 0.5553 1.0445 -0.1109 0.0467 0.0399 158 HIS B C 4256 O O . HIS B 99 ? 0.4785 0.5290 1.0214 -0.1119 0.0488 0.0407 158 HIS B O 4257 C CB . HIS B 99 ? 0.3905 0.4477 0.9355 -0.1092 0.0574 0.0445 158 HIS B CB 4258 C CG . HIS B 99 ? 0.5335 0.5899 1.0897 -0.1106 0.0623 0.0464 158 HIS B CG 4259 N ND1 . HIS B 99 ? 0.4697 0.5274 1.0417 -0.1126 0.0599 0.0452 158 HIS B ND1 4260 C CD2 . HIS B 99 ? 0.6013 0.6556 1.1551 -0.1103 0.0695 0.0494 158 HIS B CD2 4261 C CE1 . HIS B 99 ? 0.5601 0.6166 1.1392 -0.1135 0.0655 0.0474 158 HIS B CE1 4262 N NE2 . HIS B 99 ? 0.6366 0.6910 1.2047 -0.1120 0.0715 0.0500 158 HIS B NE2 4263 N N . ASP B 100 ? 0.3674 0.4225 0.9166 -0.1114 0.0401 0.0370 159 ASP B N 4264 C CA . ASP B 100 ? 0.4192 0.4735 0.9775 -0.1130 0.0346 0.0346 159 ASP B CA 4265 C C . ASP B 100 ? 0.4725 0.5229 1.0188 -0.1127 0.0303 0.0330 159 ASP B C 4266 O O . ASP B 100 ? 0.4769 0.5252 1.0272 -0.1140 0.0291 0.0326 159 ASP B O 4267 C CB . ASP B 100 ? 0.5040 0.5612 1.0716 -0.1131 0.0284 0.0317 159 ASP B CB 4268 C CG . ASP B 100 ? 0.6145 0.6755 1.1969 -0.1138 0.0321 0.0329 159 ASP B CG 4269 O OD1 . ASP B 100 ? 0.6436 0.7050 1.2276 -0.1139 0.0396 0.0362 159 ASP B OD1 4270 O OD2 . ASP B 100 ? 0.5055 0.5691 1.0979 -0.1142 0.0274 0.0306 159 ASP B OD2 4271 N N . LEU B 101 ? 0.5948 0.6444 1.1264 -0.1110 0.0281 0.0324 160 LEU B N 4272 C CA . LEU B 101 ? 0.3697 0.4157 0.8884 -0.1105 0.0243 0.0312 160 LEU B CA 4273 C C . LEU B 101 ? 0.5805 0.6234 1.0933 -0.1109 0.0300 0.0336 160 LEU B C 4274 O O . LEU B 101 ? 0.4568 0.4966 0.9649 -0.1113 0.0273 0.0328 160 LEU B O 4275 C CB . LEU B 101 ? 0.3678 0.4136 0.8720 -0.1084 0.0217 0.0303 160 LEU B CB 4276 C CG . LEU B 101 ? 0.3679 0.4154 0.8742 -0.1077 0.0145 0.0272 160 LEU B CG 4277 C CD1 . LEU B 101 ? 0.3646 0.4122 0.8567 -0.1057 0.0137 0.0270 160 LEU B CD1 4278 C CD2 . LEU B 101 ? 0.3681 0.4136 0.8764 -0.1082 0.0070 0.0243 160 LEU B CD2 4279 N N . ASN B 102 ? 0.4216 0.4654 0.9345 -0.1105 0.0378 0.0366 161 ASN B N 4280 C CA . ASN B 102 ? 0.3726 0.4137 0.8801 -0.1106 0.0440 0.0391 161 ASN B CA 4281 C C . ASN B 102 ? 0.3940 0.4343 0.9141 -0.1126 0.0463 0.0398 161 ASN B C 4282 O O . ASN B 102 ? 0.3991 0.4361 0.9142 -0.1129 0.0483 0.0406 161 ASN B O 4283 C CB . ASN B 102 ? 0.3714 0.4136 0.8745 -0.1092 0.0516 0.0420 161 ASN B CB 4284 C CG . ASN B 102 ? 0.4250 0.4645 0.9234 -0.1090 0.0587 0.0446 161 ASN B CG 4285 O OD1 . ASN B 102 ? 0.4638 0.5036 0.9725 -0.1099 0.0638 0.0465 161 ASN B OD1 4286 N ND2 . ASN B 102 ? 0.4054 0.4422 0.8879 -0.1078 0.0590 0.0447 161 ASN B ND2 4287 N N . THR B 103 ? 0.3750 0.4180 0.9114 -0.1138 0.0459 0.0395 162 THR B N 4288 C CA . THR B 103 ? 0.4283 0.4710 0.9779 -0.1156 0.0494 0.0406 162 THR B CA 4289 C C . THR B 103 ? 0.3786 0.4211 0.9395 -0.1174 0.0430 0.0380 162 THR B C 4290 O O . THR B 103 ? 0.4184 0.4596 0.9873 -0.1189 0.0450 0.0386 162 THR B O 4291 C CB . THR B 103 ? 0.4300 0.4759 0.9915 -0.1157 0.0554 0.0429 162 THR B CB 4292 O OG1 . THR B 103 ? 0.4830 0.5325 1.0526 -0.1158 0.0508 0.0410 162 THR B OG1 4293 C CG2 . THR B 103 ? 0.3754 0.4211 0.9266 -0.1138 0.0623 0.0458 162 THR B CG2 4294 N N . SER B 104 ? 0.3773 0.4213 0.9391 -0.1172 0.0354 0.0350 163 SER B N 4295 C CA . SER B 104 ? 0.3785 0.4226 0.9515 -0.1186 0.0288 0.0322 163 SER B CA 4296 C C . SER B 104 ? 0.4401 0.4803 1.0088 -0.1194 0.0265 0.0315 163 SER B C 4297 O O . SER B 104 ? 0.6623 0.6997 1.2156 -0.1183 0.0257 0.0316 163 SER B O 4298 C CB . SER B 104 ? 0.3768 0.4226 0.9487 -0.1176 0.0209 0.0290 163 SER B CB 4299 O OG . SER B 104 ? 0.6068 0.6563 1.1824 -0.1169 0.0228 0.0295 163 SER B OG 4300 N N . PRO B 105 ? 0.4694 0.5093 1.0515 -0.1213 0.0254 0.0309 164 PRO B N 4301 C CA . PRO B 105 ? 0.4642 0.5004 1.0442 -0.1223 0.0229 0.0301 164 PRO B CA 4302 C C . PRO B 105 ? 0.4421 0.4768 1.0142 -0.1214 0.0138 0.0270 164 PRO B C 4303 O O . PRO B 105 ? 0.4514 0.4882 1.0278 -0.1208 0.0081 0.0246 164 PRO B O 4304 C CB . PRO B 105 ? 0.4262 0.4636 1.0254 -0.1245 0.0233 0.0298 164 PRO B CB 4305 C CG . PRO B 105 ? 0.4834 0.5252 1.0943 -0.1244 0.0223 0.0289 164 PRO B CG 4306 C CD . PRO B 105 ? 0.5029 0.5461 1.1038 -0.1227 0.0267 0.0308 164 PRO B CD 4307 N N . ILE B 106 ? 0.4197 0.4505 0.9801 -0.1211 0.0125 0.0270 165 ILE B N 4308 C CA . ILE B 106 ? 0.3867 0.4156 0.9379 -0.1200 0.0042 0.0244 165 ILE B CA 4309 C C . ILE B 106 ? 0.3888 0.4164 0.9498 -0.1213 -0.0019 0.0221 165 ILE B C 4310 O O . ILE B 106 ? 0.3911 0.4168 0.9565 -0.1228 0.0005 0.0231 165 ILE B O 4311 C CB . ILE B 106 ? 0.5302 0.5555 1.0624 -0.1189 0.0055 0.0256 165 ILE B CB 4312 C CG1 . ILE B 106 ? 0.3851 0.4115 0.9067 -0.1175 0.0111 0.0276 165 ILE B CG1 4313 C CG2 . ILE B 106 ? 0.5037 0.5267 1.0269 -0.1178 -0.0031 0.0230 165 ILE B CG2 4314 C CD1 . ILE B 106 ? 0.4820 0.5104 0.9988 -0.1158 0.0068 0.0260 165 ILE B CD1 4315 N N . LYS B 107 ? 0.3882 0.4167 0.9526 -0.1205 -0.0099 0.0190 166 LYS B N 4316 C CA . LYS B 107 ? 0.5108 0.5382 1.0846 -0.1214 -0.0165 0.0166 166 LYS B CA 4317 C C . LYS B 107 ? 0.3912 0.4146 0.9515 -0.1202 -0.0225 0.0153 166 LYS B C 4318 O O . LYS B 107 ? 0.3935 0.4141 0.9547 -0.1212 -0.0239 0.0153 166 LYS B O 4319 C CB . LYS B 107 ? 0.5567 0.5872 1.1429 -0.1211 -0.0220 0.0137 166 LYS B CB 4320 C CG . LYS B 107 ? 0.5509 0.5806 1.1483 -0.1219 -0.0289 0.0109 166 LYS B CG 4321 C CD . LYS B 107 ? 0.6783 0.7106 1.2847 -0.1209 -0.0354 0.0076 166 LYS B CD 4322 C CE . LYS B 107 ? 0.7026 0.7394 1.3208 -0.1216 -0.0306 0.0084 166 LYS B CE 4323 N NZ . LYS B 107 ? 0.7538 0.7918 1.3884 -0.1242 -0.0265 0.0094 166 LYS B NZ 4324 N N . HIS B 108 ? 0.3896 0.4127 0.9372 -0.1180 -0.0259 0.0144 167 HIS B N 4325 C CA . HIS B 108 ? 0.4413 0.4607 0.9753 -0.1166 -0.0317 0.0133 167 HIS B CA 4326 C C . HIS B 108 ? 0.4139 0.4323 0.9296 -0.1149 -0.0293 0.0147 167 HIS B C 4327 O O . HIS B 108 ? 0.4707 0.4917 0.9845 -0.1141 -0.0262 0.0153 167 HIS B O 4328 C CB . HIS B 108 ? 0.3904 0.4099 0.9284 -0.1152 -0.0412 0.0097 167 HIS B CB 4329 C CG . HIS B 108 ? 0.7443 0.7644 1.2994 -0.1167 -0.0447 0.0078 167 HIS B CG 4330 N ND1 . HIS B 108 ? 0.8292 0.8468 1.3879 -0.1182 -0.0448 0.0083 167 HIS B ND1 4331 C CD2 . HIS B 108 ? 0.6478 0.6707 1.2174 -0.1167 -0.0485 0.0054 167 HIS B CD2 4332 C CE1 . HIS B 108 ? 0.8195 0.8383 1.3943 -0.1193 -0.0484 0.0063 167 HIS B CE1 4333 N NE2 . HIS B 108 ? 0.7305 0.7526 1.3123 -0.1184 -0.0507 0.0045 167 HIS B NE2 4334 N N . VAL B 109 ? 0.4724 0.4870 0.9748 -0.1143 -0.0307 0.0152 168 VAL B N 4335 C CA . VAL B 109 ? 0.4201 0.4334 0.9045 -0.1125 -0.0300 0.0160 168 VAL B CA 4336 C C . VAL B 109 ? 0.3896 0.3999 0.8647 -0.1108 -0.0384 0.0139 168 VAL B C 4337 O O . VAL B 109 ? 0.3918 0.3990 0.8655 -0.1113 -0.0412 0.0137 168 VAL B O 4338 C CB . VAL B 109 ? 0.3999 0.4113 0.8743 -0.1131 -0.0226 0.0190 168 VAL B CB 4339 C CG1 . VAL B 109 ? 0.3881 0.3983 0.8441 -0.1111 -0.0223 0.0196 168 VAL B CG1 4340 C CG2 . VAL B 109 ? 0.3889 0.4031 0.8723 -0.1145 -0.0141 0.0212 168 VAL B CG2 4341 N N . HIS B 110 ? 0.3879 0.3989 0.8566 -0.1087 -0.0424 0.0124 169 HIS B N 4342 C CA . HIS B 110 ? 0.4638 0.4719 0.9236 -0.1067 -0.0505 0.0104 169 HIS B CA 4343 C C . HIS B 110 ? 0.4677 0.4747 0.9098 -0.1047 -0.0499 0.0112 169 HIS B C 4344 O O . HIS B 110 ? 0.3851 0.3943 0.8239 -0.1045 -0.0449 0.0123 169 HIS B O 4345 C CB . HIS B 110 ? 0.4668 0.4764 0.9369 -0.1056 -0.0576 0.0073 169 HIS B CB 4346 C CG . HIS B 110 ? 0.6269 0.6369 1.1134 -0.1072 -0.0600 0.0060 169 HIS B CG 4347 N ND1 . HIS B 110 ? 0.7103 0.7174 1.1982 -0.1067 -0.0670 0.0043 169 HIS B ND1 4348 C CD2 . HIS B 110 ? 0.6131 0.6261 1.1156 -0.1093 -0.0563 0.0063 169 HIS B CD2 4349 C CE1 . HIS B 110 ? 0.7676 0.7760 1.2717 -0.1085 -0.0676 0.0034 169 HIS B CE1 4350 N NE2 . HIS B 110 ? 0.7412 0.7531 1.2545 -0.1101 -0.0611 0.0046 169 HIS B NE2 4351 N N . ILE B 111 ? 0.4332 0.4367 0.8638 -0.1032 -0.0551 0.0105 170 ILE B N 4352 C CA . ILE B 111 ? 0.4749 0.4770 0.8888 -0.1012 -0.0556 0.0108 170 ILE B CA 4353 C C . ILE B 111 ? 0.5581 0.5619 0.9732 -0.0991 -0.0602 0.0086 170 ILE B C 4354 O O . ILE B 111 ? 0.5614 0.5647 0.9828 -0.0981 -0.0671 0.0062 170 ILE B O 4355 C CB . ILE B 111 ? 0.3887 0.3864 0.7901 -0.1002 -0.0599 0.0108 170 ILE B CB 4356 C CG1 . ILE B 111 ? 0.3904 0.3863 0.7893 -0.1021 -0.0549 0.0131 170 ILE B CG1 4357 C CG2 . ILE B 111 ? 0.3874 0.3839 0.7722 -0.0979 -0.0610 0.0110 170 ILE B CG2 4358 C CD1 . ILE B 111 ? 0.5551 0.5467 0.9422 -0.1013 -0.0590 0.0132 170 ILE B CD1 4359 N N . MSE B 112 ? 0.5370 0.5427 0.9457 -0.0984 -0.0563 0.0095 171 MSE B N 4360 C CA . MSE B 112 ? 0.6899 0.6977 1.1007 -0.0967 -0.0593 0.0076 171 MSE B CA 4361 C C . MSE B 112 ? 0.9578 0.9631 1.3595 -0.0939 -0.0669 0.0056 171 MSE B C 4362 O O . MSE B 112 ? 0.9849 0.9868 1.3741 -0.0930 -0.0687 0.0062 171 MSE B O 4363 C CB . MSE B 112 ? 0.7901 0.8005 1.1958 -0.0966 -0.0528 0.0092 171 MSE B CB 4364 C CG . MSE B 112 ? 0.9086 0.9229 1.3279 -0.0984 -0.0474 0.0100 171 MSE B CG 4365 SE SE . MSE B 112 ? 1.9318 1.9500 2.3493 -0.0971 -0.0446 0.0099 171 MSE B SE 4366 C CE . MSE B 112 ? 0.3749 0.3919 0.7910 -0.0942 -0.0551 0.0060 171 MSE B CE 4367 N N . ASP B 113 ? 1.0263 1.0330 1.4341 -0.0924 -0.0714 0.0032 172 ASP B N 4368 C CA . ASP B 113 ? 1.1326 1.1371 1.5325 -0.0894 -0.0785 0.0011 172 ASP B CA 4369 C C . ASP B 113 ? 1.2413 1.2472 1.6326 -0.0879 -0.0765 0.0012 172 ASP B C 4370 O O . ASP B 113 ? 1.2995 1.3052 1.6893 -0.0855 -0.0815 -0.0010 172 ASP B O 4371 C CB . ASP B 113 ? 1.1758 1.1806 1.5881 -0.0885 -0.0853 -0.0020 172 ASP B CB 4372 C CG . ASP B 113 ? 1.2834 1.2841 1.6898 -0.0862 -0.0933 -0.0037 172 ASP B CG 4373 O OD1 . ASP B 113 ? 1.4235 1.4212 1.8153 -0.0850 -0.0939 -0.0026 172 ASP B OD1 4374 O OD2 . ASP B 113 ? 1.2189 1.2192 1.6354 -0.0854 -0.0991 -0.0061 172 ASP B OD2 4375 N N . GLY B 114 ? 1.3289 1.3362 1.7146 -0.0891 -0.0692 0.0037 173 GLY B N 4376 C CA . GLY B 114 ? 1.3294 1.3384 1.7079 -0.0879 -0.0665 0.0040 173 GLY B CA 4377 C C . GLY B 114 ? 1.3506 1.3570 1.7113 -0.0865 -0.0660 0.0051 173 GLY B C 4378 O O . GLY B 114 ? 1.1893 1.1928 1.5424 -0.0843 -0.0718 0.0038 173 GLY B O 4379 N N . GLY B 115 ? 1.3856 1.3932 1.7402 -0.0875 -0.0590 0.0075 174 GLY B N 4380 C CA . GLY B 115 ? 1.3041 1.3096 1.6422 -0.0865 -0.0575 0.0087 174 GLY B CA 4381 C C . GLY B 115 ? 1.2977 1.2994 1.6276 -0.0865 -0.0594 0.0094 174 GLY B C 4382 O O . GLY B 115 ? 1.5623 1.5621 1.8971 -0.0865 -0.0645 0.0083 174 GLY B O 4383 N N . THR B 116 ? 0.7802 0.7807 1.0975 -0.0866 -0.0554 0.0113 175 THR B N 4384 C CA . THR B 116 ? 0.6730 0.6698 0.9802 -0.0864 -0.0572 0.0120 175 THR B CA 4385 C C . THR B 116 ? 0.6174 0.6141 0.9221 -0.0884 -0.0505 0.0144 175 THR B C 4386 O O . THR B 116 ? 0.5965 0.5904 0.8961 -0.0887 -0.0516 0.0150 175 THR B O 4387 C CB . THR B 116 ? 0.8622 0.8568 1.1539 -0.0840 -0.0597 0.0118 175 THR B CB 4388 O OG1 . THR B 116 ? 0.9409 0.9377 1.2269 -0.0839 -0.0543 0.0128 175 THR B OG1 4389 C CG2 . THR B 116 ? 0.7845 0.7780 1.0775 -0.0817 -0.0673 0.0094 175 THR B CG2 4390 N N . GLN B 117 ? 0.5248 0.5244 0.8325 -0.0895 -0.0436 0.0158 176 GLN B N 4391 C CA . GLN B 117 ? 0.3757 0.3752 0.6816 -0.0912 -0.0370 0.0180 176 GLN B CA 4392 C C . GLN B 117 ? 0.3768 0.3776 0.6980 -0.0933 -0.0353 0.0182 176 GLN B C 4393 O O . GLN B 117 ? 0.5193 0.5218 0.8526 -0.0935 -0.0382 0.0168 176 GLN B O 4394 C CB . GLN B 117 ? 0.3737 0.3752 0.6741 -0.0912 -0.0300 0.0195 176 GLN B CB 4395 C CG . GLN B 117 ? 0.4847 0.4847 0.7689 -0.0894 -0.0306 0.0196 176 GLN B CG 4396 C CD . GLN B 117 ? 0.5988 0.6009 0.8780 -0.0892 -0.0239 0.0210 176 GLN B CD 4397 O OE1 . GLN B 117 ? 0.5350 0.5377 0.8146 -0.0903 -0.0176 0.0227 176 GLN B OE1 4398 N NE2 . GLN B 117 ? 0.4636 0.4666 0.7379 -0.0876 -0.0253 0.0202 176 GLN B NE2 4399 N N . VAL B 118 ? 0.4529 0.4527 0.7735 -0.0948 -0.0307 0.0199 177 VAL B N 4400 C CA . VAL B 118 ? 0.3794 0.3799 0.7138 -0.0968 -0.0291 0.0203 177 VAL B CA 4401 C C . VAL B 118 ? 0.3780 0.3825 0.7260 -0.0978 -0.0254 0.0204 177 VAL B C 4402 O O . VAL B 118 ? 0.3765 0.3829 0.7225 -0.0978 -0.0192 0.0219 177 VAL B O 4403 C CB . VAL B 118 ? 0.3810 0.3796 0.7110 -0.0981 -0.0237 0.0223 177 VAL B CB 4404 C CG1 . VAL B 118 ? 0.3795 0.3791 0.7007 -0.0978 -0.0163 0.0241 177 VAL B CG1 4405 C CG2 . VAL B 118 ? 0.3824 0.3819 0.7273 -0.1002 -0.0215 0.0227 177 VAL B CG2 4406 N N . LYS B 119 ? 0.3786 0.3842 0.7402 -0.0984 -0.0294 0.0189 178 LYS B N 4407 C CA . LYS B 119 ? 0.4512 0.4605 0.8270 -0.0995 -0.0262 0.0190 178 LYS B CA 4408 C C . LYS B 119 ? 0.4119 0.4215 0.8027 -0.1008 -0.0299 0.0177 178 LYS B C 4409 O O . LYS B 119 ? 0.6212 0.6287 1.0119 -0.1001 -0.0369 0.0159 178 LYS B O 4410 C CB . LYS B 119 ? 0.3984 0.4103 0.7740 -0.0980 -0.0276 0.0179 178 LYS B CB 4411 C CG . LYS B 119 ? 0.5149 0.5260 0.8907 -0.0964 -0.0360 0.0152 178 LYS B CG 4412 C CD . LYS B 119 ? 0.6053 0.6188 0.9793 -0.0949 -0.0362 0.0144 178 LYS B CD 4413 C CE . LYS B 119 ? 0.8339 0.8467 1.2085 -0.0931 -0.0443 0.0116 178 LYS B CE 4414 N NZ . LYS B 119 ? 0.9140 0.9291 1.2865 -0.0916 -0.0442 0.0108 178 LYS B NZ 4415 N N . PHE B 120 ? 0.3793 0.3911 0.7828 -0.1025 -0.0251 0.0187 179 PHE B N 4416 C CA . PHE B 120 ? 0.3807 0.3931 0.7996 -0.1039 -0.0280 0.0176 179 PHE B CA 4417 C C . PHE B 120 ? 0.3793 0.3954 0.8109 -0.1039 -0.0292 0.0162 179 PHE B C 4418 O O . PHE B 120 ? 0.4026 0.4213 0.8333 -0.1035 -0.0252 0.0170 179 PHE B O 4419 C CB . PHE B 120 ? 0.3823 0.3944 0.8076 -0.1061 -0.0220 0.0196 179 PHE B CB 4420 C CG . PHE B 120 ? 0.3874 0.3956 0.8017 -0.1063 -0.0212 0.0207 179 PHE B CG 4421 C CD1 . PHE B 120 ? 0.3848 0.3900 0.7877 -0.1049 -0.0272 0.0195 179 PHE B CD1 4422 C CD2 . PHE B 120 ? 0.3852 0.3929 0.8003 -0.1077 -0.0142 0.0230 179 PHE B CD2 4423 C CE1 . PHE B 120 ? 0.4689 0.4706 0.8614 -0.1050 -0.0265 0.0206 179 PHE B CE1 4424 C CE2 . PHE B 120 ? 0.3870 0.3911 0.7917 -0.1078 -0.0133 0.0240 179 PHE B CE2 4425 C CZ . PHE B 120 ? 0.3876 0.3888 0.7810 -0.1065 -0.0195 0.0227 179 PHE B CZ 4426 N N . VAL B 121 ? 0.5101 0.5265 0.9534 -0.1043 -0.0347 0.0141 180 VAL B N 4427 C CA . VAL B 121 ? 0.4843 0.5044 0.9422 -0.1047 -0.0351 0.0129 180 VAL B CA 4428 C C . VAL B 121 ? 0.4546 0.4760 0.9273 -0.1072 -0.0312 0.0139 180 VAL B C 4429 O O . VAL B 121 ? 0.4797 0.4991 0.9577 -0.1082 -0.0337 0.0134 180 VAL B O 4430 C CB . VAL B 121 ? 0.4177 0.4376 0.8799 -0.1033 -0.0440 0.0095 180 VAL B CB 4431 C CG1 . VAL B 121 ? 0.5064 0.5227 0.9675 -0.1032 -0.0499 0.0083 180 VAL B CG1 4432 C CG2 . VAL B 121 ? 0.4505 0.4741 0.9298 -0.1041 -0.0444 0.0082 180 VAL B CG2 4433 N N . PHE B 122 ? 0.5227 0.5473 1.0019 -0.1080 -0.0248 0.0156 181 PHE B N 4434 C CA . PHE B 122 ? 0.3801 0.4062 0.8740 -0.1102 -0.0204 0.0167 181 PHE B CA 4435 C C . PHE B 122 ? 0.4983 0.5272 1.0083 -0.1107 -0.0245 0.0144 181 PHE B C 4436 O O . PHE B 122 ? 0.3932 0.4247 0.9050 -0.1096 -0.0256 0.0134 181 PHE B O 4437 C CB . PHE B 122 ? 0.4175 0.4455 0.9108 -0.1108 -0.0114 0.0197 181 PHE B CB 4438 C CG . PHE B 122 ? 0.3798 0.4051 0.8612 -0.1109 -0.0061 0.0222 181 PHE B CG 4439 C CD1 . PHE B 122 ? 0.3816 0.4032 0.8552 -0.1109 -0.0091 0.0218 181 PHE B CD1 4440 C CD2 . PHE B 122 ? 0.3980 0.4245 0.8761 -0.1108 0.0019 0.0250 181 PHE B CD2 4441 C CE1 . PHE B 122 ? 0.5536 0.5726 1.0160 -0.1109 -0.0042 0.0240 181 PHE B CE1 4442 C CE2 . PHE B 122 ? 0.4110 0.4349 0.8781 -0.1107 0.0069 0.0271 181 PHE B CE2 4443 C CZ . PHE B 122 ? 0.3815 0.4017 0.8407 -0.1108 0.0038 0.0265 181 PHE B CZ 4444 N N . THR B 123 ? 0.6583 0.6865 1.1798 -0.1121 -0.0269 0.0135 182 THR B N 4445 C CA . THR B 123 ? 0.3819 0.4129 0.9205 -0.1129 -0.0296 0.0115 182 THR B CA 4446 C C . THR B 123 ? 0.4200 0.4529 0.9712 -0.1152 -0.0225 0.0138 182 THR B C 4447 O O . THR B 123 ? 0.4934 0.5243 1.0472 -0.1167 -0.0204 0.0149 182 THR B O 4448 C CB . THR B 123 ? 0.3837 0.4129 0.9281 -0.1128 -0.0380 0.0085 182 THR B CB 4449 O OG1 . THR B 123 ? 0.5219 0.5494 1.0550 -0.1103 -0.0446 0.0064 182 THR B OG1 4450 C CG2 . THR B 123 ? 0.3838 0.4161 0.9469 -0.1137 -0.0402 0.0066 182 THR B CG2 4451 N N . PHE B 124 ? 0.4214 0.4580 0.9800 -0.1154 -0.0187 0.0145 183 PHE B N 4452 C CA . PHE B 124 ? 0.4162 0.4547 0.9861 -0.1173 -0.0114 0.0169 183 PHE B CA 4453 C C . PHE B 124 ? 0.5117 0.5517 1.1004 -0.1190 -0.0140 0.0152 183 PHE B C 4454 O O . PHE B 124 ? 0.5923 0.6322 1.1856 -0.1185 -0.0216 0.0121 183 PHE B O 4455 C CB . PHE B 124 ? 0.3787 0.4205 0.9485 -0.1167 -0.0060 0.0186 183 PHE B CB 4456 C CG . PHE B 124 ? 0.4193 0.4600 0.9718 -0.1151 -0.0026 0.0204 183 PHE B CG 4457 C CD1 . PHE B 124 ? 0.3782 0.4169 0.9238 -0.1156 0.0042 0.0235 183 PHE B CD1 4458 C CD2 . PHE B 124 ? 0.3906 0.4319 0.9335 -0.1131 -0.0060 0.0191 183 PHE B CD2 4459 C CE1 . PHE B 124 ? 0.4234 0.4610 0.9531 -0.1141 0.0073 0.0250 183 PHE B CE1 4460 C CE2 . PHE B 124 ? 0.3743 0.4145 0.9014 -0.1118 -0.0029 0.0207 183 PHE B CE2 4461 C CZ . PHE B 124 ? 0.3750 0.4135 0.8956 -0.1123 0.0037 0.0237 183 PHE B CZ 4462 N N . LYS B 125 ? 0.4391 0.4804 1.0386 -0.1208 -0.0075 0.0174 184 LYS B N 4463 C CA . LYS B 125 ? 0.4558 0.4985 1.0739 -0.1227 -0.0087 0.0163 184 LYS B CA 4464 C C . LYS B 125 ? 0.4851 0.5315 1.1138 -0.1221 -0.0136 0.0135 184 LYS B C 4465 O O . LYS B 125 ? 0.4966 0.5432 1.1364 -0.1228 -0.0193 0.0108 184 LYS B O 4466 C CB . LYS B 125 ? 0.4871 0.5309 1.1137 -0.1244 0.0002 0.0196 184 LYS B CB 4467 C CG . LYS B 125 ? 0.6012 0.6477 1.2483 -0.1262 0.0005 0.0189 184 LYS B CG 4468 C CD . LYS B 125 ? 0.5839 0.6308 1.2374 -0.1278 0.0098 0.0225 184 LYS B CD 4469 C CE . LYS B 125 ? 0.5243 0.5734 1.1984 -0.1298 0.0102 0.0219 184 LYS B CE 4470 N NZ . LYS B 125 ? 0.5623 0.6126 1.2435 -0.1308 0.0197 0.0255 184 LYS B NZ 4471 N N . ASN B 126 ? 0.4224 0.4713 1.0471 -0.1209 -0.0115 0.0141 185 ASN B N 4472 C CA . ASN B 126 ? 0.3791 0.4313 1.0115 -0.1201 -0.0160 0.0115 185 ASN B CA 4473 C C . ASN B 126 ? 0.5338 0.5847 1.1581 -0.1180 -0.0248 0.0080 185 ASN B C 4474 O O . ASN B 126 ? 0.6452 0.6984 1.2724 -0.1168 -0.0286 0.0058 185 ASN B O 4475 C CB . ASN B 126 ? 0.3767 0.4321 1.0071 -0.1194 -0.0104 0.0135 185 ASN B CB 4476 C CG . ASN B 126 ? 0.5398 0.5936 1.1512 -0.1177 -0.0083 0.0151 185 ASN B CG 4477 O OD1 . ASN B 126 ? 0.4970 0.5473 1.0962 -0.1168 -0.0114 0.0145 185 ASN B OD1 4478 N ND2 . ASN B 126 ? 0.4769 0.5330 1.0856 -0.1171 -0.0028 0.0173 185 ASN B ND2 4479 N N . ASP B 127 ? 0.4329 0.4798 1.0465 -0.1175 -0.0279 0.0077 186 ASP B N 4480 C CA . ASP B 127 ? 0.4354 0.4802 1.0400 -0.1154 -0.0361 0.0046 186 ASP B CA 4481 C C . ASP B 127 ? 0.4978 0.5431 1.0886 -0.1131 -0.0364 0.0046 186 ASP B C 4482 O O . ASP B 127 ? 0.3779 0.4217 0.9613 -0.1111 -0.0430 0.0021 186 ASP B O 4483 C CB . ASP B 127 ? 0.4169 0.4629 1.0349 -0.1152 -0.0434 0.0008 186 ASP B CB 4484 C CG . ASP B 127 ? 0.6504 0.6946 1.2783 -0.1169 -0.0457 0.0000 186 ASP B CG 4485 O OD1 . ASP B 127 ? 0.3968 0.4374 1.0162 -0.1173 -0.0452 0.0013 186 ASP B OD1 4486 O OD2 . ASP B 127 ? 0.7861 0.8323 1.4301 -0.1178 -0.0481 -0.0019 186 ASP B OD2 4487 N N . LYS B 128 ? 0.3764 0.4236 0.9639 -0.1133 -0.0292 0.0074 187 LYS B N 4488 C CA . LYS B 128 ? 0.4729 0.5202 1.0458 -0.1113 -0.0286 0.0079 187 LYS B CA 4489 C C . LYS B 128 ? 0.5586 0.6020 1.1151 -0.1107 -0.0278 0.0094 187 LYS B C 4490 O O . LYS B 128 ? 0.4484 0.4894 1.0052 -0.1120 -0.0262 0.0105 187 LYS B O 4491 C CB . LYS B 128 ? 0.4402 0.4908 1.0150 -0.1117 -0.0213 0.0105 187 LYS B CB 4492 C CG . LYS B 128 ? 0.4566 0.5113 1.0455 -0.1118 -0.0224 0.0089 187 LYS B CG 4493 C CD . LYS B 128 ? 0.4291 0.4841 1.0150 -0.1097 -0.0301 0.0053 187 LYS B CD 4494 C CE . LYS B 128 ? 0.5686 0.6278 1.1673 -0.1097 -0.0308 0.0038 187 LYS B CE 4495 N NZ . LYS B 128 ? 0.4584 0.5193 1.0753 -0.1119 -0.0301 0.0035 187 LYS B NZ 4496 N N . GLN B 129 ? 0.4231 0.4657 0.9650 -0.1087 -0.0288 0.0093 188 GLN B N 4497 C CA . GLN B 129 ? 0.3743 0.4131 0.9003 -0.1079 -0.0292 0.0101 188 GLN B CA 4498 C C . GLN B 129 ? 0.4487 0.4877 0.9608 -0.1068 -0.0241 0.0124 188 GLN B C 4499 O O . GLN B 129 ? 0.3706 0.4124 0.8836 -0.1062 -0.0217 0.0128 188 GLN B O 4500 C CB . GLN B 129 ? 0.3750 0.4114 0.8952 -0.1061 -0.0381 0.0070 188 GLN B CB 4501 C CG . GLN B 129 ? 0.3772 0.4124 0.9087 -0.1069 -0.0435 0.0048 188 GLN B CG 4502 C CD . GLN B 129 ? 0.4456 0.4779 0.9701 -0.1048 -0.0522 0.0019 188 GLN B CD 4503 O OE1 . GLN B 129 ? 0.4182 0.4512 0.9389 -0.1027 -0.0561 -0.0001 188 GLN B OE1 4504 N NE2 . GLN B 129 ? 0.3802 0.4092 0.9029 -0.1052 -0.0551 0.0017 188 GLN B NE2 4505 N N . ALA B 130 ? 0.6125 0.6482 1.1116 -0.1066 -0.0225 0.0139 189 ALA B N 4506 C CA . ALA B 130 ? 0.4808 0.5163 0.9659 -0.1056 -0.0178 0.0160 189 ALA B CA 4507 C C . ALA B 130 ? 0.5430 0.5745 1.0124 -0.1046 -0.0201 0.0160 189 ALA B C 4508 O O . ALA B 130 ? 0.4396 0.4684 0.9094 -0.1051 -0.0235 0.0152 189 ALA B O 4509 C CB . ALA B 130 ? 0.3715 0.4082 0.8596 -0.1069 -0.0089 0.0193 189 ALA B CB 4510 N N . VAL B 131 ? 0.4221 0.4532 0.8777 -0.1031 -0.0182 0.0168 190 VAL B N 4511 C CA . VAL B 131 ? 0.3717 0.3992 0.8115 -0.1021 -0.0195 0.0172 190 VAL B CA 4512 C C . VAL B 131 ? 0.4338 0.4603 0.8672 -0.1029 -0.0119 0.0202 190 VAL B C 4513 O O . VAL B 131 ? 0.4367 0.4652 0.8692 -0.1028 -0.0059 0.0221 190 VAL B O 4514 C CB . VAL B 131 ? 0.3700 0.3973 0.7978 -0.0998 -0.0225 0.0160 190 VAL B CB 4515 C CG1 . VAL B 131 ? 0.3705 0.3943 0.7818 -0.0989 -0.0229 0.0167 190 VAL B CG1 4516 C CG2 . VAL B 131 ? 0.3700 0.3977 0.8029 -0.0987 -0.0303 0.0128 190 VAL B CG2 4517 N N . PHE B 132 ? 0.3739 0.3972 0.8025 -0.1035 -0.0123 0.0207 191 PHE B N 4518 C CA . PHE B 132 ? 0.3744 0.3964 0.7964 -0.1041 -0.0053 0.0234 191 PHE B CA 4519 C C . PHE B 132 ? 0.5286 0.5476 0.9327 -0.1027 -0.0063 0.0236 191 PHE B C 4520 O O . PHE B 132 ? 0.3756 0.3919 0.7742 -0.1022 -0.0121 0.0222 191 PHE B O 4521 C CB . PHE B 132 ? 0.3768 0.3975 0.8075 -0.1060 -0.0037 0.0242 191 PHE B CB 4522 C CG . PHE B 132 ? 0.3778 0.3965 0.8008 -0.1064 0.0030 0.0267 191 PHE B CG 4523 C CD1 . PHE B 132 ? 0.3963 0.4168 0.8214 -0.1066 0.0109 0.0290 191 PHE B CD1 4524 C CD2 . PHE B 132 ? 0.3796 0.3946 0.7931 -0.1064 0.0014 0.0267 191 PHE B CD2 4525 C CE1 . PHE B 132 ? 0.3780 0.3966 0.7960 -0.1067 0.0172 0.0313 191 PHE B CE1 4526 C CE2 . PHE B 132 ? 0.3806 0.3937 0.7868 -0.1067 0.0077 0.0289 191 PHE B CE2 4527 C CZ . PHE B 132 ? 0.3798 0.3947 0.7883 -0.1068 0.0156 0.0311 191 PHE B CZ 4528 N N . LYS B 133 ? 0.3732 0.3926 0.7681 -0.1020 -0.0005 0.0255 192 LYS B N 4529 C CA . LYS B 133 ? 0.3733 0.3899 0.7512 -0.1008 -0.0002 0.0260 192 LYS B CA 4530 C C . LYS B 133 ? 0.3741 0.3896 0.7476 -0.1013 0.0073 0.0285 192 LYS B C 4531 O O . LYS B 133 ? 0.4393 0.4568 0.8152 -0.1013 0.0136 0.0302 192 LYS B O 4532 C CB . LYS B 133 ? 0.3709 0.3888 0.7397 -0.0989 -0.0009 0.0255 192 LYS B CB 4533 C CG . LYS B 133 ? 0.3703 0.3885 0.7402 -0.0979 -0.0087 0.0229 192 LYS B CG 4534 C CD . LYS B 133 ? 0.3680 0.3876 0.7300 -0.0962 -0.0087 0.0226 192 LYS B CD 4535 C CE . LYS B 133 ? 0.3677 0.3870 0.7291 -0.0949 -0.0165 0.0199 192 LYS B CE 4536 N NZ . LYS B 133 ? 0.3657 0.3859 0.7178 -0.0931 -0.0165 0.0196 192 LYS B NZ 4537 N N . PRO B 134 ? 0.3761 0.3882 0.7430 -0.1017 0.0066 0.0287 193 PRO B N 4538 C CA . PRO B 134 ? 0.3774 0.3880 0.7405 -0.1022 0.0135 0.0309 193 PRO B CA 4539 C C . PRO B 134 ? 0.3761 0.3864 0.7251 -0.1007 0.0181 0.0322 193 PRO B C 4540 O O . PRO B 134 ? 0.3749 0.3847 0.7132 -0.0993 0.0149 0.0312 193 PRO B O 4541 C CB . PRO B 134 ? 0.3798 0.3869 0.7390 -0.1028 0.0098 0.0302 193 PRO B CB 4542 C CG . PRO B 134 ? 0.3793 0.3854 0.7324 -0.1017 0.0017 0.0281 193 PRO B CG 4543 C CD . PRO B 134 ? 0.3774 0.3868 0.7397 -0.1014 -0.0009 0.0269 193 PRO B CD 4544 N N . MSE B 135 ? 0.8793 0.8896 1.2285 -0.1009 0.0258 0.0343 194 MSE B N 4545 C CA . MSE B 135 ? 0.3757 0.3854 0.7118 -0.0994 0.0309 0.0355 194 MSE B CA 4546 C C . MSE B 135 ? 0.3771 0.3832 0.6993 -0.0989 0.0293 0.0352 194 MSE B C 4547 O O . MSE B 135 ? 0.3793 0.3831 0.7033 -0.1000 0.0276 0.0350 194 MSE B O 4548 C CB . MSE B 135 ? 0.7348 0.7453 1.0757 -0.0995 0.0395 0.0379 194 MSE B CB 4549 C CG . MSE B 135 ? 0.3757 0.3851 0.7032 -0.0979 0.0451 0.0392 194 MSE B CG 4550 SE SE . MSE B 135 ? 0.9518 0.9618 1.2857 -0.0976 0.0560 0.0421 194 MSE B SE 4551 C CE . MSE B 135 ? 0.6685 0.6762 0.9820 -0.0952 0.0608 0.0429 194 MSE B CE 4552 N N . ARG B 136 ? 0.3759 0.3813 0.6841 -0.0973 0.0300 0.0352 195 ARG B N 4553 C CA . ARG B 136 ? 0.3772 0.3792 0.6712 -0.0967 0.0288 0.0350 195 ARG B CA 4554 C C . ARG B 136 ? 0.3772 0.3784 0.6617 -0.0956 0.0362 0.0366 195 ARG B C 4555 O O . ARG B 136 ? 0.5767 0.5763 0.8614 -0.0961 0.0407 0.0377 195 ARG B O 4556 C CB . ARG B 136 ? 0.3760 0.3774 0.6605 -0.0956 0.0222 0.0333 195 ARG B CB 4557 C CG . ARG B 136 ? 0.3775 0.3754 0.6495 -0.0953 0.0192 0.0328 195 ARG B CG 4558 C CD . ARG B 136 ? 0.3763 0.3738 0.6410 -0.0941 0.0124 0.0312 195 ARG B CD 4559 N NE . ARG B 136 ? 0.3767 0.3746 0.6512 -0.0948 0.0056 0.0297 195 ARG B NE 4560 C CZ . ARG B 136 ? 0.3786 0.3741 0.6538 -0.0955 0.0007 0.0289 195 ARG B CZ 4561 N NH1 . ARG B 136 ? 0.3805 0.3729 0.6469 -0.0956 0.0016 0.0296 195 ARG B NH1 4562 N NH2 . ARG B 136 ? 0.5106 0.5066 0.7953 -0.0958 -0.0053 0.0275 195 ARG B NH2 4563 N N . PHE B 137 ? 0.4229 0.4253 0.6992 -0.0940 0.0374 0.0366 196 PHE B N 4564 C CA . PHE B 137 ? 0.4000 0.4019 0.6669 -0.0927 0.0441 0.0379 196 PHE B CA 4565 C C . PHE B 137 ? 0.4421 0.4465 0.7173 -0.0923 0.0504 0.0394 196 PHE B C 4566 O O . PHE B 137 ? 0.4870 0.4939 0.7747 -0.0932 0.0493 0.0394 196 PHE B O 4567 C CB . PHE B 137 ? 0.3733 0.3747 0.6258 -0.0910 0.0421 0.0370 196 PHE B CB 4568 C CG . PHE B 137 ? 0.4949 0.4940 0.7392 -0.0911 0.0354 0.0355 196 PHE B CG 4569 C CD1 . PHE B 137 ? 0.3763 0.3723 0.6148 -0.0916 0.0353 0.0357 196 PHE B CD1 4570 C CD2 . PHE B 137 ? 0.3725 0.3724 0.6144 -0.0907 0.0293 0.0341 196 PHE B CD2 4571 C CE1 . PHE B 137 ? 0.4648 0.4585 0.6954 -0.0915 0.0291 0.0344 196 PHE B CE1 4572 C CE2 . PHE B 137 ? 0.4000 0.3975 0.6342 -0.0905 0.0231 0.0328 196 PHE B CE2 4573 C CZ . PHE B 137 ? 0.3755 0.3700 0.6040 -0.0910 0.0230 0.0331 196 PHE B CZ 4574 N N . GLY B 138 ? 0.3740 0.3778 0.6420 -0.0910 0.0570 0.0407 197 GLY B N 4575 C CA . GLY B 138 ? 0.3731 0.3790 0.6472 -0.0902 0.0633 0.0423 197 GLY B CA 4576 C C . GLY B 138 ? 0.4184 0.4272 0.6922 -0.0892 0.0621 0.0420 197 GLY B C 4577 O O . GLY B 138 ? 0.5393 0.5483 0.8069 -0.0890 0.0567 0.0405 197 GLY B O 4578 N N . ARG B 139 ? 0.3694 0.3803 0.6496 -0.0885 0.0673 0.0435 198 ARG B N 4579 C CA . ARG B 139 ? 0.4785 0.4924 0.7592 -0.0876 0.0667 0.0434 198 ARG B CA 4580 C C . ARG B 139 ? 0.4505 0.4637 0.7161 -0.0857 0.0672 0.0429 198 ARG B C 4581 O O . ARG B 139 ? 0.4548 0.4698 0.7181 -0.0850 0.0645 0.0421 198 ARG B O 4582 C CB . ARG B 139 ? 0.3663 0.3823 0.6568 -0.0871 0.0726 0.0454 198 ARG B CB 4583 C CG . ARG B 139 ? 0.3674 0.3845 0.6738 -0.0889 0.0729 0.0460 198 ARG B CG 4584 C CD . ARG B 139 ? 0.3737 0.3927 0.6883 -0.0904 0.0660 0.0444 198 ARG B CD 4585 N NE . ARG B 139 ? 0.4109 0.4320 0.7417 -0.0916 0.0672 0.0453 198 ARG B NE 4586 C CZ . ARG B 139 ? 0.4978 0.5183 0.8381 -0.0935 0.0653 0.0449 198 ARG B CZ 4587 N NH1 . ARG B 139 ? 0.4219 0.4395 0.7570 -0.0943 0.0620 0.0438 198 ARG B NH1 4588 N NH2 . ARG B 139 ? 0.4045 0.4270 0.7594 -0.0945 0.0667 0.0458 198 ARG B NH2 4589 N N . ASP B 140 ? 0.3668 0.3773 0.6222 -0.0847 0.0705 0.0432 199 ASP B N 4590 C CA . ASP B 140 ? 0.5226 0.5324 0.7638 -0.0828 0.0718 0.0429 199 ASP B CA 4591 C C . ASP B 140 ? 0.4154 0.4237 0.6462 -0.0830 0.0655 0.0409 199 ASP B C 4592 O O . ASP B 140 ? 0.5317 0.5400 0.7517 -0.0816 0.0653 0.0403 199 ASP B O 4593 C CB . ASP B 140 ? 0.4794 0.4870 0.7139 -0.0814 0.0785 0.0440 199 ASP B CB 4594 C CG . ASP B 140 ? 0.7545 0.7634 0.9967 -0.0804 0.0854 0.0460 199 ASP B CG 4595 O OD1 . ASP B 140 ? 0.5928 0.6045 0.8410 -0.0801 0.0855 0.0465 199 ASP B OD1 4596 O OD2 . ASP B 140 ? 0.9843 0.9914 1.2265 -0.0799 0.0907 0.0472 199 ASP B OD2 4597 N N . TYR B 141 ? 0.3667 0.3739 0.6011 -0.0847 0.0605 0.0400 200 TYR B N 4598 C CA . TYR B 141 ? 0.3667 0.3723 0.5917 -0.0848 0.0543 0.0383 200 TYR B CA 4599 C C . TYR B 141 ? 0.3643 0.3718 0.5869 -0.0842 0.0502 0.0372 200 TYR B C 4600 O O . TYR B 141 ? 0.7543 0.7642 0.9868 -0.0847 0.0487 0.0371 200 TYR B O 4601 C CB . TYR B 141 ? 0.5059 0.5100 0.7369 -0.0867 0.0494 0.0376 200 TYR B CB 4602 C CG . TYR B 141 ? 0.4422 0.4442 0.6633 -0.0867 0.0432 0.0361 200 TYR B CG 4603 C CD1 . TYR B 141 ? 0.5084 0.5112 0.7300 -0.0867 0.0367 0.0347 200 TYR B CD1 4604 C CD2 . TYR B 141 ? 0.5505 0.5493 0.7615 -0.0865 0.0439 0.0361 200 TYR B CD2 4605 C CE1 . TYR B 141 ? 0.4345 0.4351 0.6469 -0.0865 0.0311 0.0334 200 TYR B CE1 4606 C CE2 . TYR B 141 ? 0.5936 0.5903 0.7954 -0.0864 0.0383 0.0348 200 TYR B CE2 4607 C CZ . TYR B 141 ? 0.7073 0.7050 0.9100 -0.0863 0.0319 0.0335 200 TYR B CZ 4608 O OH . TYR B 141 ? 0.8922 0.8876 1.0856 -0.0860 0.0263 0.0324 200 TYR B OH 4609 N N . GLU B 142 ? 0.3637 0.3699 0.5731 -0.0831 0.0485 0.0363 201 GLU B N 4610 C CA . GLU B 142 ? 0.4276 0.4351 0.6332 -0.0824 0.0445 0.0352 201 GLU B CA 4611 C C . GLU B 142 ? 0.4544 0.4599 0.6537 -0.0827 0.0376 0.0336 201 GLU B C 4612 O O . GLU B 142 ? 0.4035 0.4064 0.5957 -0.0828 0.0370 0.0335 201 GLU B O 4613 C CB . GLU B 142 ? 0.3602 0.3682 0.5556 -0.0805 0.0485 0.0354 201 GLU B CB 4614 C CG . GLU B 142 ? 0.5495 0.5588 0.7490 -0.0798 0.0558 0.0371 201 GLU B CG 4615 C CD . GLU B 142 ? 0.4890 0.5014 0.6930 -0.0791 0.0567 0.0374 201 GLU B CD 4616 O OE1 . GLU B 142 ? 0.6612 0.6748 0.8660 -0.0793 0.0517 0.0362 201 GLU B OE1 4617 O OE2 . GLU B 142 ? 0.5302 0.5438 0.7368 -0.0781 0.0625 0.0388 201 GLU B OE2 4618 N N . SER B 143 ? 0.5175 0.5243 0.7192 -0.0827 0.0324 0.0324 202 SER B N 4619 C CA . SER B 143 ? 0.3620 0.3670 0.5586 -0.0827 0.0255 0.0310 202 SER B CA 4620 C C . SER B 143 ? 0.4170 0.4200 0.5980 -0.0815 0.0255 0.0306 202 SER B C 4621 O O . SER B 143 ? 0.4913 0.4952 0.6659 -0.0803 0.0292 0.0309 202 SER B O 4622 C CB . SER B 143 ? 0.3599 0.3667 0.5614 -0.0825 0.0208 0.0298 202 SER B CB 4623 O OG . SER B 143 ? 0.7205 0.7294 0.9365 -0.0836 0.0208 0.0300 202 SER B OG 4624 N N . ASP B 144 ? 0.4721 0.4723 0.6469 -0.0817 0.0213 0.0299 203 ASP B N 4625 C CA . ASP B 144 ? 0.3628 0.3610 0.5228 -0.0805 0.0204 0.0294 203 ASP B CA 4626 C C . ASP B 144 ? 0.4437 0.4432 0.5996 -0.0793 0.0180 0.0285 203 ASP B C 4627 O O . ASP B 144 ? 0.3604 0.3605 0.5217 -0.0794 0.0131 0.0276 203 ASP B O 4628 C CB . ASP B 144 ? 0.4172 0.4123 0.5727 -0.0809 0.0153 0.0289 203 ASP B CB 4629 C CG . ASP B 144 ? 0.5335 0.5263 0.6737 -0.0799 0.0155 0.0287 203 ASP B CG 4630 O OD1 . ASP B 144 ? 0.5202 0.5136 0.6526 -0.0786 0.0162 0.0283 203 ASP B OD1 4631 O OD2 . ASP B 144 ? 0.5497 0.5399 0.6855 -0.0803 0.0147 0.0289 203 ASP B OD2 4632 N N . PRO B 145 ? 0.4092 0.4091 0.5558 -0.0781 0.0216 0.0287 204 PRO B N 4633 C CA . PRO B 145 ? 0.3576 0.3585 0.4995 -0.0770 0.0197 0.0278 204 PRO B CA 4634 C C . PRO B 145 ? 0.4567 0.4556 0.5924 -0.0765 0.0129 0.0266 204 PRO B C 4635 O O . PRO B 145 ? 0.3567 0.3564 0.4916 -0.0757 0.0099 0.0258 204 PRO B O 4636 C CB . PRO B 145 ? 0.3568 0.3578 0.4885 -0.0758 0.0249 0.0282 204 PRO B CB 4637 C CG . PRO B 145 ? 0.3578 0.3589 0.4933 -0.0763 0.0306 0.0295 204 PRO B CG 4638 C CD . PRO B 145 ? 0.3599 0.3593 0.5008 -0.0777 0.0280 0.0296 204 PRO B CD 4639 N N . ASN B 146 ? 0.3599 0.3561 0.4912 -0.0769 0.0105 0.0266 205 ASN B N 4640 C CA . ASN B 146 ? 0.4505 0.4443 0.5758 -0.0763 0.0040 0.0256 205 ASN B CA 4641 C C . ASN B 146 ? 0.3905 0.3842 0.5259 -0.0770 -0.0015 0.0250 205 ASN B C 4642 O O . ASN B 146 ? 0.3679 0.3599 0.4999 -0.0762 -0.0074 0.0242 205 ASN B O 4643 C CB . ASN B 146 ? 0.3624 0.3533 0.4775 -0.0763 0.0038 0.0259 205 ASN B CB 4644 C CG . ASN B 146 ? 0.3723 0.3631 0.4759 -0.0753 0.0083 0.0262 205 ASN B CG 4645 O OD1 . ASN B 146 ? 0.4108 0.4026 0.5096 -0.0743 0.0087 0.0257 205 ASN B OD1 4646 N ND2 . ASN B 146 ? 0.3630 0.3524 0.4618 -0.0757 0.0118 0.0268 205 ASN B ND2 4647 N N . HIS B 147 ? 0.3906 0.3860 0.5385 -0.0782 0.0004 0.0255 206 HIS B N 4648 C CA . HIS B 147 ? 0.3623 0.3579 0.5209 -0.0788 -0.0045 0.0248 206 HIS B CA 4649 C C . HIS B 147 ? 0.4785 0.4760 0.6422 -0.0781 -0.0072 0.0238 206 HIS B C 4650 O O . HIS B 147 ? 0.3605 0.3606 0.5272 -0.0780 -0.0034 0.0241 206 HIS B O 4651 C CB . HIS B 147 ? 0.4113 0.4080 0.5817 -0.0805 -0.0015 0.0257 206 HIS B CB 4652 C CG . HIS B 147 ? 0.5459 0.5401 0.7145 -0.0813 -0.0017 0.0262 206 HIS B CG 4653 N ND1 . HIS B 147 ? 0.4747 0.4693 0.6518 -0.0828 0.0019 0.0271 206 HIS B ND1 4654 C CD2 . HIS B 147 ? 0.3669 0.3580 0.5259 -0.0809 -0.0050 0.0260 206 HIS B CD2 4655 C CE1 . HIS B 147 ? 0.3686 0.3605 0.5415 -0.0832 0.0008 0.0274 206 HIS B CE1 4656 N NE2 . HIS B 147 ? 0.4820 0.4717 0.6438 -0.0821 -0.0034 0.0267 206 HIS B NE2 4657 N N . PHE B 148 ? 0.4937 0.4897 0.6580 -0.0774 -0.0138 0.0226 207 PHE B N 4658 C CA . PHE B 148 ? 0.3777 0.3754 0.5481 -0.0767 -0.0170 0.0214 207 PHE B CA 4659 C C . PHE B 148 ? 0.5430 0.5429 0.7285 -0.0780 -0.0164 0.0214 207 PHE B C 4660 O O . PHE B 148 ? 0.3615 0.3613 0.5528 -0.0794 -0.0146 0.0222 207 PHE B O 4661 C CB . PHE B 148 ? 0.3612 0.3563 0.5275 -0.0753 -0.0243 0.0201 207 PHE B CB 4662 C CG . PHE B 148 ? 0.5277 0.5211 0.6801 -0.0737 -0.0252 0.0199 207 PHE B CG 4663 C CD1 . PHE B 148 ? 0.3591 0.3537 0.5084 -0.0725 -0.0249 0.0193 207 PHE B CD1 4664 C CD2 . PHE B 148 ? 0.3621 0.3525 0.5044 -0.0735 -0.0264 0.0204 207 PHE B CD2 4665 C CE1 . PHE B 148 ? 0.4393 0.4323 0.5762 -0.0711 -0.0257 0.0191 207 PHE B CE1 4666 C CE2 . PHE B 148 ? 0.4035 0.3924 0.5331 -0.0720 -0.0272 0.0202 207 PHE B CE2 4667 C CZ . PHE B 148 ? 0.4086 0.3988 0.5357 -0.0708 -0.0268 0.0196 207 PHE B CZ 4668 N N . TYR B 149 ? 0.3629 0.3648 0.5546 -0.0775 -0.0178 0.0205 208 TYR B N 4669 C CA . TYR B 149 ? 0.4212 0.4255 0.6275 -0.0785 -0.0177 0.0203 208 TYR B CA 4670 C C . TYR B 149 ? 0.4707 0.4734 0.6842 -0.0792 -0.0224 0.0196 208 TYR B C 4671 O O . TYR B 149 ? 0.5591 0.5633 0.7842 -0.0806 -0.0211 0.0199 208 TYR B O 4672 C CB . TYR B 149 ? 0.3575 0.3638 0.5676 -0.0775 -0.0194 0.0191 208 TYR B CB 4673 C CG . TYR B 149 ? 0.4847 0.4890 0.6866 -0.0756 -0.0247 0.0177 208 TYR B CG 4674 C CD1 . TYR B 149 ? 0.4755 0.4794 0.6658 -0.0744 -0.0231 0.0179 208 TYR B CD1 4675 C CD2 . TYR B 149 ? 0.3587 0.3615 0.5644 -0.0748 -0.0313 0.0161 208 TYR B CD2 4676 C CE1 . TYR B 149 ? 0.4812 0.4832 0.6640 -0.0725 -0.0278 0.0166 208 TYR B CE1 4677 C CE2 . TYR B 149 ? 0.5038 0.5046 0.7019 -0.0727 -0.0361 0.0148 208 TYR B CE2 4678 C CZ . TYR B 149 ? 0.6256 0.6259 0.8122 -0.0716 -0.0342 0.0151 208 TYR B CZ 4679 O OH . TYR B 149 ? 0.6669 0.6651 0.8460 -0.0695 -0.0387 0.0140 208 TYR B OH 4680 N N . PHE B 150 ? 0.4859 0.4855 0.6927 -0.0781 -0.0279 0.0187 209 PHE B N 4681 C CA . PHE B 150 ? 0.4818 0.4796 0.6947 -0.0785 -0.0330 0.0180 209 PHE B CA 4682 C C . PHE B 150 ? 0.4818 0.4777 0.6917 -0.0797 -0.0314 0.0192 209 PHE B C 4683 O O . PHE B 150 ? 0.5136 0.5076 0.7271 -0.0800 -0.0355 0.0187 209 PHE B O 4684 C CB . PHE B 150 ? 0.3650 0.3604 0.5730 -0.0765 -0.0403 0.0163 209 PHE B CB 4685 C CG . PHE B 150 ? 0.4034 0.3964 0.5961 -0.0750 -0.0408 0.0167 209 PHE B CG 4686 C CD1 . PHE B 150 ? 0.3664 0.3566 0.5509 -0.0752 -0.0415 0.0175 209 PHE B CD1 4687 C CD2 . PHE B 150 ? 0.3634 0.3570 0.5499 -0.0735 -0.0407 0.0161 209 PHE B CD2 4688 C CE1 . PHE B 150 ? 0.3663 0.3544 0.5369 -0.0739 -0.0420 0.0177 209 PHE B CE1 4689 C CE2 . PHE B 150 ? 0.4487 0.4403 0.6215 -0.0722 -0.0412 0.0164 209 PHE B CE2 4690 C CZ . PHE B 150 ? 0.3647 0.3535 0.5296 -0.0724 -0.0419 0.0172 209 PHE B CZ 4691 N N . SER B 151 ? 0.6353 0.6315 0.8384 -0.0802 -0.0254 0.0207 210 SER B N 4692 C CA . SER B 151 ? 0.5400 0.5344 0.7397 -0.0813 -0.0231 0.0219 210 SER B CA 4693 C C . SER B 151 ? 0.4882 0.4848 0.6964 -0.0831 -0.0166 0.0232 210 SER B C 4694 O O . SER B 151 ? 0.4243 0.4196 0.6323 -0.0841 -0.0143 0.0241 210 SER B O 4695 C CB . SER B 151 ? 0.6428 0.6353 0.8269 -0.0804 -0.0215 0.0225 210 SER B CB 4696 O OG . SER B 151 ? 0.7596 0.7497 0.9357 -0.0788 -0.0276 0.0215 210 SER B OG 4697 N N . ASP B 152 ? 0.6243 0.6241 0.8397 -0.0832 -0.0136 0.0232 211 ASP B N 4698 C CA . ASP B 152 ? 0.5997 0.6016 0.8228 -0.0845 -0.0071 0.0246 211 ASP B CA 4699 C C . ASP B 152 ? 0.5609 0.5632 0.7974 -0.0861 -0.0081 0.0246 211 ASP B C 4700 O O . ASP B 152 ? 0.6734 0.6762 0.9185 -0.0862 -0.0128 0.0234 211 ASP B O 4701 C CB . ASP B 152 ? 0.6483 0.6535 0.8752 -0.0841 -0.0041 0.0247 211 ASP B CB 4702 C CG . ASP B 152 ? 0.6835 0.6905 0.9127 -0.0847 0.0036 0.0265 211 ASP B CG 4703 O OD1 . ASP B 152 ? 0.6434 0.6488 0.8675 -0.0851 0.0071 0.0276 211 ASP B OD1 4704 O OD2 . ASP B 152 ? 0.7541 0.7639 0.9900 -0.0847 0.0063 0.0268 211 ASP B OD2 4705 N N . PHE B 153 ? 0.5801 0.5818 0.8182 -0.0873 -0.0034 0.0260 212 PHE B N 4706 C CA . PHE B 153 ? 0.3687 0.3710 0.6201 -0.0890 -0.0030 0.0263 212 PHE B CA 4707 C C . PHE B 153 ? 0.3706 0.3764 0.6340 -0.0895 0.0002 0.0267 212 PHE B C 4708 O O . PHE B 153 ? 0.5429 0.5506 0.8037 -0.0890 0.0051 0.0276 212 PHE B O 4709 C CB . PHE B 153 ? 0.4145 0.4151 0.6635 -0.0899 0.0017 0.0278 212 PHE B CB 4710 C CG . PHE B 153 ? 0.3727 0.3703 0.6205 -0.0906 -0.0027 0.0273 212 PHE B CG 4711 C CD1 . PHE B 153 ? 0.6075 0.6048 0.8636 -0.0909 -0.0091 0.0259 212 PHE B CD1 4712 C CD2 . PHE B 153 ? 0.3742 0.3691 0.6124 -0.0906 -0.0004 0.0282 212 PHE B CD2 4713 C CE1 . PHE B 153 ? 0.4541 0.4485 0.7092 -0.0914 -0.0133 0.0255 212 PHE B CE1 4714 C CE2 . PHE B 153 ? 0.3764 0.3684 0.6133 -0.0912 -0.0045 0.0278 212 PHE B CE2 4715 C CZ . PHE B 153 ? 0.5801 0.5719 0.8254 -0.0915 -0.0110 0.0265 212 PHE B CZ 4716 N N . GLU B 154 ? 0.3679 0.3748 0.6446 -0.0905 -0.0027 0.0259 213 GLU B N 4717 C CA . GLU B 154 ? 0.3666 0.3770 0.6557 -0.0911 0.0000 0.0262 213 GLU B CA 4718 C C . GLU B 154 ? 0.3668 0.3782 0.6594 -0.0920 0.0079 0.0284 213 GLU B C 4719 O O . GLU B 154 ? 0.5660 0.5755 0.8567 -0.0927 0.0103 0.0293 213 GLU B O 4720 C CB . GLU B 154 ? 0.3675 0.3786 0.6702 -0.0920 -0.0048 0.0249 213 GLU B CB 4721 C CG . GLU B 154 ? 0.3668 0.3781 0.6695 -0.0908 -0.0118 0.0226 213 GLU B CG 4722 C CD . GLU B 154 ? 0.6287 0.6414 0.9464 -0.0916 -0.0157 0.0213 213 GLU B CD 4723 O OE1 . GLU B 154 ? 0.6463 0.6615 0.9698 -0.0911 -0.0168 0.0203 213 GLU B OE1 4724 O OE2 . GLU B 154 ? 0.7277 0.7390 1.0512 -0.0927 -0.0176 0.0211 213 GLU B OE2 4725 N N . ARG B 155 ? 0.3651 0.3795 0.6627 -0.0918 0.0119 0.0291 214 ARG B N 4726 C CA . ARG B 155 ? 0.3652 0.3808 0.6679 -0.0924 0.0193 0.0312 214 ARG B CA 4727 C C . ARG B 155 ? 0.3649 0.3834 0.6839 -0.0935 0.0198 0.0313 214 ARG B C 4728 O O . ARG B 155 ? 0.4057 0.4268 0.7288 -0.0930 0.0186 0.0307 214 ARG B O 4729 C CB . ARG B 155 ? 0.3635 0.3801 0.6573 -0.0911 0.0246 0.0324 214 ARG B CB 4730 C CG . ARG B 155 ? 0.3639 0.3778 0.6419 -0.0900 0.0254 0.0326 214 ARG B CG 4731 C CD . ARG B 155 ? 0.3619 0.3769 0.6311 -0.0884 0.0289 0.0331 214 ARG B CD 4732 N NE . ARG B 155 ? 0.4488 0.4648 0.7146 -0.0875 0.0240 0.0316 214 ARG B NE 4733 C CZ . ARG B 155 ? 0.3951 0.4091 0.6505 -0.0868 0.0194 0.0303 214 ARG B CZ 4734 N NH1 . ARG B 155 ? 0.4334 0.4444 0.6806 -0.0868 0.0188 0.0303 214 ARG B NH1 4735 N NH2 . ARG B 155 ? 0.4365 0.4513 0.6896 -0.0858 0.0153 0.0289 214 ARG B NH2 4736 N N . HIS B 156 ? 0.3739 0.3920 0.7024 -0.0950 0.0215 0.0320 215 HIS B N 4737 C CA . HIS B 156 ? 0.3666 0.3873 0.7113 -0.0963 0.0218 0.0321 215 HIS B CA 4738 C C . HIS B 156 ? 0.4788 0.5025 0.8276 -0.0958 0.0275 0.0336 215 HIS B C 4739 O O . HIS B 156 ? 0.3977 0.4242 0.7568 -0.0961 0.0264 0.0332 215 HIS B O 4740 C CB . HIS B 156 ? 0.3690 0.3883 0.7219 -0.0979 0.0236 0.0329 215 HIS B CB 4741 C CG . HIS B 156 ? 0.5166 0.5360 0.8703 -0.0981 0.0319 0.0354 215 HIS B CG 4742 N ND1 . HIS B 156 ? 0.3698 0.3872 0.7109 -0.0971 0.0361 0.0366 215 HIS B ND1 4743 C CD2 . HIS B 156 ? 0.3697 0.3910 0.7355 -0.0989 0.0369 0.0369 215 HIS B CD2 4744 C CE1 . HIS B 156 ? 0.3704 0.3881 0.7153 -0.0972 0.0433 0.0387 215 HIS B CE1 4745 N NE2 . HIS B 156 ? 0.5082 0.5283 0.8681 -0.0983 0.0439 0.0390 215 HIS B NE2 4746 N N . HIS B 157 ? 0.3646 0.3877 0.7049 -0.0949 0.0336 0.0354 216 HIS B N 4747 C CA . HIS B 157 ? 0.3759 0.4015 0.7193 -0.0942 0.0394 0.0372 216 HIS B CA 4748 C C . HIS B 157 ? 0.4674 0.4950 0.8059 -0.0928 0.0373 0.0363 216 HIS B C 4749 O O . HIS B 157 ? 0.5977 0.6278 0.9401 -0.0923 0.0408 0.0374 216 HIS B O 4750 C CB . HIS B 157 ? 0.3637 0.3879 0.6995 -0.0933 0.0466 0.0393 216 HIS B CB 4751 C CG . HIS B 157 ? 0.4630 0.4849 0.7823 -0.0920 0.0460 0.0388 216 HIS B CG 4752 N ND1 . HIS B 157 ? 0.4625 0.4812 0.7739 -0.0923 0.0441 0.0382 216 HIS B ND1 4753 C CD2 . HIS B 157 ? 0.3617 0.3842 0.6708 -0.0903 0.0471 0.0389 216 HIS B CD2 4754 C CE1 . HIS B 157 ? 0.4972 0.5146 0.7945 -0.0908 0.0441 0.0379 216 HIS B CE1 4755 N NE2 . HIS B 157 ? 0.3984 0.4181 0.6941 -0.0897 0.0458 0.0382 216 HIS B NE2 4756 N N . ALA B 158 ? 0.3604 0.3866 0.6901 -0.0922 0.0315 0.0344 217 ALA B N 4757 C CA . ALA B 158 ? 0.3583 0.3861 0.6834 -0.0910 0.0289 0.0333 217 ALA B CA 4758 C C . ALA B 158 ? 0.3577 0.3879 0.6949 -0.0916 0.0247 0.0320 217 ALA B C 4759 O O . ALA B 158 ? 0.5504 0.5831 0.8891 -0.0909 0.0249 0.0318 217 ALA B O 4760 C CB . ALA B 158 ? 0.4161 0.4415 0.7279 -0.0900 0.0243 0.0318 217 ALA B CB 4761 N N . GLU B 159 ? 0.3772 0.4067 0.7229 -0.0929 0.0209 0.0309 218 GLU B N 4762 C CA . GLU B 159 ? 0.4299 0.4617 0.7885 -0.0936 0.0171 0.0295 218 GLU B CA 4763 C C . GLU B 159 ? 0.3581 0.3931 0.7274 -0.0941 0.0223 0.0312 218 GLU B C 4764 O O . GLU B 159 ? 0.4152 0.4528 0.7900 -0.0937 0.0209 0.0305 218 GLU B O 4765 C CB . GLU B 159 ? 0.3610 0.3913 0.7272 -0.0949 0.0128 0.0283 218 GLU B CB 4766 C CG . GLU B 159 ? 0.4396 0.4669 0.7972 -0.0943 0.0062 0.0263 218 GLU B CG 4767 C CD . GLU B 159 ? 0.5679 0.5961 0.9269 -0.0933 -0.0004 0.0238 218 GLU B CD 4768 O OE1 . GLU B 159 ? 0.4964 0.5272 0.8567 -0.0926 0.0007 0.0237 218 GLU B OE1 4769 O OE2 . GLU B 159 ? 0.4818 0.5081 0.8404 -0.0932 -0.0066 0.0219 218 GLU B OE2 4770 N N . ILE B 160 ? 0.3911 0.4257 0.7632 -0.0948 0.0283 0.0334 219 ILE B N 4771 C CA . ILE B 160 ? 0.3584 0.3957 0.7403 -0.0951 0.0340 0.0354 219 ILE B CA 4772 C C . ILE B 160 ? 0.4918 0.5309 0.8672 -0.0935 0.0374 0.0365 219 ILE B C 4773 O O . ILE B 160 ? 0.4860 0.5280 0.8684 -0.0933 0.0378 0.0366 219 ILE B O 4774 C CB . ILE B 160 ? 0.4623 0.4983 0.8472 -0.0959 0.0400 0.0376 219 ILE B CB 4775 C CG1 . ILE B 160 ? 0.3623 0.3968 0.7554 -0.0976 0.0370 0.0367 219 ILE B CG1 4776 C CG2 . ILE B 160 ? 0.3594 0.3981 0.7531 -0.0958 0.0463 0.0400 219 ILE B CG2 4777 C CD1 . ILE B 160 ? 0.3643 0.3963 0.7557 -0.0982 0.0418 0.0384 219 ILE B CD1 4778 N N . ALA B 161 ? 0.3560 0.3932 0.7178 -0.0923 0.0398 0.0372 220 ALA B N 4779 C CA . ALA B 161 ? 0.3985 0.4370 0.7529 -0.0906 0.0434 0.0383 220 ALA B CA 4780 C C . ALA B 161 ? 0.3575 0.3981 0.7111 -0.0899 0.0390 0.0367 220 ALA B C 4781 O O . ALA B 161 ? 0.5069 0.5499 0.8621 -0.0891 0.0417 0.0376 220 ALA B O 4782 C CB . ALA B 161 ? 0.3543 0.3902 0.6938 -0.0895 0.0454 0.0388 220 ALA B CB 4783 N N . THR B 162 ? 0.3525 0.3919 0.7034 -0.0900 0.0322 0.0342 221 THR B N 4784 C CA . THR B 162 ? 0.3509 0.3917 0.6995 -0.0891 0.0279 0.0324 221 THR B CA 4785 C C . THR B 162 ? 0.4246 0.4685 0.7870 -0.0898 0.0265 0.0319 221 THR B C 4786 O O . THR B 162 ? 0.5859 0.6320 0.9484 -0.0889 0.0261 0.0315 221 THR B O 4787 C CB . THR B 162 ? 0.3515 0.3900 0.6931 -0.0888 0.0210 0.0299 221 THR B CB 4788 O OG1 . THR B 162 ? 0.3522 0.3877 0.6812 -0.0883 0.0223 0.0304 221 THR B OG1 4789 C CG2 . THR B 162 ? 0.3499 0.3895 0.6875 -0.0875 0.0172 0.0282 221 THR B CG2 4790 N N . PHE B 163 ? 0.3866 0.4306 0.7606 -0.0913 0.0256 0.0317 222 PHE B N 4791 C CA . PHE B 163 ? 0.5095 0.5565 0.8977 -0.0921 0.0248 0.0313 222 PHE B CA 4792 C C . PHE B 163 ? 0.4183 0.4680 0.8100 -0.0917 0.0309 0.0337 222 PHE B C 4793 O O . PHE B 163 ? 0.5292 0.5816 0.9258 -0.0913 0.0299 0.0332 222 PHE B O 4794 C CB . PHE B 163 ? 0.3534 0.3999 0.7534 -0.0939 0.0240 0.0312 222 PHE B CB 4795 C CG . PHE B 163 ? 0.4059 0.4555 0.8212 -0.0949 0.0253 0.0316 222 PHE B CG 4796 C CD1 . PHE B 163 ? 0.3524 0.4041 0.7743 -0.0947 0.0203 0.0294 222 PHE B CD1 4797 C CD2 . PHE B 163 ? 0.4326 0.4831 0.8556 -0.0957 0.0315 0.0342 222 PHE B CD2 4798 C CE1 . PHE B 163 ? 0.3532 0.4079 0.7892 -0.0956 0.0215 0.0297 222 PHE B CE1 4799 C CE2 . PHE B 163 ? 0.4076 0.4611 0.8449 -0.0966 0.0327 0.0346 222 PHE B CE2 4800 C CZ . PHE B 163 ? 0.4411 0.4968 0.8850 -0.0966 0.0276 0.0324 222 PHE B CZ 4801 N N . HIS B 164 ? 0.3505 0.3994 0.7394 -0.0916 0.0372 0.0363 223 HIS B N 4802 C CA . HIS B 164 ? 0.5291 0.5802 0.9200 -0.0909 0.0435 0.0388 223 HIS B CA 4803 C C . HIS B 164 ? 0.5651 0.6171 0.9460 -0.0891 0.0436 0.0388 223 HIS B C 4804 O O . HIS B 164 ? 0.5731 0.6278 0.9583 -0.0886 0.0454 0.0396 223 HIS B O 4805 C CB . HIS B 164 ? 0.3505 0.3999 0.7393 -0.0908 0.0500 0.0415 223 HIS B CB 4806 C CG . HIS B 164 ? 0.4879 0.5372 0.8892 -0.0924 0.0518 0.0423 223 HIS B CG 4807 N ND1 . HIS B 164 ? 0.4711 0.5221 0.8815 -0.0925 0.0576 0.0448 223 HIS B ND1 4808 C CD2 . HIS B 164 ? 0.5141 0.5618 0.9204 -0.0940 0.0486 0.0410 223 HIS B CD2 4809 C CE1 . HIS B 164 ? 0.4607 0.5112 0.8814 -0.0942 0.0580 0.0450 223 HIS B CE1 4810 N NE2 . HIS B 164 ? 0.4570 0.5055 0.8754 -0.0951 0.0525 0.0427 223 HIS B NE2 4811 N N . LEU B 165 ? 0.4512 0.5009 0.8187 -0.0882 0.0417 0.0378 224 LEU B N 4812 C CA . LEU B 165 ? 0.4888 0.5392 0.8463 -0.0866 0.0415 0.0375 224 LEU B CA 4813 C C . LEU B 165 ? 0.5378 0.5903 0.8996 -0.0864 0.0364 0.0354 224 LEU B C 4814 O O . LEU B 165 ? 0.3599 0.4143 0.7194 -0.0854 0.0374 0.0358 224 LEU B O 4815 C CB . LEU B 165 ? 0.3456 0.3930 0.6886 -0.0858 0.0398 0.0366 224 LEU B CB 4816 C CG . LEU B 165 ? 0.5361 0.5839 0.8683 -0.0841 0.0394 0.0361 224 LEU B CG 4817 C CD1 . LEU B 165 ? 0.3426 0.3920 0.6733 -0.0830 0.0458 0.0387 224 LEU B CD1 4818 C CD2 . LEU B 165 ? 0.3441 0.3890 0.6629 -0.0834 0.0371 0.0349 224 LEU B CD2 4819 N N . ASP B 166 ? 0.3453 0.3973 0.7131 -0.0875 0.0309 0.0332 225 ASP B N 4820 C CA . ASP B 166 ? 0.3518 0.4056 0.7244 -0.0873 0.0257 0.0309 225 ASP B CA 4821 C C . ASP B 166 ? 0.4798 0.5371 0.8638 -0.0876 0.0285 0.0321 225 ASP B C 4822 O O . ASP B 166 ? 0.5074 0.5667 0.8927 -0.0869 0.0264 0.0311 225 ASP B O 4823 C CB . ASP B 166 ? 0.4201 0.4724 0.7977 -0.0882 0.0195 0.0284 225 ASP B CB 4824 C CG . ASP B 166 ? 0.4731 0.5271 0.8561 -0.0878 0.0141 0.0259 225 ASP B CG 4825 O OD1 . ASP B 166 ? 0.5022 0.5585 0.8978 -0.0887 0.0141 0.0258 225 ASP B OD1 4826 O OD2 . ASP B 166 ? 0.3626 0.4155 0.7371 -0.0866 0.0099 0.0239 225 ASP B OD2 4827 N N . ARG B 167 ? 0.3959 0.4538 0.7880 -0.0886 0.0333 0.0344 226 ARG B N 4828 C CA . ARG B 167 ? 0.3512 0.4123 0.7539 -0.0888 0.0368 0.0360 226 ARG B CA 4829 C C . ARG B 167 ? 0.5476 0.6099 0.9433 -0.0873 0.0416 0.0382 226 ARG B C 4830 O O . ARG B 167 ? 0.5399 0.6049 0.9386 -0.0867 0.0416 0.0383 226 ARG B O 4831 C CB . ARG B 167 ? 0.4170 0.4781 0.8300 -0.0902 0.0408 0.0380 226 ARG B CB 4832 C CG . ARG B 167 ? 0.3444 0.4087 0.7681 -0.0904 0.0452 0.0401 226 ARG B CG 4833 C CD . ARG B 167 ? 0.4622 0.5263 0.8972 -0.0918 0.0486 0.0417 226 ARG B CD 4834 N NE . ARG B 167 ? 0.5144 0.5787 0.9600 -0.0935 0.0437 0.0395 226 ARG B NE 4835 C CZ . ARG B 167 ? 0.6221 0.6862 1.0784 -0.0950 0.0455 0.0403 226 ARG B CZ 4836 N NH1 . ARG B 167 ? 0.5033 0.5668 0.9608 -0.0950 0.0522 0.0434 226 ARG B NH1 4837 N NH2 . ARG B 167 ? 0.6490 0.7132 1.1147 -0.0964 0.0406 0.0381 226 ARG B NH2 4838 N N . VAL B 168 ? 0.3422 0.4025 0.7285 -0.0866 0.0457 0.0399 227 VAL B N 4839 C CA . VAL B 168 ? 0.3408 0.4019 0.7199 -0.0849 0.0506 0.0420 227 VAL B CA 4840 C C . VAL B 168 ? 0.4176 0.4795 0.7887 -0.0837 0.0475 0.0405 227 VAL B C 4841 O O . VAL B 168 ? 0.6708 0.7348 1.0411 -0.0826 0.0502 0.0419 227 VAL B O 4842 C CB . VAL B 168 ? 0.5987 0.6569 0.9676 -0.0843 0.0545 0.0435 227 VAL B CB 4843 C CG1 . VAL B 168 ? 0.6249 0.6836 0.9852 -0.0823 0.0589 0.0453 227 VAL B CG1 4844 C CG2 . VAL B 168 ? 0.3433 0.4006 0.7199 -0.0852 0.0586 0.0453 227 VAL B CG2 4845 N N . LEU B 169 ? 0.3614 0.4218 0.7269 -0.0838 0.0417 0.0377 228 LEU B N 4846 C CA . LEU B 169 ? 0.4346 0.4955 0.7922 -0.0826 0.0385 0.0361 228 LEU B CA 4847 C C . LEU B 169 ? 0.3838 0.4474 0.7504 -0.0828 0.0350 0.0346 228 LEU B C 4848 O O . LEU B 169 ? 0.5040 0.5684 0.8655 -0.0817 0.0327 0.0333 228 LEU B O 4849 C CB . LEU B 169 ? 0.3581 0.4161 0.7058 -0.0823 0.0338 0.0338 228 LEU B CB 4850 C CG . LEU B 169 ? 0.4356 0.4909 0.7720 -0.0818 0.0368 0.0349 228 LEU B CG 4851 C CD1 . LEU B 169 ? 0.4272 0.4796 0.7551 -0.0817 0.0318 0.0326 228 LEU B CD1 4852 C CD2 . LEU B 169 ? 0.3481 0.4042 0.6761 -0.0802 0.0409 0.0365 228 LEU B CD2 4853 N N . GLY B 170 ? 0.4162 0.4810 0.7958 -0.0841 0.0348 0.0347 229 GLY B N 4854 C CA . GLY B 170 ? 0.3376 0.4053 0.7269 -0.0844 0.0321 0.0335 229 GLY B CA 4855 C C . GLY B 170 ? 0.5367 0.6035 0.9264 -0.0845 0.0249 0.0298 229 GLY B C 4856 O O . GLY B 170 ? 0.5904 0.6592 0.9851 -0.0842 0.0218 0.0282 229 GLY B O 4857 N N . PHE B 171 ? 0.5130 0.5767 0.8973 -0.0848 0.0221 0.0286 230 PHE B N 4858 C CA . PHE B 171 ? 0.5263 0.5887 0.9104 -0.0846 0.0150 0.0252 230 PHE B CA 4859 C C . PHE B 171 ? 0.4627 0.5262 0.8611 -0.0860 0.0123 0.0240 230 PHE B C 4860 O O . PHE B 171 ? 0.5402 0.6048 0.9437 -0.0856 0.0079 0.0216 230 PHE B O 4861 C CB . PHE B 171 ? 0.6926 0.7513 1.0660 -0.0843 0.0130 0.0244 230 PHE B CB 4862 C CG . PHE B 171 ? 0.6635 0.7210 1.0225 -0.0829 0.0145 0.0250 230 PHE B CG 4863 C CD1 . PHE B 171 ? 0.4681 0.5276 0.8238 -0.0816 0.0151 0.0249 230 PHE B CD1 4864 C CD2 . PHE B 171 ? 0.5491 0.6038 0.8981 -0.0827 0.0152 0.0255 230 PHE B CD2 4865 C CE1 . PHE B 171 ? 0.5628 0.6212 0.9055 -0.0803 0.0165 0.0253 230 PHE B CE1 4866 C CE2 . PHE B 171 ? 0.5172 0.5709 0.8533 -0.0814 0.0166 0.0259 230 PHE B CE2 4867 C CZ . PHE B 171 ? 0.5432 0.5988 0.8763 -0.0802 0.0172 0.0258 230 PHE B CZ 4868 N N . ARG B 172 ? 0.6279 0.6908 1.0326 -0.0874 0.0151 0.0256 231 ARG B N 4869 C CA . ARG B 172 ? 0.4790 0.5427 0.8975 -0.0889 0.0130 0.0246 231 ARG B CA 4870 C C . ARG B 172 ? 0.4942 0.5562 0.9133 -0.0887 0.0055 0.0211 231 ARG B C 4871 O O . ARG B 172 ? 0.3656 0.4292 0.7954 -0.0891 0.0021 0.0192 231 ARG B O 4872 C CB . ARG B 172 ? 0.5260 0.5934 0.9560 -0.0893 0.0148 0.0252 231 ARG B CB 4873 C CG . ARG B 172 ? 0.5918 0.6607 1.0256 -0.0898 0.0222 0.0289 231 ARG B CG 4874 C CD . ARG B 172 ? 0.5006 0.5733 0.9441 -0.0898 0.0239 0.0296 231 ARG B CD 4875 N NE . ARG B 172 ? 0.5669 0.6408 1.0082 -0.0893 0.0307 0.0331 231 ARG B NE 4876 C CZ . ARG B 172 ? 0.5486 0.6228 0.9964 -0.0902 0.0361 0.0359 231 ARG B CZ 4877 N NH1 . ARG B 172 ? 0.5401 0.6134 0.9970 -0.0918 0.0353 0.0355 231 ARG B NH1 4878 N NH2 . ARG B 172 ? 0.6270 0.7021 1.0721 -0.0894 0.0422 0.0390 231 ARG B NH2 4879 N N . ARG B 173 ? 0.3924 0.4513 0.7999 -0.0879 0.0029 0.0201 232 ARG B N 4880 C CA . ARG B 173 ? 0.4445 0.5013 0.8512 -0.0874 -0.0042 0.0169 232 ARG B CA 4881 C C . ARG B 173 ? 0.5524 0.6060 0.9565 -0.0882 -0.0052 0.0171 232 ARG B C 4882 O O . ARG B 173 ? 0.3494 0.4005 0.7498 -0.0876 -0.0108 0.0149 232 ARG B O 4883 C CB . ARG B 173 ? 0.5453 0.6011 0.9404 -0.0853 -0.0076 0.0151 232 ARG B CB 4884 C CG . ARG B 173 ? 0.5369 0.5957 0.9335 -0.0844 -0.0068 0.0148 232 ARG B CG 4885 C CD . ARG B 173 ? 0.4211 0.4788 0.8100 -0.0824 -0.0121 0.0120 232 ARG B CD 4886 N NE . ARG B 173 ? 0.5035 0.5588 0.8774 -0.0813 -0.0113 0.0126 232 ARG B NE 4887 C CZ . ARG B 173 ? 0.5495 0.6058 0.9158 -0.0806 -0.0071 0.0143 232 ARG B CZ 4888 N NH1 . ARG B 173 ? 0.5196 0.5791 0.8916 -0.0810 -0.0032 0.0158 232 ARG B NH1 4889 N NH2 . ARG B 173 ? 0.6977 0.7517 1.0508 -0.0796 -0.0068 0.0146 232 ARG B NH2 4890 N N . ALA B 174 ? 0.3487 0.4022 0.7546 -0.0895 0.0003 0.0199 233 ALA B N 4891 C CA . ALA B 174 ? 0.4616 0.5122 0.8657 -0.0905 0.0000 0.0202 233 ALA B CA 4892 C C . ALA B 174 ? 0.4305 0.4817 0.8493 -0.0922 -0.0010 0.0199 233 ALA B C 4893 O O . ALA B 174 ? 0.5705 0.6247 1.0009 -0.0928 -0.0001 0.0199 233 ALA B O 4894 C CB . ALA B 174 ? 0.3502 0.3998 0.7466 -0.0907 0.0064 0.0233 233 ALA B CB 4895 N N . ILE B 175 ? 0.4601 0.5085 0.8782 -0.0930 -0.0027 0.0196 234 ILE B N 4896 C CA . ILE B 175 ? 0.3552 0.4039 0.7867 -0.0946 -0.0041 0.0191 234 ILE B CA 4897 C C . ILE B 175 ? 0.4153 0.4640 0.8506 -0.0962 0.0026 0.0221 234 ILE B C 4898 O O . ILE B 175 ? 0.4440 0.4904 0.8695 -0.0960 0.0056 0.0237 234 ILE B O 4899 C CB . ILE B 175 ? 0.3570 0.4025 0.7862 -0.0945 -0.0107 0.0168 234 ILE B CB 4900 C CG1 . ILE B 175 ? 0.4036 0.4487 0.8277 -0.0925 -0.0171 0.0138 234 ILE B CG1 4901 C CG2 . ILE B 175 ? 0.3587 0.4045 0.8024 -0.0961 -0.0125 0.0160 234 ILE B CG2 4902 C CD1 . ILE B 175 ? 0.4953 0.5373 0.9172 -0.0920 -0.0239 0.0115 234 ILE B CD1 4903 N N . PRO B 176 ? 0.5594 0.6106 1.0090 -0.0975 0.0051 0.0229 235 PRO B N 4904 C CA . PRO B 176 ? 0.4072 0.4586 0.8624 -0.0989 0.0118 0.0258 235 PRO B CA 4905 C C . PRO B 176 ? 0.6267 0.6746 1.0770 -0.0996 0.0123 0.0265 235 PRO B C 4906 O O . PRO B 176 ? 0.5773 0.6236 1.0312 -0.1003 0.0075 0.0246 235 PRO B O 4907 C CB . PRO B 176 ? 0.3573 0.4113 0.8300 -0.1003 0.0112 0.0253 235 PRO B CB 4908 C CG . PRO B 176 ? 0.4033 0.4597 0.8780 -0.0992 0.0070 0.0231 235 PRO B CG 4909 C CD . PRO B 176 ? 0.3556 0.4096 0.8170 -0.0976 0.0017 0.0210 235 PRO B CD 4910 N N . THR B 177 ? 0.3587 0.4054 0.8007 -0.0993 0.0183 0.0291 236 THR B N 4911 C CA . THR B 177 ? 0.3604 0.4037 0.7961 -0.0998 0.0195 0.0299 236 THR B CA 4912 C C . THR B 177 ? 0.4749 0.5184 0.9125 -0.1004 0.0277 0.0331 236 THR B C 4913 O O . THR B 177 ? 0.5020 0.5470 0.9366 -0.0994 0.0327 0.0349 236 THR B O 4914 C CB . THR B 177 ? 0.4385 0.4792 0.8570 -0.0983 0.0175 0.0292 236 THR B CB 4915 O OG1 . THR B 177 ? 0.4301 0.4708 0.8465 -0.0975 0.0101 0.0263 236 THR B OG1 4916 C CG2 . THR B 177 ? 0.3619 0.3991 0.7741 -0.0989 0.0180 0.0297 236 THR B CG2 4917 N N . VAL B 178 ? 0.3629 0.4047 0.8057 -0.1017 0.0292 0.0337 237 VAL B N 4918 C CA . VAL B 178 ? 0.3638 0.4052 0.8090 -0.1022 0.0370 0.0367 237 VAL B CA 4919 C C . VAL B 178 ? 0.3658 0.4035 0.8035 -0.1025 0.0382 0.0373 237 VAL B C 4920 O O . VAL B 178 ? 0.3970 0.4326 0.8326 -0.1031 0.0328 0.0353 237 VAL B O 4921 C CB . VAL B 178 ? 0.4639 0.5076 0.9268 -0.1037 0.0392 0.0375 237 VAL B CB 4922 C CG1 . VAL B 178 ? 0.3667 0.4088 0.8376 -0.1055 0.0357 0.0362 237 VAL B CG1 4923 C CG2 . VAL B 178 ? 0.3646 0.4089 0.8299 -0.1035 0.0479 0.0408 237 VAL B CG2 4924 N N . GLY B 179 ? 0.3949 0.4315 0.8279 -0.1020 0.0453 0.0398 238 GLY B N 4925 C CA . GLY B 179 ? 0.3684 0.4015 0.7952 -0.1023 0.0474 0.0405 238 GLY B CA 4926 C C . GLY B 179 ? 0.4730 0.5057 0.9131 -0.1042 0.0487 0.0410 238 GLY B C 4927 O O . GLY B 179 ? 0.3704 0.4056 0.8237 -0.1050 0.0511 0.0419 238 GLY B O 4928 N N . ARG B 180 ? 0.4123 0.4419 0.8488 -0.1050 0.0472 0.0405 239 ARG B N 4929 C CA . ARG B 180 ? 0.4054 0.4341 0.8536 -0.1068 0.0484 0.0409 239 ARG B CA 4930 C C . ARG B 180 ? 0.5066 0.5313 0.9461 -0.1070 0.0494 0.0412 239 ARG B C 4931 O O . ARG B 180 ? 0.4126 0.4352 0.8417 -0.1067 0.0445 0.0396 239 ARG B O 4932 C CB . ARG B 180 ? 0.3751 0.4052 0.8352 -0.1083 0.0414 0.0385 239 ARG B CB 4933 C CG . ARG B 180 ? 0.3773 0.4070 0.8513 -0.1103 0.0425 0.0388 239 ARG B CG 4934 C CD . ARG B 180 ? 0.3774 0.4085 0.8631 -0.1115 0.0352 0.0362 239 ARG B CD 4935 N NE . ARG B 180 ? 0.4995 0.5299 0.9981 -0.1135 0.0359 0.0363 239 ARG B NE 4936 C CZ . ARG B 180 ? 0.3799 0.4125 0.8939 -0.1148 0.0327 0.0350 239 ARG B CZ 4937 N NH1 . ARG B 180 ? 0.4390 0.4745 0.9574 -0.1143 0.0287 0.0333 239 ARG B NH1 4938 N NH2 . ARG B 180 ? 0.3821 0.4139 0.9073 -0.1166 0.0337 0.0352 239 ARG B NH2 4939 N N . VAL B 181 ? 0.3789 0.4025 0.8225 -0.1075 0.0560 0.0433 240 VAL B N 4940 C CA . VAL B 181 ? 0.3814 0.4011 0.8180 -0.1079 0.0576 0.0438 240 VAL B CA 4941 C C . VAL B 181 ? 0.3835 0.4024 0.8317 -0.1100 0.0543 0.0427 240 VAL B C 4942 O O . VAL B 181 ? 0.5266 0.5469 0.9891 -0.1112 0.0571 0.0436 240 VAL B O 4943 C CB . VAL B 181 ? 0.3824 0.4009 0.8160 -0.1069 0.0668 0.0466 240 VAL B CB 4944 C CG1 . VAL B 181 ? 0.3850 0.3994 0.8104 -0.1072 0.0683 0.0468 240 VAL B CG1 4945 C CG2 . VAL B 181 ? 0.3803 0.3998 0.8031 -0.1047 0.0701 0.0476 240 VAL B CG2 4946 N N . LEU B 182 ? 0.4688 0.4853 0.9107 -0.1104 0.0482 0.0408 241 LEU B N 4947 C CA . LEU B 182 ? 0.3864 0.4021 0.8387 -0.1124 0.0439 0.0395 241 LEU B CA 4948 C C . LEU B 182 ? 0.3893 0.4013 0.8381 -0.1131 0.0470 0.0405 241 LEU B C 4949 O O . LEU B 182 ? 0.6686 0.6780 1.1029 -0.1120 0.0491 0.0412 241 LEU B O 4950 C CB . LEU B 182 ? 0.3858 0.4012 0.8350 -0.1123 0.0344 0.0367 241 LEU B CB 4951 C CG . LEU B 182 ? 0.3836 0.4022 0.8393 -0.1120 0.0290 0.0348 241 LEU B CG 4952 C CD1 . LEU B 182 ? 0.5340 0.5553 1.0090 -0.1137 0.0291 0.0346 241 LEU B CD1 4953 C CD2 . LEU B 182 ? 0.5071 0.5278 0.9552 -0.1103 0.0315 0.0355 241 LEU B CD2 4954 N N . ASN B 183 ? 0.3964 0.4082 0.8587 -0.1150 0.0473 0.0405 242 ASN B N 4955 C CA . ASN B 183 ? 0.3942 0.4025 0.8546 -0.1159 0.0485 0.0409 242 ASN B CA 4956 C C . ASN B 183 ? 0.3949 0.4012 0.8503 -0.1163 0.0398 0.0385 242 ASN B C 4957 O O . ASN B 183 ? 0.4653 0.4728 0.9317 -0.1175 0.0339 0.0367 242 ASN B O 4958 C CB . ASN B 183 ? 0.3961 0.4049 0.8733 -0.1178 0.0523 0.0419 242 ASN B CB 4959 C CG . ASN B 183 ? 0.5365 0.5415 1.0118 -0.1187 0.0542 0.0425 242 ASN B CG 4960 O OD1 . ASN B 183 ? 0.6379 0.6410 1.1118 -0.1196 0.0481 0.0408 242 ASN B OD1 4961 N ND2 . ASN B 183 ? 0.4822 0.4860 0.9575 -0.1185 0.0627 0.0449 242 ASN B ND2 4962 N N . MSE B 184 ? 0.3953 0.3987 0.8343 -0.1152 0.0389 0.0384 243 MSE B N 4963 C CA . MSE B 184 ? 0.7059 0.7072 1.1380 -0.1152 0.0306 0.0363 243 MSE B CA 4964 C C . MSE B 184 ? 0.6491 0.6488 1.0908 -0.1171 0.0274 0.0355 243 MSE B C 4965 O O . MSE B 184 ? 0.4670 0.4661 0.9098 -0.1173 0.0194 0.0334 243 MSE B O 4966 C CB . MSE B 184 ? 0.3961 0.3944 0.8087 -0.1137 0.0314 0.0367 243 MSE B CB 4967 C CG . MSE B 184 ? 0.5624 0.5621 0.9643 -0.1117 0.0337 0.0373 243 MSE B CG 4968 SE SE . MSE B 184 ? 0.7775 0.7733 1.1550 -0.1099 0.0343 0.0376 243 MSE B SE 4969 C CE . MSE B 184 ? 0.5126 0.5065 0.8861 -0.1101 0.0225 0.0349 243 MSE B CE 4970 N N . THR B 185 ? 0.4005 0.3992 0.8491 -0.1183 0.0335 0.0371 244 THR B N 4971 C CA . THR B 185 ? 0.4133 0.4104 0.8714 -0.1201 0.0311 0.0364 244 THR B CA 4972 C C . THR B 185 ? 0.4547 0.4548 0.9315 -0.1215 0.0273 0.0351 244 THR B C 4973 O O . THR B 185 ? 0.4916 0.4911 0.9729 -0.1222 0.0199 0.0330 244 THR B O 4974 C CB . THR B 185 ? 0.4056 0.4007 0.8656 -0.1210 0.0393 0.0387 244 THR B CB 4975 O OG1 . THR B 185 ? 0.4062 0.3984 0.8485 -0.1195 0.0429 0.0398 244 THR B OG1 4976 C CG2 . THR B 185 ? 0.4085 0.4015 0.8774 -0.1229 0.0366 0.0379 244 THR B CG2 4977 N N . THR B 186 ? 0.4014 0.4047 0.8889 -0.1218 0.0324 0.0362 245 THR B N 4978 C CA . THR B 186 ? 0.5031 0.5093 1.0093 -0.1233 0.0299 0.0351 245 THR B CA 4979 C C . THR B 186 ? 0.3984 0.4077 0.9068 -0.1224 0.0236 0.0331 245 THR B C 4980 O O . THR B 186 ? 0.5170 0.5276 1.0365 -0.1233 0.0175 0.0310 245 THR B O 4981 C CB . THR B 186 ? 0.4012 0.4096 0.9194 -0.1240 0.0383 0.0374 245 THR B CB 4982 O OG1 . THR B 186 ? 0.3994 0.4095 0.9105 -0.1223 0.0432 0.0389 245 THR B OG1 4983 C CG2 . THR B 186 ? 0.4042 0.4095 0.9228 -0.1250 0.0445 0.0392 245 THR B CG2 4984 N N . GLU B 187 ? 0.4696 0.4800 0.9673 -0.1206 0.0251 0.0336 246 GLU B N 4985 C CA . GLU B 187 ? 0.3934 0.4070 0.8933 -0.1197 0.0202 0.0319 246 GLU B CA 4986 C C . GLU B 187 ? 0.3928 0.4047 0.8803 -0.1183 0.0123 0.0298 246 GLU B C 4987 O O . GLU B 187 ? 0.6359 0.6498 1.1268 -0.1177 0.0065 0.0277 246 GLU B O 4988 C CB . GLU B 187 ? 0.3911 0.4072 0.8880 -0.1185 0.0263 0.0337 246 GLU B CB 4989 C CG . GLU B 187 ? 0.3914 0.4096 0.9017 -0.1195 0.0336 0.0358 246 GLU B CG 4990 C CD . GLU B 187 ? 0.4880 0.5085 0.9946 -0.1181 0.0391 0.0375 246 GLU B CD 4991 O OE1 . GLU B 187 ? 0.4097 0.4338 0.9264 -0.1182 0.0385 0.0371 246 GLU B OE1 4992 O OE2 . GLU B 187 ? 0.3891 0.4080 0.8829 -0.1168 0.0440 0.0393 246 GLU B OE2 4993 N N . LEU B 188 ? 0.4111 0.4195 0.8843 -0.1177 0.0123 0.0302 247 LEU B N 4994 C CA . LEU B 188 ? 0.3935 0.4001 0.8542 -0.1162 0.0051 0.0284 247 LEU B CA 4995 C C . LEU B 188 ? 0.4187 0.4222 0.8796 -0.1170 -0.0007 0.0271 247 LEU B C 4996 O O . LEU B 188 ? 0.4326 0.4363 0.8988 -0.1169 -0.0083 0.0248 247 LEU B O 4997 C CB . LEU B 188 ? 0.3926 0.3976 0.8349 -0.1146 0.0085 0.0298 247 LEU B CB 4998 C CG . LEU B 188 ? 0.3898 0.3978 0.8292 -0.1133 0.0123 0.0306 247 LEU B CG 4999 C CD1 . LEU B 188 ? 0.3890 0.3952 0.8095 -0.1116 0.0139 0.0314 247 LEU B CD1 5000 C CD2 . LEU B 188 ? 0.3879 0.3988 0.8343 -0.1128 0.0064 0.0286 247 LEU B CD2 5001 N N . PHE B 189 ? 0.4382 0.4386 0.8931 -0.1176 0.0029 0.0286 248 PHE B N 5002 C CA . PHE B 189 ? 0.4423 0.4394 0.8956 -0.1183 -0.0021 0.0276 248 PHE B CA 5003 C C . PHE B 189 ? 0.4753 0.4732 0.9462 -0.1199 -0.0063 0.0260 248 PHE B C 5004 O O . PHE B 189 ? 0.4367 0.4337 0.9086 -0.1195 -0.0144 0.0238 248 PHE B O 5005 C CB . PHE B 189 ? 0.4150 0.4089 0.8609 -0.1189 0.0039 0.0296 248 PHE B CB 5006 C CG . PHE B 189 ? 0.4055 0.3958 0.8490 -0.1196 -0.0008 0.0288 248 PHE B CG 5007 C CD1 . PHE B 189 ? 0.4106 0.3985 0.8406 -0.1182 -0.0072 0.0277 248 PHE B CD1 5008 C CD2 . PHE B 189 ? 0.4080 0.3974 0.8627 -0.1216 0.0012 0.0293 248 PHE B CD2 5009 C CE1 . PHE B 189 ? 0.4081 0.3926 0.8356 -0.1187 -0.0116 0.0271 248 PHE B CE1 5010 C CE2 . PHE B 189 ? 0.4105 0.3965 0.8629 -0.1222 -0.0032 0.0285 248 PHE B CE2 5011 C CZ . PHE B 189 ? 0.4105 0.3941 0.8492 -0.1207 -0.0097 0.0275 248 PHE B CZ 5012 N N . GLU B 190 ? 0.4518 0.4516 0.9367 -0.1216 -0.0007 0.0271 249 GLU B N 5013 C CA . GLU B 190 ? 0.4478 0.4484 0.9502 -0.1233 -0.0038 0.0258 249 GLU B CA 5014 C C . GLU B 190 ? 0.5167 0.5205 1.0292 -0.1229 -0.0099 0.0234 249 GLU B C 5015 O O . GLU B 190 ? 0.4584 0.4626 0.9833 -0.1238 -0.0150 0.0215 249 GLU B O 5016 C CB . GLU B 190 ? 0.4786 0.4802 0.9929 -0.1251 0.0044 0.0278 249 GLU B CB 5017 C CG . GLU B 190 ? 0.4506 0.4486 0.9589 -0.1259 0.0092 0.0297 249 GLU B CG 5018 C CD . GLU B 190 ? 0.5465 0.5455 1.0634 -0.1271 0.0187 0.0321 249 GLU B CD 5019 O OE1 . GLU B 190 ? 0.6331 0.6356 1.1612 -0.1274 0.0214 0.0324 249 GLU B OE1 5020 O OE2 . GLU B 190 ? 0.5500 0.5460 1.0622 -0.1276 0.0236 0.0337 249 GLU B OE2 5021 N N . LYS B 191 ? 0.3993 0.4054 0.9066 -0.1214 -0.0093 0.0234 250 LYS B N 5022 C CA . LYS B 191 ? 0.3974 0.4066 0.9130 -0.1207 -0.0147 0.0211 250 LYS B CA 5023 C C . LYS B 191 ? 0.3966 0.4044 0.9007 -0.1186 -0.0228 0.0190 250 LYS B C 5024 O O . LYS B 191 ? 0.4362 0.4461 0.9449 -0.1176 -0.0277 0.0169 250 LYS B O 5025 C CB . LYS B 191 ? 0.3950 0.4079 0.9137 -0.1204 -0.0091 0.0224 250 LYS B CB 5026 C CG . LYS B 191 ? 0.3956 0.4103 0.9270 -0.1222 -0.0013 0.0244 250 LYS B CG 5027 C CD . LYS B 191 ? 0.5341 0.5499 1.0842 -0.1240 -0.0044 0.0229 250 LYS B CD 5028 C CE . LYS B 191 ? 0.4336 0.4509 0.9965 -0.1258 0.0035 0.0251 250 LYS B CE 5029 N NZ . LYS B 191 ? 0.4920 0.5107 1.0737 -0.1276 0.0005 0.0235 250 LYS B NZ 5030 N N . ALA B 192 ? 0.3977 0.4018 0.8868 -0.1178 -0.0240 0.0195 251 ALA B N 5031 C CA . ALA B 192 ? 0.5818 0.5843 1.0580 -0.1156 -0.0308 0.0180 251 ALA B CA 5032 C C . ALA B 192 ? 0.3986 0.3992 0.8792 -0.1153 -0.0398 0.0154 251 ALA B C 5033 O O . ALA B 192 ? 0.4009 0.4000 0.8890 -0.1168 -0.0406 0.0153 251 ALA B O 5034 C CB . ALA B 192 ? 0.3973 0.3968 0.8549 -0.1147 -0.0280 0.0197 251 ALA B CB 5035 N N . GLU B 193 ? 0.5383 0.5390 1.0143 -0.1132 -0.0467 0.0133 252 GLU B N 5036 C CA . GLU B 193 ? 0.3989 0.3974 0.8761 -0.1123 -0.0558 0.0109 252 GLU B CA 5037 C C . GLU B 193 ? 0.5622 0.5562 1.0268 -0.1121 -0.0571 0.0118 252 GLU B C 5038 O O . GLU B 193 ? 0.5418 0.5346 0.9940 -0.1121 -0.0519 0.0140 252 GLU B O 5039 C CB . GLU B 193 ? 0.3973 0.3964 0.8700 -0.1096 -0.0621 0.0087 252 GLU B CB 5040 C CG . GLU B 193 ? 0.4822 0.4799 0.9361 -0.1077 -0.0612 0.0097 252 GLU B CG 5041 C CD . GLU B 193 ? 0.5898 0.5878 1.0394 -0.1050 -0.0680 0.0074 252 GLU B CD 5042 O OE1 . GLU B 193 ? 0.5774 0.5743 1.0329 -0.1041 -0.0755 0.0050 252 GLU B OE1 5043 O OE2 . GLU B 193 ? 0.4849 0.4838 0.9250 -0.1038 -0.0657 0.0080 252 GLU B OE2 5044 N N . LYS B 194 ? 0.6564 0.6481 1.1244 -0.1118 -0.0642 0.0101 253 LYS B N 5045 C CA . LYS B 194 ? 0.5450 0.5324 1.0032 -0.1119 -0.0659 0.0110 253 LYS B CA 5046 C C . LYS B 194 ? 0.6133 0.5983 1.0511 -0.1099 -0.0663 0.0120 253 LYS B C 5047 O O . LYS B 194 ? 0.6012 0.5840 1.0288 -0.1106 -0.0622 0.0140 253 LYS B O 5048 C CB . LYS B 194 ? 0.7161 0.7015 1.1812 -0.1114 -0.0747 0.0086 253 LYS B CB 5049 C CG . LYS B 194 ? 0.9554 0.9363 1.4106 -0.1113 -0.0773 0.0093 253 LYS B CG 5050 C CD . LYS B 194 ? 1.0507 1.0294 1.5094 -0.1098 -0.0873 0.0068 253 LYS B CD 5051 C CE . LYS B 194 ? 1.0967 1.0749 1.5465 -0.1066 -0.0937 0.0052 253 LYS B CE 5052 N NZ . LYS B 194 ? 1.0337 1.0096 1.4634 -0.1052 -0.0923 0.0069 253 LYS B NZ 5053 N N . LYS B 195 ? 0.6281 0.6134 1.0597 -0.1075 -0.0711 0.0105 254 LYS B N 5054 C CA . LYS B 195 ? 0.5802 0.5632 0.9927 -0.1055 -0.0720 0.0113 254 LYS B CA 5055 C C . LYS B 195 ? 0.5991 0.5835 1.0032 -0.1061 -0.0633 0.0137 254 LYS B C 5056 O O . LYS B 195 ? 0.5955 0.5776 0.9841 -0.1053 -0.0618 0.0151 254 LYS B O 5057 C CB . LYS B 195 ? 0.5620 0.5450 0.9707 -0.1027 -0.0791 0.0092 254 LYS B CB 5058 C CG . LYS B 195 ? 0.7990 0.7861 1.2145 -0.1023 -0.0772 0.0083 254 LYS B CG 5059 C CD . LYS B 195 ? 0.7501 0.7366 1.1579 -0.0992 -0.0834 0.0066 254 LYS B CD 5060 C CE . LYS B 195 ? 0.8688 0.8592 1.2843 -0.0987 -0.0823 0.0054 254 LYS B CE 5061 N NZ . LYS B 195 ? 0.9841 0.9738 1.3912 -0.0956 -0.0878 0.0038 254 LYS B NZ 5062 N N . LEU B 196 ? 0.5229 0.5111 0.9371 -0.1073 -0.0578 0.0142 255 LEU B N 5063 C CA . LEU B 196 ? 0.4518 0.4414 0.8596 -0.1078 -0.0492 0.0164 255 LEU B CA 5064 C C . LEU B 196 ? 0.3996 0.3880 0.8081 -0.1099 -0.0427 0.0186 255 LEU B C 5065 O O . LEU B 196 ? 0.4200 0.4074 0.8169 -0.1098 -0.0372 0.0205 255 LEU B O 5066 C CB . LEU B 196 ? 0.5073 0.5013 0.9255 -0.1081 -0.0459 0.0162 255 LEU B CB 5067 C CG . LEU B 196 ? 0.3941 0.3899 0.8083 -0.1087 -0.0367 0.0186 255 LEU B CG 5068 C CD1 . LEU B 196 ? 0.3930 0.3872 0.7885 -0.1070 -0.0357 0.0195 255 LEU B CD1 5069 C CD2 . LEU B 196 ? 0.4066 0.4066 0.8321 -0.1090 -0.0341 0.0183 255 LEU B CD2 5070 N N . LYS B 197 ? 0.4014 0.3898 0.8237 -0.1116 -0.0434 0.0181 256 LYS B N 5071 C CA . LYS B 197 ? 0.4033 0.3905 0.8284 -0.1137 -0.0372 0.0200 256 LYS B CA 5072 C C . LYS B 197 ? 0.4705 0.4536 0.8797 -0.1133 -0.0371 0.0212 256 LYS B C 5073 O O . LYS B 197 ? 0.5134 0.4956 0.9173 -0.1141 -0.0301 0.0232 256 LYS B O 5074 C CB . LYS B 197 ? 0.4071 0.3946 0.8494 -0.1155 -0.0396 0.0190 256 LYS B CB 5075 C CG . LYS B 197 ? 0.5422 0.5299 0.9927 -0.1179 -0.0320 0.0209 256 LYS B CG 5076 C CD . LYS B 197 ? 0.6267 0.6152 1.0959 -0.1196 -0.0347 0.0196 256 LYS B CD 5077 C CE . LYS B 197 ? 0.5951 0.5875 1.0797 -0.1211 -0.0287 0.0202 256 LYS B CE 5078 N NZ . LYS B 197 ? 0.8258 0.8217 1.3149 -0.1200 -0.0310 0.0188 256 LYS B NZ 5079 N N . LYS B 198 ? 0.4729 0.4534 0.8747 -0.1118 -0.0450 0.0198 257 LYS B N 5080 C CA . LYS B 198 ? 0.4692 0.4457 0.8564 -0.1113 -0.0462 0.0206 257 LYS B CA 5081 C C . LYS B 198 ? 0.4214 0.3971 0.7907 -0.1098 -0.0427 0.0220 257 LYS B C 5082 O O . LYS B 198 ? 0.4395 0.4121 0.7960 -0.1096 -0.0420 0.0230 257 LYS B O 5083 C CB . LYS B 198 ? 0.4088 0.3828 0.7942 -0.1100 -0.0561 0.0187 257 LYS B CB 5084 C CG . LYS B 198 ? 0.7169 0.6909 1.1187 -0.1114 -0.0598 0.0174 257 LYS B CG 5085 C CD . LYS B 198 ? 0.9344 0.9071 1.3400 -0.1138 -0.0541 0.0191 257 LYS B CD 5086 C CE . LYS B 198 ? 0.9751 0.9491 1.4004 -0.1157 -0.0553 0.0180 257 LYS B CE 5087 N NZ . LYS B 198 ? 0.9994 0.9724 1.4291 -0.1180 -0.0489 0.0197 257 LYS B NZ 5088 N N . THR B 199 ? 0.4980 0.4766 0.8663 -0.1089 -0.0406 0.0219 258 THR B N 5089 C CA . THR B 199 ? 0.4250 0.4032 0.7771 -0.1075 -0.0374 0.0230 258 THR B CA 5090 C C . THR B 199 ? 0.4188 0.3980 0.7696 -0.1086 -0.0275 0.0252 258 THR B C 5091 O O . THR B 199 ? 0.4859 0.4653 0.8251 -0.1075 -0.0236 0.0262 258 THR B O 5092 C CB . THR B 199 ? 0.3993 0.3798 0.7495 -0.1057 -0.0401 0.0219 258 THR B CB 5093 O OG1 . THR B 199 ? 0.5952 0.5797 0.9579 -0.1066 -0.0356 0.0220 258 THR B OG1 5094 C CG2 . THR B 199 ? 0.3996 0.3792 0.7524 -0.1043 -0.0497 0.0196 258 THR B CG2 5095 N N . PHE B 200 ? 0.4519 0.4316 0.8147 -0.1106 -0.0235 0.0259 259 PHE B N 5096 C CA . PHE B 200 ? 0.4035 0.3837 0.7660 -0.1115 -0.0141 0.0280 259 PHE B CA 5097 C C . PHE B 200 ? 0.5053 0.4817 0.8568 -0.1118 -0.0116 0.0292 259 PHE B C 5098 O O . PHE B 200 ? 0.4938 0.4675 0.8443 -0.1122 -0.0166 0.0285 259 PHE B O 5099 C CB . PHE B 200 ? 0.4039 0.3865 0.7851 -0.1134 -0.0104 0.0283 259 PHE B CB 5100 C CG . PHE B 200 ? 0.4012 0.3880 0.7914 -0.1132 -0.0090 0.0279 259 PHE B CG 5101 C CD1 . PHE B 200 ? 0.4021 0.3906 0.7989 -0.1126 -0.0160 0.0258 259 PHE B CD1 5102 C CD2 . PHE B 200 ? 0.4001 0.3890 0.7920 -0.1134 -0.0007 0.0297 259 PHE B CD2 5103 C CE1 . PHE B 200 ? 0.3976 0.3899 0.8024 -0.1123 -0.0147 0.0255 259 PHE B CE1 5104 C CE2 . PHE B 200 ? 0.4759 0.4685 0.8757 -0.1131 0.0005 0.0294 259 PHE B CE2 5105 C CZ . PHE B 200 ? 0.3964 0.3909 0.8027 -0.1126 -0.0065 0.0273 259 PHE B CZ 5106 N N . PHE B 201 ? 0.4796 0.4557 0.8228 -0.1115 -0.0039 0.0309 260 PHE B N 5107 C CA . PHE B 201 ? 0.4080 0.3806 0.7400 -0.1116 -0.0007 0.0321 260 PHE B CA 5108 C C . PHE B 201 ? 0.4390 0.4122 0.7669 -0.1114 0.0091 0.0340 260 PHE B C 5109 O O . PHE B 201 ? 0.4096 0.3858 0.7419 -0.1110 0.0129 0.0344 260 PHE B O 5110 C CB . PHE B 201 ? 0.4080 0.3780 0.7229 -0.1100 -0.0060 0.0315 260 PHE B CB 5111 C CG . PHE B 201 ? 0.4541 0.4253 0.7573 -0.1081 -0.0046 0.0317 260 PHE B CG 5112 C CD1 . PHE B 201 ? 0.4030 0.3767 0.7089 -0.1072 -0.0091 0.0304 260 PHE B CD1 5113 C CD2 . PHE B 201 ? 0.4237 0.3936 0.7132 -0.1073 0.0012 0.0329 260 PHE B CD2 5114 C CE1 . PHE B 201 ? 0.4154 0.3902 0.7108 -0.1055 -0.0077 0.0306 260 PHE B CE1 5115 C CE2 . PHE B 201 ? 0.4564 0.4275 0.7355 -0.1056 0.0025 0.0330 260 PHE B CE2 5116 C CZ . PHE B 201 ? 0.4461 0.4196 0.7283 -0.1048 -0.0020 0.0319 260 PHE B CZ 5117 N N . PHE B 202 ? 0.4487 0.4188 0.7677 -0.1116 0.0131 0.0351 261 PHE B N 5118 C CA . PHE B 202 ? 0.4100 0.3800 0.7231 -0.1110 0.0222 0.0367 261 PHE B CA 5119 C C . PHE B 202 ? 0.4096 0.3776 0.7028 -0.1091 0.0227 0.0369 261 PHE B C 5120 O O . PHE B 202 ? 0.4830 0.4480 0.7659 -0.1089 0.0187 0.0365 261 PHE B O 5121 C CB . PHE B 202 ? 0.4130 0.3810 0.7315 -0.1123 0.0278 0.0379 261 PHE B CB 5122 C CG . PHE B 202 ? 0.4133 0.3836 0.7514 -0.1140 0.0300 0.0382 261 PHE B CG 5123 C CD1 . PHE B 202 ? 0.4248 0.3972 0.7693 -0.1139 0.0378 0.0395 261 PHE B CD1 5124 C CD2 . PHE B 202 ? 0.4144 0.3847 0.7647 -0.1157 0.0242 0.0371 261 PHE B CD2 5125 C CE1 . PHE B 202 ? 0.4127 0.3873 0.7753 -0.1154 0.0399 0.0399 261 PHE B CE1 5126 C CE2 . PHE B 202 ? 0.4146 0.3871 0.7832 -0.1172 0.0263 0.0373 261 PHE B CE2 5127 C CZ . PHE B 202 ? 0.4137 0.3885 0.7885 -0.1171 0.0342 0.0387 261 PHE B CZ 5128 N N . SER B 203 ? 0.4076 0.3774 0.6954 -0.1078 0.0277 0.0376 262 SER B N 5129 C CA . SER B 203 ? 0.4070 0.3753 0.6766 -0.1059 0.0290 0.0377 262 SER B CA 5130 C C . SER B 203 ? 0.4097 0.3747 0.6709 -0.1058 0.0350 0.0388 262 SER B C 5131 O O . SER B 203 ? 0.4865 0.4509 0.7568 -0.1070 0.0392 0.0397 262 SER B O 5132 C CB . SER B 203 ? 0.4041 0.3753 0.6718 -0.1045 0.0329 0.0381 262 SER B CB 5133 O OG . SER B 203 ? 0.4360 0.4076 0.7061 -0.1043 0.0419 0.0396 262 SER B OG 5134 N N . PRO B 204 ? 0.5129 0.4757 0.7566 -0.1043 0.0352 0.0388 263 PRO B N 5135 C CA . PRO B 204 ? 0.4620 0.4219 0.6966 -0.1040 0.0413 0.0397 263 PRO B CA 5136 C C . PRO B 204 ? 0.4790 0.4399 0.7183 -0.1035 0.0508 0.0410 263 PRO B C 5137 O O . PRO B 204 ? 0.5915 0.5500 0.8284 -0.1035 0.0564 0.0419 263 PRO B O 5138 C CB . PRO B 204 ? 0.4116 0.3700 0.6270 -0.1021 0.0397 0.0392 263 PRO B CB 5139 C CG . PRO B 204 ? 0.5033 0.4626 0.7182 -0.1021 0.0307 0.0380 263 PRO B CG 5140 C CD . PRO B 204 ? 0.4691 0.4319 0.7007 -0.1030 0.0293 0.0378 263 PRO B CD 5141 N N . ALA B 205 ? 0.4098 0.3742 0.6557 -0.1030 0.0526 0.0412 264 ALA B N 5142 C CA . ALA B 205 ? 0.4097 0.3753 0.6609 -0.1023 0.0613 0.0426 264 ALA B CA 5143 C C . ALA B 205 ? 0.4106 0.3776 0.6806 -0.1041 0.0632 0.0433 264 ALA B C 5144 O O . ALA B 205 ? 0.5134 0.4819 0.7908 -0.1037 0.0697 0.0444 264 ALA B O 5145 C CB . ALA B 205 ? 0.4065 0.3751 0.6551 -0.1008 0.0624 0.0425 264 ALA B CB 5146 N N . LYS B 206 ? 0.4117 0.3781 0.6895 -0.1060 0.0571 0.0425 265 LYS B N 5147 C CA . LYS B 206 ? 0.5072 0.4745 0.8029 -0.1080 0.0579 0.0429 265 LYS B CA 5148 C C . LYS B 206 ? 0.6358 0.6074 0.9450 -0.1083 0.0572 0.0429 265 LYS B C 5149 O O . LYS B 206 ? 0.5459 0.5190 0.8702 -0.1095 0.0601 0.0436 265 LYS B O 5150 C CB . LYS B 206 ? 0.4156 0.3809 0.7134 -0.1080 0.0665 0.0444 265 LYS B CB 5151 C CG . LYS B 206 ? 0.4450 0.4060 0.7324 -0.1083 0.0660 0.0443 265 LYS B CG 5152 C CD . LYS B 206 ? 0.6269 0.5869 0.9237 -0.1105 0.0601 0.0436 265 LYS B CD 5153 C CE . LYS B 206 ? 0.8537 0.8095 1.1443 -0.1110 0.0626 0.0440 265 LYS B CE 5154 N NZ . LYS B 206 ? 0.8290 0.7836 1.1226 -0.1106 0.0724 0.0456 265 LYS B NZ 5155 N N . ASN B 207 ? 0.4910 0.4646 0.7945 -0.1072 0.0534 0.0420 266 ASN B N 5156 C CA . ASN B 207 ? 0.4048 0.3823 0.7196 -0.1074 0.0515 0.0417 266 ASN B CA 5157 C C . ASN B 207 ? 0.4240 0.4024 0.7480 -0.1088 0.0428 0.0401 266 ASN B C 5158 O O . ASN B 207 ? 0.4511 0.4274 0.7679 -0.1089 0.0366 0.0389 266 ASN B O 5159 C CB . ASN B 207 ? 0.4019 0.3811 0.7064 -0.1054 0.0516 0.0415 266 ASN B CB 5160 C CG . ASN B 207 ? 0.4238 0.4026 0.7211 -0.1038 0.0603 0.0430 266 ASN B CG 5161 O OD1 . ASN B 207 ? 0.4747 0.4539 0.7805 -0.1040 0.0669 0.0444 266 ASN B OD1 5162 N ND2 . ASN B 207 ? 0.4009 0.3788 0.6825 -0.1020 0.0605 0.0427 266 ASN B ND2 5163 N N . PHE B 208 ? 0.4354 0.4169 0.7752 -0.1098 0.0422 0.0399 267 PHE B N 5164 C CA . PHE B 208 ? 0.4030 0.3856 0.7526 -0.1110 0.0341 0.0382 267 PHE B CA 5165 C C . PHE B 208 ? 0.4106 0.3950 0.7542 -0.1097 0.0283 0.0369 267 PHE B C 5166 O O . PHE B 208 ? 0.4219 0.4087 0.7640 -0.1086 0.0313 0.0373 267 PHE B O 5167 C CB . PHE B 208 ? 0.4030 0.3883 0.7723 -0.1126 0.0359 0.0385 267 PHE B CB 5168 C CG . PHE B 208 ? 0.4369 0.4222 0.8173 -0.1142 0.0286 0.0369 267 PHE B CG 5169 C CD1 . PHE B 208 ? 0.4058 0.3880 0.7800 -0.1145 0.0232 0.0360 267 PHE B CD1 5170 C CD2 . PHE B 208 ? 0.4799 0.4684 0.8770 -0.1152 0.0271 0.0363 267 PHE B CD2 5171 C CE1 . PHE B 208 ? 0.4068 0.3888 0.7912 -0.1158 0.0164 0.0344 267 PHE B CE1 5172 C CE2 . PHE B 208 ? 0.4038 0.3924 0.8114 -0.1165 0.0203 0.0346 267 PHE B CE2 5173 C CZ . PHE B 208 ? 0.4058 0.3910 0.8070 -0.1167 0.0149 0.0337 267 PHE B CZ 5174 N N . CYS B 209 ? 0.4005 0.3835 0.7406 -0.1097 0.0202 0.0352 268 CYS B N 5175 C CA . CYS B 209 ? 0.5255 0.5095 0.8578 -0.1082 0.0145 0.0339 268 CYS B CA 5176 C C . CYS B 209 ? 0.3982 0.3825 0.7380 -0.1087 0.0056 0.0320 268 CYS B C 5177 O O . CYS B 209 ? 0.4005 0.3832 0.7467 -0.1099 0.0026 0.0315 268 CYS B O 5178 C CB . CYS B 209 ? 0.3985 0.3796 0.7115 -0.1068 0.0140 0.0341 268 CYS B CB 5179 S SG . CYS B 209 ? 0.4157 0.3961 0.7175 -0.1057 0.0239 0.0361 268 CYS B SG 5180 N N . PHE B 210 ? 0.3958 0.3821 0.7349 -0.1075 0.0013 0.0308 269 PHE B N 5181 C CA . PHE B 210 ? 0.3958 0.3820 0.7393 -0.1074 -0.0076 0.0287 269 PHE B CA 5182 C C . PHE B 210 ? 0.3941 0.3799 0.7245 -0.1053 -0.0124 0.0277 269 PHE B C 5183 O O . PHE B 210 ? 0.3922 0.3793 0.7153 -0.1042 -0.0090 0.0283 269 PHE B O 5184 C CB . PHE B 210 ? 0.3948 0.3844 0.7561 -0.1083 -0.0089 0.0278 269 PHE B CB 5185 C CG . PHE B 210 ? 0.3920 0.3851 0.7550 -0.1075 -0.0057 0.0280 269 PHE B CG 5186 C CD1 . PHE B 210 ? 0.3900 0.3841 0.7479 -0.1058 -0.0105 0.0267 269 PHE B CD1 5187 C CD2 . PHE B 210 ? 0.4142 0.4095 0.7843 -0.1083 0.0021 0.0297 269 PHE B CD2 5188 C CE1 . PHE B 210 ? 0.3875 0.3848 0.7469 -0.1051 -0.0076 0.0269 269 PHE B CE1 5189 C CE2 . PHE B 210 ? 0.3890 0.3874 0.7606 -0.1075 0.0049 0.0300 269 PHE B CE2 5190 C CZ . PHE B 210 ? 0.3869 0.3865 0.7533 -0.1060 0.0000 0.0286 269 PHE B CZ 5191 N N . VAL B 211 ? 0.5175 0.5011 0.8448 -0.1047 -0.0203 0.0263 270 VAL B N 5192 C CA . VAL B 211 ? 0.3938 0.3766 0.7091 -0.1026 -0.0255 0.0253 270 VAL B CA 5193 C C . VAL B 211 ? 0.3921 0.3774 0.7160 -0.1019 -0.0305 0.0235 270 VAL B C 5194 O O . VAL B 211 ? 0.4814 0.4676 0.7984 -0.1003 -0.0317 0.0230 270 VAL B O 5195 C CB . VAL B 211 ? 0.5684 0.5471 0.8743 -0.1020 -0.0314 0.0248 270 VAL B CB 5196 C CG1 . VAL B 211 ? 0.3947 0.3726 0.6898 -0.0997 -0.0375 0.0237 270 VAL B CG1 5197 C CG2 . VAL B 211 ? 0.3975 0.3737 0.6928 -0.1025 -0.0265 0.0265 270 VAL B CG2 5198 N N . SER B 212 ? 0.4357 0.4219 0.7747 -0.1030 -0.0333 0.0225 271 SER B N 5199 C CA . SER B 212 ? 0.3919 0.3801 0.7403 -0.1023 -0.0389 0.0204 271 SER B CA 5200 C C . SER B 212 ? 0.4573 0.4432 0.7962 -0.1001 -0.0470 0.0189 271 SER B C 5201 O O . SER B 212 ? 0.5012 0.4838 0.8282 -0.0995 -0.0489 0.0193 271 SER B O 5202 C CB . SER B 212 ? 0.3892 0.3812 0.7413 -0.1020 -0.0347 0.0207 271 SER B CB 5203 O OG . SER B 212 ? 0.4282 0.4223 0.7905 -0.1014 -0.0397 0.0186 271 SER B OG 5204 N N . ARG B 213 ? 0.4988 0.4863 0.8426 -0.0988 -0.0516 0.0171 272 ARG B N 5205 C CA . ARG B 213 ? 0.3907 0.3761 0.7257 -0.0964 -0.0591 0.0156 272 ARG B CA 5206 C C . ARG B 213 ? 0.3882 0.3759 0.7212 -0.0948 -0.0596 0.0147 272 ARG B C 5207 O O . ARG B 213 ? 0.6381 0.6289 0.9829 -0.0951 -0.0593 0.0137 272 ARG B O 5208 C CB . ARG B 213 ? 0.3925 0.3765 0.7365 -0.0961 -0.0669 0.0136 272 ARG B CB 5209 C CG . ARG B 213 ? 0.7792 0.7604 1.1235 -0.0974 -0.0678 0.0143 272 ARG B CG 5210 C CD . ARG B 213 ? 1.0490 1.0292 1.4047 -0.0972 -0.0751 0.0122 272 ARG B CD 5211 N NE . ARG B 213 ? 1.1198 1.0981 1.4690 -0.0943 -0.0831 0.0105 272 ARG B NE 5212 C CZ . ARG B 213 ? 1.0671 1.0415 1.4066 -0.0930 -0.0883 0.0104 272 ARG B CZ 5213 N NH1 . ARG B 213 ? 1.1288 1.1008 1.4635 -0.0944 -0.0863 0.0120 272 ARG B NH1 5214 N NH2 . ARG B 213 ? 0.9429 0.9155 1.2770 -0.0902 -0.0954 0.0089 272 ARG B NH2 5215 N N . CYS B 214 ? 0.4223 0.4085 0.7402 -0.0929 -0.0605 0.0150 273 CYS B N 5216 C CA . CYS B 214 ? 0.3852 0.3731 0.6994 -0.0912 -0.0613 0.0141 273 CYS B CA 5217 C C . CYS B 214 ? 0.5152 0.5003 0.8123 -0.0890 -0.0640 0.0143 273 CYS B C 5218 O O . CYS B 214 ? 0.6370 0.6191 0.9251 -0.0890 -0.0646 0.0152 273 CYS B O 5219 C CB . CYS B 214 ? 0.3831 0.3745 0.6997 -0.0922 -0.0534 0.0154 273 CYS B CB 5220 S SG . CYS B 214 ? 0.4426 0.4331 0.7443 -0.0926 -0.0460 0.0180 273 CYS B SG 5221 N N . ASP B 215 ? 0.5063 0.4923 0.7990 -0.0872 -0.0655 0.0134 274 ASP B N 5222 C CA . ASP B 215 ? 0.6170 0.6005 0.8941 -0.0849 -0.0683 0.0134 274 ASP B CA 5223 C C . ASP B 215 ? 0.3822 0.3657 0.6472 -0.0854 -0.0618 0.0154 274 ASP B C 5224 O O . ASP B 215 ? 0.5070 0.4878 0.7586 -0.0843 -0.0631 0.0160 274 ASP B O 5225 C CB . ASP B 215 ? 0.8119 0.7962 1.0890 -0.0826 -0.0724 0.0116 274 ASP B CB 5226 C CG . ASP B 215 ? 0.9030 0.8864 1.1896 -0.0815 -0.0798 0.0094 274 ASP B CG 5227 O OD1 . ASP B 215 ? 0.6738 0.6548 0.9623 -0.0818 -0.0835 0.0092 274 ASP B OD1 5228 O OD2 . ASP B 215 ? 0.9634 0.9485 1.2554 -0.0803 -0.0821 0.0077 274 ASP B OD2 5229 N N . TYR B 216 ? 0.4847 0.4714 0.7544 -0.0868 -0.0549 0.0164 275 TYR B N 5230 C CA . TYR B 216 ? 0.4024 0.3895 0.6611 -0.0869 -0.0487 0.0181 275 TYR B CA 5231 C C . TYR B 216 ? 0.4147 0.4014 0.6730 -0.0889 -0.0427 0.0199 275 TYR B C 5232 O O . TYR B 216 ? 0.4132 0.4024 0.6795 -0.0904 -0.0369 0.0208 275 TYR B O 5233 C CB . TYR B 216 ? 0.5107 0.5013 0.7728 -0.0867 -0.0448 0.0180 275 TYR B CB 5234 C CG . TYR B 216 ? 0.8607 0.8516 1.1101 -0.0861 -0.0399 0.0193 275 TYR B CG 5235 C CD1 . TYR B 216 ? 0.9622 0.9545 1.2115 -0.0875 -0.0322 0.0210 275 TYR B CD1 5236 C CD2 . TYR B 216 ? 0.9733 0.9628 1.2109 -0.0841 -0.0428 0.0187 275 TYR B CD2 5237 C CE1 . TYR B 216 ? 0.9041 0.8967 1.1421 -0.0868 -0.0278 0.0220 275 TYR B CE1 5238 C CE2 . TYR B 216 ? 0.8610 0.8509 1.0874 -0.0836 -0.0384 0.0197 275 TYR B CE2 5239 C CZ . TYR B 216 ? 0.8979 0.8893 1.1246 -0.0849 -0.0309 0.0213 275 TYR B CZ 5240 O OH . TYR B 216 ? 0.9349 0.9266 1.1506 -0.0843 -0.0265 0.0222 275 TYR B OH 5241 N N . TYR B 217 ? 0.4920 0.4755 0.7409 -0.0887 -0.0442 0.0205 276 TYR B N 5242 C CA . TYR B 217 ? 0.3832 0.3657 0.6281 -0.0902 -0.0385 0.0222 276 TYR B CA 5243 C C . TYR B 217 ? 0.6171 0.6006 0.8757 -0.0924 -0.0357 0.0227 276 TYR B C 5244 O O . TYR B 217 ? 0.3845 0.3687 0.6436 -0.0936 -0.0289 0.0242 276 TYR B O 5245 C CB . TYR B 217 ? 0.3814 0.3654 0.6181 -0.0900 -0.0316 0.0235 276 TYR B CB 5246 C CG . TYR B 217 ? 0.6262 0.6086 0.8475 -0.0880 -0.0336 0.0233 276 TYR B CG 5247 C CD1 . TYR B 217 ? 0.3822 0.3611 0.5914 -0.0874 -0.0358 0.0237 276 TYR B CD1 5248 C CD2 . TYR B 217 ? 0.3784 0.3627 0.5970 -0.0868 -0.0331 0.0228 276 TYR B CD2 5249 C CE1 . TYR B 217 ? 0.6076 0.5852 0.8030 -0.0856 -0.0376 0.0236 276 TYR B CE1 5250 C CE2 . TYR B 217 ? 0.4829 0.4658 0.6877 -0.0850 -0.0348 0.0226 276 TYR B CE2 5251 C CZ . TYR B 217 ? 0.5148 0.4943 0.7081 -0.0845 -0.0370 0.0230 276 TYR B CZ 5252 O OH . TYR B 217 ? 0.5532 0.5314 0.7330 -0.0827 -0.0387 0.0229 276 TYR B OH 5253 N N . CYS B 218 ? 0.3854 0.3689 0.6553 -0.0927 -0.0410 0.0214 277 CYS B N 5254 C CA . CYS B 218 ? 0.3872 0.3706 0.6685 -0.0948 -0.0396 0.0218 277 CYS B CA 5255 C C . CYS B 218 ? 0.4942 0.4738 0.7673 -0.0949 -0.0416 0.0223 277 CYS B C 5256 O O . CYS B 218 ? 0.5456 0.5233 0.8216 -0.0947 -0.0480 0.0213 277 CYS B O 5257 C CB . CYS B 218 ? 0.3874 0.3722 0.6840 -0.0951 -0.0445 0.0201 277 CYS B CB 5258 S SG . CYS B 218 ? 0.3850 0.3746 0.6946 -0.0956 -0.0408 0.0197 277 CYS B SG 5259 N N . ASP B 219 ? 0.3899 0.3684 0.6526 -0.0952 -0.0361 0.0239 278 ASP B N 5260 C CA . ASP B 219 ? 0.3922 0.3671 0.6459 -0.0954 -0.0370 0.0246 278 ASP B CA 5261 C C . ASP B 219 ? 0.3930 0.3679 0.6465 -0.0970 -0.0290 0.0264 278 ASP B C 5262 O O . ASP B 219 ? 0.7693 0.7469 1.0288 -0.0977 -0.0228 0.0270 278 ASP B O 5263 C CB . ASP B 219 ? 0.3918 0.3644 0.6283 -0.0934 -0.0399 0.0246 278 ASP B CB 5264 C CG . ASP B 219 ? 0.4667 0.4410 0.6948 -0.0926 -0.0348 0.0252 278 ASP B CG 5265 O OD1 . ASP B 219 ? 0.5196 0.4957 0.7498 -0.0936 -0.0274 0.0264 278 ASP B OD1 5266 O OD2 . ASP B 219 ? 0.4698 0.4438 0.6893 -0.0907 -0.0382 0.0246 278 ASP B OD2 5267 N N . THR B 220 ? 0.4656 0.4373 0.7119 -0.0974 -0.0291 0.0270 279 THR B N 5268 C CA . THR B 220 ? 0.3966 0.3677 0.6421 -0.0987 -0.0218 0.0285 279 THR B CA 5269 C C . THR B 220 ? 0.5936 0.5661 0.8309 -0.0981 -0.0146 0.0296 279 THR B C 5270 O O . THR B 220 ? 0.5558 0.5297 0.7988 -0.0990 -0.0076 0.0306 279 THR B O 5271 C CB . THR B 220 ? 0.4671 0.4342 0.7033 -0.0988 -0.0237 0.0290 279 THR B CB 5272 O OG1 . THR B 220 ? 0.4008 0.3666 0.6447 -0.0993 -0.0307 0.0280 279 THR B OG1 5273 C CG2 . THR B 220 ? 0.4008 0.3672 0.6371 -0.1002 -0.0161 0.0304 279 THR B CG2 5274 N N . THR B 221 ? 0.3937 0.3655 0.6174 -0.0963 -0.0163 0.0294 280 THR B N 5275 C CA . THR B 221 ? 0.4194 0.3922 0.6337 -0.0955 -0.0101 0.0302 280 THR B CA 5276 C C . THR B 221 ? 0.4367 0.4133 0.6607 -0.0957 -0.0057 0.0303 280 THR B C 5277 O O . THR B 221 ? 0.4682 0.4458 0.6905 -0.0957 0.0015 0.0314 280 THR B O 5278 C CB . THR B 221 ? 0.5561 0.5277 0.7554 -0.0935 -0.0137 0.0297 280 THR B CB 5279 O OG1 . THR B 221 ? 0.4392 0.4072 0.6288 -0.0932 -0.0177 0.0297 280 THR B OG1 5280 C CG2 . THR B 221 ? 0.3896 0.3622 0.5791 -0.0926 -0.0073 0.0304 280 THR B CG2 5281 N N . HIS B 222 ? 0.4068 0.3854 0.6409 -0.0957 -0.0101 0.0293 281 HIS B N 5282 C CA . HIS B 222 ? 0.3866 0.3689 0.6298 -0.0958 -0.0067 0.0293 281 HIS B CA 5283 C C . HIS B 222 ? 0.3872 0.3713 0.6480 -0.0975 -0.0058 0.0293 281 HIS B C 5284 O O . HIS B 222 ? 0.4050 0.3921 0.6757 -0.0975 -0.0061 0.0288 281 HIS B O 5285 C CB . HIS B 222 ? 0.3845 0.3681 0.6255 -0.0943 -0.0116 0.0280 281 HIS B CB 5286 C CG . HIS B 222 ? 0.4272 0.4094 0.6515 -0.0926 -0.0124 0.0280 281 HIS B CG 5287 N ND1 . HIS B 222 ? 0.3849 0.3640 0.5995 -0.0917 -0.0182 0.0274 281 HIS B ND1 5288 C CD2 . HIS B 222 ? 0.3819 0.3652 0.5977 -0.0915 -0.0082 0.0285 281 HIS B CD2 5289 C CE1 . HIS B 222 ? 0.4669 0.4455 0.6679 -0.0903 -0.0174 0.0276 281 HIS B CE1 5290 N NE2 . HIS B 222 ? 0.6031 0.5841 0.8045 -0.0902 -0.0114 0.0281 281 HIS B NE2 5291 N N . ALA B 223 ? 0.3896 0.3719 0.6544 -0.0988 -0.0047 0.0299 282 ALA B N 5292 C CA . ALA B 223 ? 0.3904 0.3742 0.6720 -0.1006 -0.0035 0.0300 282 ALA B CA 5293 C C . ALA B 223 ? 0.3891 0.3759 0.6777 -0.1010 0.0042 0.0312 282 ALA B C 5294 O O . ALA B 223 ? 0.4189 0.4056 0.6986 -0.1002 0.0100 0.0324 282 ALA B O 5295 C CB . ALA B 223 ? 0.3934 0.3744 0.6763 -0.1019 -0.0030 0.0305 282 ALA B CB 5296 N N . ILE B 224 ? 0.4112 0.4005 0.7156 -0.1021 0.0042 0.0309 283 ILE B N 5297 C CA . ILE B 224 ? 0.3877 0.3798 0.7004 -0.1025 0.0113 0.0322 283 ILE B CA 5298 C C . ILE B 224 ? 0.3899 0.3808 0.7081 -0.1039 0.0170 0.0337 283 ILE B C 5299 O O . ILE B 224 ? 0.4415 0.4313 0.7681 -0.1053 0.0144 0.0333 283 ILE B O 5300 C CB . ILE B 224 ? 0.3862 0.3817 0.7137 -0.1030 0.0088 0.0313 283 ILE B CB 5301 C CG1 . ILE B 224 ? 0.3839 0.3806 0.7057 -0.1014 0.0039 0.0299 283 ILE B CG1 5302 C CG2 . ILE B 224 ? 0.3855 0.3836 0.7226 -0.1036 0.0162 0.0328 283 ILE B CG2 5303 C CD1 . ILE B 224 ? 0.4025 0.4002 0.7137 -0.1000 0.0086 0.0309 283 ILE B CD1 5304 N N . CYS B 225 ? 0.4065 0.3974 0.7198 -0.1034 0.0248 0.0354 284 CYS B N 5305 C CA . CYS B 225 ? 0.3922 0.3814 0.7081 -0.1043 0.0307 0.0368 284 CYS B CA 5306 C C . CYS B 225 ? 0.3917 0.3831 0.7156 -0.1043 0.0387 0.0385 284 CYS B C 5307 O O . CYS B 225 ? 0.3896 0.3828 0.7095 -0.1030 0.0418 0.0390 284 CYS B O 5308 C CB . CYS B 225 ? 0.3936 0.3794 0.6928 -0.1033 0.0327 0.0373 284 CYS B CB 5309 S SG . CYS B 225 ? 0.3948 0.3774 0.6838 -0.1033 0.0239 0.0357 284 CYS B SG 5310 N N . GLY B 226 ? 0.3936 0.3847 0.7289 -0.1058 0.0420 0.0394 285 GLY B N 5311 C CA . GLY B 226 ? 0.3934 0.3863 0.7368 -0.1057 0.0499 0.0412 285 GLY B CA 5312 C C . GLY B 226 ? 0.5133 0.5035 0.8466 -0.1047 0.0573 0.0427 285 GLY B C 5313 O O . GLY B 226 ? 0.4205 0.4079 0.7401 -0.1040 0.0561 0.0423 285 GLY B O 5314 N N . LEU B 227 ? 0.3954 0.3865 0.7352 -0.1044 0.0649 0.0445 286 LEU B N 5315 C CA . LEU B 227 ? 0.4247 0.4134 0.7561 -0.1033 0.0724 0.0460 286 LEU B CA 5316 C C . LEU B 227 ? 0.4302 0.4186 0.7739 -0.1041 0.0789 0.0477 286 LEU B C 5317 O O . LEU B 227 ? 0.5327 0.5221 0.8789 -0.1029 0.0858 0.0493 286 LEU B O 5318 C CB . LEU B 227 ? 0.4847 0.4744 0.8061 -0.1009 0.0765 0.0467 286 LEU B CB 5319 C CG . LEU B 227 ? 0.5139 0.5004 0.8201 -0.0991 0.0816 0.0473 286 LEU B CG 5320 C CD1 . LEU B 227 ? 0.3978 0.3813 0.6926 -0.0995 0.0765 0.0459 286 LEU B CD1 5321 C CD2 . LEU B 227 ? 0.4922 0.4800 0.7888 -0.0967 0.0846 0.0476 286 LEU B CD2 5322 N N . PRO B 228 ? 0.4015 0.3883 0.7527 -0.1060 0.0769 0.0473 287 PRO B N 5323 C CA . PRO B 228 ? 0.4023 0.3874 0.7502 -0.1073 0.0689 0.0455 287 PRO B CA 5324 C C . PRO B 228 ? 0.5050 0.4927 0.8662 -0.1090 0.0617 0.0441 287 PRO B C 5325 O O . PRO B 228 ? 0.4856 0.4727 0.8424 -0.1093 0.0541 0.0424 287 PRO B O 5326 C CB . PRO B 228 ? 0.4058 0.3875 0.7543 -0.1082 0.0720 0.0462 287 PRO B CB 5327 C CG . PRO B 228 ? 0.4066 0.3896 0.7688 -0.1086 0.0790 0.0479 287 PRO B CG 5328 C CD . PRO B 228 ? 0.4041 0.3896 0.7645 -0.1067 0.0834 0.0489 287 PRO B CD 5329 N N . ASP B 229 ? 0.4007 0.3911 0.7777 -0.1099 0.0640 0.0448 288 ASP B N 5330 C CA . ASP B 229 ? 0.4002 0.3927 0.7915 -0.1117 0.0578 0.0434 288 ASP B CA 5331 C C . ASP B 229 ? 0.3975 0.3941 0.7984 -0.1115 0.0571 0.0433 288 ASP B C 5332 O O . ASP B 229 ? 0.5151 0.5137 0.9289 -0.1129 0.0525 0.0422 288 ASP B O 5333 C CB . ASP B 229 ? 0.4030 0.3943 0.8072 -0.1136 0.0599 0.0440 288 ASP B CB 5334 C CG . ASP B 229 ? 0.4551 0.4473 0.8673 -0.1134 0.0691 0.0463 288 ASP B CG 5335 O OD1 . ASP B 229 ? 0.5169 0.5093 0.9208 -0.1115 0.0746 0.0476 288 ASP B OD1 5336 O OD2 . ASP B 229 ? 0.6164 0.6090 1.0432 -0.1151 0.0708 0.0468 288 ASP B OD2 5337 N N . MSE B 230 ? 0.4453 0.4434 0.8402 -0.1097 0.0617 0.0444 289 MSE B N 5338 C CA . MSE B 230 ? 0.3929 0.3949 0.7952 -0.1094 0.0609 0.0443 289 MSE B CA 5339 C C . MSE B 230 ? 0.6522 0.6550 1.0428 -0.1080 0.0558 0.0429 289 MSE B C 5340 O O . MSE B 230 ? 0.5508 0.5513 0.9260 -0.1068 0.0557 0.0428 289 MSE B O 5341 C CB . MSE B 230 ? 0.3924 0.3959 0.7984 -0.1084 0.0696 0.0467 289 MSE B CB 5342 C CG . MSE B 230 ? 0.3912 0.3941 0.7820 -0.1060 0.0737 0.0476 289 MSE B CG 5343 SE SE . MSE B 230 ? 0.9326 0.9303 1.3056 -0.1050 0.0767 0.0479 289 MSE B SE 5344 C CE . MSE B 230 ? 0.3974 0.3934 0.7839 -0.1065 0.0834 0.0497 289 MSE B CE 5345 N N . LYS B 231 ? 0.4694 0.4753 0.8671 -0.1081 0.0514 0.0417 290 LYS B N 5346 C CA . LYS B 231 ? 0.3861 0.3927 0.7736 -0.1068 0.0464 0.0403 290 LYS B CA 5347 C C . LYS B 231 ? 0.3834 0.3941 0.7784 -0.1064 0.0459 0.0401 290 LYS B C 5348 O O . LYS B 231 ? 0.3976 0.4102 0.8055 -0.1076 0.0422 0.0391 290 LYS B O 5349 C CB . LYS B 231 ? 0.3867 0.3918 0.7717 -0.1074 0.0377 0.0380 290 LYS B CB 5350 C CG . LYS B 231 ? 0.3845 0.3904 0.7606 -0.1061 0.0318 0.0364 290 LYS B CG 5351 C CD . LYS B 231 ? 0.4694 0.4743 0.8291 -0.1042 0.0352 0.0372 290 LYS B CD 5352 C CE . LYS B 231 ? 0.3856 0.3866 0.7339 -0.1041 0.0370 0.0378 290 LYS B CE 5353 N NZ . LYS B 231 ? 0.3845 0.3845 0.7160 -0.1022 0.0387 0.0381 290 LYS B NZ 5354 N N . GLU B 232 ? 0.4493 0.4609 0.8359 -0.1047 0.0496 0.0411 291 GLU B N 5355 C CA . GLU B 232 ? 0.3790 0.3942 0.7702 -0.1040 0.0490 0.0409 291 GLU B CA 5356 C C . GLU B 232 ? 0.3777 0.3934 0.7652 -0.1038 0.0406 0.0384 291 GLU B C 5357 O O . GLU B 232 ? 0.5958 0.6090 0.9726 -0.1034 0.0365 0.0373 291 GLU B O 5358 C CB . GLU B 232 ? 0.3776 0.3934 0.7598 -0.1021 0.0551 0.0426 291 GLU B CB 5359 C CG . GLU B 232 ? 0.3749 0.3943 0.7609 -0.1013 0.0549 0.0426 291 GLU B CG 5360 C CD . GLU B 232 ? 0.3892 0.4091 0.7663 -0.0993 0.0611 0.0444 291 GLU B CD 5361 O OE1 . GLU B 232 ? 0.5585 0.5774 0.9359 -0.0989 0.0680 0.0464 291 GLU B OE1 5362 O OE2 . GLU B 232 ? 0.3878 0.4089 0.7576 -0.0981 0.0589 0.0436 291 GLU B OE2 5363 N N . GLY B 233 ? 0.3759 0.3948 0.7724 -0.1039 0.0379 0.0376 292 GLY B N 5364 C CA . GLY B 233 ? 0.3867 0.4062 0.7796 -0.1033 0.0305 0.0353 292 GLY B CA 5365 C C . GLY B 233 ? 0.3730 0.3963 0.7734 -0.1029 0.0301 0.0350 292 GLY B C 5366 O O . GLY B 233 ? 0.4318 0.4573 0.8417 -0.1033 0.0351 0.0365 292 GLY B O 5367 N N . SER B 234 ? 0.3708 0.3948 0.7666 -0.1020 0.0242 0.0330 293 SER B N 5368 C CA . SER B 234 ? 0.3688 0.3962 0.7717 -0.1016 0.0229 0.0323 293 SER B CA 5369 C C . SER B 234 ? 0.3694 0.3980 0.7860 -0.1028 0.0173 0.0304 293 SER B C 5370 O O . SER B 234 ? 0.4550 0.4814 0.8704 -0.1031 0.0115 0.0286 293 SER B O 5371 C CB . SER B 234 ? 0.3669 0.3945 0.7577 -0.0998 0.0199 0.0312 293 SER B CB 5372 O OG . SER B 234 ? 0.4975 0.5233 0.8840 -0.0994 0.0123 0.0289 293 SER B OG 5373 N N . VAL B 235 ? 0.3686 0.4004 0.7981 -0.1034 0.0191 0.0307 294 VAL B N 5374 C CA . VAL B 235 ? 0.3692 0.4023 0.8126 -0.1045 0.0141 0.0287 294 VAL B CA 5375 C C . VAL B 235 ? 0.3670 0.4034 0.8142 -0.1036 0.0115 0.0274 294 VAL B C 5376 O O . VAL B 235 ? 0.4034 0.4425 0.8548 -0.1035 0.0162 0.0289 294 VAL B O 5377 C CB . VAL B 235 ? 0.5158 0.5499 0.9739 -0.1063 0.0182 0.0301 294 VAL B CB 5378 C CG1 . VAL B 235 ? 0.3709 0.4068 0.8439 -0.1074 0.0129 0.0279 294 VAL B CG1 5379 C CG2 . VAL B 235 ? 0.3729 0.4036 0.8273 -0.1072 0.0206 0.0312 294 VAL B CG2 5380 N N . GLN B 236 ? 0.3669 0.4027 0.8121 -0.1028 0.0040 0.0247 295 GLN B N 5381 C CA . GLN B 236 ? 0.4410 0.4794 0.8875 -0.1017 0.0009 0.0231 295 GLN B CA 5382 C C . GLN B 236 ? 0.4830 0.5227 0.9430 -0.1023 -0.0048 0.0205 295 GLN B C 5383 O O . GLN B 236 ? 0.3861 0.4236 0.8470 -0.1025 -0.0102 0.0187 295 GLN B O 5384 C CB . GLN B 236 ? 0.3641 0.4007 0.7952 -0.0997 -0.0028 0.0219 295 GLN B CB 5385 C CG . GLN B 236 ? 0.3624 0.4011 0.7939 -0.0984 -0.0065 0.0200 295 GLN B CG 5386 C CD . GLN B 236 ? 0.4143 0.4513 0.8302 -0.0964 -0.0094 0.0191 295 GLN B CD 5387 O OE1 . GLN B 236 ? 0.4675 0.5027 0.8801 -0.0955 -0.0159 0.0167 295 GLN B OE1 5388 N NE2 . GLN B 236 ? 0.4974 0.5347 0.9037 -0.0957 -0.0044 0.0210 295 GLN B NE2 5389 N N . VAL B 237 ? 0.4503 0.4936 0.9204 -0.1025 -0.0038 0.0204 296 VAL B N 5390 C CA . VAL B 237 ? 0.3934 0.4383 0.8771 -0.1030 -0.0088 0.0179 296 VAL B CA 5391 C C . VAL B 237 ? 0.3650 0.4082 0.8432 -0.1014 -0.0172 0.0146 296 VAL B C 5392 O O . VAL B 237 ? 0.4348 0.4775 0.9011 -0.0996 -0.0186 0.0141 296 VAL B O 5393 C CB . VAL B 237 ? 0.4432 0.4923 0.9365 -0.1031 -0.0063 0.0182 296 VAL B CB 5394 C CG1 . VAL B 237 ? 0.3610 0.4111 0.8439 -0.1011 -0.0064 0.0180 296 VAL B CG1 5395 C CG2 . VAL B 237 ? 0.4572 0.5081 0.9654 -0.1037 -0.0114 0.0155 296 VAL B CG2 5396 N N . PHE B 238 ? 0.4498 0.4922 0.9366 -0.1020 -0.0225 0.0124 297 PHE B N 5397 C CA . PHE B 238 ? 0.4224 0.4631 0.9056 -0.1003 -0.0307 0.0092 297 PHE B CA 5398 C C . PHE B 238 ? 0.4613 0.5046 0.9459 -0.0988 -0.0331 0.0073 297 PHE B C 5399 O O . PHE B 238 ? 0.5151 0.5618 1.0099 -0.0995 -0.0304 0.0077 297 PHE B O 5400 C CB . PHE B 238 ? 0.3692 0.4089 0.8636 -0.1013 -0.0357 0.0072 297 PHE B CB 5401 C CG . PHE B 238 ? 0.5239 0.5594 1.0094 -0.1003 -0.0414 0.0059 297 PHE B CG 5402 C CD1 . PHE B 238 ? 0.5212 0.5539 0.9982 -0.1010 -0.0387 0.0079 297 PHE B CD1 5403 C CD2 . PHE B 238 ? 0.3714 0.4058 0.8571 -0.0985 -0.0494 0.0026 297 PHE B CD2 5404 C CE1 . PHE B 238 ? 0.3957 0.4246 0.8643 -0.1001 -0.0439 0.0068 297 PHE B CE1 5405 C CE2 . PHE B 238 ? 0.5075 0.5381 0.9850 -0.0974 -0.0546 0.0015 297 PHE B CE2 5406 C CZ . PHE B 238 ? 0.4304 0.4582 0.8993 -0.0983 -0.0519 0.0037 297 PHE B CZ 5407 N N . LEU B 239 ? 0.5001 0.5417 0.9742 -0.0966 -0.0382 0.0054 298 LEU B N 5408 C CA . LEU B 239 ? 0.5071 0.5506 0.9827 -0.0949 -0.0415 0.0031 298 LEU B CA 5409 C C . LEU B 239 ? 0.5220 0.5667 1.0124 -0.0951 -0.0467 0.0003 298 LEU B C 5410 O O . LEU B 239 ? 0.6195 0.6622 1.1147 -0.0959 -0.0498 -0.0005 298 LEU B O 5411 C CB . LEU B 239 ? 0.4700 0.5110 0.9309 -0.0923 -0.0459 0.0017 298 LEU B CB 5412 C CG . LEU B 239 ? 0.5315 0.5722 0.9784 -0.0917 -0.0411 0.0039 298 LEU B CG 5413 C CD1 . LEU B 239 ? 0.4754 0.5131 0.9081 -0.0893 -0.0457 0.0025 298 LEU B CD1 5414 C CD2 . LEU B 239 ? 0.5164 0.5609 0.9669 -0.0916 -0.0372 0.0046 298 LEU B CD2 5415 N N . PRO B 240 ? 0.4962 0.5439 0.9938 -0.0945 -0.0476 -0.0013 299 PRO B N 5416 C CA . PRO B 240 ? 0.4068 0.4557 0.9184 -0.0945 -0.0529 -0.0043 299 PRO B CA 5417 C C . PRO B 240 ? 0.3665 0.4119 0.8739 -0.0926 -0.0610 -0.0074 299 PRO B C 5418 O O . PRO B 240 ? 0.5364 0.5793 1.0298 -0.0907 -0.0629 -0.0076 299 PRO B O 5419 C CB . PRO B 240 ? 0.5046 0.5571 1.0202 -0.0936 -0.0525 -0.0054 299 PRO B CB 5420 C CG . PRO B 240 ? 0.5883 0.6404 1.0890 -0.0922 -0.0495 -0.0039 299 PRO B CG 5421 C CD . PRO B 240 ? 0.5094 0.5597 1.0026 -0.0936 -0.0442 -0.0005 299 PRO B CD 5422 N N . ASP B 241 ? 0.4980 0.5433 1.0174 -0.0930 -0.0656 -0.0096 300 ASP B N 5423 C CA . ASP B 241 ? 0.4052 0.4470 0.9217 -0.0911 -0.0733 -0.0124 300 ASP B CA 5424 C C . ASP B 241 ? 0.5849 0.6258 1.0926 -0.0878 -0.0781 -0.0150 300 ASP B C 5425 O O . ASP B 241 ? 0.6808 0.7245 1.1912 -0.0871 -0.0775 -0.0160 300 ASP B O 5426 C CB . ASP B 241 ? 0.6996 0.7421 1.2323 -0.0920 -0.0775 -0.0148 300 ASP B CB 5427 C CG . ASP B 241 ? 0.9690 1.0075 1.4989 -0.0905 -0.0848 -0.0170 300 ASP B CG 5428 O OD1 . ASP B 241 ? 1.0282 1.0646 1.5585 -0.0920 -0.0841 -0.0156 300 ASP B OD1 5429 O OD2 . ASP B 241 ? 1.0766 1.1138 1.6037 -0.0876 -0.0912 -0.0201 300 ASP B OD2 5430 N N . GLU B 242 ? 0.6954 0.7323 1.1922 -0.0859 -0.0829 -0.0160 301 GLU B N 5431 C CA . GLU B 242 ? 0.6582 0.6936 1.1449 -0.0825 -0.0873 -0.0181 301 GLU B CA 5432 C C . GLU B 242 ? 0.8015 0.8381 1.2979 -0.0806 -0.0930 -0.0221 301 GLU B C 5433 O O . GLU B 242 ? 0.8375 0.8747 1.3294 -0.0784 -0.0945 -0.0238 301 GLU B O 5434 C CB . GLU B 242 ? 0.7671 0.7977 1.2413 -0.0808 -0.0914 -0.0183 301 GLU B CB 5435 C CG . GLU B 242 ? 0.9054 0.9340 1.3668 -0.0774 -0.0949 -0.0198 301 GLU B CG 5436 C CD . GLU B 242 ? 1.0031 1.0325 1.4525 -0.0776 -0.0890 -0.0172 301 GLU B CD 5437 O OE1 . GLU B 242 ? 0.9980 1.0283 1.4461 -0.0801 -0.0828 -0.0140 301 GLU B OE1 5438 O OE2 . GLU B 242 ? 1.1018 1.1307 1.5430 -0.0751 -0.0905 -0.0184 301 GLU B OE2 5439 N N . SER B 243 ? 0.9651 1.0019 1.4747 -0.0815 -0.0963 -0.0238 302 SER B N 5440 C CA . SER B 243 ? 0.8410 0.8790 1.3613 -0.0798 -0.1019 -0.0278 302 SER B CA 5441 C C . SER B 243 ? 0.6276 0.6701 1.1549 -0.0803 -0.0985 -0.0281 302 SER B C 5442 O O . SER B 243 ? 0.7125 0.7557 1.2412 -0.0778 -0.1025 -0.0312 302 SER B O 5443 C CB . SER B 243 ? 0.8625 0.9003 1.3967 -0.0812 -0.1051 -0.0290 302 SER B CB 5444 O OG . SER B 243 ? 0.9699 1.0105 1.5138 -0.0849 -0.0988 -0.0263 302 SER B OG 5445 N N . ALA B 244 ? 0.5415 0.5870 1.0731 -0.0833 -0.0912 -0.0249 303 ALA B N 5446 C CA . ALA B 244 ? 0.4066 0.4566 0.9448 -0.0839 -0.0874 -0.0248 303 ALA B CA 5447 C C . ALA B 244 ? 0.5318 0.5821 1.0564 -0.0827 -0.0840 -0.0233 303 ALA B C 5448 O O . ALA B 244 ? 0.6786 0.7305 1.2027 -0.0809 -0.0853 -0.0252 303 ALA B O 5449 C CB . ALA B 244 ? 0.4096 0.4626 0.9592 -0.0875 -0.0812 -0.0220 303 ALA B CB 5450 N N . VAL B 245 ? 0.7536 0.8024 1.2670 -0.0836 -0.0796 -0.0200 304 VAL B N 5451 C CA . VAL B 245 ? 0.6630 0.7119 1.1631 -0.0826 -0.0760 -0.0184 304 VAL B CA 5452 C C . VAL B 245 ? 0.6787 0.7232 1.1632 -0.0808 -0.0785 -0.0182 304 VAL B C 5453 O O . VAL B 245 ? 0.7924 0.8354 1.2699 -0.0822 -0.0750 -0.0153 304 VAL B O 5454 C CB . VAL B 245 ? 0.4837 0.5351 0.9840 -0.0853 -0.0674 -0.0142 304 VAL B CB 5455 C CG1 . VAL B 245 ? 0.6046 0.6566 1.0923 -0.0841 -0.0640 -0.0129 304 VAL B CG1 5456 C CG2 . VAL B 245 ? 0.4667 0.5222 0.9832 -0.0872 -0.0648 -0.0141 304 VAL B CG2 5457 N N . PRO B 246 ? 0.7534 0.7959 1.2323 -0.0776 -0.0846 -0.0213 305 PRO B N 5458 C CA . PRO B 246 ? 0.8221 0.8603 1.2861 -0.0755 -0.0875 -0.0213 305 PRO B CA 5459 C C . PRO B 246 ? 0.7015 0.7397 1.1520 -0.0757 -0.0819 -0.0184 305 PRO B C 5460 O O . PRO B 246 ? 0.5228 0.5643 0.9745 -0.0764 -0.0774 -0.0174 305 PRO B O 5461 C CB . PRO B 246 ? 0.7221 0.7589 1.1849 -0.0719 -0.0945 -0.0254 305 PRO B CB 5462 C CG . PRO B 246 ? 0.7279 0.7687 1.2014 -0.0721 -0.0936 -0.0269 305 PRO B CG 5463 C CD . PRO B 246 ? 0.6486 0.6925 1.1352 -0.0757 -0.0893 -0.0251 305 PRO B CD 5464 N N . ARG B 247 ? 0.8125 0.8472 1.2506 -0.0751 -0.0824 -0.0172 306 ARG B N 5465 C CA . ARG B 247 ? 0.6670 0.7015 1.0921 -0.0753 -0.0772 -0.0144 306 ARG B CA 5466 C C . ARG B 247 ? 0.4809 0.5116 0.8912 -0.0725 -0.0808 -0.0154 306 ARG B C 5467 O O . ARG B 247 ? 0.5927 0.6202 1.0015 -0.0707 -0.0869 -0.0173 306 ARG B O 5468 C CB . ARG B 247 ? 0.6673 0.7018 1.0922 -0.0782 -0.0719 -0.0110 306 ARG B CB 5469 C CG . ARG B 247 ? 0.7017 0.7404 1.1360 -0.0808 -0.0654 -0.0089 306 ARG B CG 5470 C CD . ARG B 247 ? 0.5534 0.5919 0.9885 -0.0835 -0.0601 -0.0056 306 ARG B CD 5471 N NE . ARG B 247 ? 0.7285 0.7646 1.1686 -0.0843 -0.0638 -0.0063 306 ARG B NE 5472 C CZ . ARG B 247 ? 0.7364 0.7690 1.1676 -0.0840 -0.0652 -0.0056 306 ARG B CZ 5473 N NH1 . ARG B 247 ? 0.9285 0.9593 1.3450 -0.0832 -0.0633 -0.0042 306 ARG B NH1 5474 N NH2 . ARG B 247 ? 0.7464 0.7771 1.1835 -0.0847 -0.0686 -0.0064 306 ARG B NH2 5475 N N . LYS B 248 ? 0.6130 0.6441 1.0125 -0.0719 -0.0770 -0.0138 307 LYS B N 5476 C CA . LYS B 248 ? 0.6156 0.6434 1.0007 -0.0692 -0.0798 -0.0145 307 LYS B CA 5477 C C . LYS B 248 ? 0.5958 0.6217 0.9692 -0.0702 -0.0761 -0.0115 307 LYS B C 5478 O O . LYS B 248 ? 0.5723 0.6003 0.9457 -0.0726 -0.0698 -0.0088 307 LYS B O 5479 C CB . LYS B 248 ? 0.6966 0.7258 1.0774 -0.0674 -0.0791 -0.0156 307 LYS B CB 5480 C CG . LYS B 248 ? 0.8988 0.9284 1.2866 -0.0651 -0.0846 -0.0194 307 LYS B CG 5481 C CD . LYS B 248 ? 0.9502 0.9814 1.3334 -0.0635 -0.0831 -0.0202 307 LYS B CD 5482 C CE . LYS B 248 ? 0.9712 0.9994 1.3384 -0.0614 -0.0833 -0.0197 307 LYS B CE 5483 N NZ . LYS B 248 ? 0.9170 0.9469 1.2790 -0.0603 -0.0808 -0.0199 307 LYS B NZ 5484 N N . HIS B 249 ? 0.6482 0.6701 1.0115 -0.0683 -0.0801 -0.0122 308 HIS B N 5485 C CA . HIS B 249 ? 0.6853 0.7051 1.0366 -0.0689 -0.0773 -0.0096 308 HIS B CA 5486 C C . HIS B 249 ? 0.7385 0.7563 1.0761 -0.0663 -0.0784 -0.0101 308 HIS B C 5487 O O . HIS B 249 ? 0.7606 0.7753 1.0937 -0.0635 -0.0842 -0.0122 308 HIS B O 5488 C CB . HIS B 249 ? 0.8093 0.8258 1.1601 -0.0691 -0.0810 -0.0096 308 HIS B CB 5489 C CG . HIS B 249 ? 1.1802 1.1983 1.5440 -0.0717 -0.0799 -0.0090 308 HIS B CG 5490 N ND1 . HIS B 249 ? 1.3084 1.3274 1.6727 -0.0745 -0.0743 -0.0061 308 HIS B ND1 5491 C CD2 . HIS B 249 ? 1.2354 1.2542 1.6122 -0.0718 -0.0837 -0.0111 308 HIS B CD2 5492 C CE1 . HIS B 249 ? 1.3696 1.3898 1.7467 -0.0763 -0.0746 -0.0063 308 HIS B CE1 5493 N NE2 . HIS B 249 ? 1.2701 1.2903 1.6551 -0.0748 -0.0803 -0.0093 308 HIS B NE2 5494 N N . ASN B 250 ? 0.7099 0.7294 1.0409 -0.0669 -0.0728 -0.0082 309 ASN B N 5495 C CA . ASN B 250 ? 0.6816 0.6995 1.0002 -0.0646 -0.0733 -0.0087 309 ASN B CA 5496 C C . ASN B 250 ? 0.6134 0.6297 0.9191 -0.0651 -0.0697 -0.0062 309 ASN B C 5497 O O . ASN B 250 ? 0.7199 0.7383 1.0256 -0.0674 -0.0638 -0.0037 309 ASN B O 5498 C CB . ASN B 250 ? 0.6280 0.6492 0.9492 -0.0643 -0.0706 -0.0092 309 ASN B CB 5499 C CG . ASN B 250 ? 0.7766 0.7990 1.1085 -0.0631 -0.0748 -0.0122 309 ASN B CG 5500 O OD1 . ASN B 250 ? 0.8561 0.8821 1.1988 -0.0647 -0.0724 -0.0121 309 ASN B OD1 5501 N ND2 . ASN B 250 ? 0.6794 0.6988 1.0084 -0.0601 -0.0811 -0.0148 309 ASN B ND2 5502 N N . ARG B 251 ? 0.5762 0.5889 0.8711 -0.0628 -0.0734 -0.0069 310 ARG B N 5503 C CA . ARG B 251 ? 0.5677 0.5787 0.8495 -0.0628 -0.0707 -0.0049 310 ARG B CA 5504 C C . ARG B 251 ? 0.6040 0.6173 0.8804 -0.0631 -0.0652 -0.0037 310 ARG B C 5505 O O . ARG B 251 ? 0.6567 0.6711 0.9336 -0.0616 -0.0659 -0.0052 310 ARG B O 5506 C CB . ARG B 251 ? 0.5785 0.5851 0.8504 -0.0599 -0.0762 -0.0062 310 ARG B CB 5507 C CG . ARG B 251 ? 0.8681 0.8725 1.1261 -0.0598 -0.0740 -0.0043 310 ARG B CG 5508 C CD . ARG B 251 ? 0.9299 0.9302 1.1786 -0.0566 -0.0795 -0.0057 310 ARG B CD 5509 N NE . ARG B 251 ? 1.0214 1.0192 1.2579 -0.0566 -0.0783 -0.0039 310 ARG B NE 5510 C CZ . ARG B 251 ? 0.9731 0.9709 1.1994 -0.0563 -0.0747 -0.0027 310 ARG B CZ 5511 N NH1 . ARG B 251 ? 0.9572 0.9574 1.1840 -0.0560 -0.0720 -0.0032 310 ARG B NH1 5512 N NH2 . ARG B 251 ? 0.8967 0.8923 1.1124 -0.0564 -0.0738 -0.0012 310 ARG B NH2 5513 N N . SER B 252 ? 0.6053 0.6192 0.8764 -0.0650 -0.0598 -0.0011 311 SER B N 5514 C CA . SER B 252 ? 0.5378 0.5538 0.8034 -0.0653 -0.0545 0.0002 311 SER B CA 5515 C C . SER B 252 ? 0.5818 0.5954 0.8341 -0.0630 -0.0558 -0.0003 311 SER B C 5516 O O . SER B 252 ? 0.5267 0.5370 0.7710 -0.0621 -0.0583 -0.0001 311 SER B O 5517 C CB . SER B 252 ? 0.5508 0.5682 0.8154 -0.0678 -0.0483 0.0031 311 SER B CB 5518 O OG . SER B 252 ? 0.4435 0.4629 0.7028 -0.0680 -0.0432 0.0043 311 SER B OG 5519 N N . PRO B 253 ? 0.5718 0.5869 0.8216 -0.0620 -0.0541 -0.0008 312 PRO B N 5520 C CA . PRO B 253 ? 0.5335 0.5466 0.7708 -0.0600 -0.0544 -0.0010 312 PRO B CA 5521 C C . PRO B 253 ? 0.6777 0.6907 0.9059 -0.0613 -0.0496 0.0014 312 PRO B C 5522 O O . PRO B 253 ? 0.4672 0.4779 0.6842 -0.0599 -0.0501 0.0015 312 PRO B O 5523 C CB . PRO B 253 ? 0.3517 0.3673 0.5910 -0.0592 -0.0530 -0.0020 312 PRO B CB 5524 C CG . PRO B 253 ? 0.6240 0.6435 0.8748 -0.0615 -0.0495 -0.0011 312 PRO B CG 5525 C CD . PRO B 253 ? 0.5683 0.5871 0.8274 -0.0626 -0.0520 -0.0012 312 PRO B CD 5526 N N . TYR B 254 ? 0.4423 0.4575 0.6753 -0.0638 -0.0450 0.0034 313 TYR B N 5527 C CA . TYR B 254 ? 0.5048 0.5198 0.7299 -0.0650 -0.0403 0.0057 313 TYR B CA 5528 C C . TYR B 254 ? 0.4605 0.4737 0.6859 -0.0662 -0.0411 0.0066 313 TYR B C 5529 O O . TYR B 254 ? 0.4969 0.5108 0.7203 -0.0678 -0.0365 0.0086 313 TYR B O 5530 C CB . TYR B 254 ? 0.3485 0.3673 0.5774 -0.0666 -0.0339 0.0074 313 TYR B CB 5531 C CG . TYR B 254 ? 0.7348 0.7551 0.9602 -0.0655 -0.0321 0.0070 313 TYR B CG 5532 C CD1 . TYR B 254 ? 0.5169 0.5391 0.7498 -0.0649 -0.0336 0.0055 313 TYR B CD1 5533 C CD2 . TYR B 254 ? 0.4993 0.5192 0.7139 -0.0651 -0.0290 0.0080 313 TYR B CD2 5534 C CE1 . TYR B 254 ? 0.5343 0.5579 0.7636 -0.0639 -0.0320 0.0052 313 TYR B CE1 5535 C CE2 . TYR B 254 ? 0.6599 0.6812 0.8713 -0.0641 -0.0274 0.0076 313 TYR B CE2 5536 C CZ . TYR B 254 ? 0.6500 0.6730 0.8686 -0.0635 -0.0288 0.0062 313 TYR B CZ 5537 O OH . TYR B 254 ? 0.5637 0.5880 0.7788 -0.0625 -0.0272 0.0059 313 TYR B OH 5538 N N . ARG B 255 ? 0.5473 0.5582 0.7755 -0.0653 -0.0468 0.0051 314 ARG B N 5539 C CA . ARG B 255 ? 0.4789 0.4875 0.7060 -0.0661 -0.0484 0.0058 314 ARG B CA 5540 C C . ARG B 255 ? 0.4707 0.4770 0.6842 -0.0657 -0.0470 0.0070 314 ARG B C 5541 O O . ARG B 255 ? 0.5799 0.5848 0.7845 -0.0638 -0.0483 0.0064 314 ARG B O 5542 C CB . ARG B 255 ? 0.5344 0.5406 0.7655 -0.0647 -0.0554 0.0038 314 ARG B CB 5543 C CG . ARG B 255 ? 0.6432 0.6470 0.8736 -0.0654 -0.0575 0.0045 314 ARG B CG 5544 C CD . ARG B 255 ? 0.8864 0.8876 1.1203 -0.0637 -0.0647 0.0024 314 ARG B CD 5545 N NE . ARG B 255 ? 0.8716 0.8705 1.1054 -0.0645 -0.0668 0.0031 314 ARG B NE 5546 C CZ . ARG B 255 ? 0.8801 0.8756 1.1031 -0.0635 -0.0688 0.0037 314 ARG B CZ 5547 N NH1 . ARG B 255 ? 0.7302 0.7242 0.9418 -0.0617 -0.0689 0.0037 314 ARG B NH1 5548 N NH2 . ARG B 255 ? 1.0723 1.0659 1.2957 -0.0643 -0.0706 0.0043 314 ARG B NH2 5549 N N . ARG B 256 ? 0.5173 0.5233 0.7293 -0.0674 -0.0442 0.0087 315 ARG B N 5550 C CA . ARG B 256 ? 0.5525 0.5564 0.7518 -0.0671 -0.0427 0.0099 315 ARG B CA 5551 C C . ARG B 256 ? 0.4873 0.4872 0.6813 -0.0656 -0.0487 0.0090 315 ARG B C 5552 O O . ARG B 256 ? 0.4851 0.4840 0.6859 -0.0650 -0.0537 0.0076 315 ARG B O 5553 C CB . ARG B 256 ? 0.4793 0.4843 0.6790 -0.0693 -0.0371 0.0120 315 ARG B CB 5554 C CG . ARG B 256 ? 0.3806 0.3893 0.5846 -0.0704 -0.0311 0.0130 315 ARG B CG 5555 C CD . ARG B 256 ? 0.4401 0.4501 0.6469 -0.0725 -0.0257 0.0149 315 ARG B CD 5556 N NE . ARG B 256 ? 0.4375 0.4501 0.6433 -0.0729 -0.0196 0.0161 315 ARG B NE 5557 C CZ . ARG B 256 ? 0.4400 0.4524 0.6366 -0.0729 -0.0154 0.0174 315 ARG B CZ 5558 N NH1 . ARG B 256 ? 0.5273 0.5369 0.7144 -0.0726 -0.0165 0.0176 315 ARG B NH1 5559 N NH2 . ARG B 256 ? 0.6599 0.6748 0.8567 -0.0731 -0.0102 0.0184 315 ARG B NH2 5560 N N . THR B 257 ? 0.4567 0.4543 0.6388 -0.0650 -0.0485 0.0098 316 THR B N 5561 C CA . THR B 257 ? 0.4684 0.4621 0.6442 -0.0633 -0.0543 0.0091 316 THR B CA 5562 C C . THR B 257 ? 0.5259 0.5179 0.7048 -0.0644 -0.0563 0.0097 316 THR B C 5563 O O . THR B 257 ? 0.5869 0.5763 0.7663 -0.0630 -0.0621 0.0086 316 THR B O 5564 C CB . THR B 257 ? 0.4361 0.4278 0.5975 -0.0621 -0.0534 0.0098 316 THR B CB 5565 O OG1 . THR B 257 ? 0.7051 0.6981 0.8634 -0.0611 -0.0516 0.0093 316 THR B OG1 5566 C CG2 . THR B 257 ? 0.7692 0.7567 0.9239 -0.0600 -0.0596 0.0091 316 THR B CG2 5567 N N . TYR B 258 ? 0.4699 0.4635 0.6510 -0.0667 -0.0514 0.0112 317 TYR B N 5568 C CA . TYR B 258 ? 0.4733 0.4654 0.6566 -0.0680 -0.0525 0.0119 317 TYR B CA 5569 C C . TYR B 258 ? 0.4430 0.4312 0.6145 -0.0666 -0.0560 0.0122 317 TYR B C 5570 O O . TYR B 258 ? 0.5827 0.5684 0.7557 -0.0662 -0.0607 0.0118 317 TYR B O 5571 C CB . TYR B 258 ? 0.3639 0.3562 0.5599 -0.0682 -0.0565 0.0107 317 TYR B CB 5572 C CG . TYR B 258 ? 0.5398 0.5360 0.7482 -0.0699 -0.0528 0.0108 317 TYR B CG 5573 C CD1 . TYR B 258 ? 0.3737 0.3712 0.5897 -0.0723 -0.0495 0.0119 317 TYR B CD1 5574 C CD2 . TYR B 258 ? 0.4731 0.4715 0.6853 -0.0691 -0.0523 0.0098 317 TYR B CD2 5575 C CE1 . TYR B 258 ? 0.4780 0.4790 0.7052 -0.0737 -0.0459 0.0121 317 TYR B CE1 5576 C CE2 . TYR B 258 ? 0.4283 0.4302 0.6516 -0.0706 -0.0488 0.0099 317 TYR B CE2 5577 C CZ . TYR B 258 ? 0.5045 0.5078 0.7353 -0.0729 -0.0457 0.0111 317 TYR B CZ 5578 O OH . TYR B 258 ? 0.5140 0.5207 0.7559 -0.0743 -0.0422 0.0114 317 TYR B OH 5579 N N . SER B 259 ? 0.4215 0.4091 0.5813 -0.0660 -0.0536 0.0129 318 SER B N 5580 C CA . SER B 259 ? 0.5849 0.5690 0.7325 -0.0648 -0.0560 0.0134 318 SER B CA 5581 C C . SER B 259 ? 0.6027 0.5874 0.7406 -0.0656 -0.0503 0.0148 318 SER B C 5582 O O . SER B 259 ? 0.5070 0.4942 0.6447 -0.0659 -0.0459 0.0150 318 SER B O 5583 C CB . SER B 259 ? 0.6294 0.6112 0.7715 -0.0620 -0.0613 0.0121 318 SER B CB 5584 O OG . SER B 259 ? 0.5862 0.5655 0.7149 -0.0608 -0.0617 0.0128 318 SER B OG 5585 N N . LYS B 260 ? 0.5424 0.5248 0.6722 -0.0658 -0.0505 0.0158 319 LYS B N 5586 C CA . LYS B 260 ? 0.4925 0.4752 0.6125 -0.0664 -0.0454 0.0170 319 LYS B CA 5587 C C . LYS B 260 ? 0.4985 0.4796 0.6061 -0.0645 -0.0466 0.0168 319 LYS B C 5588 O O . LYS B 260 ? 0.6872 0.6690 0.7873 -0.0648 -0.0421 0.0175 319 LYS B O 5589 C CB . LYS B 260 ? 0.4582 0.4394 0.5752 -0.0677 -0.0444 0.0181 319 LYS B CB 5590 C CG . LYS B 260 ? 0.6119 0.5895 0.7259 -0.0667 -0.0507 0.0179 319 LYS B CG 5591 C CD . LYS B 260 ? 0.5575 0.5340 0.6709 -0.0683 -0.0494 0.0190 319 LYS B CD 5592 C CE . LYS B 260 ? 0.7114 0.6842 0.8215 -0.0672 -0.0557 0.0189 319 LYS B CE 5593 N NZ . LYS B 260 ? 0.8122 0.7824 0.9093 -0.0651 -0.0588 0.0189 319 LYS B NZ 5594 N N . LYS B 261 ? 0.5953 0.5740 0.7007 -0.0624 -0.0525 0.0159 320 LYS B N 5595 C CA . LYS B 261 ? 0.7534 0.7305 0.8482 -0.0604 -0.0539 0.0156 320 LYS B CA 5596 C C . LYS B 261 ? 0.6907 0.6701 0.7881 -0.0597 -0.0520 0.0147 320 LYS B C 5597 O O . LYS B 261 ? 0.8209 0.8017 0.9129 -0.0600 -0.0475 0.0152 320 LYS B O 5598 C CB . LYS B 261 ? 0.7586 0.7319 0.8496 -0.0581 -0.0609 0.0150 320 LYS B CB 5599 C CG . LYS B 261 ? 0.9943 0.9645 1.0748 -0.0578 -0.0624 0.0161 320 LYS B CG 5600 C CD . LYS B 261 ? 1.0592 1.0297 1.1424 -0.0600 -0.0604 0.0171 320 LYS B CD 5601 C CE . LYS B 261 ? 0.9979 0.9654 1.0694 -0.0595 -0.0619 0.0181 320 LYS B CE 5602 N NZ . LYS B 261 ? 1.0066 0.9740 1.0794 -0.0615 -0.0599 0.0190 320 LYS B NZ 5603 N N . ASN B 262 ? 0.6337 0.6135 0.7395 -0.0588 -0.0554 0.0135 321 ASN B N 5604 C CA . ASN B 262 ? 0.6621 0.6441 0.7712 -0.0582 -0.0537 0.0126 321 ASN B CA 5605 C C . ASN B 262 ? 0.4604 0.4462 0.5804 -0.0604 -0.0494 0.0128 321 ASN B C 5606 O O . ASN B 262 ? 0.6819 0.6686 0.8125 -0.0607 -0.0515 0.0120 321 ASN B O 5607 C CB . ASN B 262 ? 0.7430 0.7232 0.8546 -0.0558 -0.0595 0.0110 321 ASN B CB 5608 C CG . ASN B 262 ? 0.9619 0.9380 1.0636 -0.0535 -0.0644 0.0109 321 ASN B CG 5609 O OD1 . ASN B 262 ? 1.0359 1.0095 1.1386 -0.0529 -0.0689 0.0109 321 ASN B OD1 5610 N ND2 . ASN B 262 ? 0.7655 0.7406 0.8575 -0.0521 -0.0634 0.0110 321 ASN B ND2 5611 N N . GLN B 263 ? 0.3940 0.3821 0.5115 -0.0617 -0.0433 0.0138 322 GLN B N 5612 C CA . GLN B 263 ? 0.4704 0.4619 0.5972 -0.0637 -0.0387 0.0143 322 GLN B CA 5613 C C . GLN B 263 ? 0.5753 0.5696 0.7071 -0.0634 -0.0366 0.0136 322 GLN B C 5614 O O . GLN B 263 ? 0.4684 0.4657 0.6076 -0.0649 -0.0325 0.0142 322 GLN B O 5615 C CB . GLN B 263 ? 0.3667 0.3590 0.4884 -0.0652 -0.0330 0.0158 322 GLN B CB 5616 C CG . GLN B 263 ? 0.5003 0.4901 0.6174 -0.0657 -0.0344 0.0166 322 GLN B CG 5617 C CD . GLN B 263 ? 0.4055 0.3958 0.5160 -0.0668 -0.0289 0.0179 322 GLN B CD 5618 O OE1 . GLN B 263 ? 0.3553 0.3482 0.4671 -0.0674 -0.0236 0.0183 322 GLN B OE1 5619 N NE2 . GLN B 263 ? 0.4550 0.4427 0.5580 -0.0668 -0.0300 0.0184 322 GLN B NE2 5620 N N . VAL B 264 ? 0.5665 0.5598 0.6940 -0.0615 -0.0394 0.0125 323 VAL B N 5621 C CA . VAL B 264 ? 0.3898 0.3855 0.5202 -0.0611 -0.0373 0.0119 323 VAL B CA 5622 C C . VAL B 264 ? 0.5124 0.5076 0.6486 -0.0595 -0.0421 0.0102 323 VAL B C 5623 O O . VAL B 264 ? 0.6983 0.6909 0.8289 -0.0574 -0.0463 0.0092 323 VAL B O 5624 C CB . VAL B 264 ? 0.5507 0.5460 0.6701 -0.0601 -0.0350 0.0121 323 VAL B CB 5625 C CG1 . VAL B 264 ? 0.4126 0.4104 0.5351 -0.0596 -0.0329 0.0115 323 VAL B CG1 5626 C CG2 . VAL B 264 ? 0.3509 0.3469 0.4645 -0.0614 -0.0300 0.0136 323 VAL B CG2 5627 N N . ALA B 265 ? 0.4770 0.4747 0.6248 -0.0604 -0.0416 0.0098 324 ALA B N 5628 C CA . ALA B 265 ? 0.5239 0.5216 0.6781 -0.0590 -0.0456 0.0080 324 ALA B CA 5629 C C . ALA B 265 ? 0.4707 0.4695 0.6212 -0.0578 -0.0440 0.0074 324 ALA B C 5630 O O . ALA B 265 ? 0.5560 0.5564 0.7018 -0.0585 -0.0392 0.0084 324 ALA B O 5631 C CB . ALA B 265 ? 0.3534 0.3537 0.5209 -0.0605 -0.0452 0.0078 324 ALA B CB 5632 N N . GLU B 266 ? 0.3909 0.3887 0.5433 -0.0557 -0.0481 0.0056 325 GLU B N 5633 C CA . GLU B 266 ? 0.4826 0.4811 0.6317 -0.0543 -0.0471 0.0047 325 GLU B CA 5634 C C . GLU B 266 ? 0.5479 0.5505 0.7019 -0.0560 -0.0416 0.0055 325 GLU B C 5635 O O . GLU B 266 ? 0.5526 0.5560 0.7006 -0.0557 -0.0384 0.0059 325 GLU B O 5636 C CB . GLU B 266 ? 0.5613 0.5584 0.7140 -0.0520 -0.0524 0.0025 325 GLU B CB 5637 C CG . GLU B 266 ? 0.6654 0.6630 0.8149 -0.0504 -0.0514 0.0015 325 GLU B CG 5638 C CD . GLU B 266 ? 0.8040 0.7998 0.9561 -0.0478 -0.0567 -0.0008 325 GLU B CD 5639 O OE1 . GLU B 266 ? 0.8523 0.8460 1.0077 -0.0469 -0.0614 -0.0016 325 GLU B OE1 5640 O OE2 . GLU B 266 ? 0.8198 0.8161 0.9704 -0.0464 -0.0562 -0.0018 325 GLU B OE2 5641 N N . TRP B 267 ? 0.4252 0.4302 0.5900 -0.0576 -0.0406 0.0057 326 TRP B N 5642 C CA . TRP B 267 ? 0.3919 0.4007 0.5622 -0.0590 -0.0356 0.0064 326 TRP B CA 5643 C C . TRP B 267 ? 0.5165 0.5266 0.6818 -0.0606 -0.0299 0.0085 326 TRP B C 5644 O O . TRP B 267 ? 0.3808 0.3937 0.5479 -0.0614 -0.0254 0.0093 326 TRP B O 5645 C CB . TRP B 267 ? 0.3579 0.3689 0.5414 -0.0604 -0.0360 0.0063 326 TRP B CB 5646 C CG . TRP B 267 ? 0.5500 0.5605 0.7374 -0.0620 -0.0362 0.0073 326 TRP B CG 5647 C CD1 . TRP B 267 ? 0.5211 0.5292 0.7108 -0.0616 -0.0411 0.0064 326 TRP B CD1 5648 C CD2 . TRP B 267 ? 0.4193 0.4316 0.6089 -0.0642 -0.0311 0.0093 326 TRP B CD2 5649 N NE1 . TRP B 267 ? 0.4765 0.4848 0.6696 -0.0635 -0.0394 0.0078 326 TRP B NE1 5650 C CE2 . TRP B 267 ? 0.4457 0.4566 0.6388 -0.0651 -0.0332 0.0095 326 TRP B CE2 5651 C CE3 . TRP B 267 ? 0.4255 0.4404 0.6144 -0.0654 -0.0250 0.0109 326 TRP B CE3 5652 C CZ2 . TRP B 267 ? 0.3494 0.3613 0.5451 -0.0672 -0.0292 0.0113 326 TRP B CZ2 5653 C CZ3 . TRP B 267 ? 0.4073 0.4231 0.5988 -0.0672 -0.0211 0.0126 326 TRP B CZ3 5654 C CH2 . TRP B 267 ? 0.3940 0.4083 0.5888 -0.0681 -0.0231 0.0128 326 TRP B CH2 5655 N N . GLN B 268 ? 0.4518 0.4597 0.6105 -0.0609 -0.0301 0.0093 327 GLN B N 5656 C CA . GLN B 268 ? 0.5711 0.5798 0.7243 -0.0621 -0.0250 0.0111 327 GLN B CA 5657 C C . GLN B 268 ? 0.6529 0.6607 0.7946 -0.0609 -0.0236 0.0111 327 GLN B C 5658 O O . GLN B 268 ? 0.4489 0.4580 0.5865 -0.0616 -0.0188 0.0123 327 GLN B O 5659 C CB . GLN B 268 ? 0.3558 0.3627 0.5073 -0.0631 -0.0256 0.0120 327 GLN B CB 5660 C CG . GLN B 268 ? 0.3582 0.3668 0.5205 -0.0649 -0.0243 0.0127 327 GLN B CG 5661 C CD . GLN B 268 ? 0.4181 0.4244 0.5793 -0.0656 -0.0261 0.0132 327 GLN B CD 5662 O OE1 . GLN B 268 ? 0.3570 0.3603 0.5144 -0.0644 -0.0311 0.0123 327 GLN B OE1 5663 N NE2 . GLN B 268 ? 0.3689 0.3764 0.5333 -0.0674 -0.0221 0.0147 327 GLN B NE2 5664 N N . SER B 269 ? 0.6865 0.6921 0.8234 -0.0589 -0.0277 0.0097 328 SER B N 5665 C CA . SER B 269 ? 0.6722 0.6766 0.7983 -0.0577 -0.0267 0.0096 328 SER B CA 5666 C C . SER B 269 ? 0.7297 0.7351 0.8561 -0.0563 -0.0267 0.0085 328 SER B C 5667 O O . SER B 269 ? 0.9592 0.9649 1.0788 -0.0559 -0.0240 0.0087 328 SER B O 5668 C CB . SER B 269 ? 0.4361 0.4366 0.5541 -0.0562 -0.0309 0.0091 328 SER B CB 5669 O OG . SER B 269 ? 0.6861 0.6848 0.8083 -0.0548 -0.0365 0.0077 328 SER B OG 5670 N N . SER B 270 ? 0.7167 0.7225 0.8508 -0.0557 -0.0298 0.0072 329 SER B N 5671 C CA . SER B 270 ? 0.5580 0.5645 0.6925 -0.0543 -0.0301 0.0060 329 SER B CA 5672 C C . SER B 270 ? 0.6444 0.6548 0.7878 -0.0556 -0.0268 0.0063 329 SER B C 5673 O O . SER B 270 ? 0.8390 0.8507 0.9920 -0.0565 -0.0278 0.0062 329 SER B O 5674 C CB . SER B 270 ? 0.5196 0.5236 0.6556 -0.0522 -0.0361 0.0040 329 SER B CB 5675 O OG . SER B 270 ? 0.8762 0.8807 1.0222 -0.0528 -0.0386 0.0035 329 SER B OG 5676 N N . MSE B 271 ? 0.6422 0.6544 0.7822 -0.0557 -0.0227 0.0069 330 MSE B N 5677 C CA . MSE B 271 ? 0.7158 0.7317 0.8630 -0.0569 -0.0190 0.0076 330 MSE B CA 5678 C C . MSE B 271 ? 0.8001 0.8171 0.9551 -0.0561 -0.0215 0.0061 330 MSE B C 5679 O O . MSE B 271 ? 1.0547 1.0746 1.2184 -0.0573 -0.0196 0.0066 330 MSE B O 5680 C CB . MSE B 271 ? 0.8633 0.8806 1.0041 -0.0569 -0.0144 0.0084 330 MSE B CB 5681 C CG . MSE B 271 ? 1.0120 1.0272 1.1438 -0.0549 -0.0161 0.0072 330 MSE B CG 5682 SE SE . MSE B 271 ? 1.6521 1.6689 1.7755 -0.0550 -0.0103 0.0083 330 MSE B SE 5683 C CE . MSE B 271 ? 0.9302 0.9507 1.0621 -0.0551 -0.0083 0.0081 330 MSE B CE 5684 N N . ASN B 272 ? 0.6004 0.6151 0.7520 -0.0540 -0.0256 0.0042 331 ASN B N 5685 C CA . ASN B 272 ? 0.6034 0.6188 0.7611 -0.0529 -0.0281 0.0025 331 ASN B CA 5686 C C . ASN B 272 ? 0.6353 0.6495 0.8004 -0.0525 -0.0330 0.0012 331 ASN B C 5687 O O . ASN B 272 ? 0.6698 0.6836 0.8385 -0.0510 -0.0362 -0.0007 331 ASN B O 5688 C CB . ASN B 272 ? 0.7314 0.7449 0.8816 -0.0505 -0.0296 0.0011 331 ASN B CB 5689 C CG . ASN B 272 ? 0.8772 0.8918 1.0200 -0.0508 -0.0251 0.0022 331 ASN B CG 5690 O OD1 . ASN B 272 ? 0.7691 0.7867 0.9151 -0.0518 -0.0213 0.0030 331 ASN B OD1 5691 N ND2 . ASN B 272 ? 0.9675 0.9795 1.1004 -0.0498 -0.0254 0.0022 331 ASN B ND2 5692 N N . TYR B 273 ? 0.6414 0.6549 0.8085 -0.0538 -0.0335 0.0022 332 TYR B N 5693 C CA . TYR B 273 ? 0.7794 0.7916 0.9533 -0.0536 -0.0382 0.0011 332 TYR B CA 5694 C C . TYR B 273 ? 0.6955 0.7102 0.8809 -0.0538 -0.0390 0.0001 332 TYR B C 5695 O O . TYR B 273 ? 0.5574 0.5707 0.7466 -0.0523 -0.0438 -0.0019 332 TYR B O 5696 C CB . TYR B 273 ? 0.6132 0.6251 0.7884 -0.0554 -0.0373 0.0027 332 TYR B CB 5697 C CG . TYR B 273 ? 0.4530 0.4634 0.6350 -0.0553 -0.0421 0.0017 332 TYR B CG 5698 C CD1 . TYR B 273 ? 0.4217 0.4283 0.5986 -0.0534 -0.0471 0.0006 332 TYR B CD1 5699 C CD2 . TYR B 273 ? 0.4767 0.4895 0.6702 -0.0569 -0.0416 0.0019 332 TYR B CD2 5700 C CE1 . TYR B 273 ? 0.4484 0.4536 0.6314 -0.0531 -0.0517 -0.0004 332 TYR B CE1 5701 C CE2 . TYR B 273 ? 0.4652 0.4767 0.6652 -0.0568 -0.0461 0.0009 332 TYR B CE2 5702 C CZ . TYR B 273 ? 0.4266 0.4341 0.6212 -0.0549 -0.0511 -0.0003 332 TYR B CZ 5703 O OH . TYR B 273 ? 0.4094 0.4156 0.6105 -0.0546 -0.0557 -0.0013 332 TYR B OH 5704 N N . CYS B 274 ? 0.6070 0.6253 0.7979 -0.0557 -0.0345 0.0014 333 CYS B N 5705 C CA . CYS B 274 ? 0.6683 0.6893 0.8703 -0.0562 -0.0347 0.0007 333 CYS B CA 5706 C C . CYS B 274 ? 0.8200 0.8410 1.0214 -0.0541 -0.0369 -0.0014 333 CYS B C 5707 O O . CYS B 274 ? 0.7505 0.7715 0.9589 -0.0532 -0.0406 -0.0033 333 CYS B O 5708 C CB . CYS B 274 ? 0.7116 0.7364 0.9183 -0.0584 -0.0290 0.0028 333 CYS B CB 5709 S SG . CYS B 274 ? 0.6201 0.6485 0.8414 -0.0594 -0.0288 0.0024 333 CYS B SG 5710 N N . THR B 275 ? 0.8363 0.8571 1.0292 -0.0532 -0.0347 -0.0012 334 THR B N 5711 C CA . THR B 275 ? 0.6500 0.6706 0.8409 -0.0511 -0.0362 -0.0031 334 THR B CA 5712 C C . THR B 275 ? 0.6152 0.6320 0.8038 -0.0485 -0.0422 -0.0055 334 THR B C 5713 O O . THR B 275 ? 0.6755 0.6923 0.8687 -0.0470 -0.0451 -0.0076 334 THR B O 5714 C CB . THR B 275 ? 0.6181 0.6387 0.7992 -0.0506 -0.0327 -0.0023 334 THR B CB 5715 O OG1 . THR B 275 ? 0.7400 0.7643 0.9241 -0.0525 -0.0274 -0.0004 334 THR B OG1 5716 C CG2 . THR B 275 ? 0.6027 0.6222 0.7803 -0.0481 -0.0348 -0.0044 334 THR B CG2 5717 N N . ASP B 276 ? 0.5306 0.5442 0.7119 -0.0478 -0.0439 -0.0052 335 ASP B N 5718 C CA . ASP B 276 ? 0.4762 0.4858 0.6535 -0.0450 -0.0493 -0.0073 335 ASP B CA 5719 C C . ASP B 276 ? 0.6283 0.6366 0.8128 -0.0447 -0.0541 -0.0084 335 ASP B C 5720 O O . ASP B 276 ? 0.8130 0.8191 0.9983 -0.0421 -0.0588 -0.0106 335 ASP B O 5721 C CB . ASP B 276 ? 0.4667 0.4732 0.6321 -0.0441 -0.0491 -0.0064 335 ASP B CB 5722 C CG . ASP B 276 ? 0.6736 0.6812 0.8316 -0.0443 -0.0446 -0.0055 335 ASP B CG 5723 O OD1 . ASP B 276 ? 0.8385 0.8480 0.9984 -0.0438 -0.0432 -0.0063 335 ASP B OD1 5724 O OD2 . ASP B 276 ? 0.8054 0.8120 0.9557 -0.0449 -0.0425 -0.0040 335 ASP B OD2 5725 N N . LYS B 277 ? 0.6923 0.7019 0.8819 -0.0471 -0.0529 -0.0068 336 LYS B N 5726 C CA . LYS B 277 ? 0.6337 0.6414 0.8286 -0.0468 -0.0575 -0.0076 336 LYS B CA 5727 C C . LYS B 277 ? 0.5946 0.6052 0.8028 -0.0485 -0.0577 -0.0079 336 LYS B C 5728 O O . LYS B 277 ? 0.6077 0.6169 0.8214 -0.0478 -0.0622 -0.0092 336 LYS B O 5729 C CB . LYS B 277 ? 0.6653 0.6712 0.8546 -0.0479 -0.0571 -0.0058 336 LYS B CB 5730 C CG . LYS B 277 ? 0.7111 0.7137 0.8875 -0.0461 -0.0576 -0.0056 336 LYS B CG 5731 C CD . LYS B 277 ? 0.7429 0.7416 0.9166 -0.0428 -0.0636 -0.0078 336 LYS B CD 5732 C CE . LYS B 277 ? 0.7630 0.7584 0.9240 -0.0408 -0.0640 -0.0076 336 LYS B CE 5733 N NZ . LYS B 277 ? 0.6848 0.6787 0.8398 -0.0420 -0.0633 -0.0057 336 LYS B NZ 5734 N N . VAL B 278 ? 0.3495 0.3640 0.5629 -0.0507 -0.0530 -0.0067 337 VAL B N 5735 C CA . VAL B 278 ? 0.5854 0.6027 0.8117 -0.0524 -0.0530 -0.0068 337 VAL B CA 5736 C C . VAL B 278 ? 0.6462 0.6663 0.8785 -0.0518 -0.0524 -0.0081 337 VAL B C 5737 O O . VAL B 278 ? 0.6696 0.6902 0.9108 -0.0513 -0.0556 -0.0099 337 VAL B O 5738 C CB . VAL B 278 ? 0.6402 0.6598 0.8700 -0.0556 -0.0481 -0.0040 337 VAL B CB 5739 C CG1 . VAL B 278 ? 0.4733 0.4905 0.6938 -0.0559 -0.0473 -0.0024 337 VAL B CG1 5740 C CG2 . VAL B 278 ? 0.5409 0.5644 0.7724 -0.0570 -0.0424 -0.0024 337 VAL B CG2 5741 N N . LYS B 279 ? 0.4919 0.5136 0.7193 -0.0519 -0.0484 -0.0073 338 LYS B N 5742 C CA . LYS B 279 ? 0.5329 0.5572 0.7649 -0.0513 -0.0477 -0.0085 338 LYS B CA 5743 C C . LYS B 279 ? 0.6664 0.6883 0.8973 -0.0481 -0.0530 -0.0117 338 LYS B C 5744 O O . LYS B 279 ? 0.7044 0.7280 0.9414 -0.0474 -0.0540 -0.0133 338 LYS B O 5745 C CB . LYS B 279 ? 0.5607 0.5868 0.7862 -0.0517 -0.0426 -0.0070 338 LYS B CB 5746 C CG . LYS B 279 ? 0.5566 0.5863 0.7868 -0.0545 -0.0371 -0.0042 338 LYS B CG 5747 C CD . LYS B 279 ? 0.3407 0.3718 0.5638 -0.0546 -0.0324 -0.0028 338 LYS B CD 5748 C CE . LYS B 279 ? 0.4337 0.4684 0.6621 -0.0570 -0.0270 -0.0003 338 LYS B CE 5749 N NZ . LYS B 279 ? 0.4447 0.4806 0.6659 -0.0570 -0.0225 0.0012 338 LYS B NZ 5750 N N . THR B 280 ? 0.5579 0.5757 0.7808 -0.0461 -0.0563 -0.0125 339 THR B N 5751 C CA . THR B 280 ? 0.5320 0.5470 0.7526 -0.0427 -0.0613 -0.0155 339 THR B CA 5752 C C . THR B 280 ? 0.6017 0.6151 0.8299 -0.0418 -0.0668 -0.0173 339 THR B C 5753 O O . THR B 280 ? 0.8601 0.8713 1.0882 -0.0389 -0.0713 -0.0200 339 THR B O 5754 C CB . THR B 280 ? 0.6572 0.6683 0.8649 -0.0406 -0.0622 -0.0155 339 THR B CB 5755 O OG1 . THR B 280 ? 0.6604 0.6694 0.8648 -0.0414 -0.0631 -0.0141 339 THR B OG1 5756 C CG2 . THR B 280 ? 0.4106 0.4231 0.6109 -0.0412 -0.0571 -0.0141 339 THR B CG2 5757 N N . LYS B 281 ? 0.6407 0.6554 0.8755 -0.0443 -0.0662 -0.0159 340 LYS B N 5758 C CA . LYS B 281 ? 0.7225 0.7360 0.9655 -0.0438 -0.0712 -0.0175 340 LYS B CA 5759 C C . LYS B 281 ? 0.8505 0.8671 1.1050 -0.0440 -0.0719 -0.0192 340 LYS B C 5760 O O . LYS B 281 ? 0.7674 0.7877 1.0257 -0.0458 -0.0675 -0.0181 340 LYS B O 5761 C CB . LYS B 281 ? 0.7886 0.8022 1.0345 -0.0464 -0.0702 -0.0154 340 LYS B CB 5762 C CG . LYS B 281 ? 0.8254 0.8355 1.0607 -0.0458 -0.0709 -0.0141 340 LYS B CG 5763 C CD . LYS B 281 ? 0.9381 0.9437 1.1688 -0.0423 -0.0772 -0.0165 340 LYS B CD 5764 C CE . LYS B 281 ? 1.0222 1.0266 1.2613 -0.0421 -0.0820 -0.0177 340 LYS B CE 5765 N NZ . LYS B 281 ? 1.0382 1.0379 1.2721 -0.0384 -0.0881 -0.0197 340 LYS B NZ 5766 N N . ARG B 282 ? 0.9062 0.9210 1.1661 -0.0419 -0.0774 -0.0220 341 ARG B N 5767 C CA . ARG B 282 ? 0.8016 0.8191 1.0726 -0.0418 -0.0789 -0.0240 341 ARG B CA 5768 C C . ARG B 282 ? 0.7503 0.7721 1.0324 -0.0454 -0.0753 -0.0223 341 ARG B C 5769 O O . ARG B 282 ? 0.7220 0.7472 1.0095 -0.0463 -0.0727 -0.0223 341 ARG B O 5770 C CB . ARG B 282 ? 0.9217 0.9362 1.1969 -0.0390 -0.0858 -0.0271 341 ARG B CB 5771 C CG . ARG B 282 ? 1.1947 1.2056 1.4660 -0.0386 -0.0889 -0.0265 341 ARG B CG 5772 C CD . ARG B 282 ? 1.3376 1.3449 1.6104 -0.0350 -0.0960 -0.0298 341 ARG B CD 5773 N NE . ARG B 282 ? 1.5045 1.5079 1.7723 -0.0342 -0.0991 -0.0291 341 ARG B NE 5774 C CZ . ARG B 282 ? 1.5172 1.5202 1.7920 -0.0355 -0.1015 -0.0289 341 ARG B CZ 5775 N NH1 . ARG B 282 ? 1.6135 1.6199 1.9011 -0.0376 -0.1011 -0.0293 341 ARG B NH1 5776 N NH2 . ARG B 282 ? 1.3197 1.3191 1.5888 -0.0346 -0.1044 -0.0282 341 ARG B NH2 5777 N N . GLN B 283 ? 0.8692 0.8906 1.1543 -0.0475 -0.0751 -0.0206 342 GLN B N 5778 C CA . GLN B 283 ? 0.7473 0.7724 1.0432 -0.0508 -0.0719 -0.0189 342 GLN B CA 5779 C C . GLN B 283 ? 0.6405 0.6689 0.9349 -0.0533 -0.0649 -0.0160 342 GLN B C 5780 O O . GLN B 283 ? 0.5303 0.5623 0.8342 -0.0556 -0.0620 -0.0149 342 GLN B O 5781 C CB . GLN B 283 ? 0.8975 0.9209 1.1958 -0.0523 -0.0732 -0.0177 342 GLN B CB 5782 C CG . GLN B 283 ? 1.1241 1.1443 1.4249 -0.0500 -0.0802 -0.0204 342 GLN B CG 5783 C CD . GLN B 283 ? 1.1584 1.1740 1.4468 -0.0476 -0.0832 -0.0207 342 GLN B CD 5784 O OE1 . GLN B 283 ? 1.0962 1.1109 1.3741 -0.0466 -0.0810 -0.0200 342 GLN B OE1 5785 N NE2 . GLN B 283 ? 1.1745 1.1869 1.4641 -0.0464 -0.0883 -0.0218 342 GLN B NE2 5786 N N . TYR B 284 ? 0.5359 0.5633 0.8186 -0.0527 -0.0623 -0.0147 343 TYR B N 5787 C CA . TYR B 284 ? 0.5512 0.5814 0.8314 -0.0549 -0.0558 -0.0118 343 TYR B CA 5788 C C . TYR B 284 ? 0.5512 0.5830 0.8274 -0.0538 -0.0535 -0.0123 343 TYR B C 5789 O O . TYR B 284 ? 0.6090 0.6434 0.8843 -0.0554 -0.0483 -0.0100 343 TYR B O 5790 C CB . TYR B 284 ? 0.6779 0.7059 0.9480 -0.0556 -0.0535 -0.0096 343 TYR B CB 5791 C CG . TYR B 284 ? 0.6672 0.6944 0.9412 -0.0574 -0.0538 -0.0083 343 TYR B CG 5792 C CD1 . TYR B 284 ? 0.6440 0.6677 0.9165 -0.0561 -0.0590 -0.0096 343 TYR B CD1 5793 C CD2 . TYR B 284 ? 0.5264 0.5563 0.8053 -0.0603 -0.0489 -0.0057 343 TYR B CD2 5794 C CE1 . TYR B 284 ? 0.6187 0.6416 0.8945 -0.0578 -0.0594 -0.0085 343 TYR B CE1 5795 C CE2 . TYR B 284 ? 0.6857 0.7147 0.9680 -0.0619 -0.0491 -0.0045 343 TYR B CE2 5796 C CZ . TYR B 284 ? 0.6698 0.6954 0.9505 -0.0607 -0.0543 -0.0059 343 TYR B CZ 5797 O OH . TYR B 284 ? 0.7094 0.7341 0.9932 -0.0624 -0.0545 -0.0048 343 TYR B OH 5798 N N . ALA B 285 ? 0.6255 0.6556 0.8992 -0.0509 -0.0575 -0.0151 344 ALA B N 5799 C CA . ALA B 285 ? 0.6907 0.7219 0.9595 -0.0496 -0.0557 -0.0157 344 ALA B CA 5800 C C . ALA B 285 ? 0.6994 0.7350 0.9775 -0.0509 -0.0531 -0.0155 344 ALA B C 5801 O O . ALA B 285 ? 0.5252 0.5628 0.7998 -0.0511 -0.0494 -0.0145 344 ALA B O 5802 C CB . ALA B 285 ? 0.6227 0.6507 0.8868 -0.0460 -0.0608 -0.0190 344 ALA B CB 5803 N N . HIS B 286 ? 0.6186 0.6557 0.9086 -0.0518 -0.0550 -0.0164 345 HIS B N 5804 C CA . HIS B 286 ? 0.4562 0.4975 0.7560 -0.0530 -0.0529 -0.0163 345 HIS B CA 5805 C C . HIS B 286 ? 0.5808 0.6242 0.8928 -0.0556 -0.0523 -0.0152 345 HIS B C 5806 O O . HIS B 286 ? 0.5310 0.5726 0.8477 -0.0553 -0.0564 -0.0165 345 HIS B O 5807 C CB . HIS B 286 ? 0.5374 0.5787 0.8399 -0.0505 -0.0568 -0.0198 345 HIS B CB 5808 C CG . HIS B 286 ? 0.6739 0.7135 0.9652 -0.0480 -0.0569 -0.0209 345 HIS B CG 5809 N ND1 . HIS B 286 ? 0.6568 0.6989 0.9449 -0.0482 -0.0529 -0.0198 345 HIS B ND1 5810 C CD2 . HIS B 286 ? 0.6302 0.6658 0.9127 -0.0451 -0.0606 -0.0229 345 HIS B CD2 5811 C CE1 . HIS B 286 ? 0.7692 0.8088 1.0470 -0.0457 -0.0540 -0.0212 345 HIS B CE1 5812 N NE2 . HIS B 286 ? 0.7968 0.8324 1.0711 -0.0437 -0.0586 -0.0231 345 HIS B NE2 5813 N N . GLY B 287 ? 0.3577 0.4047 0.6748 -0.0579 -0.0472 -0.0127 346 GLY B N 5814 C CA . GLY B 287 ? 0.6079 0.6571 0.9371 -0.0603 -0.0461 -0.0115 346 GLY B CA 5815 C C . GLY B 287 ? 0.6331 0.6838 0.9617 -0.0629 -0.0401 -0.0077 346 GLY B C 5816 O O . GLY B 287 ? 0.4762 0.5279 0.7979 -0.0631 -0.0359 -0.0057 346 GLY B O 5817 N N . ARG B 288 ? 0.4842 0.5350 0.8201 -0.0648 -0.0399 -0.0066 347 ARG B N 5818 C CA . ARG B 288 ? 0.6355 0.6876 0.9720 -0.0672 -0.0343 -0.0030 347 ARG B CA 5819 C C . ARG B 288 ? 0.7280 0.7769 1.0585 -0.0676 -0.0348 -0.0021 347 ARG B C 5820 O O . ARG B 288 ? 0.7581 0.8073 1.0867 -0.0692 -0.0303 0.0007 347 ARG B O 5821 C CB . ARG B 288 ? 0.5310 0.5863 0.8818 -0.0692 -0.0325 -0.0021 347 ARG B CB 5822 C CG . ARG B 288 ? 0.5089 0.5631 0.8688 -0.0696 -0.0371 -0.0040 347 ARG B CG 5823 C CD . ARG B 288 ? 0.3434 0.4006 0.7171 -0.0719 -0.0345 -0.0026 347 ARG B CD 5824 N NE . ARG B 288 ? 0.5051 0.5626 0.8779 -0.0739 -0.0290 0.0009 347 ARG B NE 5825 C CZ . ARG B 288 ? 0.6325 0.6931 1.0111 -0.0755 -0.0237 0.0035 347 ARG B CZ 5826 N NH1 . ARG B 288 ? 0.4846 0.5484 0.8706 -0.0754 -0.0231 0.0030 347 ARG B NH1 5827 N NH2 . ARG B 288 ? 0.5499 0.6103 0.9270 -0.0770 -0.0189 0.0065 347 ARG B NH2 5828 N N . ARG B 289 ? 0.5388 0.5845 0.8662 -0.0660 -0.0404 -0.0046 348 ARG B N 5829 C CA . ARG B 289 ? 0.5037 0.5460 0.8258 -0.0663 -0.0419 -0.0040 348 ARG B CA 5830 C C . ARG B 289 ? 0.4858 0.5271 0.7961 -0.0666 -0.0377 -0.0016 348 ARG B C 5831 O O . ARG B 289 ? 0.5121 0.5527 0.8215 -0.0682 -0.0353 0.0005 348 ARG B O 5832 C CB . ARG B 289 ? 0.3874 0.4263 0.7061 -0.0638 -0.0486 -0.0071 348 ARG B CB 5833 C CG . ARG B 289 ? 0.6572 0.6930 0.9748 -0.0642 -0.0514 -0.0071 348 ARG B CG 5834 C CD . ARG B 289 ? 0.7226 0.7547 1.0353 -0.0614 -0.0580 -0.0099 348 ARG B CD 5835 N NE . ARG B 289 ? 0.8449 0.8774 1.1679 -0.0604 -0.0628 -0.0128 348 ARG B NE 5836 C CZ . ARG B 289 ? 1.1077 1.1389 1.4376 -0.0607 -0.0666 -0.0138 348 ARG B CZ 5837 N NH1 . ARG B 289 ? 1.3130 1.3424 1.6406 -0.0620 -0.0661 -0.0121 348 ARG B NH1 5838 N NH2 . ARG B 289 ? 1.1030 1.1347 1.4422 -0.0596 -0.0710 -0.0166 348 ARG B NH2 5839 N N . LEU B 290 ? 0.5738 0.6148 0.8749 -0.0650 -0.0369 -0.0019 349 LEU B N 5840 C CA . LEU B 290 ? 0.4744 0.5144 0.7640 -0.0651 -0.0332 0.0002 349 LEU B CA 5841 C C . LEU B 290 ? 0.6224 0.6653 0.9146 -0.0672 -0.0266 0.0032 349 LEU B C 5842 O O . LEU B 290 ? 0.8136 0.8557 1.1001 -0.0681 -0.0234 0.0053 349 LEU B O 5843 C CB . LEU B 290 ? 0.5595 0.5986 0.8394 -0.0629 -0.0340 -0.0011 349 LEU B CB 5844 C CG . LEU B 290 ? 0.5627 0.6000 0.8297 -0.0626 -0.0314 0.0004 349 LEU B CG 5845 C CD1 . LEU B 290 ? 0.6375 0.6715 0.9000 -0.0627 -0.0337 0.0005 349 LEU B CD1 5846 C CD2 . LEU B 290 ? 0.6096 0.6458 0.8678 -0.0603 -0.0327 -0.0010 349 LEU B CD2 5847 N N . LEU B 291 ? 0.6395 0.6858 0.9400 -0.0678 -0.0247 0.0035 350 LEU B N 5848 C CA . LEU B 291 ? 0.4936 0.5427 0.7978 -0.0695 -0.0185 0.0065 350 LEU B CA 5849 C C . LEU B 291 ? 0.6366 0.6856 0.9474 -0.0715 -0.0171 0.0080 350 LEU B C 5850 O O . LEU B 291 ? 0.5722 0.6220 0.8817 -0.0727 -0.0120 0.0107 350 LEU B O 5851 C CB . LEU B 291 ? 0.3967 0.4494 0.7093 -0.0696 -0.0173 0.0063 350 LEU B CB 5852 C CG . LEU B 291 ? 0.5991 0.6528 0.9051 -0.0681 -0.0164 0.0059 350 LEU B CG 5853 C CD1 . LEU B 291 ? 0.4163 0.4734 0.7317 -0.0681 -0.0163 0.0053 350 LEU B CD1 5854 C CD2 . LEU B 291 ? 0.3702 0.4244 0.6680 -0.0684 -0.0109 0.0086 350 LEU B CD2 5855 N N . ASP B 292 ? 0.5623 0.6103 0.8801 -0.0717 -0.0215 0.0062 351 ASP B N 5856 C CA . ASP B 292 ? 0.5092 0.5566 0.8331 -0.0735 -0.0209 0.0074 351 ASP B CA 5857 C C . ASP B 292 ? 0.5560 0.6003 0.8693 -0.0735 -0.0200 0.0085 351 ASP B C 5858 O O . ASP B 292 ? 0.5300 0.5745 0.8439 -0.0750 -0.0160 0.0108 351 ASP B O 5859 C CB . ASP B 292 ? 0.3439 0.3905 0.6768 -0.0734 -0.0265 0.0049 351 ASP B CB 5860 C CG . ASP B 292 ? 0.5274 0.5773 0.8724 -0.0737 -0.0270 0.0039 351 ASP B CG 5861 O OD1 . ASP B 292 ? 0.3914 0.4442 0.7396 -0.0745 -0.0222 0.0058 351 ASP B OD1 5862 O OD2 . ASP B 292 ? 0.6208 0.6702 0.9722 -0.0730 -0.0321 0.0013 351 ASP B OD2 5863 N N . LEU B 293 ? 0.4842 0.5257 0.7878 -0.0718 -0.0238 0.0069 352 LEU B N 5864 C CA . LEU B 293 ? 0.4400 0.4786 0.7328 -0.0716 -0.0236 0.0077 352 LEU B CA 5865 C C . LEU B 293 ? 0.4908 0.5302 0.7765 -0.0722 -0.0173 0.0103 352 LEU B C 5866 O O . LEU B 293 ? 0.5214 0.5594 0.8028 -0.0730 -0.0151 0.0119 352 LEU B O 5867 C CB . LEU B 293 ? 0.4032 0.4389 0.6868 -0.0693 -0.0285 0.0054 352 LEU B CB 5868 C CG . LEU B 293 ? 0.4323 0.4644 0.7046 -0.0688 -0.0294 0.0058 352 LEU B CG 5869 C CD1 . LEU B 293 ? 0.5145 0.5435 0.7857 -0.0673 -0.0362 0.0034 352 LEU B CD1 5870 C CD2 . LEU B 293 ? 0.4202 0.4519 0.6807 -0.0678 -0.0268 0.0065 352 LEU B CD2 5871 N N . VAL B 294 ? 0.3652 0.4069 0.6498 -0.0716 -0.0146 0.0108 353 VAL B N 5872 C CA . VAL B 294 ? 0.5168 0.5596 0.7955 -0.0720 -0.0086 0.0132 353 VAL B CA 5873 C C . VAL B 294 ? 0.5021 0.5469 0.7890 -0.0739 -0.0039 0.0156 353 VAL B C 5874 O O . VAL B 294 ? 0.5432 0.5873 0.8253 -0.0745 0.0001 0.0176 353 VAL B O 5875 C CB . VAL B 294 ? 0.4594 0.5042 0.7354 -0.0709 -0.0070 0.0131 353 VAL B CB 5876 C CG1 . VAL B 294 ? 0.4260 0.4722 0.6977 -0.0714 -0.0007 0.0158 353 VAL B CG1 5877 C CG2 . VAL B 294 ? 0.3379 0.3805 0.6043 -0.0690 -0.0109 0.0110 353 VAL B CG2 5878 N N . ASP B 295 ? 0.4765 0.5234 0.7756 -0.0747 -0.0045 0.0154 354 ASP B N 5879 C CA . ASP B 295 ? 0.5071 0.5558 0.8152 -0.0764 -0.0001 0.0175 354 ASP B CA 5880 C C . ASP B 295 ? 0.5826 0.6291 0.8907 -0.0775 0.0000 0.0183 354 ASP B C 5881 O O . ASP B 295 ? 0.4499 0.4966 0.7575 -0.0784 0.0049 0.0206 354 ASP B O 5882 C CB . ASP B 295 ? 0.4775 0.5288 0.7992 -0.0770 -0.0016 0.0167 354 ASP B CB 5883 C CG . ASP B 295 ? 0.6344 0.6890 0.9590 -0.0767 0.0018 0.0178 354 ASP B CG 5884 O OD1 . ASP B 295 ? 0.5572 0.6122 0.8740 -0.0762 0.0058 0.0195 354 ASP B OD1 5885 O OD2 . ASP B 295 ? 0.6764 0.7332 1.0110 -0.0770 0.0004 0.0169 354 ASP B OD2 5886 N N . ILE B 296 ? 0.3421 0.3863 0.6505 -0.0774 -0.0055 0.0162 355 ILE B N 5887 C CA . ILE B 296 ? 0.5056 0.5476 0.8146 -0.0784 -0.0061 0.0166 355 ILE B CA 5888 C C . ILE B 296 ? 0.5514 0.5910 0.8472 -0.0780 -0.0042 0.0177 355 ILE B C 5889 O O . ILE B 296 ? 0.4307 0.4690 0.7258 -0.0790 -0.0018 0.0191 355 ILE B O 5890 C CB . ILE B 296 ? 0.3453 0.3855 0.6584 -0.0782 -0.0129 0.0140 355 ILE B CB 5891 C CG1 . ILE B 296 ? 0.5012 0.5397 0.8180 -0.0796 -0.0132 0.0146 355 ILE B CG1 5892 C CG2 . ILE B 296 ? 0.4002 0.4379 0.7026 -0.0762 -0.0175 0.0121 355 ILE B CG2 5893 C CD1 . ILE B 296 ? 0.4479 0.4848 0.7702 -0.0794 -0.0198 0.0122 355 ILE B CD1 5894 N N . HIS B 297 ? 0.4494 0.4881 0.7348 -0.0764 -0.0051 0.0170 356 HIS B N 5895 C CA . HIS B 297 ? 0.4165 0.4531 0.6892 -0.0759 -0.0032 0.0179 356 HIS B CA 5896 C C . HIS B 297 ? 0.4580 0.4963 0.7285 -0.0763 0.0036 0.0204 356 HIS B C 5897 O O . HIS B 297 ? 0.4743 0.5111 0.7370 -0.0764 0.0064 0.0216 356 HIS B O 5898 C CB . HIS B 297 ? 0.3423 0.3774 0.6049 -0.0741 -0.0066 0.0162 356 HIS B CB 5899 C CG . HIS B 297 ? 0.4237 0.4556 0.6827 -0.0734 -0.0125 0.0143 356 HIS B CG 5900 N ND1 . HIS B 297 ? 0.4350 0.4640 0.6833 -0.0729 -0.0131 0.0145 356 HIS B ND1 5901 C CD2 . HIS B 297 ? 0.3451 0.3761 0.6097 -0.0729 -0.0182 0.0122 356 HIS B CD2 5902 C CE1 . HIS B 297 ? 0.5773 0.6038 0.8247 -0.0722 -0.0188 0.0127 356 HIS B CE1 5903 N NE2 . HIS B 297 ? 0.4864 0.5140 0.7436 -0.0721 -0.0220 0.0113 356 HIS B NE2 5904 N N . ILE B 298 ? 0.4211 0.4625 0.6982 -0.0764 0.0064 0.0212 357 ILE B N 5905 C CA . ILE B 298 ? 0.4605 0.5036 0.7372 -0.0767 0.0129 0.0237 357 ILE B CA 5906 C C . ILE B 298 ? 0.5764 0.6192 0.8593 -0.0781 0.0159 0.0253 357 ILE B C 5907 O O . ILE B 298 ? 0.5363 0.5785 0.8145 -0.0782 0.0205 0.0272 357 ILE B O 5908 C CB . ILE B 298 ? 0.4165 0.4629 0.6996 -0.0764 0.0149 0.0242 357 ILE B CB 5909 C CG1 . ILE B 298 ? 0.4717 0.5183 0.7461 -0.0748 0.0138 0.0232 357 ILE B CG1 5910 C CG2 . ILE B 298 ? 0.4939 0.5421 0.7805 -0.0769 0.0215 0.0270 357 ILE B CG2 5911 C CD1 . ILE B 298 ? 0.4909 0.5407 0.7707 -0.0745 0.0154 0.0236 357 ILE B CD1 5912 N N . LEU B 299 ? 0.3679 0.4110 0.6615 -0.0792 0.0132 0.0245 358 LEU B N 5913 C CA . LEU B 299 ? 0.4607 0.5035 0.7612 -0.0807 0.0154 0.0258 358 LEU B CA 5914 C C . LEU B 299 ? 0.5232 0.5626 0.8152 -0.0808 0.0146 0.0258 358 LEU B C 5915 O O . LEU B 299 ? 0.3443 0.3830 0.6347 -0.0813 0.0191 0.0276 358 LEU B O 5916 C CB . LEU B 299 ? 0.3435 0.3872 0.6570 -0.0817 0.0118 0.0246 358 LEU B CB 5917 C CG . LEU B 299 ? 0.3704 0.4138 0.6927 -0.0834 0.0136 0.0257 358 LEU B CG 5918 C CD1 . LEU B 299 ? 0.4594 0.5049 0.7869 -0.0839 0.0204 0.0284 358 LEU B CD1 5919 C CD2 . LEU B 299 ? 0.3839 0.4278 0.7177 -0.0842 0.0087 0.0239 358 LEU B CD2 5920 N N . ASP B 300 ? 0.3444 0.3817 0.6309 -0.0802 0.0090 0.0237 359 ASP B N 5921 C CA . ASP B 300 ? 0.3675 0.4015 0.6455 -0.0802 0.0075 0.0235 359 ASP B CA 5922 C C . ASP B 300 ? 0.5464 0.5794 0.8123 -0.0794 0.0117 0.0248 359 ASP B C 5923 O O . ASP B 300 ? 0.4160 0.4470 0.6769 -0.0798 0.0133 0.0256 359 ASP B O 5924 C CB . ASP B 300 ? 0.3464 0.3784 0.6205 -0.0793 0.0005 0.0210 359 ASP B CB 5925 C CG . ASP B 300 ? 0.5312 0.5631 0.8163 -0.0801 -0.0041 0.0195 359 ASP B CG 5926 O OD1 . ASP B 300 ? 0.4359 0.4688 0.7306 -0.0815 -0.0019 0.0205 359 ASP B OD1 5927 O OD2 . ASP B 300 ? 0.5403 0.5712 0.8245 -0.0791 -0.0098 0.0173 359 ASP B OD2 5928 N N . TYR B 301 ? 0.3433 0.3778 0.6044 -0.0783 0.0135 0.0250 360 TYR B N 5929 C CA . TYR B 301 ? 0.3494 0.3832 0.5993 -0.0775 0.0174 0.0261 360 TYR B CA 5930 C C . TYR B 301 ? 0.4139 0.4488 0.6667 -0.0780 0.0240 0.0285 360 TYR B C 5931 O O . TYR B 301 ? 0.3427 0.3760 0.5876 -0.0777 0.0271 0.0295 360 TYR B O 5932 C CB . TYR B 301 ? 0.4602 0.4953 0.7047 -0.0761 0.0174 0.0256 360 TYR B CB 5933 C CG . TYR B 301 ? 0.5286 0.5632 0.7623 -0.0751 0.0216 0.0267 360 TYR B CG 5934 C CD1 . TYR B 301 ? 0.5689 0.6009 0.7913 -0.0746 0.0203 0.0261 360 TYR B CD1 5935 C CD2 . TYR B 301 ? 0.4947 0.5315 0.7293 -0.0747 0.0267 0.0283 360 TYR B CD2 5936 C CE1 . TYR B 301 ? 0.5110 0.5426 0.7237 -0.0737 0.0240 0.0269 360 TYR B CE1 5937 C CE2 . TYR B 301 ? 0.5253 0.5618 0.7502 -0.0737 0.0304 0.0291 360 TYR B CE2 5938 C CZ . TYR B 301 ? 0.7195 0.7533 0.9335 -0.0732 0.0291 0.0284 360 TYR B CZ 5939 O OH . TYR B 301 ? 0.6463 0.6797 0.8507 -0.0722 0.0327 0.0291 360 TYR B OH 5940 N N . LEU B 302 ? 0.5379 0.5753 0.8018 -0.0786 0.0263 0.0295 361 LEU B N 5941 C CA . LEU B 302 ? 0.3421 0.3804 0.6100 -0.0790 0.0326 0.0319 361 LEU B CA 5942 C C . LEU B 302 ? 0.4906 0.5270 0.7603 -0.0801 0.0335 0.0325 361 LEU B C 5943 O O . LEU B 302 ? 0.5387 0.5745 0.8058 -0.0799 0.0386 0.0342 361 LEU B O 5944 C CB . LEU B 302 ? 0.3595 0.4010 0.6398 -0.0794 0.0342 0.0327 361 LEU B CB 5945 C CG . LEU B 302 ? 0.5532 0.5970 0.8321 -0.0783 0.0354 0.0330 361 LEU B CG 5946 C CD1 . LEU B 302 ? 0.3390 0.3858 0.6307 -0.0789 0.0354 0.0333 361 LEU B CD1 5947 C CD2 . LEU B 302 ? 0.3386 0.3827 0.6107 -0.0772 0.0415 0.0350 361 LEU B CD2 5948 N N . ILE B 303 ? 0.4192 0.4543 0.6931 -0.0810 0.0285 0.0310 362 ILE B N 5949 C CA . ILE B 303 ? 0.4888 0.5220 0.7651 -0.0822 0.0288 0.0314 362 ILE B CA 5950 C C . ILE B 303 ? 0.4595 0.4894 0.7243 -0.0818 0.0258 0.0303 362 ILE B C 5951 O O . ILE B 303 ? 0.4495 0.4774 0.7139 -0.0826 0.0260 0.0306 362 ILE B O 5952 C CB . ILE B 303 ? 0.4160 0.4498 0.7052 -0.0836 0.0252 0.0305 362 ILE B CB 5953 C CG1 . ILE B 303 ? 0.3484 0.3813 0.6360 -0.0833 0.0179 0.0279 362 ILE B CG1 5954 C CG2 . ILE B 303 ? 0.3703 0.4075 0.6710 -0.0839 0.0279 0.0315 362 ILE B CG2 5955 C CD1 . ILE B 303 ? 0.3571 0.3912 0.6578 -0.0843 0.0140 0.0268 362 ILE B CD1 5956 N N . GLY B 304 ? 0.3471 0.3765 0.6026 -0.0806 0.0231 0.0291 363 GLY B N 5957 C CA . GLY B 304 ? 0.3479 0.3743 0.5919 -0.0801 0.0202 0.0281 363 GLY B CA 5958 C C . GLY B 304 ? 0.3494 0.3739 0.5960 -0.0807 0.0138 0.0265 363 GLY B C 5959 O O . GLY B 304 ? 0.4643 0.4861 0.7038 -0.0807 0.0120 0.0261 363 GLY B O 5960 N N . ASN B 305 ? 0.5240 0.5500 0.7808 -0.0811 0.0104 0.0254 364 ASN B N 5961 C CA . ASN B 305 ? 0.3508 0.3751 0.6108 -0.0814 0.0040 0.0237 364 ASN B CA 5962 C C . ASN B 305 ? 0.4694 0.4922 0.7206 -0.0799 -0.0012 0.0218 364 ASN B C 5963 O O . ASN B 305 ? 0.4647 0.4890 0.7161 -0.0789 -0.0024 0.0210 364 ASN B O 5964 C CB . ASN B 305 ? 0.3855 0.4120 0.6602 -0.0823 0.0022 0.0231 364 ASN B CB 5965 C CG . ASN B 305 ? 0.3779 0.4027 0.6563 -0.0823 -0.0047 0.0210 364 ASN B CG 5966 O OD1 . ASN B 305 ? 0.3538 0.3757 0.6265 -0.0823 -0.0072 0.0207 364 ASN B OD1 5967 N ND2 . ASN B 305 ? 0.4213 0.4479 0.7092 -0.0823 -0.0078 0.0197 364 ASN B ND2 5968 N N . GLN B 306 ? 0.3821 0.4018 0.6255 -0.0796 -0.0043 0.0213 365 GLN B N 5969 C CA . GLN B 306 ? 0.5826 0.6004 0.8169 -0.0780 -0.0092 0.0197 365 GLN B CA 5970 C C . GLN B 306 ? 0.3531 0.3694 0.5924 -0.0777 -0.0161 0.0178 365 GLN B C 5971 O O . GLN B 306 ? 0.5225 0.5375 0.7564 -0.0761 -0.0206 0.0163 365 GLN B O 5972 C CB . GLN B 306 ? 0.3522 0.3673 0.5733 -0.0775 -0.0083 0.0203 365 GLN B CB 5973 C CG . GLN B 306 ? 0.3510 0.3671 0.5658 -0.0775 -0.0018 0.0220 365 GLN B CG 5974 C CD . GLN B 306 ? 0.4710 0.4843 0.6731 -0.0771 -0.0011 0.0224 365 GLN B CD 5975 O OE1 . GLN B 306 ? 0.3766 0.3879 0.5780 -0.0777 -0.0026 0.0225 365 GLN B OE1 5976 N NE2 . GLN B 306 ? 0.3504 0.3639 0.5428 -0.0760 0.0010 0.0226 365 GLN B NE2 5977 N N . ASP B 307 ? 0.4404 0.4571 0.6904 -0.0790 -0.0169 0.0179 366 ASP B N 5978 C CA . ASP B 307 ? 0.3572 0.3720 0.6113 -0.0787 -0.0234 0.0162 366 ASP B CA 5979 C C . ASP B 307 ? 0.3950 0.4117 0.6596 -0.0783 -0.0269 0.0144 366 ASP B C 5980 O O . ASP B 307 ? 0.6622 0.6785 0.9359 -0.0788 -0.0305 0.0134 366 ASP B O 5981 C CB . ASP B 307 ? 0.4077 0.4214 0.6670 -0.0804 -0.0229 0.0170 366 ASP B CB 5982 C CG . ASP B 307 ? 0.4296 0.4403 0.6882 -0.0799 -0.0295 0.0156 366 ASP B CG 5983 O OD1 . ASP B 307 ? 0.5501 0.5588 0.8003 -0.0781 -0.0338 0.0144 366 ASP B OD1 5984 O OD2 . ASP B 307 ? 0.5171 0.5274 0.7836 -0.0811 -0.0305 0.0157 366 ASP B OD2 5985 N N . ARG B 308 ? 0.3967 0.4153 0.6601 -0.0773 -0.0259 0.0140 367 ARG B N 5986 C CA . ARG B 308 ? 0.3931 0.4134 0.6655 -0.0768 -0.0289 0.0123 367 ARG B CA 5987 C C . ARG B 308 ? 0.5836 0.6016 0.8508 -0.0746 -0.0356 0.0100 367 ARG B C 5988 O O . ARG B 308 ? 0.5474 0.5655 0.8085 -0.0730 -0.0360 0.0093 367 ARG B O 5989 C CB . ARG B 308 ? 0.5023 0.5260 0.7765 -0.0768 -0.0245 0.0130 367 ARG B CB 5990 C CG . ARG B 308 ? 0.3512 0.3772 0.6362 -0.0765 -0.0268 0.0114 367 ARG B CG 5991 C CD . ARG B 308 ? 0.3519 0.3795 0.6507 -0.0783 -0.0259 0.0118 367 ARG B CD 5992 N NE . ARG B 308 ? 0.3791 0.4090 0.6810 -0.0799 -0.0190 0.0143 367 ARG B NE 5993 C CZ . ARG B 308 ? 0.5106 0.5422 0.8242 -0.0816 -0.0168 0.0152 367 ARG B CZ 5994 N NH1 . ARG B 308 ? 0.3527 0.3840 0.6760 -0.0821 -0.0211 0.0137 367 ARG B NH1 5995 N NH2 . ARG B 308 ? 0.3777 0.4110 0.6931 -0.0827 -0.0103 0.0176 367 ARG B NH2 5996 N N . HIS B 309 ? 0.5136 0.5291 0.7828 -0.0743 -0.0407 0.0089 368 HIS B N 5997 C CA . HIS B 309 ? 0.4475 0.4602 0.7116 -0.0720 -0.0472 0.0068 368 HIS B CA 5998 C C . HIS B 309 ? 0.4735 0.4873 0.7477 -0.0711 -0.0517 0.0045 368 HIS B C 5999 O O . HIS B 309 ? 0.4561 0.4684 0.7264 -0.0688 -0.0560 0.0026 368 HIS B O 6000 C CB . HIS B 309 ? 0.3593 0.3685 0.6188 -0.0719 -0.0506 0.0069 368 HIS B CB 6001 C CG . HIS B 309 ? 0.4831 0.4927 0.7531 -0.0739 -0.0507 0.0073 368 HIS B CG 6002 N ND1 . HIS B 309 ? 0.5483 0.5576 0.8285 -0.0736 -0.0557 0.0055 368 HIS B ND1 6003 C CD2 . HIS B 309 ? 0.4134 0.4235 0.6853 -0.0760 -0.0463 0.0093 368 HIS B CD2 6004 C CE1 . HIS B 309 ? 0.3866 0.3963 0.6746 -0.0756 -0.0545 0.0063 368 HIS B CE1 6005 N NE2 . HIS B 309 ? 0.5475 0.5576 0.8306 -0.0771 -0.0487 0.0087 368 HIS B NE2 6006 N N . HIS B 310 ? 0.6464 0.6624 0.9335 -0.0728 -0.0506 0.0045 369 HIS B N 6007 C CA . HIS B 310 ? 0.3582 0.3755 0.6560 -0.0720 -0.0545 0.0022 369 HIS B CA 6008 C C . HIS B 310 ? 0.4618 0.4833 0.7702 -0.0737 -0.0500 0.0029 369 HIS B C 6009 O O . HIS B 310 ? 0.4692 0.4924 0.7789 -0.0756 -0.0442 0.0052 369 HIS B O 6010 C CB . HIS B 310 ? 0.4904 0.5059 0.7953 -0.0722 -0.0597 0.0010 369 HIS B CB 6011 C CG . HIS B 310 ? 0.7803 0.7918 1.0773 -0.0697 -0.0661 -0.0007 369 HIS B CG 6012 N ND1 . HIS B 310 ? 0.9366 0.9452 1.2203 -0.0689 -0.0661 0.0004 369 HIS B ND1 6013 C CD2 . HIS B 310 ? 0.8093 0.8191 1.1100 -0.0676 -0.0728 -0.0033 369 HIS B CD2 6014 C CE1 . HIS B 310 ? 0.8656 0.8709 1.1449 -0.0665 -0.0724 -0.0014 369 HIS B CE1 6015 N NE2 . HIS B 310 ? 0.7750 0.7808 1.0644 -0.0656 -0.0766 -0.0036 369 HIS B NE2 6016 N N . PHE B 311 ? 0.6423 0.6655 0.9581 -0.0727 -0.0527 0.0009 370 PHE B N 6017 C CA . PHE B 311 ? 0.3788 0.4059 0.7057 -0.0742 -0.0491 0.0013 370 PHE B CA 6018 C C . PHE B 311 ? 0.4679 0.4958 0.8088 -0.0747 -0.0528 -0.0004 370 PHE B C 6019 O O . PHE B 311 ? 0.5776 0.6034 0.9194 -0.0732 -0.0590 -0.0027 370 PHE B O 6020 C CB . PHE B 311 ? 0.3538 0.3829 0.6783 -0.0727 -0.0484 0.0005 370 PHE B CB 6021 C CG . PHE B 311 ? 0.4622 0.4910 0.7743 -0.0723 -0.0442 0.0022 370 PHE B CG 6022 C CD1 . PHE B 311 ? 0.4903 0.5212 0.8021 -0.0741 -0.0375 0.0049 370 PHE B CD1 6023 C CD2 . PHE B 311 ? 0.4375 0.4640 0.7382 -0.0700 -0.0469 0.0010 370 PHE B CD2 6024 C CE1 . PHE B 311 ? 0.5806 0.6113 0.8812 -0.0737 -0.0338 0.0064 370 PHE B CE1 6025 C CE2 . PHE B 311 ? 0.4101 0.4365 0.6998 -0.0697 -0.0431 0.0025 370 PHE B CE2 6026 C CZ . PHE B 311 ? 0.4793 0.5078 0.7689 -0.0716 -0.0366 0.0052 370 PHE B CZ 6027 N N . GLU B 312 ? 0.5707 0.6017 0.9225 -0.0769 -0.0488 0.0008 371 GLU B N 6028 C CA . GLU B 312 ? 0.4211 0.4532 0.7871 -0.0777 -0.0517 -0.0006 371 GLU B CA 6029 C C . GLU B 312 ? 0.5113 0.5473 0.8867 -0.0779 -0.0500 -0.0012 371 GLU B C 6030 O O . GLU B 312 ? 0.5132 0.5518 0.8880 -0.0788 -0.0443 0.0008 371 GLU B O 6031 C CB . GLU B 312 ? 0.5065 0.5387 0.8787 -0.0802 -0.0488 0.0013 371 GLU B CB 6032 C CG . GLU B 312 ? 0.6307 0.6634 1.0170 -0.0810 -0.0525 -0.0003 371 GLU B CG 6033 C CD . GLU B 312 ? 0.7634 0.7923 1.1471 -0.0799 -0.0590 -0.0021 371 GLU B CD 6034 O OE1 . GLU B 312 ? 0.7640 0.7899 1.1348 -0.0783 -0.0609 -0.0022 371 GLU B OE1 6035 O OE2 . GLU B 312 ? 0.8814 0.9102 1.2759 -0.0804 -0.0624 -0.0035 371 GLU B OE2 6036 N N . SER B 313 ? 0.5668 0.6033 0.9506 -0.0769 -0.0551 -0.0041 372 SER B N 6037 C CA . SER B 313 ? 0.5200 0.5601 0.9126 -0.0769 -0.0542 -0.0050 372 SER B CA 6038 C C . SER B 313 ? 0.6281 0.6691 1.0348 -0.0771 -0.0586 -0.0075 372 SER B C 6039 O O . SER B 313 ? 0.5426 0.5808 0.9496 -0.0759 -0.0644 -0.0096 372 SER B O 6040 C CB . SER B 313 ? 0.4499 0.4898 0.8340 -0.0744 -0.0558 -0.0066 372 SER B CB 6041 O OG . SER B 313 ? 0.6856 0.7255 1.0585 -0.0744 -0.0509 -0.0042 372 SER B OG 6042 N N . PHE B 314 ? 0.6844 0.7291 1.1026 -0.0784 -0.0559 -0.0072 373 PHE B N 6043 C CA . PHE B 314 ? 0.5768 0.6228 1.0087 -0.0784 -0.0601 -0.0098 373 PHE B CA 6044 C C . PHE B 314 ? 0.7023 0.7476 1.1317 -0.0754 -0.0656 -0.0133 373 PHE B C 6045 O O . PHE B 314 ? 0.6728 0.7186 1.0938 -0.0740 -0.0642 -0.0132 373 PHE B O 6046 C CB . PHE B 314 ? 0.3558 0.4061 0.8005 -0.0806 -0.0555 -0.0085 373 PHE B CB 6047 C CG . PHE B 314 ? 0.4535 0.5044 0.9024 -0.0834 -0.0502 -0.0053 373 PHE B CG 6048 C CD1 . PHE B 314 ? 0.3872 0.4362 0.8417 -0.0845 -0.0524 -0.0055 373 PHE B CD1 6049 C CD2 . PHE B 314 ? 0.4427 0.4958 0.8900 -0.0847 -0.0430 -0.0020 373 PHE B CD2 6050 C CE1 . PHE B 314 ? 0.3868 0.4362 0.8451 -0.0870 -0.0474 -0.0026 373 PHE B CE1 6051 C CE2 . PHE B 314 ? 0.4099 0.4633 0.8610 -0.0870 -0.0380 0.0009 373 PHE B CE2 6052 C CZ . PHE B 314 ? 0.4599 0.5115 0.9165 -0.0882 -0.0401 0.0006 373 PHE B CZ 6053 N N . ASN B 315 ? 0.7848 0.8290 1.2214 -0.0743 -0.0718 -0.0164 374 ASN B N 6054 C CA . ASN B 315 ? 0.8253 0.8689 1.2609 -0.0713 -0.0772 -0.0200 374 ASN B CA 6055 C C . ASN B 315 ? 0.7341 0.7803 1.1855 -0.0716 -0.0798 -0.0224 374 ASN B C 6056 O O . ASN B 315 ? 0.6996 0.7441 1.1561 -0.0703 -0.0859 -0.0253 374 ASN B O 6057 C CB . ASN B 315 ? 0.7278 0.7667 1.1547 -0.0687 -0.0833 -0.0219 374 ASN B CB 6058 C CG . ASN B 315 ? 0.7425 0.7802 1.1648 -0.0651 -0.0881 -0.0252 374 ASN B CG 6059 O OD1 . ASN B 315 ? 0.6455 0.6857 1.0671 -0.0645 -0.0860 -0.0256 374 ASN B OD1 6060 N ND2 . ASN B 315 ? 0.6830 0.7170 1.1021 -0.0626 -0.0945 -0.0276 374 ASN B ND2 6061 N N . VAL B 316 ? 0.6102 0.6605 1.0692 -0.0734 -0.0751 -0.0212 375 VAL B N 6062 C CA . VAL B 316 ? 0.8146 0.8679 1.2897 -0.0744 -0.0762 -0.0227 375 VAL B CA 6063 C C . VAL B 316 ? 0.8629 0.9199 1.3417 -0.0739 -0.0745 -0.0235 375 VAL B C 6064 O O . VAL B 316 ? 0.8678 0.9266 1.3575 -0.0734 -0.0775 -0.0263 375 VAL B O 6065 C CB . VAL B 316 ? 0.6792 0.7341 1.1637 -0.0780 -0.0717 -0.0198 375 VAL B CB 6066 C CG1 . VAL B 316 ? 0.5363 0.5935 1.0169 -0.0798 -0.0637 -0.0158 375 VAL B CG1 6067 C CG2 . VAL B 316 ? 0.7189 0.7765 1.2208 -0.0790 -0.0735 -0.0216 375 VAL B CG2 6068 N N . PHE B 317 ? 0.7314 0.7893 1.2009 -0.0738 -0.0697 -0.0213 376 PHE B N 6069 C CA . PHE B 317 ? 0.6993 0.7606 1.1711 -0.0732 -0.0682 -0.0221 376 PHE B CA 6070 C C . PHE B 317 ? 0.8961 0.9554 1.3598 -0.0696 -0.0733 -0.0255 376 PHE B C 6071 O O . PHE B 317 ? 1.0285 1.0858 1.4787 -0.0682 -0.0724 -0.0248 376 PHE B O 6072 C CB . PHE B 317 ? 0.6783 0.7416 1.1442 -0.0746 -0.0608 -0.0182 376 PHE B CB 6073 C CG . PHE B 317 ? 0.8986 0.9639 1.3723 -0.0778 -0.0553 -0.0147 376 PHE B CG 6074 C CD1 . PHE B 317 ? 0.8862 0.9495 1.3531 -0.0791 -0.0520 -0.0117 376 PHE B CD1 6075 C CD2 . PHE B 317 ? 0.8460 0.9150 1.3336 -0.0794 -0.0533 -0.0145 376 PHE B CD2 6076 C CE1 . PHE B 317 ? 0.8263 0.8911 1.3001 -0.0819 -0.0468 -0.0086 376 PHE B CE1 6077 C CE2 . PHE B 317 ? 0.8821 0.9528 1.3770 -0.0822 -0.0481 -0.0112 376 PHE B CE2 6078 C CZ . PHE B 317 ? 0.9241 0.9926 1.4120 -0.0834 -0.0448 -0.0083 376 PHE B CZ 6079 N N . ASN B 318 ? 1.0848 1.1443 1.5569 -0.0681 -0.0787 -0.0293 377 ASN B N 6080 C CA . ASN B 318 ? 1.2281 1.2855 1.6938 -0.0644 -0.0841 -0.0330 377 ASN B CA 6081 C C . ASN B 318 ? 1.1823 1.2413 1.6400 -0.0631 -0.0812 -0.0327 377 ASN B C 6082 O O . ASN B 318 ? 1.0840 1.1469 1.5468 -0.0648 -0.0766 -0.0310 377 ASN B O 6083 C CB . ASN B 318 ? 1.3789 1.4369 1.8567 -0.0631 -0.0898 -0.0371 377 ASN B CB 6084 C CG . ASN B 318 ? 1.5236 1.5779 1.9946 -0.0590 -0.0966 -0.0411 377 ASN B CG 6085 O OD1 . ASN B 318 ? 1.5705 1.6212 2.0290 -0.0574 -0.0977 -0.0406 377 ASN B OD1 6086 N ND2 . ASN B 318 ? 1.5086 1.5639 1.9881 -0.0571 -0.1011 -0.0450 377 ASN B ND2 6087 N N . ASP B 319 ? 1.2424 1.2983 1.6876 -0.0602 -0.0838 -0.0342 378 ASP B N 6088 C CA . ASP B 319 ? 1.2495 1.3063 1.6862 -0.0585 -0.0819 -0.0344 378 ASP B CA 6089 C C . ASP B 319 ? 1.1391 1.1978 1.5697 -0.0607 -0.0747 -0.0302 378 ASP B C 6090 O O . ASP B 319 ? 1.2547 1.3147 1.6793 -0.0598 -0.0724 -0.0300 378 ASP B O 6091 C CB . ASP B 319 ? 1.2804 1.3402 1.7262 -0.0575 -0.0837 -0.0373 378 ASP B CB 6092 C CG . ASP B 319 ? 1.3042 1.3616 1.7529 -0.0543 -0.0911 -0.0421 378 ASP B CG 6093 O OD1 . ASP B 319 ? 1.1137 1.1668 1.5539 -0.0521 -0.0948 -0.0433 378 ASP B OD1 6094 O OD2 . ASP B 319 ? 1.4938 1.5536 1.9533 -0.0539 -0.0933 -0.0447 378 ASP B OD2 6095 N N . LEU B 320 ? 0.9547 1.0137 1.3868 -0.0635 -0.0710 -0.0268 379 LEU B N 6096 C CA . LEU B 320 ? 0.8852 0.9456 1.3112 -0.0654 -0.0642 -0.0227 379 LEU B CA 6097 C C . LEU B 320 ? 0.7681 0.8251 1.1831 -0.0656 -0.0633 -0.0207 379 LEU B C 6098 O O . LEU B 320 ? 0.7246 0.7787 1.1403 -0.0654 -0.0669 -0.0216 379 LEU B O 6099 C CB . LEU B 320 ? 0.7608 0.8250 1.1987 -0.0686 -0.0594 -0.0201 379 LEU B CB 6100 C CG . LEU B 320 ? 0.7773 0.8455 1.2270 -0.0688 -0.0594 -0.0215 379 LEU B CG 6101 C CD1 . LEU B 320 ? 0.6941 0.7658 1.1527 -0.0719 -0.0535 -0.0180 379 LEU B CD1 6102 C CD2 . LEU B 320 ? 0.7411 0.8102 1.1837 -0.0667 -0.0593 -0.0227 379 LEU B CD2 6103 N N . PRO B 321 ? 0.7110 0.7680 1.1155 -0.0659 -0.0586 -0.0181 380 PRO B N 6104 C CA . PRO B 321 ? 0.7075 0.7613 1.1010 -0.0660 -0.0577 -0.0162 380 PRO B CA 6105 C C . PRO B 321 ? 0.6451 0.6994 1.0435 -0.0690 -0.0542 -0.0132 380 PRO B C 6106 O O . PRO B 321 ? 0.6580 0.7155 1.0640 -0.0711 -0.0496 -0.0111 380 PRO B O 6107 C CB . PRO B 321 ? 0.5843 0.6386 0.9665 -0.0654 -0.0535 -0.0145 380 PRO B CB 6108 C CG . PRO B 321 ? 0.5215 0.5801 0.9111 -0.0664 -0.0500 -0.0137 380 PRO B CG 6109 C CD . PRO B 321 ? 0.5064 0.5663 0.9080 -0.0658 -0.0544 -0.0169 380 PRO B CD 6110 N N . SER B 322 ? 0.6543 0.7051 1.0480 -0.0689 -0.0563 -0.0131 381 SER B N 6111 C CA . SER B 322 ? 0.5581 0.6087 0.9549 -0.0715 -0.0533 -0.0104 381 SER B CA 6112 C C . SER B 322 ? 0.7243 0.7747 1.1108 -0.0724 -0.0474 -0.0070 381 SER B C 6113 O O . SER B 322 ? 0.7044 0.7542 1.0802 -0.0709 -0.0465 -0.0069 381 SER B O 6114 C CB . SER B 322 ? 0.4644 0.5114 0.8607 -0.0710 -0.0583 -0.0118 381 SER B CB 6115 O OG . SER B 322 ? 0.6386 0.6820 1.0220 -0.0685 -0.0615 -0.0130 381 SER B OG 6116 N N . TYR B 323 ? 0.6064 0.6573 0.9963 -0.0748 -0.0434 -0.0042 382 TYR B N 6117 C CA . TYR B 323 ? 0.5942 0.6448 0.9749 -0.0757 -0.0379 -0.0010 382 TYR B CA 6118 C C . TYR B 323 ? 0.5938 0.6415 0.9716 -0.0766 -0.0382 0.0001 382 TYR B C 6119 O O . TYR B 323 ? 0.6287 0.6756 1.0146 -0.0774 -0.0412 -0.0009 382 TYR B O 6120 C CB . TYR B 323 ? 0.4902 0.5445 0.8771 -0.0775 -0.0314 0.0017 382 TYR B CB 6121 C CG . TYR B 323 ? 0.5650 0.6210 0.9663 -0.0796 -0.0304 0.0024 382 TYR B CG 6122 C CD1 . TYR B 323 ? 0.4307 0.4855 0.8335 -0.0813 -0.0279 0.0044 382 TYR B CD1 6123 C CD2 . TYR B 323 ? 0.6817 0.7406 1.0952 -0.0797 -0.0318 0.0009 382 TYR B CD2 6124 C CE1 . TYR B 323 ? 0.6172 0.6736 1.0333 -0.0832 -0.0268 0.0050 382 TYR B CE1 6125 C CE2 . TYR B 323 ? 0.7126 0.7732 1.1396 -0.0817 -0.0308 0.0015 382 TYR B CE2 6126 C CZ . TYR B 323 ? 0.6454 0.7046 1.0737 -0.0834 -0.0283 0.0035 382 TYR B CZ 6127 O OH . TYR B 323 ? 0.5003 0.5611 0.9421 -0.0854 -0.0271 0.0041 382 TYR B OH 6128 N N . ALA B 324 ? 0.5689 0.6150 0.9352 -0.0766 -0.0351 0.0021 383 ALA B N 6129 C CA . ALA B 324 ? 0.5430 0.5863 0.9051 -0.0775 -0.0351 0.0032 383 ALA B CA 6130 C C . ALA B 324 ? 0.4972 0.5421 0.8679 -0.0800 -0.0303 0.0057 383 ALA B C 6131 O O . ALA B 324 ? 0.4871 0.5343 0.8585 -0.0809 -0.0245 0.0080 383 ALA B O 6132 C CB . ALA B 324 ? 0.5042 0.5454 0.8511 -0.0766 -0.0332 0.0044 383 ALA B CB 6133 N N . ILE B 325 ? 0.5137 0.5572 0.8908 -0.0810 -0.0328 0.0051 384 ILE B N 6134 C CA . ILE B 325 ? 0.4133 0.4578 0.7981 -0.0834 -0.0284 0.0074 384 ILE B CA 6135 C C . ILE B 325 ? 0.4704 0.5128 0.8444 -0.0838 -0.0245 0.0099 384 ILE B C 6136 O O . ILE B 325 ? 0.5174 0.5567 0.8828 -0.0831 -0.0275 0.0092 384 ILE B O 6137 C CB . ILE B 325 ? 0.5959 0.6396 0.9914 -0.0843 -0.0325 0.0060 384 ILE B CB 6138 C CG1 . ILE B 325 ? 0.5620 0.6075 0.9679 -0.0836 -0.0369 0.0032 384 ILE B CG1 6139 C CG2 . ILE B 325 ? 0.4919 0.5365 0.8955 -0.0868 -0.0275 0.0085 384 ILE B CG2 6140 C CD1 . ILE B 325 ? 0.4034 0.4476 0.8186 -0.0840 -0.0422 0.0011 384 ILE B CD1 6141 N N . HIS B 326 ? 0.4465 0.4908 0.8211 -0.0849 -0.0177 0.0127 385 HIS B N 6142 C CA . HIS B 326 ? 0.3504 0.3930 0.7150 -0.0853 -0.0134 0.0150 385 HIS B CA 6143 C C . HIS B 326 ? 0.3922 0.4329 0.7603 -0.0868 -0.0135 0.0157 385 HIS B C 6144 O O . HIS B 326 ? 0.3816 0.4236 0.7581 -0.0884 -0.0093 0.0174 385 HIS B O 6145 C CB . HIS B 326 ? 0.4340 0.4791 0.7984 -0.0857 -0.0063 0.0177 385 HIS B CB 6146 C CG . HIS B 326 ? 0.5314 0.5782 0.8910 -0.0842 -0.0060 0.0173 385 HIS B CG 6147 N ND1 . HIS B 326 ? 0.5944 0.6438 0.9548 -0.0843 -0.0004 0.0194 385 HIS B ND1 6148 C CD2 . HIS B 326 ? 0.5256 0.5718 0.8796 -0.0826 -0.0106 0.0150 385 HIS B CD2 6149 C CE1 . HIS B 326 ? 0.4750 0.5254 0.8303 -0.0829 -0.0016 0.0184 385 HIS B CE1 6150 N NE2 . HIS B 326 ? 0.5865 0.6350 0.9378 -0.0818 -0.0076 0.0157 385 HIS B NE2 6151 N N . LEU B 327 ? 0.5506 0.5880 0.9119 -0.0861 -0.0182 0.0143 386 LEU B N 6152 C CA . LEU B 327 ? 0.5410 0.5761 0.9049 -0.0873 -0.0193 0.0145 386 LEU B CA 6153 C C . LEU B 327 ? 0.4458 0.4777 0.7956 -0.0868 -0.0186 0.0155 386 LEU B C 6154 O O . LEU B 327 ? 0.4351 0.4665 0.7736 -0.0855 -0.0176 0.0157 386 LEU B O 6155 C CB . LEU B 327 ? 0.4936 0.5276 0.8643 -0.0869 -0.0267 0.0117 386 LEU B CB 6156 C CG . LEU B 327 ? 0.6400 0.6723 1.0175 -0.0882 -0.0290 0.0114 386 LEU B CG 6157 C CD1 . LEU B 327 ? 0.7688 0.8029 1.1557 -0.0904 -0.0231 0.0136 386 LEU B CD1 6158 C CD2 . LEU B 327 ? 0.5904 0.6227 0.9768 -0.0876 -0.0359 0.0084 386 LEU B CD2 6159 N N . ASP B 328 ? 0.4283 0.4580 0.7791 -0.0879 -0.0191 0.0159 387 ASP B N 6160 C CA . ASP B 328 ? 0.4275 0.4539 0.7657 -0.0875 -0.0192 0.0166 387 ASP B CA 6161 C C . ASP B 328 ? 0.3573 0.3840 0.6853 -0.0873 -0.0130 0.0188 387 ASP B C 6162 O O . ASP B 328 ? 0.3626 0.3882 0.6790 -0.0858 -0.0138 0.0184 387 ASP B O 6163 C CB . ASP B 328 ? 0.3853 0.4092 0.7154 -0.0856 -0.0260 0.0144 387 ASP B CB 6164 C CG . ASP B 328 ? 0.6032 0.6261 0.9419 -0.0856 -0.0325 0.0122 387 ASP B CG 6165 O OD1 . ASP B 328 ? 0.6935 0.7169 1.0427 -0.0873 -0.0318 0.0126 387 ASP B OD1 6166 O OD2 . ASP B 328 ? 0.7899 0.8114 1.1249 -0.0838 -0.0384 0.0101 387 ASP B OD2 6167 N N . HIS B 329 ? 0.3573 0.3851 0.6896 -0.0886 -0.0067 0.0210 388 HIS B N 6168 C CA . HIS B 329 ? 0.4721 0.5002 0.7957 -0.0883 -0.0005 0.0231 388 HIS B CA 6169 C C . HIS B 329 ? 0.5746 0.6002 0.8927 -0.0890 0.0025 0.0246 388 HIS B C 6170 O O . HIS B 329 ? 0.3571 0.3830 0.6704 -0.0889 0.0085 0.0265 388 HIS B O 6171 C CB . HIS B 329 ? 0.3549 0.3864 0.6865 -0.0887 0.0050 0.0247 388 HIS B CB 6172 C CG . HIS B 329 ? 0.4498 0.4839 0.7869 -0.0881 0.0025 0.0233 388 HIS B CG 6173 N ND1 . HIS B 329 ? 0.3843 0.4210 0.7354 -0.0890 0.0026 0.0231 388 HIS B ND1 6174 C CD2 . HIS B 329 ? 0.3522 0.3866 0.6823 -0.0865 -0.0002 0.0220 388 HIS B CD2 6175 C CE1 . HIS B 329 ? 0.5344 0.5730 0.8868 -0.0880 0.0001 0.0218 388 HIS B CE1 6176 N NE2 . HIS B 329 ? 0.4374 0.4746 0.7772 -0.0865 -0.0016 0.0211 388 HIS B NE2 6177 N N . GLY B 330 ? 0.3595 0.3827 0.6781 -0.0895 -0.0017 0.0236 389 GLY B N 6178 C CA . GLY B 330 ? 0.3611 0.3817 0.6747 -0.0902 0.0006 0.0248 389 GLY B CA 6179 C C . GLY B 330 ? 0.3670 0.3858 0.6649 -0.0891 0.0028 0.0256 389 GLY B C 6180 O O . GLY B 330 ? 0.3880 0.4055 0.6814 -0.0895 0.0072 0.0272 389 GLY B O 6181 N N . ARG B 331 ? 0.3594 0.3781 0.6490 -0.0876 -0.0002 0.0245 390 ARG B N 6182 C CA . ARG B 331 ? 0.4064 0.4233 0.6809 -0.0864 0.0014 0.0250 390 ARG B CA 6183 C C . ARG B 331 ? 0.3801 0.3994 0.6512 -0.0856 0.0065 0.0260 390 ARG B C 6184 O O . ARG B 331 ? 0.4779 0.4965 0.7378 -0.0843 0.0063 0.0257 390 ARG B O 6185 C CB . ARG B 331 ? 0.3591 0.3739 0.6253 -0.0851 -0.0053 0.0231 390 ARG B CB 6186 C CG . ARG B 331 ? 0.3612 0.3727 0.6234 -0.0854 -0.0089 0.0227 390 ARG B CG 6187 C CD . ARG B 331 ? 0.4653 0.4748 0.7233 -0.0841 -0.0164 0.0207 390 ARG B CD 6188 N NE . ARG B 331 ? 0.4195 0.4257 0.6727 -0.0843 -0.0197 0.0205 390 ARG B NE 6189 C CZ . ARG B 331 ? 0.5199 0.5238 0.7706 -0.0832 -0.0266 0.0189 390 ARG B CZ 6190 N NH1 . ARG B 331 ? 0.5322 0.5369 0.7850 -0.0819 -0.0308 0.0173 390 ARG B NH1 6191 N NH2 . ARG B 331 ? 0.5631 0.5640 0.8092 -0.0834 -0.0292 0.0190 390 ARG B NH2 6192 N N . ALA B 332 ? 0.3818 0.4036 0.6627 -0.0864 0.0110 0.0272 391 ALA B N 6193 C CA . ALA B 332 ? 0.3544 0.3784 0.6329 -0.0856 0.0163 0.0285 391 ALA B CA 6194 C C . ALA B 332 ? 0.4214 0.4447 0.6960 -0.0857 0.0231 0.0306 391 ALA B C 6195 O O . ALA B 332 ? 0.3932 0.4149 0.6698 -0.0867 0.0241 0.0312 391 ALA B O 6196 C CB . ALA B 332 ? 0.3534 0.3807 0.6443 -0.0860 0.0171 0.0286 391 ALA B CB 6197 N N . PHE B 333 ? 0.3534 0.3779 0.6224 -0.0846 0.0276 0.0317 392 PHE B N 6198 C CA . PHE B 333 ? 0.5166 0.5407 0.7820 -0.0843 0.0345 0.0337 392 PHE B CA 6199 C C . PHE B 333 ? 0.3781 0.3989 0.6334 -0.0843 0.0347 0.0337 392 PHE B C 6200 O O . PHE B 333 ? 0.3605 0.3803 0.6165 -0.0846 0.0391 0.0350 392 PHE B O 6201 C CB . PHE B 333 ? 0.3544 0.3800 0.6326 -0.0854 0.0386 0.0353 392 PHE B CB 6202 C CG . PHE B 333 ? 0.3671 0.3960 0.6548 -0.0854 0.0395 0.0357 392 PHE B CG 6203 C CD1 . PHE B 333 ? 0.5243 0.5549 0.8093 -0.0841 0.0444 0.0370 392 PHE B CD1 6204 C CD2 . PHE B 333 ? 0.4869 0.5173 0.7863 -0.0865 0.0355 0.0346 392 PHE B CD2 6205 C CE1 . PHE B 333 ? 0.4422 0.4758 0.7356 -0.0840 0.0453 0.0375 392 PHE B CE1 6206 C CE2 . PHE B 333 ? 0.4689 0.5025 0.7768 -0.0864 0.0364 0.0350 392 PHE B CE2 6207 C CZ . PHE B 333 ? 0.3652 0.4004 0.6700 -0.0852 0.0413 0.0365 392 PHE B CZ 6208 N N . GLY B 334 ? 0.4406 0.4597 0.6863 -0.0837 0.0299 0.0322 393 GLY B N 6209 C CA . GLY B 334 ? 0.3566 0.3725 0.5918 -0.0835 0.0296 0.0320 393 GLY B CA 6210 C C . GLY B 334 ? 0.5445 0.5599 0.7681 -0.0822 0.0344 0.0329 393 GLY B C 6211 O O . GLY B 334 ? 0.5227 0.5358 0.7395 -0.0821 0.0367 0.0334 393 GLY B O 6212 N N . ARG B 335 ? 0.3539 0.3712 0.5750 -0.0811 0.0360 0.0329 394 ARG B N 6213 C CA . ARG B 335 ? 0.4438 0.4607 0.6538 -0.0796 0.0402 0.0335 394 ARG B CA 6214 C C . ARG B 335 ? 0.4351 0.4547 0.6491 -0.0788 0.0453 0.0348 394 ARG B C 6215 O O . ARG B 335 ? 0.5724 0.5943 0.7926 -0.0788 0.0436 0.0345 394 ARG B O 6216 C CB . ARG B 335 ? 0.4111 0.4269 0.6097 -0.0786 0.0362 0.0320 394 ARG B CB 6217 C CG . ARG B 335 ? 0.5360 0.5490 0.7294 -0.0791 0.0310 0.0309 394 ARG B CG 6218 C CD . ARG B 335 ? 0.5222 0.5328 0.7050 -0.0787 0.0338 0.0313 394 ARG B CD 6219 N NE . ARG B 335 ? 0.5407 0.5513 0.7122 -0.0771 0.0359 0.0311 394 ARG B NE 6220 C CZ . ARG B 335 ? 0.4767 0.4863 0.6390 -0.0764 0.0321 0.0299 394 ARG B CZ 6221 N NH1 . ARG B 335 ? 0.6912 0.6997 0.8541 -0.0769 0.0258 0.0288 394 ARG B NH1 6222 N NH2 . ARG B 335 ? 0.5616 0.5714 0.7144 -0.0750 0.0345 0.0298 394 ARG B NH2 6223 N N . SER B 336 ? 0.3983 0.4175 0.6086 -0.0779 0.0514 0.0361 395 SER B N 6224 C CA . SER B 336 ? 0.4289 0.4503 0.6421 -0.0768 0.0565 0.0375 395 SER B CA 6225 C C . SER B 336 ? 0.4651 0.4866 0.6669 -0.0750 0.0579 0.0371 395 SER B C 6226 O O . SER B 336 ? 0.6179 0.6414 0.8209 -0.0740 0.0611 0.0380 395 SER B O 6227 C CB . SER B 336 ? 0.5374 0.5583 0.7545 -0.0766 0.0628 0.0393 395 SER B CB 6228 O OG . SER B 336 ? 0.5097 0.5281 0.7160 -0.0757 0.0654 0.0393 395 SER B OG 6229 N N . ASP B 337 ? 0.4855 0.5048 0.6761 -0.0747 0.0553 0.0359 396 ASP B N 6230 C CA . ASP B 337 ? 0.4949 0.5141 0.6740 -0.0731 0.0566 0.0354 396 ASP B CA 6231 C C . ASP B 337 ? 0.6167 0.6360 0.7911 -0.0731 0.0509 0.0337 396 ASP B C 6232 O O . ASP B 337 ? 0.5911 0.6099 0.7552 -0.0719 0.0510 0.0330 396 ASP B O 6233 C CB . ASP B 337 ? 0.4447 0.4612 0.6134 -0.0724 0.0591 0.0354 396 ASP B CB 6234 C CG . ASP B 337 ? 0.6437 0.6578 0.8084 -0.0735 0.0543 0.0342 396 ASP B CG 6235 O OD1 . ASP B 337 ? 0.8082 0.8224 0.9804 -0.0749 0.0500 0.0338 396 ASP B OD1 6236 O OD2 . ASP B 337 ? 0.8345 0.8465 0.9885 -0.0728 0.0549 0.0337 396 ASP B OD2 6237 N N . PHE B 338 ? 0.4340 0.4539 0.6158 -0.0743 0.0460 0.0330 397 PHE B N 6238 C CA . PHE B 338 ? 0.4606 0.4804 0.6384 -0.0742 0.0403 0.0314 397 PHE B CA 6239 C C . PHE B 338 ? 0.4064 0.4284 0.5943 -0.0747 0.0374 0.0310 397 PHE B C 6240 O O . PHE B 338 ? 0.5929 0.6154 0.7911 -0.0759 0.0361 0.0312 397 PHE B O 6241 C CB . PHE B 338 ? 0.5439 0.5608 0.7169 -0.0748 0.0357 0.0303 397 PHE B CB 6242 C CG . PHE B 338 ? 0.5567 0.5732 0.7276 -0.0747 0.0294 0.0286 397 PHE B CG 6243 C CD1 . PHE B 338 ? 0.5970 0.6136 0.7594 -0.0734 0.0285 0.0278 397 PHE B CD1 6244 C CD2 . PHE B 338 ? 0.4112 0.4271 0.5888 -0.0756 0.0243 0.0278 397 PHE B CD2 6245 C CE1 . PHE B 338 ? 0.3457 0.3617 0.5060 -0.0731 0.0229 0.0264 397 PHE B CE1 6246 C CE2 . PHE B 338 ? 0.3481 0.3634 0.5236 -0.0752 0.0185 0.0263 397 PHE B CE2 6247 C CZ . PHE B 338 ? 0.4090 0.4243 0.5758 -0.0739 0.0179 0.0256 397 PHE B CZ 6248 N N . ASP B 339 ? 0.4435 0.4668 0.6282 -0.0738 0.0362 0.0303 398 ASP B N 6249 C CA . ASP B 339 ? 0.4530 0.4781 0.6454 -0.0740 0.0329 0.0296 398 ASP B CA 6250 C C . ASP B 339 ? 0.4549 0.4786 0.6418 -0.0737 0.0268 0.0277 398 ASP B C 6251 O O . ASP B 339 ? 0.7161 0.7389 0.8928 -0.0726 0.0265 0.0270 398 ASP B O 6252 C CB . ASP B 339 ? 0.3409 0.3686 0.5348 -0.0731 0.0364 0.0303 398 ASP B CB 6253 C CG . ASP B 339 ? 0.5566 0.5854 0.7537 -0.0729 0.0429 0.0323 398 ASP B CG 6254 O OD1 . ASP B 339 ? 0.5015 0.5298 0.7047 -0.0739 0.0444 0.0332 398 ASP B OD1 6255 O OD2 . ASP B 339 ? 0.4952 0.5252 0.6887 -0.0717 0.0465 0.0331 398 ASP B OD2 6256 N N . ASP B 340 ? 0.5825 0.6058 0.7761 -0.0745 0.0220 0.0267 399 ASP B N 6257 C CA . ASP B 340 ? 0.3439 0.3656 0.5330 -0.0739 0.0160 0.0249 399 ASP B CA 6258 C C . ASP B 340 ? 0.3426 0.3662 0.5350 -0.0733 0.0142 0.0240 399 ASP B C 6259 O O . ASP B 340 ? 0.4106 0.4354 0.6127 -0.0738 0.0117 0.0234 399 ASP B O 6260 C CB . ASP B 340 ? 0.4349 0.4548 0.6288 -0.0748 0.0113 0.0241 399 ASP B CB 6261 C CG . ASP B 340 ? 0.4668 0.4847 0.6554 -0.0740 0.0050 0.0223 399 ASP B CG 6262 O OD1 . ASP B 340 ? 0.5019 0.5191 0.6809 -0.0728 0.0047 0.0218 399 ASP B OD1 6263 O OD2 . ASP B 340 ? 0.5364 0.5533 0.7306 -0.0744 0.0005 0.0214 399 ASP B OD2 6264 N N . ASP B 341 ? 0.4031 0.4271 0.5874 -0.0721 0.0155 0.0238 400 ASP B N 6265 C CA . ASP B 341 ? 0.5568 0.5826 0.7428 -0.0713 0.0145 0.0231 400 ASP B CA 6266 C C . ASP B 341 ? 0.4859 0.5107 0.6730 -0.0708 0.0081 0.0211 400 ASP B C 6267 O O . ASP B 341 ? 0.5566 0.5828 0.7469 -0.0702 0.0067 0.0203 400 ASP B O 6268 C CB . ASP B 341 ? 0.4966 0.5227 0.6728 -0.0701 0.0173 0.0233 400 ASP B CB 6269 C CG . ASP B 341 ? 0.7461 0.7735 0.9218 -0.0702 0.0237 0.0251 400 ASP B CG 6270 O OD1 . ASP B 341 ? 0.7690 0.7955 0.9351 -0.0695 0.0261 0.0254 400 ASP B OD1 6271 O OD2 . ASP B 341 ? 0.7810 0.8103 0.9660 -0.0709 0.0264 0.0263 400 ASP B OD2 6272 N N . ASP B 342 ? 0.3420 0.3640 0.5260 -0.0709 0.0042 0.0203 401 ASP B N 6273 C CA . ASP B 342 ? 0.4466 0.4672 0.6320 -0.0702 -0.0021 0.0185 401 ASP B CA 6274 C C . ASP B 342 ? 0.5021 0.5245 0.7005 -0.0710 -0.0038 0.0180 401 ASP B C 6275 O O . ASP B 342 ? 0.5025 0.5248 0.7036 -0.0701 -0.0080 0.0164 401 ASP B O 6276 C CB . ASP B 342 ? 0.4316 0.4489 0.6116 -0.0702 -0.0057 0.0180 401 ASP B CB 6277 C CG . ASP B 342 ? 0.4695 0.4846 0.6364 -0.0689 -0.0065 0.0176 401 ASP B CG 6278 O OD1 . ASP B 342 ? 0.5101 0.5263 0.6716 -0.0683 -0.0033 0.0179 401 ASP B OD1 6279 O OD2 . ASP B 342 ? 0.4842 0.4965 0.6462 -0.0684 -0.0105 0.0169 401 ASP B OD2 6280 N N . ILE B 343 ? 0.3433 0.3671 0.5497 -0.0724 -0.0005 0.0194 402 ILE B N 6281 C CA . ILE B 343 ? 0.4896 0.5152 0.7090 -0.0733 -0.0018 0.0191 402 ILE B CA 6282 C C . ILE B 343 ? 0.5124 0.5409 0.7367 -0.0728 -0.0006 0.0189 402 ILE B C 6283 O O . ILE B 343 ? 0.4532 0.4826 0.6853 -0.0727 -0.0039 0.0176 402 ILE B O 6284 C CB . ILE B 343 ? 0.4946 0.5211 0.7211 -0.0749 0.0021 0.0208 402 ILE B CB 6285 C CG1 . ILE B 343 ? 0.5686 0.5921 0.7904 -0.0754 0.0009 0.0210 402 ILE B CG1 6286 C CG2 . ILE B 343 ? 0.3991 0.4275 0.6396 -0.0759 0.0009 0.0205 402 ILE B CG2 6287 C CD1 . ILE B 343 ? 0.3464 0.3704 0.5725 -0.0768 0.0056 0.0228 402 ILE B CD1 6288 N N . ILE B 344 ? 0.4700 0.4999 0.6895 -0.0724 0.0040 0.0200 403 ILE B N 6289 C CA . ILE B 344 ? 0.4924 0.5252 0.7160 -0.0720 0.0057 0.0201 403 ILE B CA 6290 C C . ILE B 344 ? 0.4758 0.5079 0.6923 -0.0704 0.0026 0.0184 403 ILE B C 6291 O O . ILE B 344 ? 0.7118 0.7459 0.9294 -0.0698 0.0039 0.0184 403 ILE B O 6292 C CB . ILE B 344 ? 0.4060 0.4407 0.6285 -0.0722 0.0123 0.0223 403 ILE B CB 6293 C CG1 . ILE B 344 ? 0.6385 0.6765 0.8691 -0.0722 0.0143 0.0229 403 ILE B CG1 6294 C CG2 . ILE B 344 ? 0.4516 0.4851 0.6613 -0.0711 0.0141 0.0225 403 ILE B CG2 6295 C CD1 . ILE B 344 ? 0.3490 0.3883 0.5926 -0.0733 0.0124 0.0225 403 ILE B CD1 6296 N N . LEU B 345 ? 0.5237 0.5528 0.7329 -0.0696 -0.0014 0.0171 404 LEU B N 6297 C CA . LEU B 345 ? 0.5860 0.6141 0.7885 -0.0679 -0.0047 0.0155 404 LEU B CA 6298 C C . LEU B 345 ? 0.5544 0.5837 0.7638 -0.0673 -0.0078 0.0139 404 LEU B C 6299 O O . LEU B 345 ? 0.6587 0.6886 0.8641 -0.0660 -0.0080 0.0131 404 LEU B O 6300 C CB . LEU B 345 ? 0.3923 0.4167 0.5871 -0.0672 -0.0089 0.0144 404 LEU B CB 6301 C CG . LEU B 345 ? 0.6090 0.6318 0.7919 -0.0668 -0.0066 0.0152 404 LEU B CG 6302 C CD1 . LEU B 345 ? 0.4134 0.4326 0.5893 -0.0659 -0.0113 0.0141 404 LEU B CD1 6303 C CD2 . LEU B 345 ? 0.3768 0.4007 0.5535 -0.0658 -0.0041 0.0152 404 LEU B CD2 6304 N N . PRO B 346 ? 0.5243 0.5542 0.7441 -0.0680 -0.0104 0.0132 405 PRO B N 6305 C CA . PRO B 346 ? 0.5182 0.5495 0.7448 -0.0673 -0.0131 0.0116 405 PRO B CA 6306 C C . PRO B 346 ? 0.6250 0.6596 0.8542 -0.0673 -0.0091 0.0125 405 PRO B C 6307 O O . PRO B 346 ? 0.3378 0.3729 0.5665 -0.0661 -0.0110 0.0111 405 PRO B O 6308 C CB . PRO B 346 ? 0.4095 0.4413 0.6477 -0.0684 -0.0152 0.0113 405 PRO B CB 6309 C CG . PRO B 346 ? 0.4493 0.4783 0.6836 -0.0689 -0.0166 0.0116 405 PRO B CG 6310 C CD . PRO B 346 ? 0.4149 0.4435 0.6397 -0.0691 -0.0120 0.0134 405 PRO B CD 6311 N N . LEU B 347 ? 0.5240 0.5605 0.7556 -0.0686 -0.0038 0.0147 406 LEU B N 6312 C CA . LEU B 347 ? 0.4274 0.4669 0.6606 -0.0685 0.0003 0.0158 406 LEU B CA 6313 C C . LEU B 347 ? 0.4596 0.4984 0.6818 -0.0671 0.0010 0.0155 406 LEU B C 6314 O O . LEU B 347 ? 0.5873 0.6277 0.8099 -0.0662 0.0011 0.0150 406 LEU B O 6315 C CB . LEU B 347 ? 0.4579 0.4990 0.6943 -0.0698 0.0060 0.0185 406 LEU B CB 6316 C CG . LEU B 347 ? 0.4079 0.4519 0.6451 -0.0696 0.0107 0.0200 406 LEU B CG 6317 C CD1 . LEU B 347 ? 0.3328 0.3792 0.5790 -0.0695 0.0092 0.0192 406 LEU B CD1 6318 C CD2 . LEU B 347 ? 0.4980 0.5431 0.7377 -0.0705 0.0162 0.0226 406 LEU B CD2 6319 N N . ARG B 348 ? 0.7647 0.8012 0.9772 -0.0667 0.0014 0.0158 407 ARG B N 6320 C CA . ARG B 348 ? 0.6479 0.6837 0.8497 -0.0655 0.0024 0.0156 407 ARG B CA 6321 C C . ARG B 348 ? 0.6005 0.6345 0.7981 -0.0639 -0.0025 0.0132 407 ARG B C 6322 O O . ARG B 348 ? 0.6119 0.6461 0.8041 -0.0628 -0.0019 0.0127 407 ARG B O 6323 C CB . ARG B 348 ? 0.4546 0.4885 0.6475 -0.0657 0.0045 0.0166 407 ARG B CB 6324 C CG . ARG B 348 ? 0.8586 0.8921 1.0411 -0.0645 0.0064 0.0166 407 ARG B CG 6325 C CD . ARG B 348 ? 0.9417 0.9783 1.1268 -0.0644 0.0103 0.0177 407 ARG B CD 6326 N NE . ARG B 348 ? 1.1796 1.2159 1.3565 -0.0631 0.0106 0.0170 407 ARG B NE 6327 C CZ . ARG B 348 ? 1.1829 1.2194 1.3599 -0.0621 0.0080 0.0155 407 ARG B CZ 6328 N NH1 . ARG B 348 ? 1.1022 1.1393 1.2874 -0.0622 0.0049 0.0144 407 ARG B NH1 6329 N NH2 . ARG B 348 ? 1.0653 1.1015 1.2346 -0.0610 0.0087 0.0150 407 ARG B NH2 6330 N N . GLN B 349 ? 0.5161 0.5480 0.7161 -0.0637 -0.0074 0.0117 408 GLN B N 6331 C CA . GLN B 349 ? 0.5366 0.5664 0.7324 -0.0619 -0.0122 0.0094 408 GLN B CA 6332 C C . GLN B 349 ? 0.6413 0.6727 0.8443 -0.0612 -0.0143 0.0079 408 GLN B C 6333 O O . GLN B 349 ? 0.8295 0.8604 1.0280 -0.0596 -0.0157 0.0066 408 GLN B O 6334 C CB . GLN B 349 ? 0.5320 0.5586 0.7267 -0.0616 -0.0168 0.0084 408 GLN B CB 6335 C CG . GLN B 349 ? 0.5638 0.5882 0.7490 -0.0618 -0.0157 0.0094 408 GLN B CG 6336 C CD . GLN B 349 ? 0.5990 0.6201 0.7828 -0.0613 -0.0204 0.0085 408 GLN B CD 6337 O OE1 . GLN B 349 ? 0.6351 0.6554 0.8241 -0.0606 -0.0249 0.0068 408 GLN B OE1 6338 N NE2 . GLN B 349 ? 0.3692 0.3885 0.5459 -0.0617 -0.0195 0.0095 408 GLN B NE2 6339 N N . CYS B 350 ? 0.5232 0.5565 0.7373 -0.0623 -0.0145 0.0081 409 CYS B N 6340 C CA . CYS B 350 ? 0.5448 0.5797 0.7665 -0.0617 -0.0167 0.0066 409 CYS B CA 6341 C C . CYS B 350 ? 0.6221 0.6603 0.8454 -0.0620 -0.0125 0.0077 409 CYS B C 6342 O O . CYS B 350 ? 0.4755 0.5144 0.6992 -0.0608 -0.0138 0.0063 409 CYS B O 6343 C CB . CYS B 350 ? 0.4540 0.4897 0.6874 -0.0629 -0.0187 0.0062 409 CYS B CB 6344 S SG . CYS B 350 ? 0.5421 0.5741 0.7746 -0.0627 -0.0237 0.0052 409 CYS B SG 6345 N N . CYS B 351 ? 0.5353 0.5752 0.7592 -0.0634 -0.0074 0.0101 410 CYS B N 6346 C CA . CYS B 351 ? 0.4113 0.4542 0.6365 -0.0636 -0.0030 0.0116 410 CYS B CA 6347 C C . CYS B 351 ? 0.5327 0.5784 0.7680 -0.0637 -0.0037 0.0110 410 CYS B C 6348 O O . CYS B 351 ? 0.5934 0.6408 0.8278 -0.0630 -0.0023 0.0110 410 CYS B O 6349 C CB . CYS B 351 ? 0.3484 0.3907 0.5630 -0.0622 -0.0020 0.0113 410 CYS B CB 6350 S SG . CYS B 351 ? 0.6323 0.6733 0.8364 -0.0625 0.0020 0.0132 410 CYS B SG 6351 N N . ILE B 352 ? 0.6441 0.6901 0.8890 -0.0646 -0.0060 0.0104 411 ILE B N 6352 C CA . ILE B 352 ? 0.5573 0.6063 0.8132 -0.0651 -0.0058 0.0103 411 ILE B CA 6353 C C . ILE B 352 ? 0.4949 0.5454 0.7593 -0.0670 -0.0027 0.0124 411 ILE B C 6354 O O . ILE B 352 ? 0.5690 0.6178 0.8326 -0.0679 -0.0028 0.0131 411 ILE B O 6355 C CB . ILE B 352 ? 0.5798 0.6279 0.8407 -0.0642 -0.0116 0.0073 411 ILE B CB 6356 C CG1 . ILE B 352 ? 0.5442 0.5905 0.8098 -0.0649 -0.0148 0.0066 411 ILE B CG1 6357 C CG2 . ILE B 352 ? 0.5776 0.6236 0.8294 -0.0620 -0.0146 0.0052 411 ILE B CG2 6358 C CD1 . ILE B 352 ? 0.5541 0.5999 0.8264 -0.0640 -0.0202 0.0038 411 ILE B CD1 6359 N N . LEU B 353 ? 0.5080 0.5617 0.7805 -0.0677 0.0000 0.0136 412 LEU B N 6360 C CA . LEU B 353 ? 0.3973 0.4526 0.6775 -0.0694 0.0038 0.0160 412 LEU B CA 6361 C C . LEU B 353 ? 0.5467 0.6054 0.8384 -0.0700 0.0048 0.0164 412 LEU B C 6362 O O . LEU B 353 ? 0.6550 0.7157 0.9461 -0.0693 0.0063 0.0168 412 LEU B O 6363 C CB . LEU B 353 ? 0.3504 0.4059 0.6238 -0.0696 0.0093 0.0187 412 LEU B CB 6364 C CG . LEU B 353 ? 0.4497 0.5067 0.7299 -0.0710 0.0140 0.0215 412 LEU B CG 6365 C CD1 . LEU B 353 ? 0.4017 0.4568 0.6854 -0.0721 0.0126 0.0213 412 LEU B CD1 6366 C CD2 . LEU B 353 ? 0.4402 0.4974 0.7128 -0.0706 0.0194 0.0238 412 LEU B CD2 6367 N N . ARG B 354 ? 0.5206 0.5798 0.8228 -0.0713 0.0037 0.0164 413 ARG B N 6368 C CA . ARG B 354 ? 0.5730 0.6354 0.8871 -0.0720 0.0047 0.0168 413 ARG B CA 6369 C C . ARG B 354 ? 0.6391 0.7039 0.9542 -0.0724 0.0109 0.0200 413 ARG B C 6370 O O . ARG B 354 ? 0.5530 0.6172 0.8656 -0.0730 0.0148 0.0223 413 ARG B O 6371 C CB . ARG B 354 ? 0.5839 0.6461 0.9086 -0.0735 0.0030 0.0165 413 ARG B CB 6372 C CG . ARG B 354 ? 0.5301 0.5953 0.8680 -0.0742 0.0031 0.0164 413 ARG B CG 6373 C CD . ARG B 354 ? 0.5135 0.5780 0.8612 -0.0755 0.0001 0.0153 413 ARG B CD 6374 N NE . ARG B 354 ? 0.5068 0.5698 0.8546 -0.0745 -0.0064 0.0118 413 ARG B NE 6375 C CZ . ARG B 354 ? 0.4638 0.5240 0.8108 -0.0746 -0.0103 0.0103 413 ARG B CZ 6376 N NH1 . ARG B 354 ? 0.4723 0.5310 0.8182 -0.0758 -0.0082 0.0120 413 ARG B NH1 6377 N NH2 . ARG B 354 ? 0.3927 0.4515 0.7397 -0.0733 -0.0162 0.0071 413 ARG B NH2 6378 N N . PRO B 355 ? 0.5720 0.6395 0.8902 -0.0718 0.0117 0.0201 414 PRO B N 6379 C CA . PRO B 355 ? 0.4328 0.5026 0.7509 -0.0717 0.0172 0.0230 414 PRO B CA 6380 C C . PRO B 355 ? 0.5195 0.5905 0.8457 -0.0731 0.0216 0.0258 414 PRO B C 6381 O O . PRO B 355 ? 0.4170 0.4883 0.7395 -0.0729 0.0265 0.0285 414 PRO B O 6382 C CB . PRO B 355 ? 0.5603 0.6329 0.8833 -0.0711 0.0158 0.0220 414 PRO B CB 6383 C CG . PRO B 355 ? 0.5515 0.6223 0.8709 -0.0702 0.0099 0.0184 414 PRO B CG 6384 C CD . PRO B 355 ? 0.6166 0.6849 0.9376 -0.0710 0.0071 0.0172 414 PRO B CD 6385 N N . SER B 356 ? 0.3887 0.4602 0.7257 -0.0743 0.0198 0.0251 415 SER B N 6386 C CA . SER B 356 ? 0.5358 0.6083 0.8814 -0.0757 0.0238 0.0277 415 SER B CA 6387 C C . SER B 356 ? 0.6318 0.7015 0.9709 -0.0760 0.0261 0.0290 415 SER B C 6388 O O . SER B 356 ? 0.5918 0.6620 0.9320 -0.0763 0.0313 0.0318 415 SER B O 6389 C CB . SER B 356 ? 0.3308 0.4041 0.6892 -0.0770 0.0208 0.0263 415 SER B CB 6390 O OG . SER B 356 ? 0.6261 0.6967 0.9825 -0.0771 0.0157 0.0236 415 SER B OG 6391 N N . THR B 357 ? 0.5415 0.6084 0.8738 -0.0758 0.0223 0.0269 416 THR B N 6392 C CA . THR B 357 ? 0.5724 0.6367 0.8975 -0.0760 0.0240 0.0278 416 THR B CA 6393 C C . THR B 357 ? 0.5555 0.6198 0.8709 -0.0749 0.0286 0.0299 416 THR B C 6394 O O . THR B 357 ? 0.4130 0.4765 0.7267 -0.0752 0.0329 0.0321 416 THR B O 6395 C CB . THR B 357 ? 0.4544 0.5157 0.7728 -0.0757 0.0186 0.0251 416 THR B CB 6396 O OG1 . THR B 357 ? 0.5490 0.6102 0.8765 -0.0765 0.0141 0.0231 416 THR B OG1 6397 C CG2 . THR B 357 ? 0.4291 0.4876 0.7403 -0.0760 0.0204 0.0261 416 THR B CG2 6398 N N . PHE B 358 ? 0.5765 0.6414 0.8856 -0.0737 0.0277 0.0291 417 PHE B N 6399 C CA . PHE B 358 ? 0.3945 0.4595 0.6942 -0.0725 0.0317 0.0308 417 PHE B CA 6400 C C . PHE B 358 ? 0.6120 0.6791 0.9166 -0.0725 0.0376 0.0340 417 PHE B C 6401 O O . PHE B 358 ? 0.5082 0.5743 0.8072 -0.0720 0.0417 0.0360 417 PHE B O 6402 C CB . PHE B 358 ? 0.4990 0.5646 0.7925 -0.0712 0.0295 0.0293 417 PHE B CB 6403 C CG . PHE B 358 ? 0.6577 0.7238 0.9428 -0.0700 0.0335 0.0311 417 PHE B CG 6404 C CD1 . PHE B 358 ? 0.5951 0.6589 0.8690 -0.0693 0.0343 0.0311 417 PHE B CD1 6405 C CD2 . PHE B 358 ? 0.5602 0.6290 0.8487 -0.0694 0.0365 0.0328 417 PHE B CD2 6406 C CE1 . PHE B 358 ? 0.6498 0.7140 0.9162 -0.0681 0.0379 0.0326 417 PHE B CE1 6407 C CE2 . PHE B 358 ? 0.5424 0.6115 0.8232 -0.0682 0.0401 0.0345 417 PHE B CE2 6408 C CZ . PHE B 358 ? 0.6338 0.7006 0.9036 -0.0675 0.0408 0.0343 417 PHE B CZ 6409 N N . GLN B 359 ? 0.5852 0.6549 0.9000 -0.0729 0.0379 0.0346 418 GLN B N 6410 C CA . GLN B 359 ? 0.6183 0.6900 0.9386 -0.0728 0.0434 0.0378 418 GLN B CA 6411 C C . GLN B 359 ? 0.6325 0.7030 0.9566 -0.0737 0.0466 0.0395 418 GLN B C 6412 O O . GLN B 359 ? 0.4554 0.5258 0.7770 -0.0730 0.0517 0.0420 418 GLN B O 6413 C CB . GLN B 359 ? 0.6907 0.7656 1.0221 -0.0732 0.0427 0.0378 418 GLN B CB 6414 C CG . GLN B 359 ? 0.7571 0.8336 1.0847 -0.0720 0.0413 0.0370 418 GLN B CG 6415 C CD . GLN B 359 ? 0.7944 0.8742 1.1328 -0.0723 0.0416 0.0377 418 GLN B CD 6416 O OE1 . GLN B 359 ? 0.7749 0.8554 1.1227 -0.0734 0.0388 0.0362 418 GLN B OE1 6417 N NE2 . GLN B 359 ? 0.7086 0.7903 1.0455 -0.0712 0.0451 0.0398 418 GLN B NE2 6418 N N . THR B 360 ? 0.5612 0.6308 0.8916 -0.0751 0.0435 0.0380 419 THR B N 6419 C CA . THR B 360 ? 0.4660 0.5340 0.7994 -0.0761 0.0459 0.0392 419 THR B CA 6420 C C . THR B 360 ? 0.4284 0.4937 0.7497 -0.0753 0.0479 0.0398 419 THR B C 6421 O O . THR B 360 ? 0.5848 0.6495 0.9055 -0.0750 0.0528 0.0421 419 THR B O 6422 C CB . THR B 360 ? 0.5765 0.6435 0.9167 -0.0776 0.0413 0.0371 419 THR B CB 6423 O OG1 . THR B 360 ? 0.3691 0.4387 0.7209 -0.0783 0.0394 0.0364 419 THR B OG1 6424 C CG2 . THR B 360 ? 0.3629 0.4282 0.7063 -0.0786 0.0441 0.0385 419 THR B CG2 6425 N N . LEU B 361 ? 0.3303 0.3940 0.6421 -0.0748 0.0441 0.0376 420 LEU B N 6426 C CA . LEU B 361 ? 0.4470 0.5082 0.7467 -0.0739 0.0456 0.0378 420 LEU B CA 6427 C C . LEU B 361 ? 0.5028 0.5648 0.7958 -0.0723 0.0502 0.0398 420 LEU B C 6428 O O . LEU B 361 ? 0.7870 0.8473 1.0713 -0.0716 0.0527 0.0405 420 LEU B O 6429 C CB . LEU B 361 ? 0.4513 0.5106 0.7427 -0.0737 0.0402 0.0349 420 LEU B CB 6430 C CG . LEU B 361 ? 0.4374 0.4949 0.7322 -0.0750 0.0356 0.0329 420 LEU B CG 6431 C CD1 . LEU B 361 ? 0.5038 0.5593 0.7896 -0.0743 0.0306 0.0303 420 LEU B CD1 6432 C CD2 . LEU B 361 ? 0.3578 0.4134 0.6530 -0.0758 0.0381 0.0342 420 LEU B CD2 6433 N N . MSE B 362 ? 0.5996 0.6643 0.8967 -0.0718 0.0513 0.0406 421 MSE B N 6434 C CA . MSE B 362 ? 0.6500 0.7156 0.9414 -0.0701 0.0555 0.0426 421 MSE B CA 6435 C C . MSE B 362 ? 0.8043 0.8708 1.1011 -0.0697 0.0615 0.0458 421 MSE B C 6436 O O . MSE B 362 ? 0.6429 0.7085 0.9330 -0.0684 0.0656 0.0474 421 MSE B O 6437 C CB . MSE B 362 ? 0.6742 0.7422 0.9662 -0.0695 0.0538 0.0420 421 MSE B CB 6438 C CG . MSE B 362 ? 0.9076 0.9768 1.1949 -0.0678 0.0580 0.0441 421 MSE B CG 6439 SE SE . MSE B 362 ? 1.9918 2.0583 2.2630 -0.0662 0.0598 0.0440 421 MSE B SE 6440 C CE . MSE B 362 ? 0.3234 0.3885 0.5879 -0.0668 0.0527 0.0400 421 MSE B CE 6441 N N . ASN B 363 ? 0.4454 0.5134 0.7542 -0.0708 0.0619 0.0466 422 ASN B N 6442 C CA . ASN B 363 ? 0.4460 0.5149 0.7612 -0.0704 0.0675 0.0497 422 ASN B CA 6443 C C . ASN B 363 ? 0.6396 0.7059 0.9515 -0.0702 0.0712 0.0509 422 ASN B C 6444 O O . ASN B 363 ? 0.8168 0.8830 1.1264 -0.0687 0.0763 0.0534 422 ASN B O 6445 C CB . ASN B 363 ? 0.5069 0.5778 0.8361 -0.0718 0.0668 0.0500 422 ASN B CB 6446 C CG . ASN B 363 ? 0.6227 0.6966 0.9559 -0.0715 0.0649 0.0497 422 ASN B CG 6447 O OD1 . ASN B 363 ? 0.6424 0.7170 0.9689 -0.0700 0.0658 0.0502 422 ASN B OD1 6448 N ND2 . ASN B 363 ? 0.6466 0.7221 0.9908 -0.0729 0.0624 0.0488 422 ASN B ND2 6449 N N . PHE B 364 ? 0.5519 0.6163 0.8637 -0.0715 0.0684 0.0492 423 PHE B N 6450 C CA . PHE B 364 ? 0.5225 0.5842 0.8306 -0.0715 0.0713 0.0500 423 PHE B CA 6451 C C . PHE B 364 ? 0.5703 0.6304 0.8649 -0.0698 0.0728 0.0499 423 PHE B C 6452 O O . PHE B 364 ? 0.6476 0.7064 0.9385 -0.0687 0.0774 0.0516 423 PHE B O 6453 C CB . PHE B 364 ? 0.4797 0.5396 0.7899 -0.0733 0.0673 0.0479 423 PHE B CB 6454 C CG . PHE B 364 ? 0.5006 0.5617 0.8245 -0.0750 0.0665 0.0481 423 PHE B CG 6455 C CD1 . PHE B 364 ? 0.5532 0.6151 0.8852 -0.0749 0.0715 0.0508 423 PHE B CD1 6456 C CD2 . PHE B 364 ? 0.4078 0.4693 0.7366 -0.0765 0.0607 0.0457 423 PHE B CD2 6457 C CE1 . PHE B 364 ? 0.4819 0.5450 0.8269 -0.0765 0.0709 0.0509 423 PHE B CE1 6458 C CE2 . PHE B 364 ? 0.3867 0.4493 0.7283 -0.0780 0.0598 0.0457 423 PHE B CE2 6459 C CZ . PHE B 364 ? 0.3971 0.4606 0.7470 -0.0781 0.0649 0.0484 423 PHE B CZ 6460 N N . TYR B 365 ? 0.6179 0.6779 0.9051 -0.0696 0.0687 0.0478 424 TYR B N 6461 C CA . TYR B 365 ? 0.6036 0.6620 0.8778 -0.0682 0.0695 0.0474 424 TYR B CA 6462 C C . TYR B 365 ? 0.6848 0.7443 0.9561 -0.0661 0.0746 0.0497 424 TYR B C 6463 O O . TYR B 365 ? 0.6521 0.7100 0.9152 -0.0648 0.0776 0.0503 424 TYR B O 6464 C CB . TYR B 365 ? 0.4281 0.4865 0.6962 -0.0684 0.0641 0.0447 424 TYR B CB 6465 C CG . TYR B 365 ? 0.6455 0.7024 0.9005 -0.0670 0.0646 0.0441 424 TYR B CG 6466 C CD1 . TYR B 365 ? 0.6555 0.7097 0.9036 -0.0669 0.0658 0.0439 424 TYR B CD1 6467 C CD2 . TYR B 365 ? 0.6223 0.6803 0.8719 -0.0659 0.0639 0.0437 424 TYR B CD2 6468 C CE1 . TYR B 365 ? 0.4681 0.5210 0.7044 -0.0657 0.0662 0.0432 424 TYR B CE1 6469 C CE2 . TYR B 365 ? 0.7260 0.7825 0.9638 -0.0647 0.0643 0.0430 424 TYR B CE2 6470 C CZ . TYR B 365 ? 0.7210 0.7751 0.9525 -0.0646 0.0654 0.0428 424 TYR B CZ 6471 O OH . TYR B 365 ? 0.6705 0.7233 0.8905 -0.0634 0.0659 0.0421 424 TYR B OH 6472 N N . SER B 366 ? 0.6996 0.7617 0.9777 -0.0658 0.0755 0.0510 425 SER B N 6473 C CA . SER B 366 ? 0.7076 0.7708 0.9833 -0.0637 0.0799 0.0533 425 SER B CA 6474 C C . SER B 366 ? 0.7318 0.7941 1.0100 -0.0627 0.0858 0.0559 425 SER B C 6475 O O . SER B 366 ? 0.7820 0.8443 1.0559 -0.0605 0.0899 0.0578 425 SER B O 6476 C CB . SER B 366 ? 0.6730 0.7393 0.9557 -0.0637 0.0792 0.0540 425 SER B CB 6477 O OG . SER B 366 ? 0.8386 0.9056 1.1197 -0.0646 0.0738 0.0514 425 SER B OG 6478 N N . THR B 367 ? 0.6669 0.7284 0.9521 -0.0641 0.0861 0.0561 426 THR B N 6479 C CA . THR B 367 ? 0.6417 0.7019 0.9290 -0.0632 0.0915 0.0583 426 THR B CA 6480 C C . THR B 367 ? 0.7132 0.7705 0.9969 -0.0641 0.0908 0.0570 426 THR B C 6481 O O . THR B 367 ? 0.6355 0.6925 0.9262 -0.0661 0.0887 0.0562 426 THR B O 6482 C CB . THR B 367 ? 0.6394 0.7013 0.9401 -0.0638 0.0938 0.0604 426 THR B CB 6483 O OG1 . THR B 367 ? 0.7282 0.7928 1.0320 -0.0628 0.0944 0.0617 426 THR B OG1 6484 C CG2 . THR B 367 ? 0.6735 0.7338 0.9758 -0.0625 0.0998 0.0629 426 THR B CG2 6485 N N . PRO B 368 ? 0.7057 0.7609 0.9785 -0.0627 0.0926 0.0567 427 PRO B N 6486 C CA . PRO B 368 ? 0.7420 0.7944 1.0098 -0.0634 0.0921 0.0555 427 PRO B CA 6487 C C . PRO B 368 ? 0.6886 0.7401 0.9650 -0.0643 0.0948 0.0568 427 PRO B C 6488 O O . PRO B 368 ? 0.6741 0.7263 0.9568 -0.0632 0.0993 0.0593 427 PRO B O 6489 C CB . PRO B 368 ? 0.7988 0.8495 1.0550 -0.0610 0.0955 0.0559 427 PRO B CB 6490 C CG . PRO B 368 ? 0.7574 0.8100 1.0102 -0.0597 0.0949 0.0560 427 PRO B CG 6491 C CD . PRO B 368 ? 0.7495 0.8048 1.0135 -0.0603 0.0950 0.0575 427 PRO B CD 6492 N N . LYS B 369 ? 0.6235 0.6733 0.9001 -0.0661 0.0918 0.0551 428 LYS B N 6493 C CA . LYS B 369 ? 0.5221 0.5707 0.8062 -0.0672 0.0936 0.0559 428 LYS B CA 6494 C C . LYS B 369 ? 0.6917 0.7425 0.9900 -0.0689 0.0926 0.0566 428 LYS B C 6495 O O . LYS B 369 ? 0.6495 0.6995 0.9552 -0.0700 0.0939 0.0572 428 LYS B O 6496 C CB . LYS B 369 ? 0.5217 0.5688 0.8041 -0.0652 0.1005 0.0583 428 LYS B CB 6497 C CG . LYS B 369 ? 0.5066 0.5515 0.7756 -0.0633 0.1024 0.0577 428 LYS B CG 6498 C CD . LYS B 369 ? 0.7344 0.7782 1.0030 -0.0608 0.1094 0.0603 428 LYS B CD 6499 C CE . LYS B 369 ? 0.8259 0.8673 1.0814 -0.0587 0.1117 0.0597 428 LYS B CE 6500 N NZ . LYS B 369 ? 0.9187 0.9574 1.1695 -0.0598 0.1106 0.0582 428 LYS B NZ 6501 N N . SER B 370 ? 0.6346 0.6881 0.9368 -0.0690 0.0902 0.0564 429 SER B N 6502 C CA . SER B 370 ? 0.5513 0.6071 0.8671 -0.0704 0.0895 0.0571 429 SER B CA 6503 C C . SER B 370 ? 0.4598 0.5154 0.7813 -0.0730 0.0840 0.0549 429 SER B C 6504 O O . SER B 370 ? 0.4762 0.5325 0.8090 -0.0743 0.0844 0.0555 429 SER B O 6505 C CB . SER B 370 ? 0.4276 0.4864 0.7455 -0.0697 0.0887 0.0576 429 SER B CB 6506 O OG . SER B 370 ? 0.5157 0.5749 0.8280 -0.0703 0.0831 0.0550 429 SER B OG 6507 N N . LEU B 371 ? 0.4395 0.4942 0.7534 -0.0735 0.0789 0.0522 430 LEU B N 6508 C CA . LEU B 371 ? 0.6322 0.6865 0.9505 -0.0757 0.0733 0.0499 430 LEU B CA 6509 C C . LEU B 371 ? 0.5868 0.6388 0.9082 -0.0767 0.0746 0.0502 430 LEU B C 6510 O O . LEU B 371 ? 0.3826 0.4351 0.7146 -0.0784 0.0731 0.0500 430 LEU B O 6511 C CB . LEU B 371 ? 0.6716 0.7248 0.9796 -0.0756 0.0681 0.0472 430 LEU B CB 6512 C CG . LEU B 371 ? 0.5745 0.6266 0.8852 -0.0774 0.0620 0.0447 430 LEU B CG 6513 C CD1 . LEU B 371 ? 0.3381 0.3927 0.6607 -0.0786 0.0588 0.0440 430 LEU B CD1 6514 C CD2 . LEU B 371 ? 0.5435 0.5940 0.8426 -0.0770 0.0576 0.0425 430 LEU B CD2 6515 N N . THR B 372 ? 0.5001 0.5495 0.8120 -0.0757 0.0775 0.0507 431 THR B N 6516 C CA . THR B 372 ? 0.6446 0.6916 0.9578 -0.0766 0.0791 0.0510 431 THR B CA 6517 C C . THR B 372 ? 0.5386 0.5863 0.8622 -0.0765 0.0846 0.0536 431 THR B C 6518 O O . THR B 372 ? 0.6871 0.7337 1.0169 -0.0778 0.0851 0.0538 431 THR B O 6519 C CB . THR B 372 ? 0.6663 0.7105 0.9662 -0.0753 0.0811 0.0508 431 THR B CB 6520 O OG1 . THR B 372 ? 0.7792 0.8239 1.0739 -0.0730 0.0861 0.0526 431 THR B OG1 6521 C CG2 . THR B 372 ? 0.4477 0.4910 0.7381 -0.0756 0.0754 0.0482 431 THR B CG2 6522 N N . LYS B 373 ? 0.5918 0.6413 0.9171 -0.0749 0.0887 0.0556 432 LYS B N 6523 C CA . LYS B 373 ? 0.5921 0.6424 0.9279 -0.0747 0.0938 0.0583 432 LYS B CA 6524 C C . LYS B 373 ? 0.5128 0.5654 0.8622 -0.0768 0.0905 0.0577 432 LYS B C 6525 O O . LYS B 373 ? 0.4431 0.4956 0.8024 -0.0778 0.0925 0.0588 432 LYS B O 6526 C CB . LYS B 373 ? 0.6679 0.7196 1.0018 -0.0722 0.0986 0.0606 432 LYS B CB 6527 C CG . LYS B 373 ? 0.7006 0.7498 1.0256 -0.0699 0.1042 0.0621 432 LYS B CG 6528 C CD . LYS B 373 ? 0.8045 0.8549 1.1255 -0.0672 0.1079 0.0639 432 LYS B CD 6529 C CE . LYS B 373 ? 0.7550 0.8028 1.0670 -0.0647 0.1134 0.0652 432 LYS B CE 6530 N NZ . LYS B 373 ? 0.6002 0.6490 0.9087 -0.0618 0.1171 0.0671 432 LYS B NZ 6531 N N . ALA B 374 ? 0.5169 0.5716 0.8667 -0.0773 0.0855 0.0560 433 ALA B N 6532 C CA . ALA B 374 ? 0.3855 0.4423 0.7472 -0.0792 0.0816 0.0550 433 ALA B CA 6533 C C . ALA B 374 ? 0.4641 0.5193 0.8292 -0.0813 0.0776 0.0530 433 ALA B C 6534 O O . ALA B 374 ? 0.6159 0.6723 0.9928 -0.0829 0.0757 0.0526 433 ALA B O 6535 C CB . ALA B 374 ? 0.3547 0.4138 0.7143 -0.0790 0.0772 0.0534 433 ALA B CB 6536 N N . LEU B 375 ? 0.6560 0.7084 1.0105 -0.0812 0.0759 0.0517 434 LEU B N 6537 C CA . LEU B 375 ? 0.6015 0.6520 0.9577 -0.0829 0.0723 0.0499 434 LEU B CA 6538 C C . LEU B 375 ? 0.5688 0.6176 0.9303 -0.0835 0.0769 0.0517 434 LEU B C 6539 O O . LEU B 375 ? 0.4425 0.4912 0.8134 -0.0853 0.0749 0.0511 434 LEU B O 6540 C CB . LEU B 375 ? 0.5076 0.5556 0.8501 -0.0825 0.0689 0.0480 434 LEU B CB 6541 C CG . LEU B 375 ? 0.5996 0.6452 0.9418 -0.0840 0.0651 0.0463 434 LEU B CG 6542 C CD1 . LEU B 375 ? 0.3477 0.3946 0.6995 -0.0857 0.0591 0.0443 434 LEU B CD1 6543 C CD2 . LEU B 375 ? 0.3476 0.3907 0.6751 -0.0833 0.0628 0.0449 434 LEU B CD2 6544 N N . HIS B 376 ? 0.5022 0.5498 0.8579 -0.0818 0.0829 0.0538 435 HIS B N 6545 C CA . HIS B 376 ? 0.4316 0.4771 0.7902 -0.0819 0.0878 0.0554 435 HIS B CA 6546 C C . HIS B 376 ? 0.6002 0.6471 0.9741 -0.0830 0.0902 0.0570 435 HIS B C 6547 O O . HIS B 376 ? 0.6031 0.6485 0.9826 -0.0845 0.0902 0.0568 435 HIS B O 6548 C CB . HIS B 376 ? 0.5888 0.6330 0.9388 -0.0794 0.0943 0.0575 435 HIS B CB 6549 C CG . HIS B 376 ? 0.6629 0.7046 1.0138 -0.0792 0.0993 0.0590 435 HIS B CG 6550 N ND1 . HIS B 376 ? 0.7319 0.7706 1.0766 -0.0799 0.0978 0.0576 435 HIS B ND1 6551 C CD2 . HIS B 376 ? 0.5804 0.6218 0.9372 -0.0781 0.1058 0.0617 435 HIS B CD2 6552 C CE1 . HIS B 376 ? 0.6221 0.6589 0.9689 -0.0795 0.1032 0.0593 435 HIS B CE1 6553 N NE2 . HIS B 376 ? 0.6056 0.6438 0.9596 -0.0783 0.1082 0.0618 435 HIS B NE2 6554 N N . GLU B 377 ? 0.5191 0.5688 0.8998 -0.0824 0.0924 0.0585 436 GLU B N 6555 C CA . GLU B 377 ? 0.5712 0.6225 0.9668 -0.0833 0.0950 0.0602 436 GLU B CA 6556 C C . GLU B 377 ? 0.4293 0.4816 0.8349 -0.0859 0.0893 0.0581 436 GLU B C 6557 O O . GLU B 377 ? 0.6073 0.6595 1.0240 -0.0873 0.0907 0.0587 436 GLU B O 6558 C CB . GLU B 377 ? 0.6107 0.6649 1.0106 -0.0818 0.0981 0.0623 436 GLU B CB 6559 C CG . GLU B 377 ? 0.8184 0.8760 1.2265 -0.0830 0.0933 0.0610 436 GLU B CG 6560 C CD . GLU B 377 ? 1.1241 1.1821 1.5222 -0.0827 0.0880 0.0586 436 GLU B CD 6561 O OE1 . GLU B 377 ? 1.1838 1.2397 1.5691 -0.0815 0.0884 0.0582 436 GLU B OE1 6562 O OE2 . GLU B 377 ? 1.1401 1.2006 1.5433 -0.0835 0.0835 0.0571 436 GLU B OE2 6563 N N . SER B 378 ? 0.5451 0.5982 0.9471 -0.0865 0.0828 0.0554 437 SER B N 6564 C CA . SER B 378 ? 0.3507 0.4047 0.7612 -0.0887 0.0767 0.0530 437 SER B CA 6565 C C . SER B 378 ? 0.6003 0.6512 1.0095 -0.0899 0.0753 0.0520 437 SER B C 6566 O O . SER B 378 ? 0.5652 0.6162 0.9853 -0.0917 0.0739 0.0516 437 SER B O 6567 C CB . SER B 378 ? 0.3912 0.4464 0.7966 -0.0886 0.0703 0.0504 437 SER B CB 6568 O OG . SER B 378 ? 0.4904 0.5465 0.9051 -0.0904 0.0645 0.0481 437 SER B OG 6569 N N . LEU B 379 ? 0.3747 0.4228 0.7704 -0.0890 0.0755 0.0516 438 LEU B N 6570 C CA . LEU B 379 ? 0.4912 0.5362 0.8840 -0.0901 0.0742 0.0507 438 LEU B CA 6571 C C . LEU B 379 ? 0.4984 0.5423 0.8988 -0.0905 0.0800 0.0529 438 LEU B C 6572 O O . LEU B 379 ? 0.6753 0.7176 1.0803 -0.0921 0.0785 0.0522 438 LEU B O 6573 C CB . LEU B 379 ? 0.5832 0.6255 0.9595 -0.0887 0.0741 0.0501 438 LEU B CB 6574 C CG . LEU B 379 ? 0.4329 0.4755 0.8003 -0.0883 0.0680 0.0477 438 LEU B CG 6575 C CD1 . LEU B 379 ? 0.3534 0.3935 0.7049 -0.0869 0.0691 0.0475 438 LEU B CD1 6576 C CD2 . LEU B 379 ? 0.4265 0.4688 0.7986 -0.0901 0.0609 0.0451 438 LEU B CD2 6577 N N . SER B 380 ? 0.5058 0.5504 0.9073 -0.0890 0.0867 0.0556 439 SER B N 6578 C CA . SER B 380 ? 0.5362 0.5796 0.9442 -0.0890 0.0929 0.0579 439 SER B CA 6579 C C . SER B 380 ? 0.6265 0.6713 1.0510 -0.0911 0.0921 0.0580 439 SER B C 6580 O O . SER B 380 ? 0.6995 0.7425 1.1292 -0.0919 0.0953 0.0590 439 SER B O 6581 C CB . SER B 380 ? 0.5751 0.6193 0.9816 -0.0866 0.0999 0.0608 439 SER B CB 6582 O OG . SER B 380 ? 0.7378 0.7855 1.1528 -0.0866 0.0994 0.0615 439 SER B OG 6583 N N . LYS B 381 ? 0.3586 0.4065 0.7914 -0.0921 0.0878 0.0569 440 LYS B N 6584 C CA . LYS B 381 ? 0.5214 0.5708 0.9703 -0.0941 0.0868 0.0568 440 LYS B CA 6585 C C . LYS B 381 ? 0.4818 0.5295 0.9328 -0.0962 0.0813 0.0543 440 LYS B C 6586 O O . LYS B 381 ? 0.6209 0.6690 1.0845 -0.0979 0.0808 0.0541 440 LYS B O 6587 C CB . LYS B 381 ? 0.5629 0.6163 1.0200 -0.0943 0.0841 0.0563 440 LYS B CB 6588 C CG . LYS B 381 ? 0.5838 0.6382 1.0379 -0.0950 0.0760 0.0530 440 LYS B CG 6589 C CD . LYS B 381 ? 0.6975 0.7557 1.1597 -0.0950 0.0743 0.0527 440 LYS B CD 6590 C CE . LYS B 381 ? 0.7851 0.8442 1.2389 -0.0943 0.0684 0.0503 440 LYS B CE 6591 N NZ . LYS B 381 ? 0.7427 0.8054 1.2026 -0.0939 0.0679 0.0505 440 LYS B NZ 6592 N N . ASP B 382 ? 0.4529 0.4986 0.8915 -0.0959 0.0772 0.0523 441 ASP B N 6593 C CA . ASP B 382 ? 0.4325 0.4762 0.8712 -0.0975 0.0721 0.0501 441 ASP B CA 6594 C C . ASP B 382 ? 0.4998 0.5405 0.9382 -0.0978 0.0769 0.0517 441 ASP B C 6595 O O . ASP B 382 ? 0.5319 0.5708 0.9608 -0.0962 0.0821 0.0533 441 ASP B O 6596 C CB . ASP B 382 ? 0.3614 0.4036 0.7863 -0.0969 0.0666 0.0478 441 ASP B CB 6597 C CG . ASP B 382 ? 0.4754 0.5157 0.9009 -0.0984 0.0604 0.0454 441 ASP B CG 6598 O OD1 . ASP B 382 ? 0.5159 0.5532 0.9374 -0.0988 0.0620 0.0458 441 ASP B OD1 6599 O OD2 . ASP B 382 ? 0.4127 0.4543 0.8425 -0.0991 0.0540 0.0431 441 ASP B OD2 6600 N N . PRO B 383 ? 0.3667 0.4066 0.8153 -0.0998 0.0753 0.0510 442 PRO B N 6601 C CA . PRO B 383 ? 0.4318 0.4691 0.8822 -0.1004 0.0801 0.0525 442 PRO B CA 6602 C C . PRO B 383 ? 0.4256 0.4591 0.8607 -0.0995 0.0805 0.0522 442 PRO B C 6603 O O . PRO B 383 ? 0.6048 0.6359 1.0385 -0.0993 0.0858 0.0538 442 PRO B O 6604 C CB . PRO B 383 ? 0.3707 0.4082 0.8341 -0.1028 0.0759 0.0510 442 PRO B CB 6605 C CG . PRO B 383 ? 0.4240 0.4652 0.8962 -0.1034 0.0712 0.0496 442 PRO B CG 6606 C CD . PRO B 383 ? 0.3664 0.4083 0.8263 -0.1016 0.0689 0.0488 442 PRO B CD 6607 N N . ALA B 384 ? 0.5057 0.5387 0.9296 -0.0990 0.0752 0.0502 443 ALA B N 6608 C CA . ALA B 384 ? 0.3700 0.3996 0.7794 -0.0983 0.0749 0.0496 443 ALA B CA 6609 C C . ALA B 384 ? 0.4571 0.4862 0.8527 -0.0959 0.0785 0.0507 443 ALA B C 6610 O O . ALA B 384 ? 0.5308 0.5576 0.9131 -0.0951 0.0774 0.0499 443 ALA B O 6611 C CB . ALA B 384 ? 0.3699 0.3986 0.7751 -0.0992 0.0665 0.0467 443 ALA B CB 6612 N N . HIS B 385 ? 0.4105 0.4420 0.8094 -0.0947 0.0827 0.0524 444 HIS B N 6613 C CA . HIS B 385 ? 0.3660 0.3973 0.7527 -0.0922 0.0862 0.0534 444 HIS B CA 6614 C C . HIS B 385 ? 0.4640 0.4920 0.8421 -0.0910 0.0920 0.0547 444 HIS B C 6615 O O . HIS B 385 ? 0.4915 0.5181 0.8761 -0.0918 0.0955 0.0559 444 HIS B O 6616 C CB . HIS B 385 ? 0.4200 0.4544 0.8130 -0.0911 0.0901 0.0552 444 HIS B CB 6617 C CG . HIS B 385 ? 0.6784 0.7125 1.0794 -0.0906 0.0975 0.0580 444 HIS B CG 6618 N ND1 . HIS B 385 ? 0.9496 0.9844 1.3653 -0.0924 0.0982 0.0586 444 HIS B ND1 6619 C CD2 . HIS B 385 ? 0.6391 0.6722 1.0354 -0.0884 0.1047 0.0604 444 HIS B CD2 6620 C CE1 . HIS B 385 ? 0.7822 0.8164 1.2019 -0.0913 0.1056 0.0613 444 HIS B CE1 6621 N NE2 . HIS B 385 ? 0.7828 0.8159 1.1908 -0.0888 0.1096 0.0624 444 HIS B NE2 6622 N N . PRO B 386 ? 0.3944 0.4210 0.7577 -0.0891 0.0930 0.0546 445 PRO B N 6623 C CA . PRO B 386 ? 0.5339 0.5619 0.8883 -0.0881 0.0894 0.0533 445 PRO B CA 6624 C C . PRO B 386 ? 0.5416 0.5693 0.8926 -0.0895 0.0811 0.0505 445 PRO B C 6625 O O . PRO B 386 ? 0.5475 0.5726 0.8944 -0.0904 0.0789 0.0495 445 PRO B O 6626 C CB . PRO B 386 ? 0.3648 0.3906 0.7048 -0.0858 0.0937 0.0540 445 PRO B CB 6627 C CG . PRO B 386 ? 0.3676 0.3901 0.7061 -0.0862 0.0966 0.0545 445 PRO B CG 6628 C CD . PRO B 386 ? 0.3689 0.3923 0.7232 -0.0877 0.0985 0.0557 445 PRO B CD 6629 N N . ILE B 387 ? 0.5284 0.5587 0.8812 -0.0896 0.0767 0.0494 446 ILE B N 6630 C CA . ILE B 387 ? 0.5438 0.5740 0.8939 -0.0906 0.0689 0.0467 446 ILE B CA 6631 C C . ILE B 387 ? 0.4486 0.4772 0.7825 -0.0892 0.0670 0.0456 446 ILE B C 6632 O O . ILE B 387 ? 0.4771 0.5036 0.8047 -0.0898 0.0624 0.0439 446 ILE B O 6633 C CB . ILE B 387 ? 0.4331 0.4666 0.7922 -0.0912 0.0648 0.0458 446 ILE B CB 6634 C CG1 . ILE B 387 ? 0.3915 0.4268 0.7671 -0.0925 0.0667 0.0468 446 ILE B CG1 6635 C CG2 . ILE B 387 ? 0.4231 0.4562 0.7796 -0.0920 0.0567 0.0429 446 ILE B CG2 6636 C CD1 . ILE B 387 ? 0.4030 0.4364 0.7851 -0.0944 0.0652 0.0463 446 ILE B CD1 6637 N N . LEU B 388 ? 0.4047 0.4342 0.7319 -0.0874 0.0707 0.0467 447 LEU B N 6638 C CA . LEU B 388 ? 0.4521 0.4802 0.7642 -0.0859 0.0695 0.0457 447 LEU B CA 6639 C C . LEU B 388 ? 0.3589 0.3852 0.6620 -0.0842 0.0760 0.0473 447 LEU B C 6640 O O . LEU B 388 ? 0.6427 0.6698 0.9507 -0.0833 0.0820 0.0494 447 LEU B O 6641 C CB . LEU B 388 ? 0.3557 0.3864 0.6660 -0.0851 0.0672 0.0451 447 LEU B CB 6642 C CG . LEU B 388 ? 0.4532 0.4854 0.7686 -0.0862 0.0600 0.0430 447 LEU B CG 6643 C CD1 . LEU B 388 ? 0.3524 0.3872 0.6665 -0.0851 0.0592 0.0428 447 LEU B CD1 6644 C CD2 . LEU B 388 ? 0.4714 0.5010 0.7783 -0.0867 0.0543 0.0409 447 LEU B CD2 6645 N N . ALA B 389 ? 0.4820 0.5059 0.7721 -0.0835 0.0749 0.0463 448 ALA B N 6646 C CA . ALA B 389 ? 0.5036 0.5260 0.7834 -0.0815 0.0805 0.0474 448 ALA B CA 6647 C C . ALA B 389 ? 0.5175 0.5421 0.7947 -0.0797 0.0825 0.0480 448 ALA B C 6648 O O . ALA B 389 ? 0.6289 0.6553 0.9054 -0.0799 0.0780 0.0468 448 ALA B O 6649 C CB . ALA B 389 ? 0.3602 0.3798 0.6263 -0.0812 0.0782 0.0460 448 ALA B CB 6650 N N . TYR B 390 ? 0.5347 0.5592 0.8104 -0.0779 0.0892 0.0499 449 TYR B N 6651 C CA . TYR B 390 ? 0.6453 0.6721 0.9204 -0.0761 0.0917 0.0509 449 TYR B CA 6652 C C . TYR B 390 ? 0.5440 0.5708 0.8066 -0.0750 0.0890 0.0494 449 TYR B C 6653 O O . TYR B 390 ? 0.5699 0.5989 0.8323 -0.0741 0.0889 0.0496 449 TYR B O 6654 C CB . TYR B 390 ? 0.5292 0.5553 0.8045 -0.0741 0.0995 0.0532 449 TYR B CB 6655 C CG . TYR B 390 ? 0.5875 0.6138 0.8759 -0.0750 0.1029 0.0550 449 TYR B CG 6656 C CD1 . TYR B 390 ? 0.4770 0.5054 0.7780 -0.0771 0.0994 0.0548 449 TYR B CD1 6657 C CD2 . TYR B 390 ? 0.5774 0.6017 0.8654 -0.0735 0.1095 0.0567 449 TYR B CD2 6658 C CE1 . TYR B 390 ? 0.6088 0.6374 0.9221 -0.0780 0.1025 0.0564 449 TYR B CE1 6659 C CE2 . TYR B 390 ? 0.4798 0.5042 0.7799 -0.0743 0.1127 0.0584 449 TYR B CE2 6660 C CZ . TYR B 390 ? 0.6172 0.6438 0.9300 -0.0766 0.1092 0.0582 449 TYR B CZ 6661 O OH . TYR B 390 ? 0.6961 0.7228 1.0212 -0.0774 0.1124 0.0599 449 TYR B OH 6662 N N . LYS B 391 ? 0.3545 0.3788 0.6067 -0.0751 0.0869 0.0480 450 LYS B N 6663 C CA . LYS B 391 ? 0.3906 0.4146 0.6304 -0.0740 0.0844 0.0465 450 LYS B CA 6664 C C . LYS B 391 ? 0.4385 0.4644 0.6803 -0.0751 0.0780 0.0450 450 LYS B C 6665 O O . LYS B 391 ? 0.6003 0.6266 0.8337 -0.0741 0.0762 0.0440 450 LYS B O 6666 C CB . LYS B 391 ? 0.3545 0.3754 0.5835 -0.0741 0.0832 0.0453 450 LYS B CB 6667 C CG . LYS B 391 ? 0.5513 0.5709 0.7846 -0.0763 0.0789 0.0444 450 LYS B CG 6668 C CD . LYS B 391 ? 0.3574 0.3738 0.5790 -0.0762 0.0778 0.0433 450 LYS B CD 6669 C CE . LYS B 391 ? 0.5199 0.5347 0.7462 -0.0782 0.0747 0.0428 450 LYS B CE 6670 N NZ . LYS B 391 ? 0.3607 0.3724 0.5751 -0.0781 0.0730 0.0416 450 LYS B NZ 6671 N N . HIS B 392 ? 0.4726 0.4997 0.7255 -0.0770 0.0747 0.0447 451 HIS B N 6672 C CA . HIS B 392 ? 0.4613 0.4901 0.7170 -0.0778 0.0687 0.0432 451 HIS B CA 6673 C C . HIS B 392 ? 0.5277 0.5596 0.7882 -0.0770 0.0702 0.0441 451 HIS B C 6674 O O . HIS B 392 ? 0.6644 0.6977 0.9240 -0.0770 0.0662 0.0428 451 HIS B O 6675 C CB . HIS B 392 ? 0.3805 0.4094 0.6464 -0.0800 0.0643 0.0424 451 HIS B CB 6676 C CG . HIS B 392 ? 0.4510 0.4770 0.7115 -0.0809 0.0611 0.0411 451 HIS B CG 6677 N ND1 . HIS B 392 ? 0.3526 0.3775 0.6056 -0.0810 0.0552 0.0391 451 HIS B ND1 6678 C CD2 . HIS B 392 ? 0.5035 0.5272 0.7648 -0.0816 0.0629 0.0417 451 HIS B CD2 6679 C CE1 . HIS B 392 ? 0.4173 0.4395 0.6667 -0.0818 0.0534 0.0385 451 HIS B CE1 6680 N NE2 . HIS B 392 ? 0.6052 0.6267 0.8594 -0.0822 0.0580 0.0400 451 HIS B NE2 6681 N N . TYR B 393 ? 0.5528 0.5856 0.8183 -0.0761 0.0762 0.0462 452 TYR B N 6682 C CA . TYR B 393 ? 0.5200 0.5556 0.7902 -0.0752 0.0782 0.0474 452 TYR B CA 6683 C C . TYR B 393 ? 0.4146 0.4507 0.6740 -0.0734 0.0783 0.0469 452 TYR B C 6684 O O . TYR B 393 ? 0.3431 0.3813 0.6042 -0.0734 0.0756 0.0463 452 TYR B O 6685 C CB . TYR B 393 ? 0.5720 0.6081 0.8489 -0.0743 0.0850 0.0500 452 TYR B CB 6686 C CG . TYR B 393 ? 0.4812 0.5175 0.7711 -0.0761 0.0851 0.0507 452 TYR B CG 6687 C CD1 . TYR B 393 ? 0.5600 0.5975 0.8577 -0.0781 0.0795 0.0493 452 TYR B CD1 6688 C CD2 . TYR B 393 ? 0.6000 0.6354 0.8945 -0.0756 0.0910 0.0528 452 TYR B CD2 6689 C CE1 . TYR B 393 ? 0.5683 0.6060 0.8781 -0.0798 0.0796 0.0498 452 TYR B CE1 6690 C CE2 . TYR B 393 ? 0.6070 0.6426 0.9137 -0.0773 0.0913 0.0534 452 TYR B CE2 6691 C CZ . TYR B 393 ? 0.5323 0.5691 0.8467 -0.0794 0.0855 0.0519 452 TYR B CZ 6692 O OH . TYR B 393 ? 0.5494 0.5866 0.8763 -0.0811 0.0857 0.0524 452 TYR B OH 6693 N N . PRO B 394 ? 0.5308 0.5649 0.7791 -0.0718 0.0813 0.0471 453 PRO B N 6694 C CA . PRO B 394 ? 0.6339 0.6686 0.8725 -0.0702 0.0809 0.0464 453 PRO B CA 6695 C C . PRO B 394 ? 0.7514 0.7859 0.9850 -0.0712 0.0743 0.0440 453 PRO B C 6696 O O . PRO B 394 ? 0.8346 0.8704 1.0640 -0.0704 0.0729 0.0434 453 PRO B O 6697 C CB . PRO B 394 ? 0.4710 0.5033 0.6991 -0.0685 0.0851 0.0468 453 PRO B CB 6698 C CG . PRO B 394 ? 0.4649 0.4950 0.6949 -0.0696 0.0857 0.0468 453 PRO B CG 6699 C CD . PRO B 394 ? 0.4210 0.4524 0.6651 -0.0713 0.0853 0.0478 453 PRO B CD 6700 N N . ALA B 395 ? 0.7661 0.7990 1.0000 -0.0728 0.0704 0.0427 454 ALA B N 6701 C CA . ALA B 395 ? 0.5313 0.5638 0.7609 -0.0736 0.0639 0.0405 454 ALA B CA 6702 C C . ALA B 395 ? 0.6358 0.6709 0.8735 -0.0742 0.0604 0.0399 454 ALA B C 6703 O O . ALA B 395 ? 0.4879 0.5235 0.7206 -0.0738 0.0570 0.0386 454 ALA B O 6704 C CB . ALA B 395 ? 0.5181 0.5482 0.7475 -0.0750 0.0606 0.0394 454 ALA B CB 6705 N N . MSE B 396 ? 0.7992 0.8357 1.0492 -0.0752 0.0612 0.0409 455 MSE B N 6706 C CA . MSE B 396 ? 0.6927 0.7317 0.9512 -0.0758 0.0580 0.0403 455 MSE B CA 6707 C C . MSE B 396 ? 0.8217 0.8630 1.0787 -0.0744 0.0605 0.0412 455 MSE B C 6708 O O . MSE B 396 ? 0.6175 0.6604 0.8760 -0.0744 0.0571 0.0401 455 MSE B O 6709 C CB . MSE B 396 ? 0.4444 0.4846 0.7168 -0.0773 0.0587 0.0413 455 MSE B CB 6710 C CG . MSE B 396 ? 0.7060 0.7440 0.9809 -0.0788 0.0559 0.0403 455 MSE B CG 6711 SE SE . MSE B 396 ? 1.1602 1.1997 1.4533 -0.0806 0.0570 0.0415 455 MSE B SE 6712 C CE . MSE B 396 ? 0.3937 0.4365 0.6948 -0.0810 0.0520 0.0401 455 MSE B CE 6713 N N . GLU B 397 ? 0.6534 0.6946 0.9072 -0.0730 0.0663 0.0431 456 GLU B N 6714 C CA . GLU B 397 ? 0.6188 0.6619 0.8698 -0.0713 0.0689 0.0440 456 GLU B CA 6715 C C . GLU B 397 ? 0.5726 0.6149 0.8117 -0.0705 0.0662 0.0423 456 GLU B C 6716 O O . GLU B 397 ? 0.6742 0.7182 0.9121 -0.0699 0.0648 0.0419 456 GLU B O 6717 C CB . GLU B 397 ? 0.6534 0.6963 0.9038 -0.0698 0.0757 0.0463 456 GLU B CB 6718 C CG . GLU B 397 ? 0.5349 0.5787 0.7974 -0.0704 0.0790 0.0483 456 GLU B CG 6719 C CD . GLU B 397 ? 0.5714 0.6183 0.8436 -0.0707 0.0783 0.0490 456 GLU B CD 6720 O OE1 . GLU B 397 ? 0.6824 0.7308 0.9510 -0.0697 0.0775 0.0487 456 GLU B OE1 6721 O OE2 . GLU B 397 ? 0.5881 0.6359 0.8717 -0.0720 0.0785 0.0497 456 GLU B OE2 6722 N N . ARG B 398 ? 0.6016 0.6413 0.8318 -0.0704 0.0656 0.0414 457 ARG B N 6723 C CA . ARG B 398 ? 0.5234 0.5620 0.7419 -0.0696 0.0631 0.0398 457 ARG B CA 6724 C C . ARG B 398 ? 0.4865 0.5256 0.7061 -0.0706 0.0568 0.0377 457 ARG B C 6725 O O . ARG B 398 ? 0.5833 0.6229 0.7971 -0.0698 0.0549 0.0367 457 ARG B O 6726 C CB . ARG B 398 ? 0.4719 0.5077 0.6816 -0.0695 0.0637 0.0392 457 ARG B CB 6727 C CG . ARG B 398 ? 0.4263 0.4608 0.6237 -0.0687 0.0612 0.0376 457 ARG B CG 6728 C CD . ARG B 398 ? 0.5349 0.5666 0.7240 -0.0686 0.0617 0.0371 457 ARG B CD 6729 N NE . ARG B 398 ? 0.5699 0.6001 0.7629 -0.0703 0.0581 0.0364 457 ARG B NE 6730 C CZ . ARG B 398 ? 0.5403 0.5693 0.7369 -0.0710 0.0604 0.0373 457 ARG B CZ 6731 N NH1 . ARG B 398 ? 0.5339 0.5629 0.7308 -0.0700 0.0663 0.0389 457 ARG B NH1 6732 N NH2 . ARG B 398 ? 0.6053 0.6330 0.8052 -0.0725 0.0567 0.0365 457 ARG B NH2 6733 N N . ARG B 399 ? 0.5144 0.5531 0.7415 -0.0722 0.0534 0.0371 458 ARG B N 6734 C CA . ARG B 399 ? 0.5545 0.5934 0.7833 -0.0729 0.0472 0.0351 458 ARG B CA 6735 C C . ARG B 399 ? 0.4955 0.5372 0.7311 -0.0728 0.0466 0.0352 458 ARG B C 6736 O O . ARG B 399 ? 0.5002 0.5423 0.7333 -0.0725 0.0426 0.0336 458 ARG B O 6737 C CB . ARG B 399 ? 0.4217 0.4594 0.6570 -0.0745 0.0440 0.0344 458 ARG B CB 6738 C CG . ARG B 399 ? 0.4590 0.4936 0.6863 -0.0747 0.0431 0.0338 458 ARG B CG 6739 C CD . ARG B 399 ? 0.4193 0.4527 0.6540 -0.0763 0.0415 0.0338 458 ARG B CD 6740 N NE . ARG B 399 ? 0.4368 0.4675 0.6641 -0.0763 0.0425 0.0339 458 ARG B NE 6741 C CZ . ARG B 399 ? 0.3451 0.3745 0.5771 -0.0775 0.0424 0.0342 458 ARG B CZ 6742 N NH1 . ARG B 399 ? 0.4101 0.4407 0.6544 -0.0787 0.0414 0.0344 458 ARG B NH1 6743 N NH2 . ARG B 399 ? 0.4480 0.4747 0.6722 -0.0774 0.0433 0.0342 458 ARG B NH2 6744 N N . LEU B 400 ? 0.5654 0.6091 0.8097 -0.0729 0.0505 0.0370 459 LEU B N 6745 C CA . LEU B 400 ? 0.6835 0.7300 0.9344 -0.0726 0.0505 0.0374 459 LEU B CA 6746 C C . LEU B 400 ? 0.7046 0.7518 0.9469 -0.0711 0.0513 0.0373 459 LEU B C 6747 O O . LEU B 400 ? 0.4669 0.5155 0.7099 -0.0709 0.0484 0.0362 459 LEU B O 6748 C CB . LEU B 400 ? 0.5643 0.6125 0.8249 -0.0728 0.0553 0.0398 459 LEU B CB 6749 C CG . LEU B 400 ? 0.4976 0.5489 0.7654 -0.0725 0.0559 0.0405 459 LEU B CG 6750 C CD1 . LEU B 400 ? 0.3331 0.3855 0.6079 -0.0736 0.0503 0.0386 459 LEU B CD1 6751 C CD2 . LEU B 400 ? 0.4120 0.4648 0.6884 -0.0724 0.0612 0.0432 459 LEU B CD2 6752 N N . ALA B 401 ? 0.6034 0.6497 0.8378 -0.0699 0.0554 0.0384 460 ALA B N 6753 C CA . ALA B 401 ? 0.5170 0.5638 0.7428 -0.0683 0.0566 0.0383 460 ALA B CA 6754 C C . ALA B 401 ? 0.6289 0.6746 0.8471 -0.0683 0.0515 0.0359 460 ALA B C 6755 O O . ALA B 401 ? 0.7170 0.7639 0.9326 -0.0675 0.0504 0.0353 460 ALA B O 6756 C CB . ALA B 401 ? 0.4373 0.4829 0.6557 -0.0670 0.0615 0.0396 460 ALA B CB 6757 N N . LYS B 402 ? 0.5437 0.5870 0.7583 -0.0690 0.0485 0.0346 461 LYS B N 6758 C CA . LYS B 402 ? 0.5985 0.6405 0.8060 -0.0689 0.0436 0.0323 461 LYS B CA 6759 C C . LYS B 402 ? 0.5841 0.6272 0.7979 -0.0694 0.0390 0.0310 461 LYS B C 6760 O O . LYS B 402 ? 0.6038 0.6467 0.8125 -0.0688 0.0361 0.0295 461 LYS B O 6761 C CB . LYS B 402 ? 0.3958 0.4349 0.5985 -0.0695 0.0415 0.0314 461 LYS B CB 6762 C CG . LYS B 402 ? 0.6240 0.6616 0.8183 -0.0688 0.0454 0.0323 461 LYS B CG 6763 C CD . LYS B 402 ? 0.6830 0.7178 0.8727 -0.0695 0.0431 0.0314 461 LYS B CD 6764 C CE . LYS B 402 ? 0.6923 0.7255 0.8714 -0.0685 0.0462 0.0317 461 LYS B CE 6765 N NZ . LYS B 402 ? 0.7012 0.7316 0.8748 -0.0691 0.0437 0.0308 461 LYS B NZ 6766 N N . ILE B 403 ? 0.5279 0.5722 0.7529 -0.0705 0.0385 0.0314 462 ILE B N 6767 C CA . ILE B 403 ? 0.4644 0.5099 0.6964 -0.0709 0.0343 0.0300 462 ILE B CA 6768 C C . ILE B 403 ? 0.6078 0.6556 0.8397 -0.0700 0.0354 0.0303 462 ILE B C 6769 O O . ILE B 403 ? 0.3958 0.4438 0.6262 -0.0695 0.0316 0.0285 462 ILE B O 6770 C CB . ILE B 403 ? 0.4357 0.4823 0.6804 -0.0723 0.0342 0.0306 462 ILE B CB 6771 C CG1 . ILE B 403 ? 0.4320 0.4761 0.6771 -0.0733 0.0316 0.0298 462 ILE B CG1 6772 C CG2 . ILE B 403 ? 0.3830 0.4315 0.6355 -0.0725 0.0307 0.0294 462 ILE B CG2 6773 C CD1 . ILE B 403 ? 0.4525 0.4973 0.7089 -0.0747 0.0330 0.0309 462 ILE B CD1 6774 N N . MSE B 404 ? 0.3655 0.4150 0.5988 -0.0695 0.0406 0.0324 463 MSE B N 6775 C CA . MSE B 404 ? 0.6689 0.7207 0.9022 -0.0685 0.0421 0.0330 463 MSE B CA 6776 C C . MSE B 404 ? 0.7743 0.8251 0.9964 -0.0673 0.0408 0.0318 463 MSE B C 6777 O O . MSE B 404 ? 0.5978 0.6499 0.8194 -0.0667 0.0392 0.0310 463 MSE B O 6778 C CB . MSE B 404 ? 0.6804 0.7338 0.9165 -0.0679 0.0481 0.0357 463 MSE B CB 6779 C CG . MSE B 404 ? 0.8396 0.8939 1.0870 -0.0690 0.0499 0.0372 463 MSE B CG 6780 SE SE . MSE B 404 ? 1.0112 1.0672 1.2713 -0.0705 0.0449 0.0357 463 MSE B SE 6781 C CE . MSE B 404 ? 1.6142 1.6730 1.8733 -0.0692 0.0449 0.0357 463 MSE B CE 6782 N N . SER B 405 ? 0.5114 0.5601 0.7245 -0.0669 0.0417 0.0316 464 SER B N 6783 C CA . SER B 405 ? 0.5193 0.5668 0.7215 -0.0658 0.0406 0.0304 464 SER B CA 6784 C C . SER B 405 ? 0.6393 0.6858 0.8402 -0.0660 0.0348 0.0280 464 SER B C 6785 O O . SER B 405 ? 0.7364 0.7833 0.9327 -0.0651 0.0335 0.0270 464 SER B O 6786 C CB . SER B 405 ? 0.5268 0.5721 0.7201 -0.0655 0.0423 0.0306 464 SER B CB 6787 O OG . SER B 405 ? 0.7701 0.8160 0.9647 -0.0652 0.0476 0.0327 464 SER B OG 6788 N N . HIS B 406 ? 0.6067 0.6520 0.8118 -0.0670 0.0314 0.0270 465 HIS B N 6789 C CA . HIS B 406 ? 0.5443 0.5885 0.7490 -0.0669 0.0257 0.0246 465 HIS B CA 6790 C C . HIS B 406 ? 0.6190 0.6654 0.8307 -0.0667 0.0242 0.0241 465 HIS B C 6791 O O . HIS B 406 ? 0.6741 0.7200 0.8831 -0.0659 0.0207 0.0222 465 HIS B O 6792 C CB . HIS B 406 ? 0.4104 0.4527 0.6187 -0.0679 0.0225 0.0238 465 HIS B CB 6793 C CG . HIS B 406 ? 0.6665 0.7064 0.8673 -0.0680 0.0233 0.0242 465 HIS B CG 6794 N ND1 . HIS B 406 ? 0.7130 0.7516 0.9027 -0.0671 0.0243 0.0240 465 HIS B ND1 6795 C CD2 . HIS B 406 ? 0.6133 0.6518 0.8161 -0.0690 0.0233 0.0246 465 HIS B CD2 6796 C CE1 . HIS B 406 ? 0.7117 0.7483 0.8967 -0.0674 0.0249 0.0243 465 HIS B CE1 6797 N NE2 . HIS B 406 ? 0.7665 0.8029 0.9592 -0.0686 0.0243 0.0247 465 HIS B NE2 6798 N N . ILE B 407 ? 0.4345 0.4834 0.6553 -0.0673 0.0271 0.0257 466 ILE B N 6799 C CA . ILE B 407 ? 0.5596 0.6109 0.7874 -0.0672 0.0261 0.0253 466 ILE B CA 6800 C C . ILE B 407 ? 0.7516 0.8039 0.9730 -0.0659 0.0279 0.0256 466 ILE B C 6801 O O . ILE B 407 ? 0.5378 0.5908 0.7593 -0.0653 0.0253 0.0242 466 ILE B O 6802 C CB . ILE B 407 ? 0.5301 0.5838 0.7691 -0.0681 0.0291 0.0272 466 ILE B CB 6803 C CG1 . ILE B 407 ? 0.4367 0.4894 0.6830 -0.0695 0.0269 0.0268 466 ILE B CG1 6804 C CG2 . ILE B 407 ? 0.4056 0.4619 0.6509 -0.0678 0.0287 0.0271 466 ILE B CG2 6805 C CD1 . ILE B 407 ? 0.4312 0.4857 0.6880 -0.0705 0.0303 0.0288 466 ILE B CD1 6806 N N . LEU B 408 ? 0.6605 0.7130 0.8765 -0.0654 0.0324 0.0273 467 LEU B N 6807 C CA . LEU B 408 ? 0.5301 0.5834 0.7394 -0.0642 0.0343 0.0277 467 LEU B CA 6808 C C . LEU B 408 ? 0.5771 0.6285 0.7775 -0.0634 0.0308 0.0255 467 LEU B C 6809 O O . LEU B 408 ? 0.5940 0.6462 0.7914 -0.0624 0.0304 0.0248 467 LEU B O 6810 C CB . LEU B 408 ? 0.5942 0.6475 0.7987 -0.0637 0.0395 0.0298 467 LEU B CB 6811 C CG . LEU B 408 ? 0.6035 0.6576 0.8010 -0.0623 0.0419 0.0303 467 LEU B CG 6812 C CD1 . LEU B 408 ? 0.5684 0.6252 0.7716 -0.0619 0.0423 0.0309 467 LEU B CD1 6813 C CD2 . LEU B 408 ? 0.5796 0.6335 0.7730 -0.0616 0.0468 0.0322 467 LEU B CD2 6814 N N . GLU B 409 ? 0.6238 0.6725 0.8199 -0.0636 0.0283 0.0243 468 GLU B N 6815 C CA . GLU B 409 ? 0.6243 0.6709 0.8119 -0.0628 0.0249 0.0222 468 GLU B CA 6816 C C . GLU B 409 ? 0.6466 0.6933 0.8376 -0.0625 0.0204 0.0202 468 GLU B C 6817 O O . GLU B 409 ? 0.7612 0.8072 0.9464 -0.0614 0.0188 0.0189 468 GLU B O 6818 C CB . GLU B 409 ? 0.7278 0.7715 0.9106 -0.0632 0.0233 0.0216 468 GLU B CB 6819 C CG . GLU B 409 ? 0.9284 0.9717 1.1056 -0.0632 0.0274 0.0232 468 GLU B CG 6820 C CD . GLU B 409 ? 1.1928 1.2335 1.3666 -0.0637 0.0259 0.0227 468 GLU B CD 6821 O OE1 . GLU B 409 ? 1.3793 1.4186 1.5559 -0.0642 0.0217 0.0214 468 GLU B OE1 6822 O OE2 . GLU B 409 ? 1.1637 1.2035 1.3318 -0.0637 0.0290 0.0237 468 GLU B OE2 6823 N N . CYS B 410 ? 0.6694 0.7167 0.8700 -0.0633 0.0184 0.0199 469 CYS B N 6824 C CA . CYS B 410 ? 0.6847 0.7324 0.8897 -0.0629 0.0142 0.0179 469 CYS B CA 6825 C C . CYS B 410 ? 0.7713 0.8215 0.9779 -0.0622 0.0159 0.0182 469 CYS B C 6826 O O . CYS B 410 ? 0.7881 0.8380 0.9928 -0.0612 0.0131 0.0164 469 CYS B O 6827 C CB . CYS B 410 ? 0.6505 0.6985 0.8660 -0.0640 0.0121 0.0176 469 CYS B CB 6828 S SG . CYS B 410 ? 0.6078 0.6523 0.8213 -0.0644 0.0081 0.0164 469 CYS B SG 6829 N N . PHE B 411 ? 0.7628 0.8154 0.9727 -0.0627 0.0204 0.0206 470 PHE B N 6830 C CA . PHE B 411 ? 0.6721 0.7272 0.8832 -0.0621 0.0225 0.0213 470 PHE B CA 6831 C C . PHE B 411 ? 0.7423 0.7965 0.9428 -0.0608 0.0230 0.0208 470 PHE B C 6832 O O . PHE B 411 ? 0.6641 0.7192 0.8636 -0.0599 0.0223 0.0200 470 PHE B O 6833 C CB . PHE B 411 ? 0.6209 0.6783 0.8371 -0.0626 0.0275 0.0242 470 PHE B CB 6834 C CG . PHE B 411 ? 0.5482 0.6071 0.7762 -0.0638 0.0274 0.0248 470 PHE B CG 6835 C CD1 . PHE B 411 ? 0.5032 0.5617 0.7370 -0.0643 0.0228 0.0228 470 PHE B CD1 6836 C CD2 . PHE B 411 ? 0.5630 0.6238 0.7965 -0.0643 0.0318 0.0275 470 PHE B CD2 6837 C CE1 . PHE B 411 ? 0.5510 0.6109 0.7959 -0.0654 0.0227 0.0233 470 PHE B CE1 6838 C CE2 . PHE B 411 ? 0.6845 0.7467 0.9291 -0.0654 0.0318 0.0281 470 PHE B CE2 6839 C CZ . PHE B 411 ? 0.6309 0.6927 0.8813 -0.0660 0.0272 0.0260 470 PHE B CZ 6840 N N . GLU B 412 ? 0.7356 0.7879 0.9281 -0.0606 0.0245 0.0212 471 GLU B N 6841 C CA . GLU B 412 ? 0.4343 0.4858 0.6167 -0.0595 0.0253 0.0208 471 GLU B CA 6842 C C . GLU B 412 ? 0.4827 0.5317 0.6594 -0.0586 0.0209 0.0181 471 GLU B C 6843 O O . GLU B 412 ? 0.7046 0.7534 0.8753 -0.0576 0.0208 0.0173 471 GLU B O 6844 C CB . GLU B 412 ? 0.4238 0.4744 0.6001 -0.0595 0.0287 0.0222 471 GLU B CB 6845 C CG . GLU B 412 ? 0.3606 0.4135 0.5407 -0.0597 0.0337 0.0248 471 GLU B CG 6846 C CD . GLU B 412 ? 0.7987 0.8505 0.9726 -0.0596 0.0370 0.0260 471 GLU B CD 6847 O OE1 . GLU B 412 ? 0.9639 1.0133 1.1324 -0.0597 0.0353 0.0249 471 GLU B OE1 6848 O OE2 . GLU B 412 ? 0.7030 0.7563 0.8775 -0.0592 0.0412 0.0280 471 GLU B OE2 6849 N N . SER B 413 ? 0.5440 0.5911 0.7224 -0.0590 0.0173 0.0168 472 SER B N 6850 C CA . SER B 413 ? 0.6637 0.7081 0.8365 -0.0580 0.0131 0.0144 472 SER B CA 6851 C C . SER B 413 ? 0.6782 0.7232 0.8558 -0.0573 0.0098 0.0127 472 SER B C 6852 O O . SER B 413 ? 0.9491 0.9932 1.1214 -0.0560 0.0083 0.0112 472 SER B O 6853 C CB . SER B 413 ? 0.6368 0.6786 0.8088 -0.0585 0.0104 0.0138 472 SER B CB 6854 O OG . SER B 413 ? 0.9386 0.9776 1.1049 -0.0573 0.0064 0.0116 472 SER B OG 6855 N N . ARG B 414 ? 0.6959 0.7424 0.8834 -0.0581 0.0088 0.0128 473 ARG B N 6856 C CA . ARG B 414 ? 0.6492 0.6965 0.8422 -0.0575 0.0058 0.0111 473 ARG B CA 6857 C C . ARG B 414 ? 0.6638 0.7148 0.8638 -0.0581 0.0090 0.0127 473 ARG B C 6858 O O . ARG B 414 ? 0.6340 0.6864 0.8353 -0.0590 0.0130 0.0151 473 ARG B O 6859 C CB . ARG B 414 ? 0.7055 0.7515 0.9047 -0.0578 0.0015 0.0095 473 ARG B CB 6860 C CG . ARG B 414 ? 0.7178 0.7602 0.9105 -0.0573 -0.0014 0.0084 473 ARG B CG 6861 C CD . ARG B 414 ? 0.8100 0.8508 1.0074 -0.0567 -0.0067 0.0061 473 ARG B CD 6862 N NE . ARG B 414 ? 0.9584 0.9954 1.1481 -0.0555 -0.0100 0.0047 473 ARG B NE 6863 C CZ . ARG B 414 ? 1.1476 1.1824 1.3395 -0.0548 -0.0148 0.0029 473 ARG B CZ 6864 N NH1 . ARG B 414 ? 1.2319 1.2679 1.4337 -0.0551 -0.0170 0.0020 473 ARG B NH1 6865 N NH2 . ARG B 414 ? 1.1589 1.1903 1.3432 -0.0536 -0.0174 0.0018 473 ARG B NH2 6866 N N . GLY B 415 ? 0.5881 0.6404 0.7921 -0.0574 0.0072 0.0114 474 GLY B N 6867 C CA . GLY B 415 ? 0.6595 0.7151 0.8695 -0.0578 0.0100 0.0129 474 GLY B CA 6868 C C . GLY B 415 ? 0.7695 0.8269 0.9897 -0.0594 0.0115 0.0146 474 GLY B C 6869 O O . GLY B 415 ? 0.7439 0.8003 0.9690 -0.0601 0.0089 0.0137 474 GLY B O 6870 N N . VAL B 416 ? 0.7642 0.8244 0.9878 -0.0599 0.0157 0.0170 475 VAL B N 6871 C CA . VAL B 416 ? 0.6518 0.7138 0.8850 -0.0614 0.0178 0.0189 475 VAL B CA 6872 C C . VAL B 416 ? 0.5430 0.6063 0.7862 -0.0617 0.0146 0.0174 475 VAL B C 6873 O O . VAL B 416 ? 0.6886 0.7525 0.9404 -0.0629 0.0142 0.0178 475 VAL B O 6874 C CB . VAL B 416 ? 0.7851 0.8495 1.0191 -0.0615 0.0231 0.0220 475 VAL B CB 6875 C CG1 . VAL B 416 ? 0.8193 0.8859 1.0533 -0.0605 0.0235 0.0219 475 VAL B CG1 6876 C CG2 . VAL B 416 ? 0.6592 0.7252 0.9032 -0.0628 0.0255 0.0240 475 VAL B CG2 6877 N N . ALA B 417 ? 0.6956 0.7594 0.9374 -0.0605 0.0123 0.0156 476 ALA B N 6878 C CA . ALA B 417 ? 0.6242 0.6892 0.8745 -0.0605 0.0091 0.0138 476 ALA B CA 6879 C C . ALA B 417 ? 0.5207 0.5831 0.7718 -0.0602 0.0041 0.0111 476 ALA B C 6880 O O . ALA B 417 ? 0.7976 0.8605 1.0566 -0.0603 0.0010 0.0094 476 ALA B O 6881 C CB . ALA B 417 ? 0.5548 0.6210 0.8024 -0.0591 0.0086 0.0127 476 ALA B CB 6882 N N . GLU B 418 ? 0.5365 0.5959 0.7791 -0.0599 0.0033 0.0106 477 GLU B N 6883 C CA . GLU B 418 ? 0.7666 0.8230 1.0083 -0.0594 -0.0015 0.0082 477 GLU B CA 6884 C C . GLU B 418 ? 0.6798 0.7351 0.9250 -0.0609 -0.0013 0.0093 477 GLU B C 6885 O O . GLU B 418 ? 0.6460 0.6995 0.8938 -0.0608 -0.0053 0.0075 477 GLU B O 6886 C CB . GLU B 418 ? 0.6982 0.7517 0.9279 -0.0578 -0.0029 0.0068 477 GLU B CB 6887 C CG . GLU B 418 ? 0.9243 0.9745 1.1518 -0.0567 -0.0081 0.0042 477 GLU B CG 6888 C CD . GLU B 418 ? 1.1567 1.2067 1.3867 -0.0551 -0.0121 0.0013 477 GLU B CD 6889 O OE1 . GLU B 418 ? 1.2223 1.2751 1.4605 -0.0555 -0.0118 0.0012 477 GLU B OE1 6890 O OE2 . GLU B 418 ? 1.1510 1.1981 1.3748 -0.0534 -0.0155 -0.0009 477 GLU B OE2 6891 N N . VAL B 419 ? 0.5462 0.6027 0.7914 -0.0621 0.0033 0.0121 478 VAL B N 6892 C CA . VAL B 419 ? 0.6892 0.7450 0.9381 -0.0635 0.0041 0.0133 478 VAL B CA 6893 C C . VAL B 419 ? 0.7684 0.8266 1.0302 -0.0648 0.0046 0.0141 478 VAL B C 6894 O O . VAL B 419 ? 0.6733 0.7305 0.9411 -0.0655 0.0018 0.0131 478 VAL B O 6895 C CB . VAL B 419 ? 0.5677 0.6233 0.8105 -0.0640 0.0090 0.0160 478 VAL B CB 6896 C CG1 . VAL B 419 ? 0.6453 0.6999 0.8916 -0.0654 0.0097 0.0171 478 VAL B CG1 6897 C CG2 . VAL B 419 ? 0.4831 0.5365 0.7134 -0.0628 0.0087 0.0153 478 VAL B CG2 6898 N N . LEU B 420 ? 0.6141 0.6754 0.8801 -0.0651 0.0082 0.0159 479 LEU B N 6899 C CA . LEU B 420 ? 0.5359 0.5997 0.8142 -0.0663 0.0095 0.0170 479 LEU B CA 6900 C C . LEU B 420 ? 0.6308 0.6958 0.9165 -0.0660 0.0055 0.0146 479 LEU B C 6901 O O . LEU B 420 ? 0.7613 0.8288 1.0495 -0.0655 0.0065 0.0148 479 LEU B O 6902 C CB . LEU B 420 ? 0.3878 0.4543 0.6675 -0.0666 0.0151 0.0200 479 LEU B CB 6903 C CG . LEU B 420 ? 0.5367 0.6023 0.8101 -0.0669 0.0195 0.0225 479 LEU B CG 6904 C CD1 . LEU B 420 ? 0.5415 0.6098 0.8163 -0.0667 0.0247 0.0254 479 LEU B CD1 6905 C CD2 . LEU B 420 ? 0.7225 0.7868 1.0002 -0.0682 0.0199 0.0232 479 LEU B CD2 6906 N N . VAL B 421 ? 0.6120 0.6752 0.9008 -0.0660 0.0009 0.0123 480 VAL B N 6907 C CA . VAL B 421 ? 0.5760 0.6400 0.8719 -0.0655 -0.0033 0.0097 480 VAL B CA 6908 C C . VAL B 421 ? 0.6449 0.7096 0.9529 -0.0669 -0.0048 0.0095 480 VAL B C 6909 O O . VAL B 421 ? 0.5923 0.6554 0.9009 -0.0679 -0.0046 0.0102 480 VAL B O 6910 C CB . VAL B 421 ? 0.4975 0.5586 0.7863 -0.0637 -0.0085 0.0064 480 VAL B CB 6911 C CG1 . VAL B 421 ? 0.4787 0.5392 0.7562 -0.0622 -0.0071 0.0064 480 VAL B CG1 6912 C CG2 . VAL B 421 ? 0.4569 0.5146 0.7425 -0.0639 -0.0109 0.0058 480 VAL B CG2 6913 N N . ALA B 422 ? 0.5912 0.6583 0.9087 -0.0670 -0.0061 0.0084 481 ALA B N 6914 C CA . ALA B 422 ? 0.5075 0.5756 0.8375 -0.0684 -0.0074 0.0082 481 ALA B CA 6915 C C . ALA B 422 ? 0.5472 0.6128 0.8785 -0.0677 -0.0135 0.0049 481 ALA B C 6916 O O . ALA B 422 ? 0.7033 0.7685 1.0426 -0.0688 -0.0152 0.0045 481 ALA B O 6917 C CB . ALA B 422 ? 0.5361 0.6079 0.8760 -0.0688 -0.0062 0.0085 481 ALA B CB 6918 N N . GLU B 423 ? 0.6284 0.6922 0.9517 -0.0656 -0.0169 0.0024 482 GLU B N 6919 C CA . GLU B 423 ? 0.6154 0.6761 0.9376 -0.0644 -0.0228 -0.0007 482 GLU B CA 6920 C C . GLU B 423 ? 0.5830 0.6407 0.8914 -0.0626 -0.0241 -0.0016 482 GLU B C 6921 O O . GLU B 423 ? 0.6892 0.7476 0.9907 -0.0617 -0.0217 -0.0010 482 GLU B O 6922 C CB . GLU B 423 ? 0.7601 0.8220 1.0901 -0.0634 -0.0269 -0.0038 482 GLU B CB 6923 C CG . GLU B 423 ? 1.0244 1.0833 1.3554 -0.0621 -0.0332 -0.0070 482 GLU B CG 6924 C CD . GLU B 423 ? 1.0644 1.1239 1.3998 -0.0602 -0.0374 -0.0105 482 GLU B CD 6925 O OE1 . GLU B 423 ? 1.0773 1.1401 1.4183 -0.0605 -0.0356 -0.0103 482 GLU B OE1 6926 O OE2 . GLU B 423 ? 1.0436 1.1001 1.3765 -0.0583 -0.0426 -0.0134 482 GLU B OE2 6927 N N . TYR B 424 ? 0.7401 0.7943 1.0446 -0.0619 -0.0277 -0.0030 483 TYR B N 6928 C CA . TYR B 424 ? 0.6634 0.7145 0.9551 -0.0600 -0.0291 -0.0039 483 TYR B CA 6929 C C . TYR B 424 ? 0.6044 0.6537 0.8947 -0.0575 -0.0345 -0.0076 483 TYR B C 6930 O O . TYR B 424 ? 0.6762 0.7248 0.9733 -0.0570 -0.0389 -0.0097 483 TYR B O 6931 C CB . TYR B 424 ? 0.5099 0.5580 0.7964 -0.0605 -0.0297 -0.0031 483 TYR B CB 6932 C CG . TYR B 424 ? 0.5220 0.5666 0.7957 -0.0585 -0.0316 -0.0042 483 TYR B CG 6933 C CD1 . TYR B 424 ? 0.3764 0.4212 0.6406 -0.0583 -0.0279 -0.0027 483 TYR B CD1 6934 C CD2 . TYR B 424 ? 0.3577 0.3989 0.6291 -0.0568 -0.0370 -0.0066 483 TYR B CD2 6935 C CE1 . TYR B 424 ? 0.3562 0.3978 0.6090 -0.0564 -0.0295 -0.0037 483 TYR B CE1 6936 C CE2 . TYR B 424 ? 0.5740 0.6121 0.8339 -0.0549 -0.0386 -0.0075 483 TYR B CE2 6937 C CZ . TYR B 424 ? 0.6086 0.6469 0.8593 -0.0548 -0.0348 -0.0060 483 TYR B CZ 6938 O OH . TYR B 424 ? 0.6942 0.7293 0.9336 -0.0529 -0.0362 -0.0069 483 TYR B OH 6939 N N . ASN B 425 ? 0.6379 0.6866 0.9192 -0.0558 -0.0340 -0.0082 484 ASN B N 6940 C CA . ASN B 425 ? 0.8108 0.8575 1.0888 -0.0530 -0.0385 -0.0116 484 ASN B CA 6941 C C . ASN B 425 ? 0.8072 0.8507 1.0716 -0.0513 -0.0386 -0.0117 484 ASN B C 6942 O O . ASN B 425 ? 0.4762 0.5207 0.7341 -0.0517 -0.0345 -0.0099 484 ASN B O 6943 C CB . ASN B 425 ? 0.5648 0.6144 0.8467 -0.0523 -0.0379 -0.0127 484 ASN B CB 6944 C CG . ASN B 425 ? 0.6088 0.6616 0.9045 -0.0538 -0.0381 -0.0127 484 ASN B CG 6945 O OD1 . ASN B 425 ? 0.7686 0.8248 1.0689 -0.0556 -0.0338 -0.0104 484 ASN B OD1 6946 N ND2 . ASN B 425 ? 0.5420 0.5936 0.8442 -0.0529 -0.0430 -0.0154 484 ASN B ND2 6947 N N . ASN B 426 ? 0.8722 0.9120 1.1327 -0.0494 -0.0432 -0.0138 485 ASN B N 6948 C CA . ASN B 426 ? 0.8058 0.8422 1.0536 -0.0477 -0.0436 -0.0141 485 ASN B CA 6949 C C . ASN B 426 ? 0.9381 0.9732 1.1815 -0.0447 -0.0461 -0.0169 485 ASN B C 6950 O O . ASN B 426 ? 0.9370 0.9703 1.1831 -0.0426 -0.0509 -0.0197 485 ASN B O 6951 C CB . ASN B 426 ? 0.6629 0.6956 0.9080 -0.0472 -0.0471 -0.0145 485 ASN B CB 6952 C CG . ASN B 426 ? 0.9071 0.9365 1.1392 -0.0456 -0.0470 -0.0143 485 ASN B CG 6953 O OD1 . ASN B 426 ? 1.0136 1.0410 1.2399 -0.0430 -0.0491 -0.0164 485 ASN B OD1 6954 N ND2 . ASN B 426 ? 0.8754 0.9040 1.1031 -0.0472 -0.0448 -0.0120 485 ASN B ND2 6955 N N . PRO B 427 ? 0.9947 1.0306 1.2309 -0.0443 -0.0427 -0.0161 486 PRO B N 6956 C CA . PRO B 427 ? 1.0799 1.1146 1.3104 -0.0416 -0.0442 -0.0185 486 PRO B CA 6957 C C . PRO B 427 ? 1.0460 1.0760 1.2701 -0.0386 -0.0489 -0.0209 486 PRO B C 6958 O O . PRO B 427 ? 0.9173 0.9459 1.1408 -0.0359 -0.0520 -0.0238 486 PRO B O 6959 C CB . PRO B 427 ? 0.9282 0.9637 1.1500 -0.0422 -0.0393 -0.0163 486 PRO B CB 6960 C CG . PRO B 427 ? 0.8508 0.8891 1.0763 -0.0453 -0.0350 -0.0130 486 PRO B CG 6961 C CD . PRO B 427 ? 0.8752 0.9138 1.1099 -0.0467 -0.0369 -0.0128 486 PRO B CD 6962 N N . ASP B 428 ? 0.7813 0.8086 1.0003 -0.0389 -0.0493 -0.0198 487 ASP B N 6963 C CA . ASP B 428 ? 0.6394 0.6620 0.8509 -0.0361 -0.0532 -0.0216 487 ASP B CA 6964 C C . ASP B 428 ? 0.5645 0.5853 0.7826 -0.0347 -0.0588 -0.0239 487 ASP B C 6965 O O . ASP B 428 ? 0.6605 0.6836 0.8888 -0.0365 -0.0593 -0.0236 487 ASP B O 6966 C CB . ASP B 428 ? 1.1870 1.2077 1.3903 -0.0370 -0.0514 -0.0193 487 ASP B CB 6967 C CG . ASP B 428 ? 1.2962 1.3185 1.4925 -0.0381 -0.0461 -0.0172 487 ASP B CG 6968 O OD1 . ASP B 428 ? 1.3348 1.3544 1.5212 -0.0373 -0.0455 -0.0167 487 ASP B OD1 6969 O OD2 . ASP B 428 ? 1.2855 1.3115 1.4862 -0.0398 -0.0426 -0.0161 487 ASP B OD2 6970 N N . PRO C 3 ? 0.8476 0.7422 0.7443 0.0835 -0.0011 -0.0830 62 PRO C N 6971 C CA . PRO C 3 ? 0.8679 0.7703 0.7723 0.0769 -0.0012 -0.0802 62 PRO C CA 6972 C C . PRO C 3 ? 0.8628 0.7674 0.7753 0.0748 -0.0052 -0.0785 62 PRO C C 6973 O O . PRO C 3 ? 0.8477 0.7495 0.7623 0.0784 -0.0092 -0.0804 62 PRO C O 6974 C CB . PRO C 3 ? 0.6998 0.6056 0.6063 0.0770 -0.0021 -0.0825 62 PRO C CB 6975 C CG . PRO C 3 ? 0.5792 0.4793 0.4824 0.0837 -0.0047 -0.0866 62 PRO C CG 6976 C CD . PRO C 3 ? 0.6559 0.5488 0.5507 0.0879 -0.0026 -0.0870 62 PRO C CD 6977 N N . HIS C 4 ? 0.7089 0.6182 0.6256 0.0691 -0.0040 -0.0748 63 HIS C N 6978 C CA . HIS C 4 ? 0.5997 0.5114 0.5240 0.0667 -0.0074 -0.0729 63 HIS C CA 6979 C C . HIS C 4 ? 0.6123 0.5288 0.5448 0.0651 -0.0108 -0.0738 63 HIS C C 6980 O O . HIS C 4 ? 0.7378 0.6540 0.6757 0.0660 -0.0149 -0.0742 63 HIS C O 6981 C CB . HIS C 4 ? 0.7250 0.6403 0.6509 0.0612 -0.0048 -0.0689 63 HIS C CB 6982 C CG . HIS C 4 ? 0.7824 0.6931 0.7015 0.0625 -0.0021 -0.0678 63 HIS C CG 6983 N ND1 . HIS C 4 ? 0.6934 0.5988 0.6040 0.0667 0.0004 -0.0697 63 HIS C ND1 6984 C CD2 . HIS C 4 ? 0.7184 0.6289 0.6379 0.0604 -0.0015 -0.0650 63 HIS C CD2 6985 C CE1 . HIS C 4 ? 0.8426 0.7447 0.7489 0.0670 0.0025 -0.0680 63 HIS C CE1 6986 N NE2 . HIS C 4 ? 0.7377 0.6429 0.6492 0.0631 0.0013 -0.0652 63 HIS C NE2 6987 N N . GLN C 5 ? 0.5348 0.4557 0.4684 0.0627 -0.0089 -0.0740 64 GLN C N 6988 C CA . GLN C 5 ? 0.6207 0.5457 0.5613 0.0619 -0.0118 -0.0754 64 GLN C CA 6989 C C . GLN C 5 ? 0.6592 0.5813 0.5955 0.0667 -0.0122 -0.0794 64 GLN C C 6990 O O . GLN C 5 ? 0.6920 0.6156 0.6246 0.0661 -0.0092 -0.0799 64 GLN C O 6991 C CB . GLN C 5 ? 0.4236 0.3560 0.3693 0.0558 -0.0098 -0.0727 64 GLN C CB 6992 C CG . GLN C 5 ? 0.5905 0.5265 0.5421 0.0509 -0.0101 -0.0690 64 GLN C CG 6993 C CD . GLN C 5 ? 0.5497 0.4929 0.5072 0.0455 -0.0087 -0.0667 64 GLN C CD 6994 O OE1 . GLN C 5 ? 0.6631 0.6096 0.6252 0.0451 -0.0102 -0.0679 64 GLN C OE1 6995 N NE2 . GLN C 5 ? 0.5568 0.5027 0.5144 0.0413 -0.0059 -0.0633 64 GLN C NE2 6996 N N . PRO C 6 ? 0.5883 0.5060 0.5247 0.0717 -0.0160 -0.0824 65 PRO C N 6997 C CA . PRO C 6 ? 0.6937 0.6078 0.6254 0.0771 -0.0166 -0.0866 65 PRO C CA 6998 C C . PRO C 6 ? 0.5126 0.4312 0.4499 0.0762 -0.0185 -0.0884 65 PRO C C 6999 O O . PRO C 6 ? 0.5819 0.5065 0.5275 0.0715 -0.0197 -0.0864 65 PRO C O 7000 C CB . PRO C 6 ? 0.4199 0.3278 0.3506 0.0825 -0.0203 -0.0886 65 PRO C CB 7001 C CG . PRO C 6 ? 0.6130 0.5239 0.5523 0.0791 -0.0234 -0.0862 65 PRO C CG 7002 C CD . PRO C 6 ? 0.5605 0.4764 0.5016 0.0727 -0.0200 -0.0819 65 PRO C CD 7003 N N . ILE C 7 ? 0.5563 0.4722 0.4889 0.0807 -0.0186 -0.0922 66 ILE C N 7004 C CA . ILE C 7 ? 0.7023 0.6218 0.6398 0.0807 -0.0207 -0.0945 66 ILE C CA 7005 C C . ILE C 7 ? 0.6264 0.5465 0.5725 0.0817 -0.0261 -0.0956 66 ILE C C 7006 O O . ILE C 7 ? 0.5990 0.5150 0.5451 0.0840 -0.0284 -0.0956 66 ILE C O 7007 C CB . ILE C 7 ? 0.7879 0.7035 0.7177 0.0861 -0.0199 -0.0987 66 ILE C CB 7008 C CG1 . ILE C 7 ? 0.5307 0.4383 0.4551 0.0929 -0.0218 -0.1015 66 ILE C CG1 7009 C CG2 . ILE C 7 ? 0.8479 0.7638 0.7699 0.0847 -0.0145 -0.0976 66 ILE C CG2 7010 C CD1 . ILE C 7 ? 0.7623 0.6657 0.6798 0.0988 -0.0215 -0.1061 66 ILE C CD1 7011 N N . PRO C 8 ? 0.6860 0.6111 0.6394 0.0798 -0.0283 -0.0965 67 PRO C N 7012 C CA . PRO C 8 ? 0.5910 0.5160 0.5521 0.0816 -0.0336 -0.0984 67 PRO C CA 7013 C C . PRO C 8 ? 0.6912 0.6091 0.6470 0.0891 -0.0361 -0.1028 67 PRO C C 7014 O O . PRO C 8 ? 0.4751 0.3907 0.4245 0.0927 -0.0346 -0.1058 67 PRO C O 7015 C CB . PRO C 8 ? 0.5641 0.4954 0.5320 0.0789 -0.0344 -0.0992 67 PRO C CB 7016 C CG . PRO C 8 ? 0.5364 0.4725 0.5030 0.0735 -0.0298 -0.0957 67 PRO C CG 7017 C CD . PRO C 8 ? 0.6801 0.6115 0.6358 0.0755 -0.0259 -0.0954 67 PRO C CD 7018 N N . PRO C 9 ? 0.5425 0.4568 0.5007 0.0917 -0.0397 -0.1032 68 PRO C N 7019 C CA . PRO C 9 ? 0.6318 0.5388 0.5850 0.0991 -0.0423 -0.1070 68 PRO C CA 7020 C C . PRO C 9 ? 0.6812 0.5877 0.6350 0.1032 -0.0446 -0.1118 68 PRO C C 7021 O O . PRO C 9 ? 0.6662 0.5667 0.6128 0.1095 -0.0449 -0.1153 68 PRO C O 7022 C CB . PRO C 9 ? 0.6281 0.5338 0.5873 0.0993 -0.0466 -0.1059 68 PRO C CB 7023 C CG . PRO C 9 ? 0.6587 0.5719 0.6279 0.0923 -0.0470 -0.1026 68 PRO C CG 7024 C CD . PRO C 9 ? 0.5388 0.4561 0.5051 0.0875 -0.0418 -0.0999 68 PRO C CD 7025 N N . SER C 10 ? 0.5579 0.4708 0.5203 0.0997 -0.0462 -0.1119 69 SER C N 7026 C CA . SER C 10 ? 0.6501 0.5634 0.6138 0.1029 -0.0483 -0.1163 69 SER C CA 7027 C C . SER C 10 ? 0.7841 0.6963 0.7386 0.1047 -0.0443 -0.1180 69 SER C C 7028 O O . SER C 10 ? 0.9318 0.8414 0.8831 0.1097 -0.0455 -0.1224 69 SER C O 7029 C CB . SER C 10 ? 0.5185 0.4394 0.4936 0.0980 -0.0504 -0.1154 69 SER C CB 7030 O OG . SER C 10 ? 0.7367 0.6634 0.7124 0.0920 -0.0463 -0.1121 69 SER C OG 7031 N N . LEU C 11 ? 0.7447 0.6589 0.6950 0.1006 -0.0394 -0.1146 70 LEU C N 7032 C CA . LEU C 11 ? 0.6071 0.5204 0.5483 0.1018 -0.0352 -0.1158 70 LEU C CA 7033 C C . LEU C 11 ? 0.5023 0.4080 0.4325 0.1066 -0.0327 -0.1166 70 LEU C C 7034 O O . LEU C 11 ? 0.5581 0.4621 0.4797 0.1077 -0.0288 -0.1173 70 LEU C O 7035 C CB . LEU C 11 ? 0.6003 0.5200 0.5429 0.0949 -0.0312 -0.1117 70 LEU C CB 7036 C CG . LEU C 11 ? 0.7370 0.6643 0.6893 0.0903 -0.0327 -0.1109 70 LEU C CG 7037 C CD1 . LEU C 11 ? 0.4178 0.3508 0.3708 0.0838 -0.0285 -0.1065 70 LEU C CD1 7038 C CD2 . LEU C 11 ? 0.4242 0.3517 0.3756 0.0938 -0.0341 -0.1153 70 LEU C CD2 7039 N N . GLY C 12 ? 0.7243 0.6252 0.6545 0.1095 -0.0351 -0.1165 71 GLY C N 7040 C CA . GLY C 12 ? 0.7647 0.6581 0.6850 0.1142 -0.0330 -0.1171 71 GLY C CA 7041 C C . GLY C 12 ? 0.8442 0.7310 0.7609 0.1222 -0.0361 -0.1220 71 GLY C C 7042 O O . GLY C 12 ? 0.8230 0.7111 0.7441 0.1242 -0.0395 -0.1252 71 GLY C O 7043 N N . GLU C 13 ? 0.7532 0.6326 0.6616 0.1271 -0.0349 -0.1226 72 GLU C N 7044 C CA . GLU C 13 ? 0.9702 0.8425 0.8745 0.1353 -0.0377 -0.1272 72 GLU C CA 7045 C C . GLU C 13 ? 0.9306 0.8031 0.8437 0.1366 -0.0438 -0.1280 72 GLU C C 7046 O O . GLU C 13 ? 0.7841 0.6577 0.7022 0.1336 -0.0453 -0.1248 72 GLU C O 7047 C CB . GLU C 13 ? 1.1315 0.9960 1.0258 0.1400 -0.0351 -0.1270 72 GLU C CB 7048 C CG . GLU C 13 ? 1.3455 1.2022 1.2363 0.1485 -0.0385 -0.1310 72 GLU C CG 7049 C CD . GLU C 13 ? 1.4712 1.3199 1.3507 0.1538 -0.0352 -0.1315 72 GLU C CD 7050 O OE1 . GLU C 13 ? 1.5013 1.3483 1.3729 0.1556 -0.0312 -0.1332 72 GLU C OE1 7051 O OE2 . GLU C 13 ? 1.5266 1.3706 1.4051 0.1563 -0.0364 -0.1302 72 GLU C OE2 7052 N N . LYS C 14 ? 0.9472 0.8188 0.8622 0.1409 -0.0473 -0.1326 73 LYS C N 7053 C CA . LYS C 14 ? 0.8171 0.6894 0.7412 0.1421 -0.0534 -0.1339 73 LYS C CA 7054 C C . LYS C 14 ? 0.8519 0.7171 0.7736 0.1472 -0.0559 -0.1340 73 LYS C C 7055 O O . LYS C 14 ? 1.0369 0.8948 0.9499 0.1540 -0.0553 -0.1367 73 LYS C O 7056 C CB . LYS C 14 ? 0.8534 0.7256 0.7788 0.1464 -0.0562 -0.1392 73 LYS C CB 7057 C CG . LYS C 14 ? 1.0778 0.9577 1.0080 0.1412 -0.0549 -0.1392 73 LYS C CG 7058 C CD . LYS C 14 ? 1.2877 1.1753 1.2298 0.1339 -0.0568 -0.1357 73 LYS C CD 7059 C CE . LYS C 14 ? 1.3201 1.2150 1.2648 0.1284 -0.0541 -0.1348 73 LYS C CE 7060 N NZ . LYS C 14 ? 1.1261 1.0201 1.0671 0.1327 -0.0543 -0.1397 73 LYS C NZ 7061 N N . ASP C 15 ? 0.8903 0.7576 0.8195 0.1439 -0.0588 -0.1310 74 ASP C N 7062 C CA . ASP C 15 ? 0.9401 0.8010 0.8677 0.1485 -0.0617 -0.1309 74 ASP C CA 7063 C C . ASP C 15 ? 0.9099 0.7674 0.8403 0.1550 -0.0673 -0.1357 74 ASP C C 7064 O O . ASP C 15 ? 0.9899 0.8520 0.9300 0.1528 -0.0713 -0.1365 74 ASP C O 7065 C CB . ASP C 15 ? 0.8973 0.7616 0.8317 0.1429 -0.0628 -0.1262 74 ASP C CB 7066 C CG . ASP C 15 ? 0.9341 0.7918 0.8656 0.1473 -0.0652 -0.1255 74 ASP C CG 7067 O OD1 . ASP C 15 ? 1.1317 0.9819 1.0550 0.1546 -0.0651 -0.1282 74 ASP C OD1 7068 O OD2 . ASP C 15 ? 1.0842 0.9440 1.0214 0.1436 -0.0671 -0.1221 74 ASP C OD2 7069 N N . LEU C 16 ? 0.9360 0.7854 0.8579 0.1630 -0.0676 -0.1389 75 LEU C N 7070 C CA . LEU C 16 ? 1.0176 0.8630 0.9410 0.1701 -0.0728 -0.1439 75 LEU C CA 7071 C C . LEU C 16 ? 0.9462 0.7862 0.8706 0.1742 -0.0771 -0.1434 75 LEU C C 7072 O O . LEU C 16 ? 0.8607 0.6999 0.7875 0.1775 -0.0810 -0.1448 75 LEU C O 7073 C CB . LEU C 16 ? 0.9773 0.8197 0.8917 0.1746 -0.0700 -0.1462 75 LEU C CB 7074 C CG . LEU C 16 ? 0.8563 0.7020 0.7683 0.1727 -0.0664 -0.1483 75 LEU C CG 7075 C CD1 . LEU C 16 ? 0.9457 0.7916 0.8505 0.1739 -0.0632 -0.1473 75 LEU C CD1 7076 C CD2 . LEU C 16 ? 0.6126 0.4648 0.5349 0.1695 -0.0697 -0.1504 75 LEU C CD2 7077 N N . SER C 17 ? 0.8657 0.7055 0.7894 0.1708 -0.0755 -0.1387 76 SER C N 7078 C CA . SER C 17 ? 0.8596 0.6941 0.7834 0.1745 -0.0790 -0.1377 76 SER C CA 7079 C C . SER C 17 ? 0.8404 0.6784 0.7756 0.1730 -0.0852 -0.1380 76 SER C C 7080 O O . SER C 17 ? 0.9334 0.7789 0.8772 0.1669 -0.0859 -0.1373 76 SER C O 7081 C CB . SER C 17 ? 0.8309 0.6653 0.7516 0.1704 -0.0755 -0.1323 76 SER C CB 7082 O OG . SER C 17 ? 1.0009 0.8436 0.9294 0.1614 -0.0746 -0.1284 76 SER C OG 7083 N N . ASP C 18 ? 0.8889 0.7210 0.8239 0.1786 -0.0898 -0.1390 77 ASP C N 7084 C CA . ASP C 18 ? 0.9291 0.7635 0.8743 0.1779 -0.0959 -0.1393 77 ASP C CA 7085 C C . ASP C 18 ? 0.8964 0.7355 0.8473 0.1704 -0.0957 -0.1338 77 ASP C C 7086 O O . ASP C 18 ? 0.7213 0.5567 0.6674 0.1710 -0.0946 -0.1307 77 ASP C O 7087 C CB . ASP C 18 ? 1.0250 0.8567 0.9684 0.1818 -0.0992 -0.1385 77 ASP C CB 7088 C CG . ASP C 18 ? 1.0555 0.8886 1.0091 0.1822 -0.1061 -0.1398 77 ASP C CG 7089 O OD1 . ASP C 18 ? 1.1391 0.9749 1.1018 0.1803 -0.1086 -0.1424 77 ASP C OD1 7090 O OD2 . ASP C 18 ? 0.9918 0.8235 0.9445 0.1841 -0.1088 -0.1380 77 ASP C OD2 7091 N N . PRO C 19 ? 0.7669 0.6141 0.7278 0.1635 -0.0966 -0.1325 78 PRO C N 7092 C CA . PRO C 19 ? 0.5690 0.4213 0.5358 0.1559 -0.0961 -0.1274 78 PRO C CA 7093 C C . PRO C 19 ? 0.5546 0.4040 0.5250 0.1578 -0.1012 -0.1261 78 PRO C C 7094 O O . PRO C 19 ? 0.8018 0.6543 0.7757 0.1523 -0.1008 -0.1218 78 PRO C O 7095 C CB . PRO C 19 ? 0.7327 0.5937 0.7097 0.1496 -0.0966 -0.1275 78 PRO C CB 7096 C CG . PRO C 19 ? 0.6495 0.5103 0.6238 0.1528 -0.0954 -0.1320 78 PRO C CG 7097 C CD . PRO C 19 ? 0.7283 0.5804 0.6954 0.1623 -0.0977 -0.1359 78 PRO C CD 7098 N N . PHE C 20 ? 0.6730 0.5163 0.6422 0.1655 -0.1059 -0.1298 79 PHE C N 7099 C CA . PHE C 20 ? 0.8780 0.7184 0.8508 0.1677 -0.1112 -0.1290 79 PHE C CA 7100 C C . PHE C 20 ? 0.8877 0.7184 0.8513 0.1766 -0.1127 -0.1305 79 PHE C C 7101 O O . PHE C 20 ? 0.9530 0.7799 0.9189 0.1814 -0.1182 -0.1321 79 PHE C O 7102 C CB . PHE C 20 ? 0.7044 0.5480 0.6880 0.1677 -0.1170 -0.1319 79 PHE C CB 7103 C CG . PHE C 20 ? 0.6350 0.4880 0.6281 0.1591 -0.1156 -0.1303 79 PHE C CG 7104 C CD1 . PHE C 20 ? 0.7383 0.5961 0.7383 0.1525 -0.1163 -0.1260 79 PHE C CD1 7105 C CD2 . PHE C 20 ? 0.5149 0.3719 0.5098 0.1578 -0.1136 -0.1329 79 PHE C CD2 7106 C CE1 . PHE C 20 ? 0.6276 0.4938 0.6362 0.1448 -0.1149 -0.1244 79 PHE C CE1 7107 C CE2 . PHE C 20 ? 0.6058 0.4714 0.6093 0.1501 -0.1123 -0.1313 79 PHE C CE2 7108 C CZ . PHE C 20 ? 0.7253 0.5954 0.7357 0.1437 -0.1129 -0.1270 79 PHE C CZ 7109 N N . ASN C 21 ? 0.9892 0.8161 0.9425 0.1787 -0.1077 -0.1300 80 ASN C N 7110 C CA . ASN C 21 ? 0.9564 0.7787 0.9007 0.1826 -0.1066 -0.1280 80 ASN C CA 7111 C C . ASN C 21 ? 0.9167 0.7356 0.8586 0.1821 -0.1067 -0.1241 80 ASN C C 7112 O O . ASN C 21 ? 1.2087 1.0250 1.1418 0.1828 -0.1027 -0.1212 80 ASN C O 7113 C CB . ASN C 21 ? 1.0512 0.8732 0.9862 0.1831 -0.1005 -0.1278 80 ASN C CB 7114 C CG . ASN C 21 ? 1.1065 0.9266 1.0337 0.1855 -0.0991 -0.1252 80 ASN C CG 7115 O OD1 . ASN C 21 ? 1.2186 1.0400 1.1430 0.1869 -0.0979 -0.1264 80 ASN C OD1 7116 N ND2 . ASN C 21 ? 1.1497 0.9668 1.0736 0.1859 -0.0993 -0.1216 80 ASN C ND2 7117 N N . PHE C 22 ? 0.8092 0.6294 0.7591 0.1798 -0.1107 -0.1232 81 PHE C N 7118 C CA . PHE C 22 ? 0.8754 0.6942 0.8236 0.1778 -0.1107 -0.1185 81 PHE C CA 7119 C C . PHE C 22 ? 0.9004 0.7161 0.8522 0.1815 -0.1174 -0.1187 81 PHE C C 7120 O O . PHE C 22 ? 0.9092 0.7274 0.8680 0.1819 -0.1217 -0.1211 81 PHE C O 7121 C CB . PHE C 22 ? 0.7935 0.6207 0.7473 0.1677 -0.1077 -0.1141 81 PHE C CB 7122 C CG . PHE C 22 ? 0.7502 0.5845 0.7159 0.1626 -0.1111 -0.1145 81 PHE C CG 7123 C CD1 . PHE C 22 ? 0.7090 0.5443 0.6812 0.1611 -0.1158 -0.1127 81 PHE C CD1 7124 C CD2 . PHE C 22 ? 0.6116 0.4516 0.5820 0.1593 -0.1094 -0.1166 81 PHE C CD2 7125 C CE1 . PHE C 22 ? 0.6673 0.5090 0.6506 0.1564 -0.1187 -0.1131 81 PHE C CE1 7126 C CE2 . PHE C 22 ? 0.6354 0.4819 0.6169 0.1547 -0.1124 -0.1169 81 PHE C CE2 7127 C CZ . PHE C 22 ? 0.6220 0.4693 0.6101 0.1532 -0.1170 -0.1152 81 PHE C CZ 7128 N N . LEU C 23 ? 0.9989 0.8117 0.9459 0.1819 -0.1172 -0.1148 82 LEU C N 7129 C CA . LEU C 23 ? 1.0327 0.8451 0.9819 0.1828 -0.1221 -0.1130 82 LEU C CA 7130 C C . LEU C 23 ? 0.9537 0.7664 0.9117 0.1808 -0.1267 -0.1124 82 LEU C C 7131 O O . LEU C 23 ? 1.0570 0.8737 1.0151 0.1741 -0.1232 -0.1082 82 LEU C O 7132 C CB . LEU C 23 ? 1.2107 1.0199 1.1504 0.1841 -0.1197 -0.1089 82 LEU C CB 7133 C CG . LEU C 23 ? 1.2778 1.0865 1.2093 0.1864 -0.1164 -0.1087 82 LEU C CG 7134 C CD1 . LEU C 23 ? 1.2742 1.0797 1.1970 0.1869 -0.1132 -0.1046 82 LEU C CD1 7135 C CD2 . LEU C 23 ? 1.2235 1.0340 1.1578 0.1881 -0.1206 -0.1103 82 LEU C CD2 7136 N N . PHE C 24 ? 1.0307 0.8454 0.9963 0.1810 -0.1323 -0.1137 83 PHE C N 7137 C CA . PHE C 24 ? 1.0900 0.9080 1.0642 0.1766 -0.1360 -0.1115 83 PHE C CA 7138 C C . PHE C 24 ? 1.0845 0.8998 1.0601 0.1803 -0.1420 -0.1115 83 PHE C C 7139 O O . PHE C 24 ? 1.1288 0.9440 1.0991 0.1825 -0.1416 -0.1119 83 PHE C O 7140 C CB . PHE C 24 ? 1.0671 0.8937 1.0519 0.1701 -0.1359 -0.1126 83 PHE C CB 7141 C CG . PHE C 24 ? 0.9924 0.8253 0.9847 0.1620 -0.1364 -0.1086 83 PHE C CG 7142 C CD1 . PHE C 24 ? 0.7613 0.5979 0.7512 0.1555 -0.1311 -0.1042 83 PHE C CD1 7143 C CD2 . PHE C 24 ? 0.8727 0.7080 0.8746 0.1610 -0.1420 -0.1093 83 PHE C CD2 7144 C CE1 . PHE C 24 ? 0.8322 0.6746 0.8287 0.1483 -0.1314 -0.1006 83 PHE C CE1 7145 C CE2 . PHE C 24 ? 0.8813 0.7223 0.8900 0.1537 -0.1423 -0.1056 83 PHE C CE2 7146 C CZ . PHE C 24 ? 0.8070 0.6515 0.8128 0.1474 -0.1369 -0.1013 83 PHE C CZ 7147 N N . SER C 25 ? 1.2167 1.0325 1.1991 0.1785 -0.1464 -0.1100 84 SER C N 7148 C CA . SER C 25 ? 1.3373 1.1530 1.3209 0.1795 -0.1511 -0.1089 84 SER C CA 7149 C C . SER C 25 ? 1.3035 1.1225 1.2979 0.1791 -0.1565 -0.1120 84 SER C C 7150 O O . SER C 25 ? 1.3092 1.1310 1.3128 0.1768 -0.1575 -0.1140 84 SER C O 7151 C CB . SER C 25 ? 1.3021 1.1157 1.2851 0.1780 -0.1526 -0.1047 84 SER C CB 7152 O OG . SER C 25 ? 1.2185 1.0324 1.2027 0.1785 -0.1572 -0.1036 84 SER C OG 7153 N N . SER C 26 ? 1.2524 1.0717 1.2456 0.1807 -0.1595 -0.1123 85 SER C N 7154 C CA . SER C 26 ? 1.2662 1.0884 1.2689 0.1806 -0.1648 -0.1152 85 SER C CA 7155 C C . SER C 26 ? 1.2287 1.0505 1.2342 0.1799 -0.1697 -0.1130 85 SER C C 7156 O O . SER C 26 ? 1.1323 0.9557 1.1427 0.1804 -0.1740 -0.1150 85 SER C O 7157 C CB . SER C 26 ? 1.2062 1.0295 1.2056 0.1832 -0.1643 -0.1183 85 SER C CB 7158 O OG . SER C 26 ? 1.0893 0.9104 1.0801 0.1852 -0.1641 -0.1163 85 SER C OG 7159 N N . ASN C 27 ? 1.1622 0.9818 1.1641 0.1787 -0.1689 -0.1090 86 ASN C N 7160 C CA . ASN C 27 ? 1.0242 0.8432 1.0278 0.1778 -0.1731 -0.1065 86 ASN C CA 7161 C C . ASN C 27 ? 1.0111 0.8329 1.0279 0.1755 -0.1783 -0.1078 86 ASN C C 7162 O O . ASN C 27 ? 1.1843 1.0072 1.2079 0.1732 -0.1782 -0.1075 86 ASN C O 7163 C CB . ASN C 27 ? 1.0200 0.8361 1.0168 0.1768 -0.1708 -0.1018 86 ASN C CB 7164 C CG . ASN C 27 ? 1.0028 0.8180 0.9993 0.1760 -0.1746 -0.0990 86 ASN C CG 7165 O OD1 . ASN C 27 ? 0.8302 0.6472 0.8357 0.1743 -0.1793 -0.0993 86 ASN C OD1 7166 N ND2 . ASN C 27 ? 1.2200 1.0326 1.2062 0.1773 -0.1724 -0.0962 86 ASN C ND2 7167 N N . LYS C 28 ? 0.8371 0.6602 0.8578 0.1760 -0.1828 -0.1093 87 LYS C N 7168 C CA . LYS C 28 ? 0.9231 0.7492 0.9567 0.1741 -0.1880 -0.1112 87 LYS C CA 7169 C C . LYS C 28 ? 0.8563 0.6822 0.8942 0.1718 -0.1918 -0.1080 87 LYS C C 7170 O O . LYS C 28 ? 0.7515 0.5800 0.8005 0.1700 -0.1961 -0.1092 87 LYS C O 7171 C CB . LYS C 28 ? 0.8992 0.7269 0.9352 0.1759 -0.1910 -0.1149 87 LYS C CB 7172 C CG . LYS C 28 ? 0.9155 0.7437 0.9477 0.1782 -0.1876 -0.1182 87 LYS C CG 7173 C CD . LYS C 28 ? 1.0329 0.8634 1.0726 0.1767 -0.1859 -0.1201 87 LYS C CD 7174 C CE . LYS C 28 ? 1.2052 1.0365 1.2411 0.1788 -0.1824 -0.1233 87 LYS C CE 7175 N NZ . LYS C 28 ? 1.0842 0.9174 1.1264 0.1771 -0.1802 -0.1251 87 LYS C NZ 7176 N N . ILE C 29 ? 0.8712 0.6943 0.9005 0.1716 -0.1901 -0.1039 88 ILE C N 7177 C CA . ILE C 29 ? 0.9720 0.7949 1.0041 0.1694 -0.1936 -0.1006 88 ILE C CA 7178 C C . ILE C 29 ? 0.9786 0.8036 1.0217 0.1662 -0.1953 -0.0997 88 ILE C C 7179 O O . ILE C 29 ? 1.0335 0.8605 1.0855 0.1643 -0.2000 -0.0997 88 ILE C O 7180 C CB . ILE C 29 ? 0.8779 0.6973 0.8982 0.1697 -0.1908 -0.0962 88 ILE C CB 7181 C CG1 . ILE C 29 ? 0.8301 0.6475 0.8403 0.1726 -0.1895 -0.0967 88 ILE C CG1 7182 C CG2 . ILE C 29 ? 0.4697 0.2890 0.4928 0.1671 -0.1941 -0.0927 88 ILE C CG2 7183 C CD1 . ILE C 29 ? 0.8926 0.7111 0.9067 0.1733 -0.1941 -0.0989 88 ILE C CD1 7184 N N . THR C 30 ? 0.8932 0.7211 0.9345 0.1621 -0.1895 -0.0980 89 THR C N 7185 C CA . THR C 30 ? 0.8862 0.7227 0.9353 0.1525 -0.1863 -0.0956 89 THR C CA 7186 C C . THR C 30 ? 0.8641 0.7055 0.9253 0.1506 -0.1887 -0.0992 89 THR C C 7187 O O . THR C 30 ? 0.8684 0.7149 0.9386 0.1452 -0.1902 -0.0980 89 THR C O 7188 C CB . THR C 30 ? 1.0089 0.8490 1.0530 0.1475 -0.1783 -0.0934 89 THR C CB 7189 O OG1 . THR C 30 ? 1.0151 0.8512 1.0488 0.1485 -0.1761 -0.0897 89 THR C OG1 7190 C CG2 . THR C 30 ? 1.0338 0.8828 1.0864 0.1380 -0.1752 -0.0912 89 THR C CG2 7191 N N . LEU C 31 ? 0.8411 0.6810 0.9023 0.1552 -0.1888 -0.1037 90 LEU C N 7192 C CA . LEU C 31 ? 0.7585 0.6025 0.8304 0.1542 -0.1910 -0.1077 90 LEU C CA 7193 C C . LEU C 31 ? 0.7841 0.6273 0.8645 0.1561 -0.1984 -0.1092 90 LEU C C 7194 O O . LEU C 31 ? 0.6979 0.5470 0.7892 0.1510 -0.1995 -0.1095 90 LEU C O 7195 C CB . LEU C 31 ? 0.6015 0.4423 0.6700 0.1605 -0.1906 -0.1124 90 LEU C CB 7196 C CG . LEU C 31 ? 0.6298 0.4742 0.7086 0.1607 -0.1930 -0.1172 90 LEU C CG 7197 C CD1 . LEU C 31 ? 0.5191 0.3726 0.6062 0.1515 -0.1888 -0.1158 90 LEU C CD1 7198 C CD2 . LEU C 31 ? 0.7488 0.5891 0.8223 0.1676 -0.1925 -0.1218 90 LEU C CD2 7199 N N . ARG C 32 ? 0.8701 0.7058 0.9453 0.1636 -0.2034 -0.1100 91 ARG C N 7200 C CA . ARG C 32 ? 1.0132 0.8489 1.0940 0.1643 -0.2093 -0.1111 91 ARG C CA 7201 C C . ARG C 32 ? 1.0037 0.8407 1.0906 0.1605 -0.2122 -0.1075 91 ARG C C 7202 O O . ARG C 32 ? 0.7962 0.6359 0.8933 0.1588 -0.2165 -0.1087 91 ARG C O 7203 C CB . ARG C 32 ? 1.0329 0.8656 1.1016 0.1671 -0.2090 -0.1109 91 ARG C CB 7204 C CG . ARG C 32 ? 0.9802 0.8128 1.0442 0.1702 -0.2068 -0.1147 91 ARG C CG 7205 C CD . ARG C 32 ? 1.0511 0.8807 1.1026 0.1729 -0.2057 -0.1140 91 ARG C CD 7206 N NE . ARG C 32 ? 0.9340 0.7636 0.9805 0.1757 -0.2030 -0.1171 91 ARG C NE 7207 C CZ . ARG C 32 ? 1.1039 0.9314 1.1406 0.1784 -0.2019 -0.1173 91 ARG C CZ 7208 N NH1 . ARG C 32 ? 1.2933 1.1185 1.3240 0.1786 -0.2031 -0.1147 91 ARG C NH1 7209 N NH2 . ARG C 32 ? 1.1429 0.9708 1.1757 0.1807 -0.1995 -0.1200 91 ARG C NH2 7210 N N . LYS C 33 ? 0.8444 0.6813 0.9239 0.1573 -0.2084 -0.1027 92 LYS C N 7211 C CA . LYS C 33 ? 0.7914 0.6318 0.8745 0.1509 -0.2087 -0.0984 92 LYS C CA 7212 C C . LYS C 33 ? 0.9922 0.8415 1.0860 0.1422 -0.2057 -0.0979 92 LYS C C 7213 O O . LYS C 33 ? 0.9586 0.8112 1.0606 0.1383 -0.2083 -0.0967 92 LYS C O 7214 C CB . LYS C 33 ? 0.5203 0.3590 0.5927 0.1492 -0.2045 -0.0936 92 LYS C CB 7215 C CG . LYS C 33 ? 0.5154 0.3453 0.5773 0.1571 -0.2076 -0.0931 92 LYS C CG 7216 C CD . LYS C 33 ? 0.7245 0.5535 0.7768 0.1545 -0.2032 -0.0881 92 LYS C CD 7217 C CE . LYS C 33 ? 0.9266 0.7494 0.9679 0.1593 -0.2047 -0.0866 92 LYS C CE 7218 N NZ . LYS C 33 ? 0.9786 0.7989 1.0105 0.1588 -0.2010 -0.0824 92 LYS C NZ 7219 N N . LEU C 34 ? 0.9381 0.7914 1.0318 0.1394 -0.2000 -0.0988 93 LEU C N 7220 C CA . LEU C 34 ? 0.8761 0.7378 0.9795 0.1315 -0.1967 -0.0984 93 LEU C CA 7221 C C . LEU C 34 ? 0.7870 0.6510 0.9024 0.1323 -0.2014 -0.1026 93 LEU C C 7222 O O . LEU C 34 ? 0.6708 0.5405 0.7963 0.1265 -0.2017 -0.1017 93 LEU C O 7223 C CB . LEU C 34 ? 0.8270 0.6917 0.9263 0.1290 -0.1897 -0.0984 93 LEU C CB 7224 C CG . LEU C 34 ? 0.7877 0.6534 0.8787 0.1247 -0.1837 -0.0936 93 LEU C CG 7225 C CD1 . LEU C 34 ? 0.8200 0.6867 0.9052 0.1244 -0.1777 -0.0942 93 LEU C CD1 7226 C CD2 . LEU C 34 ? 0.6487 0.5210 0.7462 0.1161 -0.1816 -0.0899 93 LEU C CD2 7227 N N . TYR C 35 ? 1.0053 0.8648 1.1197 0.1397 -0.2048 -0.1072 94 TYR C N 7228 C CA . TYR C 35 ? 1.0777 0.9386 1.2031 0.1415 -0.2097 -0.1116 94 TYR C CA 7229 C C . TYR C 35 ? 0.9899 0.8497 1.1216 0.1417 -0.2160 -0.1110 94 TYR C C 7230 O O . TYR C 35 ? 0.8788 0.7437 1.0223 0.1377 -0.2179 -0.1118 94 TYR C O 7231 C CB . TYR C 35 ? 0.9863 0.8417 1.1078 0.1502 -0.2124 -0.1167 94 TYR C CB 7232 C CG . TYR C 35 ? 0.9718 0.8284 1.1044 0.1526 -0.2176 -0.1216 94 TYR C CG 7233 C CD1 . TYR C 35 ? 0.9530 0.8155 1.0932 0.1492 -0.2152 -0.1242 94 TYR C CD1 7234 C CD2 . TYR C 35 ? 1.0109 0.8627 1.1462 0.1583 -0.2251 -0.1238 94 TYR C CD2 7235 C CE1 . TYR C 35 ? 0.9915 0.8553 1.1421 0.1513 -0.2199 -0.1287 94 TYR C CE1 7236 C CE2 . TYR C 35 ? 0.9400 0.7936 1.0850 0.1597 -0.2294 -0.1282 94 TYR C CE2 7237 C CZ . TYR C 35 ? 1.0591 0.9181 1.2125 0.1569 -0.2273 -0.1309 94 TYR C CZ 7238 O OH . TYR C 35 ? 1.1573 1.0176 1.3212 0.1591 -0.2322 -0.1357 94 TYR C OH 7239 N N . ASP C 36 ? 0.9222 0.7755 1.0462 0.1466 -0.2193 -0.1095 95 ASP C N 7240 C CA . ASP C 36 ? 1.0039 0.8550 1.1323 0.1480 -0.2258 -0.1089 95 ASP C CA 7241 C C . ASP C 36 ? 0.9441 0.8015 1.0796 0.1392 -0.2242 -0.1050 95 ASP C C 7242 O O . ASP C 36 ? 0.8669 0.7261 1.0121 0.1379 -0.2287 -0.1059 95 ASP C O 7243 C CB . ASP C 36 ? 1.1078 0.9508 1.2248 0.1543 -0.2285 -0.1072 95 ASP C CB 7244 C CG . ASP C 36 ? 1.2967 1.1390 1.4150 0.1536 -0.2332 -0.1066 95 ASP C CG 7245 O OD1 . ASP C 36 ? 1.3228 1.1652 1.4424 0.1552 -0.2356 -0.1101 95 ASP C OD1 7246 O OD2 . ASP C 36 ? 1.3018 1.1436 1.4196 0.1513 -0.2342 -0.1025 95 ASP C OD2 7247 N N . LEU C 37 ? 0.8119 0.6726 0.9425 0.1334 -0.2178 -0.1009 96 LEU C N 7248 C CA . LEU C 37 ? 0.7540 0.6203 0.8898 0.1252 -0.2156 -0.0969 96 LEU C CA 7249 C C . LEU C 37 ? 0.7760 0.6502 0.9242 0.1189 -0.2133 -0.0981 96 LEU C C 7250 O O . LEU C 37 ? 0.8964 0.7756 1.0505 0.1121 -0.2118 -0.0953 96 LEU C O 7251 C CB . LEU C 37 ? 0.7918 0.6587 0.9178 0.1213 -0.2094 -0.0921 96 LEU C CB 7252 C CG . LEU C 37 ? 0.8857 0.7464 1.0010 0.1250 -0.2112 -0.0892 96 LEU C CG 7253 C CD1 . LEU C 37 ? 0.8001 0.6607 0.9046 0.1230 -0.2046 -0.0859 96 LEU C CD1 7254 C CD2 . LEU C 37 ? 0.9030 0.7645 1.0223 0.1219 -0.2146 -0.0864 96 LEU C CD2 7255 N N . THR C 38 ? 0.7400 0.6152 0.8918 0.1213 -0.2131 -0.1024 97 THR C N 7256 C CA . THR C 38 ? 0.8707 0.7534 1.0332 0.1154 -0.2102 -0.1035 97 THR C CA 7257 C C . THR C 38 ? 0.9248 0.8078 1.0970 0.1189 -0.2150 -0.1088 97 THR C C 7258 O O . THR C 38 ? 0.9771 0.8662 1.1588 0.1146 -0.2131 -0.1102 97 THR C O 7259 C CB . THR C 38 ? 0.7541 0.6399 0.9114 0.1127 -0.2029 -0.1028 97 THR C CB 7260 O OG1 . THR C 38 ? 0.6708 0.5510 0.8193 0.1198 -0.2032 -0.1057 97 THR C OG1 7261 C CG2 . THR C 38 ? 0.6182 0.5056 0.7685 0.1074 -0.1975 -0.0974 97 THR C CG2 7262 N N . LYS C 39 ? 0.8715 0.7481 1.0417 0.1267 -0.2212 -0.1119 98 LYS C N 7263 C CA . LYS C 39 ? 0.9198 0.7960 1.0985 0.1309 -0.2262 -0.1174 98 LYS C CA 7264 C C . LYS C 39 ? 0.8850 0.7660 1.0781 0.1265 -0.2294 -0.1179 98 LYS C C 7265 O O . LYS C 39 ? 1.0081 0.8908 1.2104 0.1281 -0.2323 -0.1222 98 LYS C O 7266 C CB . LYS C 39 ? 0.9680 0.8356 1.1405 0.1405 -0.2324 -0.1202 98 LYS C CB 7267 C CG . LYS C 39 ? 1.1361 0.9997 1.3063 0.1420 -0.2369 -0.1175 98 LYS C CG 7268 C CD . LYS C 39 ? 1.1364 0.9917 1.3008 0.1516 -0.2430 -0.1206 98 LYS C CD 7269 C CE . LYS C 39 ? 1.0199 0.8724 1.1783 0.1507 -0.2452 -0.1171 98 LYS C CE 7270 N NZ . LYS C 39 ? 0.9272 0.7827 1.0986 0.1474 -0.2496 -0.1162 98 LYS C NZ 7271 N N . ASN C 40 ? 0.9649 0.8482 1.1601 0.1210 -0.2287 -0.1135 99 ASN C N 7272 C CA . ASN C 40 ? 1.0709 0.9588 1.2795 0.1164 -0.2313 -0.1135 99 ASN C CA 7273 C C . ASN C 40 ? 0.9913 0.8872 1.2058 0.1072 -0.2249 -0.1105 99 ASN C C 7274 O O . ASN C 40 ? 0.9614 0.8615 1.1862 0.1023 -0.2259 -0.1095 99 ASN C O 7275 C CB . ASN C 40 ? 1.1534 1.0377 1.3613 0.1173 -0.2362 -0.1112 99 ASN C CB 7276 C CG . ASN C 40 ? 1.0375 0.9142 1.2421 0.1265 -0.2435 -0.1146 99 ASN C CG 7277 O OD1 . ASN C 40 ? 0.9244 0.8000 1.1340 0.1311 -0.2469 -0.1195 99 ASN C OD1 7278 N ND2 . ASN C 40 ? 1.0918 0.9632 1.2880 0.1292 -0.2459 -0.1119 99 ASN C ND2 7279 N N . VAL C 41 ? 0.9751 0.8730 1.1829 0.1050 -0.2184 -0.1090 100 VAL C N 7280 C CA . VAL C 41 ? 0.9381 0.8434 1.1505 0.0967 -0.2120 -0.1062 100 VAL C CA 7281 C C . VAL C 41 ? 0.9334 0.8438 1.1567 0.0952 -0.2115 -0.1098 100 VAL C C 7282 O O . VAL C 41 ? 0.9064 0.8152 1.1277 0.0997 -0.2119 -0.1136 100 VAL C O 7283 C CB . VAL C 41 ? 0.7121 0.6176 0.9129 0.0949 -0.2052 -0.1031 100 VAL C CB 7284 C CG1 . VAL C 41 ? 0.5752 0.4883 0.7811 0.0866 -0.1987 -0.1003 100 VAL C CG1 7285 C CG2 . VAL C 41 ? 0.5974 0.4982 0.7876 0.0961 -0.2056 -0.0994 100 VAL C CG2 7286 N N . ASP C 42 ? 0.9607 0.8771 1.1954 0.0889 -0.2104 -0.1086 101 ASP C N 7287 C CA . ASP C 42 ? 0.9529 0.8746 1.1988 0.0868 -0.2097 -0.1116 101 ASP C CA 7288 C C . ASP C 42 ? 0.9539 0.8803 1.1967 0.0825 -0.2021 -0.1099 101 ASP C C 7289 O O . ASP C 42 ? 1.0735 1.0054 1.3209 0.0755 -0.1977 -0.1066 101 ASP C O 7290 C CB . ASP C 42 ? 1.0801 1.0063 1.3398 0.0820 -0.2117 -0.1110 101 ASP C CB 7291 C CG . ASP C 42 ? 1.1478 1.0791 1.4199 0.0804 -0.2118 -0.1145 101 ASP C CG 7292 O OD1 . ASP C 42 ? 1.0543 0.9852 1.3242 0.0837 -0.2110 -0.1178 101 ASP C OD1 7293 O OD2 . ASP C 42 ? 1.2381 1.1736 1.5221 0.0759 -0.2125 -0.1139 101 ASP C OD2 7294 N N . PHE C 43 ? 0.9393 0.8632 1.1740 0.0868 -0.2007 -0.1122 102 PHE C N 7295 C CA . PHE C 43 ? 0.9536 0.8812 1.1839 0.0834 -0.1937 -0.1107 102 PHE C CA 7296 C C . PHE C 43 ? 0.9003 0.8347 1.1419 0.0792 -0.1915 -0.1122 102 PHE C C 7297 O O . PHE C 43 ? 1.0601 0.9995 1.3021 0.0735 -0.1855 -0.1093 102 PHE C O 7298 C CB . PHE C 43 ? 0.9168 0.8395 1.1356 0.0897 -0.1931 -0.1131 102 PHE C CB 7299 C CG . PHE C 43 ? 0.8832 0.8000 1.0889 0.0926 -0.1928 -0.1105 102 PHE C CG 7300 C CD1 . PHE C 43 ? 0.8784 0.7882 1.0795 0.0997 -0.1986 -0.1127 102 PHE C CD1 7301 C CD2 . PHE C 43 ? 0.7937 0.7120 0.9919 0.0882 -0.1869 -0.1059 102 PHE C CD2 7302 C CE1 . PHE C 43 ? 0.8076 0.7120 0.9968 0.1025 -0.1983 -0.1102 102 PHE C CE1 7303 C CE2 . PHE C 43 ? 0.8228 0.7358 1.0092 0.0909 -0.1866 -0.1036 102 PHE C CE2 7304 C CZ . PHE C 43 ? 0.7902 0.6962 0.9720 0.0980 -0.1923 -0.1057 102 PHE C CZ 7305 N N . ASP C 44 ? 0.8764 0.8110 1.1273 0.0821 -0.1964 -0.1166 103 ASP C N 7306 C CA . ASP C 44 ? 0.9175 0.8582 1.1796 0.0788 -0.1949 -0.1185 103 ASP C CA 7307 C C . ASP C 44 ? 0.8368 0.7840 1.1079 0.0706 -0.1916 -0.1146 103 ASP C C 7308 O O . ASP C 44 ? 0.8007 0.7534 1.0750 0.0660 -0.1865 -0.1134 103 ASP C O 7309 C CB . ASP C 44 ? 0.9205 0.8599 1.1917 0.0834 -0.2016 -0.1240 103 ASP C CB 7310 C CG . ASP C 44 ? 0.9903 0.9248 1.2543 0.0911 -0.2039 -0.1286 103 ASP C CG 7311 O OD1 . ASP C 44 ? 1.0247 0.9585 1.2786 0.0918 -0.1994 -0.1279 103 ASP C OD1 7312 O OD2 . ASP C 44 ? 1.1509 1.0822 1.4192 0.0965 -0.2101 -0.1329 103 ASP C OD2 7313 N N . GLN C 45 ? 0.7742 0.7205 1.0492 0.0690 -0.1945 -0.1126 104 GLN C N 7314 C CA . GLN C 45 ? 0.8279 0.7797 1.1111 0.0616 -0.1915 -0.1088 104 GLN C CA 7315 C C . GLN C 45 ? 0.8758 0.8291 1.1501 0.0571 -0.1849 -0.1036 104 GLN C C 7316 O O . GLN C 45 ? 0.8688 0.8276 1.1480 0.0509 -0.1801 -0.1008 104 GLN C O 7317 C CB . GLN C 45 ? 0.8825 0.8327 1.1724 0.0614 -0.1967 -0.1084 104 GLN C CB 7318 C CG . GLN C 45 ? 1.2109 1.1670 1.5121 0.0542 -0.1944 -0.1055 104 GLN C CG 7319 C CD . GLN C 45 ? 1.3093 1.2712 1.6223 0.0518 -0.1931 -0.1079 104 GLN C CD 7320 O OE1 . GLN C 45 ? 1.2458 1.2127 1.5600 0.0470 -0.1871 -0.1057 104 GLN C OE1 7321 N NE2 . GLN C 45 ? 1.2726 1.2338 1.5945 0.0552 -0.1987 -0.1125 104 GLN C NE2 7322 N N . LEU C 46 ? 0.8275 0.7755 1.0886 0.0605 -0.1847 -0.1025 105 LEU C N 7323 C CA . LEU C 46 ? 0.8188 0.7676 1.0705 0.0569 -0.1787 -0.0978 105 LEU C CA 7324 C C . LEU C 46 ? 0.8324 0.7850 1.0816 0.0548 -0.1727 -0.0976 105 LEU C C 7325 O O . LEU C 46 ? 0.7919 0.7490 1.0415 0.0490 -0.1671 -0.0940 105 LEU C O 7326 C CB . LEU C 46 ? 0.6427 0.5848 0.8812 0.0615 -0.1802 -0.0970 105 LEU C CB 7327 C CG . LEU C 46 ? 0.4119 0.3509 0.6503 0.0616 -0.1841 -0.0949 105 LEU C CG 7328 C CD1 . LEU C 46 ? 0.4802 0.4120 0.7059 0.0674 -0.1864 -0.0949 105 LEU C CD1 7329 C CD2 . LEU C 46 ? 0.4084 0.3516 0.6483 0.0545 -0.1796 -0.0899 105 LEU C CD2 7330 N N . ARG C 47 ? 0.7778 0.7285 1.0241 0.0596 -0.1738 -0.1016 106 ARG C N 7331 C CA . ARG C 47 ? 0.7871 0.7412 1.0309 0.0581 -0.1685 -0.1019 106 ARG C CA 7332 C C . ARG C 47 ? 0.8332 0.7946 1.0889 0.0522 -0.1657 -0.1011 106 ARG C C 7333 O O . ARG C 47 ? 0.6997 0.6652 0.9538 0.0484 -0.1599 -0.0990 106 ARG C O 7334 C CB . ARG C 47 ? 0.7174 0.6682 0.9577 0.0646 -0.1710 -0.1068 106 ARG C CB 7335 C CG . ARG C 47 ? 0.8696 0.8131 1.0967 0.0707 -0.1727 -0.1076 106 ARG C CG 7336 C CD . ARG C 47 ? 0.9425 0.8827 1.1678 0.0775 -0.1759 -0.1130 106 ARG C CD 7337 N NE . ARG C 47 ? 1.0047 0.9485 1.2294 0.0763 -0.1714 -0.1142 106 ARG C NE 7338 C CZ . ARG C 47 ? 0.8806 0.8223 1.0939 0.0784 -0.1677 -0.1141 106 ARG C CZ 7339 N NH1 . ARG C 47 ? 0.7742 0.7103 0.9762 0.0817 -0.1679 -0.1128 106 ARG C NH1 7340 N NH2 . ARG C 47 ? 0.8616 0.8069 1.0750 0.0771 -0.1639 -0.1152 106 ARG C NH2 7341 N N . GLN C 48 ? 0.9620 0.9250 1.2298 0.0515 -0.1699 -0.1027 107 GLN C N 7342 C CA . GLN C 48 ? 0.9798 0.9495 1.2601 0.0464 -0.1678 -0.1023 107 GLN C CA 7343 C C . GLN C 48 ? 0.7870 0.7605 1.0693 0.0395 -0.1633 -0.0970 107 GLN C C 7344 O O . GLN C 48 ? 0.8295 0.8087 1.1211 0.0347 -0.1605 -0.0958 107 GLN C O 7345 C CB . GLN C 48 ? 1.0668 1.0366 1.3596 0.0482 -0.1740 -0.1060 107 GLN C CB 7346 C CG . GLN C 48 ? 1.1367 1.1126 1.4418 0.0452 -0.1728 -0.1077 107 GLN C CG 7347 C CD . GLN C 48 ? 1.1383 1.1136 1.4545 0.0482 -0.1793 -0.1121 107 GLN C CD 7348 O OE1 . GLN C 48 ? 1.1305 1.1010 1.4459 0.0520 -0.1848 -0.1136 107 GLN C OE1 7349 N NE2 . GLN C 48 ? 1.1272 1.1073 1.4539 0.0465 -0.1789 -0.1143 107 GLN C NE2 7350 N N . ASN C 49 ? 0.7306 0.7009 1.0040 0.0393 -0.1625 -0.0938 108 ASN C N 7351 C CA . ASN C 49 ? 0.7616 0.7349 1.0356 0.0333 -0.1583 -0.0888 108 ASN C CA 7352 C C . ASN C 49 ? 0.7283 0.7020 0.9910 0.0315 -0.1522 -0.0856 108 ASN C C 7353 O O . ASN C 49 ? 0.6639 0.6404 0.9262 0.0265 -0.1479 -0.0814 108 ASN C O 7354 C CB . ASN C 49 ? 0.8225 0.7923 1.0959 0.0337 -0.1621 -0.0873 108 ASN C CB 7355 C CG . ASN C 49 ? 0.9282 0.8993 1.2150 0.0332 -0.1669 -0.0891 108 ASN C CG 7356 O OD1 . ASN C 49 ? 1.0263 1.0017 1.3217 0.0280 -0.1649 -0.0868 108 ASN C OD1 7357 N ND2 . ASN C 49 ? 0.8604 0.8276 1.1490 0.0387 -0.1732 -0.0933 108 ASN C ND2 7358 N N . GLU C 50 ? 0.7636 0.7343 1.0171 0.0357 -0.1518 -0.0876 109 GLU C N 7359 C CA . GLU C 50 ? 0.7527 0.7233 0.9949 0.0345 -0.1462 -0.0849 109 GLU C CA 7360 C C . GLU C 50 ? 0.7270 0.7040 0.9734 0.0295 -0.1403 -0.0831 109 GLU C C 7361 O O . GLU C 50 ? 0.6514 0.6300 0.8919 0.0261 -0.1351 -0.0795 109 GLU C O 7362 C CB . GLU C 50 ? 0.6308 0.5967 0.8628 0.0406 -0.1473 -0.0878 109 GLU C CB 7363 C CG . GLU C 50 ? 0.6140 0.5731 0.8407 0.0461 -0.1529 -0.0894 109 GLU C CG 7364 C CD . GLU C 50 ? 0.8030 0.7572 1.0193 0.0522 -0.1536 -0.0922 109 GLU C CD 7365 O OE1 . GLU C 50 ? 0.8722 0.8283 1.0847 0.0517 -0.1494 -0.0925 109 GLU C OE1 7366 O OE2 . GLU C 50 ? 0.6973 0.6457 0.9092 0.0575 -0.1583 -0.0940 109 GLU C OE2 7367 N N . CYS C 51 ? 0.6682 0.6488 0.9248 0.0290 -0.1414 -0.0857 110 CYS C N 7368 C CA . CYS C 51 ? 0.8056 0.7923 1.0674 0.0244 -0.1363 -0.0842 110 CYS C CA 7369 C C . CYS C 51 ? 0.8340 0.8252 1.1100 0.0203 -0.1371 -0.0835 110 CYS C C 7370 O O . CYS C 51 ? 0.9199 0.9111 1.2047 0.0223 -0.1417 -0.0869 110 CYS C O 7371 C CB . CYS C 51 ? 1.0052 0.9926 1.2658 0.0273 -0.1359 -0.0877 110 CYS C CB 7372 S SG . CYS C 51 ? 1.0548 1.0495 1.3206 0.0221 -0.1296 -0.0859 110 CYS C SG 7373 N N . LYS C 52 ? 0.8400 0.8349 1.1181 0.0148 -0.1325 -0.0792 111 LYS C N 7374 C CA . LYS C 52 ? 0.9714 0.9705 1.2625 0.0105 -0.1325 -0.0780 111 LYS C CA 7375 C C . LYS C 52 ? 0.9371 0.9405 1.2386 0.0100 -0.1327 -0.0806 111 LYS C C 7376 O O . LYS C 52 ? 0.9853 0.9886 1.2959 0.0118 -0.1374 -0.0838 111 LYS C O 7377 C CB . LYS C 52 ? 0.9290 0.9314 1.2191 0.0049 -0.1268 -0.0729 111 LYS C CB 7378 C CG . LYS C 52 ? 0.9106 0.9136 1.2079 0.0018 -0.1280 -0.0707 111 LYS C CG 7379 C CD . LYS C 52 ? 0.9690 0.9740 1.2623 -0.0028 -0.1223 -0.0657 111 LYS C CD 7380 C CE . LYS C 52 ? 1.0017 1.0066 1.3003 -0.0055 -0.1236 -0.0635 111 LYS C CE 7381 N NZ . LYS C 52 ? 0.9869 0.9932 1.2802 -0.0095 -0.1182 -0.0589 111 LYS C NZ 7382 N N . LYS C 53 ? 0.8938 0.9011 1.1940 0.0077 -0.1274 -0.0792 112 LYS C N 7383 C CA . LYS C 53 ? 0.8430 0.8544 1.1519 0.0072 -0.1270 -0.0815 112 LYS C CA 7384 C C . LYS C 53 ? 0.8993 0.9105 1.1997 0.0096 -0.1247 -0.0829 112 LYS C C 7385 O O . LYS C 53 ? 0.8476 0.8595 1.1396 0.0079 -0.1197 -0.0800 112 LYS C O 7386 C CB . LYS C 53 ? 0.7541 0.7715 1.0725 0.0013 -0.1227 -0.0781 112 LYS C CB 7387 C CG . LYS C 53 ? 0.9063 0.9246 1.2355 -0.0012 -0.1250 -0.0772 112 LYS C CG 7388 C CD . LYS C 53 ? 0.9544 0.9787 1.2935 -0.0066 -0.1206 -0.0743 112 LYS C CD 7389 C CE . LYS C 53 ? 0.9260 0.9513 1.2764 -0.0091 -0.1228 -0.0735 112 LYS C CE 7390 N NZ . LYS C 53 ? 0.8001 0.8220 1.1445 -0.0098 -0.1231 -0.0708 112 LYS C NZ 7391 N N . ASN C 54 ? 0.8838 0.8938 1.1859 0.0138 -0.1283 -0.0876 113 ASN C N 7392 C CA . ASN C 54 ? 0.6997 0.7094 0.9938 0.0164 -0.1263 -0.0893 113 ASN C CA 7393 C C . ASN C 54 ? 0.7453 0.7610 1.0460 0.0131 -0.1225 -0.0887 113 ASN C C 7394 O O . ASN C 54 ? 0.7801 0.7979 1.0896 0.0142 -0.1250 -0.0920 113 ASN C O 7395 C CB . ASN C 54 ? 0.4903 0.4957 0.7820 0.0227 -0.1317 -0.0947 113 ASN C CB 7396 C CG . ASN C 54 ? 0.6237 0.6275 0.9045 0.0259 -0.1295 -0.0963 113 ASN C CG 7397 O OD1 . ASN C 54 ? 0.4647 0.4715 0.7416 0.0231 -0.1242 -0.0938 113 ASN C OD1 7398 N ND2 . ASN C 54 ? 0.5390 0.5380 0.8150 0.0318 -0.1338 -0.1005 113 ASN C ND2 7399 N N . ILE C 55 ? 0.6973 0.7158 0.9937 0.0093 -0.1166 -0.0847 114 ILE C N 7400 C CA . ILE C 55 ? 0.8044 0.8286 1.1063 0.0062 -0.1126 -0.0836 114 ILE C CA 7401 C C . ILE C 55 ? 0.8531 0.8776 1.1437 0.0062 -0.1077 -0.0820 114 ILE C C 7402 O O . ILE C 55 ? 0.8792 0.9011 1.1597 0.0060 -0.1055 -0.0796 114 ILE C O 7403 C CB . ILE C 55 ? 0.6548 0.6834 0.9663 0.0005 -0.1099 -0.0796 114 ILE C CB 7404 C CG1 . ILE C 55 ? 0.7431 0.7776 1.0610 -0.0026 -0.1059 -0.0784 114 ILE C CG1 7405 C CG2 . ILE C 55 ? 0.5894 0.6167 0.8933 -0.0020 -0.1065 -0.0750 114 ILE C CG2 7406 C CD1 . ILE C 55 ? 0.7501 0.7888 1.0776 -0.0079 -0.1030 -0.0745 114 ILE C CD1 7407 N N . THR C 56 ? 0.7822 0.8098 1.0744 0.0065 -0.1062 -0.0836 115 THR C N 7408 C CA . THR C 56 ? 0.7058 0.7339 0.9879 0.0065 -0.1016 -0.0823 115 THR C CA 7409 C C . THR C 56 ? 0.6482 0.6813 0.9329 0.0010 -0.0959 -0.0773 115 THR C C 7410 O O . THR C 56 ? 0.6500 0.6861 0.9447 -0.0025 -0.0955 -0.0752 115 THR C O 7411 C CB . THR C 56 ? 0.6586 0.6875 0.9402 0.0096 -0.1025 -0.0862 115 THR C CB 7412 O OG1 . THR C 56 ? 0.7225 0.7571 1.0155 0.0067 -0.1014 -0.0860 115 THR C OG1 7413 C CG2 . THR C 56 ? 0.4087 0.4332 0.6901 0.0150 -0.1086 -0.0915 115 THR C CG2 7414 N N . LEU C 57 ? 0.7631 0.7970 1.0389 0.0005 -0.0914 -0.0755 116 LEU C N 7415 C CA . LEU C 57 ? 0.8201 0.8583 1.0971 -0.0043 -0.0858 -0.0708 116 LEU C CA 7416 C C . LEU C 57 ? 0.8786 0.9223 1.1663 -0.0065 -0.0847 -0.0709 116 LEU C C 7417 O O . LEU C 57 ? 0.9630 1.0106 1.2574 -0.0107 -0.0816 -0.0673 116 LEU C O 7418 C CB . LEU C 57 ? 0.6658 0.7030 0.9298 -0.0039 -0.0816 -0.0691 116 LEU C CB 7419 C CG . LEU C 57 ? 0.7670 0.8070 1.0294 -0.0084 -0.0761 -0.0638 116 LEU C CG 7420 C CD1 . LEU C 57 ? 0.7252 0.7636 0.9890 -0.0103 -0.0765 -0.0613 116 LEU C CD1 7421 C CD2 . LEU C 57 ? 0.8475 0.8863 1.0970 -0.0075 -0.0725 -0.0627 116 LEU C CD2 7422 N N . SER C 58 ? 0.8388 0.8828 1.1281 -0.0035 -0.0871 -0.0749 117 SER C N 7423 C CA . SER C 58 ? 0.9245 0.9735 1.2239 -0.0051 -0.0864 -0.0754 117 SER C CA 7424 C C . SER C 58 ? 0.9167 0.9674 1.2301 -0.0067 -0.0895 -0.0760 117 SER C C 7425 O O . SER C 58 ? 0.9547 1.0100 1.2778 -0.0103 -0.0873 -0.0737 117 SER C O 7426 C CB . SER C 58 ? 0.8452 0.8937 1.1417 -0.0012 -0.0884 -0.0799 117 SER C CB 7427 O OG . SER C 58 ? 0.8774 0.9224 1.1762 0.0028 -0.0942 -0.0846 117 SER C OG 7428 N N . LYS C 59 ? 0.8036 0.8502 1.1178 -0.0038 -0.0946 -0.0791 118 LYS C N 7429 C CA . LYS C 59 ? 0.8672 0.9144 1.1938 -0.0047 -0.0983 -0.0801 118 LYS C CA 7430 C C . LYS C 59 ? 0.8291 0.8777 1.1595 -0.0092 -0.0957 -0.0754 118 LYS C C 7431 O O . LYS C 59 ? 1.0131 1.0640 1.3554 -0.0115 -0.0969 -0.0749 118 LYS C O 7432 C CB . LYS C 59 ? 0.8655 0.9075 1.1902 -0.0001 -0.1044 -0.0844 118 LYS C CB 7433 C CG . LYS C 59 ? 0.8556 0.8979 1.1929 -0.0005 -0.1088 -0.0859 118 LYS C CG 7434 C CD . LYS C 59 ? 0.9971 1.0438 1.3470 -0.0013 -0.1099 -0.0881 118 LYS C CD 7435 C CE . LYS C 59 ? 0.9814 1.0282 1.3441 -0.0018 -0.1144 -0.0897 118 LYS C CE 7436 N NZ . LYS C 59 ? 0.8558 0.9069 1.2313 -0.0025 -0.1156 -0.0919 118 LYS C NZ 7437 N N . PHE C 60 ? 0.8284 0.8757 1.1486 -0.0104 -0.0919 -0.0719 119 PHE C N 7438 C CA . PHE C 60 ? 0.8580 0.9063 1.1801 -0.0144 -0.0890 -0.0673 119 PHE C CA 7439 C C . PHE C 60 ? 0.8214 0.8754 1.1520 -0.0187 -0.0846 -0.0642 119 PHE C C 7440 O O . PHE C 60 ? 0.8663 0.9221 1.2044 -0.0220 -0.0834 -0.0614 119 PHE C O 7441 C CB . PHE C 60 ? 0.9884 1.0338 1.2969 -0.0143 -0.0860 -0.0647 119 PHE C CB 7442 C CG . PHE C 60 ? 0.9741 1.0204 1.2833 -0.0183 -0.0827 -0.0600 119 PHE C CG 7443 C CD1 . PHE C 60 ? 0.8837 0.9275 1.1952 -0.0186 -0.0854 -0.0597 119 PHE C CD1 7444 C CD2 . PHE C 60 ? 1.0435 1.0932 1.3508 -0.0216 -0.0769 -0.0560 119 PHE C CD2 7445 C CE1 . PHE C 60 ? 0.7766 0.8212 1.0884 -0.0222 -0.0823 -0.0555 119 PHE C CE1 7446 C CE2 . PHE C 60 ? 0.8865 0.9369 1.1943 -0.0250 -0.0738 -0.0519 119 PHE C CE2 7447 C CZ . PHE C 60 ? 0.7405 0.7885 1.0506 -0.0253 -0.0764 -0.0516 119 PHE C CZ 7448 N N . TRP C 61 ? 0.9763 1.0332 1.3059 -0.0185 -0.0823 -0.0645 120 TRP C N 7449 C CA . TRP C 61 ? 1.0564 1.1188 1.3941 -0.0221 -0.0783 -0.0616 120 TRP C CA 7450 C C . TRP C 61 ? 1.1235 1.1886 1.4761 -0.0228 -0.0812 -0.0637 120 TRP C C 7451 O O . TRP C 61 ? 1.1365 1.2017 1.4922 -0.0202 -0.0846 -0.0678 120 TRP C O 7452 C CB . TRP C 61 ? 1.1678 1.2323 1.4995 -0.0216 -0.0751 -0.0614 120 TRP C CB 7453 C CG . TRP C 61 ? 1.4593 1.5294 1.8008 -0.0243 -0.0723 -0.0597 120 TRP C CG 7454 C CD1 . TRP C 61 ? 1.6924 1.7652 2.0387 -0.0232 -0.0732 -0.0623 120 TRP C CD1 7455 C CD2 . TRP C 61 ? 1.5162 1.5898 1.8644 -0.0286 -0.0681 -0.0551 120 TRP C CD2 7456 N NE1 . TRP C 61 ? 1.7767 1.8545 2.1320 -0.0265 -0.0699 -0.0594 120 TRP C NE1 7457 C CE2 . TRP C 61 ? 1.6736 1.7519 2.0302 -0.0299 -0.0667 -0.0549 120 TRP C CE2 7458 C CE3 . TRP C 61 ? 1.3784 1.4515 1.7257 -0.0314 -0.0654 -0.0511 120 TRP C CE3 7459 C CZ2 . TRP C 61 ? 1.5404 1.6228 1.9049 -0.0337 -0.0626 -0.0508 120 TRP C CZ2 7460 C CZ3 . TRP C 61 ? 1.3382 1.4153 1.6932 -0.0351 -0.0613 -0.0471 120 TRP C CZ3 7461 C CH2 . TRP C 61 ? 1.3358 1.4174 1.6993 -0.0362 -0.0599 -0.0470 120 TRP C CH2 7462 N N . GLU C 71 ? 0.6691 0.7281 0.9242 0.0049 -0.0711 -0.0830 130 GLU C N 7463 C CA . GLU C 71 ? 0.8108 0.8640 1.0565 0.0095 -0.0739 -0.0868 130 GLU C CA 7464 C C . GLU C 71 ? 0.8052 0.8575 1.0417 0.0129 -0.0733 -0.0897 130 GLU C C 7465 O O . GLU C 71 ? 0.5943 0.6442 0.8300 0.0171 -0.0769 -0.0947 130 GLU C O 7466 C CB . GLU C 71 ? 0.7881 0.8390 1.0413 0.0120 -0.0795 -0.0908 130 GLU C CB 7467 C CG . GLU C 71 ? 0.7870 0.8371 1.0461 0.0095 -0.0805 -0.0883 130 GLU C CG 7468 C CD . GLU C 71 ? 0.9026 0.9490 1.1661 0.0127 -0.0863 -0.0923 130 GLU C CD 7469 O OE1 . GLU C 71 ? 0.9775 1.0220 1.2395 0.0170 -0.0895 -0.0972 130 GLU C OE1 7470 O OE2 . GLU C 71 ? 0.9103 0.9557 1.1784 0.0111 -0.0875 -0.0907 130 GLU C OE2 7471 N N . ASP C 72 ? 0.8585 0.9126 1.0880 0.0112 -0.0686 -0.0866 131 ASP C N 7472 C CA . ASP C 72 ? 0.9046 0.9581 1.1245 0.0140 -0.0674 -0.0888 131 ASP C CA 7473 C C . ASP C 72 ? 0.8754 0.9227 1.0822 0.0180 -0.0679 -0.0910 131 ASP C C 7474 O O . ASP C 72 ? 0.9641 1.0092 1.1640 0.0219 -0.0688 -0.0948 131 ASP C O 7475 C CB . ASP C 72 ? 0.9826 1.0403 1.1997 0.0107 -0.0622 -0.0845 131 ASP C CB 7476 C CG . ASP C 72 ? 1.0355 1.0938 1.2520 0.0067 -0.0587 -0.0790 131 ASP C CG 7477 O OD1 . ASP C 72 ? 0.9713 1.0336 1.1980 0.0029 -0.0578 -0.0759 131 ASP C OD1 7478 O OD2 . ASP C 72 ? 1.1505 1.2054 1.3565 0.0074 -0.0569 -0.0778 131 ASP C OD2 7479 N N . ASP C 73 ? 0.7469 0.7911 0.9499 0.0171 -0.0672 -0.0887 132 ASP C N 7480 C CA . ASP C 73 ? 0.7341 0.7724 0.9248 0.0208 -0.0675 -0.0904 132 ASP C CA 7481 C C . ASP C 73 ? 0.7058 0.7398 0.8978 0.0221 -0.0708 -0.0912 132 ASP C C 7482 O O . ASP C 73 ? 0.6248 0.6606 0.8269 0.0196 -0.0724 -0.0898 132 ASP C O 7483 C CB . ASP C 73 ? 0.5180 0.5563 0.6986 0.0188 -0.0624 -0.0864 132 ASP C CB 7484 C CG . ASP C 73 ? 0.5699 0.6112 0.7553 0.0137 -0.0596 -0.0810 132 ASP C CG 7485 O OD1 . ASP C 73 ? 0.6871 0.7321 0.8715 0.0107 -0.0555 -0.0775 132 ASP C OD1 7486 O OD2 . ASP C 73 ? 0.5653 0.6051 0.7551 0.0128 -0.0614 -0.0801 132 ASP C OD2 7487 N N . ASN C 74 ? 0.5802 0.6086 0.7618 0.0260 -0.0717 -0.0934 133 ASN C N 7488 C CA . ASN C 74 ? 0.5894 0.6130 0.7708 0.0282 -0.0750 -0.0946 133 ASN C CA 7489 C C . ASN C 74 ? 0.6398 0.6634 0.8214 0.0244 -0.0730 -0.0898 133 ASN C C 7490 O O . ASN C 74 ? 0.5698 0.5907 0.7542 0.0251 -0.0759 -0.0901 133 ASN C O 7491 C CB . ASN C 74 ? 0.6262 0.6436 0.7956 0.0337 -0.0761 -0.0981 133 ASN C CB 7492 C CG . ASN C 74 ? 0.5288 0.5452 0.6984 0.0382 -0.0791 -0.1035 133 ASN C CG 7493 O OD1 . ASN C 74 ? 0.6629 0.6812 0.8286 0.0387 -0.0769 -0.1044 133 ASN C OD1 7494 N ND2 . ASN C 74 ? 0.5900 0.6035 0.7642 0.0416 -0.0841 -0.1073 133 ASN C ND2 7495 N N . TRP C 75 ? 0.4792 0.5058 0.6578 0.0207 -0.0682 -0.0856 134 TRP C N 7496 C CA . TRP C 75 ? 0.5988 0.6262 0.7787 0.0167 -0.0660 -0.0809 134 TRP C CA 7497 C C . TRP C 75 ? 0.6891 0.7202 0.8826 0.0136 -0.0677 -0.0796 134 TRP C C 7498 O O . TRP C 75 ? 0.6978 0.7272 0.8947 0.0128 -0.0695 -0.0786 134 TRP C O 7499 C CB . TRP C 75 ? 0.6204 0.6506 0.7948 0.0135 -0.0604 -0.0768 134 TRP C CB 7500 C CG . TRP C 75 ? 0.5838 0.6101 0.7446 0.0156 -0.0581 -0.0767 134 TRP C CG 7501 C CD1 . TRP C 75 ? 0.5056 0.5299 0.6601 0.0142 -0.0557 -0.0737 134 TRP C CD1 7502 C CD2 . TRP C 75 ? 0.6091 0.6331 0.7609 0.0194 -0.0577 -0.0798 134 TRP C CD2 7503 N NE1 . TRP C 75 ? 0.6376 0.6584 0.7800 0.0169 -0.0539 -0.0747 134 TRP C NE1 7504 C CE2 . TRP C 75 ? 0.6223 0.6428 0.7627 0.0201 -0.0551 -0.0784 134 TRP C CE2 7505 C CE3 . TRP C 75 ? 0.4890 0.5134 0.6412 0.0223 -0.0594 -0.0837 134 TRP C CE3 7506 C CZ2 . TRP C 75 ? 0.6238 0.6412 0.7534 0.0236 -0.0540 -0.0807 134 TRP C CZ2 7507 C CZ3 . TRP C 75 ? 0.4358 0.4571 0.5769 0.0258 -0.0583 -0.0861 134 TRP C CZ3 7508 C CH2 . TRP C 75 ? 0.4985 0.5163 0.6285 0.0264 -0.0556 -0.0845 134 TRP C CH2 7509 N N . GLU C 76 ? 0.6558 0.6918 0.8571 0.0118 -0.0672 -0.0796 135 GLU C N 7510 C CA . GLU C 76 ? 0.7471 0.7870 0.9619 0.0087 -0.0684 -0.0784 135 GLU C CA 7511 C C . GLU C 76 ? 0.6877 0.7251 0.9092 0.0113 -0.0740 -0.0821 135 GLU C C 7512 O O . GLU C 76 ? 0.5186 0.5570 0.7488 0.0091 -0.0755 -0.0808 135 GLU C O 7513 C CB . GLU C 76 ? 0.4321 0.4775 0.6530 0.0069 -0.0667 -0.0780 135 GLU C CB 7514 C CG . GLU C 76 ? 0.7360 0.7847 0.9528 0.0035 -0.0611 -0.0734 135 GLU C CG 7515 C CD . GLU C 76 ? 0.9728 1.0266 1.1947 0.0021 -0.0595 -0.0731 135 GLU C CD 7516 O OE1 . GLU C 76 ? 1.0355 1.0901 1.2631 0.0041 -0.0626 -0.0768 135 GLU C OE1 7517 O OE2 . GLU C 76 ? 0.9520 1.0089 1.1723 -0.0009 -0.0551 -0.0691 135 GLU C OE2 7518 N N . ARG C 77 ? 0.5272 0.5615 0.7447 0.0161 -0.0771 -0.0870 136 ARG C N 7519 C CA . ARG C 77 ? 0.4949 0.5262 0.7177 0.0193 -0.0827 -0.0909 136 ARG C CA 7520 C C . ARG C 77 ? 0.7067 0.7333 0.9255 0.0201 -0.0843 -0.0900 136 ARG C C 7521 O O . ARG C 77 ? 0.7730 0.7985 0.9991 0.0204 -0.0880 -0.0910 136 ARG C O 7522 C CB . ARG C 77 ? 0.5272 0.5557 0.7451 0.0247 -0.0854 -0.0963 136 ARG C CB 7523 C CG . ARG C 77 ? 0.6695 0.7024 0.8931 0.0245 -0.0853 -0.0982 136 ARG C CG 7524 C CD . ARG C 77 ? 0.6654 0.6951 0.8850 0.0303 -0.0886 -0.1041 136 ARG C CD 7525 N NE . ARG C 77 ? 0.8214 0.8546 1.0411 0.0304 -0.0870 -0.1055 136 ARG C NE 7526 C CZ . ARG C 77 ? 0.9277 0.9604 1.1366 0.0314 -0.0836 -0.1052 136 ARG C CZ 7527 N NH1 . ARG C 77 ? 0.9798 1.0086 1.1772 0.0323 -0.0814 -0.1036 136 ARG C NH1 7528 N NH2 . ARG C 77 ? 0.8281 0.8642 1.0375 0.0314 -0.0823 -0.1064 136 ARG C NH2 7529 N N . PHE C 78 ? 0.6695 0.6933 0.8767 0.0205 -0.0813 -0.0881 137 PHE C N 7530 C CA . PHE C 78 ? 0.4713 0.4909 0.6739 0.0210 -0.0821 -0.0867 137 PHE C CA 7531 C C . PHE C 78 ? 0.5898 0.6122 0.7994 0.0159 -0.0806 -0.0822 137 PHE C C 7532 O O . PHE C 78 ? 0.6170 0.6375 0.8306 0.0159 -0.0836 -0.0822 137 PHE C O 7533 C CB . PHE C 78 ? 0.5549 0.5710 0.7435 0.0225 -0.0790 -0.0857 137 PHE C CB 7534 C CG . PHE C 78 ? 0.5720 0.5852 0.7560 0.0214 -0.0783 -0.0828 137 PHE C CG 7535 C CD1 . PHE C 78 ? 0.5160 0.5243 0.6990 0.0246 -0.0824 -0.0847 137 PHE C CD1 7536 C CD2 . PHE C 78 ? 0.3712 0.3865 0.5519 0.0174 -0.0735 -0.0781 137 PHE C CD2 7537 C CE1 . PHE C 78 ? 0.3761 0.3817 0.5547 0.0236 -0.0818 -0.0820 137 PHE C CE1 7538 C CE2 . PHE C 78 ? 0.4352 0.4478 0.6116 0.0164 -0.0729 -0.0756 137 PHE C CE2 7539 C CZ . PHE C 78 ? 0.4784 0.4862 0.6537 0.0195 -0.0770 -0.0775 137 PHE C CZ 7540 N N . TYR C 79 ? 0.4826 0.5097 0.6934 0.0117 -0.0760 -0.0784 138 TYR C N 7541 C CA . TYR C 79 ? 0.5317 0.5619 0.7489 0.0068 -0.0739 -0.0740 138 TYR C CA 7542 C C . TYR C 79 ? 0.6221 0.6545 0.8529 0.0055 -0.0773 -0.0748 138 TYR C C 7543 O O . TYR C 79 ? 0.6713 0.7032 0.9063 0.0035 -0.0781 -0.0729 138 TYR C O 7544 C CB . TYR C 79 ? 0.4351 0.4700 0.6519 0.0030 -0.0685 -0.0703 138 TYR C CB 7545 C CG . TYR C 79 ? 0.6471 0.6802 0.8510 0.0036 -0.0647 -0.0687 138 TYR C CG 7546 C CD1 . TYR C 79 ? 0.6790 0.7073 0.8740 0.0051 -0.0650 -0.0684 138 TYR C CD1 7547 C CD2 . TYR C 79 ? 0.7154 0.7516 0.9160 0.0025 -0.0609 -0.0675 138 TYR C CD2 7548 C CE1 . TYR C 79 ? 0.6356 0.6623 0.8192 0.0056 -0.0615 -0.0671 138 TYR C CE1 7549 C CE2 . TYR C 79 ? 0.6459 0.6804 0.8349 0.0029 -0.0575 -0.0662 138 TYR C CE2 7550 C CZ . TYR C 79 ? 0.6783 0.7081 0.8590 0.0044 -0.0578 -0.0660 138 TYR C CZ 7551 O OH . TYR C 79 ? 0.5436 0.5717 0.7130 0.0049 -0.0543 -0.0647 138 TYR C OH 7552 N N . SER C 80 ? 0.6362 0.6708 0.8737 0.0067 -0.0792 -0.0778 139 SER C N 7553 C CA . SER C 80 ? 0.6895 0.7266 0.9406 0.0055 -0.0824 -0.0789 139 SER C CA 7554 C C . SER C 80 ? 0.6550 0.6876 0.9079 0.0084 -0.0877 -0.0817 139 SER C C 7555 O O . SER C 80 ? 0.7401 0.7738 1.0025 0.0064 -0.0897 -0.0809 139 SER C O 7556 C CB . SER C 80 ? 0.5065 0.5467 0.7634 0.0066 -0.0834 -0.0819 139 SER C CB 7557 O OG . SER C 80 ? 0.6042 0.6495 0.8629 0.0031 -0.0788 -0.0788 139 SER C OG 7558 N N . ASN C 81 ? 0.5805 0.6080 0.8242 0.0131 -0.0900 -0.0849 140 ASN C N 7559 C CA . ASN C 81 ? 0.6357 0.6586 0.8804 0.0166 -0.0954 -0.0878 140 ASN C CA 7560 C C . ASN C 81 ? 0.5614 0.5804 0.7994 0.0164 -0.0952 -0.0854 140 ASN C C 7561 O O . ASN C 81 ? 0.5264 0.5407 0.7626 0.0199 -0.0993 -0.0877 140 ASN C O 7562 C CB . ASN C 81 ? 0.6594 0.6785 0.8982 0.0225 -0.0984 -0.0930 140 ASN C CB 7563 C CG . ASN C 81 ? 0.6005 0.6227 0.8480 0.0235 -0.1006 -0.0965 140 ASN C CG 7564 O OD1 . ASN C 81 ? 0.5864 0.6080 0.8422 0.0252 -0.1053 -0.0995 140 ASN C OD1 7565 N ND2 . ASN C 81 ? 0.4468 0.4724 0.6925 0.0225 -0.0971 -0.0962 140 ASN C ND2 7566 N N . ILE C 82 ? 0.3711 0.3918 0.6053 0.0126 -0.0904 -0.0808 141 ILE C N 7567 C CA . ILE C 82 ? 0.6596 0.6773 0.8888 0.0117 -0.0900 -0.0781 141 ILE C CA 7568 C C . ILE C 82 ? 0.6273 0.6455 0.8667 0.0101 -0.0933 -0.0776 141 ILE C C 7569 O O . ILE C 82 ? 0.6690 0.6917 0.9178 0.0060 -0.0917 -0.0753 141 ILE C O 7570 C CB . ILE C 82 ? 0.5958 0.6159 0.8199 0.0077 -0.0841 -0.0732 141 ILE C CB 7571 C CG1 . ILE C 82 ? 0.5453 0.5641 0.7579 0.0096 -0.0810 -0.0736 141 ILE C CG1 7572 C CG2 . ILE C 82 ? 0.5730 0.5905 0.7936 0.0064 -0.0839 -0.0704 141 ILE C CG2 7573 C CD1 . ILE C 82 ? 0.4562 0.4775 0.6639 0.0058 -0.0753 -0.0691 141 ILE C CD1 7574 N N . GLY C 83 ? 0.5695 0.5828 0.8071 0.0136 -0.0978 -0.0798 142 GLY C N 7575 C CA . GLY C 83 ? 0.6998 0.7129 0.9471 0.0129 -0.1017 -0.0802 142 GLY C CA 7576 C C . GLY C 83 ? 0.5914 0.6035 0.8373 0.0101 -0.1007 -0.0764 142 GLY C C 7577 O O . GLY C 83 ? 0.4252 0.4364 0.6621 0.0089 -0.0971 -0.0735 142 GLY C O 7578 N N . SER C 84 ? 0.6997 0.7120 0.9546 0.0091 -0.1041 -0.0765 143 SER C N 7579 C CA . SER C 84 ? 0.6813 0.6929 0.9362 0.0064 -0.1035 -0.0730 143 SER C CA 7580 C C . SER C 84 ? 0.7039 0.7093 0.9504 0.0100 -0.1068 -0.0739 143 SER C C 7581 O O . SER C 84 ? 0.7384 0.7425 0.9816 0.0082 -0.1058 -0.0709 143 SER C O 7582 C CB . SER C 84 ? 0.5641 0.5788 0.8327 0.0035 -0.1054 -0.0725 143 SER C CB 7583 O OG . SER C 84 ? 0.6252 0.6379 0.8999 0.0069 -0.1112 -0.0768 143 SER C OG 7584 N N . CYS C 85 ? 0.6326 0.6341 0.8755 0.0153 -0.1107 -0.0780 144 CYS C N 7585 C CA . CYS C 85 ? 0.8328 0.8281 1.0678 0.0194 -0.1141 -0.0791 144 CYS C CA 7586 C C . CYS C 85 ? 0.7756 0.7672 0.9991 0.0239 -0.1136 -0.0814 144 CYS C C 7587 O O . CYS C 85 ? 0.7055 0.6915 0.9218 0.0282 -0.1166 -0.0828 144 CYS C O 7588 C CB . CYS C 85 ? 1.0318 1.0248 1.2743 0.0221 -0.1206 -0.0822 144 CYS C CB 7589 S SG . CYS C 85 ? 0.8345 0.8308 1.0896 0.0173 -0.1216 -0.0796 144 CYS C SG 7590 N N . SER C 86 ? 0.8214 0.8160 1.0432 0.0230 -0.1099 -0.0815 145 SER C N 7591 C CA . SER C 86 ? 0.5474 0.5389 0.7585 0.0270 -0.1088 -0.0835 145 SER C CA 7592 C C . SER C 86 ? 0.6511 0.6471 0.8608 0.0241 -0.1034 -0.0821 145 SER C C 7593 O O . SER C 86 ? 0.6458 0.6471 0.8647 0.0206 -0.1020 -0.0812 145 SER C O 7594 C CB . SER C 86 ? 0.4570 0.4453 0.6692 0.0327 -0.1138 -0.0888 145 SER C CB 7595 O OG . SER C 86 ? 0.8504 0.8428 1.0692 0.0322 -0.1134 -0.0910 145 SER C OG 7596 N N . VAL C 87 ? 0.4991 0.4929 0.6975 0.0258 -0.1004 -0.0818 146 VAL C N 7597 C CA . VAL C 87 ? 0.5957 0.5934 0.7916 0.0236 -0.0955 -0.0806 146 VAL C CA 7598 C C . VAL C 87 ? 0.4907 0.4898 0.6902 0.0260 -0.0970 -0.0846 146 VAL C C 7599 O O . VAL C 87 ? 0.4857 0.4898 0.6900 0.0232 -0.0942 -0.0838 146 VAL C O 7600 C CB . VAL C 87 ? 0.6723 0.6669 0.8546 0.0247 -0.0919 -0.0792 146 VAL C CB 7601 C CG1 . VAL C 87 ? 0.4444 0.4418 0.6232 0.0241 -0.0878 -0.0793 146 VAL C CG1 7602 C CG2 . VAL C 87 ? 0.5661 0.5611 0.7457 0.0209 -0.0890 -0.0746 146 VAL C CG2 7603 N N . TYR C 88 ? 0.4829 0.4775 0.6802 0.0315 -0.1014 -0.0889 147 TYR C N 7604 C CA . TYR C 88 ? 0.3847 0.3801 0.5852 0.0345 -0.1034 -0.0932 147 TYR C CA 7605 C C . TYR C 88 ? 0.4678 0.4587 0.6708 0.0397 -0.1097 -0.0976 147 TYR C C 7606 O O . TYR C 88 ? 0.5594 0.5454 0.7576 0.0422 -0.1120 -0.0976 147 TYR C O 7607 C CB . TYR C 88 ? 0.3854 0.3796 0.5754 0.0367 -0.1001 -0.0942 147 TYR C CB 7608 C CG . TYR C 88 ? 0.5386 0.5261 0.7167 0.0418 -0.1012 -0.0960 147 TYR C CG 7609 C CD1 . TYR C 88 ? 0.5426 0.5276 0.7120 0.0408 -0.0985 -0.0927 147 TYR C CD1 7610 C CD2 . TYR C 88 ? 0.3921 0.3756 0.5676 0.0478 -0.1049 -0.1009 147 TYR C CD2 7611 C CE1 . TYR C 88 ? 0.4403 0.4191 0.5989 0.0456 -0.0993 -0.0942 147 TYR C CE1 7612 C CE2 . TYR C 88 ? 0.6440 0.6210 0.8085 0.0527 -0.1058 -0.1025 147 TYR C CE2 7613 C CZ . TYR C 88 ? 0.4611 0.4359 0.6173 0.0516 -0.1029 -0.0990 147 TYR C CZ 7614 O OH . TYR C 88 ? 0.5570 0.5254 0.7025 0.0565 -0.1036 -0.1004 147 TYR C OH 7615 N N . SER C 89 ? 0.7219 0.7147 0.9326 0.0413 -0.1125 -0.1013 148 SER C N 7616 C CA . SER C 89 ? 0.6940 0.6827 0.9071 0.0466 -0.1186 -0.1060 148 SER C CA 7617 C C . SER C 89 ? 0.7317 0.7196 0.9431 0.0511 -0.1199 -0.1109 148 SER C C 7618 O O . SER C 89 ? 0.8395 0.8237 1.0520 0.0562 -0.1249 -0.1152 148 SER C O 7619 C CB . SER C 89 ? 0.4376 0.4289 0.6645 0.0444 -0.1222 -0.1061 148 SER C CB 7620 O OG . SER C 89 ? 0.5165 0.5145 0.7525 0.0393 -0.1194 -0.1042 148 SER C OG 7621 N N . ASP C 90 ? 0.5860 0.5772 0.7942 0.0494 -0.1156 -0.1102 149 ASP C N 7622 C CA . ASP C 90 ? 0.6378 0.6288 0.8444 0.0533 -0.1164 -0.1147 149 ASP C CA 7623 C C . ASP C 90 ? 0.6552 0.6427 0.8474 0.0560 -0.1131 -0.1149 149 ASP C C 7624 O O . ASP C 90 ? 0.5438 0.5341 0.7317 0.0530 -0.1081 -0.1122 149 ASP C O 7625 C CB . ASP C 90 ? 0.6158 0.6137 0.8312 0.0493 -0.1143 -0.1142 149 ASP C CB 7626 C CG . ASP C 90 ? 0.6770 0.6750 0.8919 0.0532 -0.1156 -0.1192 149 ASP C CG 7627 O OD1 . ASP C 90 ? 0.6173 0.6099 0.8260 0.0592 -0.1187 -0.1233 149 ASP C OD1 7628 O OD2 . ASP C 90 ? 0.7050 0.7084 0.9254 0.0504 -0.1136 -0.1189 149 ASP C OD2 7629 N N . ASP C 91 ? 0.4001 0.3811 0.5850 0.0621 -0.1162 -0.1180 150 ASP C N 7630 C CA . ASP C 91 ? 0.7169 0.6935 0.8877 0.0653 -0.1134 -0.1183 150 ASP C CA 7631 C C . ASP C 91 ? 0.7222 0.7004 0.8886 0.0665 -0.1108 -0.1205 150 ASP C C 7632 O O . ASP C 91 ? 0.5243 0.5019 0.6811 0.0660 -0.1063 -0.1187 150 ASP C O 7633 C CB . ASP C 91 ? 0.5132 0.4823 0.6782 0.0720 -0.1177 -0.1215 150 ASP C CB 7634 C CG . ASP C 91 ? 0.5962 0.5628 0.7623 0.0710 -0.1197 -0.1188 150 ASP C CG 7635 O OD1 . ASP C 91 ? 0.5684 0.5387 0.7379 0.0652 -0.1170 -0.1142 150 ASP C OD1 7636 O OD2 . ASP C 91 ? 0.5704 0.5312 0.7337 0.0762 -0.1238 -0.1213 150 ASP C OD2 7637 N N . GLN C 92 ? 0.6867 0.6670 0.8602 0.0682 -0.1135 -0.1244 151 GLN C N 7638 C CA . GLN C 92 ? 0.5860 0.5675 0.7552 0.0701 -0.1115 -0.1271 151 GLN C CA 7639 C C . GLN C 92 ? 0.6698 0.6573 0.8394 0.0643 -0.1060 -0.1232 151 GLN C C 7640 O O . GLN C 92 ? 0.5753 0.5623 0.7354 0.0650 -0.1023 -0.1230 151 GLN C O 7641 C CB . GLN C 92 ? 0.4959 0.4785 0.6734 0.0731 -0.1160 -0.1322 151 GLN C CB 7642 C CG . GLN C 92 ? 0.6101 0.5935 0.7827 0.0756 -0.1144 -0.1355 151 GLN C CG 7643 C CD . GLN C 92 ? 0.7498 0.7273 0.9073 0.0804 -0.1125 -0.1369 151 GLN C CD 7644 O OE1 . GLN C 92 ? 0.8627 0.8414 1.0127 0.0792 -0.1079 -0.1355 151 GLN C OE1 7645 N NE2 . GLN C 92 ? 0.7553 0.7262 0.9084 0.0859 -0.1160 -0.1395 151 GLN C NE2 7646 N N . MSE C 93 ? 0.4994 0.4924 0.6797 0.0586 -0.1054 -0.1200 152 MSE C N 7647 C CA . MSE C 93 ? 0.6774 0.6762 0.8587 0.0531 -0.1002 -0.1161 152 MSE C CA 7648 C C . MSE C 93 ? 0.6737 0.6713 0.8461 0.0506 -0.0958 -0.1114 152 MSE C C 7649 O O . MSE C 93 ? 0.5029 0.5035 0.6712 0.0476 -0.0911 -0.1087 152 MSE C O 7650 C CB . MSE C 93 ? 0.7877 0.7926 0.9833 0.0480 -0.1009 -0.1140 152 MSE C CB 7651 C CG . MSE C 93 ? 0.8714 0.8766 1.0715 0.0442 -0.1008 -0.1098 152 MSE C CG 7652 SE SE . MSE C 93 ? 1.2512 1.2606 1.4476 0.0373 -0.0936 -0.1026 152 MSE C SE 7653 C CE . MSE C 93 ? 0.6781 0.6877 0.8835 0.0337 -0.0956 -0.0991 152 MSE C CE 7654 N N . ILE C 94 ? 0.7337 0.7267 0.9029 0.0519 -0.0975 -0.1106 153 ILE C N 7655 C CA . ILE C 94 ? 0.5046 0.4957 0.6647 0.0503 -0.0937 -0.1067 153 ILE C CA 7656 C C . ILE C 94 ? 0.5259 0.5128 0.6728 0.0545 -0.0918 -0.1087 153 ILE C C 7657 O O . ILE C 94 ? 0.4453 0.4331 0.5849 0.0524 -0.0870 -0.1059 153 ILE C O 7658 C CB . ILE C 94 ? 0.6164 0.6038 0.7769 0.0507 -0.0963 -0.1054 153 ILE C CB 7659 C CG1 . ILE C 94 ? 0.3894 0.3814 0.5614 0.0453 -0.0967 -0.1020 153 ILE C CG1 7660 C CG2 . ILE C 94 ? 0.5276 0.5115 0.6764 0.0508 -0.0929 -0.1026 153 ILE C CG2 7661 C CD1 . ILE C 94 ? 0.4321 0.4292 0.6047 0.0394 -0.0912 -0.0972 153 ILE C CD1 7662 N N . ASP C 95 ? 0.4936 0.4759 0.6376 0.0606 -0.0954 -0.1136 154 ASP C N 7663 C CA . ASP C 95 ? 0.6718 0.6500 0.8038 0.0653 -0.0939 -0.1162 154 ASP C CA 7664 C C . ASP C 95 ? 0.4684 0.4510 0.5989 0.0633 -0.0901 -0.1161 154 ASP C C 7665 O O . ASP C 95 ? 0.6913 0.6721 0.8112 0.0646 -0.0867 -0.1160 154 ASP C O 7666 C CB . ASP C 95 ? 0.4050 0.3780 0.5358 0.0722 -0.0988 -0.1219 154 ASP C CB 7667 C CG . ASP C 95 ? 0.7393 0.7064 0.8673 0.0754 -0.1019 -0.1221 154 ASP C CG 7668 O OD1 . ASP C 95 ? 0.7320 0.6999 0.8622 0.0717 -0.1012 -0.1180 154 ASP C OD1 7669 O OD2 . ASP C 95 ? 0.6221 0.5835 0.7454 0.0818 -0.1050 -0.1263 154 ASP C OD2 7670 N N . ASN C 96 ? 0.4249 0.4133 0.5660 0.0602 -0.0908 -0.1162 155 ASN C N 7671 C CA . ASN C 96 ? 0.5849 0.5782 0.7258 0.0577 -0.0872 -0.1154 155 ASN C CA 7672 C C . ASN C 96 ? 0.6287 0.6250 0.7666 0.0523 -0.0819 -0.1098 155 ASN C C 7673 O O . ASN C 96 ? 0.5889 0.5862 0.7195 0.0517 -0.0780 -0.1089 155 ASN C O 7674 C CB . ASN C 96 ? 0.4423 0.4409 0.5960 0.0557 -0.0895 -0.1167 155 ASN C CB 7675 C CG . ASN C 96 ? 0.6353 0.6313 0.7918 0.0612 -0.0946 -0.1227 155 ASN C CG 7676 O OD1 . ASN C 96 ? 0.6283 0.6191 0.7758 0.0667 -0.0955 -0.1263 155 ASN C OD1 7677 N ND2 . ASN C 96 ? 0.6573 0.6569 0.8265 0.0599 -0.0978 -0.1239 155 ASN C ND2 7678 N N . LEU C 97 ? 0.4370 0.4347 0.5805 0.0485 -0.0819 -0.1061 156 LEU C N 7679 C CA . LEU C 97 ? 0.5217 0.5219 0.6627 0.0435 -0.0772 -0.1007 156 LEU C CA 7680 C C . LEU C 97 ? 0.6527 0.6481 0.7802 0.0456 -0.0745 -0.1000 156 LEU C C 7681 O O . LEU C 97 ? 0.4962 0.4934 0.6179 0.0431 -0.0699 -0.0971 156 LEU C O 7682 C CB . LEU C 97 ? 0.5286 0.5305 0.6780 0.0396 -0.0782 -0.0973 156 LEU C CB 7683 C CG . LEU C 97 ? 0.5400 0.5441 0.6869 0.0346 -0.0736 -0.0918 156 LEU C CG 7684 C CD1 . LEU C 97 ? 0.5183 0.5280 0.6665 0.0309 -0.0694 -0.0895 156 LEU C CD1 7685 C CD2 . LEU C 97 ? 0.6325 0.6378 0.7877 0.0314 -0.0751 -0.0891 156 LEU C CD2 7686 N N . LEU C 98 ? 0.3909 0.3802 0.5135 0.0502 -0.0774 -0.1025 157 LEU C N 7687 C CA . LEU C 98 ? 0.3928 0.3769 0.5026 0.0530 -0.0752 -0.1023 157 LEU C CA 7688 C C . LEU C 98 ? 0.5192 0.5029 0.6206 0.0551 -0.0724 -0.1043 157 LEU C C 7689 O O . LEU C 98 ? 0.5924 0.5756 0.6853 0.0539 -0.0681 -0.1020 157 LEU C O 7690 C CB . LEU C 98 ? 0.3965 0.3739 0.5033 0.0583 -0.0793 -0.1053 157 LEU C CB 7691 C CG . LEU C 98 ? 0.4268 0.4035 0.5399 0.0568 -0.0822 -0.1034 157 LEU C CG 7692 C CD1 . LEU C 98 ? 0.4582 0.4277 0.5659 0.0625 -0.0857 -0.1061 157 LEU C CD1 7693 C CD2 . LEU C 98 ? 0.3925 0.3716 0.5046 0.0514 -0.0783 -0.0979 157 LEU C CD2 7694 N N . HIS C 99 ? 0.6667 0.6506 0.7704 0.0584 -0.0749 -0.1086 158 HIS C N 7695 C CA . HIS C 99 ? 0.3970 0.3808 0.4934 0.0606 -0.0726 -0.1109 158 HIS C CA 7696 C C . HIS C 99 ? 0.5632 0.5529 0.6599 0.0553 -0.0679 -0.1071 158 HIS C C 7697 O O . HIS C 99 ? 0.4387 0.4276 0.5260 0.0558 -0.0642 -0.1067 158 HIS C O 7698 C CB . HIS C 99 ? 0.4300 0.4139 0.5309 0.0644 -0.0764 -0.1160 158 HIS C CB 7699 C CG . HIS C 99 ? 0.6358 0.6204 0.7302 0.0663 -0.0742 -0.1183 158 HIS C CG 7700 N ND1 . HIS C 99 ? 0.6291 0.6199 0.7283 0.0628 -0.0724 -0.1173 158 HIS C ND1 7701 C CD2 . HIS C 99 ? 0.7159 0.6957 0.7992 0.0714 -0.0734 -0.1216 158 HIS C CD2 7702 C CE1 . HIS C 99 ? 0.7042 0.6940 0.7954 0.0656 -0.0707 -0.1199 158 HIS C CE1 7703 N NE2 . HIS C 99 ? 0.7307 0.7139 0.8122 0.0708 -0.0712 -0.1225 158 HIS C NE2 7704 N N . ASP C 100 ? 0.3900 0.3853 0.4976 0.0505 -0.0680 -0.1044 159 ASP C N 7705 C CA . ASP C 100 ? 0.3865 0.3875 0.4955 0.0454 -0.0638 -0.1006 159 ASP C CA 7706 C C . ASP C 100 ? 0.4370 0.4375 0.5394 0.0425 -0.0596 -0.0961 159 ASP C C 7707 O O . ASP C 100 ? 0.4911 0.4937 0.5881 0.0406 -0.0555 -0.0940 159 ASP C O 7708 C CB . ASP C 100 ? 0.6584 0.6653 0.7811 0.0412 -0.0652 -0.0988 159 ASP C CB 7709 C CG . ASP C 100 ? 0.7804 0.7890 0.9099 0.0434 -0.0686 -0.1030 159 ASP C CG 7710 O OD1 . ASP C 100 ? 0.7752 0.7799 0.8990 0.0486 -0.0704 -0.1075 159 ASP C OD1 7711 O OD2 . ASP C 100 ? 0.7015 0.7152 0.8420 0.0401 -0.0692 -0.1018 159 ASP C OD2 7712 N N . LEU C 101 ? 0.6949 0.6927 0.7978 0.0422 -0.0607 -0.0946 160 LEU C N 7713 C CA . LEU C 101 ? 0.5136 0.5105 0.6103 0.0397 -0.0571 -0.0905 160 LEU C CA 7714 C C . LEU C 101 ? 0.6886 0.6812 0.7720 0.0429 -0.0545 -0.0918 160 LEU C C 7715 O O . LEU C 101 ? 0.4899 0.4833 0.5674 0.0405 -0.0503 -0.0886 160 LEU C O 7716 C CB . LEU C 101 ? 0.4535 0.4476 0.5527 0.0394 -0.0593 -0.0893 160 LEU C CB 7717 C CG . LEU C 101 ? 0.5361 0.5344 0.6473 0.0351 -0.0607 -0.0867 160 LEU C CG 7718 C CD1 . LEU C 101 ? 0.3819 0.3765 0.4944 0.0361 -0.0636 -0.0864 160 LEU C CD1 7719 C CD2 . LEU C 101 ? 0.3770 0.3802 0.4896 0.0295 -0.0562 -0.0818 160 LEU C CD2 7720 N N . ASN C 102 ? 0.5341 0.5222 0.6131 0.0485 -0.0570 -0.0964 161 ASN C N 7721 C CA . ASN C 102 ? 0.4433 0.4268 0.5097 0.0522 -0.0548 -0.0981 161 ASN C CA 7722 C C . ASN C 102 ? 0.5248 0.5110 0.5869 0.0519 -0.0518 -0.0987 161 ASN C C 7723 O O . ASN C 102 ? 0.5321 0.5165 0.5844 0.0524 -0.0482 -0.0979 161 ASN C O 7724 C CB . ASN C 102 ? 0.3964 0.3737 0.4594 0.0586 -0.0587 -0.1030 161 ASN C CB 7725 C CG . ASN C 102 ? 0.4700 0.4424 0.5202 0.0630 -0.0565 -0.1052 161 ASN C CG 7726 O OD1 . ASN C 102 ? 0.6326 0.6050 0.6795 0.0656 -0.0562 -0.1083 161 ASN C OD1 7727 N ND2 . ASN C 102 ? 0.4201 0.3880 0.4628 0.0639 -0.0548 -0.1037 161 ASN C ND2 7728 N N . THR C 103 ? 0.4968 0.4873 0.5663 0.0511 -0.0532 -0.1001 162 THR C N 7729 C CA . THR C 103 ? 0.5264 0.5188 0.5914 0.0519 -0.0511 -0.1016 162 THR C CA 7730 C C . THR C 103 ? 0.3869 0.3862 0.4567 0.0464 -0.0481 -0.0979 162 THR C C 7731 O O . THR C 103 ? 0.4864 0.4872 0.5504 0.0464 -0.0453 -0.0978 162 THR C O 7732 C CB . THR C 103 ? 0.3950 0.3867 0.4630 0.0561 -0.0550 -0.1069 162 THR C CB 7733 O OG1 . THR C 103 ? 0.6066 0.6024 0.6877 0.0538 -0.0581 -0.1067 162 THR C OG1 7734 C CG2 . THR C 103 ? 0.3978 0.3823 0.4600 0.0622 -0.0578 -0.1110 162 THR C CG2 7735 N N . SER C 104 ? 0.4678 0.4713 0.5479 0.0421 -0.0488 -0.0947 163 SER C N 7736 C CA . SER C 104 ? 0.3801 0.3901 0.4656 0.0371 -0.0461 -0.0911 163 SER C CA 7737 C C . SER C 104 ? 0.5541 0.5648 0.6311 0.0348 -0.0411 -0.0876 163 SER C C 7738 O O . SER C 104 ? 0.7925 0.8002 0.8639 0.0346 -0.0395 -0.0858 163 SER C O 7739 C CB . SER C 104 ? 0.3780 0.3916 0.4753 0.0330 -0.0474 -0.0882 163 SER C CB 7740 O OG . SER C 104 ? 0.5724 0.5854 0.6780 0.0349 -0.0522 -0.0914 163 SER C OG 7741 N N . PRO C 105 ? 0.7504 0.7652 0.8265 0.0332 -0.0386 -0.0866 164 PRO C N 7742 C CA . PRO C 105 ? 0.6915 0.7074 0.7600 0.0310 -0.0339 -0.0833 164 PRO C CA 7743 C C . PRO C 105 ? 0.5792 0.5978 0.6519 0.0261 -0.0317 -0.0781 164 PRO C C 7744 O O . PRO C 105 ? 0.4021 0.4246 0.4854 0.0232 -0.0329 -0.0763 164 PRO C O 7745 C CB . PRO C 105 ? 0.5451 0.5653 0.6144 0.0304 -0.0327 -0.0836 164 PRO C CB 7746 C CG . PRO C 105 ? 0.6185 0.6417 0.6994 0.0302 -0.0363 -0.0853 164 PRO C CG 7747 C CD . PRO C 105 ? 0.6866 0.7051 0.7689 0.0336 -0.0403 -0.0887 164 PRO C CD 7748 N N . ILE C 106 ? 0.4747 0.4914 0.5392 0.0254 -0.0284 -0.0758 165 ILE C N 7749 C CA . ILE C 106 ? 0.3909 0.4097 0.4580 0.0211 -0.0262 -0.0710 165 ILE C CA 7750 C C . ILE C 106 ? 0.4606 0.4843 0.5275 0.0176 -0.0224 -0.0673 165 ILE C C 7751 O O . ILE C 106 ? 0.5112 0.5344 0.5697 0.0186 -0.0199 -0.0676 165 ILE C O 7752 C CB . ILE C 106 ? 0.5759 0.5897 0.6348 0.0221 -0.0249 -0.0704 165 ILE C CB 7753 C CG1 . ILE C 106 ? 0.4295 0.4386 0.4895 0.0253 -0.0287 -0.0734 165 ILE C CG1 7754 C CG2 . ILE C 106 ? 0.5726 0.5888 0.6334 0.0177 -0.0222 -0.0655 165 ILE C CG2 7755 C CD1 . ILE C 106 ? 0.4603 0.4634 0.5096 0.0286 -0.0279 -0.0748 165 ILE C CD1 7756 N N . LYS C 107 ? 0.4596 0.4878 0.5355 0.0135 -0.0220 -0.0639 166 LYS C N 7757 C CA . LYS C 107 ? 0.4054 0.4383 0.4820 0.0102 -0.0185 -0.0601 166 LYS C CA 7758 C C . LYS C 107 ? 0.5782 0.6107 0.6506 0.0077 -0.0153 -0.0562 166 LYS C C 7759 O O . LYS C 107 ? 0.5325 0.5656 0.5980 0.0070 -0.0119 -0.0545 166 LYS C O 7760 C CB . LYS C 107 ? 0.6275 0.6656 0.7164 0.0073 -0.0196 -0.0583 166 LYS C CB 7761 C CG . LYS C 107 ? 0.6368 0.6800 0.7269 0.0041 -0.0161 -0.0544 166 LYS C CG 7762 C CD . LYS C 107 ? 0.7647 0.8126 0.8672 0.0009 -0.0168 -0.0520 166 LYS C CD 7763 C CE . LYS C 107 ? 0.7842 0.8332 0.8943 0.0025 -0.0205 -0.0554 166 LYS C CE 7764 N NZ . LYS C 107 ? 0.8224 0.8760 0.9449 -0.0006 -0.0209 -0.0530 166 LYS C NZ 7765 N N . HIS C 108 ? 0.4067 0.4380 0.4832 0.0064 -0.0163 -0.0550 167 HIS C N 7766 C CA . HIS C 108 ? 0.4142 0.4451 0.4875 0.0040 -0.0134 -0.0515 167 HIS C CA 7767 C C . HIS C 108 ? 0.4889 0.5149 0.5590 0.0056 -0.0149 -0.0527 167 HIS C C 7768 O O . HIS C 108 ? 0.5136 0.5376 0.5880 0.0072 -0.0184 -0.0551 167 HIS C O 7769 C CB . HIS C 108 ? 0.4744 0.5101 0.5568 -0.0002 -0.0124 -0.0474 167 HIS C CB 7770 C CG . HIS C 108 ? 0.7613 0.8019 0.8466 -0.0019 -0.0105 -0.0455 167 HIS C CG 7771 N ND1 . HIS C 108 ? 0.9163 0.9577 0.9941 -0.0020 -0.0073 -0.0443 167 HIS C ND1 7772 C CD2 . HIS C 108 ? 0.7818 0.8269 0.8769 -0.0037 -0.0113 -0.0445 167 HIS C CD2 7773 C CE1 . HIS C 108 ? 0.9979 1.0439 1.0803 -0.0036 -0.0064 -0.0426 167 HIS C CE1 7774 N NE2 . HIS C 108 ? 0.8035 0.8518 0.8966 -0.0046 -0.0087 -0.0427 167 HIS C NE2 7775 N N . VAL C 109 ? 0.4810 0.5049 0.5436 0.0051 -0.0122 -0.0509 168 VAL C N 7776 C CA . VAL C 109 ? 0.5957 0.6154 0.6557 0.0058 -0.0130 -0.0512 168 VAL C CA 7777 C C . VAL C 109 ? 0.4228 0.4444 0.4838 0.0022 -0.0104 -0.0469 168 VAL C C 7778 O O . VAL C 109 ? 0.4644 0.4872 0.5204 0.0008 -0.0069 -0.0447 168 VAL C O 7779 C CB . VAL C 109 ? 0.4280 0.4424 0.4769 0.0094 -0.0125 -0.0537 168 VAL C CB 7780 C CG1 . VAL C 109 ? 0.4294 0.4395 0.4759 0.0102 -0.0133 -0.0537 168 VAL C CG1 7781 C CG2 . VAL C 109 ? 0.3976 0.4100 0.4450 0.0134 -0.0150 -0.0581 168 VAL C CG2 7782 N N . HIS C 110 ? 0.5442 0.5660 0.6117 0.0007 -0.0121 -0.0458 169 HIS C N 7783 C CA . HIS C 110 ? 0.6381 0.6614 0.7069 -0.0027 -0.0098 -0.0420 169 HIS C CA 7784 C C . HIS C 110 ? 0.5118 0.5311 0.5782 -0.0019 -0.0110 -0.0423 169 HIS C C 7785 O O . HIS C 110 ? 0.3957 0.4118 0.4631 0.0006 -0.0144 -0.0451 169 HIS C O 7786 C CB . HIS C 110 ? 0.5645 0.5927 0.6440 -0.0059 -0.0100 -0.0396 169 HIS C CB 7787 C CG . HIS C 110 ? 0.7028 0.7356 0.7846 -0.0073 -0.0081 -0.0382 169 HIS C CG 7788 N ND1 . HIS C 110 ? 0.6891 0.7231 0.7737 -0.0057 -0.0098 -0.0405 169 HIS C ND1 7789 C CD2 . HIS C 110 ? 0.5817 0.6179 0.6633 -0.0099 -0.0046 -0.0347 169 HIS C CD2 7790 C CE1 . HIS C 110 ? 0.7500 0.7881 0.8359 -0.0074 -0.0074 -0.0385 169 HIS C CE1 7791 N NE2 . HIS C 110 ? 0.8350 0.8744 0.9191 -0.0099 -0.0043 -0.0349 169 HIS C NE2 7792 N N . ILE C 111 ? 0.4228 0.4420 0.4859 -0.0039 -0.0083 -0.0396 170 ILE C N 7793 C CA . ILE C 111 ? 0.5017 0.5174 0.5626 -0.0036 -0.0091 -0.0394 170 ILE C CA 7794 C C . ILE C 111 ? 0.5755 0.5929 0.6455 -0.0057 -0.0112 -0.0381 170 ILE C C 7795 O O . ILE C 111 ? 0.5291 0.5505 0.6045 -0.0089 -0.0096 -0.0351 170 ILE C O 7796 C CB . ILE C 111 ? 0.4299 0.4452 0.4842 -0.0051 -0.0054 -0.0369 170 ILE C CB 7797 C CG1 . ILE C 111 ? 0.4795 0.4925 0.5244 -0.0028 -0.0035 -0.0384 170 ILE C CG1 7798 C CG2 . ILE C 111 ? 0.4290 0.4411 0.4817 -0.0052 -0.0062 -0.0364 170 ILE C CG2 7799 C CD1 . ILE C 111 ? 0.6008 0.6135 0.6391 -0.0042 0.0001 -0.0362 170 ILE C CD1 7800 N N . MSE C 112 ? 0.6445 0.6587 0.7161 -0.0036 -0.0148 -0.0402 171 MSE C N 7801 C CA . MSE C 112 ? 0.7346 0.7498 0.8143 -0.0053 -0.0170 -0.0392 171 MSE C CA 7802 C C . MSE C 112 ? 0.7769 0.7921 0.8550 -0.0078 -0.0150 -0.0362 171 MSE C C 7803 O O . MSE C 112 ? 0.7471 0.7589 0.8176 -0.0067 -0.0140 -0.0362 171 MSE C O 7804 C CB . MSE C 112 ? 0.9631 0.9743 1.0438 -0.0022 -0.0214 -0.0424 171 MSE C CB 7805 C CG . MSE C 112 ? 1.0048 1.0176 1.0928 -0.0011 -0.0245 -0.0447 171 MSE C CG 7806 SE SE . MSE C 112 ? 1.3939 1.4057 1.4913 -0.0010 -0.0294 -0.0456 171 MSE C SE 7807 C CE . MSE C 112 ? 1.3186 1.3342 1.4206 -0.0063 -0.0265 -0.0405 171 MSE C CE 7808 N N . ASP C 113 ? 1.1409 1.1600 1.2264 -0.0111 -0.0142 -0.0335 172 ASP C N 7809 C CA . ASP C 113 ? 1.2745 1.2941 1.3592 -0.0136 -0.0121 -0.0305 172 ASP C CA 7810 C C . ASP C 113 ? 1.3192 1.3359 1.4053 -0.0132 -0.0149 -0.0309 172 ASP C C 7811 O O . ASP C 113 ? 1.3247 1.3405 1.4080 -0.0145 -0.0136 -0.0291 172 ASP C O 7812 C CB . ASP C 113 ? 1.2784 1.3031 1.3700 -0.0171 -0.0099 -0.0275 172 ASP C CB 7813 C CG . ASP C 113 ? 1.3653 1.3929 1.4545 -0.0178 -0.0066 -0.0264 172 ASP C CG 7814 O OD1 . ASP C 113 ? 1.5109 1.5364 1.5922 -0.0159 -0.0056 -0.0277 172 ASP C OD1 7815 O OD2 . ASP C 113 ? 1.2577 1.2895 1.3528 -0.0201 -0.0050 -0.0242 172 ASP C OD2 7816 N N . GLY C 114 ? 1.1497 1.1648 1.2400 -0.0113 -0.0189 -0.0334 173 GLY C N 7817 C CA . GLY C 114 ? 1.3119 1.3248 1.4049 -0.0110 -0.0219 -0.0337 173 GLY C CA 7818 C C . GLY C 114 ? 1.3649 1.3722 1.4510 -0.0075 -0.0242 -0.0361 173 GLY C C 7819 O O . GLY C 114 ? 1.5319 1.5369 1.6176 -0.0043 -0.0270 -0.0391 173 GLY C O 7820 N N . GLY C 115 ? 1.0027 1.0078 1.0834 -0.0079 -0.0231 -0.0347 174 GLY C N 7821 C CA . GLY C 115 ? 0.7819 0.7815 0.8560 -0.0046 -0.0252 -0.0365 174 GLY C CA 7822 C C . GLY C 115 ? 0.8785 0.8761 0.9434 -0.0046 -0.0220 -0.0353 174 GLY C C 7823 O O . GLY C 115 ? 0.7802 0.7805 0.8446 -0.0076 -0.0186 -0.0326 174 GLY C O 7824 N N . THR C 116 ? 0.8322 0.8250 0.8900 -0.0011 -0.0230 -0.0373 175 THR C N 7825 C CA . THR C 116 ? 0.7603 0.7505 0.8093 -0.0008 -0.0204 -0.0364 175 THR C CA 7826 C C . THR C 116 ? 0.5947 0.5825 0.6366 0.0021 -0.0190 -0.0384 175 THR C C 7827 O O . THR C 116 ? 0.7247 0.7136 0.7620 0.0009 -0.0153 -0.0373 175 THR C O 7828 C CB . THR C 116 ? 0.9026 0.8885 0.9487 0.0008 -0.0227 -0.0365 175 THR C CB 7829 O OG1 . THR C 116 ? 0.9956 0.9802 1.0471 0.0024 -0.0272 -0.0382 175 THR C OG1 7830 C CG2 . THR C 116 ? 0.8527 0.8404 0.8992 -0.0026 -0.0208 -0.0334 175 THR C CG2 7831 N N . GLN C 117 ? 0.5528 0.5373 0.5938 0.0059 -0.0220 -0.0415 176 GLN C N 7832 C CA . GLN C 117 ? 0.4529 0.4345 0.4868 0.0091 -0.0209 -0.0437 176 GLN C CA 7833 C C . GLN C 117 ? 0.3733 0.3582 0.4101 0.0089 -0.0202 -0.0448 176 GLN C C 7834 O O . GLN C 117 ? 0.7291 0.7180 0.7740 0.0068 -0.0212 -0.0443 176 GLN C O 7835 C CB . GLN C 117 ? 0.4385 0.4144 0.4692 0.0138 -0.0244 -0.0466 176 GLN C CB 7836 C CG . GLN C 117 ? 0.5669 0.5388 0.5924 0.0147 -0.0246 -0.0457 176 GLN C CG 7837 C CD . GLN C 117 ? 0.6344 0.6006 0.6570 0.0195 -0.0282 -0.0484 176 GLN C CD 7838 O OE1 . GLN C 117 ? 0.6441 0.6072 0.6620 0.0232 -0.0284 -0.0509 176 GLN C OE1 7839 N NE2 . GLN C 117 ? 0.5417 0.5063 0.5669 0.0197 -0.0312 -0.0478 176 GLN C NE2 7840 N N . VAL C 118 ? 0.4712 0.4542 0.5012 0.0111 -0.0184 -0.0464 177 VAL C N 7841 C CA . VAL C 118 ? 0.3810 0.3670 0.4120 0.0110 -0.0171 -0.0473 177 VAL C CA 7842 C C . VAL C 118 ? 0.4515 0.4386 0.4895 0.0123 -0.0207 -0.0496 177 VAL C C 7843 O O . VAL C 118 ? 0.4434 0.4266 0.4808 0.0159 -0.0241 -0.0524 177 VAL C O 7844 C CB . VAL C 118 ? 0.5279 0.5106 0.5495 0.0139 -0.0150 -0.0491 177 VAL C CB 7845 C CG1 . VAL C 118 ? 0.3719 0.3484 0.3887 0.0187 -0.0176 -0.0521 177 VAL C CG1 7846 C CG2 . VAL C 118 ? 0.3757 0.3612 0.3980 0.0141 -0.0140 -0.0503 177 VAL C CG2 7847 N N . LYS C 119 ? 0.4613 0.4536 0.5060 0.0095 -0.0201 -0.0484 178 LYS C N 7848 C CA . LYS C 119 ? 0.5155 0.5096 0.5674 0.0103 -0.0232 -0.0504 178 LYS C CA 7849 C C . LYS C 119 ? 0.4801 0.4792 0.5353 0.0082 -0.0211 -0.0496 178 LYS C C 7850 O O . LYS C 119 ? 0.5910 0.5937 0.6473 0.0046 -0.0180 -0.0464 178 LYS C O 7851 C CB . LYS C 119 ? 0.3639 0.3593 0.4246 0.0086 -0.0261 -0.0495 178 LYS C CB 7852 C CG . LYS C 119 ? 0.6639 0.6544 0.7234 0.0116 -0.0297 -0.0512 178 LYS C CG 7853 C CD . LYS C 119 ? 0.7506 0.7429 0.8195 0.0098 -0.0327 -0.0504 178 LYS C CD 7854 C CE . LYS C 119 ? 0.9147 0.9109 0.9869 0.0050 -0.0300 -0.0464 178 LYS C CE 7855 N NZ . LYS C 119 ? 0.9632 0.9568 1.0279 0.0047 -0.0278 -0.0446 178 LYS C NZ 7856 N N . PHE C 120 ? 0.3643 0.3635 0.4209 0.0105 -0.0228 -0.0524 179 PHE C N 7857 C CA . PHE C 120 ? 0.4927 0.4967 0.5528 0.0087 -0.0212 -0.0518 179 PHE C CA 7858 C C . PHE C 120 ? 0.4601 0.4671 0.5308 0.0080 -0.0243 -0.0526 179 PHE C C 7859 O O . PHE C 120 ? 0.3639 0.3683 0.4376 0.0102 -0.0282 -0.0549 179 PHE C O 7860 C CB . PHE C 120 ? 0.3645 0.3669 0.4175 0.0117 -0.0202 -0.0544 179 PHE C CB 7861 C CG . PHE C 120 ? 0.4992 0.4993 0.5420 0.0121 -0.0166 -0.0536 179 PHE C CG 7862 C CD1 . PHE C 120 ? 0.3627 0.3638 0.4041 0.0091 -0.0139 -0.0501 179 PHE C CD1 7863 C CD2 . PHE C 120 ? 0.3724 0.3693 0.4071 0.0156 -0.0160 -0.0563 179 PHE C CD2 7864 C CE1 . PHE C 120 ? 0.5247 0.5237 0.5571 0.0095 -0.0107 -0.0494 179 PHE C CE1 7865 C CE2 . PHE C 120 ? 0.4348 0.4295 0.4603 0.0160 -0.0126 -0.0555 179 PHE C CE2 7866 C CZ . PHE C 120 ? 0.3844 0.3802 0.4090 0.0129 -0.0100 -0.0520 179 PHE C CZ 7867 N N . VAL C 121 ? 0.5068 0.5191 0.5833 0.0049 -0.0227 -0.0506 180 VAL C N 7868 C CA . VAL C 121 ? 0.5317 0.5470 0.6179 0.0045 -0.0253 -0.0517 180 VAL C CA 7869 C C . VAL C 121 ? 0.4183 0.4350 0.5026 0.0061 -0.0248 -0.0537 180 VAL C C 7870 O O . VAL C 121 ? 0.4686 0.4880 0.5499 0.0045 -0.0214 -0.0518 180 VAL C O 7871 C CB . VAL C 121 ? 0.4544 0.4747 0.5496 0.0001 -0.0242 -0.0481 180 VAL C CB 7872 C CG1 . VAL C 121 ? 0.4669 0.4899 0.5585 -0.0028 -0.0196 -0.0445 180 VAL C CG1 7873 C CG2 . VAL C 121 ? 0.4051 0.4292 0.5098 -0.0005 -0.0261 -0.0491 180 VAL C CG2 7874 N N . PHE C 122 ? 0.4801 0.4950 0.5660 0.0093 -0.0282 -0.0575 181 PHE C N 7875 C CA . PHE C 122 ? 0.4610 0.4774 0.5457 0.0110 -0.0281 -0.0598 181 PHE C CA 7876 C C . PHE C 122 ? 0.5835 0.6053 0.6787 0.0086 -0.0288 -0.0589 181 PHE C C 7877 O O . PHE C 122 ? 0.5942 0.6167 0.6980 0.0083 -0.0319 -0.0597 181 PHE C O 7878 C CB . PHE C 122 ? 0.4806 0.4923 0.5616 0.0161 -0.0314 -0.0646 181 PHE C CB 7879 C CG . PHE C 122 ? 0.4025 0.4090 0.4717 0.0191 -0.0299 -0.0659 181 PHE C CG 7880 C CD1 . PHE C 122 ? 0.4148 0.4214 0.4774 0.0172 -0.0259 -0.0629 181 PHE C CD1 7881 C CD2 . PHE C 122 ? 0.4295 0.4310 0.4944 0.0239 -0.0327 -0.0700 181 PHE C CD2 7882 C CE1 . PHE C 122 ? 0.5538 0.5556 0.6058 0.0199 -0.0245 -0.0641 181 PHE C CE1 7883 C CE2 . PHE C 122 ? 0.4020 0.3986 0.4561 0.0268 -0.0312 -0.0711 181 PHE C CE2 7884 C CZ . PHE C 122 ? 0.3851 0.3819 0.4328 0.0247 -0.0271 -0.0682 181 PHE C CZ 7885 N N . THR C 123 ? 0.7003 0.7258 0.7948 0.0069 -0.0259 -0.0573 182 THR C N 7886 C CA . THR C 123 ? 0.5037 0.5342 0.6074 0.0052 -0.0265 -0.0569 182 THR C CA 7887 C C . THR C 123 ? 0.5422 0.5725 0.6427 0.0083 -0.0274 -0.0604 182 THR C C 7888 O O . THR C 123 ? 0.6055 0.6356 0.6980 0.0089 -0.0247 -0.0602 182 THR C O 7889 C CB . THR C 123 ? 0.4976 0.5330 0.6040 0.0010 -0.0228 -0.0523 182 THR C CB 7890 O OG1 . THR C 123 ? 0.5474 0.5831 0.6574 -0.0017 -0.0222 -0.0493 182 THR C OG1 7891 C CG2 . THR C 123 ? 0.4190 0.4593 0.5345 -0.0004 -0.0234 -0.0521 182 THR C CG2 7892 N N . PHE C 124 ? 0.5041 0.5342 0.6107 0.0102 -0.0312 -0.0637 183 PHE C N 7893 C CA . PHE C 124 ? 0.5504 0.5799 0.6541 0.0135 -0.0324 -0.0676 183 PHE C CA 7894 C C . PHE C 124 ? 0.6190 0.6542 0.7278 0.0113 -0.0310 -0.0661 183 PHE C C 7895 O O . PHE C 124 ? 0.5615 0.6008 0.6771 0.0074 -0.0294 -0.0624 183 PHE C O 7896 C CB . PHE C 124 ? 0.3725 0.3993 0.4805 0.0169 -0.0373 -0.0719 183 PHE C CB 7897 C CG . PHE C 124 ? 0.5583 0.5793 0.6611 0.0195 -0.0390 -0.0735 183 PHE C CG 7898 C CD1 . PHE C 124 ? 0.4604 0.4765 0.5518 0.0233 -0.0383 -0.0758 183 PHE C CD1 7899 C CD2 . PHE C 124 ? 0.5829 0.6031 0.6919 0.0183 -0.0411 -0.0725 183 PHE C CD2 7900 C CE1 . PHE C 124 ? 0.5810 0.5917 0.6676 0.0258 -0.0398 -0.0771 183 PHE C CE1 7901 C CE2 . PHE C 124 ? 0.4855 0.5003 0.5896 0.0209 -0.0427 -0.0738 183 PHE C CE2 7902 C CZ . PHE C 124 ? 0.3726 0.3826 0.4655 0.0246 -0.0421 -0.0760 183 PHE C CZ 7903 N N . LYS C 125 ? 0.6473 0.6825 0.7524 0.0139 -0.0314 -0.0691 184 LYS C N 7904 C CA . LYS C 125 ? 0.6126 0.6529 0.7217 0.0123 -0.0301 -0.0681 184 LYS C CA 7905 C C . LYS C 125 ? 0.5790 0.6233 0.7018 0.0101 -0.0324 -0.0676 184 LYS C C 7906 O O . LYS C 125 ? 0.5232 0.5725 0.6516 0.0070 -0.0305 -0.0645 184 LYS C O 7907 C CB . LYS C 125 ? 0.6038 0.6428 0.7064 0.0160 -0.0307 -0.0721 184 LYS C CB 7908 C CG . LYS C 125 ? 0.7541 0.7914 0.8441 0.0167 -0.0271 -0.0711 184 LYS C CG 7909 C CD . LYS C 125 ? 0.7629 0.7988 0.8459 0.0205 -0.0275 -0.0751 184 LYS C CD 7910 C CE . LYS C 125 ? 0.7896 0.8236 0.8601 0.0211 -0.0238 -0.0740 184 LYS C CE 7911 N NZ . LYS C 125 ? 0.7594 0.7912 0.8218 0.0252 -0.0242 -0.0781 184 LYS C NZ 7912 N N . ASN C 126 ? 0.4283 0.4705 0.5566 0.0119 -0.0364 -0.0705 185 ASN C N 7913 C CA . ASN C 126 ? 0.4910 0.5365 0.6326 0.0099 -0.0388 -0.0702 185 ASN C CA 7914 C C . ASN C 126 ? 0.4912 0.5385 0.6387 0.0058 -0.0373 -0.0657 185 ASN C C 7915 O O . ASN C 126 ? 0.6369 0.6864 0.7954 0.0041 -0.0393 -0.0653 185 ASN C O 7916 C CB . ASN C 126 ? 0.3627 0.4050 0.5080 0.0134 -0.0437 -0.0750 185 ASN C CB 7917 C CG . ASN C 126 ? 0.6709 0.7078 0.8113 0.0152 -0.0451 -0.0759 185 ASN C CG 7918 O OD1 . ASN C 126 ? 0.4935 0.5292 0.6287 0.0136 -0.0425 -0.0727 185 ASN C OD1 7919 N ND2 . ASN C 126 ? 0.5113 0.5447 0.6532 0.0188 -0.0494 -0.0802 185 ASN C ND2 7920 N N . ASP C 127 ? 0.5336 0.5799 0.6738 0.0044 -0.0339 -0.0626 186 ASP C N 7921 C CA . ASP C 127 ? 0.6522 0.6999 0.7962 0.0007 -0.0320 -0.0582 186 ASP C CA 7922 C C . ASP C 127 ? 0.6141 0.6588 0.7620 0.0009 -0.0349 -0.0589 186 ASP C C 7923 O O . ASP C 127 ? 0.6222 0.6680 0.7739 -0.0021 -0.0337 -0.0556 186 ASP C O 7924 C CB . ASP C 127 ? 0.6074 0.6609 0.7612 -0.0030 -0.0305 -0.0550 186 ASP C CB 7925 C CG . ASP C 127 ? 0.7940 0.8505 0.9431 -0.0042 -0.0266 -0.0524 186 ASP C CG 7926 O OD1 . ASP C 127 ? 0.5121 0.5666 0.6510 -0.0038 -0.0240 -0.0512 186 ASP C OD1 7927 O OD2 . ASP C 127 ? 1.0439 1.1048 1.1994 -0.0055 -0.0261 -0.0516 186 ASP C OD2 7928 N N . LYS C 128 ? 0.5092 0.5501 0.6560 0.0046 -0.0388 -0.0633 187 LYS C N 7929 C CA . LYS C 128 ? 0.6152 0.6525 0.7635 0.0054 -0.0415 -0.0641 187 LYS C CA 7930 C C . LYS C 128 ? 0.6546 0.6877 0.7917 0.0063 -0.0395 -0.0631 187 LYS C C 7931 O O . LYS C 128 ? 0.5124 0.5450 0.6406 0.0070 -0.0366 -0.0627 187 LYS C O 7932 C CB . LYS C 128 ? 0.4703 0.5048 0.6213 0.0093 -0.0463 -0.0691 187 LYS C CB 7933 C CG . LYS C 128 ? 0.4885 0.5269 0.6520 0.0082 -0.0488 -0.0701 187 LYS C CG 7934 C CD . LYS C 128 ? 0.4305 0.4716 0.6037 0.0042 -0.0486 -0.0667 187 LYS C CD 7935 C CE . LYS C 128 ? 0.6335 0.6781 0.8196 0.0033 -0.0513 -0.0679 187 LYS C CE 7936 N NZ . LYS C 128 ? 0.6099 0.6584 0.7978 0.0031 -0.0500 -0.0684 187 LYS C NZ 7937 N N . GLN C 129 ? 0.6902 0.7204 0.8277 0.0063 -0.0410 -0.0626 188 GLN C N 7938 C CA . GLN C 129 ? 0.4520 0.4787 0.5798 0.0065 -0.0388 -0.0611 188 GLN C CA 7939 C C . GLN C 129 ? 0.5471 0.5681 0.6712 0.0098 -0.0420 -0.0637 188 GLN C C 7940 O O . GLN C 129 ? 0.4858 0.5057 0.6162 0.0113 -0.0461 -0.0660 188 GLN C O 7941 C CB . GLN C 129 ? 0.4526 0.4820 0.5830 0.0021 -0.0358 -0.0562 188 GLN C CB 7942 C CG . GLN C 129 ? 0.3544 0.3888 0.4860 -0.0010 -0.0319 -0.0532 188 GLN C CG 7943 C CD . GLN C 129 ? 0.4838 0.5204 0.6170 -0.0049 -0.0288 -0.0485 188 GLN C CD 7944 O OE1 . GLN C 129 ? 0.4734 0.5107 0.6137 -0.0068 -0.0300 -0.0472 188 GLN C OE1 7945 N NE2 . GLN C 129 ? 0.3503 0.3877 0.4766 -0.0060 -0.0248 -0.0462 188 GLN C NE2 7946 N N . ALA C 130 ? 0.6739 0.6912 0.7878 0.0110 -0.0402 -0.0632 189 ALA C N 7947 C CA . ALA C 130 ? 0.5710 0.5825 0.6799 0.0143 -0.0427 -0.0652 189 ALA C CA 7948 C C . ALA C 130 ? 0.6402 0.6494 0.7410 0.0133 -0.0397 -0.0625 189 ALA C C 7949 O O . ALA C 130 ? 0.4393 0.4507 0.5362 0.0110 -0.0357 -0.0599 189 ALA C O 7950 C CB . ALA C 130 ? 0.4390 0.4468 0.5422 0.0193 -0.0446 -0.0698 189 ALA C CB 7951 N N . VAL C 131 ? 0.4885 0.4934 0.5870 0.0151 -0.0419 -0.0632 190 VAL C N 7952 C CA . VAL C 131 ? 0.3676 0.3696 0.4581 0.0147 -0.0394 -0.0611 190 VAL C CA 7953 C C . VAL C 131 ? 0.4175 0.4141 0.4973 0.0192 -0.0394 -0.0638 190 VAL C C 7954 O O . VAL C 131 ? 0.3737 0.3666 0.4528 0.0232 -0.0429 -0.0673 190 VAL C O 7955 C CB . VAL C 131 ? 0.4339 0.4343 0.5277 0.0137 -0.0415 -0.0597 190 VAL C CB 7956 C CG1 . VAL C 131 ? 0.3676 0.3647 0.4526 0.0138 -0.0393 -0.0580 190 VAL C CG1 7957 C CG2 . VAL C 131 ? 0.3642 0.3698 0.4679 0.0090 -0.0409 -0.0566 190 VAL C CG2 7958 N N . PHE C 132 ? 0.3702 0.3665 0.4418 0.0186 -0.0354 -0.0623 191 PHE C N 7959 C CA . PHE C 132 ? 0.4488 0.4400 0.5099 0.0226 -0.0347 -0.0646 191 PHE C CA 7960 C C . PHE C 132 ? 0.6150 0.6025 0.6690 0.0228 -0.0332 -0.0630 191 PHE C C 7961 O O . PHE C 132 ? 0.3711 0.3608 0.4242 0.0192 -0.0300 -0.0595 191 PHE C O 7962 C CB . PHE C 132 ? 0.4592 0.4524 0.5153 0.0225 -0.0313 -0.0648 191 PHE C CB 7963 C CG . PHE C 132 ? 0.3755 0.3637 0.4203 0.0262 -0.0299 -0.0668 191 PHE C CG 7964 C CD1 . PHE C 132 ? 0.3794 0.3634 0.4211 0.0312 -0.0325 -0.0710 191 PHE C CD1 7965 C CD2 . PHE C 132 ? 0.3919 0.3796 0.4294 0.0248 -0.0258 -0.0645 191 PHE C CD2 7966 C CE1 . PHE C 132 ? 0.3818 0.3610 0.4130 0.0348 -0.0310 -0.0728 191 PHE C CE1 7967 C CE2 . PHE C 132 ? 0.4163 0.3994 0.4436 0.0282 -0.0243 -0.0662 191 PHE C CE2 7968 C CZ . PHE C 132 ? 0.3809 0.3596 0.4049 0.0332 -0.0268 -0.0704 191 PHE C CZ 7969 N N . LYS C 133 ? 0.3768 0.3586 0.4260 0.0271 -0.0354 -0.0655 192 LYS C N 7970 C CA . LYS C 133 ? 0.4335 0.4111 0.4750 0.0279 -0.0340 -0.0644 192 LYS C CA 7971 C C . LYS C 133 ? 0.4489 0.4215 0.4804 0.0325 -0.0331 -0.0671 192 LYS C C 7972 O O . LYS C 133 ? 0.5252 0.4943 0.5558 0.0369 -0.0362 -0.0706 192 LYS C O 7973 C CB . LYS C 133 ? 0.3787 0.3536 0.4234 0.0289 -0.0376 -0.0643 192 LYS C CB 7974 C CG . LYS C 133 ? 0.3756 0.3547 0.4288 0.0242 -0.0380 -0.0612 192 LYS C CG 7975 C CD . LYS C 133 ? 0.3769 0.3530 0.4330 0.0256 -0.0420 -0.0616 192 LYS C CD 7976 C CE . LYS C 133 ? 0.3916 0.3716 0.4552 0.0210 -0.0420 -0.0583 192 LYS C CE 7977 N NZ . LYS C 133 ? 0.4330 0.4097 0.4983 0.0222 -0.0456 -0.0584 192 LYS C NZ 7978 N N . PRO C 134 ? 0.4909 0.4631 0.5149 0.0316 -0.0289 -0.0656 193 PRO C N 7979 C CA . PRO C 134 ? 0.3836 0.3514 0.3978 0.0356 -0.0274 -0.0679 193 PRO C CA 7980 C C . PRO C 134 ? 0.3869 0.3480 0.3952 0.0399 -0.0289 -0.0695 193 PRO C C 7981 O O . PRO C 134 ? 0.3935 0.3534 0.4026 0.0387 -0.0295 -0.0675 193 PRO C O 7982 C CB . PRO C 134 ? 0.3814 0.3514 0.3907 0.0325 -0.0224 -0.0651 193 PRO C CB 7983 C CG . PRO C 134 ? 0.4373 0.4103 0.4514 0.0281 -0.0217 -0.0614 193 PRO C CG 7984 C CD . PRO C 134 ? 0.3771 0.3530 0.4015 0.0268 -0.0253 -0.0615 193 PRO C CD 7985 N N . MSE C 135 ? 0.4589 0.4155 0.4610 0.0448 -0.0295 -0.0730 194 MSE C N 7986 C CA . MSE C 135 ? 0.4581 0.4079 0.4535 0.0494 -0.0305 -0.0745 194 MSE C CA 7987 C C . MSE C 135 ? 0.3937 0.3417 0.3814 0.0483 -0.0264 -0.0721 194 MSE C C 7988 O O . MSE C 135 ? 0.3919 0.3427 0.3770 0.0456 -0.0225 -0.0707 194 MSE C O 7989 C CB . MSE C 135 ? 0.3980 0.3436 0.3884 0.0551 -0.0317 -0.0789 194 MSE C CB 7990 C CG . MSE C 135 ? 0.5810 0.5192 0.5631 0.0604 -0.0321 -0.0807 194 MSE C CG 7991 SE SE . MSE C 135 ? 0.8601 0.7931 0.8365 0.0679 -0.0338 -0.0866 194 MSE C SE 7992 C CE . MSE C 135 ? 1.3153 1.2391 1.2808 0.0734 -0.0331 -0.0873 194 MSE C CE 7993 N N . ARG C 136 ? 0.5345 0.4778 0.5188 0.0503 -0.0272 -0.0717 195 ARG C N 7994 C CA . ARG C 136 ? 0.3952 0.3365 0.3724 0.0494 -0.0234 -0.0696 195 ARG C CA 7995 C C . ARG C 136 ? 0.3996 0.3336 0.3680 0.0551 -0.0234 -0.0720 195 ARG C C 7996 O O . ARG C 136 ? 0.5840 0.5161 0.5457 0.0573 -0.0208 -0.0736 195 ARG C O 7997 C CB . ARG C 136 ? 0.4267 0.3696 0.4076 0.0459 -0.0238 -0.0662 195 ARG C CB 7998 C CG . ARG C 136 ? 0.4030 0.3457 0.3784 0.0434 -0.0195 -0.0634 195 ARG C CG 7999 C CD . ARG C 136 ? 0.4147 0.3596 0.3947 0.0397 -0.0202 -0.0602 195 ARG C CD 8000 N NE . ARG C 136 ? 0.3969 0.3485 0.3839 0.0345 -0.0192 -0.0578 195 ARG C NE 8001 C CZ . ARG C 136 ? 0.3820 0.3372 0.3679 0.0307 -0.0152 -0.0554 195 ARG C CZ 8002 N NH1 . ARG C 136 ? 0.5691 0.5218 0.5471 0.0314 -0.0118 -0.0550 195 ARG C NH1 8003 N NH2 . ARG C 136 ? 0.5782 0.5393 0.5709 0.0263 -0.0147 -0.0534 195 ARG C NH2 8004 N N . PHE C 137 ? 0.4656 0.3955 0.4340 0.0578 -0.0264 -0.0723 196 PHE C N 8005 C CA . PHE C 137 ? 0.4094 0.3320 0.3698 0.0636 -0.0266 -0.0745 196 PHE C CA 8006 C C . PHE C 137 ? 0.5235 0.4428 0.4846 0.0689 -0.0305 -0.0785 196 PHE C C 8007 O O . PHE C 137 ? 0.5566 0.4795 0.5251 0.0680 -0.0334 -0.0796 196 PHE C O 8008 C CB . PHE C 137 ? 0.4062 0.3255 0.3652 0.0639 -0.0275 -0.0724 196 PHE C CB 8009 C CG . PHE C 137 ? 0.6096 0.5321 0.5685 0.0587 -0.0241 -0.0685 196 PHE C CG 8010 C CD1 . PHE C 137 ? 0.4113 0.3341 0.3642 0.0574 -0.0193 -0.0675 196 PHE C CD1 8011 C CD2 . PHE C 137 ? 0.4002 0.3256 0.3652 0.0551 -0.0258 -0.0658 196 PHE C CD2 8012 C CE1 . PHE C 137 ? 0.4581 0.3839 0.4111 0.0527 -0.0163 -0.0641 196 PHE C CE1 8013 C CE2 . PHE C 137 ? 0.4869 0.4152 0.4517 0.0504 -0.0227 -0.0624 196 PHE C CE2 8014 C CZ . PHE C 137 ? 0.4568 0.3854 0.4158 0.0493 -0.0180 -0.0615 196 PHE C CZ 8015 N N . GLY C 138 ? 0.5359 0.4484 0.4894 0.0747 -0.0306 -0.0809 197 GLY C N 8016 C CA . GLY C 138 ? 0.4171 0.3257 0.3704 0.0805 -0.0343 -0.0849 197 GLY C CA 8017 C C . GLY C 138 ? 0.5112 0.4186 0.4704 0.0819 -0.0395 -0.0851 197 GLY C C 8018 O O . GLY C 138 ? 0.6368 0.5458 0.5995 0.0785 -0.0402 -0.0820 197 GLY C O 8019 N N . ARG C 139 ? 0.4207 0.3250 0.3809 0.0869 -0.0433 -0.0889 198 ARG C N 8020 C CA . ARG C 139 ? 0.4633 0.3662 0.4293 0.0888 -0.0487 -0.0896 198 ARG C CA 8021 C C . ARG C 139 ? 0.4519 0.3490 0.4133 0.0917 -0.0497 -0.0883 198 ARG C C 8022 O O . ARG C 139 ? 0.4950 0.3918 0.4612 0.0916 -0.0534 -0.0874 198 ARG C O 8023 C CB . ARG C 139 ? 0.4247 0.3252 0.3920 0.0941 -0.0524 -0.0942 198 ARG C CB 8024 C CG . ARG C 139 ? 0.5340 0.4401 0.5057 0.0917 -0.0517 -0.0958 198 ARG C CG 8025 C CD . ARG C 139 ? 0.4919 0.4051 0.4742 0.0854 -0.0530 -0.0933 198 ARG C CD 8026 N NE . ARG C 139 ? 0.4735 0.3910 0.4617 0.0848 -0.0544 -0.0957 198 ARG C NE 8027 C CZ . ARG C 139 ? 0.6289 0.5518 0.6185 0.0807 -0.0511 -0.0947 198 ARG C CZ 8028 N NH1 . ARG C 139 ? 0.4126 0.3373 0.3981 0.0769 -0.0464 -0.0915 198 ARG C NH1 8029 N NH2 . ARG C 139 ? 0.4143 0.3407 0.4092 0.0804 -0.0526 -0.0969 198 ARG C NH2 8030 N N . ASP C 140 ? 0.5069 0.3994 0.4588 0.0943 -0.0462 -0.0882 199 ASP C N 8031 C CA . ASP C 140 ? 0.5922 0.4784 0.5387 0.0977 -0.0468 -0.0873 199 ASP C CA 8032 C C . ASP C 140 ? 0.4253 0.3139 0.3726 0.0926 -0.0448 -0.0827 199 ASP C C 8033 O O . ASP C 140 ? 0.4906 0.3752 0.4354 0.0945 -0.0461 -0.0814 199 ASP C O 8034 C CB . ASP C 140 ? 0.4325 0.3125 0.3686 0.1031 -0.0439 -0.0892 199 ASP C CB 8035 C CG . ASP C 140 ? 0.8854 0.7614 0.8196 0.1096 -0.0464 -0.0939 199 ASP C CG 8036 O OD1 . ASP C 140 ? 0.8312 0.7068 0.7710 0.1117 -0.0514 -0.0957 199 ASP C OD1 8037 O OD2 . ASP C 140 ? 1.0768 0.9499 1.0038 0.1127 -0.0434 -0.0960 199 ASP C OD2 8038 N N . TYR C 141 ? 0.4316 0.3267 0.3821 0.0863 -0.0417 -0.0804 200 TYR C N 8039 C CA . TYR C 141 ? 0.4179 0.3157 0.3692 0.0811 -0.0395 -0.0762 200 TYR C CA 8040 C C . TYR C 141 ? 0.4542 0.3529 0.4117 0.0797 -0.0436 -0.0745 200 TYR C C 8041 O O . TYR C 141 ? 0.7223 0.6241 0.6876 0.0787 -0.0471 -0.0754 200 TYR C O 8042 C CB . TYR C 141 ? 0.5957 0.5005 0.5501 0.0748 -0.0359 -0.0743 200 TYR C CB 8043 C CG . TYR C 141 ? 0.5918 0.4995 0.5467 0.0696 -0.0332 -0.0701 200 TYR C CG 8044 C CD1 . TYR C 141 ? 0.6029 0.5089 0.5505 0.0692 -0.0287 -0.0687 200 TYR C CD1 8045 C CD2 . TYR C 141 ? 0.6134 0.5256 0.5759 0.0652 -0.0352 -0.0677 200 TYR C CD2 8046 C CE1 . TYR C 141 ? 0.6809 0.5894 0.6289 0.0646 -0.0264 -0.0651 200 TYR C CE1 8047 C CE2 . TYR C 141 ? 0.6339 0.5486 0.5965 0.0606 -0.0328 -0.0641 200 TYR C CE2 8048 C CZ . TYR C 141 ? 0.8694 0.7823 0.8248 0.0604 -0.0284 -0.0629 200 TYR C CZ 8049 O OH . TYR C 141 ? 0.9843 0.8998 0.9399 0.0559 -0.0261 -0.0594 200 TYR C OH 8050 N N . GLU C 142 ? 0.4168 0.3129 0.3710 0.0796 -0.0431 -0.0721 201 GLU C N 8051 C CA . GLU C 142 ? 0.5351 0.4320 0.4945 0.0779 -0.0466 -0.0701 201 GLU C CA 8052 C C . GLU C 142 ? 0.4596 0.3607 0.4200 0.0718 -0.0435 -0.0660 201 GLU C C 8053 O O . GLU C 142 ? 0.4667 0.3675 0.4214 0.0706 -0.0391 -0.0647 201 GLU C O 8054 C CB . GLU C 142 ? 0.4194 0.3090 0.3741 0.0837 -0.0496 -0.0708 201 GLU C CB 8055 C CG . GLU C 142 ? 0.5311 0.4156 0.4833 0.0906 -0.0522 -0.0750 201 GLU C CG 8056 C CD . GLU C 142 ? 0.5169 0.3973 0.4712 0.0948 -0.0579 -0.0760 201 GLU C CD 8057 O OE1 . GLU C 142 ? 0.7181 0.6002 0.6764 0.0920 -0.0600 -0.0734 201 GLU C OE1 8058 O OE2 . GLU C 142 ? 0.4537 0.3294 0.4057 0.1010 -0.0604 -0.0794 201 GLU C OE2 8059 N N . SER C 143 ? 0.6267 0.5319 0.5944 0.0679 -0.0459 -0.0642 202 SER C N 8060 C CA . SER C 143 ? 0.5795 0.4889 0.5488 0.0621 -0.0433 -0.0604 202 SER C CA 8061 C C . SER C 143 ? 0.4061 0.3113 0.3685 0.0632 -0.0418 -0.0584 202 SER C C 8062 O O . SER C 143 ? 0.4994 0.3990 0.4586 0.0678 -0.0446 -0.0592 202 SER C O 8063 C CB . SER C 143 ? 0.4023 0.3161 0.3806 0.0584 -0.0465 -0.0591 202 SER C CB 8064 O OG . SER C 143 ? 0.8045 0.7145 0.7842 0.0622 -0.0515 -0.0601 202 SER C OG 8065 N N . ASP C 144 ? 0.6200 0.5279 0.5802 0.0591 -0.0375 -0.0559 203 ASP C N 8066 C CA . ASP C 144 ? 0.4185 0.3234 0.3729 0.0593 -0.0357 -0.0537 203 ASP C CA 8067 C C . ASP C 144 ? 0.4963 0.4004 0.4535 0.0590 -0.0395 -0.0520 203 ASP C C 8068 O O . ASP C 144 ? 0.4840 0.3929 0.4480 0.0548 -0.0409 -0.0507 203 ASP C O 8069 C CB . ASP C 144 ? 0.4780 0.3872 0.4314 0.0541 -0.0307 -0.0513 203 ASP C CB 8070 C CG . ASP C 144 ? 0.6409 0.5466 0.5871 0.0547 -0.0280 -0.0495 203 ASP C CG 8071 O OD1 . ASP C 144 ? 0.5776 0.4796 0.5220 0.0569 -0.0304 -0.0487 203 ASP C OD1 8072 O OD2 . ASP C 144 ? 0.7173 0.6240 0.6598 0.0531 -0.0235 -0.0489 203 ASP C OD2 8073 N N . PRO C 145 ? 0.4900 0.3880 0.4418 0.0634 -0.0411 -0.0521 204 PRO C N 8074 C CA . PRO C 145 ? 0.5498 0.4463 0.5031 0.0636 -0.0448 -0.0505 204 PRO C CA 8075 C C . PRO C 145 ? 0.5551 0.4558 0.5100 0.0579 -0.0428 -0.0470 204 PRO C C 8076 O O . PRO C 145 ? 0.6104 0.5121 0.5689 0.0565 -0.0457 -0.0456 204 PRO C O 8077 C CB . PRO C 145 ? 0.4237 0.3125 0.3691 0.0696 -0.0455 -0.0511 204 PRO C CB 8078 C CG . PRO C 145 ? 0.4821 0.3680 0.4239 0.0737 -0.0441 -0.0541 204 PRO C CG 8079 C CD . PRO C 145 ? 0.4109 0.3025 0.3548 0.0691 -0.0399 -0.0540 204 PRO C CD 8080 N N . ASN C 146 ? 0.4306 0.3337 0.3828 0.0548 -0.0378 -0.0458 205 ASN C N 8081 C CA . ASN C 146 ? 0.5898 0.4972 0.5433 0.0494 -0.0355 -0.0427 205 ASN C CA 8082 C C . ASN C 146 ? 0.5094 0.4239 0.4707 0.0441 -0.0349 -0.0421 205 ASN C C 8083 O O . ASN C 146 ? 0.5728 0.4912 0.5363 0.0395 -0.0335 -0.0396 205 ASN C O 8084 C CB . ASN C 146 ? 0.3976 0.3041 0.3445 0.0486 -0.0304 -0.0416 205 ASN C CB 8085 C CG . ASN C 146 ? 0.4475 0.3472 0.3869 0.0533 -0.0306 -0.0416 205 ASN C CG 8086 O OD1 . ASN C 146 ? 0.5066 0.4035 0.4455 0.0551 -0.0339 -0.0408 205 ASN C OD1 8087 N ND2 . ASN C 146 ? 0.4825 0.3794 0.4159 0.0554 -0.0271 -0.0425 205 ASN C ND2 8088 N N . HIS C 147 ? 0.4947 0.4108 0.4600 0.0448 -0.0359 -0.0443 206 HIS C N 8089 C CA . HIS C 147 ? 0.5060 0.4287 0.4787 0.0401 -0.0354 -0.0438 206 HIS C CA 8090 C C . HIS C 147 ? 0.5849 0.5095 0.5648 0.0388 -0.0396 -0.0433 206 HIS C C 8091 O O . HIS C 147 ? 0.5060 0.4274 0.4873 0.0425 -0.0439 -0.0450 206 HIS C O 8092 C CB . HIS C 147 ? 0.4428 0.3666 0.4169 0.0414 -0.0347 -0.0464 206 HIS C CB 8093 C CG . HIS C 147 ? 0.5968 0.5218 0.5666 0.0401 -0.0296 -0.0462 206 HIS C CG 8094 N ND1 . HIS C 147 ? 0.5972 0.5223 0.5661 0.0417 -0.0283 -0.0485 206 HIS C ND1 8095 C CD2 . HIS C 147 ? 0.4052 0.3314 0.3712 0.0373 -0.0255 -0.0440 206 HIS C CD2 8096 C CE1 . HIS C 147 ? 0.3907 0.3169 0.3554 0.0400 -0.0237 -0.0477 206 HIS C CE1 8097 N NE2 . HIS C 147 ? 0.5048 0.4317 0.4678 0.0374 -0.0220 -0.0450 206 HIS C NE2 8098 N N . PHE C 148 ? 0.5751 0.5049 0.5596 0.0336 -0.0384 -0.0409 207 PHE C N 8099 C CA . PHE C 148 ? 0.4005 0.3331 0.3927 0.0316 -0.0418 -0.0404 207 PHE C CA 8100 C C . PHE C 148 ? 0.5383 0.4739 0.5373 0.0314 -0.0432 -0.0424 207 PHE C C 8101 O O . PHE C 148 ? 0.3845 0.3211 0.3824 0.0318 -0.0409 -0.0437 207 PHE C O 8102 C CB . PHE C 148 ? 0.3988 0.3361 0.3936 0.0262 -0.0397 -0.0373 207 PHE C CB 8103 C CG . PHE C 148 ? 0.5647 0.4992 0.5545 0.0263 -0.0397 -0.0353 207 PHE C CG 8104 C CD1 . PHE C 148 ? 0.5182 0.4521 0.5016 0.0254 -0.0357 -0.0340 207 PHE C CD1 8105 C CD2 . PHE C 148 ? 0.4549 0.3876 0.4464 0.0272 -0.0438 -0.0347 207 PHE C CD2 8106 C CE1 . PHE C 148 ? 0.3812 0.3128 0.3601 0.0255 -0.0357 -0.0322 207 PHE C CE1 8107 C CE2 . PHE C 148 ? 0.5531 0.4834 0.5398 0.0273 -0.0439 -0.0329 207 PHE C CE2 8108 C CZ . PHE C 148 ? 0.5407 0.4703 0.5210 0.0265 -0.0398 -0.0316 207 PHE C CZ 8109 N N . TYR C 149 ? 0.4610 0.3980 0.4669 0.0307 -0.0470 -0.0425 208 TYR C N 8110 C CA . TYR C 149 ? 0.4652 0.4055 0.4787 0.0302 -0.0486 -0.0442 208 TYR C CA 8111 C C . TYR C 149 ? 0.5926 0.5389 0.6095 0.0256 -0.0445 -0.0431 208 TYR C C 8112 O O . TYR C 149 ? 0.7330 0.6815 0.7535 0.0257 -0.0444 -0.0448 208 TYR C O 8113 C CB . TYR C 149 ? 0.3832 0.3243 0.4039 0.0295 -0.0530 -0.0441 208 TYR C CB 8114 C CG . TYR C 149 ? 0.6003 0.5431 0.6218 0.0260 -0.0527 -0.0410 208 TYR C CG 8115 C CD1 . TYR C 149 ? 0.4869 0.4253 0.5032 0.0281 -0.0544 -0.0401 208 TYR C CD1 8116 C CD2 . TYR C 149 ? 0.3775 0.3261 0.4047 0.0208 -0.0506 -0.0389 208 TYR C CD2 8117 C CE1 . TYR C 149 ? 0.5145 0.4543 0.5312 0.0250 -0.0541 -0.0373 208 TYR C CE1 8118 C CE2 . TYR C 149 ? 0.5848 0.5346 0.6123 0.0178 -0.0502 -0.0362 208 TYR C CE2 8119 C CZ . TYR C 149 ? 0.6277 0.5732 0.6500 0.0198 -0.0520 -0.0355 208 TYR C CZ 8120 O OH . TYR C 149 ? 0.6681 0.6149 0.6904 0.0169 -0.0516 -0.0329 208 TYR C OH 8121 N N . PHE C 150 ? 0.5926 0.5415 0.6082 0.0217 -0.0413 -0.0403 209 PHE C N 8122 C CA . PHE C 150 ? 0.5891 0.5437 0.6078 0.0173 -0.0374 -0.0389 209 PHE C CA 8123 C C . PHE C 150 ? 0.5822 0.5363 0.5943 0.0178 -0.0331 -0.0391 209 PHE C C 8124 O O . PHE C 150 ? 0.5875 0.5458 0.6008 0.0144 -0.0296 -0.0379 209 PHE C O 8125 C CB . PHE C 150 ? 0.5144 0.4725 0.5358 0.0128 -0.0360 -0.0358 209 PHE C CB 8126 C CG . PHE C 150 ? 0.4800 0.4350 0.4947 0.0131 -0.0352 -0.0342 209 PHE C CG 8127 C CD1 . PHE C 150 ? 0.3711 0.3257 0.3793 0.0125 -0.0310 -0.0333 209 PHE C CD1 8128 C CD2 . PHE C 150 ? 0.3726 0.3252 0.3876 0.0139 -0.0385 -0.0336 209 PHE C CD2 8129 C CE1 . PHE C 150 ? 0.4704 0.4224 0.4728 0.0127 -0.0302 -0.0319 209 PHE C CE1 8130 C CE2 . PHE C 150 ? 0.5406 0.4906 0.5495 0.0142 -0.0377 -0.0320 209 PHE C CE2 8131 C CZ . PHE C 150 ? 0.4792 0.4289 0.4818 0.0136 -0.0336 -0.0312 209 PHE C CZ 8132 N N . SER C 151 ? 0.6638 0.6125 0.6687 0.0220 -0.0334 -0.0407 210 SER C N 8133 C CA . SER C 151 ? 0.5952 0.5429 0.5936 0.0228 -0.0295 -0.0411 210 SER C CA 8134 C C . SER C 151 ? 0.5916 0.5370 0.5884 0.0267 -0.0304 -0.0443 210 SER C C 8135 O O . SER C 151 ? 0.5395 0.4844 0.5316 0.0274 -0.0272 -0.0449 210 SER C O 8136 C CB . SER C 151 ? 0.6673 0.6107 0.6578 0.0243 -0.0283 -0.0401 210 SER C CB 8137 O OG . SER C 151 ? 0.8886 0.8344 0.8798 0.0205 -0.0268 -0.0373 210 SER C OG 8138 N N . ASP C 152 ? 0.6883 0.6321 0.6890 0.0294 -0.0347 -0.0463 211 ASP C N 8139 C CA . ASP C 152 ? 0.7525 0.6935 0.7516 0.0337 -0.0361 -0.0496 211 ASP C CA 8140 C C . ASP C 152 ? 0.6991 0.6447 0.7019 0.0318 -0.0342 -0.0504 211 ASP C C 8141 O O . ASP C 152 ? 0.6508 0.6014 0.6611 0.0283 -0.0347 -0.0494 211 ASP C O 8142 C CB . ASP C 152 ? 0.8272 0.7653 0.8298 0.0371 -0.0415 -0.0515 211 ASP C CB 8143 C CG . ASP C 152 ? 0.8903 0.8232 0.8883 0.0430 -0.0430 -0.0549 211 ASP C CG 8144 O OD1 . ASP C 152 ? 0.7267 0.6570 0.7173 0.0449 -0.0400 -0.0554 211 ASP C OD1 8145 O OD2 . ASP C 152 ? 0.9686 0.9001 0.9705 0.0458 -0.0473 -0.0571 211 ASP C OD2 8146 N N . PHE C 153 ? 0.6454 0.5892 0.6427 0.0342 -0.0320 -0.0522 212 PHE C N 8147 C CA . PHE C 153 ? 0.4792 0.4265 0.4791 0.0332 -0.0306 -0.0534 212 PHE C CA 8148 C C . PHE C 153 ? 0.4240 0.3713 0.4296 0.0356 -0.0349 -0.0561 212 PHE C C 8149 O O . PHE C 153 ? 0.5566 0.4990 0.5606 0.0400 -0.0382 -0.0582 212 PHE C O 8150 C CB . PHE C 153 ? 0.4900 0.4347 0.4817 0.0356 -0.0273 -0.0548 212 PHE C CB 8151 C CG . PHE C 153 ? 0.5194 0.4682 0.5096 0.0316 -0.0225 -0.0527 212 PHE C CG 8152 C CD1 . PHE C 153 ? 0.6202 0.5752 0.6172 0.0268 -0.0216 -0.0507 212 PHE C CD1 8153 C CD2 . PHE C 153 ? 0.5388 0.4851 0.5208 0.0328 -0.0189 -0.0527 212 PHE C CD2 8154 C CE1 . PHE C 153 ? 0.4942 0.4528 0.4897 0.0234 -0.0174 -0.0488 212 PHE C CE1 8155 C CE2 . PHE C 153 ? 0.3817 0.3316 0.3623 0.0292 -0.0147 -0.0508 212 PHE C CE2 8156 C CZ . PHE C 153 ? 0.5626 0.5186 0.5499 0.0246 -0.0140 -0.0489 212 PHE C CZ 8157 N N . GLU C 154 ? 0.3834 0.3359 0.3959 0.0328 -0.0348 -0.0561 213 GLU C N 8158 C CA . GLU C 154 ? 0.4176 0.3705 0.4362 0.0348 -0.0387 -0.0587 213 GLU C CA 8159 C C . GLU C 154 ? 0.3881 0.3370 0.4016 0.0400 -0.0395 -0.0625 213 GLU C C 8160 O O . GLU C 154 ? 0.4927 0.4405 0.4995 0.0409 -0.0361 -0.0629 213 GLU C O 8161 C CB . GLU C 154 ? 0.4857 0.4453 0.5124 0.0306 -0.0379 -0.0578 213 GLU C CB 8162 C CG . GLU C 154 ? 0.5292 0.4925 0.5636 0.0264 -0.0390 -0.0551 213 GLU C CG 8163 C CD . GLU C 154 ? 0.5666 0.5358 0.6098 0.0232 -0.0390 -0.0548 213 GLU C CD 8164 O OE1 . GLU C 154 ? 0.6543 0.6247 0.7052 0.0229 -0.0425 -0.0554 213 GLU C OE1 8165 O OE2 . GLU C 154 ? 0.6696 0.6422 0.7120 0.0210 -0.0354 -0.0539 213 GLU C OE2 8166 N N . ARG C 155 ? 0.4084 0.3550 0.4252 0.0435 -0.0439 -0.0652 214 ARG C N 8167 C CA . ARG C 155 ? 0.4029 0.3459 0.4161 0.0486 -0.0452 -0.0691 214 ARG C CA 8168 C C . ARG C 155 ? 0.3931 0.3400 0.4144 0.0481 -0.0475 -0.0710 214 ARG C C 8169 O O . ARG C 155 ? 0.5273 0.4751 0.5560 0.0479 -0.0514 -0.0715 214 ARG C O 8170 C CB . ARG C 155 ? 0.3977 0.3339 0.4068 0.0541 -0.0486 -0.0711 214 ARG C CB 8171 C CG . ARG C 155 ? 0.3989 0.3307 0.3991 0.0555 -0.0461 -0.0696 214 ARG C CG 8172 C CD . ARG C 155 ? 0.4022 0.3279 0.3999 0.0601 -0.0499 -0.0707 214 ARG C CD 8173 N NE . ARG C 155 ? 0.5067 0.4340 0.5103 0.0575 -0.0525 -0.0684 214 ARG C NE 8174 C CZ . ARG C 155 ? 0.4585 0.3865 0.4605 0.0543 -0.0506 -0.0650 214 ARG C CZ 8175 N NH1 . ARG C 155 ? 0.4998 0.4271 0.4949 0.0533 -0.0461 -0.0635 214 ARG C NH1 8176 N NH2 . ARG C 155 ? 0.5958 0.5252 0.6032 0.0521 -0.0532 -0.0632 214 ARG C NH2 8177 N N . HIS C 156 ? 0.3928 0.3418 0.4126 0.0479 -0.0450 -0.0722 215 HIS C N 8178 C CA . HIS C 156 ? 0.3919 0.3450 0.4191 0.0471 -0.0467 -0.0739 215 HIS C CA 8179 C C . HIS C 156 ? 0.5539 0.5037 0.5837 0.0520 -0.0517 -0.0778 215 HIS C C 8180 O O . HIS C 156 ? 0.4651 0.4180 0.5036 0.0510 -0.0546 -0.0787 215 HIS C O 8181 C CB . HIS C 156 ? 0.3916 0.3467 0.4149 0.0468 -0.0431 -0.0747 215 HIS C CB 8182 C CG . HIS C 156 ? 0.5150 0.4653 0.5315 0.0526 -0.0438 -0.0787 215 HIS C CG 8183 N ND1 . HIS C 156 ? 0.5476 0.4918 0.5546 0.0564 -0.0427 -0.0795 215 HIS C ND1 8184 C CD2 . HIS C 156 ? 0.4133 0.3636 0.4310 0.0554 -0.0454 -0.0823 215 HIS C CD2 8185 C CE1 . HIS C 156 ? 0.4243 0.3650 0.4268 0.0614 -0.0436 -0.0833 215 HIS C CE1 8186 N NE2 . HIS C 156 ? 0.5034 0.4478 0.5122 0.0609 -0.0452 -0.0851 215 HIS C NE2 8187 N N . HIS C 157 ? 0.3989 0.3422 0.4211 0.0574 -0.0527 -0.0801 216 HIS C N 8188 C CA . HIS C 157 ? 0.4599 0.3993 0.4834 0.0628 -0.0574 -0.0840 216 HIS C CA 8189 C C . HIS C 157 ? 0.4663 0.4046 0.4958 0.0629 -0.0618 -0.0834 216 HIS C C 8190 O O . HIS C 157 ? 0.6079 0.5441 0.6409 0.0666 -0.0663 -0.0864 216 HIS C O 8191 C CB . HIS C 157 ? 0.4066 0.3391 0.4195 0.0688 -0.0568 -0.0866 216 HIS C CB 8192 C CG . HIS C 157 ? 0.5143 0.4425 0.5206 0.0697 -0.0556 -0.0845 216 HIS C CG 8193 N ND1 . HIS C 157 ? 0.4063 0.3346 0.4061 0.0674 -0.0506 -0.0820 216 HIS C ND1 8194 C CD2 . HIS C 157 ? 0.4096 0.3330 0.4147 0.0726 -0.0586 -0.0845 216 HIS C CD2 8195 C CE1 . HIS C 157 ? 0.5628 0.4868 0.5578 0.0689 -0.0507 -0.0805 216 HIS C CE1 8196 N NE2 . HIS C 157 ? 0.4705 0.3914 0.4685 0.0721 -0.0554 -0.0820 216 HIS C NE2 8197 N N . ALA C 158 ? 0.5192 0.4590 0.5497 0.0590 -0.0606 -0.0796 217 ALA C N 8198 C CA . ALA C 158 ? 0.4627 0.4020 0.4991 0.0584 -0.0645 -0.0786 217 ALA C CA 8199 C C . ALA C 158 ? 0.4897 0.4350 0.5376 0.0546 -0.0664 -0.0782 217 ALA C C 8200 O O . ALA C 158 ? 0.5726 0.5173 0.6268 0.0558 -0.0709 -0.0794 217 ALA C O 8201 C CB . ALA C 158 ? 0.5120 0.4509 0.5451 0.0556 -0.0624 -0.0747 217 ALA C CB 8202 N N . GLU C 159 ? 0.4532 0.4041 0.5038 0.0501 -0.0628 -0.0766 218 GLU C N 8203 C CA . GLU C 159 ? 0.5729 0.5297 0.6342 0.0466 -0.0640 -0.0763 218 GLU C CA 8204 C C . GLU C 159 ? 0.4328 0.3888 0.4983 0.0504 -0.0679 -0.0806 218 GLU C C 8205 O O . GLU C 159 ? 0.5067 0.4645 0.5812 0.0497 -0.0715 -0.0813 218 GLU C O 8206 C CB . GLU C 159 ? 0.3882 0.3505 0.4500 0.0419 -0.0592 -0.0741 218 GLU C CB 8207 C CG . GLU C 159 ? 0.5294 0.4939 0.5898 0.0372 -0.0556 -0.0696 218 GLU C CG 8208 C CD . GLU C 159 ? 0.6451 0.6136 0.7149 0.0329 -0.0569 -0.0671 218 GLU C CD 8209 O OE1 . GLU C 159 ? 0.4933 0.4608 0.5690 0.0343 -0.0613 -0.0685 218 GLU C OE1 8210 O OE2 . GLU C 159 ? 0.5328 0.5054 0.6040 0.0282 -0.0535 -0.0637 218 GLU C OE2 8211 N N . ILE C 160 ? 0.4591 0.4121 0.5178 0.0544 -0.0671 -0.0836 219 ILE C N 8212 C CA . ILE C 160 ? 0.3988 0.3506 0.4602 0.0586 -0.0705 -0.0881 219 ILE C CA 8213 C C . ILE C 160 ? 0.5588 0.5055 0.6213 0.0633 -0.0758 -0.0904 219 ILE C C 8214 O O . ILE C 160 ? 0.5919 0.5399 0.6628 0.0640 -0.0799 -0.0923 219 ILE C O 8215 C CB . ILE C 160 ? 0.5222 0.4715 0.5748 0.0623 -0.0682 -0.0907 219 ILE C CB 8216 C CG1 . ILE C 160 ? 0.3981 0.3526 0.4499 0.0580 -0.0633 -0.0887 219 ILE C CG1 8217 C CG2 . ILE C 160 ? 0.4042 0.3514 0.4587 0.0674 -0.0720 -0.0956 219 ILE C CG2 8218 C CD1 . ILE C 160 ? 0.4000 0.3516 0.4410 0.0607 -0.0598 -0.0899 219 ILE C CD1 8219 N N . ALA C 161 ? 0.4043 0.3452 0.4584 0.0665 -0.0757 -0.0901 220 ALA C N 8220 C CA . ALA C 161 ? 0.4837 0.4190 0.5372 0.0716 -0.0805 -0.0923 220 ALA C CA 8221 C C . ALA C 161 ? 0.4131 0.3502 0.4759 0.0693 -0.0844 -0.0909 220 ALA C C 8222 O O . ALA C 161 ? 0.5583 0.4932 0.6253 0.0728 -0.0893 -0.0937 220 ALA C O 8223 C CB . ALA C 161 ? 0.4342 0.3635 0.4770 0.0745 -0.0790 -0.0912 220 ALA C CB 8224 N N . THR C 162 ? 0.4026 0.3439 0.4687 0.0634 -0.0821 -0.0867 221 THR C N 8225 C CA . THR C 162 ? 0.4561 0.3989 0.5303 0.0610 -0.0853 -0.0850 221 THR C CA 8226 C C . THR C 162 ? 0.4683 0.4158 0.5539 0.0591 -0.0879 -0.0865 221 THR C C 8227 O O . THR C 162 ? 0.5546 0.5015 0.6469 0.0600 -0.0924 -0.0874 221 THR C O 8228 C CB . THR C 162 ? 0.4123 0.3580 0.4862 0.0554 -0.0820 -0.0801 221 THR C CB 8229 O OG1 . THR C 162 ? 0.5277 0.4693 0.5910 0.0569 -0.0793 -0.0788 221 THR C OG1 8230 C CG2 . THR C 162 ? 0.4263 0.3726 0.5073 0.0536 -0.0855 -0.0785 221 THR C CG2 8231 N N . PHE C 163 ? 0.4865 0.4388 0.5744 0.0566 -0.0849 -0.0867 222 PHE C N 8232 C CA . PHE C 163 ? 0.5294 0.4862 0.6279 0.0551 -0.0870 -0.0883 222 PHE C CA 8233 C C . PHE C 163 ? 0.4744 0.4274 0.5748 0.0609 -0.0922 -0.0932 222 PHE C C 8234 O O . PHE C 163 ? 0.6870 0.6416 0.7968 0.0606 -0.0962 -0.0943 222 PHE C O 8235 C CB . PHE C 163 ? 0.3949 0.3564 0.4936 0.0523 -0.0829 -0.0881 222 PHE C CB 8236 C CG . PHE C 163 ? 0.4814 0.4464 0.5890 0.0525 -0.0852 -0.0909 222 PHE C CG 8237 C CD1 . PHE C 163 ? 0.5746 0.5442 0.6937 0.0486 -0.0869 -0.0897 222 PHE C CD1 8238 C CD2 . PHE C 163 ? 0.5154 0.4789 0.6197 0.0566 -0.0856 -0.0949 222 PHE C CD2 8239 C CE1 . PHE C 163 ? 0.5076 0.4804 0.6352 0.0488 -0.0890 -0.0923 222 PHE C CE1 8240 C CE2 . PHE C 163 ? 0.4981 0.4649 0.6106 0.0568 -0.0878 -0.0976 222 PHE C CE2 8241 C CZ . PHE C 163 ? 0.4741 0.4455 0.5984 0.0529 -0.0895 -0.0963 222 PHE C CZ 8242 N N . HIS C 164 ? 0.4823 0.4305 0.5740 0.0662 -0.0922 -0.0961 223 HIS C N 8243 C CA . HIS C 164 ? 0.6128 0.5567 0.7048 0.0725 -0.0970 -0.1009 223 HIS C CA 8244 C C . HIS C 164 ? 0.5612 0.5008 0.6549 0.0752 -0.1018 -0.1011 223 HIS C C 8245 O O . HIS C 164 ? 0.5864 0.5254 0.6869 0.0777 -0.1067 -0.1039 223 HIS C O 8246 C CB . HIS C 164 ? 0.4591 0.3982 0.5402 0.0778 -0.0953 -0.1036 223 HIS C CB 8247 C CG . HIS C 164 ? 0.4903 0.4330 0.5709 0.0769 -0.0923 -0.1051 223 HIS C CG 8248 N ND1 . HIS C 164 ? 0.4125 0.3540 0.4936 0.0814 -0.0946 -0.1098 223 HIS C ND1 8249 C CD2 . HIS C 164 ? 0.5533 0.5008 0.6329 0.0721 -0.0873 -0.1024 223 HIS C CD2 8250 C CE1 . HIS C 164 ? 0.5735 0.5188 0.6538 0.0793 -0.0911 -0.1100 223 HIS C CE1 8251 N NE2 . HIS C 164 ? 0.5208 0.4697 0.6001 0.0737 -0.0866 -0.1055 223 HIS C NE2 8252 N N . LEU C 165 ? 0.4095 0.3462 0.4970 0.0748 -0.1004 -0.0981 224 LEU C N 8253 C CA . LEU C 165 ? 0.5944 0.5270 0.6827 0.0771 -0.1048 -0.0978 224 LEU C CA 8254 C C . LEU C 165 ? 0.6036 0.5408 0.7039 0.0728 -0.1074 -0.0963 224 LEU C C 8255 O O . LEU C 165 ? 0.4377 0.3725 0.5425 0.0753 -0.1126 -0.0979 224 LEU C O 8256 C CB . LEU C 165 ? 0.4112 0.3405 0.4907 0.0767 -0.1023 -0.0944 224 LEU C CB 8257 C CG . LEU C 165 ? 0.6176 0.5426 0.6972 0.0789 -0.1065 -0.0936 224 LEU C CG 8258 C CD1 . LEU C 165 ? 0.4449 0.3637 0.5222 0.0865 -0.1114 -0.0980 224 LEU C CD1 8259 C CD2 . LEU C 165 ? 0.4124 0.3350 0.4837 0.0777 -0.1036 -0.0899 224 LEU C CD2 8260 N N . ASP C 166 ? 0.4047 0.3483 0.5101 0.0663 -0.1039 -0.0934 225 ASP C N 8261 C CA . ASP C 166 ? 0.4693 0.4177 0.5862 0.0618 -0.1056 -0.0918 225 ASP C CA 8262 C C . ASP C 166 ? 0.5296 0.4793 0.6555 0.0639 -0.1099 -0.0959 225 ASP C C 8263 O O . ASP C 166 ? 0.5527 0.5038 0.6877 0.0627 -0.1135 -0.0960 225 ASP C O 8264 C CB . ASP C 166 ? 0.5098 0.4646 0.6295 0.0549 -0.1005 -0.0880 225 ASP C CB 8265 C CG . ASP C 166 ? 0.5338 0.4937 0.6656 0.0502 -0.1019 -0.0864 225 ASP C CG 8266 O OD1 . ASP C 166 ? 0.4983 0.4624 0.6381 0.0488 -0.1023 -0.0879 225 ASP C OD1 8267 O OD2 . ASP C 166 ? 0.5655 0.5252 0.6987 0.0479 -0.1025 -0.0835 225 ASP C OD2 8268 N N . ARG C 167 ? 0.4269 0.3761 0.5501 0.0670 -0.1093 -0.0993 226 ARG C N 8269 C CA . ARG C 167 ? 0.4065 0.3563 0.5369 0.0699 -0.1133 -0.1036 226 ARG C CA 8270 C C . ARG C 167 ? 0.5775 0.5209 0.7065 0.0763 -0.1191 -0.1069 226 ARG C C 8271 O O . ARG C 167 ? 0.4452 0.3891 0.5831 0.0772 -0.1238 -0.1088 226 ARG C O 8272 C CB . ARG C 167 ? 0.5348 0.4856 0.6616 0.0717 -0.1109 -0.1064 226 ARG C CB 8273 C CG . ARG C 167 ? 0.5472 0.4982 0.6806 0.0753 -0.1152 -0.1114 226 ARG C CG 8274 C CD . ARG C 167 ? 0.4355 0.3881 0.5656 0.0764 -0.1125 -0.1138 226 ARG C CD 8275 N NE . ARG C 167 ? 0.5237 0.4835 0.6592 0.0702 -0.1085 -0.1112 226 ARG C NE 8276 C CZ . ARG C 167 ? 0.6686 0.6308 0.8017 0.0700 -0.1055 -0.1125 226 ARG C CZ 8277 N NH1 . ARG C 167 ? 0.5170 0.4752 0.6425 0.0756 -0.1060 -0.1164 226 ARG C NH1 8278 N NH2 . ARG C 167 ? 0.5833 0.5521 0.7216 0.0643 -0.1021 -0.1098 226 ARG C NH2 8279 N N . VAL C 168 ? 0.4400 0.3774 0.5577 0.0810 -0.1185 -0.1076 227 VAL C N 8280 C CA . VAL C 168 ? 0.4661 0.3965 0.5804 0.0879 -0.1235 -0.1106 227 VAL C CA 8281 C C . VAL C 168 ? 0.4312 0.3606 0.5509 0.0871 -0.1275 -0.1089 227 VAL C C 8282 O O . VAL C 168 ? 0.6857 0.6118 0.8088 0.0914 -0.1331 -0.1119 227 VAL C O 8283 C CB . VAL C 168 ? 0.5306 0.4549 0.6311 0.0922 -0.1212 -0.1106 227 VAL C CB 8284 C CG1 . VAL C 168 ? 0.6565 0.5734 0.7533 0.0993 -0.1262 -0.1131 227 VAL C CG1 8285 C CG2 . VAL C 168 ? 0.4254 0.3500 0.5205 0.0940 -0.1178 -0.1130 227 VAL C CG2 8286 N N . LEU C 169 ? 0.4391 0.3713 0.5596 0.0814 -0.1249 -0.1041 228 LEU C N 8287 C CA . LEU C 169 ? 0.5301 0.4615 0.6551 0.0802 -0.1283 -0.1021 228 LEU C CA 8288 C C . LEU C 169 ? 0.5364 0.4731 0.6751 0.0765 -0.1309 -0.1025 228 LEU C C 8289 O O . LEU C 169 ? 0.5266 0.4630 0.6707 0.0756 -0.1343 -0.1014 228 LEU C O 8290 C CB . LEU C 169 ? 0.4242 0.3565 0.5444 0.0757 -0.1243 -0.0969 228 LEU C CB 8291 C CG . LEU C 169 ? 0.4971 0.4237 0.6041 0.0791 -0.1223 -0.0960 228 LEU C CG 8292 C CD1 . LEU C 169 ? 0.4105 0.3390 0.5139 0.0739 -0.1179 -0.0909 228 LEU C CD1 8293 C CD2 . LEU C 169 ? 0.4175 0.3370 0.5210 0.0856 -0.1276 -0.0980 228 LEU C CD2 8294 N N . GLY C 170 ? 0.5896 0.5311 0.7337 0.0745 -0.1291 -0.1040 229 GLY C N 8295 C CA . GLY C 170 ? 0.4088 0.3552 0.5661 0.0715 -0.1315 -0.1049 229 GLY C CA 8296 C C . GLY C 170 ? 0.6063 0.5586 0.7697 0.0640 -0.1283 -0.1003 229 GLY C C 8297 O O . GLY C 170 ? 0.6465 0.6026 0.8212 0.0611 -0.1304 -0.1002 229 GLY C O 8298 N N . PHE C 171 ? 0.5766 0.5297 0.7328 0.0609 -0.1232 -0.0965 230 PHE C N 8299 C CA . PHE C 171 ? 0.5445 0.5030 0.7055 0.0539 -0.1197 -0.0920 230 PHE C CA 8300 C C . PHE C 171 ? 0.4653 0.4302 0.6326 0.0500 -0.1164 -0.0920 230 PHE C C 8301 O O . PHE C 171 ? 0.5244 0.4941 0.7022 0.0458 -0.1167 -0.0908 230 PHE C O 8302 C CB . PHE C 171 ? 0.7254 0.6825 0.8763 0.0520 -0.1153 -0.0881 230 PHE C CB 8303 C CG . PHE C 171 ? 0.6457 0.5972 0.7911 0.0547 -0.1181 -0.0871 230 PHE C CG 8304 C CD1 . PHE C 171 ? 0.4247 0.3744 0.5763 0.0564 -0.1236 -0.0883 230 PHE C CD1 8305 C CD2 . PHE C 171 ? 0.6502 0.5985 0.7844 0.0555 -0.1151 -0.0850 230 PHE C CD2 8306 C CE1 . PHE C 171 ? 0.5933 0.5378 0.7395 0.0590 -0.1262 -0.0874 230 PHE C CE1 8307 C CE2 . PHE C 171 ? 0.5394 0.4826 0.6683 0.0580 -0.1176 -0.0841 230 PHE C CE2 8308 C CZ . PHE C 171 ? 0.5639 0.5052 0.6987 0.0598 -0.1232 -0.0852 230 PHE C CZ 8309 N N . ARG C 172 ? 0.5943 0.5591 0.7552 0.0515 -0.1133 -0.0933 231 ARG C N 8310 C CA . ARG C 172 ? 0.4657 0.4364 0.6309 0.0480 -0.1098 -0.0930 231 ARG C CA 8311 C C . ARG C 172 ? 0.4965 0.4726 0.6660 0.0411 -0.1057 -0.0881 231 ARG C C 8312 O O . ARG C 172 ? 0.5952 0.5767 0.7740 0.0375 -0.1048 -0.0876 231 ARG C O 8313 C CB . ARG C 172 ? 0.4606 0.4334 0.6358 0.0494 -0.1134 -0.0968 231 ARG C CB 8314 C CG . ARG C 172 ? 0.5836 0.5526 0.7535 0.0557 -0.1154 -0.1017 231 ARG C CG 8315 C CD . ARG C 172 ? 0.4578 0.4284 0.6376 0.0576 -0.1197 -0.1059 231 ARG C CD 8316 N NE . ARG C 172 ? 0.5167 0.4819 0.6913 0.0648 -0.1232 -0.1108 231 ARG C NE 8317 C CZ . ARG C 172 ? 0.5403 0.5003 0.7143 0.0695 -0.1283 -0.1131 231 ARG C CZ 8318 N NH1 . ARG C 172 ? 0.5052 0.4645 0.6835 0.0678 -0.1306 -0.1109 231 ARG C NH1 8319 N NH2 . ARG C 172 ? 0.5933 0.5484 0.7620 0.0761 -0.1310 -0.1176 231 ARG C NH2 8320 N N . ARG C 173 ? 0.3889 0.3634 0.5515 0.0395 -0.1032 -0.0847 232 ARG C N 8321 C CA . ARG C 173 ? 0.5142 0.4933 0.6793 0.0333 -0.0990 -0.0800 232 ARG C CA 8322 C C . ARG C 173 ? 0.6106 0.5899 0.7657 0.0321 -0.0935 -0.0777 232 ARG C C 8323 O O . ARG C 173 ? 0.3813 0.3631 0.5356 0.0277 -0.0898 -0.0738 232 ARG C O 8324 C CB . ARG C 173 ? 0.4509 0.4285 0.6177 0.0317 -0.1008 -0.0775 232 ARG C CB 8325 C CG . ARG C 173 ? 0.4993 0.4765 0.6758 0.0329 -0.1064 -0.0796 232 ARG C CG 8326 C CD . ARG C 173 ? 0.4427 0.4208 0.6235 0.0293 -0.1070 -0.0763 232 ARG C CD 8327 N NE . ARG C 173 ? 0.5464 0.5194 0.7183 0.0313 -0.1078 -0.0750 232 ARG C NE 8328 C CZ . ARG C 173 ? 0.5388 0.5065 0.7085 0.0360 -0.1128 -0.0772 232 ARG C CZ 8329 N NH1 . ARG C 173 ? 0.4331 0.3998 0.6090 0.0393 -0.1174 -0.0811 232 ARG C NH1 8330 N NH2 . ARG C 173 ? 0.6983 0.6616 0.8596 0.0376 -0.1131 -0.0757 232 ARG C NH2 8331 N N . ALA C 174 ? 0.3861 0.3625 0.5335 0.0361 -0.0930 -0.0804 233 ALA C N 8332 C CA . ALA C 174 ? 0.4937 0.4703 0.6318 0.0353 -0.0878 -0.0787 233 ALA C CA 8333 C C . ALA C 174 ? 0.5101 0.4916 0.6513 0.0332 -0.0848 -0.0791 233 ALA C C 8334 O O . ALA C 174 ? 0.5373 0.5215 0.6870 0.0332 -0.0870 -0.0812 233 ALA C O 8335 C CB . ALA C 174 ? 0.4090 0.3792 0.5360 0.0409 -0.0886 -0.0811 233 ALA C CB 8336 N N . ILE C 175 ? 0.4495 0.4322 0.5837 0.0313 -0.0798 -0.0770 234 ILE C N 8337 C CA . ILE C 175 ? 0.3881 0.3756 0.5243 0.0291 -0.0766 -0.0768 234 ILE C CA 8338 C C . ILE C 175 ? 0.5011 0.4859 0.6297 0.0336 -0.0762 -0.0802 234 ILE C C 8339 O O . ILE C 175 ? 0.6484 0.6288 0.7666 0.0362 -0.0750 -0.0804 234 ILE C O 8340 C CB . ILE C 175 ? 0.4373 0.4283 0.5710 0.0242 -0.0711 -0.0722 234 ILE C CB 8341 C CG1 . ILE C 175 ? 0.3745 0.3676 0.5145 0.0202 -0.0713 -0.0688 234 ILE C CG1 8342 C CG2 . ILE C 175 ? 0.3746 0.3708 0.5112 0.0218 -0.0680 -0.0718 234 ILE C CG2 8343 C CD1 . ILE C 175 ? 0.5325 0.5290 0.6705 0.0155 -0.0661 -0.0644 234 ILE C CD1 8344 N N . PRO C 176 ? 0.5930 0.5802 0.7265 0.0345 -0.0773 -0.0829 235 PRO C N 8345 C CA . PRO C 176 ? 0.4474 0.4323 0.5743 0.0388 -0.0772 -0.0865 235 PRO C CA 8346 C C . PRO C 176 ? 0.5574 0.5412 0.6730 0.0387 -0.0723 -0.0849 235 PRO C C 8347 O O . PRO C 176 ? 0.4158 0.4040 0.5318 0.0344 -0.0682 -0.0818 235 PRO C O 8348 C CB . PRO C 176 ? 0.4386 0.4287 0.5740 0.0373 -0.0774 -0.0879 235 PRO C CB 8349 C CG . PRO C 176 ? 0.5478 0.5405 0.6950 0.0348 -0.0804 -0.0870 235 PRO C CG 8350 C CD . PRO C 176 ? 0.4227 0.4149 0.5689 0.0317 -0.0790 -0.0830 235 PRO C CD 8351 N N . THR C 177 ? 0.3881 0.3661 0.4941 0.0434 -0.0728 -0.0871 236 THR C N 8352 C CA . THR C 177 ? 0.4653 0.4415 0.5602 0.0437 -0.0684 -0.0858 236 THR C CA 8353 C C . THR C 177 ? 0.4851 0.4568 0.5720 0.0495 -0.0691 -0.0900 236 THR C C 8354 O O . THR C 177 ? 0.4424 0.4095 0.5285 0.0543 -0.0731 -0.0932 236 THR C O 8355 C CB . THR C 177 ? 0.5293 0.5023 0.6188 0.0431 -0.0674 -0.0829 236 THR C CB 8356 O OG1 . THR C 177 ? 0.5538 0.5307 0.6508 0.0380 -0.0671 -0.0793 236 THR C OG1 8357 C CG2 . THR C 177 ? 0.3878 0.3597 0.4668 0.0427 -0.0625 -0.0812 236 THR C CG2 8358 N N . VAL C 178 ? 0.3914 0.3643 0.4723 0.0492 -0.0652 -0.0899 237 VAL C N 8359 C CA . VAL C 178 ? 0.3948 0.3637 0.4677 0.0545 -0.0654 -0.0939 237 VAL C CA 8360 C C . VAL C 178 ? 0.3951 0.3619 0.4565 0.0547 -0.0606 -0.0923 237 VAL C C 8361 O O . VAL C 178 ? 0.4399 0.4100 0.5007 0.0500 -0.0568 -0.0884 237 VAL C O 8362 C CB . VAL C 178 ? 0.5065 0.4789 0.5838 0.0550 -0.0660 -0.0966 237 VAL C CB 8363 C CG1 . VAL C 178 ? 0.3918 0.3692 0.4677 0.0508 -0.0612 -0.0940 237 VAL C CG1 8364 C CG2 . VAL C 178 ? 0.3990 0.3665 0.4701 0.0615 -0.0680 -0.1017 237 VAL C CG2 8365 N N . GLY C 179 ? 0.5397 0.5009 0.5922 0.0601 -0.0609 -0.0954 238 GLY C N 8366 C CA . GLY C 179 ? 0.4193 0.3783 0.4609 0.0608 -0.0564 -0.0946 238 GLY C CA 8367 C C . GLY C 179 ? 0.5436 0.5059 0.5833 0.0600 -0.0537 -0.0955 238 GLY C C 8368 O O . GLY C 179 ? 0.4230 0.3872 0.4674 0.0612 -0.0559 -0.0983 238 GLY C O 8369 N N . ARG C 180 ? 0.4145 0.3776 0.4473 0.0579 -0.0489 -0.0931 239 ARG C N 8370 C CA . ARG C 180 ? 0.3967 0.3628 0.4267 0.0571 -0.0460 -0.0937 239 ARG C CA 8371 C C . ARG C 180 ? 0.5705 0.5345 0.5896 0.0571 -0.0412 -0.0922 239 ARG C C 8372 O O . ARG C 180 ? 0.4946 0.4592 0.5121 0.0539 -0.0387 -0.0885 239 ARG C O 8373 C CB . ARG C 180 ? 0.3925 0.3661 0.4316 0.0513 -0.0450 -0.0908 239 ARG C CB 8374 C CG . ARG C 180 ? 0.4445 0.4217 0.4817 0.0504 -0.0424 -0.0913 239 ARG C CG 8375 C CD . ARG C 180 ? 0.3875 0.3719 0.4339 0.0449 -0.0416 -0.0882 239 ARG C CD 8376 N NE . ARG C 180 ? 0.5835 0.5712 0.6274 0.0440 -0.0388 -0.0883 239 ARG C NE 8377 C CZ . ARG C 180 ? 0.5002 0.4935 0.5518 0.0413 -0.0391 -0.0876 239 ARG C CZ 8378 N NH1 . ARG C 180 ? 0.4738 0.4700 0.5365 0.0392 -0.0420 -0.0870 239 ARG C NH1 8379 N NH2 . ARG C 180 ? 0.3836 0.3796 0.4318 0.0407 -0.0365 -0.0876 239 ARG C NH2 8380 N N . VAL C 181 ? 0.4096 0.3711 0.4211 0.0609 -0.0401 -0.0953 240 VAL C N 8381 C CA . VAL C 181 ? 0.4002 0.3599 0.4013 0.0610 -0.0355 -0.0943 240 VAL C CA 8382 C C . VAL C 181 ? 0.3972 0.3627 0.3992 0.0570 -0.0323 -0.0924 240 VAL C C 8383 O O . VAL C 181 ? 0.6648 0.6323 0.6681 0.0581 -0.0330 -0.0947 240 VAL C O 8384 C CB . VAL C 181 ? 0.4049 0.3582 0.3963 0.0675 -0.0356 -0.0985 240 VAL C CB 8385 C CG1 . VAL C 181 ? 0.4054 0.3568 0.3862 0.0674 -0.0306 -0.0973 240 VAL C CG1 8386 C CG2 . VAL C 181 ? 0.4080 0.3554 0.3988 0.0719 -0.0390 -0.1005 240 VAL C CG2 8387 N N . LEU C 182 ? 0.5991 0.5672 0.6002 0.0525 -0.0288 -0.0881 241 LEU C N 8388 C CA . LEU C 182 ? 0.4849 0.4588 0.4875 0.0484 -0.0258 -0.0857 241 LEU C CA 8389 C C . LEU C 182 ? 0.5022 0.4747 0.4942 0.0489 -0.0214 -0.0853 241 LEU C C 8390 O O . LEU C 182 ? 0.7012 0.6693 0.6858 0.0504 -0.0196 -0.0850 241 LEU C O 8391 C CB . LEU C 182 ? 0.4837 0.4624 0.4937 0.0427 -0.0250 -0.0811 241 LEU C CB 8392 C CG . LEU C 182 ? 0.5268 0.5088 0.5486 0.0409 -0.0287 -0.0809 241 LEU C CG 8393 C CD1 . LEU C 182 ? 0.4909 0.4694 0.5152 0.0420 -0.0315 -0.0809 241 LEU C CD1 8394 C CD2 . LEU C 182 ? 0.7031 0.6917 0.7317 0.0352 -0.0267 -0.0768 241 LEU C CD2 8395 N N . ASN C 183 ? 0.4461 0.4223 0.4375 0.0477 -0.0197 -0.0853 242 ASN C N 8396 C CA . ASN C 183 ? 0.4107 0.3869 0.3934 0.0470 -0.0153 -0.0841 242 ASN C CA 8397 C C . ASN C 183 ? 0.4652 0.4455 0.4505 0.0415 -0.0125 -0.0791 242 ASN C C 8398 O O . ASN C 183 ? 0.5465 0.5324 0.5392 0.0377 -0.0126 -0.0768 242 ASN C O 8399 C CB . ASN C 183 ? 0.3908 0.3695 0.3718 0.0479 -0.0147 -0.0860 242 ASN C CB 8400 C CG . ASN C 183 ? 0.5772 0.5554 0.5483 0.0477 -0.0103 -0.0851 242 ASN C CG 8401 O OD1 . ASN C 183 ? 0.6567 0.6383 0.6281 0.0435 -0.0074 -0.0813 242 ASN C OD1 8402 N ND2 . ASN C 183 ? 0.6168 0.5907 0.5793 0.0523 -0.0098 -0.0888 242 ASN C ND2 8403 N N . MSE C 184 ? 0.5288 0.5060 0.5079 0.0413 -0.0100 -0.0775 243 MSE C N 8404 C CA . MSE C 184 ? 0.5767 0.5571 0.5579 0.0365 -0.0074 -0.0729 243 MSE C CA 8405 C C . MSE C 184 ? 0.6075 0.5928 0.5880 0.0333 -0.0043 -0.0706 243 MSE C C 8406 O O . MSE C 184 ? 0.6177 0.6076 0.6037 0.0289 -0.0033 -0.0669 243 MSE C O 8407 C CB . MSE C 184 ? 0.3846 0.3603 0.3583 0.0374 -0.0052 -0.0720 243 MSE C CB 8408 C CG . MSE C 184 ? 0.3868 0.3578 0.3614 0.0401 -0.0081 -0.0735 243 MSE C CG 8409 SE SE . MSE C 184 ? 0.7960 0.7618 0.7617 0.0406 -0.0050 -0.0719 243 MSE C SE 8410 C CE . MSE C 184 ? 0.3969 0.3692 0.3676 0.0335 -0.0020 -0.0662 243 MSE C CE 8411 N N . THR C 185 ? 0.4651 0.4493 0.4385 0.0356 -0.0028 -0.0726 244 THR C N 8412 C CA . THR C 185 ? 0.5703 0.5587 0.5418 0.0330 0.0001 -0.0706 244 THR C CA 8413 C C . THR C 185 ? 0.5152 0.5095 0.4957 0.0307 -0.0015 -0.0698 244 THR C C 8414 O O . THR C 185 ? 0.5462 0.5453 0.5310 0.0265 0.0000 -0.0661 244 THR C O 8415 C CB . THR C 185 ? 0.5457 0.5312 0.5068 0.0363 0.0021 -0.0732 244 THR C CB 8416 O OG1 . THR C 185 ? 0.4840 0.4639 0.4368 0.0386 0.0039 -0.0739 244 THR C OG1 8417 C CG2 . THR C 185 ? 0.4634 0.4532 0.4223 0.0336 0.0052 -0.0708 244 THR C CG2 8418 N N . THR C 186 ? 0.4094 0.4031 0.3927 0.0334 -0.0047 -0.0733 245 THR C N 8419 C CA . THR C 186 ? 0.5373 0.5364 0.5286 0.0317 -0.0062 -0.0730 245 THR C CA 8420 C C . THR C 186 ? 0.5157 0.5178 0.5188 0.0292 -0.0090 -0.0715 245 THR C C 8421 O O . THR C 186 ? 0.7533 0.7608 0.7636 0.0258 -0.0088 -0.0690 245 THR C O 8422 C CB . THR C 186 ? 0.3809 0.3784 0.3700 0.0359 -0.0083 -0.0776 245 THR C CB 8423 O OG1 . THR C 186 ? 0.4794 0.4722 0.4689 0.0397 -0.0115 -0.0810 245 THR C OG1 8424 C CG2 . THR C 186 ? 0.3828 0.3782 0.3605 0.0381 -0.0054 -0.0790 245 THR C CG2 8425 N N . GLU C 187 ? 0.5147 0.5132 0.5199 0.0309 -0.0116 -0.0730 246 GLU C N 8426 C CA . GLU C 187 ? 0.3835 0.3843 0.3998 0.0291 -0.0147 -0.0721 246 GLU C CA 8427 C C . GLU C 187 ? 0.4896 0.4915 0.5092 0.0254 -0.0135 -0.0681 246 GLU C C 8428 O O . GLU C 187 ? 0.5979 0.6031 0.6270 0.0226 -0.0150 -0.0663 246 GLU C O 8429 C CB . GLU C 187 ? 0.4410 0.4376 0.4587 0.0332 -0.0187 -0.0762 246 GLU C CB 8430 C CG . GLU C 187 ? 0.3813 0.3773 0.3978 0.0369 -0.0206 -0.0805 246 GLU C CG 8431 C CD . GLU C 187 ? 0.5120 0.5036 0.5300 0.0412 -0.0248 -0.0846 246 GLU C CD 8432 O OE1 . GLU C 187 ? 0.5232 0.5091 0.5337 0.0447 -0.0247 -0.0864 246 GLU C OE1 8433 O OE2 . GLU C 187 ? 0.4294 0.4234 0.4563 0.0412 -0.0281 -0.0859 246 GLU C OE2 8434 N N . LEU C 188 ? 0.5187 0.5177 0.5305 0.0254 -0.0107 -0.0668 247 LEU C N 8435 C CA . LEU C 188 ? 0.4817 0.4814 0.4957 0.0221 -0.0095 -0.0631 247 LEU C CA 8436 C C . LEU C 188 ? 0.4087 0.4118 0.4201 0.0186 -0.0053 -0.0595 247 LEU C C 8437 O O . LEU C 188 ? 0.5667 0.5745 0.5848 0.0149 -0.0047 -0.0563 247 LEU C O 8438 C CB . LEU C 188 ? 0.3736 0.3675 0.3818 0.0245 -0.0098 -0.0642 247 LEU C CB 8439 C CG . LEU C 188 ? 0.5589 0.5495 0.5707 0.0275 -0.0140 -0.0670 247 LEU C CG 8440 C CD1 . LEU C 188 ? 0.3776 0.3629 0.3842 0.0291 -0.0139 -0.0670 247 LEU C CD1 8441 C CD2 . LEU C 188 ? 0.3736 0.3682 0.3971 0.0247 -0.0167 -0.0657 247 LEU C CD2 8442 N N . PHE C 189 ? 0.3994 0.3999 0.4009 0.0201 -0.0025 -0.0599 248 PHE C N 8443 C CA . PHE C 189 ? 0.4962 0.4993 0.4941 0.0173 0.0014 -0.0567 248 PHE C CA 8444 C C . PHE C 189 ? 0.6112 0.6201 0.6138 0.0148 0.0022 -0.0549 248 PHE C C 8445 O O . PHE C 189 ? 0.4147 0.4275 0.4217 0.0111 0.0037 -0.0512 248 PHE C O 8446 C CB . PHE C 189 ? 0.4602 0.4594 0.4466 0.0198 0.0040 -0.0582 248 PHE C CB 8447 C CG . PHE C 189 ? 0.4845 0.4859 0.4666 0.0172 0.0079 -0.0551 248 PHE C CG 8448 C CD1 . PHE C 189 ? 0.4302 0.4319 0.4124 0.0145 0.0098 -0.0520 248 PHE C CD1 8449 C CD2 . PHE C 189 ? 0.3679 0.3710 0.3456 0.0176 0.0097 -0.0554 248 PHE C CD2 8450 C CE1 . PHE C 189 ? 0.4288 0.4325 0.4072 0.0123 0.0133 -0.0493 248 PHE C CE1 8451 C CE2 . PHE C 189 ? 0.3660 0.3711 0.3398 0.0153 0.0132 -0.0525 248 PHE C CE2 8452 C CZ . PHE C 189 ? 0.3641 0.3695 0.3383 0.0127 0.0150 -0.0495 248 PHE C CZ 8453 N N . GLU C 190 ? 0.5788 0.5881 0.5803 0.0169 0.0012 -0.0575 249 GLU C N 8454 C CA . GLU C 190 ? 0.5993 0.6139 0.6043 0.0150 0.0019 -0.0560 249 GLU C CA 8455 C C . GLU C 190 ? 0.5359 0.5549 0.5529 0.0124 -0.0002 -0.0545 249 GLU C C 8456 O O . GLU C 190 ? 0.6623 0.6861 0.6835 0.0099 0.0009 -0.0520 249 GLU C O 8457 C CB . GLU C 190 ? 0.5808 0.5944 0.5811 0.0183 0.0013 -0.0596 249 GLU C CB 8458 C CG . GLU C 190 ? 0.5073 0.5180 0.4958 0.0201 0.0043 -0.0603 249 GLU C CG 8459 C CD . GLU C 190 ? 0.6974 0.7057 0.6804 0.0242 0.0032 -0.0646 249 GLU C CD 8460 O OE1 . GLU C 190 ? 0.7902 0.7995 0.7789 0.0255 0.0001 -0.0669 249 GLU C OE1 8461 O OE2 . GLU C 190 ? 0.6798 0.6853 0.6529 0.0261 0.0055 -0.0657 249 GLU C OE2 8462 N N . LYS C 191 ? 0.5650 0.5823 0.5875 0.0131 -0.0032 -0.0559 250 LYS C N 8463 C CA . LYS C 191 ? 0.5272 0.5482 0.5612 0.0108 -0.0054 -0.0546 250 LYS C CA 8464 C C . LYS C 191 ? 0.5859 0.6080 0.6244 0.0076 -0.0046 -0.0511 250 LYS C C 8465 O O . LYS C 191 ? 0.5718 0.5967 0.6198 0.0055 -0.0062 -0.0498 250 LYS C O 8466 C CB . LYS C 191 ? 0.4992 0.5180 0.5375 0.0137 -0.0097 -0.0585 250 LYS C CB 8467 C CG . LYS C 191 ? 0.5301 0.5480 0.5648 0.0171 -0.0108 -0.0623 250 LYS C CG 8468 C CD . LYS C 191 ? 0.6095 0.6329 0.6480 0.0152 -0.0098 -0.0609 250 LYS C CD 8469 C CE . LYS C 191 ? 0.6017 0.6241 0.6359 0.0187 -0.0108 -0.0648 250 LYS C CE 8470 N NZ . LYS C 191 ? 0.6294 0.6572 0.6674 0.0169 -0.0099 -0.0635 250 LYS C NZ 8471 N N . ALA C 192 ? 0.5371 0.5568 0.5687 0.0072 -0.0022 -0.0496 251 ALA C N 8472 C CA . ALA C 192 ? 0.5912 0.6112 0.6259 0.0045 -0.0015 -0.0467 251 ALA C CA 8473 C C . ALA C 192 ? 0.4373 0.4622 0.4753 0.0006 0.0013 -0.0424 251 ALA C C 8474 O O . ALA C 192 ? 0.5730 0.5999 0.6072 0.0001 0.0038 -0.0414 251 ALA C O 8475 C CB . ALA C 192 ? 0.5396 0.5547 0.5657 0.0060 -0.0002 -0.0472 251 ALA C CB 8476 N N . GLU C 193 ? 0.5729 0.5995 0.6178 -0.0020 0.0010 -0.0400 252 GLU C N 8477 C CA . GLU C 193 ? 0.3478 0.3784 0.3954 -0.0055 0.0038 -0.0358 252 GLU C CA 8478 C C . GLU C 193 ? 0.6302 0.6591 0.6689 -0.0058 0.0071 -0.0344 252 GLU C C 8479 O O . GLU C 193 ? 0.5957 0.6203 0.6274 -0.0037 0.0070 -0.0363 252 GLU C O 8480 C CB . GLU C 193 ? 0.4239 0.4560 0.4801 -0.0080 0.0027 -0.0338 252 GLU C CB 8481 C CG . GLU C 193 ? 0.5547 0.5829 0.6083 -0.0075 0.0019 -0.0343 252 GLU C CG 8482 C CD . GLU C 193 ? 0.7268 0.7568 0.7882 -0.0101 0.0013 -0.0320 252 GLU C CD 8483 O OE1 . GLU C 193 ? 0.7772 0.8113 0.8431 -0.0129 0.0032 -0.0289 252 GLU C OE1 8484 O OE2 . GLU C 193 ? 0.6956 0.7228 0.7585 -0.0093 -0.0011 -0.0333 252 GLU C OE2 8485 N N . LYS C 194 ? 0.6852 0.7176 0.7244 -0.0084 0.0100 -0.0310 253 LYS C N 8486 C CA . LYS C 194 ? 0.6416 0.6729 0.6726 -0.0087 0.0132 -0.0295 253 LYS C CA 8487 C C . LYS C 194 ? 0.6956 0.7231 0.7224 -0.0085 0.0136 -0.0297 253 LYS C C 8488 O O . LYS C 194 ? 0.6798 0.7039 0.6982 -0.0068 0.0148 -0.0310 253 LYS C O 8489 C CB . LYS C 194 ? 0.8570 0.8927 0.8908 -0.0116 0.0159 -0.0255 253 LYS C CB 8490 C CG . LYS C 194 ? 1.0578 1.0926 1.0837 -0.0120 0.0191 -0.0240 253 LYS C CG 8491 C CD . LYS C 194 ? 1.1448 1.1831 1.1745 -0.0150 0.0213 -0.0200 253 LYS C CD 8492 C CE . LYS C 194 ? 1.1816 1.2192 1.2163 -0.0163 0.0203 -0.0193 253 LYS C CE 8493 N NZ . LYS C 194 ? 1.2132 1.2536 1.2511 -0.0190 0.0224 -0.0156 253 LYS C NZ 8494 N N . LYS C 195 ? 0.7011 0.7291 0.7338 -0.0102 0.0126 -0.0283 254 LYS C N 8495 C CA . LYS C 195 ? 0.7750 0.7999 0.8044 -0.0103 0.0131 -0.0281 254 LYS C CA 8496 C C . LYS C 195 ? 0.6754 0.6952 0.7006 -0.0072 0.0109 -0.0316 254 LYS C C 8497 O O . LYS C 195 ? 0.6821 0.6985 0.7013 -0.0064 0.0118 -0.0319 254 LYS C O 8498 C CB . LYS C 195 ? 0.7065 0.7334 0.7433 -0.0129 0.0126 -0.0258 254 LYS C CB 8499 C CG . LYS C 195 ? 0.8432 0.8706 0.8882 -0.0127 0.0091 -0.0269 254 LYS C CG 8500 C CD . LYS C 195 ? 0.7751 0.8034 0.8257 -0.0150 0.0088 -0.0248 254 LYS C CD 8501 C CE . LYS C 195 ? 0.7745 0.8039 0.8340 -0.0153 0.0056 -0.0255 254 LYS C CE 8502 N NZ . LYS C 195 ? 1.0444 1.0697 1.1024 -0.0124 0.0023 -0.0290 254 LYS C NZ 8503 N N . LEU C 196 ? 0.6058 0.6251 0.6340 -0.0053 0.0080 -0.0341 255 LEU C N 8504 C CA . LEU C 196 ? 0.5888 0.6032 0.6127 -0.0018 0.0058 -0.0377 255 LEU C CA 8505 C C . LEU C 196 ? 0.4997 0.5118 0.5145 0.0006 0.0075 -0.0395 255 LEU C C 8506 O O . LEU C 196 ? 0.5251 0.5325 0.5331 0.0031 0.0076 -0.0414 255 LEU C O 8507 C CB . LEU C 196 ? 0.4973 0.5118 0.5280 -0.0004 0.0020 -0.0399 255 LEU C CB 8508 C CG . LEU C 196 ? 0.3699 0.3793 0.3964 0.0037 -0.0006 -0.0439 255 LEU C CG 8509 C CD1 . LEU C 196 ? 0.3587 0.3637 0.3809 0.0047 -0.0008 -0.0441 255 LEU C CD1 8510 C CD2 . LEU C 196 ? 0.3805 0.3906 0.4145 0.0048 -0.0044 -0.0460 255 LEU C CD2 8511 N N . LYS C 197 ? 0.5678 0.5831 0.5825 0.0000 0.0089 -0.0389 256 LYS C N 8512 C CA . LYS C 197 ? 0.4948 0.5084 0.5011 0.0022 0.0105 -0.0406 256 LYS C CA 8513 C C . LYS C 197 ? 0.6090 0.6201 0.6069 0.0022 0.0136 -0.0397 256 LYS C C 8514 O O . LYS C 197 ? 0.6039 0.6111 0.5940 0.0050 0.0142 -0.0420 256 LYS C O 8515 C CB . LYS C 197 ? 0.5544 0.5725 0.5624 0.0010 0.0117 -0.0394 256 LYS C CB 8516 C CG . LYS C 197 ? 0.6956 0.7121 0.6965 0.0039 0.0122 -0.0420 256 LYS C CG 8517 C CD . LYS C 197 ? 0.6405 0.6616 0.6441 0.0027 0.0128 -0.0409 256 LYS C CD 8518 C CE . LYS C 197 ? 0.6890 0.7088 0.6885 0.0059 0.0117 -0.0443 256 LYS C CE 8519 N NZ . LYS C 197 ? 0.9392 0.9632 0.9395 0.0049 0.0128 -0.0431 256 LYS C NZ 8520 N N . LYS C 198 ? 0.5481 0.5614 0.5479 -0.0008 0.0155 -0.0364 257 LYS C N 8521 C CA . LYS C 198 ? 0.4589 0.4706 0.4516 -0.0013 0.0186 -0.0352 257 LYS C CA 8522 C C . LYS C 198 ? 0.5234 0.5301 0.5121 0.0003 0.0181 -0.0366 257 LYS C C 8523 O O . LYS C 198 ? 0.5209 0.5253 0.5028 0.0006 0.0205 -0.0363 257 LYS C O 8524 C CB . LYS C 198 ? 0.5037 0.5195 0.4999 -0.0049 0.0207 -0.0313 257 LYS C CB 8525 C CG . LYS C 198 ? 0.8246 0.8417 0.8284 -0.0070 0.0193 -0.0296 257 LYS C CG 8526 C CD . LYS C 198 ? 1.0532 1.0740 1.0594 -0.0102 0.0218 -0.0259 257 LYS C CD 8527 C CE . LYS C 198 ? 1.1337 1.1544 1.1443 -0.0119 0.0211 -0.0245 257 LYS C CE 8528 N NZ . LYS C 198 ? 1.1459 1.1700 1.1585 -0.0147 0.0236 -0.0210 257 LYS C NZ 8529 N N . THR C 199 ? 0.6089 0.6138 0.6017 0.0014 0.0150 -0.0380 258 THR C N 8530 C CA . THR C 199 ? 0.5309 0.5311 0.5203 0.0030 0.0143 -0.0392 258 THR C CA 8531 C C . THR C 199 ? 0.5559 0.5512 0.5388 0.0072 0.0134 -0.0428 258 THR C C 8532 O O . THR C 199 ? 0.5147 0.5055 0.4947 0.0093 0.0124 -0.0443 258 THR C O 8533 C CB . THR C 199 ? 0.5047 0.5049 0.5013 0.0023 0.0113 -0.0389 258 THR C CB 8534 O OG1 . THR C 199 ? 0.4423 0.4424 0.4431 0.0042 0.0080 -0.0414 258 THR C OG1 8535 C CG2 . THR C 199 ? 0.3538 0.3589 0.3574 -0.0017 0.0121 -0.0355 258 THR C CG2 8536 N N . PHE C 200 ? 0.5251 0.5211 0.5054 0.0085 0.0139 -0.0443 259 PHE C N 8537 C CA . PHE C 200 ? 0.4377 0.4292 0.4112 0.0127 0.0134 -0.0478 259 PHE C CA 8538 C C . PHE C 200 ? 0.5159 0.5047 0.4800 0.0135 0.0170 -0.0478 259 PHE C C 8539 O O . PHE C 200 ? 0.5581 0.5497 0.5209 0.0109 0.0198 -0.0453 259 PHE C O 8540 C CB . PHE C 200 ? 0.4450 0.4385 0.4202 0.0139 0.0121 -0.0497 259 PHE C CB 8541 C CG . PHE C 200 ? 0.3673 0.3611 0.3498 0.0149 0.0081 -0.0513 259 PHE C CG 8542 C CD1 . PHE C 200 ? 0.3644 0.3627 0.3564 0.0118 0.0067 -0.0491 259 PHE C CD1 8543 C CD2 . PHE C 200 ? 0.4064 0.3962 0.3866 0.0191 0.0057 -0.0551 259 PHE C CD2 8544 C CE1 . PHE C 200 ? 0.5266 0.5253 0.5256 0.0127 0.0030 -0.0507 259 PHE C CE1 8545 C CE2 . PHE C 200 ? 0.5532 0.5433 0.5403 0.0201 0.0019 -0.0567 259 PHE C CE2 8546 C CZ . PHE C 200 ? 0.3684 0.3630 0.3650 0.0168 0.0005 -0.0545 259 PHE C CZ 8547 N N . PHE C 201 ? 0.5377 0.5211 0.4952 0.0172 0.0168 -0.0506 260 PHE C N 8548 C CA . PHE C 201 ? 0.5001 0.4804 0.4485 0.0183 0.0201 -0.0509 260 PHE C CA 8549 C C . PHE C 201 ? 0.3910 0.3653 0.3327 0.0232 0.0194 -0.0546 260 PHE C C 8550 O O . PHE C 201 ? 0.4618 0.4342 0.4062 0.0256 0.0162 -0.0568 260 PHE C O 8551 C CB . PHE C 201 ? 0.3709 0.3504 0.3183 0.0162 0.0220 -0.0484 260 PHE C CB 8552 C CG . PHE C 201 ? 0.5363 0.5120 0.4848 0.0177 0.0199 -0.0492 260 PHE C CG 8553 C CD1 . PHE C 201 ? 0.3708 0.3485 0.3272 0.0162 0.0171 -0.0482 260 PHE C CD1 8554 C CD2 . PHE C 201 ? 0.4534 0.4233 0.3946 0.0208 0.0209 -0.0509 260 PHE C CD2 8555 C CE1 . PHE C 201 ? 0.3722 0.3463 0.3293 0.0177 0.0152 -0.0488 260 PHE C CE1 8556 C CE2 . PHE C 201 ? 0.4545 0.4208 0.3964 0.0224 0.0190 -0.0515 260 PHE C CE2 8557 C CZ . PHE C 201 ? 0.4547 0.4231 0.4044 0.0208 0.0161 -0.0505 260 PHE C CZ 8558 N N . PHE C 202 ? 0.4690 0.4402 0.4021 0.0246 0.0224 -0.0552 261 PHE C N 8559 C CA . PHE C 202 ? 0.4746 0.4396 0.4006 0.0294 0.0223 -0.0586 261 PHE C CA 8560 C C . PHE C 202 ? 0.4478 0.4085 0.3700 0.0301 0.0237 -0.0581 261 PHE C C 8561 O O . PHE C 202 ? 0.4820 0.4436 0.4022 0.0276 0.0266 -0.0558 261 PHE C O 8562 C CB . PHE C 202 ? 0.3842 0.3484 0.3028 0.0311 0.0248 -0.0601 261 PHE C CB 8563 C CG . PHE C 202 ? 0.4327 0.3998 0.3537 0.0317 0.0231 -0.0616 261 PHE C CG 8564 C CD1 . PHE C 202 ? 0.4023 0.3752 0.3266 0.0283 0.0240 -0.0594 261 PHE C CD1 8565 C CD2 . PHE C 202 ? 0.4962 0.4600 0.4159 0.0359 0.0207 -0.0653 261 PHE C CD2 8566 C CE1 . PHE C 202 ? 0.4867 0.4622 0.4132 0.0289 0.0225 -0.0607 261 PHE C CE1 8567 C CE2 . PHE C 202 ? 0.4016 0.3682 0.3235 0.0365 0.0191 -0.0668 261 PHE C CE2 8568 C CZ . PHE C 202 ? 0.3840 0.3565 0.3094 0.0329 0.0200 -0.0644 261 PHE C CZ 8569 N N . SER C 203 ? 0.4899 0.4458 0.4112 0.0337 0.0215 -0.0603 262 SER C N 8570 C CA . SER C 203 ? 0.4837 0.4349 0.4009 0.0350 0.0226 -0.0601 262 SER C CA 8571 C C . SER C 203 ? 0.4929 0.4401 0.4004 0.0372 0.0262 -0.0613 262 SER C C 8572 O O . SER C 203 ? 0.5208 0.4682 0.4245 0.0386 0.0273 -0.0629 262 SER C O 8573 C CB . SER C 203 ? 0.4564 0.4034 0.3751 0.0386 0.0191 -0.0622 262 SER C CB 8574 O OG . SER C 203 ? 0.5303 0.4724 0.4427 0.0436 0.0189 -0.0657 262 SER C OG 8575 N N . PRO C 204 ? 0.6774 0.6211 0.5808 0.0376 0.0283 -0.0605 263 PRO C N 8576 C CA . PRO C 204 ? 0.5913 0.5307 0.4855 0.0401 0.0318 -0.0618 263 PRO C CA 8577 C C . PRO C 204 ? 0.5532 0.4875 0.4422 0.0456 0.0308 -0.0657 263 PRO C C 8578 O O . PRO C 204 ? 0.7062 0.6378 0.5878 0.0478 0.0335 -0.0672 263 PRO C O 8579 C CB . PRO C 204 ? 0.4227 0.3590 0.3151 0.0398 0.0332 -0.0604 263 PRO C CB 8580 C CG . PRO C 204 ? 0.5350 0.4727 0.4347 0.0386 0.0298 -0.0592 263 PRO C CG 8581 C CD . PRO C 204 ? 0.5052 0.4491 0.4122 0.0355 0.0278 -0.0582 263 PRO C CD 8582 N N . ALA C 205 ? 0.5690 0.5021 0.4619 0.0479 0.0269 -0.0673 264 ALA C N 8583 C CA . ALA C 205 ? 0.4046 0.3330 0.2934 0.0533 0.0254 -0.0711 264 ALA C CA 8584 C C . ALA C 205 ? 0.4843 0.4162 0.3748 0.0533 0.0242 -0.0727 264 ALA C C 8585 O O . ALA C 205 ? 0.5950 0.5239 0.4833 0.0576 0.0224 -0.0760 264 ALA C O 8586 C CB . ALA C 205 ? 0.4302 0.3553 0.3222 0.0561 0.0216 -0.0723 264 ALA C CB 8587 N N . LYS C 206 ? 0.4581 0.3962 0.3526 0.0487 0.0251 -0.0702 265 LYS C N 8588 C CA . LYS C 206 ? 0.7096 0.6518 0.6058 0.0479 0.0244 -0.0711 265 LYS C CA 8589 C C . LYS C 206 ? 0.6710 0.6151 0.5748 0.0487 0.0199 -0.0724 265 LYS C C 8590 O O . LYS C 206 ? 0.6908 0.6366 0.5952 0.0497 0.0187 -0.0742 265 LYS C O 8591 C CB . LYS C 206 ? 0.5700 0.5087 0.4573 0.0517 0.0264 -0.0740 265 LYS C CB 8592 C CG . LYS C 206 ? 0.6117 0.5495 0.4917 0.0507 0.0311 -0.0728 265 LYS C CG 8593 C CD . LYS C 206 ? 0.7088 0.6456 0.5819 0.0531 0.0328 -0.0752 265 LYS C CD 8594 C CE . LYS C 206 ? 1.0253 0.9569 0.8887 0.0553 0.0367 -0.0760 265 LYS C CE 8595 N NZ . LYS C 206 ? 1.0403 0.9654 0.9014 0.0597 0.0357 -0.0780 265 LYS C NZ 8596 N N . ASN C 207 ? 0.5084 0.4520 0.4178 0.0482 0.0173 -0.0715 266 ASN C N 8597 C CA . ASN C 207 ? 0.4819 0.4278 0.3995 0.0482 0.0130 -0.0723 266 ASN C CA 8598 C C . ASN C 207 ? 0.4168 0.3699 0.3427 0.0428 0.0126 -0.0691 266 ASN C C 8599 O O . ASN C 207 ? 0.5435 0.4990 0.4701 0.0390 0.0149 -0.0659 266 ASN C O 8600 C CB . ASN C 207 ? 0.3988 0.3408 0.3185 0.0503 0.0103 -0.0728 266 ASN C CB 8601 C CG . ASN C 207 ? 0.5566 0.4913 0.4688 0.0563 0.0101 -0.0762 266 ASN C CG 8602 O OD1 . ASN C 207 ? 0.4163 0.3492 0.3247 0.0597 0.0098 -0.0793 266 ASN C OD1 8603 N ND2 . ASN C 207 ? 0.4865 0.4168 0.3962 0.0577 0.0103 -0.0756 266 ASN C ND2 8604 N N . PHE C 208 ? 0.4767 0.4332 0.4090 0.0425 0.0097 -0.0700 267 PHE C N 8605 C CA . PHE C 208 ? 0.3874 0.3505 0.3279 0.0376 0.0093 -0.0671 267 PHE C CA 8606 C C . PHE C 208 ? 0.4617 0.4257 0.4095 0.0356 0.0070 -0.0652 267 PHE C C 8607 O O . PHE C 208 ? 0.4004 0.3615 0.3504 0.0383 0.0037 -0.0671 267 PHE C O 8608 C CB . PHE C 208 ? 0.5083 0.4748 0.4530 0.0379 0.0073 -0.0687 267 PHE C CB 8609 C CG . PHE C 208 ? 0.5754 0.5487 0.5257 0.0332 0.0083 -0.0657 267 PHE C CG 8610 C CD1 . PHE C 208 ? 0.5683 0.5438 0.5164 0.0298 0.0118 -0.0624 267 PHE C CD1 8611 C CD2 . PHE C 208 ? 0.4356 0.4130 0.3935 0.0322 0.0057 -0.0660 267 PHE C CD2 8612 C CE1 . PHE C 208 ? 0.4067 0.3882 0.3598 0.0258 0.0127 -0.0595 267 PHE C CE1 8613 C CE2 . PHE C 208 ? 0.4028 0.3862 0.3659 0.0280 0.0067 -0.0631 267 PHE C CE2 8614 C CZ . PHE C 208 ? 0.4759 0.4614 0.4365 0.0249 0.0102 -0.0598 267 PHE C CZ 8615 N N . CYS C 209 ? 0.3891 0.3571 0.3405 0.0310 0.0086 -0.0615 268 CYS C N 8616 C CA . CYS C 209 ? 0.5812 0.5498 0.5384 0.0290 0.0069 -0.0595 268 CYS C CA 8617 C C . CYS C 209 ? 0.5209 0.4959 0.4861 0.0240 0.0071 -0.0562 268 CYS C C 8618 O O . CYS C 209 ? 0.4594 0.4380 0.4239 0.0217 0.0096 -0.0547 268 CYS C O 8619 C CB . CYS C 209 ? 0.4323 0.3973 0.3840 0.0290 0.0092 -0.0583 268 CYS C CB 8620 S SG . CYS C 209 ? 0.3862 0.3431 0.3284 0.0349 0.0094 -0.0617 268 CYS C SG 8621 N N . PHE C 210 ? 0.4662 0.4425 0.4388 0.0226 0.0044 -0.0552 269 PHE C N 8622 C CA . PHE C 210 ? 0.5118 0.4938 0.4918 0.0179 0.0048 -0.0519 269 PHE C CA 8623 C C . PHE C 210 ? 0.4520 0.4333 0.4350 0.0163 0.0040 -0.0500 269 PHE C C 8624 O O . PHE C 210 ? 0.4191 0.3965 0.4019 0.0187 0.0015 -0.0515 269 PHE C O 8625 C CB . PHE C 210 ? 0.3698 0.3557 0.3579 0.0172 0.0022 -0.0524 269 PHE C CB 8626 C CG . PHE C 210 ? 0.4379 0.4216 0.4305 0.0196 -0.0021 -0.0547 269 PHE C CG 8627 C CD1 . PHE C 210 ? 0.3896 0.3741 0.3887 0.0178 -0.0042 -0.0532 269 PHE C CD1 8628 C CD2 . PHE C 210 ? 0.4038 0.3847 0.3942 0.0237 -0.0041 -0.0585 269 PHE C CD2 8629 C CE1 . PHE C 210 ? 0.4406 0.4231 0.4439 0.0201 -0.0082 -0.0553 269 PHE C CE1 8630 C CE2 . PHE C 210 ? 0.4339 0.4127 0.4286 0.0261 -0.0082 -0.0607 269 PHE C CE2 8631 C CZ . PHE C 210 ? 0.3751 0.3548 0.3763 0.0242 -0.0103 -0.0591 269 PHE C CZ 8632 N N . VAL C 211 ? 0.5724 0.5574 0.5579 0.0123 0.0061 -0.0466 270 VAL C N 8633 C CA . VAL C 211 ? 0.3653 0.3501 0.3533 0.0104 0.0058 -0.0445 270 VAL C CA 8634 C C . VAL C 211 ? 0.4215 0.4099 0.4192 0.0081 0.0032 -0.0433 270 VAL C C 8635 O O . VAL C 211 ? 0.5518 0.5387 0.5524 0.0082 0.0010 -0.0431 270 VAL C O 8636 C CB . VAL C 211 ? 0.6626 0.6491 0.6476 0.0075 0.0096 -0.0417 270 VAL C CB 8637 C CG1 . VAL C 211 ? 0.3614 0.3484 0.3497 0.0051 0.0093 -0.0394 270 VAL C CG1 8638 C CG2 . VAL C 211 ? 0.3653 0.3476 0.3407 0.0097 0.0121 -0.0428 270 VAL C CG2 8639 N N . SER C 212 ? 0.3822 0.3754 0.3849 0.0061 0.0036 -0.0424 271 SER C N 8640 C CA . SER C 212 ? 0.3589 0.3562 0.3711 0.0034 0.0019 -0.0408 271 SER C CA 8641 C C . SER C 212 ? 0.5195 0.5182 0.5336 0.0003 0.0032 -0.0376 271 SER C C 8642 O O . SER C 212 ? 0.5407 0.5381 0.5490 -0.0002 0.0058 -0.0365 271 SER C O 8643 C CB . SER C 212 ? 0.3607 0.3562 0.3777 0.0056 -0.0025 -0.0431 271 SER C CB 8644 O OG . SER C 212 ? 0.4407 0.4405 0.4673 0.0030 -0.0040 -0.0417 271 SER C OG 8645 N N . ARG C 213 ? 0.5031 0.5047 0.5254 -0.0018 0.0015 -0.0363 272 ARG C N 8646 C CA . ARG C 213 ? 0.4971 0.4998 0.5215 -0.0046 0.0025 -0.0335 272 ARG C CA 8647 C C . ARG C 213 ? 0.4474 0.4496 0.4781 -0.0048 -0.0009 -0.0337 272 ARG C C 8648 O O . ARG C 213 ? 0.7799 0.7844 0.8178 -0.0051 -0.0031 -0.0342 272 ARG C O 8649 C CB . ARG C 213 ? 0.4828 0.4907 0.5106 -0.0081 0.0053 -0.0305 272 ARG C CB 8650 C CG . ARG C 213 ? 0.8194 0.8310 0.8527 -0.0086 0.0047 -0.0306 272 ARG C CG 8651 C CD . ARG C 213 ? 1.1054 1.1218 1.1419 -0.0119 0.0075 -0.0274 272 ARG C CD 8652 N NE . ARG C 213 ? 1.2176 1.2338 1.2472 -0.0125 0.0110 -0.0261 272 ARG C NE 8653 C CZ . ARG C 213 ? 1.2041 1.2239 1.2349 -0.0150 0.0137 -0.0233 272 ARG C CZ 8654 N NH1 . ARG C 213 ? 1.2514 1.2752 1.2901 -0.0171 0.0135 -0.0215 272 ARG C NH1 8655 N NH2 . ARG C 213 ? 1.1020 1.1213 1.1264 -0.0153 0.0167 -0.0223 272 ARG C NH2 8656 N N . CYS C 214 ? 0.5774 0.5767 0.6055 -0.0046 -0.0014 -0.0332 273 CYS C N 8657 C CA . CYS C 214 ? 0.5171 0.5156 0.5503 -0.0048 -0.0045 -0.0332 273 CYS C CA 8658 C C . CYS C 214 ? 0.4541 0.4503 0.4833 -0.0054 -0.0036 -0.0318 273 CYS C C 8659 O O . CYS C 214 ? 0.6123 0.6074 0.6350 -0.0055 -0.0007 -0.0312 273 CYS C O 8660 C CB . CYS C 214 ? 0.3818 0.3768 0.4155 -0.0012 -0.0084 -0.0364 273 CYS C CB 8661 S SG . CYS C 214 ? 0.5017 0.4900 0.5255 0.0031 -0.0088 -0.0388 273 CYS C SG 8662 N N . ASP C 215 ? 0.5933 0.5888 0.6265 -0.0060 -0.0060 -0.0313 274 ASP C N 8663 C CA . ASP C 215 ? 0.6796 0.6733 0.7095 -0.0068 -0.0053 -0.0299 274 ASP C CA 8664 C C . ASP C 215 ? 0.4694 0.4575 0.4920 -0.0033 -0.0064 -0.0317 274 ASP C C 8665 O O . ASP C 215 ? 0.6028 0.5891 0.6200 -0.0036 -0.0045 -0.0308 274 ASP C O 8666 C CB . ASP C 215 ? 0.7953 0.7904 0.8319 -0.0086 -0.0075 -0.0286 274 ASP C CB 8667 C CG . ASP C 215 ? 0.9505 0.9510 0.9938 -0.0122 -0.0059 -0.0262 274 ASP C CG 8668 O OD1 . ASP C 215 ? 0.7245 0.7275 0.7659 -0.0137 -0.0024 -0.0249 274 ASP C OD1 8669 O OD2 . ASP C 215 ? 1.0854 1.0876 1.1357 -0.0134 -0.0080 -0.0257 274 ASP C OD2 8670 N N . TYR C 216 ? 0.4864 0.4716 0.5089 0.0000 -0.0093 -0.0344 275 TYR C N 8671 C CA . TYR C 216 ? 0.4604 0.4398 0.4765 0.0036 -0.0108 -0.0362 275 TYR C CA 8672 C C . TYR C 216 ? 0.5010 0.4779 0.5102 0.0064 -0.0091 -0.0382 275 TYR C C 8673 O O . TYR C 216 ? 0.5369 0.5121 0.5462 0.0093 -0.0110 -0.0407 275 TYR C O 8674 C CB . TYR C 216 ? 0.6460 0.6231 0.6660 0.0060 -0.0155 -0.0380 275 TYR C CB 8675 C CG . TYR C 216 ? 0.9116 0.8828 0.9257 0.0094 -0.0172 -0.0391 275 TYR C CG 8676 C CD1 . TYR C 216 ? 0.9582 0.9282 0.9714 0.0083 -0.0176 -0.0373 275 TYR C CD1 8677 C CD2 . TYR C 216 ? 1.0571 1.0239 1.0663 0.0138 -0.0183 -0.0419 275 TYR C CD2 8678 C CE1 . TYR C 216 ? 0.9873 0.9520 0.9950 0.0114 -0.0191 -0.0382 275 TYR C CE1 8679 C CE2 . TYR C 216 ? 0.9030 0.8643 0.9068 0.0171 -0.0198 -0.0428 275 TYR C CE2 8680 C CZ . TYR C 216 ? 0.9331 0.8934 0.9362 0.0159 -0.0202 -0.0409 275 TYR C CZ 8681 O OH . TYR C 216 ? 1.0214 0.9762 1.0190 0.0193 -0.0217 -0.0416 275 TYR C OH 8682 N N . TYR C 217 ? 0.5992 0.5758 0.6026 0.0055 -0.0055 -0.0370 276 TYR C N 8683 C CA . TYR C 217 ? 0.4241 0.3975 0.4197 0.0082 -0.0035 -0.0386 276 TYR C CA 8684 C C . TYR C 217 ? 0.6012 0.5764 0.5972 0.0090 -0.0028 -0.0401 276 TYR C C 8685 O O . TYR C 217 ? 0.3684 0.3400 0.3593 0.0124 -0.0029 -0.0426 276 TYR C O 8686 C CB . TYR C 217 ? 0.3950 0.3623 0.3860 0.0125 -0.0058 -0.0407 276 TYR C CB 8687 C CG . TYR C 217 ? 0.6782 0.6431 0.6667 0.0121 -0.0059 -0.0392 276 TYR C CG 8688 C CD1 . TYR C 217 ? 0.3698 0.3329 0.3614 0.0130 -0.0095 -0.0393 276 TYR C CD1 8689 C CD2 . TYR C 217 ? 0.3681 0.3327 0.3515 0.0108 -0.0023 -0.0377 276 TYR C CD2 8690 C CE1 . TYR C 217 ? 0.6834 0.6444 0.6726 0.0127 -0.0096 -0.0379 276 TYR C CE1 8691 C CE2 . TYR C 217 ? 0.5869 0.5495 0.5681 0.0104 -0.0023 -0.0363 276 TYR C CE2 8692 C CZ . TYR C 217 ? 0.5816 0.5424 0.5655 0.0114 -0.0060 -0.0364 276 TYR C CZ 8693 O OH . TYR C 217 ? 0.7452 0.7039 0.7267 0.0110 -0.0061 -0.0350 276 TYR C OH 8694 N N . CYS C 218 ? 0.3901 0.3705 0.3918 0.0058 -0.0019 -0.0387 277 CYS C N 8695 C CA . CYS C 218 ? 0.4052 0.3878 0.4061 0.0059 -0.0002 -0.0394 277 CYS C CA 8696 C C . CYS C 218 ? 0.5711 0.5541 0.5658 0.0047 0.0040 -0.0381 277 CYS C C 8697 O O . CYS C 218 ? 0.6464 0.6336 0.6432 0.0015 0.0064 -0.0358 277 CYS C O 8698 C CB . CYS C 218 ? 0.4298 0.4179 0.4391 0.0031 -0.0008 -0.0382 277 CYS C CB 8699 S SG . CYS C 218 ? 0.3803 0.3685 0.3971 0.0048 -0.0056 -0.0404 277 CYS C SG 8700 N N . ASP C 219 ? 0.4105 0.3888 0.3974 0.0075 0.0050 -0.0396 278 ASP C N 8701 C CA . ASP C 219 ? 0.4722 0.4502 0.4527 0.0068 0.0090 -0.0386 278 ASP C CA 8702 C C . ASP C 219 ? 0.3669 0.3410 0.3401 0.0104 0.0100 -0.0412 278 ASP C C 8703 O O . ASP C 219 ? 0.8051 0.7765 0.7781 0.0137 0.0074 -0.0438 278 ASP C O 8704 C CB . ASP C 219 ? 0.3633 0.3396 0.3413 0.0057 0.0102 -0.0370 278 ASP C CB 8705 C CG . ASP C 219 ? 0.4558 0.4271 0.4319 0.0087 0.0075 -0.0384 278 ASP C CG 8706 O OD1 . ASP C 219 ? 0.5366 0.5039 0.5091 0.0125 0.0063 -0.0410 278 ASP C OD1 8707 O OD2 . ASP C 219 ? 0.5679 0.5390 0.5458 0.0074 0.0067 -0.0369 278 ASP C OD2 8708 N N . THR C 220 ? 0.5527 0.5265 0.5202 0.0099 0.0136 -0.0406 279 THR C N 8709 C CA . THR C 220 ? 0.4996 0.4699 0.4597 0.0131 0.0151 -0.0429 279 THR C CA 8710 C C . THR C 220 ? 0.5591 0.5231 0.5147 0.0173 0.0134 -0.0452 279 THR C C 8711 O O . THR C 220 ? 0.7467 0.7079 0.6994 0.0208 0.0125 -0.0479 279 THR C O 8712 C CB . THR C 220 ? 0.4145 0.3852 0.3691 0.0116 0.0193 -0.0415 279 THR C CB 8713 O OG1 . THR C 220 ? 0.4756 0.4520 0.4342 0.0079 0.0208 -0.0393 279 THR C OG1 8714 C CG2 . THR C 220 ? 0.3714 0.3387 0.3186 0.0148 0.0210 -0.0438 279 THR C CG2 8715 N N . THR C 221 ? 0.4284 0.3903 0.3834 0.0170 0.0132 -0.0441 280 THR C N 8716 C CA . THR C 221 ? 0.5539 0.5097 0.5045 0.0210 0.0118 -0.0459 280 THR C CA 8717 C C . THR C 221 ? 0.5082 0.4623 0.4621 0.0239 0.0075 -0.0481 280 THR C C 8718 O O . THR C 221 ? 0.4407 0.3899 0.3902 0.0282 0.0065 -0.0506 280 THR C O 8719 C CB . THR C 221 ? 0.6177 0.5722 0.5680 0.0197 0.0120 -0.0439 280 THR C CB 8720 O OG1 . THR C 221 ? 0.3806 0.3366 0.3279 0.0171 0.0159 -0.0420 280 THR C OG1 8721 C CG2 . THR C 221 ? 0.3797 0.3277 0.3250 0.0240 0.0106 -0.0456 280 THR C CG2 8722 N N . HIS C 222 ? 0.4344 0.3925 0.3963 0.0216 0.0051 -0.0472 281 HIS C N 8723 C CA . HIS C 222 ? 0.3860 0.3430 0.3522 0.0239 0.0008 -0.0491 281 HIS C CA 8724 C C . HIS C 222 ? 0.3773 0.3378 0.3475 0.0237 0.0000 -0.0503 281 HIS C C 8725 O O . HIS C 222 ? 0.4106 0.3726 0.3872 0.0237 -0.0034 -0.0510 281 HIS C O 8726 C CB . HIS C 222 ? 0.3763 0.3348 0.3487 0.0219 -0.0018 -0.0474 281 HIS C CB 8727 C CG . HIS C 222 ? 0.5429 0.4981 0.5116 0.0221 -0.0013 -0.0461 281 HIS C CG 8728 N ND1 . HIS C 222 ? 0.5307 0.4880 0.4983 0.0187 0.0018 -0.0434 281 HIS C ND1 8729 C CD2 . HIS C 222 ? 0.4572 0.4073 0.4232 0.0254 -0.0034 -0.0471 281 HIS C CD2 8730 C CE1 . HIS C 222 ? 0.4994 0.4530 0.4636 0.0198 0.0016 -0.0429 281 HIS C CE1 8731 N NE2 . HIS C 222 ? 0.6421 0.5913 0.6053 0.0239 -0.0016 -0.0450 281 HIS C NE2 8732 N N . ALA C 223 ? 0.4010 0.3627 0.3673 0.0233 0.0030 -0.0506 282 ALA C N 8733 C CA . ALA C 223 ? 0.4769 0.4418 0.4461 0.0232 0.0025 -0.0518 282 ALA C CA 8734 C C . ALA C 223 ? 0.4819 0.4434 0.4507 0.0277 -0.0007 -0.0553 282 ALA C C 8735 O O . ALA C 223 ? 0.5397 0.4956 0.5030 0.0316 -0.0013 -0.0573 282 ALA C O 8736 C CB . ALA C 223 ? 0.4705 0.4367 0.4344 0.0224 0.0065 -0.0514 282 ALA C CB 8737 N N . ILE C 224 ? 0.4910 0.4558 0.4657 0.0272 -0.0027 -0.0563 283 ILE C N 8738 C CA . ILE C 224 ? 0.3821 0.3443 0.3568 0.0314 -0.0057 -0.0599 283 ILE C CA 8739 C C . ILE C 224 ? 0.3839 0.3449 0.3519 0.0336 -0.0034 -0.0619 283 ILE C C 8740 O O . ILE C 224 ? 0.3818 0.3470 0.3504 0.0310 -0.0011 -0.0607 283 ILE C O 8741 C CB . ILE C 224 ? 0.4306 0.3968 0.4149 0.0300 -0.0090 -0.0601 283 ILE C CB 8742 C CG1 . ILE C 224 ? 0.3793 0.3460 0.3699 0.0283 -0.0115 -0.0584 283 ILE C CG1 8743 C CG2 . ILE C 224 ? 0.3957 0.3595 0.3798 0.0344 -0.0118 -0.0641 283 ILE C CG2 8744 C CD1 . ILE C 224 ? 0.4598 0.4205 0.4475 0.0323 -0.0141 -0.0602 283 ILE C CD1 8745 N N . CYS C 225 ? 0.5011 0.4564 0.4627 0.0385 -0.0040 -0.0649 284 CYS C N 8746 C CA . CYS C 225 ? 0.3899 0.3433 0.3438 0.0410 -0.0014 -0.0669 284 CYS C CA 8747 C C . CYS C 225 ? 0.5068 0.4569 0.4592 0.0460 -0.0041 -0.0711 284 CYS C C 8748 O O . CYS C 225 ? 0.4284 0.3746 0.3815 0.0493 -0.0072 -0.0728 284 CYS C O 8749 C CB . CYS C 225 ? 0.3914 0.3406 0.3367 0.0422 0.0019 -0.0663 284 CYS C CB 8750 S SG . CYS C 225 ? 0.4538 0.4066 0.3996 0.0366 0.0056 -0.0618 284 CYS C SG 8751 N N . GLY C 226 ? 0.3939 0.3454 0.3439 0.0468 -0.0029 -0.0727 285 GLY C N 8752 C CA . GLY C 226 ? 0.3974 0.3458 0.3450 0.0517 -0.0051 -0.0769 285 GLY C CA 8753 C C . GLY C 226 ? 0.5446 0.4867 0.4817 0.0562 -0.0029 -0.0790 285 GLY C C 8754 O O . GLY C 226 ? 0.4733 0.4133 0.4053 0.0554 0.0000 -0.0772 285 GLY C O 8755 N N . LEU C 227 ? 0.4048 0.3435 0.3383 0.0610 -0.0043 -0.0830 286 LEU C N 8756 C CA . LEU C 227 ? 0.5240 0.4566 0.4472 0.0657 -0.0021 -0.0854 286 LEU C CA 8757 C C . LEU C 227 ? 0.4121 0.3443 0.3307 0.0685 -0.0015 -0.0886 286 LEU C C 8758 O O . LEU C 227 ? 0.4999 0.4277 0.4157 0.0738 -0.0035 -0.0924 286 LEU C O 8759 C CB . LEU C 227 ? 0.4668 0.3930 0.3884 0.0705 -0.0047 -0.0873 286 LEU C CB 8760 C CG . LEU C 227 ? 0.6526 0.5720 0.5641 0.0742 -0.0019 -0.0881 286 LEU C CG 8761 C CD1 . LEU C 227 ? 0.5563 0.4773 0.4655 0.0700 0.0021 -0.0843 286 LEU C CD1 8762 C CD2 . LEU C 227 ? 0.5699 0.4835 0.4810 0.0786 -0.0049 -0.0896 286 LEU C CD2 8763 N N . PRO C 228 ? 0.4086 0.3452 0.3262 0.0652 0.0014 -0.0872 287 PRO C N 8764 C CA . PRO C 228 ? 0.4851 0.4267 0.4053 0.0594 0.0040 -0.0829 287 PRO C CA 8765 C C . PRO C 228 ? 0.4780 0.4267 0.4082 0.0548 0.0022 -0.0808 287 PRO C C 8766 O O . PRO C 228 ? 0.5489 0.5012 0.4833 0.0502 0.0033 -0.0771 287 PRO C O 8767 C CB . PRO C 228 ? 0.4662 0.4075 0.3780 0.0595 0.0082 -0.0831 287 PRO C CB 8768 C CG . PRO C 228 ? 0.4077 0.3479 0.3171 0.0634 0.0068 -0.0870 287 PRO C CG 8769 C CD . PRO C 228 ? 0.4108 0.3465 0.3219 0.0680 0.0029 -0.0901 287 PRO C CD 8770 N N . ASP C 229 ? 0.4621 0.4128 0.3961 0.0560 -0.0004 -0.0831 288 ASP C N 8771 C CA . ASP C 229 ? 0.5344 0.4920 0.4771 0.0517 -0.0015 -0.0812 288 ASP C CA 8772 C C . ASP C 229 ? 0.4365 0.3956 0.3882 0.0525 -0.0062 -0.0828 288 ASP C C 8773 O O . ASP C 229 ? 0.5455 0.5099 0.5042 0.0497 -0.0073 -0.0819 288 ASP C O 8774 C CB . ASP C 229 ? 0.3965 0.3569 0.3356 0.0513 0.0007 -0.0818 288 ASP C CB 8775 C CG . ASP C 229 ? 0.4654 0.4224 0.3997 0.0566 -0.0007 -0.0865 288 ASP C CG 8776 O OD1 . ASP C 229 ? 0.6129 0.5641 0.5437 0.0611 -0.0021 -0.0893 288 ASP C OD1 8777 O OD2 . ASP C 229 ? 0.5944 0.5544 0.5284 0.0563 -0.0003 -0.0875 288 ASP C OD2 8778 N N . MSE C 230 ? 0.4670 0.4211 0.4184 0.0563 -0.0090 -0.0851 289 MSE C N 8779 C CA . MSE C 230 ? 0.4230 0.3782 0.3832 0.0570 -0.0136 -0.0864 289 MSE C CA 8780 C C . MSE C 230 ? 0.4718 0.4260 0.4365 0.0555 -0.0153 -0.0842 289 MSE C C 8781 O O . MSE C 230 ? 0.6378 0.5882 0.5971 0.0563 -0.0136 -0.0833 289 MSE C O 8782 C CB . MSE C 230 ? 0.4038 0.3544 0.3610 0.0631 -0.0164 -0.0914 289 MSE C CB 8783 C CG . MSE C 230 ? 0.8109 0.7543 0.7629 0.0677 -0.0174 -0.0932 289 MSE C CG 8784 SE SE . MSE C 230 ? 0.8457 0.7840 0.7844 0.0691 -0.0120 -0.0922 289 MSE C SE 8785 C CE . MSE C 230 ? 0.5066 0.4455 0.4381 0.0713 -0.0095 -0.0952 289 MSE C CE 8786 N N . LYS C 231 ? 0.6024 0.5604 0.5773 0.0532 -0.0184 -0.0834 290 LYS C N 8787 C CA . LYS C 231 ? 0.3952 0.3526 0.3749 0.0515 -0.0202 -0.0812 290 LYS C CA 8788 C C . LYS C 231 ? 0.4402 0.3988 0.4292 0.0522 -0.0250 -0.0827 290 LYS C C 8789 O O . LYS C 231 ? 0.3927 0.3566 0.3896 0.0492 -0.0260 -0.0819 290 LYS C O 8790 C CB . LYS C 231 ? 0.3997 0.3620 0.3826 0.0456 -0.0174 -0.0765 290 LYS C CB 8791 C CG . LYS C 231 ? 0.3893 0.3520 0.3781 0.0433 -0.0192 -0.0741 290 LYS C CG 8792 C CD . LYS C 231 ? 0.5607 0.5170 0.5440 0.0468 -0.0200 -0.0750 290 LYS C CD 8793 C CE . LYS C 231 ? 0.4183 0.3715 0.3916 0.0475 -0.0158 -0.0742 290 LYS C CE 8794 N NZ . LYS C 231 ? 0.3955 0.3430 0.3643 0.0501 -0.0162 -0.0743 290 LYS C NZ 8795 N N . GLU C 232 ? 0.6028 0.5562 0.5908 0.0562 -0.0280 -0.0848 291 GLU C N 8796 C CA . GLU C 232 ? 0.4250 0.3789 0.4216 0.0571 -0.0329 -0.0862 291 GLU C CA 8797 C C . GLU C 232 ? 0.4206 0.3784 0.4250 0.0520 -0.0333 -0.0822 291 GLU C C 8798 O O . GLU C 232 ? 0.6430 0.6010 0.6446 0.0492 -0.0305 -0.0790 291 GLU C O 8799 C CB . GLU C 232 ? 0.4503 0.3972 0.4429 0.0630 -0.0359 -0.0892 291 GLU C CB 8800 C CG . GLU C 232 ? 0.4032 0.3500 0.4043 0.0643 -0.0412 -0.0909 291 GLU C CG 8801 C CD . GLU C 232 ? 0.5381 0.4777 0.5348 0.0706 -0.0442 -0.0940 291 GLU C CD 8802 O OE1 . GLU C 232 ? 0.6770 0.6124 0.6662 0.0753 -0.0435 -0.0971 291 GLU C OE1 8803 O OE2 . GLU C 232 ? 0.4485 0.3864 0.4490 0.0708 -0.0471 -0.0932 291 GLU C OE2 8804 N N . GLY C 233 ? 0.5304 0.4913 0.5446 0.0507 -0.0368 -0.0825 292 GLY C N 8805 C CA . GLY C 233 ? 0.5660 0.5302 0.5879 0.0463 -0.0377 -0.0792 292 GLY C CA 8806 C C . GLY C 233 ? 0.3906 0.3559 0.4221 0.0468 -0.0425 -0.0807 292 GLY C C 8807 O O . GLY C 233 ? 0.4758 0.4402 0.5088 0.0502 -0.0451 -0.0844 292 GLY C O 8808 N N . SER C 234 ? 0.4990 0.4663 0.5371 0.0436 -0.0437 -0.0780 293 SER C N 8809 C CA . SER C 234 ? 0.3881 0.3572 0.4363 0.0434 -0.0481 -0.0791 293 SER C CA 8810 C C . SER C 234 ? 0.3846 0.3607 0.4413 0.0387 -0.0471 -0.0773 293 SER C C 8811 O O . SER C 234 ? 0.3816 0.3613 0.4384 0.0343 -0.0435 -0.0738 293 SER C O 8812 C CB . SER C 234 ? 0.3878 0.3551 0.4387 0.0425 -0.0502 -0.0772 293 SER C CB 8813 O OG . SER C 234 ? 0.5042 0.4754 0.5574 0.0372 -0.0473 -0.0728 293 SER C OG 8814 N N . VAL C 235 ? 0.3852 0.3630 0.4490 0.0398 -0.0502 -0.0799 294 VAL C N 8815 C CA . VAL C 235 ? 0.3821 0.3665 0.4546 0.0357 -0.0496 -0.0785 294 VAL C CA 8816 C C . VAL C 235 ? 0.4086 0.3946 0.4921 0.0347 -0.0537 -0.0787 294 VAL C C 8817 O O . VAL C 235 ? 0.3839 0.3678 0.4704 0.0383 -0.0578 -0.0823 294 VAL C O 8818 C CB . VAL C 235 ? 0.5432 0.5291 0.6145 0.0375 -0.0490 -0.0812 294 VAL C CB 8819 C CG1 . VAL C 235 ? 0.4929 0.4855 0.5738 0.0333 -0.0486 -0.0797 294 VAL C CG1 8820 C CG2 . VAL C 235 ? 0.3834 0.3679 0.4437 0.0382 -0.0448 -0.0808 294 VAL C CG2 8821 N N . GLN C 236 ? 0.3783 0.3682 0.4680 0.0298 -0.0525 -0.0749 295 GLN C N 8822 C CA . GLN C 236 ? 0.5873 0.5787 0.6872 0.0284 -0.0560 -0.0746 295 GLN C CA 8823 C C . GLN C 236 ? 0.6185 0.6164 0.7281 0.0241 -0.0551 -0.0728 295 GLN C C 8824 O O . GLN C 236 ? 0.4932 0.4947 0.6023 0.0203 -0.0511 -0.0694 295 GLN C O 8825 C CB . GLN C 236 ? 0.3768 0.3664 0.4756 0.0267 -0.0559 -0.0717 295 GLN C CB 8826 C CG . GLN C 236 ? 0.4830 0.4742 0.5921 0.0247 -0.0591 -0.0709 295 GLN C CG 8827 C CD . GLN C 236 ? 0.4861 0.4750 0.5931 0.0236 -0.0592 -0.0683 295 GLN C CD 8828 O OE1 . GLN C 236 ? 0.4834 0.4755 0.5928 0.0192 -0.0566 -0.0646 295 GLN C OE1 8829 N NE2 . GLN C 236 ? 0.5232 0.5066 0.6256 0.0276 -0.0621 -0.0703 295 GLN C NE2 8830 N N . VAL C 237 ? 0.3750 0.3744 0.4936 0.0248 -0.0587 -0.0751 296 VAL C N 8831 C CA . VAL C 237 ? 0.4562 0.4618 0.5849 0.0210 -0.0581 -0.0736 296 VAL C CA 8832 C C . VAL C 237 ? 0.4884 0.4970 0.6216 0.0160 -0.0560 -0.0690 296 VAL C C 8833 O O . VAL C 237 ? 0.4919 0.4981 0.6256 0.0158 -0.0575 -0.0680 296 VAL C O 8834 C CB . VAL C 237 ? 0.6082 0.6144 0.7464 0.0227 -0.0628 -0.0769 296 VAL C CB 8835 C CG1 . VAL C 237 ? 0.3784 0.3817 0.5206 0.0236 -0.0667 -0.0773 296 VAL C CG1 8836 C CG2 . VAL C 237 ? 0.3708 0.3834 0.5193 0.0188 -0.0618 -0.0754 296 VAL C CG2 8837 N N . PHE C 238 ? 0.6021 0.6157 0.7381 0.0122 -0.0524 -0.0661 297 PHE C N 8838 C CA . PHE C 238 ? 0.4644 0.4812 0.6050 0.0075 -0.0501 -0.0617 297 PHE C CA 8839 C C . PHE C 238 ? 0.4466 0.4647 0.5983 0.0062 -0.0535 -0.0618 297 PHE C C 8840 O O . PHE C 238 ? 0.5826 0.6019 0.7414 0.0074 -0.0565 -0.0644 297 PHE C O 8841 C CB . PHE C 238 ? 0.3688 0.3909 0.5110 0.0041 -0.0459 -0.0590 297 PHE C CB 8842 C CG . PHE C 238 ? 0.5075 0.5300 0.6434 0.0016 -0.0415 -0.0551 297 PHE C CG 8843 C CD1 . PHE C 238 ? 0.4996 0.5188 0.6241 0.0035 -0.0396 -0.0555 297 PHE C CD1 8844 C CD2 . PHE C 238 ? 0.3883 0.4145 0.5298 -0.0027 -0.0392 -0.0512 297 PHE C CD2 8845 C CE1 . PHE C 238 ? 0.4826 0.5022 0.6016 0.0012 -0.0357 -0.0521 297 PHE C CE1 8846 C CE2 . PHE C 238 ? 0.4920 0.5186 0.6277 -0.0049 -0.0353 -0.0478 297 PHE C CE2 8847 C CZ . PHE C 238 ? 0.3841 0.4075 0.5087 -0.0030 -0.0336 -0.0483 297 PHE C CZ 8848 N N . LEU C 239 ? 0.5112 0.5292 0.6645 0.0037 -0.0530 -0.0589 298 LEU C N 8849 C CA . LEU C 239 ? 0.6151 0.6349 0.7791 0.0017 -0.0555 -0.0582 298 LEU C CA 8850 C C . LEU C 239 ? 0.4520 0.4779 0.6250 -0.0019 -0.0533 -0.0562 298 LEU C C 8851 O O . LEU C 239 ? 0.5280 0.5565 0.6978 -0.0038 -0.0491 -0.0539 298 LEU C O 8852 C CB . LEU C 239 ? 0.5806 0.5988 0.7432 -0.0001 -0.0550 -0.0554 298 LEU C CB 8853 C CG . LEU C 239 ? 0.6000 0.6123 0.7568 0.0034 -0.0583 -0.0574 298 LEU C CG 8854 C CD1 . LEU C 239 ? 0.5212 0.5323 0.6754 0.0013 -0.0571 -0.0543 298 LEU C CD1 8855 C CD2 . LEU C 239 ? 0.5535 0.5644 0.7176 0.0059 -0.0637 -0.0608 298 LEU C CD2 8856 N N . PRO C 240 ? 0.5090 0.5369 0.6931 -0.0028 -0.0561 -0.0570 299 PRO C N 8857 C CA . PRO C 240 ? 0.4809 0.5145 0.6741 -0.0063 -0.0540 -0.0549 299 PRO C CA 8858 C C . PRO C 240 ? 0.5030 0.5391 0.6960 -0.0104 -0.0497 -0.0501 299 PRO C C 8859 O O . PRO C 240 ? 0.7131 0.7466 0.9020 -0.0109 -0.0495 -0.0486 299 PRO C O 8860 C CB . PRO C 240 ? 0.5347 0.5691 0.7394 -0.0064 -0.0582 -0.0566 299 PRO C CB 8861 C CG . PRO C 240 ? 0.6921 0.7214 0.8936 -0.0040 -0.0617 -0.0582 299 PRO C CG 8862 C CD . PRO C 240 ? 0.6306 0.6557 0.8195 -0.0006 -0.0613 -0.0598 299 PRO C CD 8863 N N . ASP C 241 ? 0.5462 0.5869 0.7430 -0.0132 -0.0463 -0.0477 300 ASP C N 8864 C CA . ASP C 241 ? 0.5207 0.5638 0.7168 -0.0168 -0.0419 -0.0431 300 ASP C CA 8865 C C . ASP C 241 ? 0.7097 0.7526 0.9118 -0.0190 -0.0428 -0.0413 300 ASP C C 8866 O O . ASP C 241 ? 0.6853 0.7289 0.8966 -0.0191 -0.0459 -0.0426 300 ASP C O 8867 C CB . ASP C 241 ? 0.7662 0.8145 0.9674 -0.0191 -0.0388 -0.0411 300 ASP C CB 8868 C CG . ASP C 241 ? 1.0552 1.1055 1.2531 -0.0220 -0.0338 -0.0367 300 ASP C CG 8869 O OD1 . ASP C 241 ? 1.1951 1.2444 1.3834 -0.0212 -0.0313 -0.0361 300 ASP C OD1 8870 O OD2 . ASP C 241 ? 1.2141 1.2669 1.4190 -0.0249 -0.0324 -0.0338 300 ASP C OD2 8871 N N . GLU C 242 ? 0.6209 0.6629 0.8177 -0.0206 -0.0401 -0.0383 301 GLU C N 8872 C CA . GLU C 242 ? 0.7306 0.7721 0.9315 -0.0226 -0.0407 -0.0365 301 GLU C CA 8873 C C . GLU C 242 ? 0.9024 0.9483 1.1147 -0.0258 -0.0395 -0.0343 301 GLU C C 8874 O O . GLU C 242 ? 1.0240 1.0697 1.2431 -0.0268 -0.0416 -0.0341 301 GLU C O 8875 C CB . GLU C 242 ? 0.8903 0.9301 1.0824 -0.0236 -0.0378 -0.0339 301 GLU C CB 8876 C CG . GLU C 242 ? 0.9553 0.9898 1.1381 -0.0206 -0.0400 -0.0360 301 GLU C CG 8877 C CD . GLU C 242 ? 1.0414 1.0740 1.2194 -0.0219 -0.0386 -0.0335 301 GLU C CD 8878 O OE1 . GLU C 242 ? 1.0335 1.0629 1.2111 -0.0207 -0.0418 -0.0346 301 GLU C OE1 8879 O OE2 . GLU C 242 ? 1.1763 1.2106 1.3507 -0.0240 -0.0344 -0.0306 301 GLU C OE2 8880 N N . SER C 243 ? 1.0416 1.0915 1.2560 -0.0274 -0.0361 -0.0324 302 SER C N 8881 C CA . SER C 243 ? 0.9436 0.9978 1.1687 -0.0304 -0.0345 -0.0301 302 SER C CA 8882 C C . SER C 243 ? 0.6941 0.7490 0.9296 -0.0297 -0.0386 -0.0328 302 SER C C 8883 O O . SER C 243 ? 0.7040 0.7607 0.9490 -0.0318 -0.0389 -0.0316 302 SER C O 8884 C CB . SER C 243 ? 0.9926 1.0506 1.2175 -0.0316 -0.0304 -0.0280 302 SER C CB 8885 O OG . SER C 243 ? 1.0938 1.1513 1.3095 -0.0322 -0.0266 -0.0254 302 SER C OG 8886 N N . ALA C 244 ? 0.6443 0.6977 0.8781 -0.0267 -0.0417 -0.0366 303 ALA C N 8887 C CA . ALA C 244 ? 0.5479 0.6016 0.7909 -0.0255 -0.0460 -0.0398 303 ALA C CA 8888 C C . ALA C 244 ? 0.6328 0.6823 0.8752 -0.0238 -0.0503 -0.0420 303 ALA C C 8889 O O . ALA C 244 ? 0.7348 0.7847 0.9864 -0.0247 -0.0528 -0.0424 303 ALA C O 8890 C CB . ALA C 244 ? 0.5283 0.5825 0.7698 -0.0229 -0.0473 -0.0430 303 ALA C CB 8891 N N . VAL C 245 ? 0.7314 0.7766 0.9630 -0.0212 -0.0512 -0.0433 304 VAL C N 8892 C CA . VAL C 245 ? 0.6792 0.7200 0.9088 -0.0191 -0.0553 -0.0453 304 VAL C CA 8893 C C . VAL C 245 ? 0.7837 0.8217 1.0044 -0.0198 -0.0533 -0.0428 304 VAL C C 8894 O O . VAL C 245 ? 0.8741 0.9092 1.0842 -0.0177 -0.0527 -0.0435 304 VAL C O 8895 C CB . VAL C 245 ? 0.5470 0.5842 0.7716 -0.0146 -0.0590 -0.0498 304 VAL C CB 8896 C CG1 . VAL C 245 ? 0.6114 0.6441 0.8355 -0.0122 -0.0636 -0.0520 304 VAL C CG1 8897 C CG2 . VAL C 245 ? 0.5896 0.6297 0.8219 -0.0138 -0.0605 -0.0524 304 VAL C CG2 8898 N N . PRO C 246 ? 0.7780 0.8171 1.0030 -0.0228 -0.0521 -0.0399 305 PRO C N 8899 C CA . PRO C 246 ? 0.8760 0.9131 1.0935 -0.0238 -0.0501 -0.0374 305 PRO C CA 8900 C C . PRO C 246 ? 0.7372 0.7688 0.9478 -0.0208 -0.0537 -0.0395 305 PRO C C 8901 O O . PRO C 246 ? 0.4754 0.5051 0.6899 -0.0185 -0.0583 -0.0426 305 PRO C O 8902 C CB . PRO C 246 ? 0.7416 0.7810 0.9675 -0.0273 -0.0490 -0.0346 305 PRO C CB 8903 C CG . PRO C 246 ? 0.7401 0.7839 0.9770 -0.0287 -0.0487 -0.0347 305 PRO C CG 8904 C CD . PRO C 246 ? 0.6227 0.6652 0.8602 -0.0254 -0.0525 -0.0389 305 PRO C CD 8905 N N . ARG C 247 ? 0.7387 0.7679 0.9396 -0.0207 -0.0518 -0.0380 306 ARG C N 8906 C CA . ARG C 247 ? 0.6711 0.6951 0.8650 -0.0177 -0.0550 -0.0398 306 ARG C CA 8907 C C . ARG C 247 ? 0.5677 0.5902 0.7575 -0.0195 -0.0536 -0.0370 306 ARG C C 8908 O O . ARG C 247 ? 0.5874 0.6125 0.7765 -0.0225 -0.0494 -0.0338 306 ARG C O 8909 C CB . ARG C 247 ? 0.7040 0.7252 0.8876 -0.0145 -0.0546 -0.0417 306 ARG C CB 8910 C CG . ARG C 247 ? 0.7128 0.7335 0.8980 -0.0114 -0.0573 -0.0455 306 ARG C CG 8911 C CD . ARG C 247 ? 0.5130 0.5302 0.6867 -0.0081 -0.0568 -0.0471 306 ARG C CD 8912 N NE . ARG C 247 ? 0.6666 0.6849 0.8330 -0.0100 -0.0518 -0.0442 306 ARG C NE 8913 C CZ . ARG C 247 ? 0.7248 0.7459 0.8897 -0.0107 -0.0485 -0.0437 306 ARG C CZ 8914 N NH1 . ARG C 247 ? 1.0609 1.0841 1.2308 -0.0098 -0.0495 -0.0458 306 ARG C NH1 8915 N NH2 . ARG C 247 ? 0.6818 0.7036 0.8401 -0.0123 -0.0442 -0.0411 306 ARG C NH2 8916 N N . LYS C 248 ? 0.5595 0.5777 0.7464 -0.0174 -0.0572 -0.0383 307 LYS C N 8917 C CA . LYS C 248 ? 0.6505 0.6669 0.8328 -0.0187 -0.0564 -0.0359 307 LYS C CA 8918 C C . LYS C 248 ? 0.6126 0.6245 0.7829 -0.0159 -0.0566 -0.0366 307 LYS C C 8919 O O . LYS C 248 ? 0.6399 0.6486 0.8068 -0.0122 -0.0595 -0.0396 307 LYS C O 8920 C CB . LYS C 248 ? 0.6958 0.7111 0.8848 -0.0190 -0.0602 -0.0362 307 LYS C CB 8921 C CG . LYS C 248 ? 0.9429 0.9626 1.1426 -0.0227 -0.0588 -0.0342 307 LYS C CG 8922 C CD . LYS C 248 ? 0.9978 1.0199 1.1947 -0.0261 -0.0535 -0.0304 307 LYS C CD 8923 C CE . LYS C 248 ? 1.0051 1.0313 1.2124 -0.0297 -0.0517 -0.0283 307 LYS C CE 8924 N NZ . LYS C 248 ? 0.9630 0.9914 1.1673 -0.0326 -0.0465 -0.0246 307 LYS C NZ 8925 N N . HIS C 249 ? 0.6224 0.6340 0.7864 -0.0177 -0.0533 -0.0339 308 HIS C N 8926 C CA . HIS C 249 ? 0.7715 0.7790 0.9242 -0.0154 -0.0531 -0.0341 308 HIS C CA 8927 C C . HIS C 249 ? 0.7638 0.7688 0.9137 -0.0159 -0.0543 -0.0326 308 HIS C C 8928 O O . HIS C 249 ? 0.7900 0.7968 0.9399 -0.0190 -0.0513 -0.0297 308 HIS C O 8929 C CB . HIS C 249 ? 0.8117 0.8210 0.9581 -0.0167 -0.0479 -0.0324 308 HIS C CB 8930 C CG . HIS C 249 ? 1.2151 1.2205 1.3506 -0.0138 -0.0476 -0.0334 308 HIS C CG 8931 N ND1 . HIS C 249 ? 1.3871 1.3899 1.5196 -0.0101 -0.0499 -0.0366 308 HIS C ND1 8932 C CD2 . HIS C 249 ? 1.3250 1.3286 1.4517 -0.0141 -0.0451 -0.0318 308 HIS C CD2 8933 C CE1 . HIS C 249 ? 1.4465 1.4460 1.5690 -0.0082 -0.0487 -0.0367 308 HIS C CE1 8934 N NE2 . HIS C 249 ? 1.3460 1.3460 1.4649 -0.0106 -0.0459 -0.0339 308 HIS C NE2 8935 N N . ASN C 250 ? 0.7053 0.7058 0.8526 -0.0127 -0.0586 -0.0347 309 ASN C N 8936 C CA . ASN C 250 ? 0.6731 0.6708 0.8182 -0.0128 -0.0605 -0.0335 309 ASN C CA 8937 C C . ASN C 250 ? 0.6041 0.5970 0.7381 -0.0100 -0.0612 -0.0339 309 ASN C C 8938 O O . ASN C 250 ? 0.7636 0.7533 0.8937 -0.0062 -0.0634 -0.0365 309 ASN C O 8939 C CB . ASN C 250 ? 0.6391 0.6358 0.7920 -0.0118 -0.0656 -0.0352 309 ASN C CB 8940 C CG . ASN C 250 ? 0.7447 0.7461 0.9089 -0.0150 -0.0650 -0.0343 309 ASN C CG 8941 O OD1 . ASN C 250 ? 0.8508 0.8535 1.0223 -0.0141 -0.0672 -0.0365 309 ASN C OD1 8942 N ND2 . ASN C 250 ? 0.6649 0.6688 0.8307 -0.0187 -0.0618 -0.0312 309 ASN C ND2 8943 N N . ARG C 251 ? 0.5798 0.5721 0.7088 -0.0117 -0.0591 -0.0313 310 ARG C N 8944 C CA . ARG C 251 ? 0.5724 0.5602 0.6912 -0.0094 -0.0596 -0.0313 310 ARG C CA 8945 C C . ARG C 251 ? 0.5319 0.5151 0.6503 -0.0059 -0.0652 -0.0332 310 ARG C C 8946 O O . ARG C 251 ? 0.4785 0.4620 0.6033 -0.0066 -0.0681 -0.0332 310 ARG C O 8947 C CB . ARG C 251 ? 0.6427 0.6313 0.7575 -0.0123 -0.0565 -0.0281 310 ARG C CB 8948 C CG . ARG C 251 ? 0.9800 0.9642 1.0843 -0.0102 -0.0566 -0.0278 310 ARG C CG 8949 C CD . ARG C 251 ? 1.0752 1.0604 1.1765 -0.0132 -0.0541 -0.0248 310 ARG C CD 8950 N NE . ARG C 251 ? 1.1098 1.0994 1.2121 -0.0166 -0.0489 -0.0229 310 ARG C NE 8951 C CZ . ARG C 251 ? 1.0621 1.0534 1.1628 -0.0195 -0.0460 -0.0203 310 ARG C CZ 8952 N NH1 . ARG C 251 ? 0.9933 0.9823 1.0914 -0.0196 -0.0477 -0.0193 310 ARG C NH1 8953 N NH2 . ARG C 251 ? 0.9883 0.9835 1.0900 -0.0222 -0.0414 -0.0188 310 ARG C NH2 8954 N N . SER C 252 ? 0.5920 0.5708 0.7028 -0.0019 -0.0666 -0.0350 311 SER C N 8955 C CA . SER C 252 ? 0.5623 0.5363 0.6717 0.0021 -0.0719 -0.0369 311 SER C CA 8956 C C . SER C 252 ? 0.6030 0.5744 0.7079 0.0017 -0.0729 -0.0348 311 SER C C 8957 O O . SER C 252 ? 0.4395 0.4108 0.5376 0.0003 -0.0695 -0.0328 311 SER C O 8958 C CB . SER C 252 ? 0.5182 0.4882 0.6207 0.0067 -0.0728 -0.0393 311 SER C CB 8959 O OG . SER C 252 ? 0.3741 0.3391 0.4749 0.0109 -0.0779 -0.0412 311 SER C OG 8960 N N . PRO C 253 ? 0.5417 0.5111 0.6503 0.0029 -0.0776 -0.0355 312 PRO C N 8961 C CA . PRO C 253 ? 0.5127 0.4791 0.6164 0.0032 -0.0792 -0.0338 312 PRO C CA 8962 C C . PRO C 253 ? 0.7183 0.6793 0.8115 0.0073 -0.0800 -0.0345 312 PRO C C 8963 O O . PRO C 253 ? 0.4937 0.4524 0.5806 0.0073 -0.0800 -0.0327 312 PRO C O 8964 C CB . PRO C 253 ? 0.3725 0.3379 0.4835 0.0041 -0.0845 -0.0349 312 PRO C CB 8965 C CG . PRO C 253 ? 0.6133 0.5827 0.7343 0.0027 -0.0844 -0.0363 312 PRO C CG 8966 C CD . PRO C 253 ? 0.5362 0.5063 0.6542 0.0038 -0.0815 -0.0376 312 PRO C CD 8967 N N . TYR C 254 ? 0.4221 0.3812 0.5135 0.0108 -0.0807 -0.0370 313 TYR C N 8968 C CA . TYR C 254 ? 0.4622 0.4163 0.5437 0.0149 -0.0811 -0.0378 313 TYR C CA 8969 C C . TYR C 254 ? 0.4312 0.3868 0.5077 0.0141 -0.0760 -0.0375 313 TYR C C 8970 O O . TYR C 254 ? 0.4627 0.4148 0.5329 0.0177 -0.0759 -0.0391 313 TYR C O 8971 C CB . TYR C 254 ? 0.3807 0.3306 0.4628 0.0202 -0.0860 -0.0411 313 TYR C CB 8972 C CG . TYR C 254 ? 0.7476 0.6945 0.8317 0.0220 -0.0913 -0.0413 313 TYR C CG 8973 C CD1 . TYR C 254 ? 0.5861 0.5354 0.6802 0.0205 -0.0942 -0.0419 313 TYR C CD1 8974 C CD2 . TYR C 254 ? 0.3847 0.3263 0.4609 0.0253 -0.0935 -0.0408 313 TYR C CD2 8975 C CE1 . TYR C 254 ? 0.5117 0.4582 0.6076 0.0222 -0.0992 -0.0420 313 TYR C CE1 8976 C CE2 . TYR C 254 ? 0.6395 0.5781 0.7172 0.0271 -0.0984 -0.0408 313 TYR C CE2 8977 C CZ . TYR C 254 ? 0.6176 0.5587 0.7052 0.0255 -0.1013 -0.0414 313 TYR C CZ 8978 O OH . TYR C 254 ? 0.4983 0.4365 0.5874 0.0273 -0.1064 -0.0415 313 TYR C OH 8979 N N . ARG C 255 ? 0.5397 0.5003 0.6188 0.0093 -0.0717 -0.0355 314 ARG C N 8980 C CA . ARG C 255 ? 0.4796 0.4418 0.5536 0.0080 -0.0666 -0.0346 314 ARG C CA 8981 C C . ARG C 255 ? 0.5369 0.4950 0.6006 0.0098 -0.0655 -0.0336 314 ARG C C 8982 O O . ARG C 255 ? 0.6358 0.5923 0.6971 0.0093 -0.0668 -0.0320 314 ARG C O 8983 C CB . ARG C 255 ? 0.5038 0.4717 0.5821 0.0027 -0.0624 -0.0322 314 ARG C CB 8984 C CG . ARG C 255 ? 0.6835 0.6533 0.7566 0.0011 -0.0571 -0.0311 314 ARG C CG 8985 C CD . ARG C 255 ? 0.8780 0.8531 0.9554 -0.0039 -0.0533 -0.0286 314 ARG C CD 8986 N NE . ARG C 255 ? 0.9013 0.8783 0.9741 -0.0055 -0.0483 -0.0275 314 ARG C NE 8987 C CZ . ARG C 255 ? 0.9883 0.9678 1.0627 -0.0058 -0.0460 -0.0283 314 ARG C CZ 8988 N NH1 . ARG C 255 ? 0.9581 0.9386 1.0389 -0.0048 -0.0481 -0.0303 314 ARG C NH1 8989 N NH2 . ARG C 255 ? 1.0848 1.0658 1.1545 -0.0072 -0.0415 -0.0272 314 ARG C NH2 8990 N N . ARG C 256 ? 0.5454 0.5019 0.6028 0.0118 -0.0632 -0.0345 315 ARG C N 8991 C CA . ARG C 256 ? 0.5777 0.5306 0.6254 0.0133 -0.0618 -0.0335 315 ARG C CA 8992 C C . ARG C 256 ? 0.4422 0.3984 0.4877 0.0090 -0.0571 -0.0307 315 ARG C C 8993 O O . ARG C 256 ? 0.4605 0.4217 0.5117 0.0051 -0.0547 -0.0296 315 ARG C O 8994 C CB . ARG C 256 ? 0.4365 0.3859 0.4780 0.0172 -0.0610 -0.0356 315 ARG C CB 8995 C CG . ARG C 256 ? 0.5378 0.4824 0.5789 0.0226 -0.0659 -0.0383 315 ARG C CG 8996 C CD . ARG C 256 ? 0.4235 0.3655 0.4595 0.0262 -0.0646 -0.0406 315 ARG C CD 8997 N NE . ARG C 256 ? 0.5248 0.4602 0.5538 0.0313 -0.0671 -0.0417 315 ARG C NE 8998 C CZ . ARG C 256 ? 0.4477 0.3793 0.4777 0.0359 -0.0717 -0.0442 315 ARG C CZ 8999 N NH1 . ARG C 256 ? 0.5836 0.5174 0.6216 0.0359 -0.0743 -0.0460 315 ARG C NH1 9000 N NH2 . ARG C 256 ? 0.6095 0.5351 0.6325 0.0407 -0.0736 -0.0448 315 ARG C NH2 9001 N N . THR C 257 ? 0.4594 0.4128 0.4967 0.0098 -0.0556 -0.0295 316 THR C N 9002 C CA . THR C 257 ? 0.4637 0.4197 0.4984 0.0061 -0.0516 -0.0269 316 THR C CA 9003 C C . THR C 257 ? 0.6174 0.5763 0.6504 0.0043 -0.0467 -0.0267 316 THR C C 9004 O O . THR C 257 ? 0.5601 0.5230 0.5945 0.0004 -0.0432 -0.0248 316 THR C O 9005 C CB . THR C 257 ? 0.3707 0.3224 0.3972 0.0077 -0.0522 -0.0257 316 THR C CB 9006 O OG1 . THR C 257 ? 0.8311 0.7850 0.8586 0.0043 -0.0516 -0.0233 316 THR C OG1 9007 C CG2 . THR C 257 ? 0.6113 0.5616 0.6300 0.0086 -0.0484 -0.0256 316 THR C CG2 9008 N N . TYR C 258 ? 0.5109 0.4676 0.5407 0.0074 -0.0463 -0.0287 317 TYR C N 9009 C CA . TYR C 258 ? 0.5841 0.5428 0.6115 0.0063 -0.0418 -0.0288 317 TYR C CA 9010 C C . TYR C 258 ? 0.5163 0.4754 0.5375 0.0043 -0.0379 -0.0266 317 TYR C C 9011 O O . TYR C 258 ? 0.6261 0.5892 0.6483 0.0011 -0.0340 -0.0254 317 TYR C O 9012 C CB . TYR C 258 ? 0.3777 0.3420 0.4129 0.0031 -0.0403 -0.0287 317 TYR C CB 9013 C CG . TYR C 258 ? 0.5996 0.5636 0.6402 0.0054 -0.0435 -0.0312 317 TYR C CG 9014 C CD1 . TYR C 258 ? 0.4764 0.4403 0.5158 0.0071 -0.0423 -0.0331 317 TYR C CD1 9015 C CD2 . TYR C 258 ? 0.4107 0.3743 0.4572 0.0060 -0.0478 -0.0318 317 TYR C CD2 9016 C CE1 . TYR C 258 ? 0.4789 0.4426 0.5231 0.0093 -0.0452 -0.0356 317 TYR C CE1 9017 C CE2 . TYR C 258 ? 0.4517 0.4149 0.5032 0.0082 -0.0509 -0.0343 317 TYR C CE2 9018 C CZ . TYR C 258 ? 0.4787 0.4420 0.5290 0.0098 -0.0495 -0.0362 317 TYR C CZ 9019 O OH . TYR C 258 ? 0.4404 0.4035 0.4956 0.0121 -0.0525 -0.0389 317 TYR C OH 9020 N N . SER C 259 ? 0.4325 0.3874 0.4475 0.0063 -0.0390 -0.0262 318 SER C N 9021 C CA . SER C 259 ? 0.5855 0.5400 0.5939 0.0050 -0.0357 -0.0244 318 SER C CA 9022 C C . SER C 259 ? 0.6098 0.5584 0.6103 0.0092 -0.0368 -0.0251 318 SER C C 9023 O O . SER C 259 ? 0.5481 0.4929 0.5482 0.0124 -0.0409 -0.0261 318 SER C O 9024 C CB . SER C 259 ? 0.6098 0.5665 0.6198 0.0017 -0.0355 -0.0220 318 SER C CB 9025 O OG . SER C 259 ? 0.5765 0.5311 0.5794 0.0018 -0.0339 -0.0207 318 SER C OG 9026 N N . LYS C 260 ? 0.5216 0.4694 0.5159 0.0092 -0.0331 -0.0247 319 LYS C N 9027 C CA . LYS C 260 ? 0.6178 0.5600 0.6043 0.0130 -0.0337 -0.0252 319 LYS C CA 9028 C C . LYS C 260 ? 0.6160 0.5566 0.5984 0.0124 -0.0340 -0.0231 319 LYS C C 9029 O O . LYS C 260 ? 0.7116 0.6472 0.6882 0.0157 -0.0354 -0.0233 319 LYS C O 9030 C CB . LYS C 260 ? 0.4819 0.4233 0.4635 0.0138 -0.0297 -0.0259 319 LYS C CB 9031 C CG . LYS C 260 ? 0.6851 0.6311 0.6667 0.0096 -0.0250 -0.0243 319 LYS C CG 9032 C CD . LYS C 260 ? 0.6352 0.5807 0.6129 0.0106 -0.0215 -0.0254 319 LYS C CD 9033 C CE . LYS C 260 ? 0.7125 0.6622 0.6899 0.0066 -0.0170 -0.0239 319 LYS C CE 9034 N NZ . LYS C 260 ? 0.8888 0.8380 0.8624 0.0052 -0.0158 -0.0219 319 LYS C NZ 9035 N N . LYS C 261 ? 0.5822 0.5269 0.5674 0.0082 -0.0326 -0.0212 320 LYS C N 9036 C CA . LYS C 261 ? 0.7569 0.7005 0.7387 0.0073 -0.0331 -0.0193 320 LYS C CA 9037 C C . LYS C 261 ? 0.6662 0.6079 0.6505 0.0086 -0.0381 -0.0192 320 LYS C C 9038 O O . LYS C 261 ? 0.7940 0.7308 0.7736 0.0119 -0.0407 -0.0192 320 LYS C O 9039 C CB . LYS C 261 ? 0.7979 0.7466 0.7815 0.0025 -0.0297 -0.0174 320 LYS C CB 9040 C CG . LYS C 261 ? 1.0682 1.0168 1.0456 0.0016 -0.0255 -0.0165 320 LYS C CG 9041 C CD . LYS C 261 ? 1.1301 1.0780 1.1053 0.0030 -0.0228 -0.0179 320 LYS C CD 9042 C CE . LYS C 261 ? 0.9719 0.9197 0.9411 0.0020 -0.0188 -0.0170 320 LYS C CE 9043 N NZ . LYS C 261 ? 0.9808 0.9277 0.9473 0.0034 -0.0161 -0.0183 320 LYS C NZ 9044 N N . ASN C 262 ? 0.6680 0.6133 0.6596 0.0061 -0.0394 -0.0189 321 ASN C N 9045 C CA . ASN C 262 ? 0.7069 0.6506 0.7016 0.0073 -0.0442 -0.0190 321 ASN C CA 9046 C C . ASN C 262 ? 0.4987 0.4409 0.4974 0.0103 -0.0473 -0.0213 321 ASN C C 9047 O O . ASN C 262 ? 0.6571 0.6029 0.6629 0.0084 -0.0474 -0.0220 321 ASN C O 9048 C CB . ASN C 262 ? 0.7193 0.6675 0.7197 0.0031 -0.0440 -0.0174 321 ASN C CB 9049 C CG . ASN C 262 ? 0.9202 0.8708 0.9173 -0.0003 -0.0402 -0.0153 321 ASN C CG 9050 O OD1 . ASN C 262 ? 1.0771 1.0251 1.0670 0.0008 -0.0390 -0.0147 321 ASN C OD1 9051 N ND2 . ASN C 262 ? 0.8574 0.8130 0.8597 -0.0043 -0.0382 -0.0143 321 ASN C ND2 9052 N N . GLN C 263 ? 0.5624 0.4993 0.5567 0.0150 -0.0499 -0.0226 322 GLN C N 9053 C CA . GLN C 263 ? 0.5358 0.4708 0.5329 0.0183 -0.0524 -0.0252 322 GLN C CA 9054 C C . GLN C 263 ? 0.5831 0.5165 0.5849 0.0202 -0.0578 -0.0261 322 GLN C C 9055 O O . GLN C 263 ? 0.4940 0.4256 0.4981 0.0234 -0.0604 -0.0284 322 GLN C O 9056 C CB . GLN C 263 ? 0.3959 0.3258 0.3857 0.0229 -0.0520 -0.0265 322 GLN C CB 9057 C CG . GLN C 263 ? 0.4880 0.4191 0.4733 0.0215 -0.0467 -0.0261 322 GLN C CG 9058 C CD . GLN C 263 ? 0.3972 0.3228 0.3749 0.0261 -0.0463 -0.0272 322 GLN C CD 9059 O OE1 . GLN C 263 ? 0.3856 0.3067 0.3621 0.0306 -0.0498 -0.0288 322 GLN C OE1 9060 N NE2 . GLN C 263 ? 0.5035 0.4294 0.4762 0.0251 -0.0419 -0.0264 322 GLN C NE2 9061 N N . VAL C 264 ? 0.5369 0.4710 0.5401 0.0184 -0.0597 -0.0244 323 VAL C N 9062 C CA . VAL C 264 ? 0.3998 0.3319 0.4069 0.0204 -0.0651 -0.0251 323 VAL C CA 9063 C C . VAL C 264 ? 0.4594 0.3962 0.4748 0.0163 -0.0658 -0.0243 323 VAL C C 9064 O O . VAL C 264 ? 0.6947 0.6335 0.7099 0.0131 -0.0647 -0.0221 323 VAL C O 9065 C CB . VAL C 264 ? 0.5535 0.4807 0.5541 0.0230 -0.0678 -0.0238 323 VAL C CB 9066 C CG1 . VAL C 264 ? 0.3840 0.3092 0.3888 0.0251 -0.0736 -0.0245 323 VAL C CG1 9067 C CG2 . VAL C 264 ? 0.3849 0.3070 0.3773 0.0274 -0.0673 -0.0246 323 VAL C CG2 9068 N N . ALA C 265 ? 0.5469 0.4855 0.5697 0.0165 -0.0675 -0.0261 324 ALA C N 9069 C CA . ALA C 265 ? 0.5845 0.5273 0.6160 0.0131 -0.0686 -0.0256 324 ALA C CA 9070 C C . ALA C 265 ? 0.5102 0.4502 0.5427 0.0146 -0.0736 -0.0252 324 ALA C C 9071 O O . ALA C 265 ? 0.6319 0.5667 0.6595 0.0189 -0.0768 -0.0260 324 ALA C O 9072 C CB . ALA C 265 ? 0.3868 0.3320 0.4258 0.0132 -0.0691 -0.0278 324 ALA C CB 9073 N N . GLU C 266 ? 0.3760 0.3193 0.4146 0.0111 -0.0741 -0.0240 325 GLU C N 9074 C CA . GLU C 266 ? 0.5195 0.4607 0.5595 0.0119 -0.0787 -0.0235 325 GLU C CA 9075 C C . GLU C 266 ? 0.6047 0.5420 0.6469 0.0167 -0.0841 -0.0259 325 GLU C C 9076 O O . GLU C 266 ? 0.4783 0.4112 0.5167 0.0197 -0.0880 -0.0258 325 GLU C O 9077 C CB . GLU C 266 ? 0.5860 0.5319 0.6339 0.0074 -0.0782 -0.0222 325 GLU C CB 9078 C CG . GLU C 266 ? 0.7640 0.7080 0.8140 0.0080 -0.0829 -0.0217 325 GLU C CG 9079 C CD . GLU C 266 ? 0.8964 0.8451 0.9537 0.0033 -0.0819 -0.0203 325 GLU C CD 9080 O OE1 . GLU C 266 ? 0.9288 0.8819 0.9887 -0.0003 -0.0774 -0.0195 325 GLU C OE1 9081 O OE2 . GLU C 266 ? 0.9050 0.8526 0.9651 0.0034 -0.0857 -0.0199 325 GLU C OE2 9082 N N . TRP C 267 ? 0.5930 0.5319 0.6411 0.0173 -0.0845 -0.0282 326 TRP C N 9083 C CA . TRP C 267 ? 0.5055 0.4411 0.5566 0.0218 -0.0896 -0.0309 326 TRP C CA 9084 C C . TRP C 267 ? 0.5442 0.4739 0.5869 0.0272 -0.0909 -0.0322 326 TRP C C 9085 O O . TRP C 267 ? 0.3893 0.3151 0.4326 0.0317 -0.0956 -0.0341 326 TRP C O 9086 C CB . TRP C 267 ? 0.4157 0.3548 0.4752 0.0209 -0.0892 -0.0330 326 TRP C CB 9087 C CG . TRP C 267 ? 0.5649 0.5059 0.6223 0.0203 -0.0846 -0.0337 326 TRP C CG 9088 C CD1 . TRP C 267 ? 0.5991 0.5451 0.6581 0.0158 -0.0795 -0.0322 326 TRP C CD1 9089 C CD2 . TRP C 267 ? 0.4597 0.3977 0.5130 0.0245 -0.0847 -0.0361 326 TRP C CD2 9090 N NE1 . TRP C 267 ? 0.5903 0.5366 0.6464 0.0168 -0.0765 -0.0334 326 TRP C NE1 9091 C CE2 . TRP C 267 ? 0.5742 0.5156 0.6268 0.0221 -0.0795 -0.0358 326 TRP C CE2 9092 C CE3 . TRP C 267 ? 0.4628 0.3953 0.5128 0.0303 -0.0886 -0.0384 326 TRP C CE3 9093 C CZ2 . TRP C 267 ? 0.3830 0.3226 0.4315 0.0251 -0.0781 -0.0378 326 TRP C CZ2 9094 C CZ3 . TRP C 267 ? 0.5340 0.4646 0.5800 0.0333 -0.0870 -0.0404 326 TRP C CZ3 9095 C CH2 . TRP C 267 ? 0.4014 0.3356 0.4467 0.0307 -0.0818 -0.0401 326 TRP C CH2 9096 N N . GLN C 268 ? 0.4673 0.3963 0.5024 0.0270 -0.0869 -0.0311 327 GLN C N 9097 C CA . GLN C 268 ? 0.6394 0.5628 0.6661 0.0321 -0.0875 -0.0321 327 GLN C CA 9098 C C . GLN C 268 ? 0.6595 0.5785 0.6794 0.0342 -0.0898 -0.0303 327 GLN C C 9099 O O . GLN C 268 ? 0.5535 0.4670 0.5673 0.0392 -0.0918 -0.0312 327 GLN C O 9100 C CB . GLN C 268 ? 0.3878 0.3124 0.4096 0.0312 -0.0820 -0.0319 327 GLN C CB 9101 C CG . GLN C 268 ? 0.3877 0.3142 0.4137 0.0318 -0.0808 -0.0344 327 GLN C CG 9102 C CD . GLN C 268 ? 0.5169 0.4457 0.5392 0.0297 -0.0750 -0.0339 327 GLN C CD 9103 O OE1 . GLN C 268 ? 0.4966 0.4290 0.5185 0.0253 -0.0713 -0.0316 327 GLN C OE1 9104 N NE2 . GLN C 268 ? 0.3877 0.3144 0.4072 0.0330 -0.0742 -0.0361 327 GLN C NE2 9105 N N . SER C 269 ? 0.5957 0.5169 0.6163 0.0305 -0.0894 -0.0278 328 SER C N 9106 C CA . SER C 269 ? 0.7358 0.6531 0.7497 0.0320 -0.0914 -0.0259 328 SER C CA 9107 C C . SER C 269 ? 0.8679 0.7845 0.8863 0.0322 -0.0965 -0.0256 328 SER C C 9108 O O . SER C 269 ? 0.9783 0.8903 0.9919 0.0354 -0.1001 -0.0249 328 SER C O 9109 C CB . SER C 269 ? 0.4955 0.4153 0.5048 0.0280 -0.0868 -0.0231 328 SER C CB 9110 O OG . SER C 269 ? 0.7693 0.6950 0.7851 0.0225 -0.0845 -0.0221 328 SER C OG 9111 N N . SER C 270 ? 0.8212 0.7423 0.8488 0.0289 -0.0969 -0.0260 329 SER C N 9112 C CA . SER C 270 ? 0.5985 0.5194 0.6313 0.0286 -0.1015 -0.0258 329 SER C CA 9113 C C . SER C 270 ? 0.6323 0.5521 0.6720 0.0317 -0.1057 -0.0289 329 SER C C 9114 O O . SER C 270 ? 0.7534 0.6770 0.7999 0.0300 -0.1041 -0.0304 329 SER C O 9115 C CB . SER C 270 ? 0.4875 0.4141 0.5260 0.0226 -0.0990 -0.0240 329 SER C CB 9116 O OG . SER C 270 ? 0.8236 0.7505 0.8689 0.0222 -0.1033 -0.0243 329 SER C OG 9117 N N . MSE C 271 ? 0.4024 0.3171 0.4403 0.0364 -0.1112 -0.0297 330 MSE C N 9118 C CA . MSE C 271 ? 0.4809 0.3940 0.5248 0.0399 -0.1156 -0.0328 330 MSE C CA 9119 C C . MSE C 271 ? 0.6240 0.5408 0.6784 0.0368 -0.1180 -0.0331 330 MSE C C 9120 O O . MSE C 271 ? 0.6175 0.5344 0.6788 0.0386 -0.1210 -0.0357 330 MSE C O 9121 C CB . MSE C 271 ? 0.4674 0.3736 0.5057 0.0463 -0.1207 -0.0337 330 MSE C CB 9122 C CG . MSE C 271 ? 0.8501 0.7521 0.8788 0.0502 -0.1188 -0.0340 330 MSE C CG 9123 SE SE . MSE C 271 ? 1.3331 1.2369 1.3638 0.0512 -0.1150 -0.0371 330 MSE C SE 9124 C CE . MSE C 271 ? 0.4119 0.3206 0.4384 0.0450 -0.1068 -0.0341 330 MSE C CE 9125 N N . ASN C 272 ? 0.7048 0.6245 0.7602 0.0323 -0.1165 -0.0304 331 ASN C N 9126 C CA . ASN C 272 ? 0.6160 0.5392 0.6810 0.0291 -0.1184 -0.0304 331 ASN C CA 9127 C C . ASN C 272 ? 0.5781 0.5078 0.6498 0.0237 -0.1135 -0.0300 331 ASN C C 9128 O O . ASN C 272 ? 0.5898 0.5230 0.6689 0.0201 -0.1137 -0.0293 331 ASN C O 9129 C CB . ASN C 272 ? 0.7855 0.7077 0.8479 0.0276 -0.1201 -0.0277 331 ASN C CB 9130 C CG . ASN C 272 ? 0.9256 0.8484 0.9795 0.0251 -0.1155 -0.0248 331 ASN C CG 9131 O OD1 . ASN C 272 ? 0.8516 0.7707 0.8966 0.0280 -0.1149 -0.0245 331 ASN C OD1 9132 N ND2 . ASN C 272 ? 1.0917 1.0191 1.1485 0.0198 -0.1122 -0.0228 331 ASN C ND2 9133 N N . TYR C 273 ? 0.5883 0.5194 0.6574 0.0234 -0.1092 -0.0305 332 TYR C N 9134 C CA . TYR C 273 ? 0.5582 0.4953 0.6326 0.0187 -0.1042 -0.0301 332 TYR C CA 9135 C C . TYR C 273 ? 0.6497 0.5902 0.7357 0.0172 -0.1059 -0.0318 332 TYR C C 9136 O O . TYR C 273 ? 0.6223 0.5676 0.7145 0.0126 -0.1035 -0.0305 332 TYR C O 9137 C CB . TYR C 273 ? 0.6295 0.5667 0.6991 0.0197 -0.1002 -0.0310 332 TYR C CB 9138 C CG . TYR C 273 ? 0.5579 0.5010 0.6322 0.0152 -0.0950 -0.0304 332 TYR C CG 9139 C CD1 . TYR C 273 ? 0.4930 0.4391 0.5645 0.0110 -0.0903 -0.0277 332 TYR C CD1 9140 C CD2 . TYR C 273 ? 0.4904 0.4361 0.5718 0.0152 -0.0948 -0.0327 332 TYR C CD2 9141 C CE1 . TYR C 273 ? 0.4613 0.4127 0.5369 0.0070 -0.0856 -0.0272 332 TYR C CE1 9142 C CE2 . TYR C 273 ? 0.5105 0.4614 0.5959 0.0112 -0.0901 -0.0321 332 TYR C CE2 9143 C CZ . TYR C 273 ? 0.5645 0.5183 0.6470 0.0072 -0.0856 -0.0293 332 TYR C CZ 9144 O OH . TYR C 273 ? 0.5659 0.5247 0.6523 0.0034 -0.0810 -0.0286 332 TYR C OH 9145 N N . CYS C 274 ? 0.5798 0.5179 0.6689 0.0213 -0.1099 -0.0348 333 CYS C N 9146 C CA . CYS C 274 ? 0.6786 0.6196 0.7788 0.0204 -0.1117 -0.0368 333 CYS C CA 9147 C C . CYS C 274 ? 0.8341 0.7764 0.9411 0.0182 -0.1147 -0.0358 333 CYS C C 9148 O O . CYS C 274 ? 0.7453 0.6923 0.8611 0.0143 -0.1132 -0.0356 333 CYS C O 9149 C CB . CYS C 274 ? 0.4965 0.4340 0.5977 0.0259 -0.1159 -0.0404 333 CYS C CB 9150 S SG . CYS C 274 ? 0.4853 0.4267 0.5999 0.0250 -0.1176 -0.0433 333 CYS C SG 9151 N N . THR C 275 ? 0.8224 0.7603 0.9252 0.0207 -0.1188 -0.0352 334 THR C N 9152 C CA . THR C 275 ? 0.6681 0.6064 0.7762 0.0190 -0.1220 -0.0342 334 THR C CA 9153 C C . THR C 275 ? 0.6151 0.5579 0.7247 0.0131 -0.1175 -0.0312 334 THR C C 9154 O O . THR C 275 ? 0.4402 0.3865 0.5588 0.0099 -0.1177 -0.0309 334 THR C O 9155 C CB . THR C 275 ? 0.6631 0.5955 0.7644 0.0229 -0.1268 -0.0338 334 THR C CB 9156 O OG1 . THR C 275 ? 0.6916 0.6199 0.7935 0.0286 -0.1317 -0.0368 334 THR C OG1 9157 C CG2 . THR C 275 ? 0.5605 0.4936 0.6662 0.0206 -0.1293 -0.0322 334 THR C CG2 9158 N N . ASP C 276 ? 0.3832 0.3259 0.4841 0.0118 -0.1135 -0.0290 335 ASP C N 9159 C CA . ASP C 276 ? 0.5124 0.4587 0.6132 0.0067 -0.1094 -0.0260 335 ASP C CA 9160 C C . ASP C 276 ? 0.6181 0.5700 0.7235 0.0025 -0.1037 -0.0256 335 ASP C C 9161 O O . ASP C 276 ? 0.8158 0.7716 0.9261 -0.0017 -0.1013 -0.0239 335 ASP C O 9162 C CB . ASP C 276 ? 0.4744 0.4180 0.5637 0.0072 -0.1078 -0.0238 335 ASP C CB 9163 C CG . ASP C 276 ? 0.6479 0.5858 0.7318 0.0114 -0.1132 -0.0239 335 ASP C CG 9164 O OD1 . ASP C 276 ? 0.8578 0.7922 0.9318 0.0138 -0.1128 -0.0231 335 ASP C OD1 9165 O OD2 . ASP C 276 ? 0.4494 0.3861 0.5389 0.0124 -0.1179 -0.0247 335 ASP C OD2 9166 N N . LYS C 277 ? 0.5578 0.5102 0.6616 0.0039 -0.1015 -0.0270 336 LYS C N 9167 C CA . LYS C 277 ? 0.5464 0.5037 0.6525 0.0003 -0.0957 -0.0262 336 LYS C CA 9168 C C . LYS C 277 ? 0.5742 0.5345 0.6891 0.0002 -0.0956 -0.0285 336 LYS C C 9169 O O . LYS C 277 ? 0.5687 0.5336 0.6875 -0.0033 -0.0912 -0.0277 336 LYS C O 9170 C CB . LYS C 277 ? 0.6846 0.6407 0.7806 0.0011 -0.0920 -0.0255 336 LYS C CB 9171 C CG . LYS C 277 ? 0.6797 0.6334 0.7668 0.0008 -0.0914 -0.0231 336 LYS C CG 9172 C CD . LYS C 277 ? 0.6400 0.5977 0.7292 -0.0042 -0.0878 -0.0205 336 LYS C CD 9173 C CE . LYS C 277 ? 0.8063 0.7617 0.8869 -0.0045 -0.0875 -0.0182 336 LYS C CE 9174 N NZ . LYS C 277 ? 0.8364 0.7902 0.9074 -0.0033 -0.0845 -0.0177 336 LYS C NZ 9175 N N . VAL C 278 ? 0.4108 0.3684 0.5286 0.0040 -0.1003 -0.0313 337 VAL C N 9176 C CA . VAL C 278 ? 0.4164 0.3767 0.5422 0.0042 -0.1003 -0.0337 337 VAL C CA 9177 C C . VAL C 278 ? 0.5356 0.4969 0.6721 0.0039 -0.1045 -0.0349 337 VAL C C 9178 O O . VAL C 278 ? 0.3991 0.3648 0.5445 0.0008 -0.1028 -0.0350 337 VAL C O 9179 C CB . VAL C 278 ? 0.5475 0.5043 0.6687 0.0091 -0.1019 -0.0364 337 VAL C CB 9180 C CG1 . VAL C 278 ? 0.5446 0.5041 0.6744 0.0094 -0.1024 -0.0390 337 VAL C CG1 9181 C CG2 . VAL C 278 ? 0.4450 0.4013 0.5566 0.0092 -0.0974 -0.0353 337 VAL C CG2 9182 N N . LYS C 279 ? 0.4375 0.3944 0.5730 0.0071 -0.1099 -0.0359 338 LYS C N 9183 C CA . LYS C 279 ? 0.4283 0.3857 0.5736 0.0071 -0.1143 -0.0371 338 LYS C CA 9184 C C . LYS C 279 ? 0.6718 0.6330 0.8229 0.0019 -0.1123 -0.0346 338 LYS C C 9185 O O . LYS C 279 ? 0.7173 0.6806 0.8785 0.0005 -0.1143 -0.0354 338 LYS C O 9186 C CB . LYS C 279 ? 0.4628 0.4144 0.6046 0.0117 -0.1205 -0.0383 338 LYS C CB 9187 C CG . LYS C 279 ? 0.4507 0.3989 0.5916 0.0171 -0.1241 -0.0418 338 LYS C CG 9188 C CD . LYS C 279 ? 0.3965 0.3388 0.5333 0.0220 -0.1301 -0.0427 338 LYS C CD 9189 C CE . LYS C 279 ? 0.4582 0.3972 0.5954 0.0275 -0.1339 -0.0465 338 LYS C CE 9190 N NZ . LYS C 279 ? 0.5401 0.4728 0.6724 0.0327 -0.1397 -0.0473 338 LYS C NZ 9191 N N . THR C 280 ? 0.5977 0.5597 0.7423 -0.0008 -0.1083 -0.0316 339 THR C N 9192 C CA . THR C 280 ? 0.5249 0.4901 0.6736 -0.0054 -0.1061 -0.0290 339 THR C CA 9193 C C . THR C 280 ? 0.6713 0.6422 0.8254 -0.0097 -0.1004 -0.0280 339 THR C C 9194 O O . THR C 280 ? 0.7800 0.7539 0.9389 -0.0135 -0.0983 -0.0261 339 THR C O 9195 C CB . THR C 280 ? 0.5520 0.5150 0.6910 -0.0061 -0.1048 -0.0263 339 THR C CB 9196 O OG1 . THR C 280 ? 0.6881 0.6512 0.8186 -0.0061 -0.1005 -0.0254 339 THR C OG1 9197 C CG2 . THR C 280 ? 0.4507 0.4082 0.5848 -0.0021 -0.1106 -0.0270 339 THR C CG2 9198 N N . LYS C 281 ? 0.6664 0.6386 0.8194 -0.0089 -0.0979 -0.0292 340 LYS C N 9199 C CA . LYS C 281 ? 0.7828 0.7603 0.9410 -0.0126 -0.0927 -0.0282 340 LYS C CA 9200 C C . LYS C 281 ? 0.8813 0.8618 1.0521 -0.0136 -0.0943 -0.0298 340 LYS C C 9201 O O . LYS C 281 ? 0.8213 0.7998 0.9957 -0.0105 -0.0990 -0.0326 340 LYS C O 9202 C CB . LYS C 281 ? 0.7775 0.7554 0.9297 -0.0115 -0.0894 -0.0288 340 LYS C CB 9203 C CG . LYS C 281 ? 0.7927 0.7691 0.9337 -0.0117 -0.0862 -0.0267 340 LYS C CG 9204 C CD . LYS C 281 ? 0.9379 0.9147 1.0736 -0.0106 -0.0829 -0.0275 340 LYS C CD 9205 C CE . LYS C 281 ? 0.9972 0.9740 1.1237 -0.0122 -0.0785 -0.0250 340 LYS C CE 9206 N NZ . LYS C 281 ? 1.0724 1.0445 1.1900 -0.0098 -0.0808 -0.0245 340 LYS C NZ 9207 N N . ARG C 282 ? 0.9020 0.8872 1.0792 -0.0178 -0.0904 -0.0281 341 ARG C N 9208 C CA . ARG C 282 ? 0.8233 0.8119 1.0129 -0.0193 -0.0912 -0.0293 341 ARG C CA 9209 C C . ARG C 282 ? 0.7098 0.6989 0.9028 -0.0168 -0.0925 -0.0323 341 ARG C C 9210 O O . ARG C 282 ? 0.6878 0.6766 0.8885 -0.0154 -0.0965 -0.0346 341 ARG C O 9211 C CB . ARG C 282 ? 0.9917 0.9853 1.1863 -0.0241 -0.0857 -0.0267 341 ARG C CB 9212 C CG . ARG C 282 ? 1.2336 1.2271 1.4275 -0.0268 -0.0847 -0.0240 341 ARG C CG 9213 C CD . ARG C 282 ? 1.3842 1.3768 1.5863 -0.0267 -0.0893 -0.0249 341 ARG C CD 9214 N NE . ARG C 282 ? 1.5440 1.5410 1.7582 -0.0297 -0.0877 -0.0246 341 ARG C NE 9215 C CZ . ARG C 282 ? 1.5438 1.5410 1.7667 -0.0307 -0.0906 -0.0250 341 ARG C CZ 9216 N NH1 . ARG C 282 ? 1.6230 1.6164 1.8438 -0.0288 -0.0953 -0.0255 341 ARG C NH1 9217 N NH2 . ARG C 282 ? 1.3471 1.3484 1.5809 -0.0334 -0.0886 -0.0247 341 ARG C NH2 9218 N N . GLN C 283 ? 0.8700 0.8597 1.0569 -0.0164 -0.0890 -0.0322 342 GLN C N 9219 C CA . GLN C 283 ? 0.7832 0.7737 0.9724 -0.0142 -0.0895 -0.0349 342 GLN C CA 9220 C C . GLN C 283 ? 0.6093 0.5951 0.7962 -0.0091 -0.0952 -0.0381 342 GLN C C 9221 O O . GLN C 283 ? 0.6329 0.6191 0.8242 -0.0071 -0.0971 -0.0409 342 GLN C O 9222 C CB . GLN C 283 ? 0.8772 0.8690 1.0591 -0.0146 -0.0846 -0.0340 342 GLN C CB 9223 C CG . GLN C 283 ? 1.1077 1.1039 1.2912 -0.0192 -0.0788 -0.0308 342 GLN C CG 9224 C CD . GLN C 283 ? 1.1789 1.1737 1.3539 -0.0205 -0.0764 -0.0281 342 GLN C CD 9225 O OE1 . GLN C 283 ? 1.0808 1.0719 1.2516 -0.0190 -0.0795 -0.0280 342 GLN C OE1 9226 N NE2 . GLN C 283 ? 1.1934 1.1911 1.3658 -0.0233 -0.0709 -0.0258 342 GLN C NE2 9227 N N . TYR C 284 ? 0.5014 0.4827 0.6811 -0.0070 -0.0979 -0.0378 343 TYR C N 9228 C CA . TYR C 284 ? 0.4556 0.4320 0.6318 -0.0018 -0.1032 -0.0406 343 TYR C CA 9229 C C . TYR C 284 ? 0.5484 0.5224 0.7292 -0.0006 -0.1087 -0.0413 343 TYR C C 9230 O O . TYR C 284 ? 0.6076 0.5776 0.7874 0.0038 -0.1137 -0.0439 343 TYR C O 9231 C CB . TYR C 284 ? 0.6024 0.5748 0.7655 0.0007 -0.1022 -0.0399 343 TYR C CB 9232 C CG . TYR C 284 ? 0.6743 0.6480 0.8322 0.0007 -0.0977 -0.0400 343 TYR C CG 9233 C CD1 . TYR C 284 ? 0.6457 0.6180 0.8027 0.0043 -0.0991 -0.0430 343 TYR C CD1 9234 C CD2 . TYR C 284 ? 0.5845 0.5609 0.7384 -0.0029 -0.0921 -0.0371 343 TYR C CD2 9235 C CE1 . TYR C 284 ? 0.6018 0.5753 0.7538 0.0043 -0.0950 -0.0431 343 TYR C CE1 9236 C CE2 . TYR C 284 ? 0.6281 0.6058 0.7773 -0.0028 -0.0881 -0.0371 343 TYR C CE2 9237 C CZ . TYR C 284 ? 0.5871 0.5633 0.7354 0.0007 -0.0895 -0.0401 343 TYR C CZ 9238 O OH . TYR C 284 ? 0.7123 0.6897 0.8557 0.0007 -0.0855 -0.0401 343 TYR C OH 9239 N N . ALA C 285 ? 0.6472 0.6234 0.8329 -0.0044 -0.1079 -0.0390 344 ALA C N 9240 C CA . ALA C 285 ? 0.5734 0.5473 0.7630 -0.0036 -0.1128 -0.0393 344 ALA C CA 9241 C C . ALA C 285 ? 0.6639 0.6385 0.8645 -0.0021 -0.1171 -0.0425 344 ALA C C 9242 O O . ALA C 285 ? 0.6029 0.5741 0.8051 0.0007 -0.1227 -0.0440 344 ALA C O 9243 C CB . ALA C 285 ? 0.4933 0.4697 0.6856 -0.0082 -0.1103 -0.0361 344 ALA C CB 9244 N N . HIS C 286 ? 0.5203 0.4992 0.7282 -0.0039 -0.1146 -0.0433 345 HIS C N 9245 C CA . HIS C 286 ? 0.5107 0.4908 0.7297 -0.0029 -0.1182 -0.0463 345 HIS C CA 9246 C C . HIS C 286 ? 0.5808 0.5634 0.8018 -0.0022 -0.1161 -0.0483 345 HIS C C 9247 O O . HIS C 286 ? 0.6147 0.6011 0.8353 -0.0053 -0.1106 -0.0465 345 HIS C O 9248 C CB . HIS C 286 ? 0.6136 0.5974 0.8436 -0.0071 -0.1177 -0.0449 345 HIS C CB 9249 C CG . HIS C 286 ? 0.6620 0.6435 0.8906 -0.0079 -0.1199 -0.0431 345 HIS C CG 9250 N ND1 . HIS C 286 ? 0.7476 0.7258 0.9794 -0.0051 -0.1262 -0.0450 345 HIS C ND1 9251 C CD2 . HIS C 286 ? 0.5686 0.5506 0.7928 -0.0110 -0.1167 -0.0396 345 HIS C CD2 9252 C CE1 . HIS C 286 ? 0.8410 0.8176 1.0701 -0.0066 -0.1267 -0.0426 345 HIS C CE1 9253 N NE2 . HIS C 286 ? 0.7929 0.7718 1.0173 -0.0102 -0.1210 -0.0394 345 HIS C NE2 9254 N N . GLY C 287 ? 0.3778 0.3584 0.6011 0.0019 -0.1204 -0.0520 346 GLY C N 9255 C CA . GLY C 287 ? 0.5469 0.5298 0.7726 0.0028 -0.1188 -0.0542 346 GLY C CA 9256 C C . GLY C 287 ? 0.5972 0.5759 0.8150 0.0082 -0.1211 -0.0571 346 GLY C C 9257 O O . GLY C 287 ? 0.4918 0.4657 0.7064 0.0124 -0.1260 -0.0589 346 GLY C O 9258 N N . ARG C 288 ? 0.4727 0.4532 0.6874 0.0083 -0.1174 -0.0576 347 ARG C N 9259 C CA . ARG C 288 ? 0.6355 0.6125 0.8429 0.0133 -0.1188 -0.0605 347 ARG C CA 9260 C C . ARG C 288 ? 0.6623 0.6379 0.8575 0.0134 -0.1145 -0.0585 347 ARG C C 9261 O O . ARG C 288 ? 0.6916 0.6636 0.8790 0.0175 -0.1153 -0.0604 347 ARG C O 9262 C CB . ARG C 288 ? 0.5079 0.4879 0.7220 0.0139 -0.1186 -0.0634 347 ARG C CB 9263 C CG . ARG C 288 ? 0.4243 0.4099 0.6406 0.0093 -0.1125 -0.0612 347 ARG C CG 9264 C CD . ARG C 288 ? 0.4592 0.4473 0.6802 0.0105 -0.1123 -0.0641 347 ARG C CD 9265 N NE . ARG C 288 ? 0.5811 0.5656 0.7928 0.0151 -0.1128 -0.0666 347 ARG C NE 9266 C CZ . ARG C 288 ? 0.6088 0.5918 0.8227 0.0192 -0.1163 -0.0707 347 ARG C CZ 9267 N NH1 . ARG C 288 ? 0.6062 0.5910 0.8313 0.0192 -0.1197 -0.0730 347 ARG C NH1 9268 N NH2 . ARG C 288 ? 0.5686 0.5481 0.7733 0.0234 -0.1163 -0.0728 347 ARG C NH2 9269 N N . ARG C 289 ? 0.5469 0.5251 0.7403 0.0089 -0.1100 -0.0547 348 ARG C N 9270 C CA . ARG C 289 ? 0.5386 0.5163 0.7213 0.0082 -0.1053 -0.0525 348 ARG C CA 9271 C C . ARG C 289 ? 0.5520 0.5237 0.7236 0.0126 -0.1074 -0.0531 348 ARG C C 9272 O O . ARG C 289 ? 0.5610 0.5309 0.7246 0.0148 -0.1055 -0.0539 348 ARG C O 9273 C CB . ARG C 289 ? 0.4153 0.3962 0.5983 0.0030 -0.1010 -0.0484 348 ARG C CB 9274 C CG . ARG C 289 ? 0.5975 0.5822 0.7781 0.0000 -0.0948 -0.0465 348 ARG C CG 9275 C CD . ARG C 289 ? 0.7071 0.6972 0.8984 -0.0028 -0.0932 -0.0469 348 ARG C CD 9276 N NE . ARG C 289 ? 0.9000 0.8943 1.0954 -0.0079 -0.0892 -0.0434 348 ARG C NE 9277 C CZ . ARG C 289 ? 1.1823 1.1797 1.3749 -0.0107 -0.0836 -0.0411 348 ARG C CZ 9278 N NH1 . ARG C 289 ? 1.3628 1.3597 1.5486 -0.0091 -0.0815 -0.0419 348 ARG C NH1 9279 N NH2 . ARG C 289 ? 1.1875 1.1884 1.3840 -0.0150 -0.0802 -0.0381 348 ARG C NH2 9280 N N . LEU C 290 ? 0.6081 0.5765 0.7789 0.0138 -0.1113 -0.0527 349 LEU C N 9281 C CA . LEU C 290 ? 0.4986 0.4611 0.6591 0.0180 -0.1135 -0.0530 349 LEU C CA 9282 C C . LEU C 290 ? 0.5837 0.5422 0.7422 0.0239 -0.1173 -0.0570 349 LEU C C 9283 O O . LEU C 290 ? 0.8182 0.7729 0.9671 0.0274 -0.1169 -0.0575 349 LEU C O 9284 C CB . LEU C 290 ? 0.6382 0.5982 0.7989 0.0180 -0.1170 -0.0515 349 LEU C CB 9285 C CG . LEU C 290 ? 0.6413 0.5956 0.7905 0.0214 -0.1184 -0.0507 349 LEU C CG 9286 C CD1 . LEU C 290 ? 0.6338 0.5887 0.7738 0.0197 -0.1128 -0.0483 349 LEU C CD1 9287 C CD2 . LEU C 290 ? 0.6179 0.5704 0.7678 0.0206 -0.1215 -0.0490 349 LEU C CD2 9288 N N . LEU C 291 ? 0.6703 0.6300 0.8383 0.0250 -0.1209 -0.0598 350 LEU C N 9289 C CA . LEU C 291 ? 0.5819 0.5382 0.7491 0.0306 -0.1245 -0.0639 350 LEU C CA 9290 C C . LEU C 291 ? 0.6954 0.6529 0.8581 0.0313 -0.1205 -0.0650 350 LEU C C 9291 O O . LEU C 291 ? 0.6354 0.5888 0.7916 0.0363 -0.1219 -0.0674 350 LEU C O 9292 C CB . LEU C 291 ? 0.4041 0.3621 0.5834 0.0311 -0.1288 -0.0667 350 LEU C CB 9293 C CG . LEU C 291 ? 0.6348 0.5899 0.8178 0.0326 -0.1345 -0.0670 350 LEU C CG 9294 C CD1 . LEU C 291 ? 0.4810 0.4389 0.6773 0.0319 -0.1378 -0.0694 350 LEU C CD1 9295 C CD2 . LEU C 291 ? 0.4801 0.4283 0.6548 0.0390 -0.1387 -0.0689 350 LEU C CD2 9296 N N . ASP C 292 ? 0.5493 0.5123 0.7154 0.0265 -0.1155 -0.0632 351 ASP C N 9297 C CA . ASP C 292 ? 0.5663 0.5308 0.7277 0.0265 -0.1112 -0.0636 351 ASP C CA 9298 C C . ASP C 292 ? 0.6080 0.5691 0.7568 0.0278 -0.1084 -0.0619 351 ASP C C 9299 O O . ASP C 292 ? 0.5821 0.5406 0.7240 0.0313 -0.1076 -0.0637 351 ASP C O 9300 C CB . ASP C 292 ? 0.3819 0.3530 0.5498 0.0209 -0.1065 -0.0616 351 ASP C CB 9301 C CG . ASP C 292 ? 0.5670 0.5417 0.7472 0.0199 -0.1087 -0.0637 351 ASP C CG 9302 O OD1 . ASP C 292 ? 0.4176 0.3897 0.6005 0.0241 -0.1134 -0.0673 351 ASP C OD1 9303 O OD2 . ASP C 292 ? 0.6406 0.6206 0.8278 0.0152 -0.1057 -0.0617 351 ASP C OD2 9304 N N . LEU C 293 ? 0.5182 0.4793 0.6638 0.0250 -0.1069 -0.0585 352 LEU C N 9305 C CA . LEU C 293 ? 0.4340 0.3921 0.5681 0.0257 -0.1042 -0.0565 352 LEU C CA 9306 C C . LEU C 293 ? 0.4834 0.4348 0.6099 0.0320 -0.1079 -0.0587 352 LEU C C 9307 O O . LEU C 293 ? 0.4721 0.4209 0.5893 0.0342 -0.1056 -0.0588 352 LEU C O 9308 C CB . LEU C 293 ? 0.4884 0.4475 0.6216 0.0219 -0.1027 -0.0527 352 LEU C CB 9309 C CG . LEU C 293 ? 0.4277 0.3847 0.5498 0.0217 -0.0993 -0.0502 352 LEU C CG 9310 C CD1 . LEU C 293 ? 0.5467 0.5083 0.6698 0.0159 -0.0944 -0.0466 352 LEU C CD1 9311 C CD2 . LEU C 293 ? 0.5178 0.4693 0.6341 0.0249 -0.1031 -0.0499 352 LEU C CD2 9312 N N . VAL C 294 ? 0.4377 0.3863 0.5681 0.0349 -0.1136 -0.0605 353 VAL C N 9313 C CA . VAL C 294 ? 0.5230 0.4649 0.6468 0.0413 -0.1176 -0.0628 353 VAL C CA 9314 C C . VAL C 294 ? 0.5429 0.4837 0.6655 0.0452 -0.1177 -0.0665 353 VAL C C 9315 O O . VAL C 294 ? 0.5412 0.4775 0.6547 0.0494 -0.1174 -0.0675 353 VAL C O 9316 C CB . VAL C 294 ? 0.3964 0.3358 0.5255 0.0436 -0.1239 -0.0639 353 VAL C CB 9317 C CG1 . VAL C 294 ? 0.4005 0.3331 0.5234 0.0507 -0.1282 -0.0667 353 VAL C CG1 9318 C CG2 . VAL C 294 ? 0.4548 0.3944 0.5832 0.0403 -0.1239 -0.0603 353 VAL C CG2 9319 N N . ASP C 295 ? 0.5610 0.5059 0.6926 0.0438 -0.1180 -0.0684 354 ASP C N 9320 C CA . ASP C 295 ? 0.4913 0.4357 0.6226 0.0471 -0.1180 -0.0720 354 ASP C CA 9321 C C . ASP C 295 ? 0.6536 0.5985 0.7764 0.0466 -0.1125 -0.0711 354 ASP C C 9322 O O . ASP C 295 ? 0.4943 0.4352 0.6103 0.0513 -0.1127 -0.0735 354 ASP C O 9323 C CB . ASP C 295 ? 0.4295 0.3791 0.5726 0.0447 -0.1187 -0.0737 354 ASP C CB 9324 C CG . ASP C 295 ? 0.6341 0.5815 0.7841 0.0484 -0.1251 -0.0771 354 ASP C CG 9325 O OD1 . ASP C 295 ? 0.5289 0.4705 0.6739 0.0534 -0.1290 -0.0785 354 ASP C OD1 9326 O OD2 . ASP C 295 ? 0.5384 0.4899 0.6989 0.0464 -0.1262 -0.0784 354 ASP C OD2 9327 N N . ILE C 296 ? 0.4075 0.3569 0.5307 0.0410 -0.1075 -0.0678 355 ILE C N 9328 C CA . ILE C 296 ? 0.5948 0.5454 0.7111 0.0399 -0.1021 -0.0668 355 ILE C CA 9329 C C . ILE C 296 ? 0.7317 0.6773 0.8361 0.0425 -0.1008 -0.0655 355 ILE C C 9330 O O . ILE C 296 ? 0.3935 0.3375 0.4905 0.0443 -0.0979 -0.0662 355 ILE C O 9331 C CB . ILE C 296 ? 0.4201 0.3772 0.5407 0.0332 -0.0972 -0.0635 355 ILE C CB 9332 C CG1 . ILE C 296 ? 0.5060 0.4649 0.6210 0.0322 -0.0919 -0.0631 355 ILE C CG1 9333 C CG2 . ILE C 296 ? 0.5749 0.5322 0.6939 0.0299 -0.0962 -0.0597 355 ILE C CG2 9334 C CD1 . ILE C 296 ? 0.4878 0.4530 0.6074 0.0262 -0.0874 -0.0601 355 ILE C CD1 9335 N N . HIS C 297 ? 0.4787 0.4216 0.5812 0.0427 -0.1030 -0.0637 356 HIS C N 9336 C CA . HIS C 297 ? 0.4113 0.3492 0.5029 0.0454 -0.1022 -0.0626 356 HIS C CA 9337 C C . HIS C 297 ? 0.4544 0.3858 0.5411 0.0524 -0.1061 -0.0659 356 HIS C C 9338 O O . HIS C 297 ? 0.4836 0.4107 0.5606 0.0556 -0.1047 -0.0658 356 HIS C O 9339 C CB . HIS C 297 ? 0.3941 0.3313 0.4850 0.0432 -0.1032 -0.0594 356 HIS C CB 9340 C CG . HIS C 297 ? 0.5317 0.4728 0.6209 0.0376 -0.0980 -0.0556 356 HIS C CG 9341 N ND1 . HIS C 297 ? 0.3906 0.3295 0.4702 0.0376 -0.0950 -0.0535 356 HIS C ND1 9342 C CD2 . HIS C 297 ? 0.3872 0.3344 0.4831 0.0319 -0.0952 -0.0537 356 HIS C CD2 9343 C CE1 . HIS C 297 ? 0.4810 0.4244 0.5615 0.0323 -0.0906 -0.0505 356 HIS C CE1 9344 N NE2 . HIS C 297 ? 0.4851 0.4335 0.5753 0.0288 -0.0906 -0.0505 356 HIS C NE2 9345 N N . ILE C 298 ? 0.4407 0.3714 0.5342 0.0551 -0.1109 -0.0689 357 ILE C N 9346 C CA . ILE C 298 ? 0.5577 0.4827 0.6473 0.0621 -0.1146 -0.0726 357 ILE C CA 9347 C C . ILE C 298 ? 0.6775 0.6027 0.7630 0.0637 -0.1112 -0.0747 357 ILE C C 9348 O O . ILE C 298 ? 0.5699 0.4900 0.6469 0.0687 -0.1111 -0.0762 357 ILE C O 9349 C CB . ILE C 298 ? 0.4065 0.3312 0.5053 0.0643 -0.1205 -0.0756 357 ILE C CB 9350 C CG1 . ILE C 298 ? 0.4268 0.3490 0.5269 0.0649 -0.1248 -0.0741 357 ILE C CG1 9351 C CG2 . ILE C 298 ? 0.4882 0.4084 0.5842 0.0711 -0.1234 -0.0800 357 ILE C CG2 9352 C CD1 . ILE C 298 ? 0.4399 0.3619 0.5494 0.0669 -0.1307 -0.0768 357 ILE C CD1 9353 N N . LEU C 299 ? 0.5065 0.4377 0.5980 0.0595 -0.1083 -0.0746 358 LEU C N 9354 C CA . LEU C 299 ? 0.5123 0.4446 0.6003 0.0601 -0.1046 -0.0762 358 LEU C CA 9355 C C . LEU C 299 ? 0.7141 0.6450 0.7918 0.0594 -0.0996 -0.0738 358 LEU C C 9356 O O . LEU C 299 ? 0.4044 0.3317 0.4743 0.0633 -0.0983 -0.0755 358 LEU C O 9357 C CB . LEU C 299 ? 0.3995 0.3388 0.4963 0.0552 -0.1024 -0.0760 358 LEU C CB 9358 C CG . LEU C 299 ? 0.3991 0.3404 0.4931 0.0552 -0.0986 -0.0774 358 LEU C CG 9359 C CD1 . LEU C 299 ? 0.4759 0.4136 0.5689 0.0614 -0.1018 -0.0822 358 LEU C CD1 9360 C CD2 . LEU C 299 ? 0.4728 0.4214 0.5753 0.0495 -0.0959 -0.0761 358 LEU C CD2 9361 N N . ASP C 300 ? 0.4617 0.3953 0.5392 0.0544 -0.0968 -0.0698 359 ASP C N 9362 C CA . ASP C 300 ? 0.3983 0.3313 0.4669 0.0530 -0.0920 -0.0672 359 ASP C CA 9363 C C . ASP C 300 ? 0.5577 0.4836 0.6166 0.0582 -0.0933 -0.0676 359 ASP C C 9364 O O . ASP C 300 ? 0.4527 0.3765 0.5032 0.0595 -0.0898 -0.0673 359 ASP C O 9365 C CB . ASP C 300 ? 0.3947 0.3319 0.4658 0.0469 -0.0894 -0.0631 359 ASP C CB 9366 C CG . ASP C 300 ? 0.4570 0.4012 0.5353 0.0415 -0.0863 -0.0621 359 ASP C CG 9367 O OD1 . ASP C 300 ? 0.4736 0.4194 0.5529 0.0423 -0.0849 -0.0642 359 ASP C OD1 9368 O OD2 . ASP C 300 ? 0.4593 0.4073 0.5422 0.0367 -0.0851 -0.0592 359 ASP C OD2 9369 N N . TYR C 301 ? 0.4432 0.3653 0.5032 0.0613 -0.0983 -0.0682 360 TYR C N 9370 C CA . TYR C 301 ? 0.4864 0.4016 0.5375 0.0665 -0.0999 -0.0685 360 TYR C CA 9371 C C . TYR C 301 ? 0.4980 0.4087 0.5444 0.0727 -0.1008 -0.0723 360 TYR C C 9372 O O . TYR C 301 ? 0.4129 0.3188 0.4499 0.0763 -0.0992 -0.0724 360 TYR C O 9373 C CB . TYR C 301 ? 0.4893 0.4017 0.5431 0.0682 -0.1053 -0.0680 360 TYR C CB 9374 C CG . TYR C 301 ? 0.6177 0.5226 0.6626 0.0741 -0.1074 -0.0684 360 TYR C CG 9375 C CD1 . TYR C 301 ? 0.5909 0.4938 0.6274 0.0734 -0.1044 -0.0654 360 TYR C CD1 9376 C CD2 . TYR C 301 ? 0.5713 0.4712 0.6161 0.0804 -0.1126 -0.0716 360 TYR C CD2 9377 C CE1 . TYR C 301 ? 0.4811 0.3772 0.5096 0.0788 -0.1063 -0.0655 360 TYR C CE1 9378 C CE2 . TYR C 301 ? 0.4969 0.3898 0.5335 0.0861 -0.1145 -0.0718 360 TYR C CE2 9379 C CZ . TYR C 301 ? 0.6493 0.5403 0.6777 0.0852 -0.1113 -0.0687 360 TYR C CZ 9380 O OH . TYR C 301 ? 0.5618 0.4457 0.5820 0.0908 -0.1131 -0.0687 360 TYR C OH 9381 N N . LEU C 302 ? 0.5795 0.4916 0.6324 0.0742 -0.1034 -0.0756 361 LEU C N 9382 C CA . LEU C 302 ? 0.4304 0.3386 0.4796 0.0800 -0.1043 -0.0796 361 LEU C CA 9383 C C . LEU C 302 ? 0.6521 0.5615 0.6951 0.0791 -0.0986 -0.0795 361 LEU C C 9384 O O . LEU C 302 ? 0.6356 0.5401 0.6710 0.0842 -0.0979 -0.0816 361 LEU C O 9385 C CB . LEU C 302 ? 0.4152 0.3257 0.4736 0.0811 -0.1080 -0.0830 361 LEU C CB 9386 C CG . LEU C 302 ? 0.6484 0.5561 0.7120 0.0842 -0.1146 -0.0844 361 LEU C CG 9387 C CD1 . LEU C 302 ? 0.4166 0.3282 0.4910 0.0833 -0.1175 -0.0872 361 LEU C CD1 9388 C CD2 . LEU C 302 ? 0.4220 0.3217 0.4779 0.0921 -0.1177 -0.0869 361 LEU C CD2 9389 N N . ILE C 303 ? 0.5067 0.4223 0.5529 0.0728 -0.0944 -0.0770 362 ILE C N 9390 C CA . ILE C 303 ? 0.4541 0.3714 0.4952 0.0713 -0.0889 -0.0767 362 ILE C CA 9391 C C . ILE C 303 ? 0.6027 0.5196 0.6367 0.0687 -0.0846 -0.0731 362 ILE C C 9392 O O . ILE C 303 ? 0.5177 0.4354 0.5464 0.0677 -0.0800 -0.0726 362 ILE C O 9393 C CB . ILE C 303 ? 0.4070 0.3316 0.4559 0.0662 -0.0868 -0.0766 362 ILE C CB 9394 C CG1 . ILE C 303 ? 0.4017 0.3314 0.4562 0.0596 -0.0854 -0.0726 362 ILE C CG1 9395 C CG2 . ILE C 303 ? 0.4069 0.3323 0.4635 0.0684 -0.0911 -0.0802 362 ILE C CG2 9396 C CD1 . ILE C 303 ? 0.4584 0.3951 0.5222 0.0549 -0.0844 -0.0724 362 ILE C CD1 9397 N N . GLY C 304 ? 0.4072 0.3229 0.4410 0.0676 -0.0862 -0.0705 363 GLY C N 9398 C CA . GLY C 304 ? 0.4059 0.3211 0.4333 0.0653 -0.0825 -0.0671 363 GLY C CA 9399 C C . GLY C 304 ? 0.4015 0.3233 0.4320 0.0583 -0.0780 -0.0641 363 GLY C C 9400 O O . GLY C 304 ? 0.5478 0.4698 0.5723 0.0565 -0.0737 -0.0620 363 GLY C O 9401 N N . ASN C 305 ? 0.5832 0.5104 0.6231 0.0546 -0.0789 -0.0640 364 ASN C N 9402 C CA . ASN C 305 ? 0.4040 0.3376 0.4477 0.0481 -0.0749 -0.0612 364 ASN C CA 9403 C C . ASN C 305 ? 0.5085 0.4435 0.5534 0.0444 -0.0747 -0.0577 364 ASN C C 9404 O O . ASN C 305 ? 0.3927 0.3279 0.4433 0.0440 -0.0785 -0.0574 364 ASN C O 9405 C CB . ASN C 305 ? 0.4341 0.3729 0.4876 0.0458 -0.0758 -0.0625 364 ASN C CB 9406 C CG . ASN C 305 ? 0.3889 0.3343 0.4468 0.0393 -0.0718 -0.0596 364 ASN C CG 9407 O OD1 . ASN C 305 ? 0.3874 0.3338 0.4400 0.0370 -0.0674 -0.0574 364 ASN C OD1 9408 N ND2 . ASN C 305 ? 0.4530 0.4029 0.5208 0.0364 -0.0734 -0.0595 364 ASN C ND2 9409 N N . GLN C 306 ? 0.3910 0.3269 0.4304 0.0417 -0.0703 -0.0550 365 GLN C N 9410 C CA . GLN C 306 ? 0.6332 0.5702 0.6726 0.0382 -0.0697 -0.0516 365 GLN C CA 9411 C C . GLN C 306 ? 0.4560 0.3998 0.5015 0.0319 -0.0666 -0.0492 365 GLN C C 9412 O O . GLN C 306 ? 0.4517 0.3972 0.4988 0.0287 -0.0664 -0.0465 365 GLN C O 9413 C CB . GLN C 306 ? 0.4266 0.3600 0.4560 0.0394 -0.0670 -0.0500 365 GLN C CB 9414 C CG . GLN C 306 ? 0.4673 0.3936 0.4900 0.0457 -0.0698 -0.0519 365 GLN C CG 9415 C CD . GLN C 306 ? 0.5917 0.5147 0.6048 0.0466 -0.0667 -0.0503 365 GLN C CD 9416 O OE1 . GLN C 306 ? 0.3934 0.3182 0.4030 0.0447 -0.0620 -0.0496 365 GLN C OE1 9417 N NE2 . GLN C 306 ? 0.3968 0.3150 0.4056 0.0495 -0.0692 -0.0496 365 GLN C NE2 9418 N N . ASP C 307 ? 0.4938 0.4414 0.5424 0.0304 -0.0642 -0.0501 366 ASP C N 9419 C CA . ASP C 307 ? 0.4893 0.4429 0.5418 0.0248 -0.0603 -0.0477 366 ASP C CA 9420 C C . ASP C 307 ? 0.4451 0.4033 0.5085 0.0218 -0.0622 -0.0475 366 ASP C C 9421 O O . ASP C 307 ? 0.7207 0.6838 0.7887 0.0186 -0.0596 -0.0469 366 ASP C O 9422 C CB . ASP C 307 ? 0.4911 0.4465 0.5404 0.0244 -0.0562 -0.0483 366 ASP C CB 9423 C CG . ASP C 307 ? 0.4772 0.4375 0.5271 0.0192 -0.0514 -0.0453 366 ASP C CG 9424 O OD1 . ASP C 307 ? 0.5207 0.4817 0.5702 0.0166 -0.0506 -0.0427 366 ASP C OD1 9425 O OD2 . ASP C 307 ? 0.6548 0.6181 0.7051 0.0179 -0.0484 -0.0455 366 ASP C OD2 9426 N N . ARG C 308 ? 0.3968 0.3532 0.4643 0.0231 -0.0668 -0.0481 367 ARG C N 9427 C CA . ARG C 308 ? 0.3777 0.3382 0.4558 0.0205 -0.0688 -0.0480 367 ARG C CA 9428 C C . ARG C 308 ? 0.5585 0.5220 0.6391 0.0158 -0.0672 -0.0445 367 ARG C C 9429 O O . ARG C 308 ? 0.6408 0.6026 0.7230 0.0159 -0.0703 -0.0438 367 ARG C O 9430 C CB . ARG C 308 ? 0.4507 0.4079 0.5326 0.0242 -0.0747 -0.0505 367 ARG C CB 9431 C CG . ARG C 308 ? 0.4191 0.3802 0.5123 0.0220 -0.0770 -0.0511 367 ARG C CG 9432 C CD . ARG C 308 ? 0.3787 0.3431 0.4763 0.0218 -0.0757 -0.0531 367 ARG C CD 9433 N NE . ARG C 308 ? 0.5414 0.5017 0.6359 0.0273 -0.0784 -0.0568 367 ARG C NE 9434 C CZ . ARG C 308 ? 0.5397 0.5016 0.6365 0.0283 -0.0780 -0.0592 367 ARG C CZ 9435 N NH1 . ARG C 308 ? 0.4503 0.4179 0.5528 0.0243 -0.0751 -0.0582 367 ARG C NH1 9436 N NH2 . ARG C 308 ? 0.5177 0.4755 0.6112 0.0336 -0.0805 -0.0627 367 ARG C NH2 9437 N N . HIS C 309 ? 0.4777 0.4455 0.5585 0.0117 -0.0625 -0.0423 368 HIS C N 9438 C CA . HIS C 309 ? 0.4802 0.4507 0.5625 0.0074 -0.0604 -0.0390 368 HIS C CA 9439 C C . HIS C 309 ? 0.4652 0.4407 0.5582 0.0038 -0.0607 -0.0383 368 HIS C C 9440 O O . HIS C 309 ? 0.3661 0.3430 0.4620 0.0011 -0.0608 -0.0361 368 HIS C O 9441 C CB . HIS C 309 ? 0.3676 0.3397 0.4438 0.0051 -0.0550 -0.0370 368 HIS C CB 9442 C CG . HIS C 309 ? 0.6147 0.5899 0.6918 0.0044 -0.0519 -0.0378 368 HIS C CG 9443 N ND1 . HIS C 309 ? 0.5670 0.5476 0.6511 0.0007 -0.0496 -0.0365 368 HIS C ND1 9444 C CD2 . HIS C 309 ? 0.4105 0.3839 0.4823 0.0071 -0.0507 -0.0396 368 HIS C CD2 9445 C CE1 . HIS C 309 ? 0.3751 0.3573 0.4580 0.0011 -0.0473 -0.0375 368 HIS C CE1 9446 N NE2 . HIS C 309 ? 0.5145 0.4924 0.5900 0.0049 -0.0478 -0.0394 368 HIS C NE2 9447 N N . HIS C 310 ? 0.7098 0.6879 0.8084 0.0039 -0.0607 -0.0399 369 HIS C N 9448 C CA . HIS C 310 ? 0.3653 0.3481 0.4744 0.0007 -0.0609 -0.0394 369 HIS C CA 9449 C C . HIS C 310 ? 0.4411 0.4236 0.5566 0.0033 -0.0649 -0.0426 369 HIS C C 9450 O O . HIS C 310 ? 0.4173 0.3967 0.5289 0.0072 -0.0664 -0.0453 369 HIS C O 9451 C CB . HIS C 310 ? 0.5386 0.5265 0.6495 -0.0029 -0.0559 -0.0375 369 HIS C CB 9452 C CG . HIS C 310 ? 0.7118 0.7016 0.8208 -0.0066 -0.0524 -0.0341 369 HIS C CG 9453 N ND1 . HIS C 310 ? 0.9280 0.9151 1.0281 -0.0062 -0.0509 -0.0328 369 HIS C ND1 9454 C CD2 . HIS C 310 ? 0.8592 0.8534 0.9742 -0.0107 -0.0501 -0.0317 369 HIS C CD2 9455 C CE1 . HIS C 310 ? 0.9181 0.9079 1.0187 -0.0098 -0.0479 -0.0299 369 HIS C CE1 9456 N NE2 . HIS C 310 ? 0.9192 0.9132 1.0286 -0.0126 -0.0473 -0.0291 369 HIS C NE2 9457 N N . PHE C 311 ? 0.6111 0.5967 0.7366 0.0011 -0.0664 -0.0424 370 PHE C N 9458 C CA . PHE C 311 ? 0.5028 0.4889 0.6357 0.0029 -0.0699 -0.0453 370 PHE C CA 9459 C C . PHE C 311 ? 0.5285 0.5204 0.6690 -0.0003 -0.0671 -0.0447 370 PHE C C 9460 O O . PHE C 311 ? 0.5684 0.5640 0.7114 -0.0044 -0.0637 -0.0417 370 PHE C O 9461 C CB . PHE C 311 ? 0.4815 0.4661 0.6206 0.0036 -0.0748 -0.0460 370 PHE C CB 9462 C CG . PHE C 311 ? 0.6023 0.5811 0.7345 0.0073 -0.0781 -0.0469 370 PHE C CG 9463 C CD1 . PHE C 311 ? 0.6136 0.5881 0.7415 0.0123 -0.0810 -0.0500 370 PHE C CD1 9464 C CD2 . PHE C 311 ? 0.5264 0.5039 0.6564 0.0059 -0.0785 -0.0445 370 PHE C CD2 9465 C CE1 . PHE C 311 ? 0.6723 0.6413 0.7938 0.0160 -0.0841 -0.0507 370 PHE C CE1 9466 C CE2 . PHE C 311 ? 0.4991 0.4711 0.6227 0.0094 -0.0817 -0.0451 370 PHE C CE2 9467 C CZ . PHE C 311 ? 0.5385 0.5062 0.6578 0.0145 -0.0845 -0.0482 370 PHE C CZ 9468 N N . GLU C 312 ? 0.5725 0.5650 0.7163 0.0016 -0.0685 -0.0475 371 GLU C N 9469 C CA . GLU C 312 ? 0.3679 0.3657 0.5189 -0.0010 -0.0661 -0.0471 371 GLU C CA 9470 C C . GLU C 312 ? 0.5436 0.5425 0.7050 -0.0003 -0.0703 -0.0494 371 GLU C C 9471 O O . GLU C 312 ? 0.4002 0.3956 0.5612 0.0037 -0.0745 -0.0527 371 GLU C O 9472 C CB . GLU C 312 ? 0.4683 0.4665 0.6137 0.0004 -0.0634 -0.0482 371 GLU C CB 9473 C CG . GLU C 312 ? 0.6576 0.6614 0.8089 -0.0027 -0.0602 -0.0472 371 GLU C CG 9474 C CD . GLU C 312 ? 0.7691 0.7757 0.9175 -0.0065 -0.0549 -0.0434 371 GLU C CD 9475 O OE1 . GLU C 312 ? 0.7609 0.7654 0.9034 -0.0070 -0.0539 -0.0416 371 GLU C OE1 9476 O OE2 . GLU C 312 ? 0.8714 0.8823 1.0233 -0.0088 -0.0519 -0.0422 371 GLU C OE2 9477 N N . SER C 313 ? 0.6227 0.6264 0.7936 -0.0040 -0.0691 -0.0479 372 SER C N 9478 C CA . SER C 313 ? 0.5831 0.5881 0.7648 -0.0038 -0.0728 -0.0498 372 SER C CA 9479 C C . SER C 313 ? 0.6209 0.6317 0.8115 -0.0072 -0.0702 -0.0487 372 SER C C 9480 O O . SER C 313 ? 0.5118 0.5257 0.7022 -0.0107 -0.0657 -0.0454 372 SER C O 9481 C CB . SER C 313 ? 0.4943 0.4978 0.6799 -0.0045 -0.0758 -0.0490 372 SER C CB 9482 O OG . SER C 313 ? 0.6319 0.6375 0.8172 -0.0085 -0.0723 -0.0451 372 SER C OG 9483 N N . PHE C 314 ? 0.7264 0.7385 0.9248 -0.0060 -0.0730 -0.0515 373 PHE C N 9484 C CA . PHE C 314 ? 0.6099 0.6276 0.8181 -0.0090 -0.0710 -0.0506 373 PHE C CA 9485 C C . PHE C 314 ? 0.7051 0.7250 0.9219 -0.0127 -0.0709 -0.0480 373 PHE C C 9486 O O . PHE C 314 ? 0.7151 0.7324 0.9337 -0.0120 -0.0744 -0.0485 373 PHE C O 9487 C CB . PHE C 314 ? 0.3921 0.4103 0.6066 -0.0066 -0.0744 -0.0544 373 PHE C CB 9488 C CG . PHE C 314 ? 0.4016 0.4181 0.6084 -0.0031 -0.0742 -0.0570 373 PHE C CG 9489 C CD1 . PHE C 314 ? 0.4250 0.4440 0.6274 -0.0045 -0.0695 -0.0555 373 PHE C CD1 9490 C CD2 . PHE C 314 ? 0.3656 0.3778 0.5695 0.0016 -0.0786 -0.0610 373 PHE C CD2 9491 C CE1 . PHE C 314 ? 0.4724 0.4898 0.6676 -0.0014 -0.0692 -0.0578 373 PHE C CE1 9492 C CE2 . PHE C 314 ? 0.5091 0.5195 0.7057 0.0049 -0.0782 -0.0634 373 PHE C CE2 9493 C CZ . PHE C 314 ? 0.4849 0.4980 0.6772 0.0033 -0.0735 -0.0618 373 PHE C CZ 9494 N N . ASN C 315 ? 0.7718 0.7964 0.9936 -0.0165 -0.0668 -0.0453 374 ASN C N 9495 C CA . ASN C 315 ? 0.7701 0.7974 1.0008 -0.0200 -0.0662 -0.0429 374 ASN C CA 9496 C C . ASN C 315 ? 0.7017 0.7339 0.9435 -0.0221 -0.0652 -0.0427 374 ASN C C 9497 O O . ASN C 315 ? 0.6902 0.7261 0.9343 -0.0253 -0.0607 -0.0397 374 ASN C O 9498 C CB . ASN C 315 ? 0.7556 0.7835 0.9810 -0.0229 -0.0617 -0.0388 374 ASN C CB 9499 C CG . ASN C 315 ? 0.7104 0.7397 0.9431 -0.0260 -0.0616 -0.0365 374 ASN C CG 9500 O OD1 . ASN C 315 ? 0.7400 0.7685 0.9799 -0.0255 -0.0656 -0.0380 374 ASN C OD1 9501 N ND2 . ASN C 315 ? 0.5490 0.5803 0.7800 -0.0291 -0.0570 -0.0328 374 ASN C ND2 9502 N N . VAL C 316 ? 0.5514 0.5835 0.8001 -0.0202 -0.0692 -0.0461 375 VAL C N 9503 C CA . VAL C 316 ? 0.8858 0.9225 1.1445 -0.0215 -0.0685 -0.0466 375 VAL C CA 9504 C C . VAL C 316 ? 0.8918 0.9288 1.1622 -0.0214 -0.0729 -0.0487 375 VAL C C 9505 O O . VAL C 316 ? 0.9449 0.9860 1.2258 -0.0237 -0.0720 -0.0480 375 VAL C O 9506 C CB . VAL C 316 ? 0.7591 0.7960 1.0138 -0.0189 -0.0685 -0.0492 375 VAL C CB 9507 C CG1 . VAL C 316 ? 0.6281 0.6607 0.8798 -0.0142 -0.0737 -0.0537 375 VAL C CG1 9508 C CG2 . VAL C 316 ? 0.7821 0.8240 1.0463 -0.0206 -0.0670 -0.0492 375 VAL C CG2 9509 N N . PHE C 317 ? 0.8103 0.8430 1.0788 -0.0186 -0.0777 -0.0511 376 PHE C N 9510 C CA . PHE C 317 ? 0.7370 0.7694 1.0158 -0.0182 -0.0824 -0.0532 376 PHE C CA 9511 C C . PHE C 317 ? 0.9581 0.9907 1.2410 -0.0213 -0.0818 -0.0502 376 PHE C C 9512 O O . PHE C 317 ? 1.0751 1.1043 1.3511 -0.0207 -0.0826 -0.0492 376 PHE C O 9513 C CB . PHE C 317 ? 0.7462 0.7737 1.0208 -0.0134 -0.0880 -0.0572 376 PHE C CB 9514 C CG . PHE C 317 ? 0.8843 0.9114 1.1557 -0.0100 -0.0889 -0.0606 376 PHE C CG 9515 C CD1 . PHE C 317 ? 0.9796 1.0094 1.2604 -0.0095 -0.0907 -0.0633 376 PHE C CD1 9516 C CD2 . PHE C 317 ? 0.8737 0.8976 1.1325 -0.0073 -0.0879 -0.0612 376 PHE C CD2 9517 C CE1 . PHE C 317 ? 0.9126 0.9420 1.1901 -0.0063 -0.0916 -0.0665 376 PHE C CE1 9518 C CE2 . PHE C 317 ? 0.9171 0.9405 1.1725 -0.0041 -0.0886 -0.0644 376 PHE C CE2 9519 C CZ . PHE C 317 ? 0.9722 0.9984 1.2368 -0.0036 -0.0905 -0.0670 376 PHE C CZ 9520 N N . ASN C 318 ? 1.1747 1.2115 1.4690 -0.0246 -0.0803 -0.0487 377 ASN C N 9521 C CA . ASN C 318 ? 1.3161 1.3539 1.6152 -0.0280 -0.0789 -0.0456 377 ASN C CA 9522 C C . ASN C 318 ? 1.2357 1.2694 1.5343 -0.0267 -0.0834 -0.0465 377 ASN C C 9523 O O . ASN C 318 ? 1.0892 1.1200 1.3789 -0.0266 -0.0827 -0.0449 377 ASN C O 9524 C CB . ASN C 318 ? 1.4513 1.4937 1.7643 -0.0308 -0.0779 -0.0450 377 ASN C CB 9525 C CG . ASN C 318 ? 1.5885 1.6328 1.9056 -0.0348 -0.0744 -0.0410 377 ASN C CG 9526 O OD1 . ASN C 318 ? 1.6376 1.6808 1.9465 -0.0360 -0.0713 -0.0381 377 ASN C OD1 9527 N ND2 . ASN C 318 ? 1.5763 1.6234 1.9061 -0.0370 -0.0748 -0.0407 377 ASN C ND2 9528 N N . ASP C 319 ? 1.3083 1.3419 1.6166 -0.0258 -0.0880 -0.0491 378 ASP C N 9529 C CA . ASP C 319 ? 1.3070 1.3366 1.6155 -0.0243 -0.0928 -0.0504 378 ASP C CA 9530 C C . ASP C 319 ? 1.1840 1.2084 1.4802 -0.0202 -0.0955 -0.0520 378 ASP C C 9531 O O . ASP C 319 ? 1.3163 1.3381 1.6041 -0.0205 -0.0944 -0.0499 378 ASP C O 9532 C CB . ASP C 319 ? 1.3464 1.3766 1.6670 -0.0232 -0.0977 -0.0537 378 ASP C CB 9533 C CG . ASP C 319 ? 1.3324 1.3671 1.6660 -0.0272 -0.0957 -0.0519 378 ASP C CG 9534 O OD1 . ASP C 319 ? 1.1810 1.2173 1.5141 -0.0307 -0.0914 -0.0480 378 ASP C OD1 9535 O OD2 . ASP C 319 ? 1.4871 1.5235 1.8313 -0.0268 -0.0984 -0.0544 378 ASP C OD2 9536 N N . LEU C 320 ? 0.9632 0.9860 1.2588 -0.0164 -0.0990 -0.0560 379 LEU C N 9537 C CA . LEU C 320 ? 0.9509 0.9686 1.2359 -0.0118 -0.1020 -0.0584 379 LEU C CA 9538 C C . LEU C 320 ? 0.7963 0.8113 1.0678 -0.0116 -0.0992 -0.0559 379 LEU C C 9539 O O . LEU C 320 ? 0.6468 0.6644 0.9149 -0.0145 -0.0938 -0.0527 379 LEU C O 9540 C CB . LEU C 320 ? 0.8203 0.8387 1.1047 -0.0089 -0.1026 -0.0617 379 LEU C CB 9541 C CG . LEU C 320 ? 0.8762 0.8966 1.1727 -0.0081 -0.1062 -0.0650 379 LEU C CG 9542 C CD1 . LEU C 320 ? 0.8087 0.8351 1.1139 -0.0119 -0.1021 -0.0634 379 LEU C CD1 9543 C CD2 . LEU C 320 ? 0.9067 0.9243 1.1992 -0.0030 -0.1097 -0.0694 379 LEU C CD2 9544 N N . PRO C 321 ? 0.6548 0.6646 0.9185 -0.0078 -0.1028 -0.0574 380 PRO C N 9545 C CA . PRO C 321 ? 0.6404 0.6470 0.8910 -0.0070 -0.1008 -0.0556 380 PRO C CA 9546 C C . PRO C 321 ? 0.5662 0.5722 0.8084 -0.0047 -0.0987 -0.0568 380 PRO C C 9547 O O . PRO C 321 ? 0.6968 0.7021 0.9408 -0.0015 -0.1013 -0.0604 380 PRO C O 9548 C CB . PRO C 321 ? 0.5079 0.5090 0.7551 -0.0035 -0.1062 -0.0572 380 PRO C CB 9549 C CG . PRO C 321 ? 0.5661 0.5668 0.8216 -0.0007 -0.1113 -0.0612 380 PRO C CG 9550 C CD . PRO C 321 ? 0.4663 0.4726 0.7340 -0.0044 -0.1094 -0.0608 380 PRO C CD 9551 N N . SER C 322 ? 0.6425 0.6486 0.8758 -0.0061 -0.0940 -0.0541 381 SER C N 9552 C CA . SER C 322 ? 0.5665 0.5719 0.7912 -0.0040 -0.0918 -0.0550 381 SER C CA 9553 C C . SER C 322 ? 0.7186 0.7180 0.9330 0.0007 -0.0947 -0.0570 381 SER C C 9554 O O . SER C 322 ? 0.6643 0.6602 0.8768 0.0019 -0.0978 -0.0568 381 SER C O 9555 C CB . SER C 322 ? 0.5544 0.5626 0.7741 -0.0075 -0.0855 -0.0513 381 SER C CB 9556 O OG . SER C 322 ? 0.6246 0.6312 0.8394 -0.0092 -0.0843 -0.0484 381 SER C OG 9557 N N . TYR C 323 ? 0.6548 0.6530 0.8625 0.0035 -0.0938 -0.0588 382 TYR C N 9558 C CA . TYR C 323 ? 0.6556 0.6481 0.8529 0.0082 -0.0960 -0.0606 382 TYR C CA 9559 C C . TYR C 323 ? 0.5630 0.5551 0.7496 0.0081 -0.0912 -0.0591 382 TYR C C 9560 O O . TYR C 323 ? 0.5640 0.5601 0.7515 0.0054 -0.0870 -0.0578 382 TYR C O 9561 C CB . TYR C 323 ? 0.5741 0.5642 0.7734 0.0130 -0.1005 -0.0653 382 TYR C CB 9562 C CG . TYR C 323 ? 0.5817 0.5754 0.7844 0.0128 -0.0986 -0.0670 382 TYR C CG 9563 C CD1 . TYR C 323 ? 0.5123 0.5101 0.7269 0.0110 -0.0997 -0.0680 382 TYR C CD1 9564 C CD2 . TYR C 323 ? 0.6414 0.6343 0.8352 0.0145 -0.0956 -0.0676 382 TYR C CD2 9565 C CE1 . TYR C 323 ? 0.6356 0.6367 0.8531 0.0109 -0.0979 -0.0696 382 TYR C CE1 9566 C CE2 . TYR C 323 ? 0.7147 0.7108 0.9111 0.0143 -0.0939 -0.0691 382 TYR C CE2 9567 C CZ . TYR C 323 ? 0.6390 0.6392 0.8472 0.0126 -0.0951 -0.0701 382 TYR C CZ 9568 O OH . TYR C 323 ? 0.5299 0.5334 0.7407 0.0125 -0.0934 -0.0715 382 TYR C OH 9569 N N . ALA C 324 ? 0.5635 0.5506 0.7398 0.0111 -0.0920 -0.0592 383 ALA C N 9570 C CA . ALA C 324 ? 0.6228 0.6091 0.7886 0.0112 -0.0877 -0.0579 383 ALA C CA 9571 C C . ALA C 324 ? 0.5248 0.5104 0.6874 0.0144 -0.0874 -0.0610 383 ALA C C 9572 O O . ALA C 324 ? 0.5300 0.5120 0.6918 0.0190 -0.0914 -0.0645 383 ALA C O 9573 C CB . ALA C 324 ? 0.5026 0.4836 0.6587 0.0134 -0.0887 -0.0571 383 ALA C CB 9574 N N . ILE C 325 ? 0.5143 0.5033 0.6750 0.0121 -0.0826 -0.0597 384 ILE C N 9575 C CA . ILE C 325 ? 0.4899 0.4785 0.6466 0.0148 -0.0817 -0.0622 384 ILE C CA 9576 C C . ILE C 325 ? 0.4204 0.4039 0.5646 0.0183 -0.0810 -0.0628 384 ILE C C 9577 O O . ILE C 325 ? 0.5384 0.5216 0.6761 0.0165 -0.0775 -0.0599 384 ILE C O 9578 C CB . ILE C 325 ? 0.6727 0.6667 0.8314 0.0112 -0.0768 -0.0605 384 ILE C CB 9579 C CG1 . ILE C 325 ? 0.4838 0.4830 0.6550 0.0075 -0.0770 -0.0595 384 ILE C CG1 9580 C CG2 . ILE C 325 ? 0.5232 0.5167 0.6776 0.0142 -0.0760 -0.0633 384 ILE C CG2 9581 C CD1 . ILE C 325 ? 0.4204 0.4249 0.5936 0.0034 -0.0719 -0.0569 384 ILE C CD1 9582 N N . HIS C 326 ? 0.4317 0.4111 0.5726 0.0235 -0.0842 -0.0665 385 HIS C N 9583 C CA . HIS C 326 ? 0.4077 0.3819 0.5370 0.0273 -0.0837 -0.0673 385 HIS C CA 9584 C C . HIS C 326 ? 0.3804 0.3558 0.5031 0.0270 -0.0789 -0.0670 385 HIS C C 9585 O O . HIS C 326 ? 0.4131 0.3878 0.5344 0.0299 -0.0794 -0.0700 385 HIS C O 9586 C CB . HIS C 326 ? 0.3851 0.3541 0.5131 0.0334 -0.0888 -0.0714 385 HIS C CB 9587 C CG . HIS C 326 ? 0.5042 0.4712 0.6374 0.0343 -0.0937 -0.0718 385 HIS C CG 9588 N ND1 . HIS C 326 ? 0.5394 0.5023 0.6738 0.0394 -0.0990 -0.0755 385 HIS C ND1 9589 C CD2 . HIS C 326 ? 0.6352 0.6035 0.7727 0.0309 -0.0943 -0.0689 385 HIS C CD2 9590 C CE1 . HIS C 326 ? 0.3899 0.3518 0.5291 0.0391 -0.1026 -0.0748 385 HIS C CE1 9591 N NE2 . HIS C 326 ? 0.5916 0.5568 0.7327 0.0339 -0.0998 -0.0709 385 HIS C NE2 9592 N N . LEU C 327 ? 0.5785 0.5558 0.6971 0.0234 -0.0744 -0.0634 386 LEU C N 9593 C CA . LEU C 327 ? 0.4999 0.4787 0.6125 0.0225 -0.0696 -0.0627 386 LEU C CA 9594 C C . LEU C 327 ? 0.5483 0.5238 0.6502 0.0230 -0.0669 -0.0609 386 LEU C C 9595 O O . LEU C 327 ? 0.4979 0.4703 0.5974 0.0238 -0.0686 -0.0599 386 LEU C O 9596 C CB . LEU C 327 ? 0.5283 0.5137 0.6473 0.0173 -0.0661 -0.0602 386 LEU C CB 9597 C CG . LEU C 327 ? 0.7019 0.6909 0.8283 0.0126 -0.0656 -0.0569 386 LEU C CG 9598 C CD1 . LEU C 327 ? 0.7831 0.7695 0.9043 0.0118 -0.0650 -0.0544 386 LEU C CD1 9599 C CD2 . LEU C 327 ? 0.6959 0.6908 0.8260 0.0082 -0.0611 -0.0545 386 LEU C CD2 9600 N N . ASP C 328 ? 0.5269 0.5033 0.6226 0.0225 -0.0626 -0.0603 387 ASP C N 9601 C CA . ASP C 328 ? 0.4462 0.4202 0.5322 0.0225 -0.0594 -0.0584 387 ASP C CA 9602 C C . ASP C 328 ? 0.5229 0.4902 0.6016 0.0273 -0.0620 -0.0601 387 ASP C C 9603 O O . ASP C 328 ? 0.5232 0.4883 0.6000 0.0270 -0.0629 -0.0584 387 ASP C O 9604 C CB . ASP C 328 ? 0.4661 0.4430 0.5539 0.0176 -0.0570 -0.0543 387 ASP C CB 9605 C CG . ASP C 328 ? 0.6777 0.6608 0.7710 0.0130 -0.0536 -0.0522 387 ASP C CG 9606 O OD1 . ASP C 328 ? 0.8534 0.8395 0.9510 0.0091 -0.0524 -0.0493 387 ASP C OD1 9607 O OD2 . ASP C 328 ? 0.8769 0.8619 0.9703 0.0134 -0.0521 -0.0535 387 ASP C OD2 9608 N N . HIS C 329 ? 0.3827 0.3467 0.4572 0.0319 -0.0632 -0.0635 388 HIS C N 9609 C CA . HIS C 329 ? 0.4256 0.3829 0.4930 0.0371 -0.0656 -0.0654 388 HIS C CA 9610 C C . HIS C 329 ? 0.5674 0.5218 0.6242 0.0392 -0.0620 -0.0656 388 HIS C C 9611 O O . HIS C 329 ? 0.4006 0.3494 0.4510 0.0442 -0.0636 -0.0680 388 HIS C O 9612 C CB . HIS C 329 ? 0.3892 0.3441 0.4602 0.0416 -0.0704 -0.0695 388 HIS C CB 9613 C CG . HIS C 329 ? 0.5105 0.4681 0.5923 0.0400 -0.0742 -0.0695 388 HIS C CG 9614 N ND1 . HIS C 329 ? 0.4840 0.4448 0.5738 0.0397 -0.0759 -0.0717 388 HIS C ND1 9615 C CD2 . HIS C 329 ? 0.4485 0.4057 0.5341 0.0385 -0.0767 -0.0678 388 HIS C CD2 9616 C CE1 . HIS C 329 ? 0.6623 0.6247 0.7608 0.0381 -0.0792 -0.0712 388 HIS C CE1 9617 N NE2 . HIS C 329 ? 0.4238 0.3841 0.5199 0.0373 -0.0797 -0.0689 388 HIS C NE2 9618 N N . GLY C 330 ? 0.3849 0.3429 0.4397 0.0354 -0.0572 -0.0633 389 GLY C N 9619 C CA . GLY C 330 ? 0.3857 0.3416 0.4310 0.0367 -0.0534 -0.0633 389 GLY C CA 9620 C C . GLY C 330 ? 0.4539 0.4042 0.4908 0.0394 -0.0532 -0.0627 389 GLY C C 9621 O O . GLY C 330 ? 0.5146 0.4612 0.5432 0.0425 -0.0515 -0.0640 389 GLY C O 9622 N N . ARG C 331 ? 0.3872 0.3367 0.4258 0.0381 -0.0550 -0.0607 390 ARG C N 9623 C CA . ARG C 331 ? 0.4407 0.3851 0.4716 0.0404 -0.0548 -0.0599 390 ARG C CA 9624 C C . ARG C 331 ? 0.3931 0.3321 0.4235 0.0455 -0.0599 -0.0622 390 ARG C C 9625 O O . ARG C 331 ? 0.4899 0.4255 0.5172 0.0466 -0.0612 -0.0609 390 ARG C O 9626 C CB . ARG C 331 ? 0.3861 0.3329 0.4179 0.0358 -0.0531 -0.0560 390 ARG C CB 9627 C CG . ARG C 331 ? 0.3839 0.3330 0.4109 0.0327 -0.0476 -0.0537 390 ARG C CG 9628 C CD . ARG C 331 ? 0.5280 0.4811 0.5583 0.0275 -0.0458 -0.0501 390 ARG C CD 9629 N NE . ARG C 331 ? 0.5062 0.4610 0.5315 0.0248 -0.0407 -0.0481 390 ARG C NE 9630 C CZ . ARG C 331 ? 0.6219 0.5807 0.6493 0.0201 -0.0382 -0.0450 390 ARG C CZ 9631 N NH1 . ARG C 331 ? 0.5663 0.5278 0.6006 0.0175 -0.0400 -0.0436 390 ARG C NH1 9632 N NH2 . ARG C 331 ? 0.5718 0.5319 0.5944 0.0182 -0.0337 -0.0435 390 ARG C NH2 9633 N N . ALA C 332 ? 0.4122 0.3503 0.4456 0.0488 -0.0628 -0.0656 391 ALA C N 9634 C CA . ALA C 332 ? 0.3981 0.3307 0.4308 0.0543 -0.0677 -0.0682 391 ALA C CA 9635 C C . ALA C 332 ? 0.4549 0.3818 0.4784 0.0599 -0.0670 -0.0708 391 ALA C C 9636 O O . ALA C 332 ? 0.5187 0.4466 0.5378 0.0595 -0.0630 -0.0711 391 ALA C O 9637 C CB . ALA C 332 ? 0.3982 0.3331 0.4402 0.0547 -0.0718 -0.0706 391 ALA C CB 9638 N N . PHE C 333 ? 0.4053 0.3263 0.4260 0.0653 -0.0708 -0.0727 392 PHE C N 9639 C CA . PHE C 333 ? 0.6428 0.5578 0.6551 0.0715 -0.0706 -0.0754 392 PHE C CA 9640 C C . PHE C 333 ? 0.4667 0.3797 0.4697 0.0712 -0.0656 -0.0736 392 PHE C C 9641 O O . PHE C 333 ? 0.4524 0.3631 0.4493 0.0741 -0.0633 -0.0756 392 PHE C O 9642 C CB . PHE C 333 ? 0.4105 0.3264 0.4246 0.0737 -0.0710 -0.0791 392 PHE C CB 9643 C CG . PHE C 333 ? 0.4298 0.3466 0.4524 0.0752 -0.0763 -0.0816 392 PHE C CG 9644 C CD1 . PHE C 333 ? 0.6023 0.5132 0.6234 0.0814 -0.0809 -0.0844 392 PHE C CD1 9645 C CD2 . PHE C 333 ? 0.5935 0.5168 0.6256 0.0706 -0.0766 -0.0813 392 PHE C CD2 9646 C CE1 . PHE C 333 ? 0.4266 0.3383 0.4557 0.0829 -0.0858 -0.0869 392 PHE C CE1 9647 C CE2 . PHE C 333 ? 0.4224 0.3465 0.4626 0.0720 -0.0814 -0.0837 392 PHE C CE2 9648 C CZ . PHE C 333 ? 0.4272 0.3455 0.4660 0.0781 -0.0861 -0.0865 392 PHE C CZ 9649 N N . GLY C 334 ? 0.5901 0.5041 0.5919 0.0677 -0.0639 -0.0700 393 GLY C N 9650 C CA . GLY C 334 ? 0.4072 0.3196 0.4007 0.0670 -0.0593 -0.0681 393 GLY C CA 9651 C C . GLY C 334 ? 0.6378 0.5427 0.6231 0.0728 -0.0603 -0.0688 393 GLY C C 9652 O O . GLY C 334 ? 0.4123 0.3144 0.3898 0.0742 -0.0566 -0.0687 393 GLY C O 9653 N N . ARG C 335 ? 0.4775 0.3789 0.4645 0.0761 -0.0652 -0.0696 394 ARG C N 9654 C CA . ARG C 335 ? 0.5614 0.4553 0.5408 0.0817 -0.0666 -0.0701 394 ARG C CA 9655 C C . ARG C 335 ? 0.6159 0.5054 0.5968 0.0878 -0.0719 -0.0736 394 ARG C C 9656 O O . ARG C 335 ? 0.7354 0.6271 0.7241 0.0869 -0.0760 -0.0741 394 ARG C O 9657 C CB . ARG C 335 ? 0.4370 0.3303 0.4155 0.0796 -0.0669 -0.0665 394 ARG C CB 9658 C CG . ARG C 335 ? 0.5680 0.4655 0.5450 0.0737 -0.0619 -0.0631 394 ARG C CG 9659 C CD . ARG C 335 ? 0.5492 0.4425 0.5165 0.0759 -0.0580 -0.0625 394 ARG C CD 9660 N NE . ARG C 335 ? 0.6389 0.5262 0.6011 0.0799 -0.0601 -0.0617 394 ARG C NE 9661 C CZ . ARG C 335 ? 0.5667 0.4544 0.5285 0.0774 -0.0602 -0.0586 394 ARG C CZ 9662 N NH1 . ARG C 335 ? 0.7663 0.6600 0.7325 0.0709 -0.0582 -0.0560 394 ARG C NH1 9663 N NH2 . ARG C 335 ? 0.6888 0.5707 0.6456 0.0814 -0.0623 -0.0580 394 ARG C NH2 9664 N N . SER C 336 ? 0.5021 0.3854 0.4757 0.0941 -0.0718 -0.0760 395 SER C N 9665 C CA . SER C 336 ? 0.5662 0.4446 0.5402 0.1006 -0.0768 -0.0794 395 SER C CA 9666 C C . SER C 336 ? 0.5082 0.3801 0.4776 0.1051 -0.0797 -0.0785 395 SER C C 9667 O O . SER C 336 ? 0.5890 0.4569 0.5595 0.1103 -0.0846 -0.0808 395 SER C O 9668 C CB . SER C 336 ? 0.5198 0.3950 0.4887 0.1054 -0.0752 -0.0831 395 SER C CB 9669 O OG . SER C 336 ? 0.4910 0.3614 0.4500 0.1082 -0.0716 -0.0825 395 SER C OG 9670 N N . ASP C 337 ? 0.5009 0.3719 0.4652 0.1032 -0.0767 -0.0752 396 ASP C N 9671 C CA . ASP C 337 ? 0.6238 0.4885 0.5826 0.1075 -0.0788 -0.0741 396 ASP C CA 9672 C C . ASP C 337 ? 0.6834 0.5506 0.6457 0.1031 -0.0803 -0.0704 396 ASP C C 9673 O O . ASP C 337 ? 0.5864 0.4492 0.5440 0.1054 -0.0813 -0.0686 396 ASP C O 9674 C CB . ASP C 337 ? 0.6887 0.5489 0.6373 0.1099 -0.0742 -0.0733 396 ASP C CB 9675 C CG . ASP C 337 ? 0.7414 0.6064 0.6891 0.1034 -0.0687 -0.0701 396 ASP C CG 9676 O OD1 . ASP C 337 ? 0.9454 0.8071 0.8856 0.1043 -0.0654 -0.0685 396 ASP C OD1 9677 O OD2 . ASP C 337 ? 0.8439 0.7158 0.7982 0.0973 -0.0677 -0.0692 396 ASP C OD2 9678 N N . PHE C 338 ? 0.5199 0.3941 0.4904 0.0969 -0.0803 -0.0692 397 PHE C N 9679 C CA . PHE C 338 ? 0.5367 0.4139 0.5108 0.0922 -0.0813 -0.0658 397 PHE C CA 9680 C C . PHE C 338 ? 0.4216 0.3037 0.4061 0.0891 -0.0850 -0.0662 397 PHE C C 9681 O O . PHE C 338 ? 0.6452 0.5323 0.6353 0.0860 -0.0838 -0.0674 397 PHE C O 9682 C CB . PHE C 338 ? 0.6167 0.4982 0.5889 0.0862 -0.0757 -0.0626 397 PHE C CB 9683 C CG . PHE C 338 ? 0.5498 0.4356 0.5267 0.0806 -0.0762 -0.0592 397 PHE C CG 9684 C CD1 . PHE C 338 ? 0.6660 0.5486 0.6408 0.0819 -0.0790 -0.0574 397 PHE C CD1 9685 C CD2 . PHE C 338 ? 0.4125 0.3056 0.3957 0.0741 -0.0739 -0.0580 397 PHE C CD2 9686 C CE1 . PHE C 338 ? 0.4714 0.3579 0.4503 0.0768 -0.0795 -0.0544 397 PHE C CE1 9687 C CE2 . PHE C 338 ? 0.5193 0.4163 0.5067 0.0691 -0.0743 -0.0550 397 PHE C CE2 9688 C CZ . PHE C 338 ? 0.5520 0.4457 0.5371 0.0704 -0.0770 -0.0533 397 PHE C CZ 9689 N N . ASP C 339 ? 0.6230 0.5033 0.6098 0.0900 -0.0895 -0.0652 398 ASP C N 9690 C CA . ASP C 339 ? 0.5684 0.4532 0.5650 0.0867 -0.0930 -0.0652 398 ASP C CA 9691 C C . ASP C 339 ? 0.5820 0.4705 0.5806 0.0809 -0.0919 -0.0612 398 ASP C C 9692 O O . ASP C 339 ? 0.6835 0.5686 0.6774 0.0821 -0.0928 -0.0591 398 ASP C O 9693 C CB . ASP C 339 ? 0.4234 0.3037 0.4221 0.0923 -0.0995 -0.0675 398 ASP C CB 9694 C CG . ASP C 339 ? 0.5156 0.3909 0.5107 0.0991 -0.1007 -0.0714 398 ASP C CG 9695 O OD1 . ASP C 339 ? 0.5120 0.3812 0.5043 0.1052 -0.1049 -0.0728 398 ASP C OD1 9696 O OD2 . ASP C 339 ? 0.6186 0.4959 0.6133 0.0986 -0.0974 -0.0732 398 ASP C OD2 9697 N N . ASP C 340 ? 0.5255 0.4210 0.5310 0.0747 -0.0898 -0.0601 399 ASP C N 9698 C CA . ASP C 340 ? 0.4731 0.3726 0.4810 0.0689 -0.0886 -0.0564 399 ASP C CA 9699 C C . ASP C 340 ? 0.4979 0.3986 0.5134 0.0681 -0.0936 -0.0563 399 ASP C C 9700 O O . ASP C 340 ? 0.4874 0.3930 0.5115 0.0648 -0.0943 -0.0570 399 ASP C O 9701 C CB . ASP C 340 ? 0.4965 0.4027 0.5074 0.0627 -0.0834 -0.0551 399 ASP C CB 9702 C CG . ASP C 340 ? 0.5582 0.4682 0.5707 0.0570 -0.0817 -0.0513 399 ASP C CG 9703 O OD1 . ASP C 340 ? 0.7429 0.6499 0.7517 0.0580 -0.0833 -0.0495 399 ASP C OD1 9704 O OD2 . ASP C 340 ? 0.5195 0.4355 0.5368 0.0517 -0.0786 -0.0502 399 ASP C OD2 9705 N N . ASP C 341 ? 0.4361 0.3323 0.4486 0.0710 -0.0972 -0.0554 400 ASP C N 9706 C CA . ASP C 341 ? 0.6423 0.5387 0.6612 0.0709 -0.1024 -0.0554 400 ASP C CA 9707 C C . ASP C 341 ? 0.5830 0.4856 0.6082 0.0639 -0.1012 -0.0526 400 ASP C C 9708 O O . ASP C 341 ? 0.5727 0.4768 0.6049 0.0629 -0.1050 -0.0527 400 ASP C O 9709 C CB . ASP C 341 ? 0.6734 0.5633 0.6863 0.0757 -0.1062 -0.0547 400 ASP C CB 9710 C CG . ASP C 341 ? 0.8874 0.7707 0.8949 0.0832 -0.1082 -0.0576 400 ASP C CG 9711 O OD1 . ASP C 341 ? 0.8708 0.7544 0.8822 0.0854 -0.1095 -0.0610 400 ASP C OD1 9712 O OD2 . ASP C 341 ? 0.9386 0.8164 0.9379 0.0870 -0.1085 -0.0566 400 ASP C OD2 9713 N N . ASP C 342 ? 0.4041 0.3102 0.4268 0.0594 -0.0958 -0.0502 401 ASP C N 9714 C CA . ASP C 342 ? 0.5668 0.4790 0.5952 0.0528 -0.0939 -0.0477 401 ASP C CA 9715 C C . ASP C 342 ? 0.5209 0.4383 0.5594 0.0501 -0.0943 -0.0493 401 ASP C C 9716 O O . ASP C 342 ? 0.5382 0.4597 0.5836 0.0459 -0.0949 -0.0479 401 ASP C O 9717 C CB . ASP C 342 ? 0.4983 0.4130 0.5218 0.0489 -0.0879 -0.0451 401 ASP C CB 9718 C CG . ASP C 342 ? 0.5503 0.4621 0.5667 0.0490 -0.0877 -0.0424 401 ASP C CG 9719 O OD1 . ASP C 342 ? 0.5105 0.4173 0.5241 0.0532 -0.0919 -0.0427 401 ASP C OD1 9720 O OD2 . ASP C 342 ? 0.5281 0.4427 0.5419 0.0450 -0.0833 -0.0399 401 ASP C OD2 9721 N N . ILE C 343 ? 0.4156 0.3327 0.4546 0.0525 -0.0937 -0.0522 402 ILE C N 9722 C CA . ILE C 343 ? 0.6095 0.5315 0.6576 0.0502 -0.0938 -0.0539 402 ILE C CA 9723 C C . ILE C 343 ? 0.6436 0.5652 0.6996 0.0517 -0.0996 -0.0555 402 ILE C C 9724 O O . ILE C 343 ? 0.5318 0.4582 0.5968 0.0479 -0.1000 -0.0553 402 ILE C O 9725 C CB . ILE C 343 ? 0.5073 0.4285 0.5533 0.0530 -0.0921 -0.0568 402 ILE C CB 9726 C CG1 . ILE C 343 ? 0.7329 0.6547 0.7714 0.0515 -0.0862 -0.0552 402 ILE C CG1 9727 C CG2 . ILE C 343 ? 0.4433 0.3696 0.4987 0.0508 -0.0923 -0.0585 402 ILE C CG2 9728 C CD1 . ILE C 343 ? 0.4002 0.3199 0.4345 0.0551 -0.0846 -0.0580 402 ILE C CD1 9729 N N . ILE C 344 ? 0.4093 0.3249 0.4619 0.0573 -0.1041 -0.0570 403 ILE C N 9730 C CA . ILE C 344 ? 0.5526 0.4670 0.6121 0.0594 -0.1100 -0.0589 403 ILE C CA 9731 C C . ILE C 344 ? 0.4202 0.3346 0.4814 0.0574 -0.1125 -0.0562 403 ILE C C 9732 O O . ILE C 344 ? 0.5960 0.5087 0.6619 0.0594 -0.1177 -0.0573 403 ILE C O 9733 C CB . ILE C 344 ? 0.4088 0.3166 0.4641 0.0671 -0.1141 -0.0622 403 ILE C CB 9734 C CG1 . ILE C 344 ? 0.5954 0.5033 0.6595 0.0692 -0.1195 -0.0652 403 ILE C CG1 9735 C CG2 . ILE C 344 ? 0.5233 0.4251 0.5698 0.0707 -0.1156 -0.0606 403 ILE C CG2 9736 C CD1 . ILE C 344 ? 0.4078 0.3218 0.4811 0.0656 -0.1181 -0.0666 403 ILE C CD1 9737 N N . LEU C 345 ? 0.5382 0.4543 0.5955 0.0534 -0.1088 -0.0527 404 LEU C N 9738 C CA . LEU C 345 ? 0.5899 0.5063 0.6481 0.0509 -0.1105 -0.0499 404 LEU C CA 9739 C C . LEU C 345 ? 0.6561 0.5768 0.7253 0.0474 -0.1129 -0.0499 404 LEU C C 9740 O O . LEU C 345 ? 0.8062 0.7251 0.8771 0.0480 -0.1169 -0.0491 404 LEU C O 9741 C CB . LEU C 345 ? 0.3977 0.3162 0.4505 0.0467 -0.1053 -0.0464 404 LEU C CB 9742 C CG . LEU C 345 ? 0.7131 0.6263 0.7548 0.0499 -0.1048 -0.0451 404 LEU C CG 9743 C CD1 . LEU C 345 ? 0.5451 0.4610 0.5826 0.0452 -0.0997 -0.0417 404 LEU C CD1 9744 C CD2 . LEU C 345 ? 0.4023 0.3105 0.4423 0.0537 -0.1104 -0.0450 404 LEU C CD2 9745 N N . PRO C 346 ? 0.6831 0.6094 0.7598 0.0438 -0.1104 -0.0506 405 PRO C N 9746 C CA . PRO C 346 ? 0.4850 0.4149 0.5724 0.0409 -0.1129 -0.0508 405 PRO C CA 9747 C C . PRO C 346 ? 0.6463 0.5727 0.7380 0.0454 -0.1195 -0.0535 405 PRO C C 9748 O O . PRO C 346 ? 0.5318 0.4589 0.6292 0.0440 -0.1227 -0.0528 405 PRO C O 9749 C CB . PRO C 346 ? 0.3984 0.3338 0.4921 0.0377 -0.1094 -0.0517 405 PRO C CB 9750 C CG . PRO C 346 ? 0.5755 0.5118 0.6615 0.0361 -0.1037 -0.0501 405 PRO C CG 9751 C CD . PRO C 346 ? 0.5437 0.4736 0.6194 0.0413 -0.1049 -0.0506 405 PRO C CD 9752 N N . LEU C 347 ? 0.5058 0.4283 0.5947 0.0509 -0.1216 -0.0567 406 LEU C N 9753 C CA . LEU C 347 ? 0.4849 0.4035 0.5769 0.0559 -0.1280 -0.0595 406 LEU C CA 9754 C C . LEU C 347 ? 0.5655 0.4795 0.6531 0.0581 -0.1317 -0.0579 406 LEU C C 9755 O O . LEU C 347 ? 0.7024 0.6156 0.7958 0.0589 -0.1366 -0.0585 406 LEU C O 9756 C CB . LEU C 347 ? 0.4933 0.4079 0.5812 0.0619 -0.1290 -0.0631 406 LEU C CB 9757 C CG . LEU C 347 ? 0.4108 0.3205 0.5007 0.0680 -0.1357 -0.0663 406 LEU C CG 9758 C CD1 . LEU C 347 ? 0.4099 0.3234 0.5122 0.0661 -0.1390 -0.0679 406 LEU C CD1 9759 C CD2 . LEU C 347 ? 0.5026 0.4083 0.5872 0.0739 -0.1360 -0.0697 406 LEU C CD2 9760 N N . ARG C 348 ? 0.6915 0.6024 0.7689 0.0591 -0.1295 -0.0558 407 ARG C N 9761 C CA . ARG C 348 ? 0.7072 0.6133 0.7790 0.0616 -0.1327 -0.0541 407 ARG C CA 9762 C C . ARG C 348 ? 0.6226 0.5320 0.6976 0.0563 -0.1324 -0.0508 407 ARG C C 9763 O O . ARG C 348 ? 0.5254 0.4320 0.6002 0.0577 -0.1367 -0.0500 407 ARG C O 9764 C CB . ARG C 348 ? 0.5962 0.4981 0.6560 0.0644 -0.1301 -0.0529 407 ARG C CB 9765 C CG . ARG C 348 ? 0.8035 0.7009 0.8590 0.0706 -0.1310 -0.0561 407 ARG C CG 9766 C CD . ARG C 348 ? 0.9585 0.8530 1.0031 0.0721 -0.1268 -0.0548 407 ARG C CD 9767 N NE . ARG C 348 ? 1.2241 1.1148 1.2614 0.0732 -0.1278 -0.0520 407 ARG C NE 9768 C CZ . ARG C 348 ? 1.2572 1.1461 1.2854 0.0733 -0.1239 -0.0500 407 ARG C CZ 9769 N NH1 . ARG C 348 ? 1.2370 1.1275 1.2623 0.0723 -0.1189 -0.0504 407 ARG C NH1 9770 N NH2 . ARG C 348 ? 1.1181 1.0036 1.1402 0.0743 -0.1252 -0.0475 407 ARG C NH2 9771 N N . GLN C 349 ? 0.5668 0.4819 0.6444 0.0502 -0.1272 -0.0488 408 GLN C N 9772 C CA . GLN C 349 ? 0.4705 0.3890 0.5507 0.0450 -0.1262 -0.0457 408 GLN C CA 9773 C C . GLN C 349 ? 0.6422 0.5643 0.7341 0.0423 -0.1288 -0.0465 408 GLN C C 9774 O O . GLN C 349 ? 0.7375 0.6593 0.8316 0.0411 -0.1316 -0.0450 408 GLN C O 9775 C CB . GLN C 349 ? 0.4829 0.4058 0.5605 0.0398 -0.1194 -0.0432 408 GLN C CB 9776 C CG . GLN C 349 ? 0.4851 0.4047 0.5511 0.0415 -0.1166 -0.0416 408 GLN C CG 9777 C CD . GLN C 349 ? 0.6457 0.5698 0.7096 0.0364 -0.1101 -0.0392 408 GLN C CD 9778 O OE1 . GLN C 349 ? 0.6853 0.6147 0.7559 0.0314 -0.1077 -0.0384 408 GLN C OE1 9779 N NE2 . GLN C 349 ? 0.3937 0.3153 0.4480 0.0377 -0.1071 -0.0382 408 GLN C NE2 9780 N N . CYS C 350 ? 0.5638 0.4894 0.6633 0.0414 -0.1280 -0.0487 409 CYS C N 9781 C CA . CYS C 350 ? 0.5485 0.4779 0.6598 0.0387 -0.1301 -0.0496 409 CYS C CA 9782 C C . CYS C 350 ? 0.6325 0.5581 0.7478 0.0435 -0.1370 -0.0525 409 CYS C C 9783 O O . CYS C 350 ? 0.5267 0.4533 0.6491 0.0422 -0.1403 -0.0523 409 CYS C O 9784 C CB . CYS C 350 ? 0.3942 0.3290 0.5121 0.0357 -0.1264 -0.0507 409 CYS C CB 9785 S SG . CYS C 350 ? 0.5205 0.4598 0.6339 0.0304 -0.1183 -0.0476 409 CYS C SG 9786 N N . CYS C 351 ? 0.5605 0.4817 0.6712 0.0493 -0.1390 -0.0552 410 CYS C N 9787 C CA . CYS C 351 ? 0.4830 0.4001 0.5966 0.0548 -0.1455 -0.0583 410 CYS C CA 9788 C C . CYS C 351 ? 0.5034 0.4241 0.6298 0.0533 -0.1482 -0.0606 410 CYS C C 9789 O O . CYS C 351 ? 0.5987 0.5172 0.7297 0.0555 -0.1537 -0.0618 410 CYS C O 9790 C CB . CYS C 351 ? 0.4871 0.3993 0.5960 0.0573 -0.1498 -0.0568 410 CYS C CB 9791 S SG . CYS C 351 ? 0.6934 0.5984 0.7875 0.0631 -0.1498 -0.0562 410 CYS C SG 9792 N N . ILE C 352 ? 0.5910 0.5171 0.7233 0.0495 -0.1442 -0.0611 411 ILE C N 9793 C CA . ILE C 352 ? 0.6485 0.5777 0.7925 0.0490 -0.1466 -0.0639 411 ILE C CA 9794 C C . ILE C 352 ? 0.5567 0.4865 0.7002 0.0513 -0.1448 -0.0669 411 ILE C C 9795 O O . ILE C 352 ? 0.5140 0.4440 0.6503 0.0509 -0.1402 -0.0660 411 ILE C O 9796 C CB . ILE C 352 ? 0.6679 0.6037 0.8213 0.0421 -0.1439 -0.0618 411 ILE C CB 9797 C CG1 . ILE C 352 ? 0.6573 0.5979 0.8095 0.0378 -0.1370 -0.0603 411 ILE C CG1 9798 C CG2 . ILE C 352 ? 0.5587 0.4940 0.7111 0.0395 -0.1448 -0.0585 411 ILE C CG2 9799 C CD1 . ILE C 352 ? 0.5573 0.5043 0.7194 0.0316 -0.1343 -0.0587 411 ILE C CD1 9800 N N . LEU C 353 ? 0.5519 0.4818 0.7031 0.0538 -0.1486 -0.0706 412 LEU C N 9801 C CA . LEU C 353 ? 0.4058 0.3353 0.5560 0.0571 -0.1478 -0.0740 412 LEU C CA 9802 C C . LEU C 353 ? 0.4912 0.4238 0.6532 0.0571 -0.1505 -0.0773 412 LEU C C 9803 O O . LEU C 353 ? 0.5603 0.4910 0.7281 0.0594 -0.1561 -0.0792 412 LEU C O 9804 C CB . LEU C 353 ? 0.4097 0.3320 0.5504 0.0644 -0.1508 -0.0760 412 LEU C CB 9805 C CG . LEU C 353 ? 0.4441 0.3649 0.5827 0.0688 -0.1506 -0.0799 412 LEU C CG 9806 C CD1 . LEU C 353 ? 0.4184 0.3424 0.5524 0.0657 -0.1438 -0.0786 412 LEU C CD1 9807 C CD2 . LEU C 353 ? 0.4947 0.4078 0.6246 0.0763 -0.1543 -0.0819 412 LEU C CD2 9808 N N . ARG C 354 ? 0.4790 0.4163 0.6445 0.0544 -0.1465 -0.0780 413 ARG C N 9809 C CA . ARG C 354 ? 0.6182 0.5588 0.7947 0.0541 -0.1484 -0.0812 413 ARG C CA 9810 C C . ARG C 354 ? 0.6672 0.6030 0.8434 0.0612 -0.1539 -0.0859 413 ARG C C 9811 O O . ARG C 354 ? 0.5568 0.4885 0.7239 0.0658 -0.1535 -0.0874 413 ARG C O 9812 C CB . ARG C 354 ? 0.5843 0.5302 0.7622 0.0507 -0.1428 -0.0810 413 ARG C CB 9813 C CG . ARG C 354 ? 0.5232 0.4734 0.7129 0.0495 -0.1439 -0.0837 413 ARG C CG 9814 C CD . ARG C 354 ? 0.5278 0.4837 0.7191 0.0450 -0.1379 -0.0825 413 ARG C CD 9815 N NE . ARG C 354 ? 0.5291 0.4900 0.7252 0.0384 -0.1344 -0.0784 413 ARG C NE 9816 C CZ . ARG C 354 ? 0.4468 0.4103 0.6379 0.0345 -0.1284 -0.0751 413 ARG C CZ 9817 N NH1 . ARG C 354 ? 0.4689 0.4307 0.6503 0.0364 -0.1254 -0.0753 413 ARG C NH1 9818 N NH2 . ARG C 354 ? 0.5515 0.5193 0.7474 0.0288 -0.1255 -0.0716 413 ARG C NH2 9819 N N . PRO C 355 ? 0.6834 0.6195 0.8695 0.0623 -0.1591 -0.0882 414 PRO C N 9820 C CA . PRO C 355 ? 0.5091 0.4403 0.6959 0.0692 -0.1652 -0.0927 414 PRO C CA 9821 C C . PRO C 355 ? 0.5930 0.5235 0.7771 0.0730 -0.1643 -0.0965 414 PRO C C 9822 O O . PRO C 355 ? 0.4628 0.3876 0.6406 0.0796 -0.1674 -0.0992 414 PRO C O 9823 C CB . PRO C 355 ? 0.4968 0.4309 0.6972 0.0674 -0.1694 -0.0941 414 PRO C CB 9824 C CG . PRO C 355 ? 0.5616 0.4994 0.7652 0.0609 -0.1668 -0.0895 414 PRO C CG 9825 C CD . PRO C 355 ? 0.7370 0.6778 0.9342 0.0569 -0.1596 -0.0864 414 PRO C CD 9826 N N . SER C 356 ? 0.4115 0.3477 0.6002 0.0691 -0.1601 -0.0966 415 SER C N 9827 C CA . SER C 356 ? 0.5853 0.5213 0.7714 0.0723 -0.1588 -0.1000 415 SER C CA 9828 C C . SER C 356 ? 0.6467 0.5787 0.8188 0.0750 -0.1555 -0.0991 415 SER C C 9829 O O . SER C 356 ? 0.4572 0.3851 0.6237 0.0808 -0.1568 -0.1025 415 SER C O 9830 C CB . SER C 356 ? 0.4094 0.3526 0.6031 0.0670 -0.1547 -0.0997 415 SER C CB 9831 O OG . SER C 356 ? 0.5815 0.5284 0.7727 0.0610 -0.1489 -0.0950 415 SER C OG 9832 N N . THR C 357 ? 0.4790 0.4121 0.6456 0.0709 -0.1511 -0.0946 416 THR C N 9833 C CA . THR C 357 ? 0.6318 0.5613 0.7853 0.0730 -0.1476 -0.0932 416 THR C CA 9834 C C . THR C 357 ? 0.7439 0.6656 0.8899 0.0800 -0.1521 -0.0949 416 THR C C 9835 O O . THR C 357 ? 0.5411 0.4586 0.6783 0.0848 -0.1514 -0.0967 416 THR C O 9836 C CB . THR C 357 ? 0.5656 0.4975 0.7152 0.0673 -0.1427 -0.0880 416 THR C CB 9837 O OG1 . THR C 357 ? 0.4661 0.4051 0.6226 0.0610 -0.1385 -0.0864 416 THR C OG1 9838 C CG2 . THR C 357 ? 0.4192 0.3475 0.5557 0.0694 -0.1390 -0.0868 416 THR C CG2 9839 N N . PHE C 358 ? 0.6346 0.5543 0.7841 0.0806 -0.1567 -0.0942 417 PHE C N 9840 C CA . PHE C 358 ? 0.4807 0.3930 0.6236 0.0872 -0.1614 -0.0954 417 PHE C CA 9841 C C . PHE C 358 ? 0.5596 0.4681 0.7027 0.0942 -0.1653 -0.1007 417 PHE C C 9842 O O . PHE C 358 ? 0.6655 0.5681 0.7991 0.1001 -0.1660 -0.1021 417 PHE C O 9843 C CB . PHE C 358 ? 0.5958 0.5073 0.7440 0.0863 -0.1660 -0.0938 417 PHE C CB 9844 C CG . PHE C 358 ? 0.6165 0.5204 0.7594 0.0935 -0.1717 -0.0955 417 PHE C CG 9845 C CD1 . PHE C 358 ? 0.5550 0.4540 0.6866 0.0958 -0.1708 -0.0931 417 PHE C CD1 9846 C CD2 . PHE C 358 ? 0.5489 0.4507 0.6984 0.0980 -0.1779 -0.0995 417 PHE C CD2 9847 C CE1 . PHE C 358 ? 0.6252 0.5171 0.7519 0.1026 -0.1761 -0.0945 417 PHE C CE1 9848 C CE2 . PHE C 358 ? 0.5063 0.4010 0.6509 0.1048 -0.1833 -0.1010 417 PHE C CE2 9849 C CZ . PHE C 358 ? 0.5945 0.4843 0.7277 0.1072 -0.1823 -0.0984 417 PHE C CZ 9850 N N . GLN C 359 ? 0.5737 0.4857 0.7276 0.0936 -0.1677 -0.1037 418 GLN C N 9851 C CA . GLN C 359 ? 0.7246 0.6336 0.8798 0.1000 -0.1715 -0.1090 418 GLN C CA 9852 C C . GLN C 359 ? 0.7534 0.6615 0.9006 0.1023 -0.1674 -0.1107 418 GLN C C 9853 O O . GLN C 359 ? 0.5355 0.4377 0.6758 0.1093 -0.1695 -0.1138 418 GLN C O 9854 C CB . GLN C 359 ? 0.7347 0.6486 0.9038 0.0978 -0.1742 -0.1116 418 GLN C CB 9855 C CG . GLN C 359 ? 0.7774 0.6906 0.9547 0.0978 -0.1800 -0.1116 418 GLN C CG 9856 C CD . GLN C 359 ? 0.8153 0.7325 1.0060 0.0969 -0.1832 -0.1149 418 GLN C CD 9857 O OE1 . GLN C 359 ? 0.7326 0.6563 0.9305 0.0914 -0.1798 -0.1142 418 GLN C OE1 9858 N NE2 . GLN C 359 ? 0.7538 0.6670 0.9481 0.1025 -0.1899 -0.1186 418 GLN C NE2 9859 N N . THR C 360 ? 0.5345 0.4482 0.6823 0.0966 -0.1615 -0.1087 419 THR C N 9860 C CA . THR C 360 ? 0.4660 0.3794 0.6059 0.0980 -0.1569 -0.1097 419 THR C CA 9861 C C . THR C 360 ? 0.5639 0.4709 0.6903 0.1021 -0.1554 -0.1084 419 THR C C 9862 O O . THR C 360 ? 0.6086 0.5112 0.7279 0.1079 -0.1556 -0.1115 419 THR C O 9863 C CB . THR C 360 ? 0.5495 0.4699 0.6917 0.0905 -0.1505 -0.1067 419 THR C CB 9864 O OG1 . THR C 360 ? 0.5423 0.4686 0.6971 0.0868 -0.1516 -0.1078 419 THR C OG1 9865 C CG2 . THR C 360 ? 0.4216 0.3415 0.5555 0.0921 -0.1460 -0.1079 419 THR C CG2 9866 N N . LEU C 361 ? 0.4264 0.3330 0.5492 0.0990 -0.1540 -0.1040 420 LEU C N 9867 C CA . LEU C 361 ? 0.5805 0.4812 0.6909 0.1025 -0.1526 -0.1024 420 LEU C CA 9868 C C . LEU C 361 ? 0.6482 0.5414 0.7551 0.1106 -0.1585 -0.1053 420 LEU C C 9869 O O . LEU C 361 ? 0.7600 0.6475 0.8566 0.1159 -0.1578 -0.1062 420 LEU C O 9870 C CB . LEU C 361 ? 0.5693 0.4714 0.6777 0.0974 -0.1503 -0.0971 420 LEU C CB 9871 C CG . LEU C 361 ? 0.5628 0.4714 0.6721 0.0898 -0.1439 -0.0936 420 LEU C CG 9872 C CD1 . LEU C 361 ? 0.4830 0.3923 0.5902 0.0856 -0.1424 -0.0887 420 LEU C CD1 9873 C CD2 . LEU C 361 ? 0.5386 0.4467 0.6394 0.0908 -0.1387 -0.0941 420 LEU C CD2 9874 N N . MSE C 362 ? 0.7363 0.6294 0.8516 0.1117 -0.1642 -0.1068 421 MSE C N 9875 C CA . MSE C 362 ? 0.5249 0.4109 0.6379 0.1195 -0.1704 -0.1097 421 MSE C CA 9876 C C . MSE C 362 ? 0.6818 0.5649 0.7929 0.1258 -0.1717 -0.1150 421 MSE C C 9877 O O . MSE C 362 ? 0.4456 0.3218 0.5489 0.1331 -0.1739 -0.1169 421 MSE C O 9878 C CB . MSE C 362 ? 0.4809 0.3681 0.6045 0.1186 -0.1762 -0.1101 421 MSE C CB 9879 C CG . MSE C 362 ? 1.1158 0.9957 1.2364 0.1259 -0.1827 -0.1118 421 MSE C CG 9880 SE SE . MSE C 362 ? 1.0446 0.9202 1.1563 0.1253 -0.1828 -0.1061 421 MSE C SE 9881 C CE . MSE C 362 ? 1.2138 1.0842 1.3092 0.1294 -0.1773 -0.1055 421 MSE C CE 9882 N N . ASN C 363 ? 0.4399 0.3283 0.5581 0.1231 -0.1702 -0.1172 422 ASN C N 9883 C CA . ASN C 363 ? 0.5020 0.3885 0.6189 0.1286 -0.1710 -0.1223 422 ASN C CA 9884 C C . ASN C 363 ? 0.6441 0.5267 0.7482 0.1319 -0.1666 -0.1224 422 ASN C C 9885 O O . ASN C 363 ? 0.7726 0.6491 0.8707 0.1395 -0.1687 -0.1259 422 ASN C O 9886 C CB . ASN C 363 ? 0.6069 0.5006 0.7338 0.1241 -0.1695 -0.1240 422 ASN C CB 9887 C CG . ASN C 363 ? 0.7232 0.6197 0.8632 0.1227 -0.1748 -0.1256 422 ASN C CG 9888 O OD1 . ASN C 363 ? 0.6556 0.5478 0.7971 0.1270 -0.1805 -0.1268 422 ASN C OD1 9889 N ND2 . ASN C 363 ? 0.8238 0.7276 0.9735 0.1168 -0.1730 -0.1254 422 ASN C ND2 9890 N N . PHE C 364 ? 0.5580 0.4440 0.6580 0.1263 -0.1604 -0.1185 423 PHE C N 9891 C CA . PHE C 364 ? 0.6004 0.4830 0.6884 0.1286 -0.1557 -0.1180 423 PHE C CA 9892 C C . PHE C 364 ? 0.6658 0.5409 0.7438 0.1338 -0.1570 -0.1167 423 PHE C C 9893 O O . PHE C 364 ? 0.6820 0.5515 0.7510 0.1399 -0.1563 -0.1188 423 PHE C O 9894 C CB . PHE C 364 ? 0.4493 0.3378 0.5361 0.1210 -0.1488 -0.1140 423 PHE C CB 9895 C CG . PHE C 364 ? 0.5165 0.4115 0.6100 0.1171 -0.1463 -0.1155 423 PHE C CG 9896 C CD1 . PHE C 364 ? 0.4648 0.3585 0.5566 0.1216 -0.1464 -0.1201 423 PHE C CD1 9897 C CD2 . PHE C 364 ? 0.4310 0.3335 0.5324 0.1091 -0.1438 -0.1125 423 PHE C CD2 9898 C CE1 . PHE C 364 ? 0.5029 0.4026 0.6005 0.1180 -0.1442 -0.1214 423 PHE C CE1 9899 C CE2 . PHE C 364 ? 0.4718 0.3801 0.5791 0.1056 -0.1415 -0.1138 423 PHE C CE2 9900 C CZ . PHE C 364 ? 0.5213 0.4284 0.6269 0.1101 -0.1418 -0.1182 423 PHE C CZ 9901 N N . TYR C 365 ? 0.5973 0.4722 0.6768 0.1314 -0.1588 -0.1131 424 TYR C N 9902 C CA . TYR C 365 ? 0.5991 0.4671 0.6694 0.1357 -0.1600 -0.1113 424 TYR C CA 9903 C C . TYR C 365 ? 0.7339 0.5945 0.8015 0.1450 -0.1657 -0.1154 424 TYR C C 9904 O O . TYR C 365 ? 0.6847 0.5386 0.7421 0.1507 -0.1654 -0.1156 424 TYR C O 9905 C CB . TYR C 365 ? 0.4908 0.3605 0.5641 0.1312 -0.1612 -0.1069 424 TYR C CB 9906 C CG . TYR C 365 ? 0.6724 0.5354 0.7362 0.1352 -0.1623 -0.1046 424 TYR C CG 9907 C CD1 . TYR C 365 ? 0.6454 0.5053 0.6981 0.1364 -0.1576 -0.1029 424 TYR C CD1 9908 C CD2 . TYR C 365 ? 0.7106 0.5703 0.7765 0.1377 -0.1681 -0.1041 424 TYR C CD2 9909 C CE1 . TYR C 365 ? 0.5266 0.3805 0.5707 0.1401 -0.1584 -0.1007 424 TYR C CE1 9910 C CE2 . TYR C 365 ? 0.7707 0.6242 0.8277 0.1415 -0.1691 -0.1019 424 TYR C CE2 9911 C CZ . TYR C 365 ? 0.7379 0.5886 0.7841 0.1427 -0.1642 -0.1002 424 TYR C CZ 9912 O OH . TYR C 365 ? 0.7485 0.5930 0.7860 0.1464 -0.1652 -0.0979 424 TYR C OH 9913 N N . SER C 366 ? 0.7098 0.5715 0.7869 0.1466 -0.1709 -0.1188 425 SER C N 9914 C CA . SER C 366 ? 0.7883 0.6432 0.8641 0.1553 -0.1770 -0.1229 425 SER C CA 9915 C C . SER C 366 ? 0.8163 0.6673 0.8852 0.1617 -0.1755 -0.1270 425 SER C C 9916 O O . SER C 366 ? 0.8677 0.7116 0.9320 0.1699 -0.1793 -0.1301 425 SER C O 9917 C CB . SER C 366 ? 0.7723 0.6300 0.8606 0.1549 -0.1828 -0.1255 425 SER C CB 9918 O OG . SER C 366 ? 0.7646 0.6293 0.8610 0.1502 -0.1805 -0.1272 425 SER C OG 9919 N N . THR C 367 ? 0.7514 0.6068 0.8195 0.1579 -0.1700 -0.1272 426 THR C N 9920 C CA . THR C 367 ? 0.8334 0.6855 0.8942 0.1632 -0.1677 -0.1308 426 THR C CA 9921 C C . THR C 367 ? 0.7918 0.6445 0.8434 0.1602 -0.1604 -0.1276 426 THR C C 9922 O O . THR C 367 ? 0.6040 0.4632 0.6586 0.1536 -0.1558 -0.1261 426 THR C O 9923 C CB . THR C 367 ? 0.8121 0.6687 0.8806 0.1625 -0.1682 -0.1351 426 THR C CB 9924 O OG1 . THR C 367 ? 0.7419 0.5982 0.8196 0.1651 -0.1750 -0.1381 426 THR C OG1 9925 C CG2 . THR C 367 ? 0.7728 0.6254 0.8331 0.1685 -0.1660 -0.1390 426 THR C CG2 9926 N N . PRO C 368 ? 0.8322 0.6781 0.8728 0.1650 -0.1593 -0.1264 427 PRO C N 9927 C CA . PRO C 368 ? 0.8866 0.7324 0.9180 0.1625 -0.1526 -0.1233 427 PRO C CA 9928 C C . PRO C 368 ? 0.7734 0.6223 0.8031 0.1611 -0.1477 -0.1254 427 PRO C C 9929 O O . PRO C 368 ? 0.7629 0.6101 0.7931 0.1660 -0.1496 -0.1302 427 PRO C O 9930 C CB . PRO C 368 ? 0.9451 0.7816 0.9656 0.1705 -0.1537 -0.1236 427 PRO C CB 9931 C CG . PRO C 368 ? 0.8447 0.6779 0.8695 0.1743 -0.1607 -0.1243 427 PRO C CG 9932 C CD . PRO C 368 ? 0.7844 0.6222 0.8208 0.1730 -0.1646 -0.1277 427 PRO C CD 9933 N N . LYS C 369 ? 0.6702 0.5239 0.6981 0.1544 -0.1418 -0.1218 428 LYS C N 9934 C CA . LYS C 369 ? 0.6283 0.4855 0.6541 0.1521 -0.1365 -0.1229 428 LYS C CA 9935 C C . LYS C 369 ? 0.6769 0.5408 0.7131 0.1485 -0.1374 -0.1252 428 LYS C C 9936 O O . LYS C 369 ? 0.6566 0.5236 0.6916 0.1466 -0.1334 -0.1264 428 LYS C O 9937 C CB . LYS C 369 ? 0.6245 0.4749 0.6400 0.1598 -0.1352 -0.1263 428 LYS C CB 9938 C CG . LYS C 369 ? 0.5948 0.4384 0.5993 0.1637 -0.1335 -0.1241 428 LYS C CG 9939 C CD . LYS C 369 ? 0.8142 0.6507 0.8095 0.1722 -0.1329 -0.1281 428 LYS C CD 9940 C CE . LYS C 369 ? 0.9114 0.7410 0.8956 0.1761 -0.1308 -0.1258 428 LYS C CE 9941 N NZ . LYS C 369 ? 0.9500 0.7749 0.9249 0.1822 -0.1291 -0.1281 428 LYS C NZ 9942 N N . SER C 370 ? 0.6603 0.5265 0.7066 0.1473 -0.1425 -0.1259 429 SER C N 9943 C CA . SER C 370 ? 0.6809 0.5533 0.7376 0.1443 -0.1438 -0.1284 429 SER C CA 9944 C C . SER C 370 ? 0.5555 0.4361 0.6169 0.1350 -0.1390 -0.1246 429 SER C C 9945 O O . SER C 370 ? 0.5010 0.3865 0.5664 0.1324 -0.1370 -0.1262 429 SER C O 9946 C CB . SER C 370 ? 0.6549 0.5273 0.7214 0.1457 -0.1506 -0.1302 429 SER C CB 9947 O OG . SER C 370 ? 0.5996 0.4747 0.6708 0.1405 -0.1514 -0.1258 429 SER C OG 9948 N N . LEU C 371 ? 0.5478 0.4298 0.6085 0.1303 -0.1372 -0.1197 430 LEU C N 9949 C CA . LEU C 371 ? 0.7705 0.6599 0.8351 0.1217 -0.1325 -0.1158 430 LEU C CA 9950 C C . LEU C 371 ? 0.6479 0.5386 0.7055 0.1203 -0.1263 -0.1155 430 LEU C C 9951 O O . LEU C 371 ? 0.5171 0.4139 0.5795 0.1159 -0.1236 -0.1156 430 LEU C O 9952 C CB . LEU C 371 ? 0.6540 0.5435 0.7176 0.1177 -0.1317 -0.1107 430 LEU C CB 9953 C CG . LEU C 371 ? 0.5929 0.4895 0.6593 0.1092 -0.1266 -0.1064 430 LEU C CG 9954 C CD1 . LEU C 371 ? 0.4841 0.3877 0.5631 0.1042 -0.1279 -0.1068 430 LEU C CD1 9955 C CD2 . LEU C 371 ? 0.5119 0.4076 0.5753 0.1063 -0.1257 -0.1018 430 LEU C CD2 9956 N N . THR C 372 ? 0.5605 0.4456 0.6067 0.1242 -0.1239 -0.1151 431 THR C N 9957 C CA . THR C 372 ? 0.7870 0.6727 0.8255 0.1233 -0.1179 -0.1148 431 THR C CA 9958 C C . THR C 372 ? 0.6101 0.4954 0.6480 0.1272 -0.1179 -0.1196 431 THR C C 9959 O O . THR C 372 ? 0.7176 0.6062 0.7532 0.1245 -0.1133 -0.1195 431 THR C O 9960 C CB . THR C 372 ? 0.6701 0.5494 0.6967 0.1269 -0.1155 -0.1132 431 THR C CB 9961 O OG1 . THR C 372 ? 0.8100 0.6817 0.8326 0.1352 -0.1198 -0.1164 431 THR C OG1 9962 C CG2 . THR C 372 ? 0.4393 0.3198 0.4658 0.1222 -0.1143 -0.1080 431 THR C CG2 9963 N N . LYS C 373 ? 0.5787 0.4600 0.6184 0.1335 -0.1232 -0.1239 432 LYS C N 9964 C CA . LYS C 373 ? 0.6120 0.4931 0.6520 0.1373 -0.1239 -0.1289 432 LYS C CA 9965 C C . LYS C 373 ? 0.5290 0.4183 0.5799 0.1316 -0.1238 -0.1292 432 LYS C C 9966 O O . LYS C 373 ? 0.5600 0.4521 0.6101 0.1308 -0.1210 -0.1310 432 LYS C O 9967 C CB . LYS C 373 ? 0.7743 0.6490 0.8140 0.1457 -0.1298 -0.1334 432 LYS C CB 9968 C CG . LYS C 373 ? 0.8067 0.6730 0.8338 0.1532 -0.1288 -0.1349 432 LYS C CG 9969 C CD . LYS C 373 ? 0.8785 0.7381 0.9053 0.1613 -0.1349 -0.1386 432 LYS C CD 9970 C CE . LYS C 373 ? 0.8550 0.7060 0.8690 0.1689 -0.1336 -0.1400 432 LYS C CE 9971 N NZ . LYS C 373 ? 0.6184 0.4692 0.6258 0.1704 -0.1290 -0.1424 432 LYS C NZ 9972 N N . ALA C 374 ? 0.5679 0.4609 0.6289 0.1276 -0.1270 -0.1275 433 ALA C N 9973 C CA . ALA C 374 ? 0.5578 0.4586 0.6298 0.1217 -0.1269 -0.1273 433 ALA C CA 9974 C C . ALA C 374 ? 0.5900 0.4966 0.6608 0.1146 -0.1205 -0.1233 433 ALA C C 9975 O O . ALA C 374 ? 0.7287 0.6411 0.8049 0.1108 -0.1187 -0.1237 433 ALA C O 9976 C CB . ALA C 374 ? 0.4359 0.3389 0.5185 0.1192 -0.1315 -0.1260 433 ALA C CB 9977 N N . LEU C 375 ? 0.6207 0.5254 0.6842 0.1129 -0.1172 -0.1194 434 LEU C N 9978 C CA . LEU C 375 ? 0.6195 0.5288 0.6806 0.1067 -0.1111 -0.1156 434 LEU C CA 9979 C C . LEU C 375 ? 0.6271 0.5352 0.6798 0.1091 -0.1071 -0.1177 434 LEU C C 9980 O O . LEU C 375 ? 0.5427 0.4561 0.5970 0.1049 -0.1034 -0.1168 434 LEU C O 9981 C CB . LEU C 375 ? 0.4967 0.4043 0.5527 0.1044 -0.1089 -0.1110 434 LEU C CB 9982 C CG . LEU C 375 ? 0.5696 0.4812 0.6220 0.0985 -0.1026 -0.1070 434 LEU C CG 9983 C CD1 . LEU C 375 ? 0.4222 0.3420 0.4847 0.0913 -0.1014 -0.1049 434 LEU C CD1 9984 C CD2 . LEU C 375 ? 0.4368 0.3456 0.4831 0.0975 -0.1009 -0.1031 434 LEU C CD2 9985 N N . HIS C 376 ? 0.5634 0.4643 0.6071 0.1162 -0.1079 -0.1203 435 HIS C N 9986 C CA . HIS C 376 ? 0.5924 0.4911 0.6272 0.1193 -0.1043 -0.1225 435 HIS C CA 9987 C C . HIS C 376 ? 0.6528 0.5552 0.6926 0.1195 -0.1049 -0.1262 435 HIS C C 9988 O O . HIS C 376 ? 0.4435 0.3490 0.4803 0.1172 -0.1006 -0.1260 435 HIS C O 9989 C CB . HIS C 376 ? 0.6813 0.5712 0.7067 0.1277 -0.1059 -0.1253 435 HIS C CB 9990 C CG . HIS C 376 ? 0.7982 0.6853 0.8135 0.1309 -0.1018 -0.1273 435 HIS C CG 9991 N ND1 . HIS C 376 ? 0.8044 0.6921 0.8124 0.1278 -0.0960 -0.1240 435 HIS C ND1 9992 C CD2 . HIS C 376 ? 0.7420 0.6258 0.7531 0.1368 -0.1025 -0.1321 435 HIS C CD2 9993 C CE1 . HIS C 376 ? 0.7432 0.6279 0.7430 0.1317 -0.0933 -0.1267 435 HIS C CE1 9994 N NE2 . HIS C 376 ? 0.7282 0.6106 0.7296 0.1372 -0.0971 -0.1317 435 HIS C NE2 9995 N N . GLU C 377 ? 0.6367 0.5389 0.6841 0.1222 -0.1104 -0.1294 436 GLU C N 9996 C CA . GLU C 377 ? 0.7223 0.6276 0.7753 0.1230 -0.1120 -0.1333 436 GLU C CA 9997 C C . GLU C 377 ? 0.5151 0.4291 0.5759 0.1151 -0.1092 -0.1307 436 GLU C C 9998 O O . GLU C 377 ? 0.6271 0.5442 0.6881 0.1145 -0.1073 -0.1327 436 GLU C O 9999 C CB . GLU C 377 ? 0.7461 0.6496 0.8069 0.1270 -0.1188 -0.1368 436 GLU C CB 10000 C CG . GLU C 377 ? 0.9371 0.8426 1.0031 0.1293 -0.1212 -0.1417 436 GLU C CG 10001 C CD . GLU C 377 ? 1.2700 1.1697 1.3262 0.1368 -0.1209 -0.1464 436 GLU C CD 10002 O OE1 . GLU C 377 ? 1.2253 1.1192 1.2707 0.1404 -0.1187 -0.1457 436 GLU C OE1 10003 O OE2 . GLU C 377 ? 1.3587 1.2596 1.4181 0.1394 -0.1227 -0.1508 436 GLU C OE2 10004 N N . SER C 378 ? 0.6397 0.5574 0.7065 0.1092 -0.1090 -0.1264 437 SER C N 10005 C CA . SER C 378 ? 0.4646 0.3903 0.5388 0.1016 -0.1061 -0.1233 437 SER C CA 10006 C C . SER C 378 ? 0.6425 0.5701 0.7089 0.0985 -0.0997 -0.1207 437 SER C C 10007 O O . SER C 378 ? 0.6510 0.5837 0.7199 0.0953 -0.0971 -0.1208 437 SER C O 10008 C CB . SER C 378 ? 0.4743 0.4029 0.5562 0.0966 -0.1074 -0.1193 437 SER C CB 10009 O OG . SER C 378 ? 0.6256 0.5619 0.7156 0.0896 -0.1052 -0.1167 437 SER C OG 10010 N N . LEU C 379 ? 0.5702 0.4936 0.6273 0.0996 -0.0972 -0.1185 438 LEU C N 10011 C CA . LEU C 379 ? 0.5675 0.4920 0.6166 0.0969 -0.0911 -0.1159 438 LEU C CA 10012 C C . LEU C 379 ? 0.5312 0.4545 0.5740 0.1003 -0.0890 -0.1194 438 LEU C C 10013 O O . LEU C 379 ? 0.5685 0.4954 0.6084 0.0969 -0.0843 -0.1178 438 LEU C O 10014 C CB . LEU C 379 ? 0.6599 0.5792 0.7002 0.0983 -0.0894 -0.1135 438 LEU C CB 10015 C CG . LEU C 379 ? 0.4232 0.3439 0.4679 0.0940 -0.0901 -0.1091 438 LEU C CG 10016 C CD1 . LEU C 379 ? 0.4291 0.3441 0.4643 0.0963 -0.0886 -0.1073 438 LEU C CD1 10017 C CD2 . LEU C 379 ? 0.4864 0.4147 0.5366 0.0861 -0.0865 -0.1052 438 LEU C CD2 10018 N N . SER C 380 ? 0.5320 0.4504 0.5724 0.1072 -0.0924 -0.1242 439 SER C N 10019 C CA . SER C 380 ? 0.5511 0.4677 0.5850 0.1113 -0.0908 -0.1281 439 SER C CA 10020 C C . SER C 380 ? 0.6211 0.5446 0.6609 0.1074 -0.0895 -0.1287 439 SER C C 10021 O O . SER C 380 ? 0.7262 0.6500 0.7598 0.1084 -0.0863 -0.1302 439 SER C O 10022 C CB . SER C 380 ? 0.6177 0.5281 0.6498 0.1194 -0.0956 -0.1333 439 SER C CB 10023 O OG . SER C 380 ? 0.8674 0.7708 0.8925 0.1236 -0.0964 -0.1329 439 SER C OG 10024 N N . LYS C 381 ? 0.4257 0.3547 0.4773 0.1030 -0.0918 -0.1276 440 LYS C N 10025 C CA . LYS C 381 ? 0.5416 0.4775 0.5999 0.0992 -0.0908 -0.1279 440 LYS C CA 10026 C C . LYS C 381 ? 0.5223 0.4631 0.5787 0.0928 -0.0851 -0.1234 440 LYS C C 10027 O O . LYS C 381 ? 0.6884 0.6341 0.7471 0.0901 -0.0831 -0.1235 440 LYS C O 10028 C CB . LYS C 381 ? 0.5587 0.4987 0.6306 0.0967 -0.0952 -0.1281 440 LYS C CB 10029 C CG . LYS C 381 ? 0.7668 0.7026 0.8419 0.1029 -0.1012 -0.1330 440 LYS C CG 10030 C CD . LYS C 381 ? 0.8981 0.8387 0.9871 0.1002 -0.1051 -0.1335 440 LYS C CD 10031 C CE . LYS C 381 ? 0.8963 0.8407 0.9922 0.0938 -0.1046 -0.1284 440 LYS C CE 10032 N NZ . LYS C 381 ? 0.8728 0.8215 0.9824 0.0914 -0.1086 -0.1289 440 LYS C NZ 10033 N N . ASP C 382 ? 0.5066 0.4461 0.5588 0.0905 -0.0826 -0.1193 441 ASP C N 10034 C CA . ASP C 382 ? 0.4606 0.4041 0.5101 0.0848 -0.0772 -0.1150 441 ASP C CA 10035 C C . ASP C 382 ? 0.5228 0.4640 0.5611 0.0873 -0.0731 -0.1163 441 ASP C C 10036 O O . ASP C 382 ? 0.5595 0.4942 0.5889 0.0926 -0.0732 -0.1184 441 ASP C O 10037 C CB . ASP C 382 ? 0.5217 0.4643 0.5701 0.0819 -0.0759 -0.1105 441 ASP C CB 10038 C CG . ASP C 382 ? 0.4619 0.4092 0.5092 0.0756 -0.0707 -0.1059 441 ASP C CG 10039 O OD1 . ASP C 382 ? 0.4829 0.4286 0.5209 0.0762 -0.0667 -0.1053 441 ASP C OD1 10040 O OD2 . ASP C 382 ? 0.5272 0.4799 0.5832 0.0702 -0.0707 -0.1028 441 ASP C OD2 10041 N N . PRO C 383 ? 0.4412 0.3876 0.4798 0.0835 -0.0696 -0.1150 442 PRO C N 10042 C CA . PRO C 383 ? 0.4978 0.4427 0.5262 0.0854 -0.0656 -0.1163 442 PRO C CA 10043 C C . PRO C 383 ? 0.4371 0.3778 0.4551 0.0858 -0.0619 -0.1139 442 PRO C C 10044 O O . PRO C 383 ? 0.5882 0.5257 0.5965 0.0890 -0.0592 -0.1156 442 PRO C O 10045 C CB . PRO C 383 ? 0.4112 0.3635 0.4441 0.0798 -0.0628 -0.1141 442 PRO C CB 10046 C CG . PRO C 383 ? 0.5372 0.4942 0.5831 0.0768 -0.0663 -0.1136 442 PRO C CG 10047 C CD . PRO C 383 ? 0.5040 0.4580 0.5530 0.0773 -0.0693 -0.1125 442 PRO C CD 10048 N N . ALA C 384 ? 0.5758 0.5167 0.5958 0.0827 -0.0616 -0.1101 443 ALA C N 10049 C CA . ALA C 384 ? 0.4368 0.3743 0.4478 0.0825 -0.0579 -0.1075 443 ALA C CA 10050 C C . ALA C 384 ? 0.4493 0.3796 0.4558 0.0878 -0.0604 -0.1090 443 ALA C C 10051 O O . ALA C 384 ? 0.5826 0.5098 0.5829 0.0877 -0.0581 -0.1066 443 ALA C O 10052 C CB . ALA C 384 ? 0.4099 0.3522 0.4250 0.0757 -0.0554 -0.1022 443 ALA C CB 10053 N N . HIS C 385 ? 0.5306 0.4581 0.5402 0.0925 -0.0652 -0.1129 444 HIS C N 10054 C CA . HIS C 385 ? 0.4246 0.3449 0.4301 0.0982 -0.0681 -0.1146 444 HIS C CA 10055 C C . HIS C 385 ? 0.4282 0.3423 0.4209 0.1030 -0.0650 -0.1161 444 HIS C C 10056 O O . HIS C 385 ? 0.5367 0.4515 0.5246 0.1038 -0.0622 -0.1177 444 HIS C O 10057 C CB . HIS C 385 ? 0.5313 0.4501 0.5427 0.1026 -0.0738 -0.1189 444 HIS C CB 10058 C CG . HIS C 385 ? 0.8594 0.7764 0.8669 0.1074 -0.0741 -0.1237 444 HIS C CG 10059 N ND1 . HIS C 385 ? 1.0411 0.9636 1.0521 0.1047 -0.0728 -0.1246 444 HIS C ND1 10060 C CD2 . HIS C 385 ? 0.8070 0.7173 0.8073 0.1148 -0.0755 -0.1280 444 HIS C CD2 10061 C CE1 . HIS C 385 ? 0.8381 0.7575 0.8441 0.1102 -0.0734 -0.1293 444 HIS C CE1 10062 N NE2 . HIS C 385 ? 0.9120 0.8240 0.9115 0.1164 -0.0750 -0.1314 444 HIS C NE2 10063 N N . PRO C 386 ? 0.4946 0.4027 0.4817 0.1063 -0.0654 -0.1155 445 PRO C N 10064 C CA . PRO C 386 ? 0.5053 0.4118 0.4966 0.1059 -0.0687 -0.1135 445 PRO C CA 10065 C C . PRO C 386 ? 0.5598 0.4715 0.5557 0.0986 -0.0665 -0.1082 445 PRO C C 10066 O O . PRO C 386 ? 0.6123 0.5254 0.6032 0.0954 -0.0617 -0.1055 445 PRO C O 10067 C CB . PRO C 386 ? 0.4704 0.3687 0.4516 0.1118 -0.0681 -0.1144 445 PRO C CB 10068 C CG . PRO C 386 ? 0.4351 0.3324 0.4070 0.1122 -0.0628 -0.1145 445 PRO C CG 10069 C CD . PRO C 386 ? 0.4341 0.3360 0.4091 0.1110 -0.0623 -0.1168 445 PRO C CD 10070 N N . ILE C 387 ? 0.5632 0.4775 0.5683 0.0960 -0.0701 -0.1069 446 ILE C N 10071 C CA . ILE C 387 ? 0.6317 0.5509 0.6419 0.0892 -0.0685 -0.1021 446 ILE C CA 10072 C C . ILE C 387 ? 0.5993 0.5144 0.6047 0.0897 -0.0681 -0.0994 446 ILE C C 10073 O O . ILE C 387 ? 0.5131 0.4303 0.5165 0.0852 -0.0643 -0.0956 446 ILE C O 10074 C CB . ILE C 387 ? 0.5145 0.4386 0.5370 0.0860 -0.0724 -0.1018 446 ILE C CB 10075 C CG1 . ILE C 387 ? 0.4701 0.3984 0.4978 0.0856 -0.0730 -0.1045 446 ILE C CG1 10076 C CG2 . ILE C 387 ? 0.5082 0.4374 0.5357 0.0790 -0.0704 -0.0968 446 ILE C CG2 10077 C CD1 . ILE C 387 ? 0.4712 0.4038 0.4961 0.0817 -0.0677 -0.1030 446 ILE C CD1 10078 N N . LEU C 388 ? 0.5628 0.4719 0.5663 0.0952 -0.0719 -0.1014 447 LEU C N 10079 C CA . LEU C 388 ? 0.5766 0.4813 0.5755 0.0963 -0.0720 -0.0990 447 LEU C CA 10080 C C . LEU C 388 ? 0.4292 0.3259 0.4174 0.1033 -0.0715 -0.1013 447 LEU C C 10081 O O . LEU C 388 ? 0.4804 0.3737 0.4668 0.1088 -0.0736 -0.1055 447 LEU C O 10082 C CB . LEU C 388 ? 0.4243 0.3287 0.4305 0.0964 -0.0772 -0.0986 447 LEU C CB 10083 C CG . LEU C 388 ? 0.6337 0.5450 0.6499 0.0894 -0.0777 -0.0954 447 LEU C CG 10084 C CD1 . LEU C 388 ? 0.4335 0.3435 0.4564 0.0908 -0.0834 -0.0958 447 LEU C CD1 10085 C CD2 . LEU C 388 ? 0.5564 0.4699 0.5697 0.0842 -0.0734 -0.0907 447 LEU C CD2 10086 N N . ALA C 389 ? 0.5427 0.4365 0.5239 0.1030 -0.0685 -0.0986 448 ALA C N 10087 C CA . ALA C 389 ? 0.5978 0.4835 0.5695 0.1097 -0.0684 -0.1002 448 ALA C CA 10088 C C . ALA C 389 ? 0.5700 0.4513 0.5443 0.1146 -0.0743 -0.1019 448 ALA C C 10089 O O . ALA C 389 ? 0.7679 0.6515 0.7490 0.1117 -0.0773 -0.0999 448 ALA C O 10090 C CB . ALA C 389 ? 0.4333 0.3174 0.3982 0.1079 -0.0643 -0.0966 448 ALA C CB 10091 N N . TYR C 390 ? 0.6041 0.4788 0.5727 0.1221 -0.0760 -0.1057 449 TYR C N 10092 C CA . TYR C 390 ? 0.6544 0.5247 0.6256 0.1275 -0.0820 -0.1080 449 TYR C CA 10093 C C . TYR C 390 ? 0.6292 0.4962 0.5992 0.1280 -0.0838 -0.1050 449 TYR C C 10094 O O . TYR C 390 ? 0.5551 0.4201 0.5295 0.1305 -0.0891 -0.1059 449 TYR C O 10095 C CB . TYR C 390 ? 0.5107 0.3742 0.4749 0.1359 -0.0829 -0.1126 449 TYR C CB 10096 C CG . TYR C 390 ? 0.5358 0.4021 0.5013 0.1363 -0.0821 -0.1163 449 TYR C CG 10097 C CD1 . TYR C 390 ? 0.4559 0.3296 0.4310 0.1310 -0.0831 -0.1162 449 TYR C CD1 10098 C CD2 . TYR C 390 ? 0.5506 0.4119 0.5077 0.1423 -0.0803 -0.1197 449 TYR C CD2 10099 C CE1 . TYR C 390 ? 0.6533 0.5296 0.6296 0.1315 -0.0824 -0.1195 449 TYR C CE1 10100 C CE2 . TYR C 390 ? 0.4656 0.3294 0.4235 0.1428 -0.0795 -0.1231 449 TYR C CE2 10101 C CZ . TYR C 390 ? 0.6128 0.4842 0.5804 0.1373 -0.0807 -0.1229 449 TYR C CZ 10102 O OH . TYR C 390 ? 0.6844 0.5584 0.6528 0.1379 -0.0800 -0.1262 449 TYR C OH 10103 N N . LYS C 391 ? 0.4440 0.3101 0.4080 0.1257 -0.0796 -0.1015 450 LYS C N 10104 C CA . LYS C 391 ? 0.4608 0.3237 0.4229 0.1261 -0.0809 -0.0985 450 LYS C CA 10105 C C . LYS C 391 ? 0.5189 0.3869 0.4904 0.1207 -0.0840 -0.0959 450 LYS C C 10106 O O . LYS C 391 ? 0.7265 0.5919 0.6980 0.1216 -0.0865 -0.0940 450 LYS C O 10107 C CB . LYS C 391 ? 0.4436 0.3054 0.3979 0.1241 -0.0753 -0.0953 450 LYS C CB 10108 C CG . LYS C 391 ? 0.5138 0.3828 0.4704 0.1165 -0.0706 -0.0928 450 LYS C CG 10109 C CD . LYS C 391 ? 0.4386 0.3061 0.3875 0.1149 -0.0654 -0.0898 450 LYS C CD 10110 C CE . LYS C 391 ? 0.7459 0.6197 0.6957 0.1086 -0.0603 -0.0882 450 LYS C CE 10111 N NZ . LYS C 391 ? 0.4340 0.3068 0.3772 0.1065 -0.0555 -0.0850 450 LYS C NZ 10112 N N . HIS C 392 ? 0.4848 0.3600 0.4644 0.1153 -0.0836 -0.0958 451 HIS C N 10113 C CA . HIS C 392 ? 0.6137 0.4941 0.6029 0.1101 -0.0863 -0.0935 451 HIS C CA 10114 C C . HIS C 392 ? 0.5852 0.4640 0.5807 0.1137 -0.0928 -0.0962 451 HIS C C 10115 O O . HIS C 392 ? 0.5651 0.4460 0.5671 0.1110 -0.0959 -0.0944 451 HIS C O 10116 C CB . HIS C 392 ? 0.4291 0.3176 0.4245 0.1031 -0.0833 -0.0923 451 HIS C CB 10117 C CG . HIS C 392 ? 0.6279 0.5191 0.6189 0.0982 -0.0774 -0.0889 451 HIS C CG 10118 N ND1 . HIS C 392 ? 0.5978 0.4916 0.5904 0.0933 -0.0762 -0.0847 451 HIS C ND1 10119 C CD2 . HIS C 392 ? 0.6102 0.5019 0.5953 0.0977 -0.0725 -0.0891 451 HIS C CD2 10120 C CE1 . HIS C 392 ? 0.5630 0.4587 0.5509 0.0899 -0.0708 -0.0825 451 HIS C CE1 10121 N NE2 . HIS C 392 ? 0.6571 0.5516 0.6406 0.0925 -0.0684 -0.0850 451 HIS C NE2 10122 N N . TYR C 393 ? 0.6190 0.4939 0.6125 0.1199 -0.0948 -0.1007 452 TYR C N 10123 C CA . TYR C 393 ? 0.4716 0.3446 0.4709 0.1240 -0.1012 -0.1038 452 TYR C CA 10124 C C . TYR C 393 ? 0.5830 0.4504 0.5804 0.1277 -0.1052 -0.1027 452 TYR C C 10125 O O . TYR C 393 ? 0.4899 0.3590 0.4949 0.1265 -0.1096 -0.1022 452 TYR C O 10126 C CB . TYR C 393 ? 0.4738 0.3433 0.4703 0.1304 -0.1023 -0.1089 452 TYR C CB 10127 C CG . TYR C 393 ? 0.5550 0.4303 0.5551 0.1271 -0.0997 -0.1106 452 TYR C CG 10128 C CD1 . TYR C 393 ? 0.6033 0.4865 0.6121 0.1196 -0.0987 -0.1084 452 TYR C CD1 10129 C CD2 . TYR C 393 ? 0.6084 0.4810 0.6030 0.1317 -0.0981 -0.1144 452 TYR C CD2 10130 C CE1 . TYR C 393 ? 0.6935 0.5819 0.7055 0.1167 -0.0964 -0.1097 452 TYR C CE1 10131 C CE2 . TYR C 393 ? 0.5126 0.3904 0.5101 0.1288 -0.0958 -0.1158 452 TYR C CE2 10132 C CZ . TYR C 393 ? 0.5615 0.4473 0.5678 0.1213 -0.0950 -0.1134 452 TYR C CZ 10133 O OH . TYR C 393 ? 0.4781 0.3691 0.4873 0.1185 -0.0927 -0.1148 452 TYR C OH 10134 N N . PRO C 394 ? 0.6831 0.5438 0.6704 0.1325 -0.1037 -0.1023 453 PRO C N 10135 C CA . PRO C 394 ? 0.7133 0.5690 0.6989 0.1358 -0.1076 -0.1009 453 PRO C CA 10136 C C . PRO C 394 ? 0.7547 0.6145 0.7442 0.1292 -0.1072 -0.0961 453 PRO C C 10137 O O . PRO C 394 ? 0.9476 0.8055 0.9397 0.1302 -0.1115 -0.0951 453 PRO C O 10138 C CB . PRO C 394 ? 0.6057 0.4540 0.5795 0.1415 -0.1051 -0.1010 453 PRO C CB 10139 C CG . PRO C 394 ? 0.4880 0.3389 0.4576 0.1386 -0.0988 -0.1007 453 PRO C CG 10140 C CD . PRO C 394 ? 0.4489 0.3060 0.4261 0.1354 -0.0989 -0.1030 453 PRO C CD 10141 N N . ALA C 395 ? 0.5747 0.4399 0.5643 0.1225 -0.1020 -0.0932 454 ALA C N 10142 C CA . ALA C 395 ? 0.7282 0.5976 0.7211 0.1160 -0.1009 -0.0887 454 ALA C CA 10143 C C . ALA C 395 ? 0.7012 0.5756 0.7054 0.1124 -0.1050 -0.0887 454 ALA C C 10144 O O . ALA C 395 ? 0.4942 0.3690 0.5012 0.1104 -0.1074 -0.0862 454 ALA C O 10145 C CB . ALA C 395 ? 0.4336 0.3079 0.4245 0.1100 -0.0945 -0.0862 454 ALA C CB 10146 N N . MSE C 396 ? 0.5167 0.3948 0.5272 0.1116 -0.1057 -0.0916 455 MSE C N 10147 C CA . MSE C 396 ? 0.6801 0.5632 0.7019 0.1081 -0.1093 -0.0918 455 MSE C CA 10148 C C . MSE C 396 ? 0.6886 0.5672 0.7132 0.1134 -0.1160 -0.0939 455 MSE C C 10149 O O . MSE C 396 ? 0.7403 0.6213 0.7722 0.1108 -0.1194 -0.0926 455 MSE C O 10150 C CB . MSE C 396 ? 0.4302 0.3183 0.4578 0.1061 -0.1081 -0.0944 455 MSE C CB 10151 C CG . MSE C 396 ? 0.4265 0.3202 0.4533 0.0999 -0.1019 -0.0919 455 MSE C CG 10152 SE SE . MSE C 396 ? 0.8763 0.7765 0.9107 0.0975 -0.1008 -0.0950 455 MSE C SE 10153 C CE . MSE C 396 ? 0.5007 0.4044 0.5492 0.0957 -0.1072 -0.0958 455 MSE C CE 10154 N N . GLU C 397 ? 0.6976 0.5696 0.7164 0.1211 -0.1180 -0.0972 456 GLU C N 10155 C CA . GLU C 397 ? 0.6394 0.5062 0.6596 0.1270 -0.1244 -0.0994 456 GLU C CA 10156 C C . GLU C 397 ? 0.6075 0.4713 0.6245 0.1269 -0.1259 -0.0957 456 GLU C C 10157 O O . GLU C 397 ? 0.6981 0.5612 0.7203 0.1276 -0.1309 -0.0955 456 GLU C O 10158 C CB . GLU C 397 ? 0.6049 0.4649 0.6181 0.1355 -0.1256 -0.1035 456 GLU C CB 10159 C CG . GLU C 397 ? 0.5763 0.4388 0.5927 0.1364 -0.1249 -0.1076 456 GLU C CG 10160 C CD . GLU C 397 ? 0.6863 0.5523 0.7141 0.1356 -0.1299 -0.1101 456 GLU C CD 10161 O OE1 . GLU C 397 ? 0.7451 0.6088 0.7765 0.1376 -0.1352 -0.1100 456 GLU C OE1 10162 O OE2 . GLU C 397 ? 0.5498 0.4208 0.5829 0.1330 -0.1287 -0.1120 456 GLU C OE2 10163 N N . ARG C 398 ? 0.7061 0.5680 0.7145 0.1262 -0.1215 -0.0929 457 ARG C N 10164 C CA . ARG C 398 ? 0.6621 0.5213 0.6666 0.1258 -0.1221 -0.0892 457 ARG C CA 10165 C C . ARG C 398 ? 0.6381 0.5036 0.6504 0.1184 -0.1225 -0.0858 457 ARG C C 10166 O O . ARG C 398 ? 0.5875 0.4513 0.6009 0.1187 -0.1261 -0.0840 457 ARG C O 10167 C CB . ARG C 398 ? 0.5466 0.4032 0.5407 0.1260 -0.1167 -0.0869 457 ARG C CB 10168 C CG . ARG C 398 ? 0.5504 0.4042 0.5399 0.1256 -0.1169 -0.0830 457 ARG C CG 10169 C CD . ARG C 398 ? 0.5699 0.4215 0.5497 0.1256 -0.1113 -0.0809 457 ARG C CD 10170 N NE . ARG C 398 ? 0.6820 0.5400 0.6631 0.1187 -0.1056 -0.0792 457 ARG C NE 10171 C CZ . ARG C 398 ? 0.6052 0.4636 0.5826 0.1191 -0.1013 -0.0807 457 ARG C CZ 10172 N NH1 . ARG C 398 ? 0.5396 0.3922 0.5115 0.1260 -0.1018 -0.0840 457 ARG C NH1 10173 N NH2 . ARG C 398 ? 0.5633 0.4277 0.5422 0.1127 -0.0964 -0.0790 457 ARG C NH2 10174 N N . ARG C 399 ? 0.5535 0.4261 0.5709 0.1119 -0.1188 -0.0850 458 ARG C N 10175 C CA . ARG C 399 ? 0.6302 0.5090 0.6549 0.1046 -0.1185 -0.0818 458 ARG C CA 10176 C C . ARG C 399 ? 0.5839 0.4646 0.6188 0.1045 -0.1241 -0.0835 458 ARG C C 10177 O O . ARG C 399 ? 0.6052 0.4878 0.6445 0.1012 -0.1261 -0.0810 458 ARG C O 10178 C CB . ARG C 399 ? 0.4262 0.3118 0.4532 0.0982 -0.1128 -0.0806 458 ARG C CB 10179 C CG . ARG C 399 ? 0.5276 0.4124 0.5456 0.0967 -0.1071 -0.0780 458 ARG C CG 10180 C CD . ARG C 399 ? 0.5027 0.3931 0.5220 0.0922 -0.1018 -0.0780 458 ARG C CD 10181 N NE . ARG C 399 ? 0.4379 0.3262 0.4477 0.0926 -0.0967 -0.0767 458 ARG C NE 10182 C CZ . ARG C 399 ? 0.4697 0.3611 0.4779 0.0902 -0.0919 -0.0770 458 ARG C CZ 10183 N NH1 . ARG C 399 ? 0.5157 0.4124 0.5310 0.0874 -0.0915 -0.0785 458 ARG C NH1 10184 N NH2 . ARG C 399 ? 0.6131 0.5023 0.6126 0.0908 -0.0874 -0.0758 458 ARG C NH2 10185 N N . LEU C 400 ? 0.5614 0.4415 0.6000 0.1081 -0.1266 -0.0877 459 LEU C N 10186 C CA . LEU C 400 ? 0.7105 0.5919 0.7588 0.1087 -0.1322 -0.0898 459 LEU C CA 10187 C C . LEU C 400 ? 0.7818 0.6577 0.8286 0.1131 -0.1377 -0.0895 459 LEU C C 10188 O O . LEU C 400 ? 0.6232 0.5012 0.6771 0.1105 -0.1411 -0.0883 459 LEU C O 10189 C CB . LEU C 400 ? 0.5936 0.4745 0.6448 0.1128 -0.1340 -0.0948 459 LEU C CB 10190 C CG . LEU C 400 ? 0.6198 0.5017 0.6813 0.1140 -0.1400 -0.0975 459 LEU C CG 10191 C CD1 . LEU C 400 ? 0.4304 0.3202 0.5024 0.1062 -0.1393 -0.0953 459 LEU C CD1 10192 C CD2 . LEU C 400 ? 0.4440 0.3247 0.5070 0.1189 -0.1416 -0.1027 459 LEU C CD2 10193 N N . ALA C 401 ? 0.6925 0.5611 0.7300 0.1197 -0.1385 -0.0904 460 ALA C N 10194 C CA . ALA C 401 ? 0.6966 0.5592 0.7312 0.1246 -0.1435 -0.0900 460 ALA C CA 10195 C C . ALA C 401 ? 0.7228 0.5870 0.7570 0.1198 -0.1429 -0.0852 460 ALA C C 10196 O O . ALA C 401 ? 0.7880 0.6509 0.8256 0.1205 -0.1477 -0.0844 460 ALA C O 10197 C CB . ALA C 401 ? 0.5778 0.4325 0.6014 0.1322 -0.1432 -0.0913 460 ALA C CB 10198 N N . LYS C 402 ? 0.5353 0.4024 0.5654 0.1149 -0.1370 -0.0820 461 LYS C N 10199 C CA . LYS C 402 ? 0.7557 0.6247 0.7849 0.1100 -0.1358 -0.0774 461 LYS C CA 10200 C C . LYS C 402 ? 0.6832 0.5587 0.7235 0.1039 -0.1374 -0.0764 461 LYS C C 10201 O O . LYS C 402 ? 0.7792 0.6548 0.8209 0.1019 -0.1396 -0.0738 461 LYS C O 10202 C CB . LYS C 402 ? 0.4316 0.3026 0.4544 0.1062 -0.1289 -0.0746 461 LYS C CB 10203 C CG . LYS C 402 ? 0.6568 0.5212 0.6683 0.1119 -0.1271 -0.0750 461 LYS C CG 10204 C CD . LYS C 402 ? 0.6226 0.4894 0.6284 0.1078 -0.1202 -0.0724 461 LYS C CD 10205 C CE . LYS C 402 ? 0.6942 0.5541 0.6886 0.1130 -0.1186 -0.0719 461 LYS C CE 10206 N NZ . LYS C 402 ? 0.7966 0.6588 0.7857 0.1089 -0.1121 -0.0692 461 LYS C NZ 10207 N N . ILE C 403 ? 0.6699 0.5505 0.7176 0.1010 -0.1362 -0.0784 462 ILE C N 10208 C CA . ILE C 403 ? 0.5183 0.4051 0.5771 0.0955 -0.1376 -0.0777 462 ILE C CA 10209 C C . ILE C 403 ? 0.6620 0.5461 0.7263 0.0989 -0.1446 -0.0794 462 ILE C C 10210 O O . ILE C 403 ? 0.5799 0.4661 0.6489 0.0954 -0.1466 -0.0771 462 ILE C O 10211 C CB . ILE C 403 ? 0.4417 0.3341 0.5074 0.0926 -0.1352 -0.0800 462 ILE C CB 10212 C CG1 . ILE C 403 ? 0.4829 0.3793 0.5449 0.0877 -0.1281 -0.0776 462 ILE C CG1 10213 C CG2 . ILE C 403 ? 0.4434 0.3411 0.5213 0.0883 -0.1378 -0.0801 462 ILE C CG2 10214 C CD1 . ILE C 403 ? 0.4709 0.3711 0.5362 0.0867 -0.1254 -0.0802 462 ILE C CD1 10215 N N . MSE C 404 ? 0.4628 0.3422 0.5262 0.1057 -0.1484 -0.0833 463 MSE C N 10216 C CA . MSE C 404 ? 0.6250 0.5014 0.6933 0.1098 -0.1554 -0.0854 463 MSE C CA 10217 C C . MSE C 404 ? 0.4352 0.3070 0.4983 0.1115 -0.1582 -0.0825 463 MSE C C 10218 O O . MSE C 404 ? 0.6096 0.4813 0.6784 0.1115 -0.1630 -0.0823 463 MSE C O 10219 C CB . MSE C 404 ? 0.4381 0.3094 0.5046 0.1176 -0.1586 -0.0902 463 MSE C CB 10220 C CG . MSE C 404 ? 0.4373 0.3123 0.5072 0.1167 -0.1558 -0.0933 463 MSE C CG 10221 SE SE . MSE C 404 ? 0.9903 0.8756 1.0752 0.1078 -0.1546 -0.0929 463 MSE C SE 10222 C CE . MSE C 404 ? 0.7158 0.5994 0.8104 0.1104 -0.1634 -0.0946 463 MSE C CE 10223 N N . SER C 405 ? 0.4701 0.3385 0.5227 0.1129 -0.1550 -0.0802 464 SER C N 10224 C CA . SER C 405 ? 0.5394 0.4037 0.5861 0.1142 -0.1569 -0.0771 464 SER C CA 10225 C C . SER C 405 ? 0.6778 0.5474 0.7294 0.1068 -0.1559 -0.0733 464 SER C C 10226 O O . SER C 405 ? 0.7544 0.6223 0.8070 0.1072 -0.1599 -0.0718 464 SER C O 10227 C CB . SER C 405 ? 0.5318 0.3918 0.5664 0.1168 -0.1530 -0.0755 464 SER C CB 10228 O OG . SER C 405 ? 0.8774 0.7341 0.9064 0.1173 -0.1543 -0.0721 464 SER C OG 10229 N N . HIS C 406 ? 0.6640 0.5400 0.7183 0.1002 -0.1504 -0.0718 465 HIS C N 10230 C CA . HIS C 406 ? 0.7229 0.6045 0.7822 0.0929 -0.1488 -0.0684 465 HIS C CA 10231 C C . HIS C 406 ? 0.6749 0.5598 0.7459 0.0909 -0.1531 -0.0697 465 HIS C C 10232 O O . HIS C 406 ? 0.6418 0.5287 0.7162 0.0873 -0.1544 -0.0672 465 HIS C O 10233 C CB . HIS C 406 ? 0.4624 0.3499 0.5218 0.0868 -0.1418 -0.0668 465 HIS C CB 10234 C CG . HIS C 406 ? 0.6054 0.4903 0.6539 0.0878 -0.1372 -0.0652 465 HIS C CG 10235 N ND1 . HIS C 406 ? 0.7572 0.6367 0.7970 0.0909 -0.1383 -0.0632 465 HIS C ND1 10236 C CD2 . HIS C 406 ? 0.7194 0.6063 0.7643 0.0861 -0.1316 -0.0652 465 HIS C CD2 10237 C CE1 . HIS C 406 ? 0.6880 0.5663 0.7195 0.0911 -0.1334 -0.0621 465 HIS C CE1 10238 N NE2 . HIS C 406 ? 0.8079 0.6907 0.8424 0.0882 -0.1293 -0.0633 465 HIS C NE2 10239 N N . ILE C 407 ? 0.5478 0.4332 0.6248 0.0934 -0.1552 -0.0737 466 ILE C N 10240 C CA . ILE C 407 ? 0.6393 0.5276 0.7278 0.0920 -0.1594 -0.0754 466 ILE C CA 10241 C C . ILE C 407 ? 0.7941 0.6774 0.8829 0.0964 -0.1662 -0.0758 466 ILE C C 10242 O O . ILE C 407 ? 0.5428 0.4284 0.6387 0.0934 -0.1690 -0.0747 466 ILE C O 10243 C CB . ILE C 407 ? 0.5110 0.4008 0.6055 0.0940 -0.1601 -0.0799 466 ILE C CB 10244 C CG1 . ILE C 407 ? 0.4226 0.3184 0.5185 0.0887 -0.1536 -0.0792 466 ILE C CG1 10245 C CG2 . ILE C 407 ? 0.5599 0.4518 0.6662 0.0936 -0.1652 -0.0820 466 ILE C CG2 10246 C CD1 . ILE C 407 ? 0.4261 0.3230 0.5258 0.0910 -0.1536 -0.0835 466 ILE C CD1 10247 N N . LEU C 408 ? 0.7383 0.6146 0.8192 0.1037 -0.1689 -0.0773 467 LEU C N 10248 C CA . LEU C 408 ? 0.5885 0.4591 0.6681 0.1086 -0.1753 -0.0775 467 LEU C CA 10249 C C . LEU C 408 ? 0.7300 0.6010 0.8069 0.1050 -0.1751 -0.0730 467 LEU C C 10250 O O . LEU C 408 ? 0.7250 0.5948 0.8056 0.1056 -0.1801 -0.0725 467 LEU C O 10251 C CB . LEU C 408 ? 0.6100 0.4728 0.6800 0.1171 -0.1772 -0.0794 467 LEU C CB 10252 C CG . LEU C 408 ? 0.5191 0.3753 0.5866 0.1232 -0.1839 -0.0798 467 LEU C CG 10253 C CD1 . LEU C 408 ? 0.5924 0.4498 0.6710 0.1241 -0.1899 -0.0826 467 LEU C CD1 10254 C CD2 . LEU C 408 ? 0.5452 0.3938 0.6031 0.1316 -0.1850 -0.0817 467 LEU C CD2 10255 N N . GLU C 409 ? 0.7959 0.6685 0.8661 0.1013 -0.1694 -0.0697 468 GLU C N 10256 C CA . GLU C 409 ? 0.7436 0.6167 0.8104 0.0976 -0.1685 -0.0653 468 GLU C CA 10257 C C . GLU C 409 ? 0.8070 0.6865 0.8839 0.0908 -0.1685 -0.0639 468 GLU C C 10258 O O . GLU C 409 ? 0.9061 0.7849 0.9835 0.0894 -0.1712 -0.0616 468 GLU C O 10259 C CB . GLU C 409 ? 0.7411 0.6148 0.7989 0.0952 -0.1620 -0.0625 468 GLU C CB 10260 C CG . GLU C 409 ? 1.0067 0.8818 1.0612 0.0906 -0.1603 -0.0579 468 GLU C CG 10261 C CD . GLU C 409 ? 1.2518 1.1209 1.3007 0.0950 -0.1652 -0.0565 468 GLU C CD 10262 O OE1 . GLU C 409 ? 1.4066 1.2694 1.4509 0.1021 -0.1687 -0.0586 468 GLU C OE1 10263 O OE2 . GLU C 409 ? 1.2149 1.0854 1.2637 0.0914 -0.1655 -0.0534 468 GLU C OE2 10264 N N . CYS C 410 ? 0.6856 0.5710 0.7701 0.0865 -0.1654 -0.0652 469 CYS C N 10265 C CA . CYS C 410 ? 0.7331 0.6246 0.8279 0.0802 -0.1652 -0.0641 469 CYS C CA 10266 C C . CYS C 410 ? 0.7386 0.6286 0.8414 0.0827 -0.1721 -0.0663 469 CYS C C 10267 O O . CYS C 410 ? 0.8761 0.7685 0.9844 0.0791 -0.1737 -0.0645 469 CYS C O 10268 C CB . CYS C 410 ? 0.6317 0.5295 0.7327 0.0758 -0.1605 -0.0652 469 CYS C CB 10269 S SG . CYS C 410 ? 0.6237 0.5253 0.7182 0.0702 -0.1520 -0.0617 469 CYS C SG 10270 N N . PHE C 411 ? 0.6987 0.5849 0.8023 0.0890 -0.1761 -0.0702 470 PHE C N 10271 C CA . PHE C 411 ? 0.6725 0.5569 0.7835 0.0922 -0.1830 -0.0727 470 PHE C CA 10272 C C . PHE C 411 ? 0.8194 0.6989 0.9258 0.0947 -0.1876 -0.0707 470 PHE C C 10273 O O . PHE C 411 ? 0.6401 0.5203 0.7535 0.0937 -0.1918 -0.0706 470 PHE C O 10274 C CB . PHE C 411 ? 0.5805 0.4611 0.6919 0.0990 -0.1861 -0.0775 470 PHE C CB 10275 C CG . PHE C 411 ? 0.6199 0.5056 0.7388 0.0967 -0.1835 -0.0803 470 PHE C CG 10276 C CD1 . PHE C 411 ? 0.5063 0.3993 0.6318 0.0891 -0.1790 -0.0785 470 PHE C CD1 10277 C CD2 . PHE C 411 ? 0.5657 0.4487 0.6848 0.1024 -0.1855 -0.0847 470 PHE C CD2 10278 C CE1 . PHE C 411 ? 0.6399 0.5375 0.7722 0.0871 -0.1766 -0.0810 470 PHE C CE1 10279 C CE2 . PHE C 411 ? 0.6504 0.5381 0.7763 0.1004 -0.1831 -0.0873 470 PHE C CE2 10280 C CZ . PHE C 411 ? 0.6929 0.5879 0.8254 0.0927 -0.1787 -0.0854 470 PHE C CZ 10281 N N . GLU C 412 ? 0.7430 0.6174 0.8376 0.0982 -0.1867 -0.0689 471 GLU C N 10282 C CA . GLU C 412 ? 0.6800 0.5491 0.7690 0.1014 -0.1910 -0.0670 471 GLU C CA 10283 C C . GLU C 412 ? 0.6512 0.5236 0.7398 0.0951 -0.1889 -0.0625 471 GLU C C 10284 O O . GLU C 412 ? 0.8197 0.6899 0.9084 0.0959 -0.1933 -0.0611 471 GLU C O 10285 C CB . GLU C 412 ? 0.5674 0.4299 0.6439 0.1076 -0.1907 -0.0667 471 GLU C CB 10286 C CG . GLU C 412 ? 0.6393 0.4972 0.7152 0.1151 -0.1939 -0.0711 471 GLU C CG 10287 C CD . GLU C 412 ? 0.8655 0.7168 0.9289 0.1212 -0.1929 -0.0708 471 GLU C CD 10288 O OE1 . GLU C 412 ? 0.9640 0.8155 1.0197 0.1186 -0.1884 -0.0673 471 GLU C OE1 10289 O OE2 . GLU C 412 ? 0.7843 0.6302 0.8457 0.1285 -0.1967 -0.0740 471 GLU C OE2 10290 N N . SER C 413 ? 0.6569 0.5343 0.7447 0.0891 -0.1823 -0.0604 472 SER C N 10291 C CA . SER C 413 ? 0.6777 0.5586 0.7646 0.0829 -0.1794 -0.0562 472 SER C CA 10292 C C . SER C 413 ? 0.7374 0.6241 0.8361 0.0771 -0.1799 -0.0560 472 SER C C 10293 O O . SER C 413 ? 0.9931 0.8803 1.0928 0.0745 -0.1815 -0.0536 472 SER C O 10294 C CB . SER C 413 ? 0.6874 0.5709 0.7679 0.0792 -0.1721 -0.0539 472 SER C CB 10295 O OG . SER C 413 ? 0.9841 0.8734 1.0714 0.0751 -0.1679 -0.0553 472 SER C OG 10296 N N . ARG C 414 ? 0.7331 0.6242 0.8405 0.0752 -0.1783 -0.0586 473 ARG C N 10297 C CA . ARG C 414 ? 0.5952 0.4923 0.7141 0.0693 -0.1778 -0.0584 473 ARG C CA 10298 C C . ARG C 414 ? 0.6368 0.5336 0.7660 0.0718 -0.1837 -0.0618 473 ARG C C 10299 O O . ARG C 414 ? 0.6922 0.5924 0.8303 0.0680 -0.1851 -0.0614 473 ARG C O 10300 C CB . ARG C 414 ? 0.7042 0.6074 0.8265 0.0643 -0.1712 -0.0583 473 ARG C CB 10301 C CG . ARG C 414 ? 0.7809 0.6847 0.8935 0.0621 -0.1651 -0.0554 473 ARG C CG 10302 C CD . ARG C 414 ? 0.7956 0.7017 0.9063 0.0569 -0.1628 -0.0513 473 ARG C CD 10303 N NE . ARG C 414 ? 1.1083 1.0163 1.2118 0.0538 -0.1562 -0.0488 473 ARG C NE 10304 C CZ . ARG C 414 ? 1.2797 1.1936 1.3874 0.0488 -0.1508 -0.0483 473 ARG C CZ 10305 N NH1 . ARG C 414 ? 1.3385 1.2567 1.4573 0.0462 -0.1511 -0.0500 473 ARG C NH1 10306 N NH2 . ARG C 414 ? 1.2631 1.1783 1.3638 0.0464 -0.1451 -0.0462 473 ARG C NH2 10307 N N . GLY C 415 ? 0.6559 0.5486 0.7840 0.0782 -0.1871 -0.0654 474 GLY C N 10308 C CA . GLY C 415 ? 0.6296 0.5220 0.7675 0.0809 -0.1926 -0.0692 474 GLY C CA 10309 C C . GLY C 415 ? 0.7988 0.6958 0.9438 0.0792 -0.1896 -0.0720 474 GLY C C 10310 O O . GLY C 415 ? 0.7943 0.6964 0.9403 0.0737 -0.1836 -0.0703 474 GLY C O 10311 N N . VAL C 416 ? 0.6899 0.5850 0.8400 0.0840 -0.1939 -0.0764 475 VAL C N 10312 C CA . VAL C 416 ? 0.6992 0.5981 0.8552 0.0833 -0.1915 -0.0794 475 VAL C CA 10313 C C . VAL C 416 ? 0.7279 0.6341 0.8964 0.0765 -0.1896 -0.0791 475 VAL C C 10314 O O . VAL C 416 ? 0.7550 0.6657 0.9270 0.0737 -0.1854 -0.0800 475 VAL C O 10315 C CB . VAL C 416 ? 0.8325 0.7272 0.9907 0.0905 -0.1970 -0.0844 475 VAL C CB 10316 C CG1 . VAL C 416 ? 0.8625 0.7501 1.0081 0.0974 -0.1980 -0.0850 475 VAL C CG1 10317 C CG2 . VAL C 416 ? 0.7931 0.6865 0.9597 0.0921 -0.2039 -0.0859 475 VAL C CG2 10318 N N . ALA C 417 ? 0.7594 0.6667 0.9343 0.0740 -0.1926 -0.0778 476 ALA C N 10319 C CA . ALA C 417 ? 0.6425 0.5563 0.8299 0.0680 -0.1912 -0.0776 476 ALA C CA 10320 C C . ALA C 417 ? 0.5739 0.4930 0.7602 0.0607 -0.1841 -0.0736 476 ALA C C 10321 O O . ALA C 417 ? 0.8313 0.7563 1.0271 0.0557 -0.1814 -0.0735 476 ALA C O 10322 C CB . ALA C 417 ? 0.5529 0.4658 0.7474 0.0678 -0.1968 -0.0775 476 ALA C CB 10323 N N . GLU C 418 ? 0.5452 0.4623 0.7203 0.0604 -0.1809 -0.0704 477 GLU C N 10324 C CA . GLU C 418 ? 0.8130 0.7349 0.9863 0.0539 -0.1742 -0.0667 477 GLU C CA 10325 C C . GLU C 418 ? 0.7231 0.6459 0.8897 0.0540 -0.1687 -0.0668 477 GLU C C 10326 O O . GLU C 418 ? 0.7774 0.7050 0.9445 0.0487 -0.1629 -0.0646 477 GLU C O 10327 C CB . GLU C 418 ? 0.7162 0.6359 0.8820 0.0525 -0.1739 -0.0627 477 GLU C CB 10328 C CG . GLU C 418 ? 0.9572 0.8757 1.1285 0.0523 -0.1791 -0.0623 477 GLU C CG 10329 C CD . GLU C 418 ? 1.2295 1.1504 1.3994 0.0467 -0.1762 -0.0580 477 GLU C CD 10330 O OE1 . GLU C 418 ? 1.3100 1.2342 1.4763 0.0426 -0.1700 -0.0555 477 GLU C OE1 10331 O OE2 . GLU C 418 ? 1.2171 1.1365 1.3894 0.0467 -0.1802 -0.0571 477 GLU C OE2 10332 N N . VAL C 419 ? 0.5845 0.5027 0.7450 0.0601 -0.1707 -0.0694 478 VAL C N 10333 C CA . VAL C 419 ? 0.8158 0.7344 0.9700 0.0608 -0.1659 -0.0700 478 VAL C CA 10334 C C . VAL C 419 ? 0.8035 0.7261 0.9664 0.0601 -0.1651 -0.0732 478 VAL C C 10335 O O . VAL C 419 ? 0.7131 0.6405 0.8774 0.0560 -0.1596 -0.0723 478 VAL C O 10336 C CB . VAL C 419 ? 0.5929 0.5045 0.7361 0.0678 -0.1680 -0.0714 478 VAL C CB 10337 C CG1 . VAL C 419 ? 0.6975 0.6098 0.8344 0.0682 -0.1627 -0.0719 478 VAL C CG1 10338 C CG2 . VAL C 419 ? 0.4151 0.3226 0.5496 0.0687 -0.1690 -0.0682 478 VAL C CG2 10339 N N . LEU C 420 ? 0.6253 0.5458 0.7941 0.0645 -0.1706 -0.0771 479 LEU C N 10340 C CA . LEU C 420 ? 0.5766 0.5003 0.7535 0.0647 -0.1706 -0.0807 479 LEU C CA 10341 C C . LEU C 420 ? 0.6305 0.5604 0.8206 0.0590 -0.1702 -0.0802 479 LEU C C 10342 O O . LEU C 420 ? 0.7473 0.6770 0.9462 0.0603 -0.1752 -0.0825 479 LEU C O 10343 C CB . LEU C 420 ? 0.4267 0.3454 0.6043 0.0720 -0.1767 -0.0853 479 LEU C CB 10344 C CG . LEU C 420 ? 0.6336 0.5458 0.7987 0.0785 -0.1774 -0.0863 479 LEU C CG 10345 C CD1 . LEU C 420 ? 0.6194 0.5266 0.7861 0.0858 -0.1839 -0.0909 479 LEU C CD1 10346 C CD2 . LEU C 420 ? 0.7725 0.6863 0.9315 0.0777 -0.1713 -0.0862 479 LEU C CD2 10347 N N . VAL C 421 ? 0.5862 0.5215 0.7776 0.0528 -0.1642 -0.0772 480 VAL C N 10348 C CA . VAL C 421 ? 0.5301 0.4714 0.7336 0.0471 -0.1631 -0.0764 480 VAL C CA 10349 C C . VAL C 421 ? 0.6753 0.6220 0.8829 0.0442 -0.1582 -0.0771 480 VAL C C 10350 O O . VAL C 421 ? 0.6179 0.5647 0.8175 0.0441 -0.1537 -0.0763 480 VAL C O 10351 C CB . VAL C 421 ? 0.4967 0.4401 0.6996 0.0418 -0.1605 -0.0717 480 VAL C CB 10352 C CG1 . VAL C 421 ? 0.5049 0.4432 0.7045 0.0445 -0.1656 -0.0710 480 VAL C CG1 10353 C CG2 . VAL C 421 ? 0.5305 0.4750 0.7238 0.0391 -0.1540 -0.0685 480 VAL C CG2 10354 N N . ALA C 422 ? 0.6625 0.6134 0.8824 0.0419 -0.1592 -0.0787 481 ALA C N 10355 C CA . ALA C 422 ? 0.5151 0.4712 0.7399 0.0393 -0.1551 -0.0796 481 ALA C CA 10356 C C . ALA C 422 ? 0.5651 0.5265 0.7914 0.0324 -0.1489 -0.0753 481 ALA C C 10357 O O . ALA C 422 ? 0.6856 0.6507 0.9118 0.0299 -0.1441 -0.0748 481 ALA C O 10358 C CB . ALA C 422 ? 0.4933 0.4517 0.7308 0.0399 -0.1588 -0.0831 481 ALA C CB 10359 N N . GLU C 423 ? 0.7611 0.7226 0.9886 0.0294 -0.1492 -0.0723 482 GLU C N 10360 C CA . GLU C 423 ? 0.7255 0.6911 0.9528 0.0233 -0.1435 -0.0680 482 GLU C CA 10361 C C . GLU C 423 ? 0.5554 0.5178 0.7755 0.0229 -0.1440 -0.0649 482 GLU C C 10362 O O . GLU C 423 ? 0.7046 0.6633 0.9253 0.0256 -0.1493 -0.0658 482 GLU C O 10363 C CB . GLU C 423 ? 0.8129 0.7840 1.0538 0.0186 -0.1427 -0.0675 482 GLU C CB 10364 C CG . GLU C 423 ? 1.0576 1.0335 1.2993 0.0125 -0.1363 -0.0634 482 GLU C CG 10365 C CD . GLU C 423 ? 1.0004 0.9807 1.2550 0.0082 -0.1363 -0.0625 482 GLU C CD 10366 O OE1 . GLU C 423 ? 1.0772 1.0579 1.3413 0.0096 -0.1405 -0.0655 482 GLU C OE1 10367 O OE2 . GLU C 423 ? 1.0704 1.0536 1.3256 0.0034 -0.1320 -0.0589 482 GLU C OE2 10368 N N . TYR C 424 ? 0.6156 0.5794 0.8286 0.0197 -0.1387 -0.0614 483 TYR C N 10369 C CA . TYR C 424 ? 0.6620 0.6230 0.8677 0.0191 -0.1387 -0.0583 483 TYR C CA 10370 C C . TYR C 424 ? 0.6445 0.6094 0.8565 0.0134 -0.1364 -0.0552 483 TYR C C 10371 O O . TYR C 424 ? 0.6690 0.6390 0.8852 0.0090 -0.1315 -0.0536 483 TYR C O 10372 C CB . TYR C 424 ? 0.5727 0.5320 0.7657 0.0196 -0.1346 -0.0565 483 TYR C CB 10373 C CG . TYR C 424 ? 0.5425 0.4993 0.7279 0.0186 -0.1343 -0.0532 483 TYR C CG 10374 C CD1 . TYR C 424 ? 0.3906 0.3418 0.5712 0.0228 -0.1394 -0.0538 483 TYR C CD1 10375 C CD2 . TYR C 424 ? 0.4017 0.3617 0.5849 0.0137 -0.1289 -0.0495 483 TYR C CD2 10376 C CE1 . TYR C 424 ? 0.3905 0.3396 0.5642 0.0219 -0.1392 -0.0508 483 TYR C CE1 10377 C CE2 . TYR C 424 ? 0.4031 0.3610 0.5794 0.0128 -0.1286 -0.0467 483 TYR C CE2 10378 C CZ . TYR C 424 ? 0.5400 0.4924 0.7115 0.0169 -0.1338 -0.0473 483 TYR C CZ 10379 O OH . TYR C 424 ? 0.7407 0.6909 0.9050 0.0161 -0.1336 -0.0444 483 TYR C OH 10380 N N . ASN C 425 ? 0.7681 0.7306 0.9805 0.0136 -0.1400 -0.0542 484 ASN C N 10381 C CA . ASN C 425 ? 0.7717 0.7371 0.9889 0.0086 -0.1381 -0.0512 484 ASN C CA 10382 C C . ASN C 425 ? 0.7750 0.7366 0.9833 0.0089 -0.1391 -0.0486 484 ASN C C 10383 O O . ASN C 425 ? 0.5462 0.5031 0.7517 0.0129 -0.1445 -0.0498 484 ASN C O 10384 C CB . ASN C 425 ? 0.4791 0.4462 0.7096 0.0077 -0.1419 -0.0529 484 ASN C CB 10385 C CG . ASN C 425 ? 0.6361 0.6074 0.8760 0.0069 -0.1406 -0.0552 484 ASN C CG 10386 O OD1 . ASN C 425 ? 0.8000 0.7698 1.0438 0.0107 -0.1448 -0.0589 484 ASN C OD1 10387 N ND2 . ASN C 425 ? 0.5509 0.5274 0.7946 0.0021 -0.1349 -0.0531 484 ASN C ND2 10388 N N . ASN C 426 ? 0.8305 0.7943 1.0343 0.0050 -0.1339 -0.0451 485 ASN C N 10389 C CA . ASN C 426 ? 0.8495 0.8102 1.0444 0.0049 -0.1342 -0.0425 485 ASN C CA 10390 C C . ASN C 426 ? 0.9618 0.9238 1.1625 0.0015 -0.1351 -0.0406 485 ASN C C 10391 O O . ASN C 426 ? 0.9008 0.8673 1.1067 -0.0033 -0.1308 -0.0387 485 ASN C O 10392 C CB . ASN C 426 ? 0.7659 0.7277 0.9513 0.0029 -0.1282 -0.0398 485 ASN C CB 10393 C CG . ASN C 426 ? 0.9079 0.8661 1.0830 0.0034 -0.1285 -0.0373 485 ASN C CG 10394 O OD1 . ASN C 426 ? 1.0178 0.9719 1.1910 0.0062 -0.1337 -0.0378 485 ASN C OD1 10395 N ND2 . ASN C 426 ? 0.8673 0.8270 1.0355 0.0007 -0.1231 -0.0347 485 ASN C ND2 10396 N N . PRO C 427 ? 1.0500 1.0079 1.2499 0.0042 -0.1408 -0.0411 486 PRO C N 10397 C CA . PRO C 427 ? 1.1228 1.0809 1.3270 0.0016 -0.1424 -0.0394 486 PRO C CA 10398 C C . PRO C 427 ? 1.0334 0.9936 1.2326 -0.0029 -0.1371 -0.0355 486 PRO C C 10399 O O . PRO C 427 ? 0.7910 0.7538 0.9966 -0.0067 -0.1359 -0.0340 486 PRO C O 10400 C CB . PRO C 427 ? 1.0104 0.9625 1.2090 0.0063 -0.1488 -0.0402 486 PRO C CB 10401 C CG . PRO C 427 ? 0.9355 0.8845 1.1307 0.0116 -0.1515 -0.0432 486 PRO C CG 10402 C CD . PRO C 427 ? 0.9096 0.8623 1.1059 0.0102 -0.1465 -0.0439 486 PRO C CD 10403 N N . ASP C 428 ? 1.0196 0.9786 1.2076 -0.0023 -0.1338 -0.0340 487 ASP C N 10404 C CA . ASP C 428 ? 0.8531 0.8132 1.0347 -0.0058 -0.1293 -0.0305 487 ASP C CA 10405 C C . ASP C 428 ? 1.0319 0.9977 1.2180 -0.0107 -0.1227 -0.0290 487 ASP C C 10406 O O . ASP C 428 ? 0.9511 0.9183 1.1325 -0.0137 -0.1184 -0.0261 487 ASP C O 10407 C CB . ASP C 428 ? 1.0891 1.0456 1.2571 -0.0032 -0.1285 -0.0295 487 ASP C CB 10408 C CG . ASP C 428 ? 1.1030 1.0536 1.2654 0.0017 -0.1348 -0.0305 487 ASP C CG 10409 O OD1 . ASP C 428 ? 0.9545 0.9020 1.1066 0.0026 -0.1348 -0.0286 487 ASP C OD1 10410 O OD2 . ASP C 428 ? 1.0417 0.9906 1.2101 0.0047 -0.1398 -0.0332 487 ASP C OD2 10411 N N . VAL C 429 ? 1.0886 1.0576 1.2837 -0.0112 -0.1219 -0.0309 488 VAL C N 10412 C CA . VAL C 429 ? 1.1868 1.1612 1.3866 -0.0155 -0.1158 -0.0295 488 VAL C CA 10413 C C . VAL C 429 ? 1.2760 1.2539 1.4895 -0.0181 -0.1162 -0.0301 488 VAL C C 10414 O O . VAL C 429 ? 1.0824 1.0607 1.3036 -0.0164 -0.1194 -0.0329 488 VAL C O 10415 C CB . VAL C 429 ? 1.1175 1.0932 1.3151 -0.0142 -0.1131 -0.0309 488 VAL C CB 10416 C CG1 . VAL C 429 ? 0.9619 0.9431 1.1648 -0.0185 -0.1070 -0.0294 488 VAL C CG1 10417 C CG2 . VAL C 429 ? 0.7732 0.7456 0.9573 -0.0119 -0.1120 -0.0301 488 VAL C CG2 10418 N N . SER C 430 ? 1.4415 1.4219 1.6577 -0.0223 -0.1130 -0.0275 489 SER C N 10419 C CA . SER C 430 ? 1.3497 1.3336 1.5785 -0.0255 -0.1124 -0.0273 489 SER C CA 10420 C C . SER C 430 ? 1.4282 1.4137 1.6683 -0.0243 -0.1153 -0.0304 489 SER C C 10421 O O . SER C 430 ? 1.3671 1.3514 1.6144 -0.0234 -0.1201 -0.0319 489 SER C O 10422 C CB . SER C 430 ? 1.1785 1.1669 1.4085 -0.0299 -0.1053 -0.0247 489 SER C CB 10423 O OG . SER C 430 ? 1.1717 1.1620 1.3988 -0.0295 -0.1017 -0.0250 489 SER C OG 10424 N N . LEU D 2 ? 0.6424 0.8673 0.9938 -0.0229 0.0423 0.0768 61 LEU D N 10425 C CA . LEU D 2 ? 0.7928 1.0157 1.1540 -0.0252 0.0415 0.0736 61 LEU D CA 10426 C C . LEU D 2 ? 0.8892 1.1107 1.2463 -0.0256 0.0370 0.0654 61 LEU D C 10427 O O . LEU D 2 ? 1.2304 1.4543 1.5925 -0.0258 0.0342 0.0609 61 LEU D O 10428 C CB . LEU D 2 ? 0.8899 1.1159 1.2701 -0.0268 0.0426 0.0748 61 LEU D CB 10429 C CG . LEU D 2 ? 0.8482 1.0728 1.2400 -0.0292 0.0412 0.0706 61 LEU D CG 10430 C CD1 . LEU D 2 ? 0.9022 1.1233 1.2936 -0.0299 0.0439 0.0738 61 LEU D CD1 10431 C CD2 . LEU D 2 ? 0.5780 0.8064 0.9880 -0.0307 0.0413 0.0704 61 LEU D CD2 10432 N N . PRO D 3 ? 0.6162 0.8335 0.9640 -0.0256 0.0364 0.0635 62 PRO D N 10433 C CA . PRO D 3 ? 0.6128 0.8281 0.9584 -0.0262 0.0323 0.0559 62 PRO D CA 10434 C C . PRO D 3 ? 0.6271 0.8429 0.9891 -0.0284 0.0312 0.0531 62 PRO D C 10435 O O . PRO D 3 ? 0.5695 0.7847 0.9401 -0.0298 0.0340 0.0569 62 PRO D O 10436 C CB . PRO D 3 ? 0.4050 0.6158 0.7376 -0.0257 0.0328 0.0560 62 PRO D CB 10437 C CG . PRO D 3 ? 0.3516 0.5624 0.6755 -0.0242 0.0363 0.0628 62 PRO D CG 10438 C CD . PRO D 3 ? 0.3909 0.6051 0.7276 -0.0247 0.0391 0.0680 62 PRO D CD 10439 N N . HIS D 4 ? 0.5071 0.7238 0.8733 -0.0288 0.0274 0.0465 63 HIS D N 10440 C CA . HIS D 4 ? 0.3396 0.5567 0.7212 -0.0308 0.0259 0.0434 63 HIS D CA 10441 C C . HIS D 4 ? 0.4328 0.6454 0.8121 -0.0318 0.0254 0.0415 63 HIS D C 10442 O O . HIS D 4 ? 0.4788 0.6909 0.8695 -0.0337 0.0264 0.0425 63 HIS D O 10443 C CB . HIS D 4 ? 0.4514 0.6706 0.8376 -0.0306 0.0217 0.0367 63 HIS D CB 10444 C CG . HIS D 4 ? 0.4743 0.6981 0.8657 -0.0300 0.0222 0.0384 63 HIS D CG 10445 N ND1 . HIS D 4 ? 0.3541 0.5795 0.7377 -0.0286 0.0248 0.0437 63 HIS D ND1 10446 C CD2 . HIS D 4 ? 0.4818 0.7092 0.8855 -0.0306 0.0202 0.0354 63 HIS D CD2 10447 C CE1 . HIS D 4 ? 0.5310 0.7607 0.9217 -0.0283 0.0245 0.0440 63 HIS D CE1 10448 N NE2 . HIS D 4 ? 0.4093 0.6403 0.8124 -0.0296 0.0218 0.0389 63 HIS D NE2 10449 N N . GLN D 5 ? 0.4131 0.6225 0.7776 -0.0305 0.0238 0.0387 64 GLN D N 10450 C CA . GLN D 5 ? 0.4936 0.6986 0.8535 -0.0312 0.0237 0.0377 64 GLN D CA 10451 C C . GLN D 5 ? 0.5545 0.7576 0.9026 -0.0303 0.0271 0.0431 64 GLN D C 10452 O O . GLN D 5 ? 0.5039 0.7055 0.8374 -0.0285 0.0265 0.0423 64 GLN D O 10453 C CB . GLN D 5 ? 0.3710 0.5734 0.7232 -0.0304 0.0195 0.0304 64 GLN D CB 10454 C CG . GLN D 5 ? 0.4578 0.6613 0.8219 -0.0313 0.0159 0.0245 64 GLN D CG 10455 C CD . GLN D 5 ? 0.4776 0.6778 0.8342 -0.0303 0.0119 0.0177 64 GLN D CD 10456 O OE1 . GLN D 5 ? 0.4713 0.6677 0.8203 -0.0303 0.0121 0.0174 64 GLN D OE1 10457 N NE2 . GLN D 5 ? 0.3122 0.5139 0.6709 -0.0294 0.0083 0.0120 64 GLN D NE2 10458 N N . PRO D 6 ? 0.4400 0.6429 0.7942 -0.0313 0.0308 0.0488 65 PRO D N 10459 C CA . PRO D 6 ? 0.4003 0.6016 0.7445 -0.0303 0.0343 0.0545 65 PRO D CA 10460 C C . PRO D 6 ? 0.3381 0.5349 0.6728 -0.0303 0.0340 0.0531 65 PRO D C 10461 O O . PRO D 6 ? 0.4520 0.6468 0.7889 -0.0313 0.0314 0.0481 65 PRO D O 10462 C CB . PRO D 6 ? 0.3026 0.5057 0.6592 -0.0313 0.0381 0.0604 65 PRO D CB 10463 C CG . PRO D 6 ? 0.4661 0.6693 0.8369 -0.0335 0.0365 0.0570 65 PRO D CG 10464 C CD . PRO D 6 ? 0.4014 0.6057 0.7726 -0.0333 0.0319 0.0501 65 PRO D CD 10465 N N . ILE D 7 ? 0.4063 0.6014 0.7306 -0.0292 0.0367 0.0576 66 ILE D N 10466 C CA . ILE D 7 ? 0.6054 0.7963 0.9209 -0.0292 0.0371 0.0572 66 ILE D CA 10467 C C . ILE D 7 ? 0.4479 0.6374 0.7740 -0.0312 0.0385 0.0583 66 ILE D C 10468 O O . ILE D 7 ? 0.4667 0.6585 0.8058 -0.0322 0.0402 0.0609 66 ILE D O 10469 C CB . ILE D 7 ? 0.5912 0.7810 0.8943 -0.0275 0.0400 0.0623 66 ILE D CB 10470 C CG1 . ILE D 7 ? 0.4198 0.6118 0.7300 -0.0273 0.0439 0.0693 66 ILE D CG1 10471 C CG2 . ILE D 7 ? 0.6962 0.8866 0.9867 -0.0256 0.0384 0.0607 66 ILE D CG2 10472 C CD1 . ILE D 7 ? 0.6275 0.8182 0.9266 -0.0256 0.0469 0.0745 66 ILE D CD1 10473 N N . PRO D 8 ? 0.4394 0.6250 0.7599 -0.0316 0.0378 0.0562 67 PRO D N 10474 C CA . PRO D 8 ? 0.3618 0.5457 0.6902 -0.0332 0.0397 0.0579 67 PRO D CA 10475 C C . PRO D 8 ? 0.5297 0.7144 0.8601 -0.0328 0.0443 0.0652 67 PRO D C 10476 O O . PRO D 8 ? 0.4003 0.5842 0.7197 -0.0311 0.0460 0.0684 67 PRO D O 10477 C CB . PRO D 8 ? 0.3730 0.5527 0.6910 -0.0331 0.0384 0.0550 67 PRO D CB 10478 C CG . PRO D 8 ? 0.3782 0.5576 0.6880 -0.0322 0.0346 0.0496 67 PRO D CG 10479 C CD . PRO D 8 ? 0.4691 0.6518 0.7766 -0.0308 0.0351 0.0515 67 PRO D CD 10480 N N . PRO D 9 ? 0.5107 0.6967 0.8548 -0.0341 0.0463 0.0677 68 PRO D N 10481 C CA . PRO D 9 ? 0.5337 0.7204 0.8812 -0.0335 0.0508 0.0746 68 PRO D CA 10482 C C . PRO D 9 ? 0.5668 0.7502 0.9038 -0.0325 0.0532 0.0777 68 PRO D C 10483 O O . PRO D 9 ? 0.7233 0.9072 1.0572 -0.0310 0.0565 0.0833 68 PRO D O 10484 C CB . PRO D 9 ? 0.4089 0.5965 0.7727 -0.0355 0.0519 0.0751 68 PRO D CB 10485 C CG . PRO D 9 ? 0.5231 0.7092 0.8896 -0.0372 0.0480 0.0686 68 PRO D CG 10486 C CD . PRO D 9 ? 0.4338 0.6203 0.7912 -0.0362 0.0443 0.0640 68 PRO D CD 10487 N N . SER D 10 ? 0.3498 0.5299 0.6813 -0.0332 0.0516 0.0742 69 SER D N 10488 C CA . SER D 10 ? 0.5339 0.7108 0.8549 -0.0323 0.0535 0.0765 69 SER D CA 10489 C C . SER D 10 ? 0.5747 0.7515 0.8815 -0.0301 0.0535 0.0778 69 SER D C 10490 O O . SER D 10 ? 0.7004 0.8756 0.9996 -0.0288 0.0561 0.0817 69 SER D O 10491 C CB . SER D 10 ? 0.3628 0.5362 0.6808 -0.0336 0.0513 0.0719 69 SER D CB 10492 O OG . SER D 10 ? 0.4895 0.6624 0.8001 -0.0333 0.0474 0.0665 69 SER D OG 10493 N N . LEU D 11 ? 0.5053 0.6837 0.8084 -0.0297 0.0506 0.0744 70 LEU D N 10494 C CA . LEU D 11 ? 0.5227 0.7012 0.8123 -0.0276 0.0504 0.0753 70 LEU D CA 10495 C C . LEU D 11 ? 0.5456 0.7275 0.8374 -0.0263 0.0522 0.0798 70 LEU D C 10496 O O . LEU D 11 ? 0.5131 0.6955 0.7946 -0.0245 0.0520 0.0808 70 LEU D O 10497 C CB . LEU D 11 ? 0.3230 0.5010 0.6058 -0.0276 0.0462 0.0689 70 LEU D CB 10498 C CG . LEU D 11 ? 0.6085 0.7827 0.8860 -0.0284 0.0442 0.0643 70 LEU D CG 10499 C CD1 . LEU D 11 ? 0.3032 0.4772 0.5750 -0.0280 0.0402 0.0581 70 LEU D CD1 10500 C CD2 . LEU D 11 ? 0.3015 0.4727 0.5675 -0.0274 0.0461 0.0669 70 LEU D CD2 10501 N N . GLY D 12 ? 0.6211 0.8053 0.9264 -0.0271 0.0541 0.0826 71 GLY D N 10502 C CA . GLY D 12 ? 0.5676 0.7551 0.8764 -0.0258 0.0559 0.0871 71 GLY D CA 10503 C C . GLY D 12 ? 0.7372 0.9244 1.0477 -0.0247 0.0604 0.0941 71 GLY D C 10504 O O . GLY D 12 ? 0.7134 0.8976 1.0209 -0.0246 0.0621 0.0956 71 GLY D O 10505 N N . GLU D 13 ? 0.6431 0.8333 0.9584 -0.0236 0.0622 0.0983 72 GLU D N 10506 C CA . GLU D 13 ? 0.7596 0.9497 1.0776 -0.0222 0.0666 0.1052 72 GLU D CA 10507 C C . GLU D 13 ? 0.7522 0.9414 1.0830 -0.0239 0.0686 0.1060 72 GLU D C 10508 O O . GLU D 13 ? 0.7035 0.8947 1.0468 -0.0257 0.0677 0.1039 72 GLU D O 10509 C CB . GLU D 13 ? 0.8988 1.0925 1.2205 -0.0208 0.0679 0.1093 72 GLU D CB 10510 C CG . GLU D 13 ? 1.0934 1.2879 1.4016 -0.0187 0.0666 0.1097 72 GLU D CG 10511 C CD . GLU D 13 ? 1.1909 1.3829 1.4872 -0.0163 0.0689 0.1142 72 GLU D CD 10512 O OE1 . GLU D 13 ? 1.1987 1.3878 1.4848 -0.0163 0.0677 0.1116 72 GLU D OE1 10513 O OE2 . GLU D 13 ? 1.2244 1.4174 1.5214 -0.0143 0.0719 0.1202 72 GLU D OE2 10514 N N . LYS D 14 ? 0.6878 0.8740 1.0153 -0.0232 0.0712 0.1088 73 LYS D N 10515 C CA . LYS D 14 ? 0.6339 0.8188 0.9719 -0.0246 0.0733 0.1097 73 LYS D CA 10516 C C . LYS D 14 ? 0.7083 0.8954 1.0590 -0.0243 0.0767 0.1146 73 LYS D C 10517 O O . LYS D 14 ? 0.8776 1.0654 1.2260 -0.0219 0.0795 0.1201 73 LYS D O 10518 C CB . LYS D 14 ? 0.6490 0.8300 0.9789 -0.0237 0.0752 0.1114 73 LYS D CB 10519 C CG . LYS D 14 ? 0.8463 1.0247 1.1678 -0.0249 0.0720 0.1058 73 LYS D CG 10520 C CD . LYS D 14 ? 1.0903 1.2659 1.3972 -0.0230 0.0727 0.1073 73 LYS D CD 10521 C CE . LYS D 14 ? 1.1032 1.2762 1.4023 -0.0242 0.0696 0.1016 73 LYS D CE 10522 N NZ . LYS D 14 ? 0.9717 1.1429 1.2783 -0.0263 0.0696 0.0993 73 LYS D NZ 10523 N N . ASP D 15 ? 0.7188 0.9070 1.0832 -0.0265 0.0764 0.1125 74 ASP D N 10524 C CA . ASP D 15 ? 0.7398 0.9300 1.1178 -0.0266 0.0795 0.1166 74 ASP D CA 10525 C C . ASP D 15 ? 0.8139 1.0014 1.1934 -0.0255 0.0840 0.1214 74 ASP D C 10526 O O . ASP D 15 ? 0.8885 1.0733 1.2686 -0.0267 0.0841 0.1195 74 ASP D O 10527 C CB . ASP D 15 ? 0.6454 0.8373 1.0374 -0.0295 0.0776 0.1124 74 ASP D CB 10528 C CG . ASP D 15 ? 0.7919 0.9862 1.1985 -0.0297 0.0807 0.1163 74 ASP D CG 10529 O OD1 . ASP D 15 ? 0.9372 1.1324 1.3430 -0.0274 0.0840 0.1222 74 ASP D OD1 10530 O OD2 . ASP D 15 ? 0.9518 1.1472 1.3710 -0.0320 0.0798 0.1136 74 ASP D OD2 10531 N N . LEU D 16 ? 0.8055 0.9938 1.1853 -0.0231 0.0876 0.1277 75 LEU D N 10532 C CA . LEU D 16 ? 0.7714 0.9570 1.1514 -0.0214 0.0920 0.1326 75 LEU D CA 10533 C C . LEU D 16 ? 0.7861 0.9726 1.1818 -0.0222 0.0953 0.1353 75 LEU D C 10534 O O . LEU D 16 ? 0.7360 0.9204 1.1336 -0.0208 0.0992 0.1395 75 LEU D O 10535 C CB . LEU D 16 ? 0.7130 0.8984 1.0833 -0.0178 0.0943 0.1382 75 LEU D CB 10536 C CG . LEU D 16 ? 0.7550 0.9394 1.1089 -0.0164 0.0919 0.1369 75 LEU D CG 10537 C CD1 . LEU D 16 ? 0.6915 0.8732 1.0386 -0.0181 0.0891 0.1314 75 LEU D CD1 10538 C CD2 . LEU D 16 ? 0.6544 0.8422 1.0056 -0.0162 0.0891 0.1356 75 LEU D CD2 10539 N N . SER D 17 ? 0.7127 0.9022 1.1198 -0.0243 0.0937 0.1329 76 SER D N 10540 C CA . SER D 17 ? 0.5496 0.7403 0.9724 -0.0251 0.0967 0.1354 76 SER D CA 10541 C C . SER D 17 ? 0.5784 0.7662 1.0068 -0.0269 0.0977 0.1337 76 SER D C 10542 O O . SER D 17 ? 0.6263 0.8122 1.0492 -0.0284 0.0948 0.1289 76 SER D O 10543 C CB . SER D 17 ? 0.6178 0.8125 1.0513 -0.0271 0.0943 0.1326 76 SER D CB 10544 O OG . SER D 17 ? 0.8106 1.0053 1.2447 -0.0299 0.0898 0.1257 76 SER D OG 10545 N N . ASP D 18 ? 0.7473 0.9349 1.1865 -0.0267 0.1019 0.1376 77 ASP D N 10546 C CA . ASP D 18 ? 0.6181 0.8031 1.0638 -0.0283 0.1033 0.1364 77 ASP D CA 10547 C C . ASP D 18 ? 0.7040 0.8908 1.1613 -0.0319 0.1002 0.1312 77 ASP D C 10548 O O . ASP D 18 ? 0.6401 0.8299 1.1092 -0.0327 0.1008 0.1320 77 ASP D O 10549 C CB . ASP D 18 ? 0.7278 0.9117 1.1808 -0.0265 0.1091 0.1426 77 ASP D CB 10550 C CG . ASP D 18 ? 0.7829 0.9638 1.2415 -0.0279 0.1109 0.1417 77 ASP D CG 10551 O OD1 . ASP D 18 ? 0.7675 0.9468 1.2219 -0.0298 0.1079 0.1368 77 ASP D OD1 10552 O OD2 . ASP D 18 ? 0.7819 0.9622 1.2491 -0.0269 0.1154 0.1459 77 ASP D OD2 10553 N N . PRO D 19 ? 0.5522 0.7371 1.0061 -0.0339 0.0970 0.1258 78 PRO D N 10554 C CA . PRO D 19 ? 0.4753 0.6617 0.9394 -0.0372 0.0936 0.1204 78 PRO D CA 10555 C C . PRO D 19 ? 0.4870 0.6735 0.9667 -0.0386 0.0966 0.1220 78 PRO D C 10556 O O . PRO D 19 ? 0.6454 0.8333 1.1355 -0.0412 0.0942 0.1182 78 PRO D O 10557 C CB . PRO D 19 ? 0.5149 0.6984 0.9699 -0.0384 0.0903 0.1154 78 PRO D CB 10558 C CG . PRO D 19 ? 0.5327 0.7142 0.9718 -0.0358 0.0909 0.1174 78 PRO D CG 10559 C CD . PRO D 19 ? 0.5864 0.7679 1.0266 -0.0332 0.0961 0.1244 78 PRO D CD 10560 N N . PHE D 20 ? 0.5270 0.7117 1.0080 -0.0368 0.1017 0.1275 79 PHE D N 10561 C CA . PHE D 20 ? 0.6885 0.8727 1.1833 -0.0379 0.1051 0.1294 79 PHE D CA 10562 C C . PHE D 20 ? 0.6592 0.8446 1.1597 -0.0355 0.1101 0.1361 79 PHE D C 10563 O O . PHE D 20 ? 0.6833 0.8671 1.1905 -0.0349 0.1146 0.1397 79 PHE D O 10564 C CB . PHE D 20 ? 0.5846 0.7648 1.0762 -0.0382 0.1065 0.1289 79 PHE D CB 10565 C CG . PHE D 20 ? 0.4976 0.6764 0.9834 -0.0404 0.1017 0.1226 79 PHE D CG 10566 C CD1 . PHE D 20 ? 0.5569 0.7363 1.0527 -0.0435 0.0991 0.1180 79 PHE D CD1 10567 C CD2 . PHE D 20 ? 0.4041 0.5810 0.8744 -0.0392 0.0997 0.1211 79 PHE D CD2 10568 C CE1 . PHE D 20 ? 0.4705 0.6485 0.9608 -0.0452 0.0945 0.1123 79 PHE D CE1 10569 C CE2 . PHE D 20 ? 0.4564 0.6320 0.9213 -0.0411 0.0953 0.1154 79 PHE D CE2 10570 C CZ . PHE D 20 ? 0.5822 0.7583 1.0571 -0.0440 0.0927 0.1110 79 PHE D CZ 10571 N N . ASN D 21 ? 0.7692 0.9575 1.2668 -0.0340 0.1095 0.1378 80 ASN D N 10572 C CA . ASN D 21 ? 0.7115 0.9014 1.2147 -0.0317 0.1138 0.1441 80 ASN D CA 10573 C C . ASN D 21 ? 0.6774 0.8706 1.1974 -0.0338 0.1138 0.1434 80 ASN D C 10574 O O . ASN D 21 ? 0.8825 1.0788 1.4067 -0.0327 0.1148 0.1463 80 ASN D O 10575 C CB . ASN D 21 ? 0.7820 0.9732 1.2738 -0.0290 0.1130 0.1464 80 ASN D CB 10576 C CG . ASN D 21 ? 0.8563 1.0483 1.3515 -0.0259 0.1179 0.1536 80 ASN D CG 10577 O OD1 . ASN D 21 ? 0.8862 1.0767 1.3890 -0.0251 0.1225 0.1574 80 ASN D OD1 10578 N ND2 . ASN D 21 ? 0.8485 1.0428 1.3379 -0.0241 0.1170 0.1554 80 ASN D ND2 10579 N N . PHE D 22 ? 0.5225 0.7152 1.0520 -0.0368 0.1127 0.1396 81 PHE D N 10580 C CA . PHE D 22 ? 0.5790 0.7747 1.1254 -0.0389 0.1128 0.1389 81 PHE D CA 10581 C C . PHE D 22 ? 0.6603 0.8538 1.2173 -0.0394 0.1173 0.1415 81 PHE D C 10582 O O . PHE D 22 ? 0.7460 0.9358 1.2981 -0.0393 0.1185 0.1413 81 PHE D O 10583 C CB . PHE D 22 ? 0.5140 0.7114 1.0638 -0.0422 0.1070 0.1316 81 PHE D CB 10584 C CG . PHE D 22 ? 0.4935 0.6878 1.0401 -0.0441 0.1048 0.1271 81 PHE D CG 10585 C CD1 . PHE D 22 ? 0.4338 0.6271 0.9924 -0.0463 0.1058 0.1259 81 PHE D CD1 10586 C CD2 . PHE D 22 ? 0.3689 0.5612 0.9006 -0.0436 0.1016 0.1241 81 PHE D CD2 10587 C CE1 . PHE D 22 ? 0.3912 0.5816 0.9467 -0.0480 0.1037 0.1218 81 PHE D CE1 10588 C CE2 . PHE D 22 ? 0.4228 0.6122 0.9514 -0.0453 0.0996 0.1201 81 PHE D CE2 10589 C CZ . PHE D 22 ? 0.3663 0.5547 0.9067 -0.0474 0.1006 0.1190 81 PHE D CZ 10590 N N . LEU D 23 ? 0.6946 0.8905 1.2664 -0.0399 0.1199 0.1438 82 LEU D N 10591 C CA . LEU D 23 ? 0.7223 0.9163 1.3054 -0.0405 0.1244 0.1463 82 LEU D CA 10592 C C . LEU D 23 ? 0.6831 0.8776 1.2770 -0.0444 0.1214 0.1408 82 LEU D C 10593 O O . LEU D 23 ? 0.8123 1.0101 1.4132 -0.0465 0.1177 0.1370 82 LEU D O 10594 C CB . LEU D 23 ? 0.8609 1.0569 1.4547 -0.0388 0.1292 0.1522 82 LEU D CB 10595 C CG . LEU D 23 ? 0.9274 1.1219 1.5131 -0.0346 0.1339 0.1591 82 LEU D CG 10596 C CD1 . LEU D 23 ? 0.8888 1.0847 1.4606 -0.0326 0.1310 0.1593 82 LEU D CD1 10597 C CD2 . LEU D 23 ? 0.9331 1.1290 1.5319 -0.0333 0.1389 0.1647 82 LEU D CD2 10598 N N . PHE D 24 ? 0.7682 0.9592 1.3631 -0.0452 0.1231 0.1402 83 PHE D N 10599 C CA . PHE D 24 ? 0.7565 0.9475 1.3619 -0.0487 0.1207 0.1355 83 PHE D CA 10600 C C . PHE D 24 ? 0.8102 0.9989 1.4259 -0.0490 0.1259 0.1386 83 PHE D C 10601 O O . PHE D 24 ? 0.8341 1.0190 1.4436 -0.0480 0.1283 0.1398 83 PHE D O 10602 C CB . PHE D 24 ? 0.6930 0.8817 1.2880 -0.0501 0.1161 0.1299 83 PHE D CB 10603 C CG . PHE D 24 ? 0.6872 0.8767 1.2921 -0.0537 0.1122 0.1242 83 PHE D CG 10604 C CD1 . PHE D 24 ? 0.4808 0.6737 1.1008 -0.0556 0.1113 0.1230 83 PHE D CD1 10605 C CD2 . PHE D 24 ? 0.6674 0.8538 1.2668 -0.0551 0.1096 0.1201 83 PHE D CD2 10606 C CE1 . PHE D 24 ? 0.5230 0.7164 1.1522 -0.0587 0.1077 0.1177 83 PHE D CE1 10607 C CE2 . PHE D 24 ? 0.6468 0.8337 1.2553 -0.0583 0.1061 0.1150 83 PHE D CE2 10608 C CZ . PHE D 24 ? 0.5431 0.7334 1.1665 -0.0600 0.1051 0.1137 83 PHE D CZ 10609 N N . SER D 25 ? 0.9326 1.1238 1.5643 -0.0502 0.1276 0.1397 84 SER D N 10610 C CA . SER D 25 ? 1.0240 1.2133 1.6670 -0.0506 0.1325 0.1425 84 SER D CA 10611 C C . SER D 25 ? 0.9596 1.1469 1.6059 -0.0537 0.1299 0.1374 84 SER D C 10612 O O . SER D 25 ? 1.0159 1.2047 1.6618 -0.0561 0.1242 0.1316 84 SER D O 10613 C CB . SER D 25 ? 0.9674 1.1601 1.6270 -0.0512 0.1349 0.1448 84 SER D CB 10614 O OG . SER D 25 ? 0.9785 1.1674 1.6454 -0.0511 0.1387 0.1465 84 SER D OG 10615 N N . SER D 26 ? 0.8843 1.0683 1.5337 -0.0534 0.1342 0.1397 85 SER D N 10616 C CA . SER D 26 ? 0.9227 1.1044 1.5748 -0.0561 0.1323 0.1355 85 SER D CA 10617 C C . SER D 26 ? 0.9535 1.1351 1.6222 -0.0577 0.1354 0.1364 85 SER D C 10618 O O . SER D 26 ? 0.8872 1.0646 1.5548 -0.0553 0.1403 0.1404 85 SER D O 10619 C CB . SER D 26 ? 0.8745 1.0515 1.5136 -0.0545 0.1342 0.1365 85 SER D CB 10620 O OG . SER D 26 ? 0.8532 1.0281 1.4942 -0.0572 0.1320 0.1322 85 SER D OG 10621 N N . ASN D 27 ? 0.8877 1.0716 1.5669 -0.0607 0.1313 0.1319 86 ASN D N 10622 C CA . ASN D 27 ? 0.7006 0.8825 1.3912 -0.0616 0.1325 0.1313 86 ASN D CA 10623 C C . ASN D 27 ? 0.7806 0.9575 1.4694 -0.0619 0.1348 0.1312 86 ASN D C 10624 O O . ASN D 27 ? 0.8630 1.0397 1.5500 -0.0642 0.1316 0.1273 86 ASN D O 10625 C CB . ASN D 27 ? 0.6152 0.8008 1.3166 -0.0650 0.1270 0.1258 86 ASN D CB 10626 C CG . ASN D 27 ? 0.6982 0.8821 1.4119 -0.0659 0.1280 0.1252 86 ASN D CG 10627 O OD1 . ASN D 27 ? 0.6059 0.7857 1.3214 -0.0663 0.1300 0.1251 86 ASN D OD1 10628 N ND2 . ASN D 27 ? 0.9067 1.0935 1.6289 -0.0662 0.1268 0.1248 86 ASN D ND2 10629 N N . LYS D 28 ? 0.7567 0.9296 1.4460 -0.0594 0.1402 0.1356 87 LYS D N 10630 C CA . LYS D 28 ? 0.7270 0.8949 1.4125 -0.0590 0.1432 0.1363 87 LYS D CA 10631 C C . LYS D 28 ? 0.6361 0.8019 1.3319 -0.0614 0.1426 0.1334 87 LYS D C 10632 O O . LYS D 28 ? 0.5946 0.7571 1.2876 -0.0620 0.1435 0.1324 87 LYS D O 10633 C CB . LYS D 28 ? 0.7096 0.8738 1.3895 -0.0547 0.1497 0.1425 87 LYS D CB 10634 C CG . LYS D 28 ? 0.8024 0.9682 1.4724 -0.0518 0.1508 0.1461 87 LYS D CG 10635 C CD . LYS D 28 ? 0.8646 1.0259 1.5274 -0.0474 0.1570 0.1519 87 LYS D CD 10636 C CE . LYS D 28 ? 0.9829 1.1458 1.6377 -0.0441 0.1583 0.1559 87 LYS D CE 10637 N NZ . LYS D 28 ? 0.9268 1.0931 1.5732 -0.0453 0.1545 0.1538 87 LYS D NZ 10638 N N . ILE D 29 ? 0.6337 0.8014 1.3411 -0.0627 0.1411 0.1319 88 ILE D N 10639 C CA . ILE D 29 ? 0.6856 0.8515 1.4032 -0.0650 0.1403 0.1290 88 ILE D CA 10640 C C . ILE D 29 ? 0.8521 1.0197 1.5708 -0.0686 0.1343 0.1229 88 ILE D C 10641 O O . ILE D 29 ? 0.8766 1.0414 1.5956 -0.0700 0.1342 0.1210 88 ILE D O 10642 C CB . ILE D 29 ? 0.5963 0.7637 1.3266 -0.0653 0.1404 0.1291 88 ILE D CB 10643 C CG1 . ILE D 29 ? 0.5731 0.7405 1.3143 -0.0687 0.1369 0.1241 88 ILE D CG1 10644 C CG2 . ILE D 29 ? 0.4863 0.6586 1.2173 -0.0650 0.1380 0.1292 88 ILE D CG2 10645 C CD1 . ILE D 29 ? 0.6029 0.7703 1.3566 -0.0687 0.1383 0.1248 88 ILE D CD1 10646 N N . THR D 30 ? 0.7859 0.9582 1.5050 -0.0701 0.1294 0.1199 89 THR D N 10647 C CA . THR D 30 ? 0.6749 0.8491 1.3944 -0.0732 0.1234 0.1140 89 THR D CA 10648 C C . THR D 30 ? 0.6791 0.8510 1.3876 -0.0732 0.1238 0.1139 89 THR D C 10649 O O . THR D 30 ? 0.5951 0.7657 1.3046 -0.0754 0.1210 0.1102 89 THR D O 10650 C CB . THR D 30 ? 0.6549 0.8346 1.3748 -0.0741 0.1185 0.1113 89 THR D CB 10651 O OG1 . THR D 30 ? 0.7297 0.9105 1.4385 -0.0719 0.1202 0.1145 89 THR D OG1 10652 C CG2 . THR D 30 ? 0.6877 0.8699 1.4183 -0.0741 0.1181 0.1113 89 THR D CG2 10653 N N . LEU D 31 ? 0.6682 0.8396 1.3660 -0.0705 0.1271 0.1180 90 LEU D N 10654 C CA . LEU D 31 ? 0.6314 0.8006 1.3178 -0.0701 0.1278 0.1183 90 LEU D CA 10655 C C . LEU D 31 ? 0.6635 0.8278 1.3499 -0.0704 0.1305 0.1186 90 LEU D C 10656 O O . LEU D 31 ? 0.7333 0.8966 1.4162 -0.0721 0.1282 0.1156 90 LEU D O 10657 C CB . LEU D 31 ? 0.4625 0.6316 1.1382 -0.0667 0.1316 0.1233 90 LEU D CB 10658 C CG . LEU D 31 ? 0.5998 0.7653 1.2594 -0.0652 0.1320 0.1235 90 LEU D CG 10659 C CD1 . LEU D 31 ? 0.4609 0.6264 1.1114 -0.0668 0.1249 0.1175 90 LEU D CD1 10660 C CD2 . LEU D 31 ? 0.6073 0.7723 1.2563 -0.0614 0.1356 0.1285 90 LEU D CD2 10661 N N . ARG D 32 ? 0.7103 0.8716 1.4006 -0.0685 0.1354 0.1222 91 ARG D N 10662 C CA . ARG D 32 ? 0.7921 0.9486 1.4823 -0.0683 0.1386 0.1228 91 ARG D CA 10663 C C . ARG D 32 ? 0.7815 0.9378 1.4811 -0.0718 0.1348 0.1179 91 ARG D C 10664 O O . ARG D 32 ? 0.7118 0.8652 1.4091 -0.0729 0.1348 0.1164 91 ARG D O 10665 C CB . ARG D 32 ? 0.7793 0.9327 1.4717 -0.0652 0.1449 0.1279 91 ARG D CB 10666 C CG . ARG D 32 ? 0.7769 0.9252 1.4699 -0.0649 0.1484 0.1285 91 ARG D CG 10667 C CD . ARG D 32 ? 0.8011 0.9463 1.4975 -0.0618 0.1543 0.1332 91 ARG D CD 10668 N NE . ARG D 32 ? 0.7882 0.9356 1.4965 -0.0625 0.1534 0.1329 91 ARG D NE 10669 C CZ . ARG D 32 ? 0.8705 1.0173 1.5898 -0.0647 0.1523 0.1304 91 ARG D CZ 10670 N NH1 . ARG D 32 ? 0.9428 1.0868 1.6624 -0.0664 0.1519 0.1280 91 ARG D NH1 10671 N NH2 . ARG D 32 ? 0.8243 0.9732 1.5542 -0.0652 0.1515 0.1302 91 ARG D NH2 10672 N N . LYS D 33 ? 0.6907 0.8501 1.4008 -0.0735 0.1314 0.1154 92 LYS D N 10673 C CA . LYS D 33 ? 0.5555 0.7151 1.2750 -0.0767 0.1272 0.1105 92 LYS D CA 10674 C C . LYS D 33 ? 0.7264 0.8870 1.4411 -0.0791 0.1220 0.1059 92 LYS D C 10675 O O . LYS D 33 ? 0.6393 0.7979 1.3569 -0.0811 0.1200 0.1028 92 LYS D O 10676 C CB . LYS D 33 ? 0.4190 0.5822 1.1498 -0.0778 0.1241 0.1084 92 LYS D CB 10677 C CG . LYS D 33 ? 0.4011 0.5633 1.1391 -0.0760 0.1287 0.1122 92 LYS D CG 10678 C CD . LYS D 33 ? 0.5191 0.6850 1.2683 -0.0774 0.1251 0.1096 92 LYS D CD 10679 C CE . LYS D 33 ? 0.6460 0.8105 1.4039 -0.0760 0.1294 0.1128 92 LYS D CE 10680 N NZ . LYS D 33 ? 0.7013 0.8698 1.4690 -0.0769 0.1262 0.1108 92 LYS D NZ 10681 N N . LEU D 34 ? 0.7739 0.9374 1.4812 -0.0787 0.1198 0.1056 93 LEU D N 10682 C CA . LEU D 34 ? 0.7155 0.8799 1.4171 -0.0806 0.1150 0.1015 93 LEU D CA 10683 C C . LEU D 34 ? 0.7063 0.8660 1.3969 -0.0798 0.1174 0.1026 93 LEU D C 10684 O O . LEU D 34 ? 0.6159 0.7735 1.3029 -0.0813 0.1137 0.0987 93 LEU D O 10685 C CB . LEU D 34 ? 0.6419 0.8084 1.3322 -0.0790 0.1117 0.1006 93 LEU D CB 10686 C CG . LEU D 34 ? 0.5812 0.7521 1.2793 -0.0803 0.1069 0.0973 93 LEU D CG 10687 C CD1 . LEU D 34 ? 0.5836 0.7564 1.2706 -0.0781 0.1055 0.0980 93 LEU D CD1 10688 C CD2 . LEU D 34 ? 0.4753 0.6462 1.1759 -0.0828 0.1002 0.0908 93 LEU D CD2 10689 N N . TYR D 35 ? 0.8707 1.0286 1.5558 -0.0771 0.1235 0.1079 94 TYR D N 10690 C CA . TYR D 35 ? 0.9024 1.0558 1.5772 -0.0759 0.1266 0.1095 94 TYR D CA 10691 C C . TYR D 35 ? 0.8113 0.9617 1.4936 -0.0776 0.1279 0.1086 94 TYR D C 10692 O O . TYR D 35 ? 0.6675 0.8156 1.3448 -0.0788 0.1263 0.1062 94 TYR D O 10693 C CB . TYR D 35 ? 0.8312 0.9834 1.5002 -0.0724 0.1332 0.1156 94 TYR D CB 10694 C CG . TYR D 35 ? 0.8227 0.9707 1.4769 -0.0704 0.1354 0.1169 94 TYR D CG 10695 C CD1 . TYR D 35 ? 0.7696 0.9162 1.4163 -0.0669 0.1407 0.1220 94 TYR D CD1 10696 C CD2 . TYR D 35 ? 0.7874 0.9327 1.4349 -0.0719 0.1321 0.1130 94 TYR D CD2 10697 C CE1 . TYR D 35 ? 0.7300 0.8728 1.3633 -0.0649 0.1428 0.1230 94 TYR D CE1 10698 C CE2 . TYR D 35 ? 0.7643 0.9059 1.3984 -0.0700 0.1342 0.1142 94 TYR D CE2 10699 C CZ . TYR D 35 ? 0.8400 0.9804 1.4672 -0.0666 0.1395 0.1191 94 TYR D CZ 10700 O OH . TYR D 35 ? 0.9626 1.0992 1.5764 -0.0646 0.1415 0.1200 94 TYR D OH 10701 N N . ASP D 36 ? 0.7348 0.8843 1.4262 -0.0770 0.1304 0.1100 95 ASP D N 10702 C CA . ASP D 36 ? 0.7990 0.9447 1.4959 -0.0778 0.1321 0.1095 95 ASP D CA 10703 C C . ASP D 36 ? 0.7735 0.9197 1.4756 -0.0814 0.1264 0.1039 95 ASP D C 10704 O O . ASP D 36 ? 0.7680 0.9110 1.4684 -0.0823 0.1270 0.1030 95 ASP D O 10705 C CB . ASP D 36 ? 0.9373 1.0826 1.6442 -0.0767 0.1352 0.1118 95 ASP D CB 10706 C CG . ASP D 36 ? 1.0326 1.1762 1.7344 -0.0728 0.1415 0.1176 95 ASP D CG 10707 O OD1 . ASP D 36 ? 1.0673 1.2096 1.7578 -0.0709 0.1439 0.1198 95 ASP D OD1 10708 O OD2 . ASP D 36 ? 1.0150 1.1586 1.7242 -0.0716 0.1441 0.1198 95 ASP D OD2 10709 N N . LEU D 37 ? 0.8375 0.9877 1.5459 -0.0834 0.1208 0.1002 96 LEU D N 10710 C CA . LEU D 37 ? 0.7056 0.8563 1.4199 -0.0865 0.1150 0.0948 96 LEU D CA 10711 C C . LEU D 37 ? 0.7297 0.8803 1.4355 -0.0880 0.1112 0.0919 96 LEU D C 10712 O O . LEU D 37 ? 0.9144 1.0648 1.6236 -0.0903 0.1064 0.0874 96 LEU D O 10713 C CB . LEU D 37 ? 0.6883 0.8430 1.4123 -0.0879 0.1103 0.0917 96 LEU D CB 10714 C CG . LEU D 37 ? 0.8126 0.9665 1.5495 -0.0892 0.1093 0.0898 96 LEU D CG 10715 C CD1 . LEU D 37 ? 0.7275 0.8853 1.4735 -0.0895 0.1067 0.0883 96 LEU D CD1 10716 C CD2 . LEU D 37 ? 0.8465 0.9990 1.5855 -0.0919 0.1046 0.0850 96 LEU D CD2 10717 N N . THR D 38 ? 0.5513 0.7009 1.2427 -0.0857 0.1126 0.0938 97 THR D N 10718 C CA . THR D 38 ? 0.7305 0.8782 1.4073 -0.0856 0.1076 0.0901 97 THR D CA 10719 C C . THR D 38 ? 0.7950 0.9388 1.4572 -0.0835 0.1111 0.0927 97 THR D C 10720 O O . THR D 38 ? 0.8334 0.9755 1.4829 -0.0833 0.1075 0.0900 97 THR D O 10721 C CB . THR D 38 ? 0.6726 0.8233 1.3430 -0.0848 0.1029 0.0879 97 THR D CB 10722 O OG1 . THR D 38 ? 0.6011 0.7532 1.2682 -0.0823 0.1073 0.0925 97 THR D OG1 10723 C CG2 . THR D 38 ? 0.6648 0.8190 1.3477 -0.0869 0.0979 0.0840 97 THR D CG2 10724 N N . LYS D 39 ? 0.7236 0.8661 1.3873 -0.0819 0.1182 0.0978 98 LYS D N 10725 C CA . LYS D 39 ? 0.7804 0.9192 1.4307 -0.0796 0.1220 0.1004 98 LYS D CA 10726 C C . LYS D 39 ? 0.7595 0.8946 1.4061 -0.0809 0.1210 0.0981 98 LYS D C 10727 O O . LYS D 39 ? 0.8261 0.9581 1.4597 -0.0793 0.1225 0.0990 98 LYS D O 10728 C CB . LYS D 39 ? 0.7981 0.9363 1.4519 -0.0773 0.1298 0.1064 98 LYS D CB 10729 C CG . LYS D 39 ? 0.8232 0.9609 1.4920 -0.0785 0.1337 0.1081 98 LYS D CG 10730 C CD . LYS D 39 ? 0.8130 0.9482 1.4789 -0.0747 0.1407 0.1136 98 LYS D CD 10731 C CE . LYS D 39 ? 0.7846 0.9175 1.4602 -0.0744 0.1437 0.1147 98 LYS D CE 10732 N NZ . LYS D 39 ? 0.7146 0.8445 1.3927 -0.0764 0.1430 0.1122 98 LYS D NZ 10733 N N . ASN D 40 ? 0.7499 0.8852 1.4076 -0.0837 0.1184 0.0952 99 ASN D N 10734 C CA . ASN D 40 ? 0.8235 0.9554 1.4784 -0.0852 0.1171 0.0929 99 ASN D CA 10735 C C . ASN D 40 ? 0.7971 0.9294 1.4493 -0.0872 0.1091 0.0870 99 ASN D C 10736 O O . ASN D 40 ? 0.8423 0.9721 1.4936 -0.0886 0.1070 0.0846 99 ASN D O 10737 C CB . ASN D 40 ? 0.9142 1.0451 1.5833 -0.0867 0.1208 0.0943 99 ASN D CB 10738 C CG . ASN D 40 ? 0.8830 1.0125 1.5534 -0.0845 0.1291 0.1000 99 ASN D CG 10739 O OD1 . ASN D 40 ? 0.7261 0.8554 1.4052 -0.0838 0.1319 0.1018 99 ASN D OD1 10740 N ND2 . ASN D 40 ? 0.9038 1.0303 1.5602 -0.0820 0.1321 0.1021 99 ASN D ND2 10741 N N . VAL D 41 ? 0.7440 0.8794 1.3948 -0.0871 0.1046 0.0849 100 VAL D N 10742 C CA . VAL D 41 ? 0.7554 0.8913 1.4031 -0.0885 0.0969 0.0794 100 VAL D CA 10743 C C . VAL D 41 ? 0.7261 0.8596 1.3557 -0.0871 0.0947 0.0780 100 VAL D C 10744 O O . VAL D 41 ? 0.7523 0.8859 1.3719 -0.0849 0.0968 0.0803 100 VAL D O 10745 C CB . VAL D 41 ? 0.6062 0.7464 1.2600 -0.0889 0.0930 0.0773 100 VAL D CB 10746 C CG1 . VAL D 41 ? 0.5205 0.6608 1.1704 -0.0900 0.0851 0.0715 100 VAL D CG1 10747 C CG2 . VAL D 41 ? 0.4700 0.6127 1.1422 -0.0904 0.0949 0.0783 100 VAL D CG2 10748 N N . ASP D 42 ? 0.8457 0.9768 1.4712 -0.0885 0.0905 0.0743 101 ASP D N 10749 C CA . ASP D 42 ? 0.9102 1.0388 1.5191 -0.0873 0.0881 0.0727 101 ASP D CA 10750 C C . ASP D 42 ? 0.9060 1.0367 1.5094 -0.0871 0.0820 0.0691 101 ASP D C 10751 O O . ASP D 42 ? 1.0151 1.1456 1.6188 -0.0884 0.0761 0.0646 101 ASP D O 10752 C CB . ASP D 42 ? 0.9619 1.0871 1.5683 -0.0887 0.0861 0.0704 101 ASP D CB 10753 C CG . ASP D 42 ? 1.0596 1.1820 1.6488 -0.0875 0.0844 0.0692 101 ASP D CG 10754 O OD1 . ASP D 42 ? 0.9611 1.0840 1.5401 -0.0855 0.0854 0.0706 101 ASP D OD1 10755 O OD2 . ASP D 42 ? 1.1603 1.2799 1.7460 -0.0885 0.0821 0.0669 101 ASP D OD2 10756 N N . PHE D 43 ? 0.8173 0.9499 1.4155 -0.0852 0.0836 0.0712 102 PHE D N 10757 C CA . PHE D 43 ? 0.7868 0.9215 1.3794 -0.0846 0.0786 0.0683 102 PHE D CA 10758 C C . PHE D 43 ? 0.8525 0.9846 1.4297 -0.0840 0.0749 0.0655 102 PHE D C 10759 O O . PHE D 43 ? 0.9494 1.0823 1.5237 -0.0842 0.0691 0.0614 102 PHE D O 10760 C CB . PHE D 43 ? 0.7148 0.8520 1.3055 -0.0827 0.0818 0.0716 102 PHE D CB 10761 C CG . PHE D 43 ? 0.7518 0.8924 1.3577 -0.0833 0.0838 0.0733 102 PHE D CG 10762 C CD1 . PHE D 43 ? 0.7681 0.9119 1.3820 -0.0845 0.0790 0.0699 102 PHE D CD1 10763 C CD2 . PHE D 43 ? 0.7558 0.8964 1.3680 -0.0827 0.0904 0.0782 102 PHE D CD2 10764 C CE1 . PHE D 43 ? 0.7518 0.8987 1.3798 -0.0851 0.0807 0.0714 102 PHE D CE1 10765 C CE2 . PHE D 43 ? 0.7394 0.8832 1.3658 -0.0833 0.0923 0.0799 102 PHE D CE2 10766 C CZ . PHE D 43 ? 0.7328 0.8798 1.3672 -0.0846 0.0874 0.0764 102 PHE D CZ 10767 N N . ASP D 44 ? 0.7158 0.8448 1.2833 -0.0829 0.0784 0.0678 103 ASP D N 10768 C CA . ASP D 44 ? 0.8385 0.9648 1.3909 -0.0822 0.0756 0.0657 103 ASP D CA 10769 C C . ASP D 44 ? 0.7178 0.8428 1.2711 -0.0839 0.0695 0.0608 103 ASP D C 10770 O O . ASP D 44 ? 0.6770 0.8016 1.2216 -0.0835 0.0647 0.0575 103 ASP D O 10771 C CB . ASP D 44 ? 0.8055 0.9287 1.3496 -0.0810 0.0807 0.0690 103 ASP D CB 10772 C CG . ASP D 44 ? 0.9065 1.0304 1.4451 -0.0786 0.0858 0.0733 103 ASP D CG 10773 O OD1 . ASP D 44 ? 0.9643 1.0908 1.5016 -0.0777 0.0845 0.0733 103 ASP D OD1 10774 O OD2 . ASP D 44 ? 1.0337 1.1554 1.5690 -0.0775 0.0911 0.0767 103 ASP D OD2 10775 N N . GLN D 45 ? 0.6431 0.7674 1.2069 -0.0857 0.0697 0.0603 104 GLN D N 10776 C CA . GLN D 45 ? 0.6897 0.8125 1.2553 -0.0874 0.0640 0.0558 104 GLN D CA 10777 C C . GLN D 45 ? 0.7977 0.9235 1.3709 -0.0881 0.0585 0.0522 104 GLN D C 10778 O O . GLN D 45 ? 0.7468 0.8718 1.3171 -0.0885 0.0526 0.0479 104 GLN D O 10779 C CB . GLN D 45 ? 0.6826 0.8038 1.2576 -0.0891 0.0660 0.0566 104 GLN D CB 10780 C CG . GLN D 45 ? 1.0386 1.1575 1.6130 -0.0905 0.0606 0.0524 104 GLN D CG 10781 C CD . GLN D 45 ? 1.1877 1.3037 1.7458 -0.0894 0.0585 0.0510 104 GLN D CD 10782 O OE1 . GLN D 45 ? 1.1796 1.2955 1.7318 -0.0891 0.0530 0.0475 104 GLN D OE1 10783 N NE2 . GLN D 45 ? 1.1370 1.2502 1.6875 -0.0888 0.0629 0.0538 104 GLN D NE2 10784 N N . LEU D 46 ? 0.7623 0.8916 1.3453 -0.0880 0.0606 0.0539 105 LEU D N 10785 C CA . LEU D 46 ? 0.6512 0.7835 1.2421 -0.0886 0.0559 0.0507 105 LEU D CA 10786 C C . LEU D 46 ? 0.7146 0.8475 1.2939 -0.0870 0.0520 0.0482 105 LEU D C 10787 O O . LEU D 46 ? 0.7285 0.8619 1.3086 -0.0873 0.0460 0.0437 105 LEU D O 10788 C CB . LEU D 46 ? 0.4737 0.6096 1.0772 -0.0888 0.0596 0.0535 105 LEU D CB 10789 C CG . LEU D 46 ? 0.4481 0.5844 1.0675 -0.0907 0.0617 0.0544 105 LEU D CG 10790 C CD1 . LEU D 46 ? 0.3544 0.4938 0.9840 -0.0905 0.0665 0.0582 105 LEU D CD1 10791 C CD2 . LEU D 46 ? 0.3300 0.4669 0.9583 -0.0925 0.0554 0.0494 105 LEU D CD2 10792 N N . ARG D 47 ? 0.6851 0.8180 1.2539 -0.0852 0.0554 0.0512 106 ARG D N 10793 C CA . ARG D 47 ? 0.6001 0.7334 1.1570 -0.0836 0.0524 0.0494 106 ARG D CA 10794 C C . ARG D 47 ? 0.7407 0.8710 1.2878 -0.0835 0.0472 0.0453 106 ARG D C 10795 O O . ARG D 47 ? 0.7749 0.9058 1.3163 -0.0827 0.0427 0.0421 106 ARG D O 10796 C CB . ARG D 47 ? 0.6089 0.7419 1.1555 -0.0817 0.0574 0.0536 106 ARG D CB 10797 C CG . ARG D 47 ? 0.7359 0.8693 1.2697 -0.0799 0.0548 0.0521 106 ARG D CG 10798 C CD . ARG D 47 ? 0.7783 0.9111 1.3019 -0.0780 0.0598 0.0564 106 ARG D CD 10799 N NE . ARG D 47 ? 0.8859 1.0220 1.4115 -0.0769 0.0614 0.0584 106 ARG D NE 10800 C CZ . ARG D 47 ? 0.8372 0.9753 1.3719 -0.0769 0.0660 0.0622 106 ARG D CZ 10801 N NH1 . ARG D 47 ? 0.6664 0.8035 1.2093 -0.0778 0.0696 0.0645 106 ARG D NH1 10802 N NH2 . ARG D 47 ? 0.7695 0.9105 1.3051 -0.0757 0.0671 0.0639 106 ARG D NH2 10803 N N . GLN D 48 ? 0.8579 0.9851 1.4032 -0.0844 0.0478 0.0455 107 GLN D N 10804 C CA . GLN D 48 ? 0.8657 0.9898 1.4010 -0.0842 0.0435 0.0421 107 GLN D CA 10805 C C . GLN D 48 ? 0.7057 0.8300 1.2479 -0.0853 0.0369 0.0372 107 GLN D C 10806 O O . GLN D 48 ? 0.6799 0.8018 1.2146 -0.0850 0.0326 0.0340 107 GLN D O 10807 C CB . GLN D 48 ? 0.9611 1.0818 1.4924 -0.0848 0.0464 0.0440 107 GLN D CB 10808 C CG . GLN D 48 ? 0.9958 1.1159 1.5207 -0.0836 0.0529 0.0488 107 GLN D CG 10809 C CD . GLN D 48 ? 1.0377 1.1573 1.5477 -0.0816 0.0529 0.0491 107 GLN D CD 10810 O OE1 . GLN D 48 ? 1.0678 1.1863 1.5697 -0.0812 0.0481 0.0457 107 GLN D OE1 10811 N NE2 . GLN D 48 ? 1.0002 1.1205 1.5066 -0.0803 0.0582 0.0532 107 GLN D NE2 10812 N N . ASN D 49 ? 0.6692 0.7964 1.2257 -0.0863 0.0363 0.0366 108 ASN D N 10813 C CA . ASN D 49 ? 0.6553 0.7829 1.2198 -0.0872 0.0302 0.0319 108 ASN D CA 10814 C C . ASN D 49 ? 0.6619 0.7924 1.2285 -0.0863 0.0264 0.0291 108 ASN D C 10815 O O . ASN D 49 ? 0.6561 0.7869 1.2281 -0.0866 0.0210 0.0248 108 ASN D O 10816 C CB . ASN D 49 ? 0.6464 0.7748 1.2268 -0.0893 0.0316 0.0327 108 ASN D CB 10817 C CG . ASN D 49 ? 0.8224 0.9473 1.4012 -0.0903 0.0331 0.0337 108 ASN D CG 10818 O OD1 . ASN D 49 ? 0.9393 1.0620 1.5180 -0.0909 0.0286 0.0304 108 ASN D OD1 10819 N ND2 . ASN D 49 ? 0.7671 0.8913 1.3444 -0.0904 0.0395 0.0383 108 ASN D ND2 10820 N N . GLU D 50 ? 0.6297 0.7623 1.1918 -0.0851 0.0293 0.0314 109 GLU D N 10821 C CA . GLU D 50 ? 0.6917 0.8272 1.2554 -0.0841 0.0263 0.0290 109 GLU D CA 10822 C C . GLU D 50 ? 0.6824 0.8163 1.2354 -0.0827 0.0205 0.0246 109 GLU D C 10823 O O . GLU D 50 ? 0.6352 0.7708 1.1918 -0.0822 0.0161 0.0209 109 GLU D O 10824 C CB . GLU D 50 ? 0.5283 0.6662 1.0887 -0.0830 0.0311 0.0330 109 GLU D CB 10825 C CG . GLU D 50 ? 0.4715 0.6111 1.0429 -0.0841 0.0368 0.0375 109 GLU D CG 10826 C CD . GLU D 50 ? 0.6712 0.8131 1.2392 -0.0827 0.0414 0.0415 109 GLU D CD 10827 O OE1 . GLU D 50 ? 0.6400 0.7823 1.1978 -0.0811 0.0398 0.0405 109 GLU D OE1 10828 O OE2 . GLU D 50 ? 0.5463 0.6893 1.1217 -0.0832 0.0466 0.0456 109 GLU D OE2 10829 N N . CYS D 51 ? 0.6021 0.7326 1.1420 -0.0820 0.0206 0.0248 110 CYS D N 10830 C CA . CYS D 51 ? 0.7666 0.8950 1.2954 -0.0806 0.0155 0.0209 110 CYS D CA 10831 C C . CYS D 51 ? 0.7189 0.8436 1.2445 -0.0811 0.0125 0.0188 110 CYS D C 10832 O O . CYS D 51 ? 0.7780 0.9003 1.2982 -0.0815 0.0156 0.0213 110 CYS D O 10833 C CB . CYS D 51 ? 0.8558 0.9837 1.3698 -0.0788 0.0178 0.0228 110 CYS D CB 10834 S SG . CYS D 51 ? 0.9743 1.0997 1.4742 -0.0769 0.0120 0.0182 110 CYS D SG 10835 N N . LYS D 52 ? 0.7196 0.8437 1.2486 -0.0809 0.0064 0.0141 111 LYS D N 10836 C CA . LYS D 52 ? 0.8917 1.0122 1.4181 -0.0813 0.0030 0.0117 111 LYS D CA 10837 C C . LYS D 52 ? 0.8276 0.9448 1.3374 -0.0800 0.0031 0.0121 111 LYS D C 10838 O O . LYS D 52 ? 0.8372 0.9523 1.3425 -0.0807 0.0063 0.0148 111 LYS D O 10839 C CB . LYS D 52 ? 0.8078 0.9281 1.3397 -0.0807 -0.0039 0.0064 111 LYS D CB 10840 C CG . LYS D 52 ? 0.8781 1.0004 1.4272 -0.0824 -0.0049 0.0055 111 LYS D CG 10841 C CD . LYS D 52 ? 0.9090 1.0291 1.4615 -0.0824 -0.0111 0.0011 111 LYS D CD 10842 C CE . LYS D 52 ? 0.9182 1.0375 1.4637 -0.0800 -0.0169 -0.0035 111 LYS D CE 10843 N NZ . LYS D 52 ? 0.8163 0.9338 1.3672 -0.0797 -0.0232 -0.0081 111 LYS D NZ 10844 N N . LYS D 53 ? 0.8150 0.9317 1.3157 -0.0780 -0.0002 0.0094 112 LYS D N 10845 C CA . LYS D 53 ? 0.7861 0.8999 1.2710 -0.0767 -0.0001 0.0096 112 LYS D CA 10846 C C . LYS D 53 ? 0.8101 0.9254 1.2864 -0.0751 0.0014 0.0103 112 LYS D C 10847 O O . LYS D 53 ? 0.8355 0.9523 1.3126 -0.0739 -0.0019 0.0074 112 LYS D O 10848 C CB . LYS D 53 ? 0.7431 0.8537 1.2233 -0.0757 -0.0062 0.0052 112 LYS D CB 10849 C CG . LYS D 53 ? 0.8114 0.9184 1.2770 -0.0749 -0.0060 0.0057 112 LYS D CG 10850 C CD . LYS D 53 ? 0.8361 0.9400 1.2971 -0.0736 -0.0123 0.0012 112 LYS D CD 10851 C CE . LYS D 53 ? 0.8375 0.9376 1.2854 -0.0731 -0.0120 0.0019 112 LYS D CE 10852 N NZ . LYS D 53 ? 0.7312 0.8313 1.1669 -0.0720 -0.0087 0.0039 112 LYS D NZ 10853 N N . ASN D 54 ? 0.7410 0.8560 1.2091 -0.0749 0.0063 0.0141 113 ASN D N 10854 C CA . ASN D 54 ? 0.5965 0.7128 1.0558 -0.0734 0.0082 0.0153 113 ASN D CA 10855 C C . ASN D 54 ? 0.7161 0.8295 1.1606 -0.0717 0.0056 0.0132 113 ASN D C 10856 O O . ASN D 54 ? 0.8343 0.9454 1.2692 -0.0715 0.0080 0.0152 113 ASN D O 10857 C CB . ASN D 54 ? 0.5191 0.6365 0.9773 -0.0739 0.0148 0.0206 113 ASN D CB 10858 C CG . ASN D 54 ? 0.6232 0.7427 1.0750 -0.0725 0.0171 0.0222 113 ASN D CG 10859 O OD1 . ASN D 54 ? 0.4530 0.5724 0.8983 -0.0711 0.0139 0.0195 113 ASN D OD1 10860 N ND2 . ASN D 54 ? 0.5199 0.6410 0.9733 -0.0728 0.0226 0.0267 113 ASN D ND2 10861 N N . ILE D 55 ? 0.6573 0.7707 1.0999 -0.0703 0.0009 0.0092 114 ILE D N 10862 C CA . ILE D 55 ? 0.7930 0.9037 1.2219 -0.0684 -0.0017 0.0069 114 ILE D CA 10863 C C . ILE D 55 ? 0.7496 0.8620 1.1746 -0.0667 -0.0031 0.0051 114 ILE D C 10864 O O . ILE D 55 ? 0.8505 0.9655 1.2844 -0.0666 -0.0048 0.0035 114 ILE D O 10865 C CB . ILE D 55 ? 0.6885 0.7960 1.1167 -0.0681 -0.0071 0.0030 114 ILE D CB 10866 C CG1 . ILE D 55 ? 0.6749 0.7838 1.1175 -0.0690 -0.0103 0.0006 114 ILE D CG1 10867 C CG2 . ILE D 55 ? 0.6061 0.7105 1.0291 -0.0689 -0.0056 0.0047 114 ILE D CG2 10868 C CD1 . ILE D 55 ? 0.5920 0.7019 1.0367 -0.0673 -0.0149 -0.0036 114 ILE D CD1 10869 N N . THR D 56 ? 0.7151 0.8261 1.1268 -0.0652 -0.0023 0.0054 115 THR D N 10870 C CA . THR D 56 ? 0.6925 0.8047 1.0986 -0.0634 -0.0033 0.0039 115 THR D CA 10871 C C . THR D 56 ? 0.6437 0.7540 1.0462 -0.0616 -0.0092 -0.0014 115 THR D C 10872 O O . THR D 56 ? 0.6948 0.8024 1.0983 -0.0616 -0.0126 -0.0038 115 THR D O 10873 C CB . THR D 56 ? 0.6881 0.7997 1.0813 -0.0625 0.0002 0.0065 115 THR D CB 10874 O OG1 . THR D 56 ? 0.7404 0.8481 1.1227 -0.0617 -0.0016 0.0050 115 THR D OG1 10875 C CG2 . THR D 56 ? 0.3214 0.4342 0.7168 -0.0640 0.0060 0.0117 115 THR D CG2 10876 N N . LEU D 57 ? 0.6856 0.7971 1.0838 -0.0599 -0.0102 -0.0030 116 LEU D N 10877 C CA . LEU D 57 ? 0.7186 0.8284 1.1132 -0.0578 -0.0155 -0.0080 116 LEU D CA 10878 C C . LEU D 57 ? 0.8566 0.9622 1.2377 -0.0563 -0.0169 -0.0093 116 LEU D C 10879 O O . LEU D 57 ? 0.9480 1.0510 1.3272 -0.0549 -0.0216 -0.0133 116 LEU D O 10880 C CB . LEU D 57 ? 0.6920 0.8046 1.0859 -0.0564 -0.0156 -0.0091 116 LEU D CB 10881 C CG . LEU D 57 ? 0.7451 0.8576 1.1404 -0.0543 -0.0208 -0.0143 116 LEU D CG 10882 C CD1 . LEU D 57 ? 0.6595 0.7679 1.0426 -0.0519 -0.0241 -0.0177 116 LEU D CD1 10883 C CD2 . LEU D 57 ? 0.7294 0.8427 1.1386 -0.0552 -0.0241 -0.0167 116 LEU D CD2 10884 N N . SER D 58 ? 0.8570 0.9620 1.2289 -0.0566 -0.0130 -0.0060 117 SER D N 10885 C CA . SER D 58 ? 0.9214 1.0226 1.2800 -0.0552 -0.0137 -0.0069 117 SER D CA 10886 C C . SER D 58 ? 0.9269 1.0248 1.2856 -0.0558 -0.0157 -0.0076 117 SER D C 10887 O O . SER D 58 ? 0.9998 1.0944 1.3513 -0.0543 -0.0190 -0.0105 117 SER D O 10888 C CB . SER D 58 ? 0.8591 0.9606 1.2087 -0.0555 -0.0087 -0.0029 117 SER D CB 10889 O OG . SER D 58 ? 0.8391 0.9412 1.1926 -0.0575 -0.0050 0.0010 117 SER D OG 10890 N N . LYS D 59 ? 0.8228 0.9216 1.1896 -0.0580 -0.0136 -0.0050 118 LYS D N 10891 C CA . LYS D 59 ? 0.8578 0.9537 1.2250 -0.0589 -0.0150 -0.0052 118 LYS D CA 10892 C C . LYS D 59 ? 0.9093 1.0036 1.2815 -0.0579 -0.0209 -0.0097 118 LYS D C 10893 O O . LYS D 59 ? 1.0531 1.1440 1.4222 -0.0577 -0.0232 -0.0108 118 LYS D O 10894 C CB . LYS D 59 ? 0.8381 0.9356 1.2139 -0.0614 -0.0113 -0.0015 118 LYS D CB 10895 C CG . LYS D 59 ? 0.7830 0.8819 1.1541 -0.0621 -0.0053 0.0030 118 LYS D CG 10896 C CD . LYS D 59 ? 0.9099 1.0058 1.2724 -0.0625 -0.0035 0.0049 118 LYS D CD 10897 C CE . LYS D 59 ? 0.9602 1.0535 1.3087 -0.0606 -0.0047 0.0033 118 LYS D CE 10898 N NZ . LYS D 59 ? 0.8313 0.9264 1.1740 -0.0596 -0.0022 0.0045 118 LYS D NZ 10899 N N . PHE D 60 ? 0.9206 1.0170 1.3004 -0.0573 -0.0233 -0.0121 119 PHE D N 10900 C CA . PHE D 60 ? 0.8165 0.9115 1.2015 -0.0561 -0.0291 -0.0166 119 PHE D CA 10901 C C . PHE D 60 ? 0.8021 0.8936 1.1758 -0.0532 -0.0328 -0.0201 119 PHE D C 10902 O O . PHE D 60 ? 0.8010 0.8900 1.1632 -0.0526 -0.0314 -0.0190 119 PHE D O 10903 C CB . PHE D 60 ? 0.9146 1.0131 1.3110 -0.0562 -0.0303 -0.0182 119 PHE D CB 10904 C CG . PHE D 60 ? 0.9957 1.0937 1.3895 -0.0534 -0.0347 -0.0228 119 PHE D CG 10905 C CD1 . PHE D 60 ? 0.9386 1.0374 1.3241 -0.0518 -0.0334 -0.0230 119 PHE D CD1 10906 C CD2 . PHE D 60 ? 0.9963 1.0928 1.3960 -0.0522 -0.0402 -0.0270 119 PHE D CD2 10907 C CE1 . PHE D 60 ? 0.8210 0.9191 1.2038 -0.0491 -0.0373 -0.0273 119 PHE D CE1 10908 C CE2 . PHE D 60 ? 0.8832 0.9791 1.2804 -0.0494 -0.0442 -0.0314 119 PHE D CE2 10909 C CZ . PHE D 60 ? 0.7462 0.8428 1.1348 -0.0479 -0.0427 -0.0316 119 PHE D CZ 10910 N N . GLU D 71 ? 0.7649 0.8609 1.0413 -0.0446 -0.0047 -0.0059 130 GLU D N 10911 C CA . GLU D 71 ? 0.8455 0.9451 1.1255 -0.0459 -0.0004 -0.0017 130 GLU D CA 10912 C C . GLU D 71 ? 0.7239 0.8237 0.9931 -0.0449 0.0024 0.0000 130 GLU D C 10913 O O . GLU D 71 ? 0.5547 0.6547 0.8205 -0.0458 0.0061 0.0037 130 GLU D O 10914 C CB . GLU D 71 ? 0.8507 0.9505 1.1359 -0.0481 0.0022 0.0017 130 GLU D CB 10915 C CG . GLU D 71 ? 0.7949 0.8956 1.0928 -0.0494 0.0002 0.0009 130 GLU D CG 10916 C CD . GLU D 71 ? 0.9150 1.0167 1.2191 -0.0516 0.0035 0.0048 130 GLU D CD 10917 O OE1 . GLU D 71 ? 1.0036 1.1052 1.3017 -0.0519 0.0073 0.0081 130 GLU D OE1 10918 O OE2 . GLU D 71 ? 0.8943 0.9967 1.2089 -0.0528 0.0023 0.0044 130 GLU D OE2 10919 N N . ASP D 72 ? 0.7570 0.8563 1.0204 -0.0430 0.0005 -0.0028 131 ASP D N 10920 C CA . ASP D 72 ? 0.7627 0.8621 1.0156 -0.0419 0.0028 -0.0016 131 ASP D CA 10921 C C . ASP D 72 ? 0.7317 0.8351 0.9880 -0.0424 0.0060 0.0017 131 ASP D C 10922 O O . ASP D 72 ? 0.8631 0.9670 1.1125 -0.0423 0.0092 0.0045 131 ASP D O 10923 C CB . ASP D 72 ? 0.9294 1.0268 1.1749 -0.0394 -0.0002 -0.0059 131 ASP D CB 10924 C CG . ASP D 72 ? 1.0050 1.0981 1.2447 -0.0385 -0.0028 -0.0088 131 ASP D CG 10925 O OD1 . ASP D 72 ? 0.9071 0.9983 1.1429 -0.0393 -0.0012 -0.0069 131 ASP D OD1 10926 O OD2 . ASP D 72 ? 1.0957 1.1870 1.3344 -0.0367 -0.0065 -0.0129 131 ASP D OD2 10927 N N . ASP D 73 ? 0.7702 0.8765 1.0372 -0.0430 0.0050 0.0014 132 ASP D N 10928 C CA . ASP D 73 ? 0.6771 0.7873 0.9481 -0.0435 0.0078 0.0045 132 ASP D CA 10929 C C . ASP D 73 ? 0.6335 0.7464 0.9182 -0.0453 0.0086 0.0064 132 ASP D C 10930 O O . ASP D 73 ? 0.4790 0.5908 0.7705 -0.0463 0.0066 0.0050 132 ASP D O 10931 C CB . ASP D 73 ? 0.4324 0.5439 0.7009 -0.0417 0.0060 0.0019 132 ASP D CB 10932 C CG . ASP D 73 ? 0.5467 0.6575 0.8204 -0.0409 0.0013 -0.0029 132 ASP D CG 10933 O OD1 . ASP D 73 ? 0.5391 0.6512 0.8243 -0.0422 0.0002 -0.0032 132 ASP D OD1 10934 O OD2 . ASP D 73 ? 0.5332 0.6419 0.7994 -0.0389 -0.0011 -0.0066 132 ASP D OD2 10935 N N . ASN D 74 ? 0.4968 0.6132 0.7856 -0.0458 0.0115 0.0098 133 ASN D N 10936 C CA . ASN D 74 ? 0.4614 0.5804 0.7629 -0.0476 0.0130 0.0123 133 ASN D CA 10937 C C . ASN D 74 ? 0.5225 0.6430 0.8349 -0.0478 0.0096 0.0091 133 ASN D C 10938 O O . ASN D 74 ? 0.4479 0.5701 0.7716 -0.0494 0.0101 0.0104 133 ASN D O 10939 C CB . ASN D 74 ? 0.4766 0.5987 0.7788 -0.0477 0.0171 0.0168 133 ASN D CB 10940 C CG . ASN D 74 ? 0.5723 0.6932 0.8663 -0.0477 0.0209 0.0206 133 ASN D CG 10941 O OD1 . ASN D 74 ? 0.4553 0.5738 0.7479 -0.0484 0.0215 0.0210 133 ASN D OD1 10942 N ND2 . ASN D 74 ? 0.5544 0.6769 0.8432 -0.0467 0.0235 0.0233 133 ASN D ND2 10943 N N . TRP D 75 ? 0.4041 0.5241 0.7130 -0.0462 0.0061 0.0049 134 TRP D N 10944 C CA . TRP D 75 ? 0.4424 0.5632 0.7608 -0.0462 0.0022 0.0012 134 TRP D CA 10945 C C . TRP D 75 ? 0.6218 0.7400 0.9444 -0.0470 -0.0001 -0.0006 134 TRP D C 10946 O O . TRP D 75 ? 0.4566 0.5762 0.7911 -0.0484 -0.0010 -0.0007 134 TRP D O 10947 C CB . TRP D 75 ? 0.4317 0.5519 0.7442 -0.0439 -0.0012 -0.0033 134 TRP D CB 10948 C CG . TRP D 75 ? 0.5809 0.7045 0.8934 -0.0431 -0.0001 -0.0025 134 TRP D CG 10949 C CD1 . TRP D 75 ? 0.4592 0.5855 0.7800 -0.0428 -0.0022 -0.0046 134 TRP D CD1 10950 C CD2 . TRP D 75 ? 0.5813 0.7058 0.8850 -0.0425 0.0032 0.0005 134 TRP D CD2 10951 N NE1 . TRP D 75 ? 0.5590 0.6879 0.8764 -0.0420 -0.0003 -0.0031 134 TRP D NE1 10952 C CE2 . TRP D 75 ? 0.5616 0.6894 0.8685 -0.0418 0.0029 0.0001 134 TRP D CE2 10953 C CE3 . TRP D 75 ? 0.3516 0.4745 0.6449 -0.0423 0.0062 0.0034 134 TRP D CE3 10954 C CZ2 . TRP D 75 ? 0.5920 0.7215 0.8920 -0.0410 0.0056 0.0027 134 TRP D CZ2 10955 C CZ3 . TRP D 75 ? 0.3544 0.4790 0.6412 -0.0415 0.0088 0.0059 134 TRP D CZ3 10956 C CH2 . TRP D 75 ? 0.4935 0.6214 0.7835 -0.0409 0.0085 0.0056 134 TRP D CH2 10957 N N . GLU D 76 ? 0.7354 0.8498 1.0482 -0.0462 -0.0011 -0.0021 135 GLU D N 10958 C CA . GLU D 76 ? 0.6902 0.8016 1.0050 -0.0467 -0.0035 -0.0039 135 GLU D CA 10959 C C . GLU D 76 ? 0.5644 0.6763 0.8860 -0.0490 -0.0008 -0.0002 135 GLU D C 10960 O O . GLU D 76 ? 0.4381 0.5492 0.7676 -0.0500 -0.0028 -0.0014 135 GLU D O 10961 C CB . GLU D 76 ? 0.3780 0.4853 0.6797 -0.0452 -0.0047 -0.0057 135 GLU D CB 10962 C CG . GLU D 76 ? 0.7470 0.8531 1.0432 -0.0427 -0.0083 -0.0103 135 GLU D CG 10963 C CD . GLU D 76 ? 0.9628 1.0648 1.2458 -0.0410 -0.0091 -0.0120 135 GLU D CD 10964 O OE1 . GLU D 76 ? 1.0935 1.1940 1.3708 -0.0418 -0.0065 -0.0093 135 GLU D OE1 10965 O OE2 . GLU D 76 ? 0.8703 0.9706 1.1485 -0.0388 -0.0122 -0.0160 135 GLU D OE2 10966 N N . ARG D 77 ? 0.5203 0.6333 0.8387 -0.0498 0.0038 0.0042 136 ARG D N 10967 C CA . ARG D 77 ? 0.5045 0.6181 0.8291 -0.0518 0.0069 0.0080 136 ARG D CA 10968 C C . ARG D 77 ? 0.6781 0.7950 1.0170 -0.0531 0.0073 0.0090 136 ARG D C 10969 O O . ARG D 77 ? 0.7913 0.9082 1.1383 -0.0547 0.0080 0.0102 136 ARG D O 10970 C CB . ARG D 77 ? 0.4424 0.5563 0.7599 -0.0519 0.0117 0.0124 136 ARG D CB 10971 C CG . ARG D 77 ? 0.6540 0.7644 0.9589 -0.0511 0.0119 0.0121 136 ARG D CG 10972 C CD . ARG D 77 ? 0.5799 0.6906 0.8793 -0.0514 0.0167 0.0166 136 ARG D CD 10973 N NE . ARG D 77 ? 0.7815 0.8935 1.0736 -0.0500 0.0182 0.0176 136 ARG D NE 10974 C CZ . ARG D 77 ? 0.8665 0.9765 1.1466 -0.0486 0.0178 0.0164 136 ARG D CZ 10975 N NH1 . ARG D 77 ? 0.8467 0.9532 1.1208 -0.0484 0.0160 0.0142 136 ARG D NH1 10976 N NH2 . ARG D 77 ? 0.7080 0.8193 0.9820 -0.0474 0.0192 0.0175 136 ARG D NH2 10977 N N . PHE D 78 ? 0.6118 0.7317 0.9538 -0.0524 0.0069 0.0084 137 PHE D N 10978 C CA . PHE D 78 ? 0.4946 0.6178 0.8503 -0.0536 0.0069 0.0089 137 PHE D CA 10979 C C . PHE D 78 ? 0.5154 0.6375 0.8790 -0.0539 0.0023 0.0047 137 PHE D C 10980 O O . PHE D 78 ? 0.4890 0.6121 0.8638 -0.0555 0.0025 0.0055 137 PHE D O 10981 C CB . PHE D 78 ? 0.5379 0.6642 0.8941 -0.0525 0.0072 0.0089 137 PHE D CB 10982 C CG . PHE D 78 ? 0.4799 0.6094 0.8498 -0.0533 0.0056 0.0077 137 PHE D CG 10983 C CD1 . PHE D 78 ? 0.4829 0.6148 0.8639 -0.0551 0.0086 0.0112 137 PHE D CD1 10984 C CD2 . PHE D 78 ? 0.3619 0.4917 0.7335 -0.0521 0.0013 0.0030 137 PHE D CD2 10985 C CE1 . PHE D 78 ? 0.3172 0.4519 0.7111 -0.0558 0.0072 0.0101 137 PHE D CE1 10986 C CE2 . PHE D 78 ? 0.4463 0.5790 0.8307 -0.0527 -0.0002 0.0018 137 PHE D CE2 10987 C CZ . PHE D 78 ? 0.3511 0.4863 0.7468 -0.0547 0.0027 0.0053 137 PHE D CZ 10988 N N . TYR D 79 ? 0.4257 0.5459 0.7835 -0.0521 -0.0018 0.0002 138 TYR D N 10989 C CA . TYR D 79 ? 0.5520 0.6708 0.9159 -0.0519 -0.0067 -0.0042 138 TYR D CA 10990 C C . TYR D 79 ? 0.5898 0.7060 0.9561 -0.0533 -0.0070 -0.0037 138 TYR D C 10991 O O . TYR D 79 ? 0.6406 0.7571 1.0174 -0.0543 -0.0091 -0.0050 138 TYR D O 10992 C CB . TYR D 79 ? 0.3236 0.4400 0.6784 -0.0494 -0.0106 -0.0088 138 TYR D CB 10993 C CG . TYR D 79 ? 0.6583 0.7770 1.0112 -0.0479 -0.0110 -0.0101 138 TYR D CG 10994 C CD1 . TYR D 79 ? 0.6318 0.7546 0.9953 -0.0487 -0.0103 -0.0093 138 TYR D CD1 10995 C CD2 . TYR D 79 ? 0.5777 0.6946 0.9182 -0.0456 -0.0120 -0.0122 138 TYR D CD2 10996 C CE1 . TYR D 79 ? 0.4309 0.5560 0.7926 -0.0473 -0.0107 -0.0106 138 TYR D CE1 10997 C CE2 . TYR D 79 ? 0.4464 0.5655 0.7849 -0.0442 -0.0123 -0.0134 138 TYR D CE2 10998 C CZ . TYR D 79 ? 0.5210 0.6442 0.8700 -0.0450 -0.0117 -0.0126 138 TYR D CZ 10999 O OH . TYR D 79 ? 0.4550 0.5803 0.8016 -0.0435 -0.0121 -0.0138 138 TYR D OH 11000 N N . SER D 80 ? 0.4867 0.6004 0.8431 -0.0533 -0.0048 -0.0017 139 SER D N 11001 C CA . SER D 80 ? 0.6523 0.7633 1.0090 -0.0544 -0.0050 -0.0011 139 SER D CA 11002 C C . SER D 80 ? 0.5673 0.6802 0.9350 -0.0568 -0.0020 0.0023 139 SER D C 11003 O O . SER D 80 ? 0.5986 0.7101 0.9720 -0.0579 -0.0035 0.0016 139 SER D O 11004 C CB . SER D 80 ? 0.5954 0.7037 0.9387 -0.0538 -0.0029 0.0005 139 SER D CB 11005 O OG . SER D 80 ? 0.5993 0.7048 0.9329 -0.0517 -0.0061 -0.0031 139 SER D OG 11006 N N . ASN D 81 ? 0.4944 0.6103 0.8649 -0.0574 0.0022 0.0061 140 ASN D N 11007 C CA . ASN D 81 ? 0.5333 0.6509 0.9135 -0.0595 0.0056 0.0098 140 ASN D CA 11008 C C . ASN D 81 ? 0.5345 0.6553 0.9293 -0.0605 0.0046 0.0092 140 ASN D C 11009 O O . ASN D 81 ? 0.5025 0.6252 0.9058 -0.0620 0.0079 0.0125 140 ASN D O 11010 C CB . ASN D 81 ? 0.6136 0.7326 0.9892 -0.0596 0.0111 0.0146 140 ASN D CB 11011 C CG . ASN D 81 ? 0.5579 0.6739 0.9218 -0.0592 0.0129 0.0162 140 ASN D CG 11012 O OD1 . ASN D 81 ? 0.5287 0.6435 0.8941 -0.0604 0.0152 0.0185 140 ASN D OD1 11013 N ND2 . ASN D 81 ? 0.4891 0.6037 0.8411 -0.0576 0.0120 0.0148 140 ASN D ND2 11014 N N . ILE D 82 ? 0.4734 0.5947 0.8711 -0.0595 0.0002 0.0049 141 ILE D N 11015 C CA . ILE D 82 ? 0.5280 0.6520 0.9399 -0.0604 -0.0014 0.0037 141 ILE D CA 11016 C C . ILE D 82 ? 0.5678 0.6905 0.9887 -0.0621 -0.0023 0.0035 141 ILE D C 11017 O O . ILE D 82 ? 0.6590 0.7788 1.0778 -0.0617 -0.0061 0.0003 141 ILE D O 11018 C CB . ILE D 82 ? 0.5647 0.6891 0.9773 -0.0587 -0.0064 -0.0014 141 ILE D CB 11019 C CG1 . ILE D 82 ? 0.5491 0.6753 0.9541 -0.0571 -0.0052 -0.0010 141 ILE D CG1 11020 C CG2 . ILE D 82 ? 0.4875 0.6144 0.9153 -0.0597 -0.0084 -0.0031 141 ILE D CG2 11021 C CD1 . ILE D 82 ? 0.4129 0.5391 0.8168 -0.0551 -0.0099 -0.0061 141 ILE D CD1 11022 N N . GLY D 83 ? 0.4307 0.5555 0.8612 -0.0640 0.0013 0.0071 142 GLY D N 11023 C CA . GLY D 83 ? 0.6121 0.7358 1.0506 -0.0658 0.0015 0.0078 142 GLY D CA 11024 C C . GLY D 83 ? 0.6811 0.8064 1.1341 -0.0667 -0.0015 0.0053 142 GLY D C 11025 O O . GLY D 83 ? 0.6155 0.7431 1.0732 -0.0660 -0.0037 0.0030 142 GLY D O 11026 N N . SER D 84 ? 0.6231 0.7472 1.0832 -0.0684 -0.0014 0.0058 143 SER D N 11027 C CA . SER D 84 ? 0.5686 0.6939 1.0428 -0.0694 -0.0044 0.0035 143 SER D CA 11028 C C . SER D 84 ? 0.5426 0.6717 1.0296 -0.0710 -0.0008 0.0065 143 SER D C 11029 O O . SER D 84 ? 0.6465 0.7775 1.1461 -0.0718 -0.0030 0.0045 143 SER D O 11030 C CB . SER D 84 ? 0.5962 0.7184 1.0725 -0.0705 -0.0062 0.0025 143 SER D CB 11031 O OG . SER D 84 ? 0.7351 0.8541 1.2034 -0.0689 -0.0112 -0.0015 143 SER D OG 11032 N N . CYS D 85 ? 0.5415 0.6717 1.0257 -0.0714 0.0049 0.0113 144 CYS D N 11033 C CA . CYS D 85 ? 0.7390 0.8725 1.2345 -0.0727 0.0089 0.0147 144 CYS D CA 11034 C C . CYS D 85 ? 0.7165 0.8525 1.2069 -0.0716 0.0123 0.0176 144 CYS D C 11035 O O . CYS D 85 ? 0.6344 0.7731 1.1322 -0.0724 0.0164 0.0211 144 CYS D O 11036 C CB . CYS D 85 ? 0.8714 1.0038 1.3711 -0.0744 0.0130 0.0185 144 CYS D CB 11037 S SG . CYS D 85 ? 0.8153 0.9453 1.3234 -0.0760 0.0093 0.0156 144 CYS D SG 11038 N N . SER D 86 ? 0.7391 0.8740 1.2166 -0.0698 0.0108 0.0161 145 SER D N 11039 C CA . SER D 86 ? 0.5242 0.6611 0.9953 -0.0685 0.0135 0.0184 145 SER D CA 11040 C C . SER D 86 ? 0.5260 0.6614 0.9845 -0.0665 0.0101 0.0150 145 SER D C 11041 O O . SER D 86 ? 0.5702 0.7023 1.0216 -0.0660 0.0072 0.0124 145 SER D O 11042 C CB . SER D 86 ? 0.4663 0.6026 0.9317 -0.0687 0.0193 0.0237 145 SER D CB 11043 O OG . SER D 86 ? 0.7057 0.8433 1.1824 -0.0703 0.0230 0.0271 145 SER D OG 11044 N N . VAL D 87 ? 0.4419 0.5798 0.8977 -0.0653 0.0103 0.0151 146 VAL D N 11045 C CA . VAL D 87 ? 0.5343 0.6709 0.9777 -0.0632 0.0076 0.0122 146 VAL D CA 11046 C C . VAL D 87 ? 0.3841 0.5185 0.8139 -0.0625 0.0107 0.0151 146 VAL D C 11047 O O . VAL D 87 ? 0.4131 0.5447 0.8317 -0.0613 0.0085 0.0128 146 VAL D O 11048 C CB . VAL D 87 ? 0.6184 0.7583 1.0627 -0.0620 0.0070 0.0113 146 VAL D CB 11049 C CG1 . VAL D 87 ? 0.3901 0.5316 0.8457 -0.0622 0.0026 0.0070 146 VAL D CG1 11050 C CG2 . VAL D 87 ? 0.5828 0.7257 1.0306 -0.0626 0.0122 0.0164 146 VAL D CG2 11051 N N . TYR D 88 ? 0.4698 0.6053 0.9008 -0.0633 0.0160 0.0201 147 TYR D N 11052 C CA . TYR D 88 ? 0.3160 0.4494 0.7351 -0.0627 0.0193 0.0232 147 TYR D CA 11053 C C . TYR D 88 ? 0.5255 0.6591 0.9495 -0.0640 0.0243 0.0280 147 TYR D C 11054 O O . TYR D 88 ? 0.5633 0.6995 0.9986 -0.0650 0.0264 0.0301 147 TYR D O 11055 C CB . TYR D 88 ? 0.3150 0.4498 0.7250 -0.0610 0.0207 0.0244 147 TYR D CB 11056 C CG . TYR D 88 ? 0.4280 0.5664 0.8446 -0.0612 0.0245 0.0284 147 TYR D CG 11057 C CD1 . TYR D 88 ? 0.4410 0.5827 0.8665 -0.0612 0.0229 0.0269 147 TYR D CD1 11058 C CD2 . TYR D 88 ? 0.3409 0.4795 0.7547 -0.0611 0.0297 0.0335 147 TYR D CD2 11059 C CE1 . TYR D 88 ? 0.3132 0.4583 0.7448 -0.0613 0.0263 0.0306 147 TYR D CE1 11060 C CE2 . TYR D 88 ? 0.4642 0.6060 0.8839 -0.0610 0.0332 0.0372 147 TYR D CE2 11061 C CZ . TYR D 88 ? 0.3805 0.5255 0.8091 -0.0612 0.0315 0.0358 147 TYR D CZ 11062 O OH . TYR D 88 ? 0.5044 0.6526 0.9388 -0.0610 0.0350 0.0397 147 TYR D OH 11063 N N . SER D 89 ? 0.6066 0.7373 1.0220 -0.0639 0.0262 0.0296 148 SER D N 11064 C CA . SER D 89 ? 0.5336 0.6642 0.9516 -0.0647 0.0312 0.0343 148 SER D CA 11065 C C . SER D 89 ? 0.6802 0.8092 1.0852 -0.0635 0.0344 0.0370 148 SER D C 11066 O O . SER D 89 ? 0.8579 0.9844 1.2590 -0.0638 0.0362 0.0384 148 SER D O 11067 C CB . SER D 89 ? 0.4033 0.5317 0.8270 -0.0663 0.0305 0.0334 148 SER D CB 11068 O OG . SER D 89 ? 0.6004 0.7259 1.0173 -0.0660 0.0262 0.0294 148 SER D OG 11069 N N . ASP D 90 ? 0.6555 0.7858 1.0538 -0.0620 0.0351 0.0378 149 ASP D N 11070 C CA . ASP D 90 ? 0.5966 0.7255 0.9821 -0.0606 0.0377 0.0401 149 ASP D CA 11071 C C . ASP D 90 ? 0.6004 0.7319 0.9826 -0.0592 0.0389 0.0417 149 ASP D C 11072 O O . ASP D 90 ? 0.5549 0.6866 0.9314 -0.0583 0.0359 0.0388 149 ASP D O 11073 C CB . ASP D 90 ? 0.6065 0.7321 0.9807 -0.0601 0.0346 0.0368 149 ASP D CB 11074 C CG . ASP D 90 ? 0.7050 0.8289 1.0667 -0.0589 0.0375 0.0392 149 ASP D CG 11075 O OD1 . ASP D 90 ? 0.5836 0.7086 0.9454 -0.0585 0.0419 0.0435 149 ASP D OD1 11076 O OD2 . ASP D 90 ? 0.6285 0.7498 0.9801 -0.0583 0.0353 0.0367 149 ASP D OD2 11077 N N . ASP D 91 ? 0.3927 0.5260 0.7782 -0.0589 0.0435 0.0463 150 ASP D N 11078 C CA . ASP D 91 ? 0.5572 0.6932 0.9411 -0.0576 0.0449 0.0483 150 ASP D CA 11079 C C . ASP D 91 ? 0.6230 0.7578 0.9923 -0.0559 0.0447 0.0481 150 ASP D C 11080 O O . ASP D 91 ? 0.5340 0.6706 0.9003 -0.0549 0.0433 0.0471 150 ASP D O 11081 C CB . ASP D 91 ? 0.4505 0.5881 0.8406 -0.0575 0.0500 0.0536 150 ASP D CB 11082 C CG . ASP D 91 ? 0.5896 0.7291 0.9951 -0.0591 0.0504 0.0540 150 ASP D CG 11083 O OD1 . ASP D 91 ? 0.5163 0.6563 0.9279 -0.0602 0.0464 0.0500 150 ASP D OD1 11084 O OD2 . ASP D 91 ? 0.5491 0.6894 0.9605 -0.0591 0.0547 0.0582 150 ASP D OD2 11085 N N . GLN D 92 ? 0.6185 0.7505 0.9789 -0.0555 0.0460 0.0488 151 GLN D N 11086 C CA . GLN D 92 ? 0.5436 0.6744 0.8903 -0.0539 0.0463 0.0491 151 GLN D CA 11087 C C . GLN D 92 ? 0.5904 0.7203 0.9304 -0.0534 0.0416 0.0443 151 GLN D C 11088 O O . GLN D 92 ? 0.5913 0.7223 0.9252 -0.0521 0.0411 0.0440 151 GLN D O 11089 C CB . GLN D 92 ? 0.5668 0.6946 0.9061 -0.0536 0.0487 0.0508 151 GLN D CB 11090 C CG . GLN D 92 ? 0.5484 0.6751 0.8740 -0.0519 0.0494 0.0514 151 GLN D CG 11091 C CD . GLN D 92 ? 0.6979 0.8271 1.0220 -0.0505 0.0516 0.0545 151 GLN D CD 11092 O OE1 . GLN D 92 ? 0.7826 0.9124 1.0997 -0.0494 0.0499 0.0530 151 GLN D OE1 11093 N NE2 . GLN D 92 ? 0.6458 0.7765 0.9765 -0.0503 0.0555 0.0588 151 GLN D NE2 11094 N N . MSE D 93 ? 0.5612 0.6890 0.9021 -0.0543 0.0383 0.0406 152 MSE D N 11095 C CA . MSE D 93 ? 0.5460 0.6724 0.8802 -0.0537 0.0339 0.0359 152 MSE D CA 11096 C C . MSE D 93 ? 0.6985 0.8277 1.0387 -0.0535 0.0312 0.0336 152 MSE D C 11097 O O . MSE D 93 ? 0.8497 0.9785 1.1833 -0.0523 0.0284 0.0305 152 MSE D O 11098 C CB . MSE D 93 ? 0.3114 0.4349 0.6457 -0.0546 0.0310 0.0327 152 MSE D CB 11099 C CG . MSE D 93 ? 1.2443 1.3686 1.5907 -0.0559 0.0281 0.0301 152 MSE D CG 11100 SE SE . MSE D 93 ? 1.4725 1.5968 1.8180 -0.0549 0.0218 0.0238 152 MSE D SE 11101 C CE . MSE D 93 ? 0.4644 0.5886 0.8250 -0.0568 0.0188 0.0213 152 MSE D CE 11102 N N . ILE D 94 ? 0.6720 0.8038 1.0246 -0.0545 0.0322 0.0351 153 ILE D N 11103 C CA . ILE D 94 ? 0.3374 0.4721 0.6965 -0.0543 0.0301 0.0333 153 ILE D CA 11104 C C . ILE D 94 ? 0.4788 0.6157 0.8327 -0.0529 0.0325 0.0360 153 ILE D C 11105 O O . ILE D 94 ? 0.5191 0.6571 0.8695 -0.0518 0.0302 0.0337 153 ILE D O 11106 C CB . ILE D 94 ? 0.5249 0.6619 0.8995 -0.0559 0.0305 0.0341 153 ILE D CB 11107 C CG1 . ILE D 94 ? 0.4126 0.5476 0.7926 -0.0571 0.0270 0.0303 153 ILE D CG1 11108 C CG2 . ILE D 94 ? 0.4816 0.6221 0.8626 -0.0555 0.0296 0.0336 153 ILE D CG2 11109 C CD1 . ILE D 94 ? 0.4780 0.6121 0.8544 -0.0562 0.0218 0.0249 153 ILE D CD1 11110 N N . ASP D 95 ? 0.3642 0.5017 0.7173 -0.0527 0.0370 0.0410 154 ASP D N 11111 C CA . ASP D 95 ? 0.5826 0.7216 0.9293 -0.0512 0.0395 0.0440 154 ASP D CA 11112 C C . ASP D 95 ? 0.4439 0.5810 0.7763 -0.0497 0.0379 0.0420 154 ASP D C 11113 O O . ASP D 95 ? 0.6454 0.7840 0.9723 -0.0484 0.0381 0.0426 154 ASP D O 11114 C CB . ASP D 95 ? 0.4074 0.5466 0.7547 -0.0510 0.0447 0.0496 154 ASP D CB 11115 C CG . ASP D 95 ? 0.6503 0.7922 1.0114 -0.0520 0.0469 0.0524 154 ASP D CG 11116 O OD1 . ASP D 95 ? 0.6044 0.7474 0.9753 -0.0532 0.0444 0.0497 154 ASP D OD1 11117 O OD2 . ASP D 95 ? 0.6341 0.7766 0.9962 -0.0514 0.0512 0.0571 154 ASP D OD2 11118 N N . ASN D 96 ? 0.3518 0.4856 0.6781 -0.0500 0.0364 0.0397 155 ASN D N 11119 C CA . ASN D 96 ? 0.4764 0.6081 0.7897 -0.0487 0.0346 0.0372 155 ASN D CA 11120 C C . ASN D 96 ? 0.6126 0.7449 0.9258 -0.0481 0.0303 0.0326 155 ASN D C 11121 O O . ASN D 96 ? 0.6163 0.7486 0.9206 -0.0467 0.0294 0.0314 155 ASN D O 11122 C CB . ASN D 96 ? 0.3571 0.4851 0.6648 -0.0491 0.0340 0.0359 155 ASN D CB 11123 C CG . ASN D 96 ? 0.5560 0.6830 0.8616 -0.0493 0.0383 0.0402 155 ASN D CG 11124 O OD1 . ASN D 96 ? 0.4934 0.6220 0.7977 -0.0485 0.0416 0.0441 155 ASN D OD1 11125 N ND2 . ASN D 96 ? 0.5971 0.7215 0.9022 -0.0502 0.0381 0.0395 155 ASN D ND2 11126 N N . LEU D 97 ? 0.5836 0.7163 0.9067 -0.0492 0.0275 0.0298 156 LEU D N 11127 C CA . LEU D 97 ? 0.5154 0.6488 0.8398 -0.0486 0.0233 0.0252 156 LEU D CA 11128 C C . LEU D 97 ? 0.4902 0.6271 0.8166 -0.0478 0.0240 0.0262 156 LEU D C 11129 O O . LEU D 97 ? 0.4069 0.5440 0.7273 -0.0464 0.0216 0.0233 156 LEU D O 11130 C CB . LEU D 97 ? 0.5048 0.6381 0.8407 -0.0499 0.0205 0.0223 156 LEU D CB 11131 C CG . LEU D 97 ? 0.5230 0.6571 0.8621 -0.0492 0.0160 0.0174 156 LEU D CG 11132 C CD1 . LEU D 97 ? 0.4831 0.6144 0.8098 -0.0475 0.0132 0.0136 156 LEU D CD1 11133 C CD2 . LEU D 97 ? 0.5084 0.6424 0.8594 -0.0506 0.0134 0.0150 156 LEU D CD2 11134 N N . LEU D 98 ? 0.3363 0.4761 0.6710 -0.0485 0.0271 0.0303 157 LEU D N 11135 C CA . LEU D 98 ? 0.3095 0.4527 0.6460 -0.0477 0.0282 0.0320 157 LEU D CA 11136 C C . LEU D 98 ? 0.3841 0.5268 0.7071 -0.0459 0.0295 0.0333 157 LEU D C 11137 O O . LEU D 98 ? 0.4276 0.5718 0.7471 -0.0447 0.0280 0.0317 157 LEU D O 11138 C CB . LEU D 98 ? 0.4107 0.5567 0.7578 -0.0487 0.0319 0.0368 157 LEU D CB 11139 C CG . LEU D 98 ? 0.3878 0.5352 0.7502 -0.0504 0.0312 0.0362 157 LEU D CG 11140 C CD1 . LEU D 98 ? 0.4626 0.6088 0.8281 -0.0509 0.0262 0.0304 157 LEU D CD1 11141 C CD2 . LEU D 98 ? 0.3623 0.5087 0.7300 -0.0517 0.0346 0.0398 157 LEU D CD2 11142 N N . HIS D 99 ? 0.4209 0.5617 0.7366 -0.0457 0.0323 0.0363 158 HIS D N 11143 C CA . HIS D 99 ? 0.3424 0.4824 0.6449 -0.0441 0.0335 0.0375 158 HIS D CA 11144 C C . HIS D 99 ? 0.4368 0.5749 0.7304 -0.0430 0.0298 0.0325 158 HIS D C 11145 O O . HIS D 99 ? 0.3853 0.5240 0.6709 -0.0416 0.0295 0.0322 158 HIS D O 11146 C CB . HIS D 99 ? 0.4414 0.5791 0.7377 -0.0440 0.0367 0.0408 158 HIS D CB 11147 C CG . HIS D 99 ? 0.5891 0.7257 0.8718 -0.0424 0.0376 0.0417 158 HIS D CG 11148 N ND1 . HIS D 99 ? 0.5950 0.7284 0.8673 -0.0418 0.0358 0.0386 158 HIS D ND1 11149 C CD2 . HIS D 99 ? 0.6175 0.7556 0.8952 -0.0411 0.0402 0.0453 158 HIS D CD2 11150 C CE1 . HIS D 99 ? 0.5913 0.7244 0.8530 -0.0404 0.0372 0.0402 158 HIS D CE1 11151 N NE2 . HIS D 99 ? 0.6877 0.8235 0.9523 -0.0399 0.0399 0.0443 158 HIS D NE2 11152 N N . ASP D 100 ? 0.3099 0.4455 0.6046 -0.0437 0.0269 0.0287 159 ASP D N 11153 C CA . ASP D 100 ? 0.3112 0.4447 0.5980 -0.0426 0.0233 0.0238 159 ASP D CA 11154 C C . ASP D 100 ? 0.3481 0.4839 0.6389 -0.0418 0.0205 0.0208 159 ASP D C 11155 O O . ASP D 100 ? 0.4930 0.6283 0.7753 -0.0402 0.0189 0.0183 159 ASP D O 11156 C CB . ASP D 100 ? 0.5554 0.6857 0.8434 -0.0433 0.0208 0.0206 159 ASP D CB 11157 C CG . ASP D 100 ? 0.6256 0.7531 0.9069 -0.0437 0.0231 0.0228 159 ASP D CG 11158 O OD1 . ASP D 100 ? 0.6966 0.8249 0.9740 -0.0435 0.0267 0.0270 159 ASP D OD1 11159 O OD2 . ASP D 100 ? 0.5790 0.7035 0.8587 -0.0440 0.0212 0.0203 159 ASP D OD2 11160 N N . LEU D 101 ? 0.5712 0.7096 0.8750 -0.0430 0.0201 0.0210 160 LEU D N 11161 C CA . LEU D 101 ? 0.4009 0.5418 0.7098 -0.0424 0.0176 0.0182 160 LEU D CA 11162 C C . LEU D 101 ? 0.5340 0.6774 0.8376 -0.0411 0.0195 0.0207 160 LEU D C 11163 O O . LEU D 101 ? 0.3228 0.4673 0.6237 -0.0399 0.0173 0.0178 160 LEU D O 11164 C CB . LEU D 101 ? 0.3124 0.4558 0.6370 -0.0440 0.0172 0.0186 160 LEU D CB 11165 C CG . LEU D 101 ? 0.3759 0.5173 0.7073 -0.0450 0.0142 0.0150 160 LEU D CG 11166 C CD1 . LEU D 101 ? 0.3133 0.4573 0.6603 -0.0468 0.0148 0.0164 160 LEU D CD1 11167 C CD2 . LEU D 101 ? 0.3152 0.4554 0.6435 -0.0436 0.0094 0.0090 160 LEU D CD2 11168 N N . ASN D 102 ? 0.3828 0.5271 0.6849 -0.0414 0.0236 0.0260 161 ASN D N 11169 C CA . ASN D 102 ? 0.3397 0.4862 0.6365 -0.0402 0.0258 0.0290 161 ASN D CA 11170 C C . ASN D 102 ? 0.3900 0.5344 0.6714 -0.0385 0.0256 0.0281 161 ASN D C 11171 O O . ASN D 102 ? 0.4653 0.6112 0.7413 -0.0371 0.0255 0.0281 161 ASN D O 11172 C CB . ASN D 102 ? 0.3079 0.4559 0.6088 -0.0409 0.0303 0.0352 161 ASN D CB 11173 C CG . ASN D 102 ? 0.4123 0.5622 0.7068 -0.0394 0.0327 0.0387 161 ASN D CG 11174 O OD1 . ASN D 102 ? 0.5382 0.6866 0.8219 -0.0384 0.0343 0.0405 161 ASN D OD1 11175 N ND2 . ASN D 102 ? 0.3068 0.4603 0.6083 -0.0393 0.0328 0.0397 161 ASN D ND2 11176 N N . THR D 103 ? 0.3635 0.5043 0.6378 -0.0385 0.0256 0.0273 162 THR D N 11177 C CA . THR D 103 ? 0.4074 0.5461 0.6673 -0.0371 0.0262 0.0273 162 THR D CA 11178 C C . THR D 103 ? 0.3274 0.4630 0.5793 -0.0361 0.0228 0.0219 162 THR D C 11179 O O . THR D 103 ? 0.3710 0.5053 0.6113 -0.0346 0.0228 0.0212 162 THR D O 11180 C CB . THR D 103 ? 0.4146 0.5514 0.6703 -0.0375 0.0294 0.0311 162 THR D CB 11181 O OG1 . THR D 103 ? 0.4492 0.5836 0.7086 -0.0388 0.0284 0.0294 162 THR D OG1 11182 C CG2 . THR D 103 ? 0.3075 0.4470 0.5694 -0.0380 0.0332 0.0367 162 THR D CG2 11183 N N . SER D 104 ? 0.3425 0.4767 0.6004 -0.0368 0.0199 0.0182 163 SER D N 11184 C CA . SER D 104 ? 0.3468 0.4778 0.5974 -0.0357 0.0166 0.0131 163 SER D CA 11185 C C . SER D 104 ? 0.4698 0.6014 0.7145 -0.0338 0.0147 0.0100 163 SER D C 11186 O O . SER D 104 ? 0.5698 0.7046 0.8212 -0.0337 0.0139 0.0097 163 SER D O 11187 C CB . SER D 104 ? 0.3153 0.4450 0.5745 -0.0366 0.0136 0.0097 163 SER D CB 11188 O OG . SER D 104 ? 0.6016 0.7305 0.8661 -0.0383 0.0154 0.0124 163 SER D OG 11189 N N . PRO D 105 ? 0.5583 0.6871 0.7906 -0.0322 0.0139 0.0078 164 PRO D N 11190 C CA . PRO D 105 ? 0.5838 0.7126 0.8089 -0.0302 0.0121 0.0046 164 PRO D CA 11191 C C . PRO D 105 ? 0.4517 0.5804 0.6829 -0.0295 0.0080 -0.0007 164 PRO D C 11192 O O . PRO D 105 ? 0.3654 0.4919 0.6005 -0.0300 0.0060 -0.0032 164 PRO D O 11193 C CB . PRO D 105 ? 0.5081 0.6330 0.7194 -0.0289 0.0124 0.0034 164 PRO D CB 11194 C CG . PRO D 105 ? 0.5591 0.6815 0.7723 -0.0302 0.0127 0.0040 164 PRO D CG 11195 C CD . PRO D 105 ? 0.5195 0.6446 0.7436 -0.0323 0.0149 0.0083 164 PRO D CD 11196 N N . ILE D 106 ? 0.3481 0.4791 0.5799 -0.0284 0.0068 -0.0024 165 ILE D N 11197 C CA . ILE D 106 ? 0.3212 0.4525 0.5591 -0.0276 0.0030 -0.0074 165 ILE D CA 11198 C C . ILE D 106 ? 0.3600 0.4879 0.5872 -0.0250 0.0003 -0.0125 165 ILE D C 11199 O O . ILE D 106 ? 0.4487 0.5764 0.6654 -0.0235 0.0013 -0.0124 165 ILE D O 11200 C CB . ILE D 106 ? 0.5778 0.7136 0.8233 -0.0276 0.0029 -0.0067 165 ILE D CB 11201 C CG1 . ILE D 106 ? 0.4242 0.5631 0.6819 -0.0301 0.0052 -0.0021 165 ILE D CG1 11202 C CG2 . ILE D 106 ? 0.5562 0.6922 0.8069 -0.0264 -0.0012 -0.0123 165 ILE D CG2 11203 C CD1 . ILE D 106 ? 0.5024 0.6456 0.7636 -0.0302 0.0072 0.0011 165 ILE D CD1 11204 N N . LYS D 107 ? 0.3249 0.4503 0.5551 -0.0245 -0.0029 -0.0168 166 LYS D N 11205 C CA . LYS D 107 ? 0.4175 0.5393 0.6384 -0.0219 -0.0056 -0.0220 166 LYS D CA 11206 C C . LYS D 107 ? 0.3759 0.4992 0.6001 -0.0201 -0.0087 -0.0264 166 LYS D C 11207 O O . LYS D 107 ? 0.5340 0.6565 0.7490 -0.0178 -0.0093 -0.0288 166 LYS D O 11208 C CB . LYS D 107 ? 0.6113 0.7292 0.8331 -0.0220 -0.0075 -0.0243 166 LYS D CB 11209 C CG . LYS D 107 ? 0.6966 0.8102 0.9090 -0.0192 -0.0103 -0.0294 166 LYS D CG 11210 C CD . LYS D 107 ? 0.7721 0.8824 0.9882 -0.0194 -0.0125 -0.0315 166 LYS D CD 11211 C CE . LYS D 107 ? 0.8218 0.9283 1.0328 -0.0163 -0.0163 -0.0375 166 LYS D CE 11212 N NZ . LYS D 107 ? 0.8279 0.9312 1.0240 -0.0142 -0.0152 -0.0385 166 LYS D NZ 11213 N N . HIS D 108 ? 0.3504 0.4759 0.5879 -0.0211 -0.0106 -0.0274 167 HIS D N 11214 C CA . HIS D 108 ? 0.3299 0.4571 0.5721 -0.0195 -0.0137 -0.0317 167 HIS D CA 11215 C C . HIS D 108 ? 0.4478 0.5800 0.7039 -0.0215 -0.0132 -0.0295 167 HIS D C 11216 O O . HIS D 108 ? 0.4690 0.6024 0.7341 -0.0239 -0.0118 -0.0261 167 HIS D O 11217 C CB . HIS D 108 ? 0.4527 0.5766 0.6967 -0.0179 -0.0179 -0.0374 167 HIS D CB 11218 C CG . HIS D 108 ? 0.7790 0.8981 1.0095 -0.0154 -0.0188 -0.0404 167 HIS D CG 11219 N ND1 . HIS D 108 ? 0.9012 1.0196 1.1200 -0.0131 -0.0182 -0.0418 167 HIS D ND1 11220 C CD2 . HIS D 108 ? 0.8159 0.9306 1.0427 -0.0148 -0.0201 -0.0422 167 HIS D CD2 11221 C CE1 . HIS D 108 ? 0.9263 1.0400 1.1349 -0.0112 -0.0190 -0.0443 167 HIS D CE1 11222 N NE2 . HIS D 108 ? 0.8479 0.9593 1.0611 -0.0121 -0.0202 -0.0446 167 HIS D NE2 11223 N N . VAL D 109 ? 0.4658 0.6007 0.7233 -0.0202 -0.0143 -0.0314 168 VAL D N 11224 C CA . VAL D 109 ? 0.3914 0.5308 0.6625 -0.0217 -0.0146 -0.0304 168 VAL D CA 11225 C C . VAL D 109 ? 0.3299 0.4696 0.6062 -0.0198 -0.0189 -0.0365 168 VAL D C 11226 O O . VAL D 109 ? 0.4426 0.5817 0.7109 -0.0172 -0.0203 -0.0399 168 VAL D O 11227 C CB . VAL D 109 ? 0.4049 0.5482 0.6744 -0.0222 -0.0114 -0.0261 168 VAL D CB 11228 C CG1 . VAL D 109 ? 0.3527 0.5008 0.6368 -0.0236 -0.0116 -0.0251 168 VAL D CG1 11229 C CG2 . VAL D 109 ? 0.3245 0.4675 0.5888 -0.0238 -0.0071 -0.0201 168 VAL D CG2 11230 N N . HIS D 110 ? 0.3432 0.4837 0.6327 -0.0210 -0.0211 -0.0379 169 HIS D N 11231 C CA . HIS D 110 ? 0.4382 0.5790 0.7339 -0.0192 -0.0254 -0.0437 169 HIS D CA 11232 C C . HIS D 110 ? 0.4340 0.5795 0.7454 -0.0210 -0.0257 -0.0428 169 HIS D C 11233 O O . HIS D 110 ? 0.3987 0.5464 0.7185 -0.0239 -0.0232 -0.0381 169 HIS D O 11234 C CB . HIS D 110 ? 0.4657 0.6022 0.7623 -0.0183 -0.0288 -0.0478 169 HIS D CB 11235 C CG . HIS D 110 ? 0.6458 0.7775 0.9275 -0.0158 -0.0294 -0.0502 169 HIS D CG 11236 N ND1 . HIS D 110 ? 0.6060 0.7351 0.8789 -0.0166 -0.0266 -0.0467 169 HIS D ND1 11237 C CD2 . HIS D 110 ? 0.5883 0.7171 0.8624 -0.0124 -0.0324 -0.0558 169 HIS D CD2 11238 C CE1 . HIS D 110 ? 0.6303 0.7553 0.8910 -0.0139 -0.0278 -0.0500 169 HIS D CE1 11239 N NE2 . HIS D 110 ? 0.6991 0.8237 0.9602 -0.0113 -0.0313 -0.0555 169 HIS D NE2 11240 N N . ILE D 111 ? 0.3951 0.5422 0.7104 -0.0193 -0.0288 -0.0474 170 ILE D N 11241 C CA . ILE D 111 ? 0.4766 0.6280 0.8075 -0.0207 -0.0298 -0.0474 170 ILE D CA 11242 C C . ILE D 111 ? 0.4934 0.6434 0.8356 -0.0218 -0.0325 -0.0495 170 ILE D C 11243 O O . ILE D 111 ? 0.5713 0.7179 0.9114 -0.0196 -0.0363 -0.0548 170 ILE D O 11244 C CB . ILE D 111 ? 0.3329 0.4864 0.6642 -0.0184 -0.0324 -0.0520 170 ILE D CB 11245 C CG1 . ILE D 111 ? 0.3322 0.4875 0.6530 -0.0175 -0.0296 -0.0496 170 ILE D CG1 11246 C CG2 . ILE D 111 ? 0.3324 0.4900 0.6807 -0.0198 -0.0338 -0.0526 170 ILE D CG2 11247 C CD1 . ILE D 111 ? 0.4497 0.6069 0.7694 -0.0150 -0.0320 -0.0541 170 ILE D CD1 11248 N N . MSE D 112 ? 0.7173 0.8696 1.0713 -0.0249 -0.0306 -0.0454 171 MSE D N 11249 C CA . MSE D 112 ? 0.5740 0.7253 0.9393 -0.0262 -0.0328 -0.0469 171 MSE D CA 11250 C C . MSE D 112 ? 0.5263 0.6796 0.9033 -0.0253 -0.0369 -0.0518 171 MSE D C 11251 O O . MSE D 112 ? 0.6277 0.7853 1.0122 -0.0260 -0.0362 -0.0510 171 MSE D O 11252 C CB . MSE D 112 ? 0.6582 0.8113 1.0320 -0.0297 -0.0291 -0.0408 171 MSE D CB 11253 C CG . MSE D 112 ? 0.9836 1.1355 1.3688 -0.0313 -0.0311 -0.0417 171 MSE D CG 11254 SE SE . MSE D 112 ? 1.4731 1.6240 1.8594 -0.0348 -0.0262 -0.0344 171 MSE D SE 11255 C CE . MSE D 112 ? 0.6813 0.8362 1.0623 -0.0355 -0.0205 -0.0281 171 MSE D CE 11256 N N . ASP D 113 ? 0.9278 1.0778 1.3061 -0.0237 -0.0412 -0.0569 172 ASP D N 11257 C CA . ASP D 113 ? 1.0920 1.2432 1.4801 -0.0223 -0.0456 -0.0624 172 ASP D CA 11258 C C . ASP D 113 ? 1.1724 1.3267 1.5784 -0.0252 -0.0458 -0.0610 172 ASP D C 11259 O O . ASP D 113 ? 1.1830 1.3394 1.5993 -0.0246 -0.0489 -0.0648 172 ASP D O 11260 C CB . ASP D 113 ? 1.1168 1.2632 1.4999 -0.0193 -0.0502 -0.0684 172 ASP D CB 11261 C CG . ASP D 113 ? 1.2708 1.4143 1.6373 -0.0159 -0.0506 -0.0710 172 ASP D CG 11262 O OD1 . ASP D 113 ? 1.3808 1.5265 1.7408 -0.0157 -0.0479 -0.0690 172 ASP D OD1 11263 O OD2 . ASP D 113 ? 1.2162 1.3551 1.5762 -0.0134 -0.0535 -0.0750 172 ASP D OD2 11264 N N . GLY D 114 ? 1.0334 1.1879 1.4432 -0.0283 -0.0425 -0.0556 173 GLY D N 11265 C CA . GLY D 114 ? 1.1214 1.2780 1.5476 -0.0310 -0.0427 -0.0542 173 GLY D CA 11266 C C . GLY D 114 ? 1.0543 1.2160 1.4899 -0.0336 -0.0389 -0.0493 173 GLY D C 11267 O O . GLY D 114 ? 1.2995 1.4618 1.7357 -0.0360 -0.0347 -0.0436 173 GLY D O 11268 N N . GLY D 115 ? 0.7425 0.9079 1.1854 -0.0330 -0.0403 -0.0516 174 GLY D N 11269 C CA . GLY D 115 ? 0.8739 1.0443 1.3271 -0.0354 -0.0369 -0.0472 174 GLY D CA 11270 C C . GLY D 115 ? 0.9359 1.1103 1.3920 -0.0342 -0.0377 -0.0491 174 GLY D C 11271 O O . GLY D 115 ? 0.9403 1.1144 1.3957 -0.0317 -0.0418 -0.0550 174 GLY D O 11272 N N . THR D 116 ? 0.5871 0.7654 1.0464 -0.0359 -0.0335 -0.0438 175 THR D N 11273 C CA . THR D 116 ? 0.5523 0.7351 1.0162 -0.0354 -0.0334 -0.0444 175 THR D CA 11274 C C . THR D 116 ? 0.5032 0.6872 0.9549 -0.0348 -0.0296 -0.0403 175 THR D C 11275 O O . THR D 116 ? 0.5427 0.7268 0.9850 -0.0323 -0.0310 -0.0432 175 THR D O 11276 C CB . THR D 116 ? 0.6699 0.8569 1.1520 -0.0382 -0.0320 -0.0418 175 THR D CB 11277 O OG1 . THR D 116 ? 0.8203 1.0073 1.3045 -0.0408 -0.0273 -0.0351 175 THR D OG1 11278 C CG2 . THR D 116 ? 0.6493 0.8358 1.1443 -0.0384 -0.0364 -0.0468 175 THR D CG2 11279 N N . GLN D 117 ? 0.4308 0.6157 0.8829 -0.0370 -0.0248 -0.0335 176 GLN D N 11280 C CA . GLN D 117 ? 0.3222 0.5084 0.7638 -0.0366 -0.0209 -0.0289 176 GLN D CA 11281 C C . GLN D 117 ? 0.3225 0.5043 0.7468 -0.0353 -0.0201 -0.0283 176 GLN D C 11282 O O . GLN D 117 ? 0.5563 0.7342 0.9778 -0.0351 -0.0218 -0.0304 176 GLN D O 11283 C CB . GLN D 117 ? 0.3202 0.5092 0.7702 -0.0393 -0.0161 -0.0218 176 GLN D CB 11284 C CG . GLN D 117 ? 0.3198 0.5136 0.7855 -0.0405 -0.0161 -0.0216 176 GLN D CG 11285 C CD . GLN D 117 ? 0.4066 0.6028 0.8812 -0.0430 -0.0112 -0.0146 176 GLN D CD 11286 O OE1 . GLN D 117 ? 0.4756 0.6723 0.9427 -0.0431 -0.0072 -0.0093 176 GLN D OE1 11287 N NE2 . GLN D 117 ? 0.4418 0.6393 0.9323 -0.0451 -0.0115 -0.0146 176 GLN D NE2 11288 N N . VAL D 118 ? 0.3217 0.5043 0.7348 -0.0343 -0.0175 -0.0254 177 VAL D N 11289 C CA . VAL D 118 ? 0.3220 0.5008 0.7178 -0.0327 -0.0167 -0.0252 177 VAL D CA 11290 C C . VAL D 118 ? 0.3391 0.5145 0.7320 -0.0342 -0.0147 -0.0220 177 VAL D C 11291 O O . VAL D 118 ? 0.3198 0.4964 0.7181 -0.0364 -0.0110 -0.0165 177 VAL D O 11292 C CB . VAL D 118 ? 0.3398 0.5206 0.7258 -0.0319 -0.0135 -0.0214 177 VAL D CB 11293 C CG1 . VAL D 118 ? 0.3188 0.5031 0.7127 -0.0342 -0.0091 -0.0144 177 VAL D CG1 11294 C CG2 . VAL D 118 ? 0.3212 0.4982 0.6897 -0.0304 -0.0125 -0.0208 177 VAL D CG2 11295 N N . LYS D 119 ? 0.3842 0.5552 0.7683 -0.0328 -0.0171 -0.0257 178 LYS D N 11296 C CA . LYS D 119 ? 0.3224 0.4897 0.7018 -0.0338 -0.0155 -0.0233 178 LYS D CA 11297 C C . LYS D 119 ? 0.3237 0.4866 0.6874 -0.0315 -0.0170 -0.0263 178 LYS D C 11298 O O . LYS D 119 ? 0.5509 0.7125 0.9113 -0.0292 -0.0208 -0.0321 178 LYS D O 11299 C CB . LYS D 119 ? 0.3228 0.4891 0.7145 -0.0355 -0.0174 -0.0248 178 LYS D CB 11300 C CG . LYS D 119 ? 0.4621 0.6315 0.8683 -0.0383 -0.0148 -0.0204 178 LYS D CG 11301 C CD . LYS D 119 ? 0.5911 0.7586 1.0068 -0.0398 -0.0166 -0.0219 178 LYS D CD 11302 C CE . LYS D 119 ? 0.7058 0.8722 1.1254 -0.0382 -0.0222 -0.0290 178 LYS D CE 11303 N NZ . LYS D 119 ? 0.6565 0.8200 1.0820 -0.0391 -0.0244 -0.0308 178 LYS D NZ 11304 N N . PHE D 120 ? 0.3228 0.4835 0.6770 -0.0320 -0.0140 -0.0225 179 PHE D N 11305 C CA . PHE D 120 ? 0.3239 0.4802 0.6636 -0.0300 -0.0151 -0.0249 179 PHE D CA 11306 C C . PHE D 120 ? 0.3708 0.5233 0.7110 -0.0311 -0.0154 -0.0248 179 PHE D C 11307 O O . PHE D 120 ? 0.3229 0.4764 0.6717 -0.0335 -0.0134 -0.0211 179 PHE D O 11308 C CB . PHE D 120 ? 0.3230 0.4791 0.6494 -0.0294 -0.0116 -0.0211 179 PHE D CB 11309 C CG . PHE D 120 ? 0.3951 0.5542 0.7178 -0.0279 -0.0115 -0.0217 179 PHE D CG 11310 C CD1 . PHE D 120 ? 0.3244 0.4850 0.6519 -0.0264 -0.0151 -0.0268 179 PHE D CD1 11311 C CD2 . PHE D 120 ? 0.3218 0.4821 0.6359 -0.0277 -0.0080 -0.0173 179 PHE D CD2 11312 C CE1 . PHE D 120 ? 0.3289 0.4921 0.6527 -0.0250 -0.0150 -0.0275 179 PHE D CE1 11313 C CE2 . PHE D 120 ? 0.3219 0.4849 0.6322 -0.0263 -0.0080 -0.0178 179 PHE D CE2 11314 C CZ . PHE D 120 ? 0.3233 0.4877 0.6383 -0.0249 -0.0115 -0.0229 179 PHE D CZ 11315 N N . VAL D 121 ? 0.3258 0.4742 0.6570 -0.0292 -0.0180 -0.0289 180 VAL D N 11316 C CA . VAL D 121 ? 0.4706 0.6151 0.7988 -0.0300 -0.0178 -0.0282 180 VAL D CA 11317 C C . VAL D 121 ? 0.3255 0.4676 0.6386 -0.0292 -0.0151 -0.0258 180 VAL D C 11318 O O . VAL D 121 ? 0.4383 0.5786 0.7401 -0.0268 -0.0162 -0.0286 180 VAL D O 11319 C CB . VAL D 121 ? 0.4031 0.5441 0.7319 -0.0283 -0.0226 -0.0343 180 VAL D CB 11320 C CG1 . VAL D 121 ? 0.3284 0.4651 0.6511 -0.0287 -0.0222 -0.0336 180 VAL D CG1 11321 C CG2 . VAL D 121 ? 0.3503 0.4934 0.6949 -0.0294 -0.0252 -0.0363 180 VAL D CG2 11322 N N . PHE D 122 ? 0.3826 0.5245 0.6953 -0.0312 -0.0115 -0.0206 181 PHE D N 11323 C CA . PHE D 122 ? 0.3500 0.4895 0.6490 -0.0307 -0.0090 -0.0182 181 PHE D CA 11324 C C . PHE D 122 ? 0.5339 0.6687 0.8276 -0.0303 -0.0105 -0.0204 181 PHE D C 11325 O O . PHE D 122 ? 0.4340 0.5679 0.7350 -0.0319 -0.0108 -0.0196 181 PHE D O 11326 C CB . PHE D 122 ? 0.3611 0.5028 0.6616 -0.0327 -0.0042 -0.0115 181 PHE D CB 11327 C CG . PHE D 122 ? 0.3201 0.4656 0.6205 -0.0325 -0.0020 -0.0088 181 PHE D CG 11328 C CD1 . PHE D 122 ? 0.3369 0.4837 0.6344 -0.0306 -0.0041 -0.0122 181 PHE D CD1 11329 C CD2 . PHE D 122 ? 0.3181 0.4659 0.6210 -0.0341 0.0021 -0.0027 181 PHE D CD2 11330 C CE1 . PHE D 122 ? 0.4484 0.5988 0.7455 -0.0304 -0.0022 -0.0096 181 PHE D CE1 11331 C CE2 . PHE D 122 ? 0.3920 0.5433 0.6946 -0.0338 0.0041 0.0000 181 PHE D CE2 11332 C CZ . PHE D 122 ? 0.3181 0.4708 0.6179 -0.0320 0.0019 -0.0034 181 PHE D CZ 11333 N N . THR D 123 ? 0.5950 0.7266 0.8758 -0.0280 -0.0115 -0.0230 182 THR D N 11334 C CA . THR D 123 ? 0.5049 0.6320 0.7787 -0.0276 -0.0123 -0.0244 182 THR D CA 11335 C C . THR D 123 ? 0.5480 0.6738 0.8104 -0.0278 -0.0086 -0.0204 182 THR D C 11336 O O . THR D 123 ? 0.5499 0.6757 0.8024 -0.0262 -0.0077 -0.0206 182 THR D O 11337 C CB . THR D 123 ? 0.4614 0.5851 0.7289 -0.0246 -0.0163 -0.0306 182 THR D CB 11338 O OG1 . THR D 123 ? 0.5596 0.6842 0.8381 -0.0243 -0.0200 -0.0344 182 THR D OG1 11339 C CG2 . THR D 123 ? 0.3826 0.5014 0.6419 -0.0240 -0.0168 -0.0315 182 THR D CG2 11340 N N . PHE D 124 ? 0.4959 0.6208 0.7599 -0.0297 -0.0064 -0.0169 183 PHE D N 11341 C CA . PHE D 124 ? 0.4037 0.5277 0.6581 -0.0301 -0.0027 -0.0129 183 PHE D CA 11342 C C . PHE D 124 ? 0.5638 0.6831 0.8060 -0.0286 -0.0036 -0.0153 183 PHE D C 11343 O O . PHE D 124 ? 0.5812 0.6978 0.8230 -0.0273 -0.0071 -0.0199 183 PHE D O 11344 C CB . PHE D 124 ? 0.3213 0.4464 0.5824 -0.0327 0.0003 -0.0080 183 PHE D CB 11345 C CG . PHE D 124 ? 0.5421 0.6717 0.8147 -0.0342 0.0018 -0.0050 183 PHE D CG 11346 C CD1 . PHE D 124 ? 0.3785 0.5109 0.6486 -0.0341 0.0047 -0.0015 183 PHE D CD1 11347 C CD2 . PHE D 124 ? 0.4096 0.5404 0.6955 -0.0357 0.0004 -0.0056 183 PHE D CD2 11348 C CE1 . PHE D 124 ? 0.4251 0.5616 0.7058 -0.0354 0.0062 0.0014 183 PHE D CE1 11349 C CE2 . PHE D 124 ? 0.3188 0.4537 0.6156 -0.0371 0.0020 -0.0027 183 PHE D CE2 11350 C CZ . PHE D 124 ? 0.3176 0.4553 0.6117 -0.0369 0.0049 0.0008 183 PHE D CZ 11351 N N . LYS D 125 ? 0.5951 0.7134 0.8274 -0.0286 -0.0006 -0.0123 184 LYS D N 11352 C CA . LYS D 125 ? 0.5575 0.6715 0.7779 -0.0272 -0.0009 -0.0141 184 LYS D CA 11353 C C . LYS D 125 ? 0.5166 0.6275 0.7398 -0.0279 -0.0026 -0.0155 184 LYS D C 11354 O O . LYS D 125 ? 0.4600 0.5671 0.6769 -0.0262 -0.0048 -0.0192 184 LYS D O 11355 C CB . LYS D 125 ? 0.6618 0.7758 0.8730 -0.0276 0.0030 -0.0099 184 LYS D CB 11356 C CG . LYS D 125 ? 0.7077 0.8228 0.9105 -0.0260 0.0040 -0.0097 184 LYS D CG 11357 C CD . LYS D 125 ? 0.7361 0.8485 0.9308 -0.0234 0.0012 -0.0150 184 LYS D CD 11358 C CE . LYS D 125 ? 0.7556 0.8686 0.9400 -0.0218 0.0027 -0.0146 184 LYS D CE 11359 N NZ . LYS D 125 ? 0.7009 0.8185 0.8908 -0.0223 0.0037 -0.0123 184 LYS D NZ 11360 N N . ASN D 126 ? 0.3240 0.4362 0.5564 -0.0302 -0.0014 -0.0125 185 ASN D N 11361 C CA . ASN D 126 ? 0.4473 0.5569 0.6835 -0.0310 -0.0029 -0.0136 185 ASN D CA 11362 C C . ASN D 126 ? 0.4713 0.5805 0.7156 -0.0303 -0.0072 -0.0181 185 ASN D C 11363 O O . ASN D 126 ? 0.6188 0.7262 0.8682 -0.0312 -0.0088 -0.0190 185 ASN D O 11364 C CB . ASN D 126 ? 0.3652 0.4764 0.6084 -0.0337 0.0000 -0.0089 185 ASN D CB 11365 C CG . ASN D 126 ? 0.5922 0.7078 0.8477 -0.0351 0.0007 -0.0069 185 ASN D CG 11366 O OD1 . ASN D 126 ? 0.4815 0.5990 0.7413 -0.0342 -0.0013 -0.0093 185 ASN D OD1 11367 N ND2 . ASN D 126 ? 0.4593 0.5764 0.7206 -0.0372 0.0037 -0.0025 185 ASN D ND2 11368 N N . ASP D 127 ? 0.4531 0.5638 0.6985 -0.0288 -0.0091 -0.0209 186 ASP D N 11369 C CA . ASP D 127 ? 0.4970 0.6076 0.7498 -0.0277 -0.0134 -0.0255 186 ASP D CA 11370 C C . ASP D 127 ? 0.5732 0.6865 0.8410 -0.0300 -0.0139 -0.0243 186 ASP D C 11371 O O . ASP D 127 ? 0.5445 0.6577 0.8196 -0.0293 -0.0175 -0.0280 186 ASP D O 11372 C CB . ASP D 127 ? 0.4427 0.5485 0.6899 -0.0259 -0.0165 -0.0296 186 ASP D CB 11373 C CG . ASP D 127 ? 0.7818 0.8849 1.0159 -0.0231 -0.0170 -0.0324 186 ASP D CG 11374 O OD1 . ASP D 127 ? 0.5352 0.6403 0.7672 -0.0218 -0.0170 -0.0334 186 ASP D OD1 11375 O OD2 . ASP D 127 ? 0.9649 1.0638 1.1905 -0.0220 -0.0175 -0.0336 186 ASP D OD2 11376 N N . LYS D 128 ? 0.4331 0.5487 0.7055 -0.0324 -0.0104 -0.0193 187 LYS D N 11377 C CA . LYS D 128 ? 0.5346 0.6533 0.8213 -0.0345 -0.0103 -0.0177 187 LYS D CA 11378 C C . LYS D 128 ? 0.6114 0.7343 0.9036 -0.0343 -0.0102 -0.0177 187 LYS D C 11379 O O . LYS D 128 ? 0.5222 0.6457 0.8064 -0.0328 -0.0094 -0.0180 187 LYS D O 11380 C CB . LYS D 128 ? 0.5105 0.6299 0.7999 -0.0370 -0.0064 -0.0124 187 LYS D CB 11381 C CG . LYS D 128 ? 0.4183 0.5340 0.7049 -0.0375 -0.0070 -0.0127 187 LYS D CG 11382 C CD . LYS D 128 ? 0.5001 0.6144 0.7950 -0.0374 -0.0112 -0.0166 187 LYS D CD 11383 C CE . LYS D 128 ? 0.6074 0.7181 0.8999 -0.0380 -0.0118 -0.0167 187 LYS D CE 11384 N NZ . LYS D 128 ? 0.7368 0.8476 1.0266 -0.0398 -0.0075 -0.0116 187 LYS D NZ 11385 N N . GLN D 129 ? 0.5454 0.6710 0.8511 -0.0357 -0.0109 -0.0174 188 GLN D N 11386 C CA . GLN D 129 ? 0.3547 0.4842 0.6667 -0.0353 -0.0115 -0.0183 188 GLN D CA 11387 C C . GLN D 129 ? 0.5275 0.6611 0.8514 -0.0377 -0.0087 -0.0140 188 GLN D C 11388 O O . GLN D 129 ? 0.4438 0.5773 0.7735 -0.0397 -0.0070 -0.0111 188 GLN D O 11389 C CB . GLN D 129 ? 0.3781 0.5068 0.6953 -0.0338 -0.0164 -0.0241 188 GLN D CB 11390 C CG . GLN D 129 ? 0.3281 0.4531 0.6336 -0.0309 -0.0192 -0.0287 188 GLN D CG 11391 C CD . GLN D 129 ? 0.3302 0.4545 0.6408 -0.0291 -0.0241 -0.0346 188 GLN D CD 11392 O OE1 . GLN D 129 ? 0.4417 0.5657 0.7622 -0.0299 -0.0265 -0.0361 188 GLN D OE1 11393 N NE2 . GLN D 129 ? 0.3314 0.4556 0.6355 -0.0264 -0.0257 -0.0380 188 GLN D NE2 11394 N N . ALA D 130 ? 0.5874 0.7246 0.9146 -0.0373 -0.0082 -0.0136 189 ALA D N 11395 C CA . ALA D 130 ? 0.4641 0.6054 0.8025 -0.0393 -0.0056 -0.0097 189 ALA D CA 11396 C C . ALA D 130 ? 0.5443 0.6892 0.8897 -0.0386 -0.0074 -0.0119 189 ALA D C 11397 O O . ALA D 130 ? 0.4768 0.6212 0.8158 -0.0364 -0.0098 -0.0157 189 ALA D O 11398 C CB . ALA D 130 ? 0.3187 0.4611 0.6511 -0.0399 -0.0008 -0.0039 189 ALA D CB 11399 N N . VAL D 131 ? 0.3216 0.4700 0.6801 -0.0404 -0.0061 -0.0095 190 VAL D N 11400 C CA . VAL D 131 ? 0.3201 0.4723 0.6863 -0.0400 -0.0073 -0.0109 190 VAL D CA 11401 C C . VAL D 131 ? 0.3398 0.4952 0.7034 -0.0401 -0.0034 -0.0062 190 VAL D C 11402 O O . VAL D 131 ? 0.3170 0.4735 0.6834 -0.0417 0.0005 -0.0009 190 VAL D O 11403 C CB . VAL D 131 ? 0.3201 0.4744 0.7033 -0.0419 -0.0084 -0.0114 190 VAL D CB 11404 C CG1 . VAL D 131 ? 0.3200 0.4787 0.7115 -0.0417 -0.0091 -0.0122 190 VAL D CG1 11405 C CG2 . VAL D 131 ? 0.3218 0.4731 0.7079 -0.0415 -0.0129 -0.0165 190 VAL D CG2 11406 N N . PHE D 132 ? 0.3189 0.4758 0.6770 -0.0383 -0.0044 -0.0082 191 PHE D N 11407 C CA . PHE D 132 ? 0.3779 0.5378 0.7329 -0.0381 -0.0011 -0.0040 191 PHE D CA 11408 C C . PHE D 132 ? 0.4288 0.5932 0.7942 -0.0382 -0.0017 -0.0045 191 PHE D C 11409 O O . PHE D 132 ? 0.3188 0.4836 0.6858 -0.0369 -0.0054 -0.0095 191 PHE D O 11410 C CB . PHE D 132 ? 0.3180 0.4761 0.6566 -0.0359 -0.0010 -0.0049 191 PHE D CB 11411 C CG . PHE D 132 ? 0.3168 0.4780 0.6514 -0.0354 0.0019 -0.0011 191 PHE D CG 11412 C CD1 . PHE D 132 ? 0.3151 0.4770 0.6480 -0.0364 0.0063 0.0051 191 PHE D CD1 11413 C CD2 . PHE D 132 ? 0.3616 0.5248 0.6938 -0.0337 0.0002 -0.0037 191 PHE D CD2 11414 C CE1 . PHE D 132 ? 0.3141 0.4786 0.6431 -0.0358 0.0089 0.0088 191 PHE D CE1 11415 C CE2 . PHE D 132 ? 0.3164 0.4824 0.6446 -0.0332 0.0029 -0.0001 191 PHE D CE2 11416 C CZ . PHE D 132 ? 0.3147 0.4814 0.6413 -0.0342 0.0072 0.0062 191 PHE D CZ 11417 N N . LYS D 133 ? 0.3159 0.4834 0.6883 -0.0397 0.0019 0.0008 192 LYS D N 11418 C CA . LYS D 133 ? 0.3368 0.5088 0.7184 -0.0398 0.0019 0.0012 192 LYS D CA 11419 C C . LYS D 133 ? 0.3142 0.4883 0.6892 -0.0393 0.0058 0.0063 192 LYS D C 11420 O O . LYS D 133 ? 0.4676 0.6418 0.8426 -0.0403 0.0097 0.0118 192 LYS D O 11421 C CB . LYS D 133 ? 0.3151 0.4892 0.7137 -0.0421 0.0026 0.0027 192 LYS D CB 11422 C CG . LYS D 133 ? 0.3936 0.5662 0.8005 -0.0426 -0.0016 -0.0026 192 LYS D CG 11423 C CD . LYS D 133 ? 0.3160 0.4905 0.7393 -0.0450 -0.0005 -0.0006 192 LYS D CD 11424 C CE . LYS D 133 ? 0.3175 0.4909 0.7497 -0.0453 -0.0050 -0.0061 192 LYS D CE 11425 N NZ . LYS D 133 ? 0.3171 0.4927 0.7661 -0.0477 -0.0041 -0.0044 192 LYS D NZ 11426 N N . PRO D 134 ? 0.3145 0.4904 0.6839 -0.0375 0.0046 0.0045 193 PRO D N 11427 C CA . PRO D 134 ? 0.3305 0.5081 0.6918 -0.0366 0.0078 0.0089 193 PRO D CA 11428 C C . PRO D 134 ? 0.3120 0.4939 0.6845 -0.0379 0.0108 0.0139 193 PRO D C 11429 O O . PRO D 134 ? 0.3122 0.4964 0.6984 -0.0390 0.0097 0.0127 193 PRO D O 11430 C CB . PRO D 134 ? 0.3146 0.4927 0.6678 -0.0343 0.0049 0.0045 193 PRO D CB 11431 C CG . PRO D 134 ? 0.3385 0.5173 0.7019 -0.0344 0.0008 -0.0012 193 PRO D CG 11432 C CD . PRO D 134 ? 0.3162 0.4923 0.6859 -0.0360 0.0000 -0.0021 193 PRO D CD 11433 N N . MSE D 135 ? 0.6634 0.8460 1.0297 -0.0376 0.0147 0.0196 194 MSE D N 11434 C CA . MSE D 135 ? 0.3959 0.5824 0.7711 -0.0383 0.0179 0.0247 194 MSE D CA 11435 C C . MSE D 135 ? 0.3098 0.4998 0.6863 -0.0372 0.0164 0.0230 194 MSE D C 11436 O O . MSE D 135 ? 0.3636 0.5531 0.7290 -0.0353 0.0145 0.0202 194 MSE D O 11437 C CB . MSE D 135 ? 0.3156 0.5014 0.6828 -0.0379 0.0223 0.0312 194 MSE D CB 11438 C CG . MSE D 135 ? 0.3663 0.5559 0.7399 -0.0380 0.0257 0.0367 194 MSE D CG 11439 SE SE . MSE D 135 ? 0.7872 0.9757 1.1505 -0.0371 0.0312 0.0448 194 MSE D SE 11440 C CE . MSE D 135 ? 0.3044 0.4982 0.6761 -0.0367 0.0340 0.0501 194 MSE D CE 11441 N N . ARG D 136 ? 0.3093 0.5030 0.6996 -0.0382 0.0172 0.0247 195 ARG D N 11442 C CA . ARG D 136 ? 0.3094 0.5070 0.7022 -0.0373 0.0160 0.0234 195 ARG D CA 11443 C C . ARG D 136 ? 0.3080 0.5087 0.7029 -0.0372 0.0201 0.0301 195 ARG D C 11444 O O . ARG D 136 ? 0.4132 0.6141 0.7964 -0.0356 0.0215 0.0324 195 ARG D O 11445 C CB . ARG D 136 ? 0.3103 0.5098 0.7176 -0.0383 0.0129 0.0188 195 ARG D CB 11446 C CG . ARG D 136 ? 0.3108 0.5138 0.7198 -0.0371 0.0108 0.0161 195 ARG D CG 11447 C CD . ARG D 136 ? 0.3118 0.5163 0.7342 -0.0379 0.0071 0.0106 195 ARG D CD 11448 N NE . ARG D 136 ? 0.3134 0.5169 0.7287 -0.0360 0.0026 0.0038 195 ARG D NE 11449 C CZ . ARG D 136 ? 0.3148 0.5148 0.7278 -0.0356 -0.0008 -0.0015 195 ARG D CZ 11450 N NH1 . ARG D 136 ? 0.3147 0.5121 0.7319 -0.0372 -0.0003 -0.0008 195 ARG D NH1 11451 N NH2 . ARG D 136 ? 0.3695 0.5687 0.7759 -0.0335 -0.0047 -0.0076 195 ARG D NH2 11452 N N . PHE D 137 ? 0.3074 0.5104 0.7169 -0.0389 0.0222 0.0332 196 PHE D N 11453 C CA . PHE D 137 ? 0.3061 0.5120 0.7186 -0.0387 0.0262 0.0397 196 PHE D CA 11454 C C . PHE D 137 ? 0.3493 0.5531 0.7595 -0.0392 0.0306 0.0458 196 PHE D C 11455 O O . PHE D 137 ? 0.3053 0.5057 0.7132 -0.0399 0.0305 0.0449 196 PHE D O 11456 C CB . PHE D 137 ? 0.3060 0.5158 0.7359 -0.0400 0.0264 0.0401 196 PHE D CB 11457 C CG . PHE D 137 ? 0.3867 0.5988 0.8206 -0.0397 0.0221 0.0339 196 PHE D CG 11458 C CD1 . PHE D 137 ? 0.3073 0.5208 0.7315 -0.0377 0.0207 0.0324 196 PHE D CD1 11459 C CD2 . PHE D 137 ? 0.3078 0.5204 0.7550 -0.0412 0.0195 0.0297 196 PHE D CD2 11460 C CE1 . PHE D 137 ? 0.3550 0.5705 0.7827 -0.0372 0.0167 0.0266 196 PHE D CE1 11461 C CE2 . PHE D 137 ? 0.3088 0.5234 0.7598 -0.0407 0.0154 0.0238 196 PHE D CE2 11462 C CZ . PHE D 137 ? 0.3091 0.5251 0.7502 -0.0386 0.0141 0.0222 196 PHE D CZ 11463 N N . GLY D 138 ? 0.3041 0.5099 0.7148 -0.0386 0.0344 0.0520 197 GLY D N 11464 C CA . GLY D 138 ? 0.3031 0.5073 0.7124 -0.0386 0.0387 0.0581 197 GLY D CA 11465 C C . GLY D 138 ? 0.3031 0.5071 0.7269 -0.0407 0.0406 0.0597 197 GLY D C 11466 O O . GLY D 138 ? 0.3931 0.5987 0.8294 -0.0422 0.0386 0.0564 197 GLY D O 11467 N N . ARG D 139 ? 0.3024 0.5044 0.7247 -0.0407 0.0444 0.0647 198 ARG D N 11468 C CA . ARG D 139 ? 0.3232 0.5244 0.7579 -0.0425 0.0466 0.0666 198 ARG D CA 11469 C C . ARG D 139 ? 0.3194 0.5244 0.7691 -0.0432 0.0488 0.0697 198 ARG D C 11470 O O . ARG D 139 ? 0.3231 0.5283 0.7860 -0.0450 0.0495 0.0697 198 ARG D O 11471 C CB . ARG D 139 ? 0.3018 0.5000 0.7299 -0.0420 0.0504 0.0714 198 ARG D CB 11472 C CG . ARG D 139 ? 0.3020 0.4964 0.7154 -0.0413 0.0486 0.0688 198 ARG D CG 11473 C CD . ARG D 139 ? 0.3030 0.4953 0.7196 -0.0430 0.0450 0.0628 198 ARG D CD 11474 N NE . ARG D 139 ? 0.3317 0.5199 0.7368 -0.0427 0.0448 0.0619 198 ARG D NE 11475 C CZ . ARG D 139 ? 0.4007 0.5870 0.7939 -0.0419 0.0416 0.0577 198 ARG D CZ 11476 N NH1 . ARG D 139 ? 0.3040 0.4923 0.6948 -0.0411 0.0385 0.0541 198 ARG D NH1 11477 N NH2 . ARG D 139 ? 0.3036 0.4863 0.6873 -0.0417 0.0417 0.0572 198 ARG D NH2 11478 N N . ASP D 140 ? 0.3017 0.5096 0.7493 -0.0418 0.0498 0.0725 199 ASP D N 11479 C CA . ASP D 140 ? 0.3713 0.5828 0.8322 -0.0421 0.0524 0.0762 199 ASP D CA 11480 C C . ASP D 140 ? 0.3589 0.5737 0.8311 -0.0433 0.0489 0.0713 199 ASP D C 11481 O O . ASP D 140 ? 0.3736 0.5912 0.8597 -0.0442 0.0506 0.0733 199 ASP D O 11482 C CB . ASP D 140 ? 0.3045 0.5177 0.7584 -0.0399 0.0551 0.0817 199 ASP D CB 11483 C CG . ASP D 140 ? 0.6637 0.8742 1.1096 -0.0386 0.0592 0.0874 199 ASP D CG 11484 O OD1 . ASP D 140 ? 0.6594 0.8699 1.0935 -0.0364 0.0602 0.0904 199 ASP D OD1 11485 O OD2 . ASP D 140 ? 0.8190 1.0272 1.2701 -0.0396 0.0613 0.0889 199 ASP D OD2 11486 N N . TYR D 141 ? 0.3357 0.5500 0.8019 -0.0433 0.0442 0.0650 200 TYR D N 11487 C CA . TYR D 141 ? 0.3033 0.5204 0.7789 -0.0441 0.0405 0.0597 200 TYR D CA 11488 C C . TYR D 141 ? 0.3038 0.5211 0.7959 -0.0465 0.0402 0.0581 200 TYR D C 11489 O O . TYR D 141 ? 0.4568 0.6708 0.9490 -0.0476 0.0401 0.0569 200 TYR D O 11490 C CB . TYR D 141 ? 0.3545 0.5703 0.8196 -0.0433 0.0356 0.0530 200 TYR D CB 11491 C CG . TYR D 141 ? 0.4324 0.6510 0.9058 -0.0437 0.0315 0.0472 200 TYR D CG 11492 C CD1 . TYR D 141 ? 0.4089 0.6309 0.8807 -0.0424 0.0308 0.0470 200 TYR D CD1 11493 C CD2 . TYR D 141 ? 0.3443 0.5621 0.8270 -0.0453 0.0283 0.0420 200 TYR D CD2 11494 C CE1 . TYR D 141 ? 0.3406 0.5653 0.8199 -0.0427 0.0270 0.0416 200 TYR D CE1 11495 C CE2 . TYR D 141 ? 0.4118 0.6321 0.9022 -0.0455 0.0245 0.0366 200 TYR D CE2 11496 C CZ . TYR D 141 ? 0.4645 0.6883 0.9532 -0.0442 0.0239 0.0364 200 TYR D CZ 11497 O OH . TYR D 141 ? 0.6558 0.8822 1.1522 -0.0442 0.0200 0.0308 200 TYR D OH 11498 N N . GLU D 142 ? 0.3039 0.5249 0.8100 -0.0473 0.0402 0.0580 201 GLU D N 11499 C CA . GLU D 142 ? 0.3705 0.5920 0.8931 -0.0496 0.0397 0.0561 201 GLU D CA 11500 C C . GLU D 142 ? 0.3751 0.5989 0.9046 -0.0502 0.0347 0.0493 201 GLU D C 11501 O O . GLU D 142 ? 0.3053 0.5317 0.8312 -0.0489 0.0330 0.0478 201 GLU D O 11502 C CB . GLU D 142 ? 0.3039 0.5277 0.8394 -0.0504 0.0444 0.0622 201 GLU D CB 11503 C CG . GLU D 142 ? 0.4227 0.6444 0.9513 -0.0494 0.0496 0.0693 201 GLU D CG 11504 C CD . GLU D 142 ? 0.3494 0.5705 0.8910 -0.0510 0.0535 0.0732 201 GLU D CD 11505 O OE1 . GLU D 142 ? 0.4526 0.6746 1.0080 -0.0530 0.0520 0.0702 201 GLU D OE1 11506 O OE2 . GLU D 142 ? 0.3694 0.5889 0.9071 -0.0501 0.0580 0.0791 201 GLU D OE2 11507 N N . SER D 143 ? 0.3872 0.6100 0.9265 -0.0519 0.0323 0.0452 202 SER D N 11508 C CA . SER D 143 ? 0.3071 0.5316 0.8533 -0.0523 0.0273 0.0383 202 SER D CA 11509 C C . SER D 143 ? 0.3069 0.5364 0.8656 -0.0526 0.0278 0.0391 202 SER D C 11510 O O . SER D 143 ? 0.4554 0.6866 1.0241 -0.0536 0.0319 0.0443 202 SER D O 11511 C CB . SER D 143 ? 0.3081 0.5304 0.8634 -0.0542 0.0250 0.0344 202 SER D CB 11512 O OG . SER D 143 ? 0.5136 0.7314 1.0572 -0.0539 0.0242 0.0332 202 SER D OG 11513 N N . ASP D 144 ? 0.3498 0.5814 0.9075 -0.0517 0.0237 0.0338 203 ASP D N 11514 C CA . ASP D 144 ? 0.3075 0.5438 0.8773 -0.0520 0.0234 0.0335 203 ASP D CA 11515 C C . ASP D 144 ? 0.3079 0.5454 0.8972 -0.0544 0.0235 0.0328 203 ASP D C 11516 O O . ASP D 144 ? 0.3088 0.5444 0.9024 -0.0554 0.0203 0.0278 203 ASP D O 11517 C CB . ASP D 144 ? 0.3083 0.5461 0.8732 -0.0505 0.0183 0.0268 203 ASP D CB 11518 C CG . ASP D 144 ? 0.3080 0.5510 0.8816 -0.0502 0.0184 0.0271 203 ASP D CG 11519 O OD1 . ASP D 144 ? 0.3141 0.5596 0.9038 -0.0519 0.0203 0.0294 203 ASP D OD1 11520 O OD2 . ASP D 144 ? 0.4015 0.6458 0.9656 -0.0483 0.0165 0.0250 203 ASP D OD2 11521 N N . PRO D 145 ? 0.3073 0.5478 0.9083 -0.0553 0.0274 0.0378 204 PRO D N 11522 C CA . PRO D 145 ? 0.3077 0.5496 0.9280 -0.0576 0.0280 0.0376 204 PRO D CA 11523 C C . PRO D 145 ? 0.3087 0.5528 0.9387 -0.0582 0.0227 0.0302 204 PRO D C 11524 O O . PRO D 145 ? 0.3453 0.5894 0.9893 -0.0601 0.0216 0.0280 204 PRO D O 11525 C CB . PRO D 145 ? 0.3068 0.5521 0.9351 -0.0577 0.0330 0.0443 204 PRO D CB 11526 C CG . PRO D 145 ? 0.3059 0.5498 0.9181 -0.0558 0.0362 0.0496 204 PRO D CG 11527 C CD . PRO D 145 ? 0.3062 0.5486 0.9024 -0.0541 0.0319 0.0446 204 PRO D CD 11528 N N . ASN D 146 ? 0.3089 0.5547 0.9313 -0.0564 0.0193 0.0262 205 ASN D N 11529 C CA . ASN D 146 ? 0.3146 0.5623 0.9446 -0.0564 0.0140 0.0188 205 ASN D CA 11530 C C . ASN D 146 ? 0.3111 0.5550 0.9338 -0.0559 0.0091 0.0122 205 ASN D C 11531 O O . ASN D 146 ? 0.3122 0.5569 0.9417 -0.0559 0.0044 0.0057 205 ASN D O 11532 C CB . ASN D 146 ? 0.3097 0.5611 0.9351 -0.0545 0.0126 0.0174 205 ASN D CB 11533 C CG . ASN D 146 ? 0.3088 0.5644 0.9438 -0.0550 0.0168 0.0231 205 ASN D CG 11534 O OD1 . ASN D 146 ? 0.3088 0.5661 0.9603 -0.0570 0.0186 0.0249 205 ASN D OD1 11535 N ND2 . ASN D 146 ? 0.3081 0.5654 0.9326 -0.0532 0.0183 0.0260 205 ASN D ND2 11536 N N . HIS D 147 ? 0.3109 0.5506 0.9199 -0.0553 0.0102 0.0140 206 HIS D N 11537 C CA . HIS D 147 ? 0.3119 0.5477 0.9127 -0.0546 0.0060 0.0083 206 HIS D CA 11538 C C . HIS D 147 ? 0.3126 0.5461 0.9243 -0.0568 0.0051 0.0069 206 HIS D C 11539 O O . HIS D 147 ? 0.3120 0.5445 0.9284 -0.0584 0.0092 0.0120 206 HIS D O 11540 C CB . HIS D 147 ? 0.3115 0.5437 0.8928 -0.0531 0.0074 0.0106 206 HIS D CB 11541 C CG . HIS D 147 ? 0.3774 0.6104 0.9447 -0.0506 0.0057 0.0087 206 HIS D CG 11542 N ND1 . HIS D 147 ? 0.3110 0.5416 0.8608 -0.0490 0.0073 0.0112 206 HIS D ND1 11543 C CD2 . HIS D 147 ? 0.3121 0.5480 0.8803 -0.0493 0.0025 0.0043 206 HIS D CD2 11544 C CE1 . HIS D 147 ? 0.3113 0.5432 0.8516 -0.0469 0.0052 0.0086 206 HIS D CE1 11545 N NE2 . HIS D 147 ? 0.3120 0.5471 0.8630 -0.0470 0.0023 0.0043 206 HIS D NE2 11546 N N . PHE D 148 ? 0.3680 0.6006 0.9835 -0.0566 -0.0002 -0.0002 207 PHE D N 11547 C CA . PHE D 148 ? 0.3147 0.5446 0.9380 -0.0582 -0.0017 -0.0024 207 PHE D CA 11548 C C . PHE D 148 ? 0.3148 0.5396 0.9234 -0.0577 -0.0014 -0.0016 207 PHE D C 11549 O O . PHE D 148 ? 0.3144 0.5379 0.9070 -0.0558 -0.0010 -0.0009 207 PHE D O 11550 C CB . PHE D 148 ? 0.3162 0.5466 0.9475 -0.0579 -0.0078 -0.0103 207 PHE D CB 11551 C CG . PHE D 148 ? 0.3163 0.5513 0.9657 -0.0591 -0.0081 -0.0112 207 PHE D CG 11552 C CD1 . PHE D 148 ? 0.3163 0.5551 0.9663 -0.0576 -0.0098 -0.0136 207 PHE D CD1 11553 C CD2 . PHE D 148 ? 0.3164 0.5520 0.9823 -0.0616 -0.0068 -0.0097 207 PHE D CD2 11554 C CE1 . PHE D 148 ? 0.3164 0.5595 0.9832 -0.0588 -0.0101 -0.0145 207 PHE D CE1 11555 C CE2 . PHE D 148 ? 0.3165 0.5564 0.9995 -0.0628 -0.0070 -0.0105 207 PHE D CE2 11556 C CZ . PHE D 148 ? 0.3165 0.5602 1.0001 -0.0614 -0.0087 -0.0129 207 PHE D CZ 11557 N N . TYR D 149 ? 0.3152 0.5373 0.9294 -0.0593 -0.0015 -0.0017 208 TYR D N 11558 C CA . TYR D 149 ? 0.3154 0.5326 0.9171 -0.0589 -0.0014 -0.0013 208 TYR D CA 11559 C C . TYR D 149 ? 0.4040 0.6186 0.9923 -0.0566 -0.0063 -0.0074 208 TYR D C 11560 O O . TYR D 149 ? 0.4997 0.7109 1.0733 -0.0555 -0.0057 -0.0064 208 TYR D O 11561 C CB . TYR D 149 ? 0.3159 0.5308 0.9277 -0.0611 -0.0014 -0.0013 208 TYR D CB 11562 C CG . TYR D 149 ? 0.3170 0.5337 0.9451 -0.0621 -0.0053 -0.0063 208 TYR D CG 11563 C CD1 . TYR D 149 ? 0.3185 0.5330 0.9452 -0.0612 -0.0111 -0.0132 208 TYR D CD1 11564 C CD2 . TYR D 149 ? 0.3167 0.5371 0.9615 -0.0640 -0.0031 -0.0041 208 TYR D CD2 11565 C CE1 . TYR D 149 ? 0.3196 0.5356 0.9613 -0.0620 -0.0147 -0.0179 208 TYR D CE1 11566 C CE2 . TYR D 149 ? 0.3177 0.5398 0.9778 -0.0649 -0.0067 -0.0087 208 TYR D CE2 11567 C CZ . TYR D 149 ? 0.4058 0.6256 1.0642 -0.0639 -0.0126 -0.0156 208 TYR D CZ 11568 O OH . TYR D 149 ? 0.5167 0.7381 1.1903 -0.0647 -0.0163 -0.0203 208 TYR D OH 11569 N N . PHE D 150 ? 0.3773 0.5935 0.9708 -0.0556 -0.0111 -0.0136 209 PHE D N 11570 C CA . PHE D 150 ? 0.3663 0.5800 0.9479 -0.0531 -0.0159 -0.0198 209 PHE D CA 11571 C C . PHE D 150 ? 0.3185 0.5339 0.8884 -0.0508 -0.0158 -0.0200 209 PHE D C 11572 O O . PHE D 150 ? 0.4994 0.7132 1.0592 -0.0484 -0.0195 -0.0251 209 PHE D O 11573 C CB . PHE D 150 ? 0.3204 0.5344 0.9128 -0.0528 -0.0215 -0.0269 209 PHE D CB 11574 C CG . PHE D 150 ? 0.3203 0.5393 0.9280 -0.0535 -0.0220 -0.0279 209 PHE D CG 11575 C CD1 . PHE D 150 ? 0.3202 0.5409 0.9456 -0.0561 -0.0210 -0.0266 209 PHE D CD1 11576 C CD2 . PHE D 150 ? 0.3204 0.5424 0.9247 -0.0516 -0.0234 -0.0303 209 PHE D CD2 11577 C CE1 . PHE D 150 ? 0.3202 0.5455 0.9600 -0.0568 -0.0215 -0.0276 209 PHE D CE1 11578 C CE2 . PHE D 150 ? 0.3204 0.5470 0.9388 -0.0522 -0.0239 -0.0313 209 PHE D CE2 11579 C CZ . PHE D 150 ? 0.3202 0.5485 0.9566 -0.0548 -0.0230 -0.0300 209 PHE D CZ 11580 N N . SER D 151 ? 0.5214 0.7401 1.0925 -0.0513 -0.0114 -0.0145 210 SER D N 11581 C CA . SER D 151 ? 0.3633 0.5837 0.9230 -0.0492 -0.0108 -0.0139 210 SER D CA 11582 C C . SER D 151 ? 0.4045 0.6232 0.9507 -0.0490 -0.0063 -0.0077 210 SER D C 11583 O O . SER D 151 ? 0.3946 0.6138 0.9284 -0.0471 -0.0056 -0.0068 210 SER D O 11584 C CB . SER D 151 ? 0.3914 0.6172 0.9623 -0.0497 -0.0098 -0.0127 210 SER D CB 11585 O OG . SER D 151 ? 0.6131 0.8406 1.1954 -0.0495 -0.0144 -0.0190 210 SER D OG 11586 N N . ASP D 152 ? 0.4531 0.6697 1.0016 -0.0508 -0.0032 -0.0034 211 ASP D N 11587 C CA . ASP D 152 ? 0.4697 0.6846 1.0071 -0.0507 0.0014 0.0029 211 ASP D CA 11588 C C . ASP D 152 ? 0.4431 0.6540 0.9621 -0.0488 0.0000 0.0009 211 ASP D C 11589 O O . ASP D 152 ? 0.5220 0.7295 1.0385 -0.0486 -0.0032 -0.0034 211 ASP D O 11590 C CB . ASP D 152 ? 0.5622 0.7758 1.1080 -0.0531 0.0049 0.0075 211 ASP D CB 11591 C CG . ASP D 152 ? 0.6697 0.8833 1.2095 -0.0532 0.0106 0.0151 211 ASP D CG 11592 O OD1 . ASP D 152 ? 0.5763 0.7921 1.1098 -0.0518 0.0122 0.0174 211 ASP D OD1 11593 O OD2 . ASP D 152 ? 0.7058 0.9172 1.2471 -0.0545 0.0135 0.0187 211 ASP D OD2 11594 N N . PHE D 153 ? 0.4318 0.6429 0.9380 -0.0474 0.0024 0.0042 212 PHE D N 11595 C CA . PHE D 153 ? 0.3134 0.5206 0.8018 -0.0458 0.0019 0.0036 212 PHE D CA 11596 C C . PHE D 153 ? 0.3128 0.5167 0.7988 -0.0471 0.0047 0.0074 212 PHE D C 11597 O O . PHE D 153 ? 0.3641 0.5691 0.8571 -0.0486 0.0089 0.0130 212 PHE D O 11598 C CB . PHE D 153 ? 0.3126 0.5213 0.7887 -0.0440 0.0040 0.0065 212 PHE D CB 11599 C CG . PHE D 153 ? 0.3137 0.5225 0.7806 -0.0416 0.0002 0.0010 212 PHE D CG 11600 C CD1 . PHE D 153 ? 0.4432 0.6492 0.9071 -0.0407 -0.0044 -0.0057 212 PHE D CD1 11601 C CD2 . PHE D 153 ? 0.4014 0.6130 0.8624 -0.0402 0.0012 0.0025 212 PHE D CD2 11602 C CE1 . PHE D 153 ? 0.3165 0.5224 0.7716 -0.0382 -0.0078 -0.0109 212 PHE D CE1 11603 C CE2 . PHE D 153 ? 0.3143 0.5260 0.7665 -0.0379 -0.0022 -0.0027 212 PHE D CE2 11604 C CZ . PHE D 153 ? 0.4202 0.6290 0.8694 -0.0369 -0.0067 -0.0094 212 PHE D CZ 11605 N N . GLU D 154 ? 0.3136 0.5133 0.7898 -0.0464 0.0026 0.0043 213 GLU D N 11606 C CA . GLU D 154 ? 0.3132 0.5094 0.7857 -0.0474 0.0050 0.0075 213 GLU D CA 11607 C C . GLU D 154 ? 0.3118 0.5078 0.7744 -0.0470 0.0098 0.0139 213 GLU D C 11608 O O . GLU D 154 ? 0.3224 0.5194 0.7751 -0.0453 0.0102 0.0146 213 GLU D O 11609 C CB . GLU D 154 ? 0.3144 0.5061 0.7776 -0.0465 0.0015 0.0027 213 GLU D CB 11610 C CG . GLU D 154 ? 0.4069 0.5976 0.8808 -0.0474 -0.0023 -0.0022 213 GLU D CG 11611 C CD . GLU D 154 ? 0.4679 0.6537 0.9324 -0.0467 -0.0049 -0.0056 213 GLU D CD 11612 O OE1 . GLU D 154 ? 0.5252 0.7089 0.9950 -0.0483 -0.0047 -0.0050 213 GLU D OE1 11613 O OE2 . GLU D 154 ? 0.5082 0.6923 0.9600 -0.0445 -0.0071 -0.0088 213 GLU D OE2 11614 N N . ARG D 155 ? 0.3110 0.5056 0.7764 -0.0485 0.0133 0.0186 214 ARG D N 11615 C CA . ARG D 155 ? 0.3098 0.5036 0.7654 -0.0480 0.0177 0.0245 214 ARG D CA 11616 C C . ARG D 155 ? 0.3099 0.4991 0.7565 -0.0481 0.0180 0.0245 214 ARG D C 11617 O O . ARG D 155 ? 0.3495 0.5371 0.8033 -0.0497 0.0185 0.0249 214 ARG D O 11618 C CB . ARG D 155 ? 0.3087 0.5050 0.7750 -0.0492 0.0224 0.0308 214 ARG D CB 11619 C CG . ARG D 155 ? 0.3083 0.5093 0.7820 -0.0489 0.0228 0.0318 214 ARG D CG 11620 C CD . ARG D 155 ? 0.3076 0.5109 0.7952 -0.0505 0.0268 0.0370 214 ARG D CD 11621 N NE . ARG D 155 ? 0.3084 0.5120 0.8111 -0.0524 0.0250 0.0341 214 ARG D NE 11622 C CZ . ARG D 155 ? 0.3090 0.5155 0.8223 -0.0529 0.0220 0.0302 214 ARG D CZ 11623 N NH1 . ARG D 155 ? 0.3090 0.5182 0.8192 -0.0514 0.0205 0.0286 214 ARG D NH1 11624 N NH2 . ARG D 155 ? 0.3651 0.5716 0.8919 -0.0547 0.0205 0.0277 214 ARG D NH2 11625 N N . HIS D 156 ? 0.3100 0.4970 0.7408 -0.0464 0.0176 0.0240 215 HIS D N 11626 C CA . HIS D 156 ? 0.3102 0.4928 0.7311 -0.0462 0.0176 0.0235 215 HIS D CA 11627 C C . HIS D 156 ? 0.4351 0.6167 0.8580 -0.0475 0.0221 0.0294 215 HIS D C 11628 O O . HIS D 156 ? 0.3621 0.5405 0.7839 -0.0483 0.0220 0.0288 215 HIS D O 11629 C CB . HIS D 156 ? 0.3103 0.4913 0.7140 -0.0441 0.0169 0.0226 215 HIS D CB 11630 C CG . HIS D 156 ? 0.4260 0.6075 0.8219 -0.0434 0.0213 0.0286 215 HIS D CG 11631 N ND1 . HIS D 156 ? 0.3085 0.4868 0.6936 -0.0430 0.0233 0.0311 215 HIS D ND1 11632 C CD2 . HIS D 156 ? 0.3080 0.4928 0.7056 -0.0429 0.0240 0.0328 215 HIS D CD2 11633 C CE1 . HIS D 156 ? 0.3132 0.4928 0.6935 -0.0423 0.0270 0.0364 215 HIS D CE1 11634 N NE2 . HIS D 156 ? 0.4366 0.6201 0.8243 -0.0421 0.0275 0.0376 215 HIS D NE2 11635 N N . HIS D 157 ? 0.3080 0.4921 0.7335 -0.0474 0.0261 0.0349 216 HIS D N 11636 C CA . HIS D 157 ? 0.3071 0.4902 0.7337 -0.0481 0.0307 0.0407 216 HIS D CA 11637 C C . HIS D 157 ? 0.3446 0.5280 0.7866 -0.0503 0.0315 0.0413 216 HIS D C 11638 O O . HIS D 157 ? 0.4629 0.6449 0.9067 -0.0511 0.0348 0.0451 216 HIS D O 11639 C CB . HIS D 157 ? 0.3059 0.4914 0.7302 -0.0470 0.0346 0.0465 216 HIS D CB 11640 C CG . HIS D 157 ? 0.3135 0.5033 0.7497 -0.0474 0.0350 0.0474 216 HIS D CG 11641 N ND1 . HIS D 157 ? 0.3060 0.4984 0.7401 -0.0463 0.0326 0.0448 216 HIS D ND1 11642 C CD2 . HIS D 157 ? 0.3055 0.4975 0.7558 -0.0487 0.0376 0.0506 216 HIS D CD2 11643 C CE1 . HIS D 157 ? 0.3058 0.5018 0.7523 -0.0469 0.0335 0.0464 216 HIS D CE1 11644 N NE2 . HIS D 157 ? 0.3055 0.5014 0.7621 -0.0484 0.0366 0.0499 216 HIS D NE2 11645 N N . ALA D 158 ? 0.4081 0.5936 0.8613 -0.0512 0.0284 0.0374 217 ALA D N 11646 C CA . ALA D 158 ? 0.3473 0.5331 0.8154 -0.0533 0.0286 0.0372 217 ALA D CA 11647 C C . ALA D 158 ? 0.3093 0.4911 0.7749 -0.0540 0.0262 0.0337 217 ALA D C 11648 O O . ALA D 158 ? 0.3570 0.5375 0.8296 -0.0556 0.0279 0.0354 217 ALA D O 11649 C CB . ALA D 158 ? 0.3321 0.5213 0.8129 -0.0539 0.0260 0.0341 217 ALA D CB 11650 N N . GLU D 159 ? 0.3443 0.5242 0.7996 -0.0528 0.0223 0.0290 218 GLU D N 11651 C CA . GLU D 159 ? 0.4327 0.6086 0.8833 -0.0532 0.0200 0.0258 218 GLU D CA 11652 C C . GLU D 159 ? 0.3114 0.4845 0.7546 -0.0534 0.0237 0.0301 218 GLU D C 11653 O O . GLU D 159 ? 0.3105 0.4812 0.7570 -0.0546 0.0240 0.0301 218 GLU D O 11654 C CB . GLU D 159 ? 0.3117 0.4859 0.7509 -0.0514 0.0157 0.0205 218 GLU D CB 11655 C CG . GLU D 159 ? 0.4332 0.6093 0.8793 -0.0510 0.0111 0.0149 218 GLU D CG 11656 C CD . GLU D 159 ? 0.5172 0.6916 0.9721 -0.0522 0.0077 0.0107 218 GLU D CD 11657 O OE1 . GLU D 159 ? 0.3735 0.5470 0.8354 -0.0539 0.0095 0.0130 218 GLU D OE1 11658 O OE2 . GLU D 159 ? 0.4236 0.5976 0.8781 -0.0512 0.0031 0.0050 218 GLU D OE2 11659 N N . ILE D 160 ? 0.3226 0.4959 0.7556 -0.0520 0.0266 0.0338 219 ILE D N 11660 C CA . ILE D 160 ? 0.3084 0.4793 0.7337 -0.0519 0.0304 0.0382 219 ILE D CA 11661 C C . ILE D 160 ? 0.4030 0.5747 0.8391 -0.0533 0.0345 0.0430 219 ILE D C 11662 O O . ILE D 160 ? 0.4243 0.5934 0.8607 -0.0542 0.0358 0.0440 219 ILE D O 11663 C CB . ILE D 160 ? 0.4244 0.5958 0.8372 -0.0500 0.0325 0.0412 219 ILE D CB 11664 C CG1 . ILE D 160 ? 0.3081 0.4781 0.7088 -0.0485 0.0287 0.0365 219 ILE D CG1 11665 C CG2 . ILE D 160 ? 0.3067 0.4758 0.7127 -0.0497 0.0366 0.0459 219 ILE D CG2 11666 C CD1 . ILE D 160 ? 0.3101 0.4816 0.7010 -0.0466 0.0299 0.0385 219 ILE D CD1 11667 N N . ALA D 161 ? 0.3074 0.4826 0.7522 -0.0534 0.0366 0.0459 220 ALA D N 11668 C CA . ALA D 161 ? 0.3070 0.4832 0.7623 -0.0545 0.0410 0.0508 220 ALA D CA 11669 C C . ALA D 161 ? 0.3078 0.4829 0.7746 -0.0566 0.0401 0.0490 220 ALA D C 11670 O O . ALA D 161 ? 0.4750 0.6487 0.9451 -0.0573 0.0435 0.0525 220 ALA D O 11671 C CB . ALA D 161 ? 0.3065 0.4869 0.7702 -0.0542 0.0426 0.0534 220 ALA D CB 11672 N N . THR D 162 ? 0.3474 0.5231 0.8201 -0.0574 0.0355 0.0436 221 THR D N 11673 C CA . THR D 162 ? 0.3769 0.5519 0.8616 -0.0594 0.0343 0.0417 221 THR D CA 11674 C C . THR D 162 ? 0.3532 0.5239 0.8311 -0.0598 0.0335 0.0404 221 THR D C 11675 O O . THR D 162 ? 0.4873 0.6567 0.9724 -0.0613 0.0350 0.0416 221 THR D O 11676 C CB . THR D 162 ? 0.3105 0.4873 0.8035 -0.0599 0.0293 0.0360 221 THR D CB 11677 O OG1 . THR D 162 ? 0.3241 0.5049 0.8227 -0.0594 0.0299 0.0370 221 THR D OG1 11678 C CG2 . THR D 162 ? 0.3114 0.4877 0.8181 -0.0620 0.0284 0.0345 221 THR D CG2 11679 N N . PHE D 163 ? 0.3180 0.4864 0.7820 -0.0584 0.0313 0.0379 222 PHE D N 11680 C CA . PHE D 163 ? 0.3949 0.5592 0.8507 -0.0586 0.0308 0.0370 222 PHE D CA 11681 C C . PHE D 163 ? 0.4066 0.5696 0.8610 -0.0589 0.0360 0.0426 222 PHE D C 11682 O O . PHE D 163 ? 0.4976 0.6582 0.9542 -0.0600 0.0366 0.0428 222 PHE D O 11683 C CB . PHE D 163 ? 0.3105 0.4728 0.7508 -0.0568 0.0283 0.0343 222 PHE D CB 11684 C CG . PHE D 163 ? 0.4402 0.5986 0.8702 -0.0567 0.0291 0.0348 222 PHE D CG 11685 C CD1 . PHE D 163 ? 0.4305 0.5861 0.8622 -0.0577 0.0266 0.0318 222 PHE D CD1 11686 C CD2 . PHE D 163 ? 0.3700 0.5274 0.7884 -0.0555 0.0323 0.0384 222 PHE D CD2 11687 C CE1 . PHE D 163 ? 0.4787 0.6307 0.9010 -0.0576 0.0273 0.0323 222 PHE D CE1 11688 C CE2 . PHE D 163 ? 0.3723 0.5260 0.7814 -0.0553 0.0330 0.0388 222 PHE D CE2 11689 C CZ . PHE D 163 ? 0.3105 0.4616 0.7215 -0.0564 0.0306 0.0357 222 PHE D CZ 11690 N N . HIS D 164 ? 0.3317 0.4962 0.7821 -0.0577 0.0397 0.0471 223 HIS D N 11691 C CA . HIS D 164 ? 0.5129 0.6764 0.9619 -0.0576 0.0449 0.0527 223 HIS D CA 11692 C C . HIS D 164 ? 0.5215 0.6860 0.9852 -0.0592 0.0476 0.0551 223 HIS D C 11693 O O . HIS D 164 ? 0.4413 0.6035 0.9055 -0.0598 0.0502 0.0573 223 HIS D O 11694 C CB . HIS D 164 ? 0.3510 0.5162 0.7933 -0.0558 0.0480 0.0568 223 HIS D CB 11695 C CG . HIS D 164 ? 0.4181 0.5815 0.8442 -0.0541 0.0469 0.0558 223 HIS D CG 11696 N ND1 . HIS D 164 ? 0.3059 0.4672 0.7221 -0.0530 0.0502 0.0595 223 HIS D ND1 11697 C CD2 . HIS D 164 ? 0.4781 0.6413 0.8963 -0.0533 0.0429 0.0516 223 HIS D CD2 11698 C CE1 . HIS D 164 ? 0.4560 0.6160 0.8591 -0.0517 0.0482 0.0575 223 HIS D CE1 11699 N NE2 . HIS D 164 ? 0.4758 0.6369 0.8797 -0.0518 0.0439 0.0528 223 HIS D NE2 11700 N N . LEU D 165 ? 0.3141 0.4820 0.7898 -0.0599 0.0470 0.0547 224 LEU D N 11701 C CA . LEU D 165 ? 0.4632 0.6321 0.9538 -0.0615 0.0494 0.0568 224 LEU D CA 11702 C C . LEU D 165 ? 0.5172 0.6836 1.0127 -0.0633 0.0471 0.0535 224 LEU D C 11703 O O . LEU D 165 ? 0.4289 0.5944 0.9317 -0.0644 0.0500 0.0560 224 LEU D O 11704 C CB . LEU D 165 ? 0.3089 0.4820 0.8115 -0.0620 0.0485 0.0561 224 LEU D CB 11705 C CG . LEU D 165 ? 0.4827 0.6570 1.0015 -0.0637 0.0509 0.0582 224 LEU D CG 11706 C CD1 . LEU D 165 ? 0.3090 0.4828 0.8282 -0.0631 0.0572 0.0647 224 LEU D CD1 11707 C CD2 . LEU D 165 ? 0.3096 0.4879 0.8407 -0.0643 0.0492 0.0566 224 LEU D CD2 11708 N N . ASP D 166 ? 0.3105 0.4759 0.8020 -0.0634 0.0419 0.0480 225 ASP D N 11709 C CA . ASP D 166 ? 0.3116 0.4744 0.8065 -0.0649 0.0391 0.0446 225 ASP D CA 11710 C C . ASP D 166 ? 0.4859 0.6451 0.9727 -0.0648 0.0417 0.0468 225 ASP D C 11711 O O . ASP D 166 ? 0.4808 0.6381 0.9728 -0.0663 0.0418 0.0464 225 ASP D O 11712 C CB . ASP D 166 ? 0.3122 0.4744 0.8026 -0.0645 0.0331 0.0384 225 ASP D CB 11713 C CG . ASP D 166 ? 0.4473 0.6067 0.9404 -0.0657 0.0299 0.0347 225 ASP D CG 11714 O OD1 . ASP D 166 ? 0.3135 0.4696 0.7959 -0.0652 0.0292 0.0339 225 ASP D OD1 11715 O OD2 . ASP D 166 ? 0.4419 0.6025 0.9479 -0.0671 0.0280 0.0326 225 ASP D OD2 11716 N N . ARG D 167 ? 0.3855 0.5437 0.8593 -0.0632 0.0438 0.0492 226 ARG D N 11717 C CA . ARG D 167 ? 0.3104 0.4654 0.7759 -0.0629 0.0467 0.0518 226 ARG D CA 11718 C C . ARG D 167 ? 0.4140 0.5693 0.8862 -0.0632 0.0523 0.0573 226 ARG D C 11719 O O . ARG D 167 ? 0.3700 0.5231 0.8443 -0.0641 0.0541 0.0584 226 ARG D O 11720 C CB . ARG D 167 ? 0.4197 0.5736 0.8694 -0.0609 0.0471 0.0526 226 ARG D CB 11721 C CG . ARG D 167 ? 0.3693 0.5201 0.8103 -0.0604 0.0504 0.0556 226 ARG D CG 11722 C CD . ARG D 167 ? 0.3798 0.5293 0.8052 -0.0585 0.0502 0.0557 226 ARG D CD 11723 N NE . ARG D 167 ? 0.4592 0.6068 0.8771 -0.0585 0.0454 0.0505 226 ARG D NE 11724 C CZ . ARG D 167 ? 0.6106 0.7569 1.0151 -0.0571 0.0443 0.0495 226 ARG D CZ 11725 N NH1 . ARG D 167 ? 0.4859 0.6327 0.8831 -0.0555 0.0476 0.0533 226 ARG D NH1 11726 N NH2 . ARG D 167 ? 0.6207 0.7651 1.0191 -0.0570 0.0400 0.0448 226 ARG D NH2 11727 N N . VAL D 168 ? 0.3095 0.4677 0.7849 -0.0623 0.0552 0.0609 227 VAL D N 11728 C CA . VAL D 168 ? 0.3093 0.4680 0.7906 -0.0621 0.0609 0.0665 227 VAL D CA 11729 C C . VAL D 168 ? 0.3728 0.5317 0.8688 -0.0641 0.0618 0.0665 227 VAL D C 11730 O O . VAL D 168 ? 0.5675 0.7248 1.0661 -0.0643 0.0659 0.0699 227 VAL D O 11731 C CB . VAL D 168 ? 0.4370 0.5991 0.9205 -0.0608 0.0632 0.0698 227 VAL D CB 11732 C CG1 . VAL D 168 ? 0.4648 0.6275 0.9562 -0.0605 0.0689 0.0755 227 VAL D CG1 11733 C CG2 . VAL D 168 ? 0.3175 0.4792 0.7860 -0.0586 0.0631 0.0706 227 VAL D CG2 11734 N N . LEU D 169 ? 0.3453 0.5059 0.8505 -0.0656 0.0578 0.0624 228 LEU D N 11735 C CA . LEU D 169 ? 0.4153 0.5761 0.9349 -0.0676 0.0580 0.0619 228 LEU D CA 11736 C C . LEU D 169 ? 0.4498 0.6071 0.9670 -0.0688 0.0560 0.0591 228 LEU D C 11737 O O . LEU D 169 ? 0.5196 0.6764 1.0473 -0.0705 0.0562 0.0587 228 LEU D O 11738 C CB . LEU D 169 ? 0.3471 0.5112 0.8779 -0.0686 0.0544 0.0586 228 LEU D CB 11739 C CG . LEU D 169 ? 0.4191 0.5870 0.9556 -0.0678 0.0566 0.0614 228 LEU D CG 11740 C CD1 . LEU D 169 ? 0.4073 0.5782 0.9533 -0.0687 0.0522 0.0572 228 LEU D CD1 11741 C CD2 . LEU D 169 ? 0.3116 0.4802 0.8574 -0.0681 0.0625 0.0669 228 LEU D CD2 11742 N N . GLY D 170 ? 0.3969 0.5517 0.9002 -0.0679 0.0539 0.0573 229 GLY D N 11743 C CA . GLY D 170 ? 0.3132 0.4644 0.8123 -0.0687 0.0523 0.0551 229 GLY D CA 11744 C C . GLY D 170 ? 0.4326 0.5833 0.9353 -0.0699 0.0464 0.0493 229 GLY D C 11745 O O . GLY D 170 ? 0.5482 0.6962 1.0507 -0.0709 0.0450 0.0475 229 GLY D O 11746 N N . PHE D 171 ? 0.3820 0.5353 0.8879 -0.0697 0.0429 0.0463 230 PHE D N 11747 C CA . PHE D 171 ? 0.4718 0.6246 0.9807 -0.0704 0.0370 0.0406 230 PHE D CA 11748 C C . PHE D 171 ? 0.4050 0.5550 0.8996 -0.0693 0.0335 0.0373 230 PHE D C 11749 O O . PHE D 171 ? 0.4374 0.5847 0.9307 -0.0699 0.0306 0.0343 230 PHE D O 11750 C CB . PHE D 171 ? 0.6081 0.7646 1.1252 -0.0703 0.0344 0.0383 230 PHE D CB 11751 C CG . PHE D 171 ? 0.5523 0.7117 1.0854 -0.0717 0.0368 0.0405 230 PHE D CG 11752 C CD1 . PHE D 171 ? 0.4244 0.5832 0.9692 -0.0736 0.0356 0.0389 230 PHE D CD1 11753 C CD2 . PHE D 171 ? 0.5030 0.6654 1.0395 -0.0711 0.0403 0.0442 230 PHE D CD2 11754 C CE1 . PHE D 171 ? 0.5293 0.6907 1.0891 -0.0749 0.0380 0.0409 230 PHE D CE1 11755 C CE2 . PHE D 171 ? 0.4728 0.6378 1.0242 -0.0723 0.0427 0.0463 230 PHE D CE2 11756 C CZ . PHE D 171 ? 0.4751 0.6396 1.0383 -0.0742 0.0416 0.0446 230 PHE D CZ 11757 N N . ARG D 172 ? 0.4839 0.6343 0.9675 -0.0675 0.0340 0.0381 231 ARG D N 11758 C CA . ARG D 172 ? 0.4220 0.5700 0.8915 -0.0662 0.0309 0.0351 231 ARG D CA 11759 C C . ARG D 172 ? 0.4110 0.5583 0.8827 -0.0664 0.0248 0.0291 231 ARG D C 11760 O O . ARG D 172 ? 0.4996 0.6438 0.9640 -0.0661 0.0220 0.0263 231 ARG D O 11761 C CB . ARG D 172 ? 0.4734 0.6176 0.9340 -0.0662 0.0329 0.0368 231 ARG D CB 11762 C CG . ARG D 172 ? 0.5674 0.7117 1.0210 -0.0652 0.0383 0.0420 231 ARG D CG 11763 C CD . ARG D 172 ? 0.4406 0.5814 0.8873 -0.0654 0.0405 0.0437 231 ARG D CD 11764 N NE . ARG D 172 ? 0.5800 0.7212 1.0327 -0.0659 0.0458 0.0486 231 ARG D NE 11765 C CZ . ARG D 172 ? 0.5388 0.6809 0.9874 -0.0646 0.0503 0.0531 231 ARG D CZ 11766 N NH1 . ARG D 172 ? 0.5294 0.6720 0.9678 -0.0629 0.0500 0.0533 231 ARG D NH1 11767 N NH2 . ARG D 172 ? 0.5089 0.6511 0.9634 -0.0649 0.0551 0.0573 231 ARG D NH2 11768 N N . ARG D 173 ? 0.4042 0.5545 0.8862 -0.0667 0.0227 0.0271 232 ARG D N 11769 C CA . ARG D 173 ? 0.5694 0.7194 1.0543 -0.0665 0.0168 0.0213 232 ARG D CA 11770 C C . ARG D 173 ? 0.5150 0.6674 0.9968 -0.0649 0.0145 0.0189 232 ARG D C 11771 O O . ARG D 173 ? 0.3175 0.4704 0.8034 -0.0646 0.0099 0.0142 232 ARG D O 11772 C CB . ARG D 173 ? 0.4378 0.5891 0.9390 -0.0684 0.0156 0.0201 232 ARG D CB 11773 C CG . ARG D 173 ? 0.4771 0.6261 0.9819 -0.0700 0.0179 0.0223 232 ARG D CG 11774 C CD . ARG D 173 ? 0.3871 0.5361 0.9052 -0.0716 0.0147 0.0193 232 ARG D CD 11775 N NE . ARG D 173 ? 0.5247 0.6775 1.0576 -0.0727 0.0162 0.0206 232 ARG D NE 11776 C CZ . ARG D 173 ? 0.4988 0.6527 1.0395 -0.0740 0.0212 0.0252 232 ARG D CZ 11777 N NH1 . ARG D 173 ? 0.4616 0.6132 0.9967 -0.0742 0.0251 0.0289 232 ARG D NH1 11778 N NH2 . ARG D 173 ? 0.5300 0.6874 1.0843 -0.0749 0.0222 0.0260 232 ARG D NH2 11779 N N . ALA D 174 ? 0.3154 0.4690 0.7895 -0.0638 0.0177 0.0221 233 ALA D N 11780 C CA . ALA D 174 ? 0.4815 0.6371 0.9507 -0.0621 0.0159 0.0202 233 ALA D CA 11781 C C . ALA D 174 ? 0.4115 0.5642 0.8645 -0.0603 0.0140 0.0181 233 ALA D C 11782 O O . ALA D 174 ? 0.4746 0.6241 0.9196 -0.0603 0.0150 0.0191 233 ALA D O 11783 C CB . ALA D 174 ? 0.3139 0.4727 0.7848 -0.0618 0.0203 0.0250 233 ALA D CB 11784 N N . ILE D 175 ? 0.4034 0.5573 0.8515 -0.0587 0.0115 0.0153 234 ILE D N 11785 C CA . ILE D 175 ? 0.3157 0.4669 0.7487 -0.0568 0.0095 0.0129 234 ILE D CA 11786 C C . ILE D 175 ? 0.3962 0.5482 0.8187 -0.0557 0.0131 0.0167 234 ILE D C 11787 O O . ILE D 175 ? 0.4590 0.6143 0.8844 -0.0553 0.0148 0.0186 234 ILE D O 11788 C CB . ILE D 175 ? 0.3465 0.4981 0.7792 -0.0554 0.0042 0.0070 234 ILE D CB 11789 C CG1 . ILE D 175 ? 0.3669 0.5178 0.8106 -0.0564 0.0004 0.0032 234 ILE D CG1 11790 C CG2 . ILE D 175 ? 0.3174 0.4659 0.7346 -0.0534 0.0022 0.0044 234 ILE D CG2 11791 C CD1 . ILE D 175 ? 0.4146 0.5619 0.8567 -0.0573 0.0001 0.0032 234 ILE D CD1 11792 N N . PRO D 176 ? 0.5827 0.7316 0.9929 -0.0551 0.0144 0.0179 235 PRO D N 11793 C CA . PRO D 176 ? 0.4347 0.5837 0.8338 -0.0540 0.0178 0.0215 235 PRO D CA 11794 C C . PRO D 176 ? 0.3953 0.5465 0.7897 -0.0523 0.0169 0.0204 235 PRO D C 11795 O O . PRO D 176 ? 0.3416 0.4918 0.7308 -0.0511 0.0131 0.0159 235 PRO D O 11796 C CB . PRO D 176 ? 0.3134 0.4581 0.7001 -0.0533 0.0170 0.0202 235 PRO D CB 11797 C CG . PRO D 176 ? 0.4964 0.6392 0.8899 -0.0548 0.0155 0.0187 235 PRO D CG 11798 C CD . PRO D 176 ? 0.3150 0.4600 0.7219 -0.0556 0.0127 0.0159 235 PRO D CD 11799 N N . THR D 177 ? 0.3117 0.4658 0.7078 -0.0522 0.0205 0.0248 236 THR D N 11800 C CA . THR D 177 ? 0.3114 0.4680 0.7038 -0.0507 0.0201 0.0244 236 THR D CA 11801 C C . THR D 177 ? 0.3463 0.5037 0.7311 -0.0499 0.0245 0.0297 236 THR D C 11802 O O . THR D 177 ? 0.4272 0.5853 0.8169 -0.0507 0.0284 0.0344 236 THR D O 11803 C CB . THR D 177 ? 0.3776 0.5380 0.7835 -0.0514 0.0191 0.0236 236 THR D CB 11804 O OG1 . THR D 177 ? 0.3128 0.4725 0.7267 -0.0521 0.0150 0.0188 236 THR D OG1 11805 C CG2 . THR D 177 ? 0.3115 0.4743 0.7127 -0.0497 0.0180 0.0225 236 THR D CG2 11806 N N . VAL D 178 ? 0.3100 0.4670 0.6827 -0.0481 0.0239 0.0289 237 VAL D N 11807 C CA . VAL D 178 ? 0.3778 0.5353 0.7423 -0.0471 0.0277 0.0336 237 VAL D CA 11808 C C . VAL D 178 ? 0.3086 0.4688 0.6689 -0.0455 0.0270 0.0332 237 VAL D C 11809 O O . VAL D 178 ? 0.4367 0.5971 0.7959 -0.0449 0.0233 0.0285 237 VAL D O 11810 C CB . VAL D 178 ? 0.4599 0.6137 0.8108 -0.0464 0.0284 0.0339 237 VAL D CB 11811 C CG1 . VAL D 178 ? 0.3095 0.4618 0.6491 -0.0448 0.0251 0.0295 237 VAL D CG1 11812 C CG2 . VAL D 178 ? 0.3074 0.4614 0.6527 -0.0457 0.0330 0.0397 237 VAL D CG2 11813 N N . GLY D 179 ? 0.4230 0.5849 0.7810 -0.0449 0.0307 0.0382 238 GLY D N 11814 C CA . GLY D 179 ? 0.3072 0.4714 0.6596 -0.0433 0.0304 0.0384 238 GLY D CA 11815 C C . GLY D 179 ? 0.4000 0.5617 0.7362 -0.0416 0.0297 0.0372 238 GLY D C 11816 O O . GLY D 179 ? 0.3072 0.4659 0.6362 -0.0416 0.0310 0.0383 238 GLY D O 11817 N N . ARG D 180 ? 0.3078 0.4708 0.6382 -0.0402 0.0277 0.0348 239 ARG D N 11818 C CA . ARG D 180 ? 0.3081 0.4689 0.6231 -0.0385 0.0270 0.0334 239 ARG D CA 11819 C C . ARG D 180 ? 0.4568 0.6200 0.7666 -0.0369 0.0264 0.0330 239 ARG D C 11820 O O . ARG D 180 ? 0.3651 0.5302 0.6804 -0.0368 0.0238 0.0298 239 ARG D O 11821 C CB . ARG D 180 ? 0.3095 0.4669 0.6201 -0.0384 0.0233 0.0277 239 ARG D CB 11822 C CG . ARG D 180 ? 0.3100 0.4646 0.6047 -0.0368 0.0228 0.0262 239 ARG D CG 11823 C CD . ARG D 180 ? 0.3115 0.4627 0.6027 -0.0366 0.0192 0.0206 239 ARG D CD 11824 N NE . ARG D 180 ? 0.3985 0.5471 0.6747 -0.0349 0.0186 0.0189 239 ARG D NE 11825 C CZ . ARG D 180 ? 0.3273 0.4720 0.5969 -0.0346 0.0171 0.0161 239 ARG D CZ 11826 N NH1 . ARG D 180 ? 0.3475 0.4905 0.6239 -0.0359 0.0160 0.0147 239 ARG D NH1 11827 N NH2 . ARG D 180 ? 0.3135 0.4560 0.5697 -0.0330 0.0168 0.0147 239 ARG D NH2 11828 N N . VAL D 181 ? 0.3075 0.4704 0.6065 -0.0356 0.0287 0.0363 240 VAL D N 11829 C CA . VAL D 181 ? 0.3076 0.4723 0.5997 -0.0339 0.0282 0.0361 240 VAL D CA 11830 C C . VAL D 181 ? 0.3087 0.4707 0.5877 -0.0325 0.0256 0.0316 240 VAL D C 11831 O O . VAL D 181 ? 0.5803 0.7393 0.8492 -0.0321 0.0267 0.0325 240 VAL D O 11832 C CB . VAL D 181 ? 0.3062 0.4724 0.5938 -0.0331 0.0321 0.0423 240 VAL D CB 11833 C CG1 . VAL D 181 ? 0.3064 0.4746 0.5868 -0.0313 0.0314 0.0420 240 VAL D CG1 11834 C CG2 . VAL D 181 ? 0.3052 0.4739 0.6056 -0.0342 0.0349 0.0469 240 VAL D CG2 11835 N N . LEU D 182 ? 0.4383 0.6010 0.7174 -0.0317 0.0223 0.0268 241 LEU D N 11836 C CA . LEU D 182 ? 0.4401 0.6000 0.7076 -0.0303 0.0196 0.0219 241 LEU D CA 11837 C C . LEU D 182 ? 0.3116 0.4725 0.5684 -0.0283 0.0196 0.0218 241 LEU D C 11838 O O . LEU D 182 ? 0.6805 0.8450 0.9411 -0.0279 0.0201 0.0234 241 LEU D O 11839 C CB . LEU D 182 ? 0.3129 0.4722 0.5868 -0.0304 0.0156 0.0158 241 LEU D CB 11840 C CG . LEU D 182 ? 0.4217 0.5787 0.7028 -0.0320 0.0147 0.0145 241 LEU D CG 11841 C CD1 . LEU D 182 ? 0.3411 0.5010 0.6384 -0.0339 0.0153 0.0163 241 LEU D CD1 11842 C CD2 . LEU D 182 ? 0.5765 0.7308 0.8548 -0.0311 0.0106 0.0080 241 LEU D CD2 11843 N N . ASN D 183 ? 0.3421 0.4998 0.5853 -0.0269 0.0191 0.0200 242 ASN D N 11844 C CA . ASN D 183 ? 0.3131 0.4712 0.5453 -0.0249 0.0184 0.0185 242 ASN D CA 11845 C C . ASN D 183 ? 0.3149 0.4728 0.5485 -0.0240 0.0144 0.0120 242 ASN D C 11846 O O . ASN D 183 ? 0.4018 0.5564 0.6328 -0.0237 0.0121 0.0077 242 ASN D O 11847 C CB . ASN D 183 ? 0.3133 0.4680 0.5306 -0.0238 0.0195 0.0190 242 ASN D CB 11848 C CG . ASN D 183 ? 0.4429 0.5978 0.6483 -0.0217 0.0190 0.0178 242 ASN D CG 11849 O OD1 . ASN D 183 ? 0.5011 0.6552 0.7031 -0.0204 0.0162 0.0126 242 ASN D OD1 11850 N ND2 . ASN D 183 ? 0.4557 0.6115 0.6542 -0.0211 0.0218 0.0225 242 ASN D ND2 11851 N N . MSE D 184 ? 0.3151 0.4764 0.5527 -0.0234 0.0135 0.0114 243 MSE D N 11852 C CA . MSE D 184 ? 0.3452 0.5069 0.5863 -0.0225 0.0097 0.0053 243 MSE D CA 11853 C C . MSE D 184 ? 0.4549 0.6133 0.6826 -0.0202 0.0076 0.0004 243 MSE D C 11854 O O . MSE D 184 ? 0.4423 0.5993 0.6718 -0.0194 0.0043 -0.0053 243 MSE D O 11855 C CB . MSE D 184 ? 0.4779 0.6442 0.7251 -0.0222 0.0096 0.0061 243 MSE D CB 11856 C CG . MSE D 184 ? 0.4351 0.6048 0.6970 -0.0242 0.0114 0.0103 243 MSE D CG 11857 SE SE . MSE D 184 ? 0.6918 0.8672 0.9618 -0.0238 0.0109 0.0107 243 MSE D SE 11858 C CE . MSE D 184 ? 0.4080 0.5824 0.6790 -0.0223 0.0054 0.0013 243 MSE D CE 11859 N N . THR D 185 ? 0.3627 0.5198 0.5772 -0.0191 0.0094 0.0024 244 THR D N 11860 C CA . THR D 185 ? 0.5287 0.6826 0.7298 -0.0169 0.0078 -0.0019 244 THR D CA 11861 C C . THR D 185 ? 0.4160 0.5652 0.6129 -0.0170 0.0071 -0.0041 244 THR D C 11862 O O . THR D 185 ? 0.3876 0.5343 0.5820 -0.0157 0.0043 -0.0097 244 THR D O 11863 C CB . THR D 185 ? 0.4846 0.6387 0.6726 -0.0157 0.0101 0.0011 244 THR D CB 11864 O OG1 . THR D 185 ? 0.5527 0.7084 0.7430 -0.0171 0.0136 0.0078 244 THR D OG1 11865 C CG2 . THR D 185 ? 0.4325 0.5897 0.6190 -0.0141 0.0091 -0.0003 244 THR D CG2 11866 N N . THR D 186 ? 0.3198 0.4679 0.5162 -0.0185 0.0098 0.0002 245 THR D N 11867 C CA . THR D 186 ? 0.4446 0.5882 0.6356 -0.0186 0.0095 -0.0014 245 THR D CA 11868 C C . THR D 186 ? 0.4476 0.5902 0.6498 -0.0200 0.0078 -0.0033 245 THR D C 11869 O O . THR D 186 ? 0.5216 0.6606 0.7206 -0.0193 0.0058 -0.0073 245 THR D O 11870 C CB . THR D 186 ? 0.3637 0.5063 0.5483 -0.0193 0.0130 0.0038 245 THR D CB 11871 O OG1 . THR D 186 ? 0.4315 0.5769 0.6264 -0.0213 0.0153 0.0089 245 THR D OG1 11872 C CG2 . THR D 186 ? 0.3190 0.4619 0.4911 -0.0177 0.0145 0.0054 245 THR D CG2 11873 N N . GLU D 187 ? 0.4935 0.6392 0.7087 -0.0219 0.0086 -0.0005 246 GLU D N 11874 C CA . GLU D 187 ? 0.4508 0.5956 0.6768 -0.0235 0.0073 -0.0017 246 GLU D CA 11875 C C . GLU D 187 ? 0.3810 0.5272 0.6169 -0.0232 0.0038 -0.0062 246 GLU D C 11876 O O . GLU D 187 ? 0.5253 0.6700 0.7679 -0.0239 0.0017 -0.0089 246 GLU D O 11877 C CB . GLU D 187 ? 0.4245 0.5713 0.6593 -0.0258 0.0103 0.0041 246 GLU D CB 11878 C CG . GLU D 187 ? 0.3161 0.4611 0.5426 -0.0262 0.0136 0.0084 246 GLU D CG 11879 C CD . GLU D 187 ? 0.4232 0.5701 0.6587 -0.0282 0.0166 0.0138 246 GLU D CD 11880 O OE1 . GLU D 187 ? 0.3617 0.5120 0.6015 -0.0284 0.0185 0.0175 246 GLU D OE1 11881 O OE2 . GLU D 187 ? 0.3139 0.4587 0.5520 -0.0294 0.0171 0.0144 246 GLU D OE2 11882 N N . LEU D 188 ? 0.4363 0.5856 0.6731 -0.0222 0.0031 -0.0071 247 LEU D N 11883 C CA . LEU D 188 ? 0.3705 0.5215 0.6168 -0.0218 -0.0002 -0.0115 247 LEU D CA 11884 C C . LEU D 188 ? 0.3599 0.5093 0.5973 -0.0190 -0.0031 -0.0172 247 LEU D C 11885 O O . LEU D 188 ? 0.4383 0.5849 0.6760 -0.0180 -0.0062 -0.0222 247 LEU D O 11886 C CB . LEU D 188 ? 0.3205 0.4765 0.5772 -0.0229 0.0010 -0.0084 247 LEU D CB 11887 C CG . LEU D 188 ? 0.4185 0.5764 0.6875 -0.0256 0.0032 -0.0037 247 LEU D CG 11888 C CD1 . LEU D 188 ? 0.3178 0.4806 0.5981 -0.0264 0.0037 -0.0018 247 LEU D CD1 11889 C CD2 . LEU D 188 ? 0.3193 0.4748 0.5958 -0.0267 0.0013 -0.0062 247 LEU D CD2 11890 N N . PHE D 189 ? 0.3240 0.4750 0.5535 -0.0177 -0.0021 -0.0164 248 PHE D N 11891 C CA . PHE D 189 ? 0.5065 0.6564 0.7274 -0.0149 -0.0045 -0.0216 248 PHE D CA 11892 C C . PHE D 189 ? 0.5408 0.6854 0.7507 -0.0132 -0.0058 -0.0253 248 PHE D C 11893 O O . PHE D 189 ? 0.4360 0.5785 0.6461 -0.0115 -0.0092 -0.0310 248 PHE D O 11894 C CB . PHE D 189 ? 0.3791 0.5313 0.5914 -0.0139 -0.0026 -0.0191 248 PHE D CB 11895 C CG . PHE D 189 ? 0.4106 0.5618 0.6136 -0.0109 -0.0048 -0.0243 248 PHE D CG 11896 C CD1 . PHE D 189 ? 0.3731 0.5262 0.5828 -0.0099 -0.0077 -0.0286 248 PHE D CD1 11897 C CD2 . PHE D 189 ? 0.5010 0.6491 0.6883 -0.0091 -0.0039 -0.0249 248 PHE D CD2 11898 C CE1 . PHE D 189 ? 0.3432 0.4953 0.5441 -0.0070 -0.0097 -0.0335 248 PHE D CE1 11899 C CE2 . PHE D 189 ? 0.3852 0.5322 0.5637 -0.0063 -0.0058 -0.0297 248 PHE D CE2 11900 C CZ . PHE D 189 ? 0.3320 0.4810 0.5171 -0.0051 -0.0087 -0.0340 248 PHE D CZ 11901 N N . GLU D 190 ? 0.5015 0.6438 0.7019 -0.0135 -0.0032 -0.0221 249 GLU D N 11902 C CA . GLU D 190 ? 0.4718 0.6092 0.6608 -0.0119 -0.0039 -0.0251 249 GLU D CA 11903 C C . GLU D 190 ? 0.5088 0.6432 0.7039 -0.0126 -0.0058 -0.0274 249 GLU D C 11904 O O . GLU D 190 ? 0.5541 0.6843 0.7419 -0.0109 -0.0074 -0.0313 249 GLU D O 11905 C CB . GLU D 190 ? 0.5240 0.6600 0.7020 -0.0123 -0.0005 -0.0208 249 GLU D CB 11906 C CG . GLU D 190 ? 0.4739 0.6114 0.6417 -0.0107 0.0009 -0.0197 249 GLU D CG 11907 C CD . GLU D 190 ? 0.6090 0.7462 0.7688 -0.0115 0.0046 -0.0143 249 GLU D CD 11908 O OE1 . GLU D 190 ? 0.6903 0.8261 0.8522 -0.0132 0.0061 -0.0116 249 GLU D OE1 11909 O OE2 . GLU D 190 ? 0.6720 0.8103 0.8232 -0.0104 0.0059 -0.0129 249 GLU D OE2 11910 N N . LYS D 191 ? 0.5162 0.6527 0.7244 -0.0151 -0.0056 -0.0250 250 LYS D N 11911 C CA . LYS D 191 ? 0.4187 0.5528 0.6335 -0.0159 -0.0073 -0.0268 250 LYS D CA 11912 C C . LYS D 191 ? 0.4048 0.5399 0.6305 -0.0154 -0.0111 -0.0314 250 LYS D C 11913 O O . LYS D 191 ? 0.4681 0.6015 0.7005 -0.0160 -0.0130 -0.0333 250 LYS D O 11914 C CB . LYS D 191 ? 0.3885 0.5237 0.6106 -0.0189 -0.0046 -0.0214 250 LYS D CB 11915 C CG . LYS D 191 ? 0.3853 0.5194 0.5976 -0.0195 -0.0010 -0.0168 250 LYS D CG 11916 C CD . LYS D 191 ? 0.6408 0.7699 0.8411 -0.0180 -0.0015 -0.0193 250 LYS D CD 11917 C CE . LYS D 191 ? 0.5590 0.6872 0.7497 -0.0185 0.0021 -0.0148 250 LYS D CE 11918 N NZ . LYS D 191 ? 0.5852 0.7151 0.7836 -0.0212 0.0048 -0.0094 250 LYS D NZ 11919 N N . ALA D 192 ? 0.4401 0.5781 0.6673 -0.0142 -0.0122 -0.0332 251 ALA D N 11920 C CA . ALA D 192 ? 0.5549 0.6946 0.7935 -0.0139 -0.0156 -0.0372 251 ALA D CA 11921 C C . ALA D 192 ? 0.3341 0.4703 0.5679 -0.0108 -0.0195 -0.0441 251 ALA D C 11922 O O . ALA D 192 ? 0.3355 0.4691 0.5562 -0.0084 -0.0194 -0.0462 251 ALA D O 11923 C CB . ALA D 192 ? 0.4664 0.6111 0.7099 -0.0140 -0.0150 -0.0360 251 ALA D CB 11924 N N . GLU D 193 ? 0.4400 0.5761 0.6845 -0.0108 -0.0227 -0.0476 252 GLU D N 11925 C CA . GLU D 193 ? 0.3378 0.4710 0.5797 -0.0076 -0.0268 -0.0545 252 GLU D CA 11926 C C . GLU D 193 ? 0.6258 0.7610 0.8635 -0.0053 -0.0277 -0.0574 252 GLU D C 11927 O O . GLU D 193 ? 0.5825 0.7221 0.8233 -0.0065 -0.0259 -0.0543 252 GLU D O 11928 C CB . GLU D 193 ? 0.4266 0.5599 0.6823 -0.0083 -0.0301 -0.0572 252 GLU D CB 11929 C CG . GLU D 193 ? 0.4903 0.6287 0.7602 -0.0099 -0.0306 -0.0563 252 GLU D CG 11930 C CD . GLU D 193 ? 0.5861 0.7244 0.8692 -0.0102 -0.0343 -0.0598 252 GLU D CD 11931 O OE1 . GLU D 193 ? 0.6024 0.7441 0.8988 -0.0129 -0.0337 -0.0572 252 GLU D OE1 11932 O OE2 . GLU D 193 ? 0.5699 0.7044 0.8498 -0.0076 -0.0377 -0.0651 252 GLU D OE2 11933 N N . LYS D 194 ? 0.6675 0.7995 0.8980 -0.0018 -0.0306 -0.0633 253 LYS D N 11934 C CA . LYS D 194 ? 0.6080 0.7410 0.8317 0.0009 -0.0314 -0.0665 253 LYS D CA 11935 C C . LYS D 194 ? 0.6524 0.7906 0.8879 0.0003 -0.0326 -0.0671 253 LYS D C 11936 O O . LYS D 194 ? 0.6225 0.7638 0.8547 0.0004 -0.0310 -0.0656 253 LYS D O 11937 C CB . LYS D 194 ? 0.7659 0.8941 0.9818 0.0049 -0.0347 -0.0733 253 LYS D CB 11938 C CG . LYS D 194 ? 0.9660 1.0947 1.1743 0.0082 -0.0358 -0.0773 253 LYS D CG 11939 C CD . LYS D 194 ? 1.0533 1.1803 1.2453 0.0092 -0.0327 -0.0754 253 LYS D CD 11940 C CE . LYS D 194 ? 1.0850 1.2118 1.2681 0.0128 -0.0339 -0.0799 253 LYS D CE 11941 N NZ . LYS D 194 ? 1.0805 1.2034 1.2626 0.0165 -0.0379 -0.0871 253 LYS D NZ 11942 N N . LYS D 195 ? 0.6362 0.7752 0.8852 -0.0004 -0.0355 -0.0694 254 LYS D N 11943 C CA . LYS D 195 ? 0.5477 0.6914 0.8087 -0.0009 -0.0370 -0.0706 254 LYS D CA 11944 C C . LYS D 195 ? 0.5784 0.7272 0.8471 -0.0044 -0.0336 -0.0641 254 LYS D C 11945 O O . LYS D 195 ? 0.5908 0.7439 0.8650 -0.0046 -0.0336 -0.0640 254 LYS D O 11946 C CB . LYS D 195 ? 0.5226 0.6657 0.7964 -0.0007 -0.0410 -0.0747 254 LYS D CB 11947 C CG . LYS D 195 ? 0.6752 0.8178 0.9583 -0.0038 -0.0403 -0.0713 254 LYS D CG 11948 C CD . LYS D 195 ? 0.7026 0.8457 1.0000 -0.0038 -0.0443 -0.0752 254 LYS D CD 11949 C CE . LYS D 195 ? 0.8129 0.9548 1.1185 -0.0065 -0.0441 -0.0725 254 LYS D CE 11950 N NZ . LYS D 195 ? 0.9444 1.0805 1.2400 -0.0051 -0.0447 -0.0738 254 LYS D NZ 11951 N N . LEU D 196 ? 0.5134 0.6616 0.7822 -0.0071 -0.0305 -0.0587 255 LEU D N 11952 C CA . LEU D 196 ? 0.4272 0.5797 0.7019 -0.0101 -0.0269 -0.0521 255 LEU D CA 11953 C C . LEU D 196 ? 0.3910 0.5444 0.6529 -0.0093 -0.0239 -0.0492 255 LEU D C 11954 O O . LEU D 196 ? 0.3917 0.5493 0.6570 -0.0105 -0.0218 -0.0456 255 LEU D O 11955 C CB . LEU D 196 ? 0.4414 0.5927 0.7207 -0.0131 -0.0247 -0.0475 255 LEU D CB 11956 C CG . LEU D 196 ? 0.3300 0.4850 0.6135 -0.0160 -0.0204 -0.0402 255 LEU D CG 11957 C CD1 . LEU D 196 ? 0.3291 0.4892 0.6264 -0.0173 -0.0207 -0.0394 255 LEU D CD1 11958 C CD2 . LEU D 196 ? 0.3288 0.4819 0.6155 -0.0184 -0.0185 -0.0364 255 LEU D CD2 11959 N N . LYS D 197 ? 0.4825 0.6317 0.7298 -0.0073 -0.0237 -0.0508 256 LYS D N 11960 C CA . LYS D 197 ? 0.4540 0.6033 0.6877 -0.0064 -0.0209 -0.0483 256 LYS D CA 11961 C C . LYS D 197 ? 0.3582 0.5109 0.5906 -0.0047 -0.0217 -0.0502 256 LYS D C 11962 O O . LYS D 197 ? 0.4315 0.5867 0.6589 -0.0051 -0.0190 -0.0463 256 LYS D O 11963 C CB . LYS D 197 ? 0.5228 0.6668 0.7416 -0.0041 -0.0211 -0.0508 256 LYS D CB 11964 C CG . LYS D 197 ? 0.6328 0.7763 0.8384 -0.0041 -0.0176 -0.0468 256 LYS D CG 11965 C CD . LYS D 197 ? 0.5577 0.6956 0.7502 -0.0022 -0.0177 -0.0490 256 LYS D CD 11966 C CE . LYS D 197 ? 0.6565 0.7935 0.8395 -0.0035 -0.0137 -0.0435 256 LYS D CE 11967 N NZ . LYS D 197 ? 0.9156 1.0475 1.0845 -0.0014 -0.0135 -0.0457 256 LYS D NZ 11968 N N . LYS D 198 ? 0.4593 0.6118 0.6961 -0.0028 -0.0255 -0.0563 257 LYS D N 11969 C CA . LYS D 198 ? 0.3382 0.4935 0.5733 -0.0008 -0.0267 -0.0591 257 LYS D CA 11970 C C . LYS D 198 ? 0.4440 0.6051 0.6911 -0.0030 -0.0255 -0.0555 257 LYS D C 11971 O O . LYS D 198 ? 0.4764 0.6404 0.7213 -0.0019 -0.0256 -0.0562 257 LYS D O 11972 C CB . LYS D 198 ? 0.3410 0.4943 0.5780 0.0021 -0.0312 -0.0669 257 LYS D CB 11973 C CG . LYS D 198 ? 0.6151 0.7626 0.8387 0.0052 -0.0325 -0.0712 257 LYS D CG 11974 C CD . LYS D 198 ? 0.9031 1.0495 1.1101 0.0070 -0.0303 -0.0703 257 LYS D CD 11975 C CE . LYS D 198 ? 1.0209 1.1613 1.2150 0.0092 -0.0304 -0.0727 257 LYS D CE 11976 N NZ . LYS D 198 ? 1.0187 1.1579 1.1966 0.0106 -0.0279 -0.0714 257 LYS D NZ 11977 N N . THR D 199 ? 0.3549 0.5176 0.6144 -0.0061 -0.0244 -0.0516 258 THR D N 11978 C CA . THR D 199 ? 0.4098 0.5779 0.6819 -0.0083 -0.0232 -0.0482 258 THR D CA 11979 C C . THR D 199 ? 0.4199 0.5903 0.6883 -0.0101 -0.0187 -0.0408 258 THR D C 11980 O O . THR D 199 ? 0.3282 0.5028 0.6068 -0.0121 -0.0171 -0.0368 258 THR D O 11981 C CB . THR D 199 ? 0.3931 0.5621 0.6818 -0.0107 -0.0244 -0.0479 258 THR D CB 11982 O OG1 . THR D 199 ? 0.4230 0.5899 0.7112 -0.0129 -0.0219 -0.0434 258 THR D OG1 11983 C CG2 . THR D 199 ? 0.3340 0.5005 0.6264 -0.0088 -0.0290 -0.0551 258 THR D CG2 11984 N N . PHE D 200 ? 0.3547 0.5222 0.6086 -0.0093 -0.0167 -0.0389 259 PHE D N 11985 C CA . PHE D 200 ? 0.3280 0.4973 0.5769 -0.0106 -0.0126 -0.0321 259 PHE D CA 11986 C C . PHE D 200 ? 0.4082 0.5799 0.6487 -0.0088 -0.0120 -0.0321 259 PHE D C 11987 O O . PHE D 200 ? 0.4582 0.6284 0.6906 -0.0061 -0.0143 -0.0373 259 PHE D O 11988 C CB . PHE D 200 ? 0.3278 0.4929 0.5656 -0.0108 -0.0105 -0.0297 259 PHE D CB 11989 C CG . PHE D 200 ? 0.3265 0.4905 0.5728 -0.0134 -0.0093 -0.0267 259 PHE D CG 11990 C CD1 . PHE D 200 ? 0.3300 0.4914 0.5825 -0.0135 -0.0120 -0.0307 259 PHE D CD1 11991 C CD2 . PHE D 200 ? 0.3242 0.4897 0.5720 -0.0155 -0.0055 -0.0198 259 PHE D CD2 11992 C CE1 . PHE D 200 ? 0.3861 0.5465 0.6460 -0.0159 -0.0110 -0.0279 259 PHE D CE1 11993 C CE2 . PHE D 200 ? 0.4452 0.6096 0.7004 -0.0177 -0.0044 -0.0171 259 PHE D CE2 11994 C CZ . PHE D 200 ? 0.3242 0.4862 0.5855 -0.0180 -0.0071 -0.0212 259 PHE D CZ 11995 N N . PHE D 201 ? 0.3782 0.5533 0.6201 -0.0101 -0.0089 -0.0261 260 PHE D N 11996 C CA . PHE D 201 ? 0.3680 0.5457 0.6020 -0.0086 -0.0081 -0.0252 260 PHE D CA 11997 C C . PHE D 201 ? 0.3906 0.5710 0.6246 -0.0102 -0.0041 -0.0174 260 PHE D C 11998 O O . PHE D 201 ? 0.3581 0.5388 0.5996 -0.0125 -0.0020 -0.0129 260 PHE D O 11999 C CB . PHE D 201 ? 0.3271 0.5082 0.5694 -0.0077 -0.0108 -0.0292 260 PHE D CB 12000 C CG . PHE D 201 ? 0.3788 0.5642 0.6383 -0.0102 -0.0102 -0.0262 260 PHE D CG 12001 C CD1 . PHE D 201 ? 0.3440 0.5290 0.6169 -0.0117 -0.0119 -0.0280 260 PHE D CD1 12002 C CD2 . PHE D 201 ? 0.3239 0.5137 0.5863 -0.0108 -0.0080 -0.0216 260 PHE D CD2 12003 C CE1 . PHE D 201 ? 0.3240 0.5128 0.6129 -0.0140 -0.0112 -0.0253 260 PHE D CE1 12004 C CE2 . PHE D 201 ? 0.3791 0.5728 0.6576 -0.0130 -0.0073 -0.0187 260 PHE D CE2 12005 C CZ . PHE D 201 ? 0.3527 0.5459 0.6445 -0.0146 -0.0088 -0.0206 260 PHE D CZ 12006 N N . PHE D 202 ? 0.3238 0.5061 0.5491 -0.0088 -0.0031 -0.0159 261 PHE D N 12007 C CA . PHE D 202 ? 0.3217 0.5068 0.5466 -0.0099 0.0005 -0.0086 261 PHE D CA 12008 C C . PHE D 202 ? 0.3210 0.5113 0.5552 -0.0101 0.0004 -0.0074 261 PHE D C 12009 O O . PHE D 202 ? 0.3223 0.5140 0.5542 -0.0084 -0.0019 -0.0117 261 PHE D O 12010 C CB . PHE D 202 ? 0.3408 0.5241 0.5481 -0.0082 0.0022 -0.0067 261 PHE D CB 12011 C CG . PHE D 202 ? 0.3601 0.5387 0.5589 -0.0085 0.0034 -0.0058 261 PHE D CG 12012 C CD1 . PHE D 202 ? 0.3242 0.4986 0.5140 -0.0068 0.0014 -0.0113 261 PHE D CD1 12013 C CD2 . PHE D 202 ? 0.3290 0.5075 0.5290 -0.0102 0.0067 0.0005 261 PHE D CD2 12014 C CE1 . PHE D 202 ? 0.3242 0.4944 0.5064 -0.0071 0.0025 -0.0105 261 PHE D CE1 12015 C CE2 . PHE D 202 ? 0.3268 0.5012 0.5191 -0.0104 0.0078 0.0013 261 PHE D CE2 12016 C CZ . PHE D 202 ? 0.3222 0.4925 0.5057 -0.0089 0.0057 -0.0042 261 PHE D CZ 12017 N N . SER D 203 ? 0.3189 0.5121 0.5638 -0.0122 0.0028 -0.0016 262 SER D N 12018 C CA . SER D 203 ? 0.3181 0.5163 0.5724 -0.0127 0.0032 0.0004 262 SER D CA 12019 C C . SER D 203 ? 0.3432 0.5432 0.5858 -0.0109 0.0046 0.0031 262 SER D C 12020 O O . SER D 203 ? 0.3393 0.5366 0.5677 -0.0099 0.0059 0.0046 262 SER D O 12021 C CB . SER D 203 ? 0.3160 0.5164 0.5842 -0.0152 0.0059 0.0062 262 SER D CB 12022 O OG . SER D 203 ? 0.3168 0.5174 0.5787 -0.0154 0.0096 0.0132 262 SER D OG 12023 N N . PRO D 204 ? 0.3839 0.5884 0.6323 -0.0106 0.0043 0.0036 263 PRO D N 12024 C CA . PRO D 204 ? 0.3974 0.6037 0.6350 -0.0090 0.0058 0.0067 263 PRO D CA 12025 C C . PRO D 204 ? 0.3619 0.5679 0.5948 -0.0097 0.0097 0.0146 263 PRO D C 12026 O O . PRO D 204 ? 0.4738 0.6798 0.6941 -0.0082 0.0110 0.0171 263 PRO D O 12027 C CB . PRO D 204 ? 0.3169 0.5284 0.5655 -0.0092 0.0050 0.0066 263 PRO D CB 12028 C CG . PRO D 204 ? 0.4146 0.6270 0.6811 -0.0114 0.0042 0.0055 263 PRO D CG 12029 C CD . PRO D 204 ? 0.4443 0.6521 0.7084 -0.0115 0.0023 0.0009 263 PRO D CD 12030 N N . ALA D 205 ? 0.3141 0.5197 0.5569 -0.0118 0.0116 0.0183 264 ALA D N 12031 C CA . ALA D 205 ? 0.3124 0.5174 0.5515 -0.0123 0.0153 0.0255 264 ALA D CA 12032 C C . ALA D 205 ? 0.3129 0.5129 0.5409 -0.0121 0.0157 0.0249 264 ALA D C 12033 O O . ALA D 205 ? 0.4808 0.6796 0.7062 -0.0127 0.0186 0.0302 264 ALA D O 12034 C CB . ALA D 205 ? 0.3108 0.5178 0.5659 -0.0146 0.0175 0.0301 264 ALA D CB 12035 N N . LYS D 206 ? 0.3533 0.5505 0.5754 -0.0112 0.0129 0.0183 265 LYS D N 12036 C CA . LYS D 206 ? 0.5549 0.7472 0.7661 -0.0108 0.0129 0.0168 265 LYS D CA 12037 C C . LYS D 206 ? 0.5574 0.7476 0.7768 -0.0129 0.0139 0.0183 265 LYS D C 12038 O O . LYS D 206 ? 0.4722 0.6588 0.6834 -0.0129 0.0151 0.0195 265 LYS D O 12039 C CB . LYS D 206 ? 0.3150 0.5061 0.5109 -0.0095 0.0151 0.0208 265 LYS D CB 12040 C CG . LYS D 206 ? 0.3206 0.5116 0.5033 -0.0070 0.0136 0.0174 265 LYS D CG 12041 C CD . LYS D 206 ? 0.5880 0.7822 0.7658 -0.0061 0.0154 0.0224 265 LYS D CD 12042 C CE . LYS D 206 ? 0.8069 1.0026 0.9777 -0.0040 0.0132 0.0180 265 LYS D CE 12043 N NZ . LYS D 206 ? 0.7469 0.9449 0.9301 -0.0044 0.0105 0.0133 265 LYS D NZ 12044 N N . ASN D 207 ? 0.3140 0.5063 0.5493 -0.0147 0.0135 0.0183 266 ASN D N 12045 C CA . ASN D 207 ? 0.3867 0.5769 0.6304 -0.0166 0.0140 0.0188 266 ASN D CA 12046 C C . ASN D 207 ? 0.3153 0.5025 0.5588 -0.0164 0.0106 0.0116 266 ASN D C 12047 O O . ASN D 207 ? 0.4043 0.5924 0.6485 -0.0152 0.0076 0.0064 266 ASN D O 12048 C CB . ASN D 207 ? 0.3122 0.5058 0.5731 -0.0186 0.0152 0.0219 266 ASN D CB 12049 C CG . ASN D 207 ? 0.3279 0.5240 0.5897 -0.0188 0.0190 0.0295 266 ASN D CG 12050 O OD1 . ASN D 207 ? 0.3097 0.5039 0.5622 -0.0184 0.0214 0.0336 266 ASN D OD1 12051 N ND2 . ASN D 207 ? 0.3848 0.5851 0.6578 -0.0194 0.0195 0.0315 266 ASN D ND2 12052 N N . PHE D 208 ? 0.3153 0.4989 0.5578 -0.0173 0.0109 0.0114 267 PHE D N 12053 C CA . PHE D 208 ? 0.3171 0.4974 0.5590 -0.0169 0.0077 0.0049 267 PHE D CA 12054 C C . PHE D 208 ? 0.3971 0.5790 0.6558 -0.0185 0.0059 0.0027 267 PHE D C 12055 O O . PHE D 208 ? 0.4317 0.6149 0.7010 -0.0206 0.0079 0.0068 267 PHE D O 12056 C CB . PHE D 208 ? 0.3285 0.5043 0.5624 -0.0172 0.0087 0.0055 267 PHE D CB 12057 C CG . PHE D 208 ? 0.3724 0.5442 0.5993 -0.0158 0.0057 -0.0010 267 PHE D CG 12058 C CD1 . PHE D 208 ? 0.3359 0.5079 0.5576 -0.0137 0.0030 -0.0063 267 PHE D CD1 12059 C CD2 . PHE D 208 ? 0.3824 0.5503 0.6079 -0.0165 0.0056 -0.0019 267 PHE D CD2 12060 C CE1 . PHE D 208 ? 0.3231 0.4913 0.5383 -0.0121 0.0003 -0.0123 267 PHE D CE1 12061 C CE2 . PHE D 208 ? 0.3422 0.5063 0.5612 -0.0151 0.0029 -0.0078 267 PHE D CE2 12062 C CZ . PHE D 208 ? 0.3318 0.4960 0.5456 -0.0128 0.0003 -0.0129 267 PHE D CZ 12063 N N . CYS D 209 ? 0.3188 0.5004 0.5797 -0.0175 0.0022 -0.0038 268 CYS D N 12064 C CA . CYS D 209 ? 0.3993 0.5828 0.6762 -0.0188 0.0002 -0.0063 268 CYS D CA 12065 C C . CYS D 209 ? 0.3890 0.5692 0.6659 -0.0178 -0.0037 -0.0134 268 CYS D C 12066 O O . CYS D 209 ? 0.4249 0.6025 0.6898 -0.0156 -0.0054 -0.0174 268 CYS D O 12067 C CB . CYS D 209 ? 0.3188 0.5071 0.6026 -0.0184 -0.0005 -0.0066 268 CYS D CB 12068 S SG . CYS D 209 ? 0.3418 0.5342 0.6271 -0.0193 0.0039 0.0017 268 CYS D SG 12069 N N . PHE D 210 ? 0.3306 0.5109 0.6210 -0.0195 -0.0051 -0.0148 269 PHE D N 12070 C CA . PHE D 210 ? 0.4002 0.5780 0.6927 -0.0185 -0.0091 -0.0216 269 PHE D CA 12071 C C . PHE D 210 ? 0.3231 0.5039 0.6324 -0.0195 -0.0114 -0.0241 269 PHE D C 12072 O O . PHE D 210 ? 0.3215 0.5053 0.6429 -0.0217 -0.0095 -0.0200 269 PHE D O 12073 C CB . PHE D 210 ? 0.3232 0.4965 0.6129 -0.0192 -0.0091 -0.0218 269 PHE D CB 12074 C CG . PHE D 210 ? 0.3215 0.4955 0.6226 -0.0221 -0.0069 -0.0172 269 PHE D CG 12075 C CD1 . PHE D 210 ? 0.3217 0.4966 0.6376 -0.0235 -0.0089 -0.0192 269 PHE D CD1 12076 C CD2 . PHE D 210 ? 0.3199 0.4934 0.6166 -0.0233 -0.0030 -0.0110 269 PHE D CD2 12077 C CE1 . PHE D 210 ? 0.3203 0.4957 0.6463 -0.0261 -0.0068 -0.0151 269 PHE D CE1 12078 C CE2 . PHE D 210 ? 0.3237 0.4977 0.6305 -0.0258 -0.0009 -0.0070 269 PHE D CE2 12079 C CZ . PHE D 210 ? 0.3187 0.4936 0.6400 -0.0272 -0.0028 -0.0090 269 PHE D CZ 12080 N N . VAL D 211 ? 0.4436 0.6235 0.7534 -0.0176 -0.0155 -0.0309 270 VAL D N 12081 C CA . VAL D 211 ? 0.3256 0.5081 0.6507 -0.0181 -0.0183 -0.0342 270 VAL D CA 12082 C C . VAL D 211 ? 0.3263 0.5060 0.6595 -0.0192 -0.0204 -0.0367 270 VAL D C 12083 O O . VAL D 211 ? 0.4556 0.6374 0.8039 -0.0211 -0.0209 -0.0363 270 VAL D O 12084 C CB . VAL D 211 ? 0.4670 0.6502 0.7887 -0.0153 -0.0218 -0.0406 270 VAL D CB 12085 C CG1 . VAL D 211 ? 0.3283 0.5136 0.6656 -0.0156 -0.0251 -0.0448 270 VAL D CG1 12086 C CG2 . VAL D 211 ? 0.3269 0.5134 0.6421 -0.0144 -0.0198 -0.0380 270 VAL D CG2 12087 N N . SER D 212 ? 0.3275 0.5024 0.6504 -0.0179 -0.0214 -0.0391 271 SER D N 12088 C CA . SER D 212 ? 0.3521 0.5236 0.6802 -0.0182 -0.0239 -0.0423 271 SER D CA 12089 C C . SER D 212 ? 0.3471 0.5194 0.6847 -0.0170 -0.0285 -0.0487 271 SER D C 12090 O O . SER D 212 ? 0.4380 0.6126 0.7751 -0.0153 -0.0300 -0.0516 271 SER D O 12091 C CB . SER D 212 ? 0.3267 0.4988 0.6650 -0.0215 -0.0215 -0.0372 271 SER D CB 12092 O OG . SER D 212 ? 0.3608 0.5293 0.7025 -0.0218 -0.0238 -0.0399 271 SER D OG 12093 N N . ARG D 213 ? 0.3642 0.5345 0.7103 -0.0177 -0.0308 -0.0510 272 ARG D N 12094 C CA . ARG D 213 ? 0.3325 0.5035 0.6887 -0.0166 -0.0353 -0.0571 272 ARG D CA 12095 C C . ARG D 213 ? 0.3317 0.5039 0.7044 -0.0194 -0.0357 -0.0558 272 ARG D C 12096 O O . ARG D 213 ? 0.6469 0.8161 1.0199 -0.0206 -0.0352 -0.0542 272 ARG D O 12097 C CB . ARG D 213 ? 0.3893 0.5553 0.7361 -0.0133 -0.0390 -0.0634 272 ARG D CB 12098 C CG . ARG D 213 ? 0.5991 0.7637 0.9299 -0.0102 -0.0390 -0.0657 272 ARG D CG 12099 C CD . ARG D 213 ? 0.9248 1.0839 1.2455 -0.0071 -0.0419 -0.0710 272 ARG D CD 12100 N NE . ARG D 213 ? 1.0233 1.1815 1.3519 -0.0052 -0.0468 -0.0776 272 ARG D NE 12101 C CZ . ARG D 213 ? 0.9947 1.1529 1.3200 -0.0019 -0.0497 -0.0833 272 ARG D CZ 12102 N NH1 . ARG D 213 ? 1.0288 1.1879 1.3429 -0.0003 -0.0481 -0.0832 272 ARG D NH1 12103 N NH2 . ARG D 213 ? 0.9369 1.0943 1.2700 -0.0001 -0.0542 -0.0892 272 ARG D NH2 12104 N N . CYS D 214 ? 0.3313 0.5077 0.7177 -0.0203 -0.0367 -0.0565 273 CYS D N 12105 C CA . CYS D 214 ? 0.3707 0.5485 0.7739 -0.0229 -0.0373 -0.0556 273 CYS D CA 12106 C C . CYS D 214 ? 0.3309 0.5131 0.7477 -0.0230 -0.0394 -0.0583 273 CYS D C 12107 O O . CYS D 214 ? 0.5790 0.7634 0.9921 -0.0212 -0.0400 -0.0602 273 CYS D O 12108 C CB . CYS D 214 ? 0.3283 0.5073 0.7351 -0.0262 -0.0325 -0.0480 273 CYS D CB 12109 S SG . CYS D 214 ? 0.4765 0.6613 0.8875 -0.0278 -0.0282 -0.0421 273 CYS D SG 12110 N N . ASP D 215 ? 0.4173 0.6009 0.8499 -0.0251 -0.0404 -0.0583 274 ASP D N 12111 C CA . ASP D 215 ? 0.5127 0.7004 0.9598 -0.0253 -0.0426 -0.0610 274 ASP D CA 12112 C C . ASP D 215 ? 0.3593 0.5522 0.8136 -0.0275 -0.0387 -0.0556 274 ASP D C 12113 O O . ASP D 215 ? 0.4456 0.6422 0.9059 -0.0269 -0.0399 -0.0576 274 ASP D O 12114 C CB . ASP D 215 ? 0.6369 0.8238 1.0985 -0.0267 -0.0454 -0.0633 274 ASP D CB 12115 C CG . ASP D 215 ? 0.7766 0.9586 1.2329 -0.0241 -0.0500 -0.0697 274 ASP D CG 12116 O OD1 . ASP D 215 ? 0.5340 0.7144 0.9790 -0.0208 -0.0522 -0.0739 274 ASP D OD1 12117 O OD2 . ASP D 215 ? 0.9160 1.0959 1.3794 -0.0252 -0.0516 -0.0703 274 ASP D OD2 12118 N N . TYR D 216 ? 0.4757 0.6688 0.9293 -0.0300 -0.0341 -0.0487 275 TYR D N 12119 C CA . TYR D 216 ? 0.3249 0.5228 0.7871 -0.0322 -0.0303 -0.0431 275 TYR D CA 12120 C C . TYR D 216 ? 0.3238 0.5227 0.7733 -0.0315 -0.0266 -0.0387 275 TYR D C 12121 O O . TYR D 216 ? 0.3834 0.5811 0.8268 -0.0326 -0.0228 -0.0331 275 TYR D O 12122 C CB . TYR D 216 ? 0.4019 0.5997 0.8745 -0.0354 -0.0274 -0.0380 275 TYR D CB 12123 C CG . TYR D 216 ? 0.6282 0.8309 1.1135 -0.0377 -0.0241 -0.0332 275 TYR D CG 12124 C CD1 . TYR D 216 ? 0.7164 0.9223 1.2180 -0.0386 -0.0262 -0.0358 275 TYR D CD1 12125 C CD2 . TYR D 216 ? 0.8202 1.0242 1.3014 -0.0388 -0.0190 -0.0261 275 TYR D CD2 12126 C CE1 . TYR D 216 ? 0.7367 0.9470 1.2502 -0.0406 -0.0231 -0.0314 275 TYR D CE1 12127 C CE2 . TYR D 216 ? 0.6487 0.8570 1.1414 -0.0406 -0.0159 -0.0216 275 TYR D CE2 12128 C CZ . TYR D 216 ? 0.6741 0.8856 1.1830 -0.0415 -0.0179 -0.0243 275 TYR D CZ 12129 O OH . TYR D 216 ? 0.6942 0.9098 1.2148 -0.0433 -0.0148 -0.0197 275 TYR D OH 12130 N N . TYR D 217 ? 0.4519 0.6531 0.8975 -0.0294 -0.0280 -0.0414 276 TYR D N 12131 C CA . TYR D 217 ? 0.3233 0.5265 0.7589 -0.0287 -0.0248 -0.0375 276 TYR D CA 12132 C C . TYR D 217 ? 0.3930 0.5924 0.8102 -0.0275 -0.0231 -0.0356 276 TYR D C 12133 O O . TYR D 217 ? 0.3218 0.5222 0.7325 -0.0280 -0.0191 -0.0300 276 TYR D O 12134 C CB . TYR D 217 ? 0.3212 0.5283 0.7664 -0.0313 -0.0204 -0.0304 276 TYR D CB 12135 C CG . TYR D 217 ? 0.4667 0.6783 0.9288 -0.0324 -0.0215 -0.0317 276 TYR D CG 12136 C CD1 . TYR D 217 ? 0.3217 0.5364 0.7836 -0.0306 -0.0234 -0.0350 276 TYR D CD1 12137 C CD2 . TYR D 217 ? 0.3204 0.5332 0.7986 -0.0351 -0.0207 -0.0297 276 TYR D CD2 12138 C CE1 . TYR D 217 ? 0.4112 0.6302 0.8888 -0.0315 -0.0245 -0.0363 276 TYR D CE1 12139 C CE2 . TYR D 217 ? 0.3203 0.5373 0.8144 -0.0361 -0.0217 -0.0309 276 TYR D CE2 12140 C CZ . TYR D 217 ? 0.3371 0.5572 0.8309 -0.0343 -0.0236 -0.0342 276 TYR D CZ 12141 O OH . TYR D 217 ? 0.4643 0.6886 0.9741 -0.0353 -0.0247 -0.0355 276 TYR D OH 12142 N N . CYS D 218 ? 0.3250 0.5199 0.7341 -0.0257 -0.0260 -0.0404 277 CYS D N 12143 C CA . CYS D 218 ? 0.3254 0.5170 0.7161 -0.0238 -0.0252 -0.0402 277 CYS D CA 12144 C C . CYS D 218 ? 0.3546 0.5474 0.7365 -0.0210 -0.0268 -0.0439 277 CYS D C 12145 O O . CYS D 218 ? 0.4737 0.6640 0.8494 -0.0184 -0.0304 -0.0501 277 CYS D O 12146 C CB . CYS D 218 ? 0.3269 0.5131 0.7117 -0.0229 -0.0275 -0.0439 277 CYS D CB 12147 S SG . CYS D 218 ? 0.3416 0.5253 0.7303 -0.0259 -0.0248 -0.0387 277 CYS D SG 12148 N N . ASP D 219 ? 0.3252 0.5220 0.7067 -0.0213 -0.0241 -0.0399 278 ASP D N 12149 C CA . ASP D 219 ? 0.3261 0.5245 0.6989 -0.0187 -0.0252 -0.0427 278 ASP D CA 12150 C C . ASP D 219 ? 0.3247 0.5242 0.6868 -0.0188 -0.0211 -0.0367 278 ASP D C 12151 O O . ASP D 219 ? 0.5436 0.7430 0.9060 -0.0208 -0.0174 -0.0305 278 ASP D O 12152 C CB . ASP D 219 ? 0.3264 0.5292 0.7124 -0.0187 -0.0274 -0.0456 278 ASP D CB 12153 C CG . ASP D 219 ? 0.3304 0.5374 0.7315 -0.0218 -0.0246 -0.0401 278 ASP D CG 12154 O OD1 . ASP D 219 ? 0.3246 0.5340 0.7409 -0.0227 -0.0267 -0.0426 278 ASP D OD1 12155 O OD2 . ASP D 219 ? 0.3274 0.5353 0.7255 -0.0232 -0.0203 -0.0333 278 ASP D OD2 12156 N N . THR D 220 ? 0.4428 0.6435 0.7953 -0.0165 -0.0217 -0.0387 279 THR D N 12157 C CA . THR D 220 ? 0.3252 0.5269 0.6660 -0.0160 -0.0183 -0.0336 279 THR D CA 12158 C C . THR D 220 ? 0.4024 0.6082 0.7523 -0.0185 -0.0145 -0.0264 279 THR D C 12159 O O . THR D 220 ? 0.3746 0.5798 0.7183 -0.0193 -0.0108 -0.0204 279 THR D O 12160 C CB . THR D 220 ? 0.3256 0.5286 0.6568 -0.0132 -0.0199 -0.0374 279 THR D CB 12161 O OG1 . THR D 220 ? 0.3369 0.5359 0.6595 -0.0106 -0.0234 -0.0443 279 THR D OG1 12162 C CG2 . THR D 220 ? 0.3246 0.5281 0.6423 -0.0126 -0.0165 -0.0322 279 THR D CG2 12163 N N . THR D 221 ? 0.3216 0.5315 0.6866 -0.0195 -0.0154 -0.0271 280 THR D N 12164 C CA . THR D 221 ? 0.3196 0.5336 0.6945 -0.0217 -0.0120 -0.0206 280 THR D CA 12165 C C . THR D 221 ? 0.3528 0.5652 0.7331 -0.0242 -0.0089 -0.0151 280 THR D C 12166 O O . THR D 221 ? 0.5040 0.7179 0.8841 -0.0253 -0.0049 -0.0083 280 THR D O 12167 C CB . THR D 221 ? 0.3332 0.5515 0.7248 -0.0224 -0.0139 -0.0230 280 THR D CB 12168 O OG1 . THR D 221 ? 0.3211 0.5409 0.7076 -0.0199 -0.0168 -0.0282 280 THR D OG1 12169 C CG2 . THR D 221 ? 0.3177 0.5402 0.7194 -0.0244 -0.0101 -0.0161 280 THR D CG2 12170 N N . HIS D 222 ? 0.3189 0.5282 0.7038 -0.0250 -0.0108 -0.0182 281 HIS D N 12171 C CA . HIS D 222 ? 0.3177 0.5255 0.7085 -0.0274 -0.0082 -0.0137 281 HIS D CA 12172 C C . HIS D 222 ? 0.3181 0.5207 0.6954 -0.0268 -0.0078 -0.0136 281 HIS D C 12173 O O . HIS D 222 ? 0.3178 0.5181 0.6994 -0.0283 -0.0073 -0.0127 281 HIS D O 12174 C CB . HIS D 222 ? 0.3181 0.5264 0.7258 -0.0291 -0.0103 -0.0165 281 HIS D CB 12175 C CG . HIS D 222 ? 0.3177 0.5310 0.7399 -0.0299 -0.0108 -0.0167 281 HIS D CG 12176 N ND1 . HIS D 222 ? 0.3191 0.5342 0.7436 -0.0283 -0.0145 -0.0226 281 HIS D ND1 12177 C CD2 . HIS D 222 ? 0.3163 0.5330 0.7513 -0.0320 -0.0079 -0.0116 281 HIS D CD2 12178 C CE1 . HIS D 222 ? 0.3184 0.5381 0.7568 -0.0295 -0.0140 -0.0213 281 HIS D CE1 12179 N NE2 . HIS D 222 ? 0.4248 0.6455 0.8699 -0.0318 -0.0099 -0.0146 281 HIS D NE2 12180 N N . ALA D 223 ? 0.3187 0.5198 0.6799 -0.0246 -0.0079 -0.0145 282 ALA D N 12181 C CA . ALA D 223 ? 0.3190 0.5154 0.6666 -0.0239 -0.0072 -0.0143 282 ALA D CA 12182 C C . ALA D 223 ? 0.3172 0.5129 0.6644 -0.0257 -0.0028 -0.0070 282 ALA D C 12183 O O . ALA D 223 ? 0.4051 0.6041 0.7570 -0.0267 0.0002 -0.0016 282 ALA D O 12184 C CB . ALA D 223 ? 0.3200 0.5152 0.6508 -0.0211 -0.0078 -0.0162 282 ALA D CB 12185 N N . ILE D 224 ? 0.3608 0.5524 0.7023 -0.0261 -0.0025 -0.0070 283 ILE D N 12186 C CA . ILE D 224 ? 0.3158 0.5062 0.6552 -0.0275 0.0015 -0.0006 283 ILE D CA 12187 C C . ILE D 224 ? 0.3154 0.5047 0.6382 -0.0259 0.0035 0.0021 283 ILE D C 12188 O O . ILE D 224 ? 0.3838 0.5702 0.6944 -0.0241 0.0017 -0.0017 283 ILE D O 12189 C CB . ILE D 224 ? 0.3161 0.5026 0.6570 -0.0286 0.0009 -0.0017 283 ILE D CB 12190 C CG1 . ILE D 224 ? 0.3163 0.5041 0.6743 -0.0304 -0.0008 -0.0037 283 ILE D CG1 12191 C CG2 . ILE D 224 ? 0.3146 0.4996 0.6510 -0.0297 0.0050 0.0045 283 ILE D CG2 12192 C CD1 . ILE D 224 ? 0.3147 0.5061 0.6857 -0.0325 0.0023 0.0017 283 ILE D CD1 12193 N N . CYS D 225 ? 0.4191 0.6106 0.7416 -0.0265 0.0073 0.0086 284 CYS D N 12194 C CA . CYS D 225 ? 0.3134 0.5043 0.6209 -0.0248 0.0092 0.0114 284 CYS D CA 12195 C C . CYS D 225 ? 0.3118 0.5016 0.6157 -0.0257 0.0133 0.0180 284 CYS D C 12196 O O . CYS D 225 ? 0.3106 0.5019 0.6251 -0.0274 0.0157 0.0224 284 CYS D O 12197 C CB . CYS D 225 ? 0.3131 0.5083 0.6211 -0.0238 0.0095 0.0126 284 CYS D CB 12198 S SG . CYS D 225 ? 0.3151 0.5117 0.6246 -0.0223 0.0048 0.0047 284 CYS D SG 12199 N N . GLY D 226 ? 0.3120 0.4989 0.6008 -0.0244 0.0141 0.0187 285 GLY D N 12200 C CA . GLY D 226 ? 0.3107 0.4962 0.5942 -0.0248 0.0178 0.0247 285 GLY D CA 12201 C C . GLY D 226 ? 0.3589 0.5471 0.6377 -0.0238 0.0205 0.0299 285 GLY D C 12202 O O . GLY D 226 ? 0.3176 0.5090 0.5983 -0.0231 0.0196 0.0291 285 GLY D O 12203 N N . LEU D 227 ? 0.3085 0.4954 0.5811 -0.0238 0.0238 0.0352 286 LEU D N 12204 C CA . LEU D 227 ? 0.4213 0.6104 0.6881 -0.0226 0.0263 0.0405 286 LEU D CA 12205 C C . LEU D 227 ? 0.3072 0.4933 0.5587 -0.0213 0.0280 0.0430 286 LEU D C 12206 O O . LEU D 227 ? 0.4510 0.6368 0.7019 -0.0215 0.0312 0.0486 286 LEU D O 12207 C CB . LEU D 227 ? 0.3060 0.4978 0.5849 -0.0237 0.0294 0.0465 286 LEU D CB 12208 C CG . LEU D 227 ? 0.5389 0.7351 0.8305 -0.0242 0.0286 0.0461 286 LEU D CG 12209 C CD1 . LEU D 227 ? 0.5003 0.6987 0.8025 -0.0251 0.0322 0.0526 286 LEU D CD1 12210 C CD2 . LEU D 227 ? 0.3659 0.5643 0.6498 -0.0223 0.0273 0.0447 286 LEU D CD2 12211 N N . PRO D 228 ? 0.3085 0.4924 0.5473 -0.0199 0.0259 0.0387 287 PRO D N 12212 C CA . PRO D 228 ? 0.3102 0.4941 0.5483 -0.0193 0.0221 0.0319 287 PRO D CA 12213 C C . PRO D 228 ? 0.3588 0.5392 0.5977 -0.0199 0.0197 0.0265 287 PRO D C 12214 O O . PRO D 228 ? 0.4371 0.6180 0.6810 -0.0199 0.0166 0.0212 287 PRO D O 12215 C CB . PRO D 228 ? 0.3109 0.4942 0.5331 -0.0170 0.0218 0.0313 287 PRO D CB 12216 C CG . PRO D 228 ? 0.3101 0.4906 0.5229 -0.0168 0.0244 0.0353 287 PRO D CG 12217 C CD . PRO D 228 ? 0.3095 0.4912 0.5329 -0.0184 0.0273 0.0410 287 PRO D CD 12218 N N . ASP D 229 ? 0.3111 0.4881 0.5453 -0.0205 0.0211 0.0279 288 ASP D N 12219 C CA . ASP D 229 ? 0.3399 0.5131 0.5715 -0.0206 0.0188 0.0228 288 ASP D CA 12220 C C . ASP D 229 ? 0.3117 0.4831 0.5512 -0.0226 0.0198 0.0242 288 ASP D C 12221 O O . ASP D 229 ? 0.4374 0.6052 0.6732 -0.0227 0.0185 0.0209 288 ASP D O 12222 C CB . ASP D 229 ? 0.3132 0.4831 0.5280 -0.0189 0.0187 0.0214 288 ASP D CB 12223 C CG . ASP D 229 ? 0.4018 0.5707 0.6096 -0.0190 0.0222 0.0273 288 ASP D CG 12224 O OD1 . ASP D 229 ? 0.4689 0.6403 0.6830 -0.0197 0.0247 0.0327 288 ASP D OD1 12225 O OD2 . ASP D 229 ? 0.4472 0.6126 0.6432 -0.0182 0.0224 0.0264 288 ASP D OD2 12226 N N . MSE D 230 ? 0.3102 0.4839 0.5603 -0.0240 0.0222 0.0290 289 MSE D N 12227 C CA . MSE D 230 ? 0.3096 0.4819 0.5684 -0.0259 0.0231 0.0302 289 MSE D CA 12228 C C . MSE D 230 ? 0.5326 0.7074 0.8076 -0.0274 0.0219 0.0288 289 MSE D C 12229 O O . MSE D 230 ? 0.4356 0.6140 0.7163 -0.0272 0.0215 0.0291 289 MSE D O 12230 C CB . MSE D 230 ? 0.3080 0.4802 0.5659 -0.0264 0.0272 0.0369 289 MSE D CB 12231 C CG . MSE D 230 ? 0.8657 1.0417 1.1344 -0.0270 0.0296 0.0419 289 MSE D CG 12232 SE SE . MSE D 230 ? 0.9076 1.0876 1.1710 -0.0251 0.0300 0.0440 289 MSE D SE 12233 C CE . MSE D 230 ? 0.3744 0.5512 0.6178 -0.0231 0.0318 0.0466 289 MSE D CE 12234 N N . LYS D 231 ? 0.3232 0.4962 0.6055 -0.0289 0.0211 0.0271 290 LYS D N 12235 C CA . LYS D 231 ? 0.3100 0.4851 0.6080 -0.0304 0.0198 0.0256 290 LYS D CA 12236 C C . LYS D 231 ? 0.3096 0.4829 0.6156 -0.0324 0.0208 0.0270 290 LYS D C 12237 O O . LYS D 231 ? 0.3117 0.4816 0.6141 -0.0326 0.0193 0.0239 290 LYS D O 12238 C CB . LYS D 231 ? 0.3118 0.4866 0.6106 -0.0297 0.0153 0.0185 290 LYS D CB 12239 C CG . LYS D 231 ? 0.3121 0.4886 0.6270 -0.0312 0.0134 0.0162 290 LYS D CG 12240 C CD . LYS D 231 ? 0.3224 0.5035 0.6488 -0.0321 0.0154 0.0202 290 LYS D CD 12241 C CE . LYS D 231 ? 0.3110 0.4949 0.6322 -0.0304 0.0153 0.0203 290 LYS D CE 12242 N NZ . LYS D 231 ? 0.3101 0.4985 0.6439 -0.0313 0.0166 0.0232 290 LYS D NZ 12243 N N . GLU D 232 ? 0.4349 0.6106 0.7516 -0.0337 0.0236 0.0316 291 GLU D N 12244 C CA . GLU D 232 ? 0.3080 0.4824 0.6338 -0.0356 0.0248 0.0330 291 GLU D CA 12245 C C . GLU D 232 ? 0.3091 0.4836 0.6455 -0.0367 0.0213 0.0278 291 GLU D C 12246 O O . GLU D 232 ? 0.4795 0.6563 0.8202 -0.0362 0.0188 0.0246 291 GLU D O 12247 C CB . GLU D 232 ? 0.3066 0.4836 0.6410 -0.0364 0.0288 0.0394 291 GLU D CB 12248 C CG . GLU D 232 ? 0.3063 0.4820 0.6502 -0.0383 0.0305 0.0413 291 GLU D CG 12249 C CD . GLU D 232 ? 0.3998 0.5778 0.7515 -0.0388 0.0348 0.0477 291 GLU D CD 12250 O OE1 . GLU D 232 ? 0.5091 0.6875 0.8533 -0.0375 0.0376 0.0521 291 GLU D OE1 12251 O OE2 . GLU D 232 ? 0.3687 0.5481 0.7341 -0.0404 0.0354 0.0484 291 GLU D OE2 12252 N N . GLY D 233 ? 0.3995 0.5714 0.7397 -0.0380 0.0209 0.0269 292 GLY D N 12253 C CA . GLY D 233 ? 0.3811 0.5530 0.7321 -0.0391 0.0177 0.0225 292 GLY D CA 12254 C C . GLY D 233 ? 0.3102 0.4800 0.6676 -0.0409 0.0187 0.0236 292 GLY D C 12255 O O . GLY D 233 ? 0.3802 0.5480 0.7321 -0.0411 0.0216 0.0273 292 GLY D O 12256 N N . SER D 234 ? 0.3355 0.5055 0.7043 -0.0421 0.0162 0.0204 293 SER D N 12257 C CA . SER D 234 ? 0.3111 0.4789 0.6858 -0.0438 0.0166 0.0207 293 SER D CA 12258 C C . SER D 234 ? 0.3124 0.4761 0.6792 -0.0432 0.0132 0.0158 293 SER D C 12259 O O . SER D 234 ? 0.3136 0.4770 0.6779 -0.0419 0.0094 0.0107 293 SER D O 12260 C CB . SER D 234 ? 0.3113 0.4814 0.7030 -0.0455 0.0158 0.0201 293 SER D CB 12261 O OG . SER D 234 ? 0.3127 0.4830 0.7083 -0.0451 0.0111 0.0140 293 SER D OG 12262 N N . VAL D 235 ? 0.3121 0.4728 0.6749 -0.0438 0.0146 0.0174 294 VAL D N 12263 C CA . VAL D 235 ? 0.3133 0.4699 0.6685 -0.0433 0.0117 0.0132 294 VAL D CA 12264 C C . VAL D 235 ? 0.3487 0.5036 0.7124 -0.0450 0.0113 0.0129 294 VAL D C 12265 O O . VAL D 235 ? 0.3127 0.4668 0.6775 -0.0462 0.0146 0.0171 294 VAL D O 12266 C CB . VAL D 235 ? 0.3955 0.5494 0.7353 -0.0421 0.0136 0.0150 294 VAL D CB 12267 C CG1 . VAL D 235 ? 0.3757 0.5253 0.7084 -0.0416 0.0108 0.0109 294 VAL D CG1 12268 C CG2 . VAL D 235 ? 0.3128 0.4682 0.6435 -0.0402 0.0138 0.0151 294 VAL D CG2 12269 N N . GLN D 236 ? 0.3150 0.4690 0.6843 -0.0451 0.0071 0.0079 295 GLN D N 12270 C CA . GLN D 236 ? 0.4973 0.6500 0.8758 -0.0468 0.0062 0.0072 295 GLN D CA 12271 C C . GLN D 236 ? 0.5143 0.6628 0.8858 -0.0460 0.0028 0.0028 295 GLN D C 12272 O O . GLN D 236 ? 0.3896 0.5372 0.7570 -0.0443 -0.0009 -0.0020 295 GLN D O 12273 C CB . GLN D 236 ? 0.3158 0.4714 0.7096 -0.0478 0.0043 0.0053 295 GLN D CB 12274 C CG . GLN D 236 ? 0.3449 0.4990 0.7486 -0.0494 0.0029 0.0041 295 GLN D CG 12275 C CD . GLN D 236 ? 0.4217 0.5789 0.8412 -0.0505 0.0014 0.0027 295 GLN D CD 12276 O OE1 . GLN D 236 ? 0.4597 0.6167 0.8833 -0.0499 -0.0031 -0.0024 295 GLN D OE1 12277 N NE2 . GLN D 236 ? 0.4152 0.5754 0.8439 -0.0521 0.0050 0.0073 295 GLN D NE2 12278 N N . VAL D 237 ? 0.3744 0.5202 0.7443 -0.0471 0.0041 0.0045 296 VAL D N 12279 C CA . VAL D 237 ? 0.4009 0.5425 0.7642 -0.0464 0.0012 0.0010 296 VAL D CA 12280 C C . VAL D 237 ? 0.3666 0.5078 0.7381 -0.0462 -0.0036 -0.0043 296 VAL D C 12281 O O . VAL D 237 ? 0.4185 0.5618 0.8032 -0.0476 -0.0041 -0.0042 296 VAL D O 12282 C CB . VAL D 237 ? 0.5020 0.6411 0.8642 -0.0479 0.0036 0.0040 296 VAL D CB 12283 C CG1 . VAL D 237 ? 0.3169 0.4576 0.6936 -0.0501 0.0046 0.0059 296 VAL D CG1 12284 C CG2 . VAL D 237 ? 0.3774 0.5121 0.7316 -0.0470 0.0007 0.0005 296 VAL D CG2 12285 N N . PHE D 238 ? 0.4530 0.5913 0.8164 -0.0442 -0.0072 -0.0090 297 PHE D N 12286 C CA . PHE D 238 ? 0.3446 0.4820 0.7143 -0.0436 -0.0122 -0.0144 297 PHE D CA 12287 C C . PHE D 238 ? 0.4307 0.5664 0.8085 -0.0454 -0.0129 -0.0141 297 PHE D C 12288 O O . PHE D 238 ? 0.5563 0.6898 0.9293 -0.0462 -0.0108 -0.0115 297 PHE D O 12289 C CB . PHE D 238 ? 0.3866 0.5205 0.7444 -0.0409 -0.0154 -0.0190 297 PHE D CB 12290 C CG . PHE D 238 ? 0.4813 0.6166 0.8393 -0.0388 -0.0185 -0.0233 297 PHE D CG 12291 C CD1 . PHE D 238 ? 0.3748 0.5138 0.7335 -0.0386 -0.0166 -0.0216 297 PHE D CD1 12292 C CD2 . PHE D 238 ? 0.3809 0.5137 0.7380 -0.0368 -0.0233 -0.0290 297 PHE D CD2 12293 C CE1 . PHE D 238 ? 0.4010 0.5414 0.7597 -0.0367 -0.0194 -0.0257 297 PHE D CE1 12294 C CE2 . PHE D 238 ? 0.4238 0.5578 0.7809 -0.0347 -0.0261 -0.0332 297 PHE D CE2 12295 C CZ . PHE D 238 ? 0.3923 0.5301 0.7501 -0.0346 -0.0241 -0.0315 297 PHE D CZ 12296 N N . LEU D 239 ? 0.5051 0.6420 0.8951 -0.0459 -0.0159 -0.0169 298 LEU D N 12297 C CA . LEU D 239 ? 0.4017 0.5366 0.7988 -0.0472 -0.0175 -0.0176 298 LEU D CA 12298 C C . LEU D 239 ? 0.4554 0.5857 0.8427 -0.0453 -0.0209 -0.0214 298 LEU D C 12299 O O . LEU D 239 ? 0.4852 0.6144 0.8643 -0.0429 -0.0232 -0.0248 298 LEU D O 12300 C CB . LEU D 239 ? 0.4878 0.6251 0.9003 -0.0480 -0.0202 -0.0200 298 LEU D CB 12301 C CG . LEU D 239 ? 0.5351 0.6766 0.9605 -0.0503 -0.0170 -0.0161 298 LEU D CG 12302 C CD1 . LEU D 239 ? 0.4818 0.6239 0.9026 -0.0516 -0.0113 -0.0100 298 LEU D CD1 12303 C CD2 . LEU D 239 ? 0.5172 0.6625 0.9489 -0.0496 -0.0181 -0.0179 298 LEU D CD2 12304 N N . PRO D 240 ? 0.4882 0.6157 0.8760 -0.0464 -0.0212 -0.0209 299 PRO D N 12305 C CA . PRO D 240 ? 0.4802 0.6031 0.8590 -0.0445 -0.0246 -0.0245 299 PRO D CA 12306 C C . PRO D 240 ? 0.4971 0.6193 0.8796 -0.0424 -0.0301 -0.0304 299 PRO D C 12307 O O . PRO D 240 ? 0.5778 0.7028 0.9725 -0.0431 -0.0315 -0.0316 299 PRO D O 12308 C CB . PRO D 240 ? 0.5085 0.6293 0.8907 -0.0464 -0.0241 -0.0227 299 PRO D CB 12309 C CG . PRO D 240 ? 0.5689 0.6932 0.9650 -0.0490 -0.0219 -0.0197 299 PRO D CG 12310 C CD . PRO D 240 ? 0.4673 0.5955 0.8635 -0.0491 -0.0186 -0.0170 299 PRO D CD 12311 N N . ASP D 241 ? 0.5699 0.6885 0.9420 -0.0398 -0.0329 -0.0340 300 ASP D N 12312 C CA . ASP D 241 ? 0.5225 0.6402 0.8962 -0.0372 -0.0380 -0.0399 300 ASP D CA 12313 C C . ASP D 241 ? 0.6607 0.7784 1.0475 -0.0380 -0.0415 -0.0421 300 ASP D C 12314 O O . ASP D 241 ? 0.7396 0.8557 1.1295 -0.0397 -0.0412 -0.0404 300 ASP D O 12315 C CB . ASP D 241 ? 0.6671 0.7801 1.0271 -0.0343 -0.0402 -0.0429 300 ASP D CB 12316 C CG . ASP D 241 ? 0.9576 1.0696 1.3167 -0.0310 -0.0448 -0.0488 300 ASP D CG 12317 O OD1 . ASP D 241 ? 1.0485 1.1634 1.4183 -0.0311 -0.0468 -0.0509 300 ASP D OD1 12318 O OD2 . ASP D 241 ? 1.1534 1.2618 1.5011 -0.0283 -0.0465 -0.0515 300 ASP D OD2 12319 N N . GLU D 242 ? 0.6232 0.7426 1.0176 -0.0367 -0.0449 -0.0461 301 GLU D N 12320 C CA . GLU D 242 ? 0.6754 0.7952 1.0833 -0.0374 -0.0484 -0.0485 301 GLU D CA 12321 C C . GLU D 242 ? 0.8518 0.9667 1.2563 -0.0358 -0.0524 -0.0516 301 GLU D C 12322 O O . GLU D 242 ? 0.8956 1.0099 1.3090 -0.0372 -0.0540 -0.0517 301 GLU D O 12323 C CB . GLU D 242 ? 0.7710 0.8935 1.1865 -0.0359 -0.0513 -0.0525 301 GLU D CB 12324 C CG . GLU D 242 ? 0.8230 0.9509 1.2482 -0.0382 -0.0481 -0.0494 301 GLU D CG 12325 C CD . GLU D 242 ? 0.9612 1.0918 1.3996 -0.0378 -0.0516 -0.0532 301 GLU D CD 12326 O OE1 . GLU D 242 ? 0.9824 1.1122 1.4178 -0.0348 -0.0553 -0.0581 301 GLU D OE1 12327 O OE2 . GLU D 242 ? 1.0885 1.2218 1.5403 -0.0404 -0.0507 -0.0513 301 GLU D OE2 12328 N N . SER D 243 ? 1.0038 1.1152 1.3953 -0.0329 -0.0540 -0.0541 302 SER D N 12329 C CA . SER D 243 ? 0.9227 1.0291 1.3093 -0.0310 -0.0577 -0.0570 302 SER D CA 12330 C C . SER D 243 ? 0.6233 0.7280 1.0091 -0.0335 -0.0554 -0.0530 302 SER D C 12331 O O . SER D 243 ? 0.6531 0.7552 1.0424 -0.0334 -0.0584 -0.0544 302 SER D O 12332 C CB . SER D 243 ? 0.9504 1.0533 1.3222 -0.0275 -0.0588 -0.0596 302 SER D CB 12333 O OG . SER D 243 ? 1.0144 1.1175 1.3756 -0.0284 -0.0540 -0.0557 302 SER D OG 12334 N N . ALA D 244 ? 0.6088 0.7149 0.9897 -0.0355 -0.0502 -0.0480 303 ALA D N 12335 C CA . ALA D 244 ? 0.5518 0.6565 0.9315 -0.0379 -0.0475 -0.0440 303 ALA D CA 12336 C C . ALA D 244 ? 0.6530 0.7611 1.0468 -0.0412 -0.0457 -0.0410 303 ALA D C 12337 O O . ALA D 244 ? 0.8147 0.9214 1.2139 -0.0426 -0.0467 -0.0405 303 ALA D O 12338 C CB . ALA D 244 ? 0.5652 0.6697 0.9330 -0.0384 -0.0429 -0.0402 303 ALA D CB 12339 N N . VAL D 245 ? 0.7058 0.8183 1.1053 -0.0425 -0.0428 -0.0390 304 VAL D N 12340 C CA . VAL D 245 ? 0.6444 0.7603 1.0573 -0.0456 -0.0406 -0.0360 304 VAL D CA 12341 C C . VAL D 245 ? 0.7257 0.8453 1.1504 -0.0453 -0.0427 -0.0386 304 VAL D C 12342 O O . VAL D 245 ? 0.7978 0.9207 1.2233 -0.0455 -0.0402 -0.0371 304 VAL D O 12343 C CB . VAL D 245 ? 0.4609 0.5791 0.8713 -0.0477 -0.0344 -0.0301 304 VAL D CB 12344 C CG1 . VAL D 245 ? 0.5631 0.6841 0.9871 -0.0508 -0.0321 -0.0269 304 VAL D CG1 12345 C CG2 . VAL D 245 ? 0.5382 0.6530 0.9361 -0.0477 -0.0324 -0.0278 304 VAL D CG2 12346 N N . PRO D 246 ? 0.7069 0.8256 1.1404 -0.0447 -0.0474 -0.0425 305 PRO D N 12347 C CA . PRO D 246 ? 0.7375 0.8593 1.1829 -0.0444 -0.0500 -0.0455 305 PRO D CA 12348 C C . PRO D 246 ? 0.7311 0.8575 1.1889 -0.0475 -0.0462 -0.0416 305 PRO D C 12349 O O . PRO D 246 ? 0.5480 0.6745 1.0076 -0.0501 -0.0426 -0.0371 305 PRO D O 12350 C CB . PRO D 246 ? 0.6438 0.7629 1.0952 -0.0434 -0.0555 -0.0498 305 PRO D CB 12351 C CG . PRO D 246 ? 0.7336 0.8492 1.1798 -0.0444 -0.0546 -0.0475 305 PRO D CG 12352 C CD . PRO D 246 ? 0.6678 0.7822 1.0995 -0.0440 -0.0508 -0.0445 305 PRO D CD 12353 N N . ARG D 247 ? 0.7152 0.8453 1.1814 -0.0473 -0.0471 -0.0433 306 ARG D N 12354 C CA . ARG D 247 ? 0.5628 0.6975 1.0403 -0.0499 -0.0434 -0.0396 306 ARG D CA 12355 C C . ARG D 247 ? 0.5362 0.6735 1.0298 -0.0504 -0.0465 -0.0426 306 ARG D C 12356 O O . ARG D 247 ? 0.5657 0.7020 1.0609 -0.0482 -0.0516 -0.0480 306 ARG D O 12357 C CB . ARG D 247 ? 0.6051 0.7424 1.0758 -0.0494 -0.0399 -0.0374 306 ARG D CB 12358 C CG . ARG D 247 ? 0.6143 0.7508 1.0754 -0.0506 -0.0346 -0.0319 306 ARG D CG 12359 C CD . ARG D 247 ? 0.5101 0.6489 0.9633 -0.0499 -0.0312 -0.0296 306 ARG D CD 12360 N NE . ARG D 247 ? 0.6510 0.7885 1.0947 -0.0468 -0.0344 -0.0339 306 ARG D NE 12361 C CZ . ARG D 247 ? 0.7368 0.8770 1.1837 -0.0454 -0.0361 -0.0367 306 ARG D CZ 12362 N NH1 . ARG D 247 ? 0.9537 1.0982 1.4134 -0.0470 -0.0350 -0.0355 306 ARG D NH1 12363 N NH2 . ARG D 247 ? 0.5990 0.7375 1.0361 -0.0425 -0.0388 -0.0406 306 ARG D NH2 12364 N N . LYS D 248 ? 0.5463 0.6868 1.0518 -0.0533 -0.0433 -0.0390 307 LYS D N 12365 C CA . LYS D 248 ? 0.5616 0.7047 1.0838 -0.0544 -0.0456 -0.0411 307 LYS D CA 12366 C C . LYS D 248 ? 0.4981 0.6463 1.0282 -0.0549 -0.0437 -0.0403 307 LYS D C 12367 O O . LYS D 248 ? 0.5634 0.7138 1.0906 -0.0560 -0.0387 -0.0357 307 LYS D O 12368 C CB . LYS D 248 ? 0.6064 0.7491 1.1378 -0.0574 -0.0436 -0.0379 307 LYS D CB 12369 C CG . LYS D 248 ? 0.8101 0.9483 1.3390 -0.0570 -0.0471 -0.0401 307 LYS D CG 12370 C CD . LYS D 248 ? 0.8537 0.9916 1.3899 -0.0600 -0.0442 -0.0361 307 LYS D CD 12371 C CE . LYS D 248 ? 0.9322 1.0737 1.4863 -0.0622 -0.0439 -0.0358 307 LYS D CE 12372 N NZ . LYS D 248 ? 0.8791 1.0206 1.4394 -0.0652 -0.0400 -0.0313 307 LYS D NZ 12373 N N . HIS D 249 ? 0.6362 0.7862 1.1764 -0.0541 -0.0478 -0.0448 308 HIS D N 12374 C CA . HIS D 249 ? 0.6304 0.7853 1.1795 -0.0545 -0.0466 -0.0446 308 HIS D CA 12375 C C . HIS D 249 ? 0.6179 0.7754 1.1858 -0.0565 -0.0477 -0.0453 308 HIS D C 12376 O O . HIS D 249 ? 0.5992 0.7558 1.1737 -0.0554 -0.0529 -0.0505 308 HIS D O 12377 C CB . HIS D 249 ? 0.6113 0.7665 1.1546 -0.0513 -0.0502 -0.0496 308 HIS D CB 12378 C CG . HIS D 249 ? 1.0491 1.2025 1.5747 -0.0493 -0.0486 -0.0487 308 HIS D CG 12379 N ND1 . HIS D 249 ? 1.2205 1.3767 1.7412 -0.0495 -0.0445 -0.0453 308 HIS D ND1 12380 C CD2 . HIS D 249 ? 1.1723 1.3213 1.6842 -0.0471 -0.0506 -0.0507 308 HIS D CD2 12381 C CE1 . HIS D 249 ? 1.2659 1.4196 1.7706 -0.0476 -0.0440 -0.0453 308 HIS D CE1 12382 N NE2 . HIS D 249 ? 1.1896 1.3388 1.6887 -0.0461 -0.0476 -0.0486 308 HIS D NE2 12383 N N . ASN D 250 ? 0.5737 0.7341 1.1501 -0.0594 -0.0428 -0.0402 309 ASN D N 12384 C CA . ASN D 250 ? 0.5441 0.7070 1.1386 -0.0616 -0.0432 -0.0404 309 ASN D CA 12385 C C . ASN D 250 ? 0.5128 0.6809 1.1168 -0.0626 -0.0405 -0.0386 309 ASN D C 12386 O O . ASN D 250 ? 0.6348 0.8047 1.2346 -0.0634 -0.0353 -0.0336 309 ASN D O 12387 C CB . ASN D 250 ? 0.4706 0.6319 1.0692 -0.0643 -0.0400 -0.0361 309 ASN D CB 12388 C CG . ASN D 250 ? 0.6150 0.7713 1.2070 -0.0636 -0.0433 -0.0382 309 ASN D CG 12389 O OD1 . ASN D 250 ? 0.6526 0.8062 1.2341 -0.0639 -0.0407 -0.0351 309 ASN D OD1 12390 N ND2 . ASN D 250 ? 0.5523 0.7074 1.1505 -0.0625 -0.0491 -0.0437 309 ASN D ND2 12391 N N . ARG D 251 ? 0.4331 0.6036 1.0499 -0.0624 -0.0441 -0.0426 310 ARG D N 12392 C CA . ARG D 251 ? 0.4090 0.5846 1.0369 -0.0635 -0.0418 -0.0412 310 ARG D CA 12393 C C . ARG D 251 ? 0.4463 0.6237 1.0843 -0.0668 -0.0364 -0.0352 310 ARG D C 12394 O O . ARG D 251 ? 0.4472 0.6228 1.0922 -0.0685 -0.0366 -0.0347 310 ARG D O 12395 C CB . ARG D 251 ? 0.3739 0.5514 1.0142 -0.0626 -0.0471 -0.0471 310 ARG D CB 12396 C CG . ARG D 251 ? 0.7519 0.9303 1.3848 -0.0594 -0.0504 -0.0517 310 ARG D CG 12397 C CD . ARG D 251 ? 0.7922 0.9705 1.4335 -0.0578 -0.0570 -0.0588 310 ARG D CD 12398 N NE . ARG D 251 ? 0.8285 1.0064 1.4595 -0.0542 -0.0605 -0.0635 310 ARG D NE 12399 C CZ . ARG D 251 ? 0.8084 0.9819 1.4246 -0.0516 -0.0629 -0.0659 310 ARG D CZ 12400 N NH1 . ARG D 251 ? 0.7688 0.9383 1.3790 -0.0522 -0.0625 -0.0641 310 ARG D NH1 12401 N NH2 . ARG D 251 ? 0.7576 0.9310 1.3652 -0.0483 -0.0658 -0.0702 310 ARG D NH2 12402 N N . SER D 252 ? 0.3950 0.5757 1.0335 -0.0676 -0.0315 -0.0307 311 SER D N 12403 C CA . SER D 252 ? 0.4204 0.6029 1.0682 -0.0704 -0.0259 -0.0248 311 SER D CA 12404 C C . SER D 252 ? 0.4474 0.6331 1.1149 -0.0721 -0.0270 -0.0263 311 SER D C 12405 O O . SER D 252 ? 0.4175 0.6060 1.0911 -0.0712 -0.0299 -0.0300 311 SER D O 12406 C CB . SER D 252 ? 0.3396 0.5244 0.9812 -0.0704 -0.0204 -0.0195 311 SER D CB 12407 O OG . SER D 252 ? 0.3298 0.5162 0.9802 -0.0728 -0.0148 -0.0137 311 SER D OG 12408 N N . PRO D 253 ? 0.3732 0.5582 1.0507 -0.0746 -0.0248 -0.0236 312 PRO D N 12409 C CA . PRO D 253 ? 0.3540 0.5421 1.0509 -0.0766 -0.0249 -0.0242 312 PRO D CA 12410 C C . PRO D 253 ? 0.5053 0.6980 1.2088 -0.0774 -0.0204 -0.0203 312 PRO D C 12411 O O . PRO D 253 ? 0.3268 0.5229 1.0458 -0.0785 -0.0210 -0.0215 312 PRO D O 12412 C CB . PRO D 253 ? 0.3282 0.5138 1.0305 -0.0790 -0.0225 -0.0212 312 PRO D CB 12413 C CG . PRO D 253 ? 0.4775 0.6584 1.1637 -0.0779 -0.0234 -0.0212 312 PRO D CG 12414 C CD . PRO D 253 ? 0.4116 0.5927 1.0825 -0.0757 -0.0224 -0.0204 312 PRO D CD 12415 N N . TYR D 254 ? 0.3252 0.5180 1.0171 -0.0767 -0.0159 -0.0157 313 TYR D N 12416 C CA . TYR D 254 ? 0.3849 0.5820 1.0809 -0.0771 -0.0116 -0.0118 313 TYR D CA 12417 C C . TYR D 254 ? 0.3234 0.5220 1.0087 -0.0745 -0.0134 -0.0140 313 TYR D C 12418 O O . TYR D 254 ? 0.3485 0.5493 1.0298 -0.0741 -0.0095 -0.0099 313 TYR D O 12419 C CB . TYR D 254 ? 0.3227 0.5190 1.0146 -0.0782 -0.0046 -0.0044 313 TYR D CB 12420 C CG . TYR D 254 ? 0.6161 0.8120 1.3211 -0.0809 -0.0017 -0.0015 313 TYR D CG 12421 C CD1 . TYR D 254 ? 0.3228 0.5223 1.0426 -0.0825 0.0019 0.0016 313 TYR D CD1 12422 C CD2 . TYR D 254 ? 0.3240 0.5157 1.0264 -0.0817 -0.0026 -0.0020 313 TYR D CD2 12423 C CE1 . TYR D 254 ? 0.3233 0.5222 1.0550 -0.0849 0.0047 0.0042 313 TYR D CE1 12424 C CE2 . TYR D 254 ? 0.4318 0.6230 1.1459 -0.0841 0.0001 0.0006 313 TYR D CE2 12425 C CZ . TYR D 254 ? 0.3818 0.5766 1.1105 -0.0856 0.0038 0.0036 313 TYR D CZ 12426 O OH . TYR D 254 ? 0.4117 0.6058 1.1519 -0.0879 0.0067 0.0062 313 TYR D OH 12427 N N . ARG D 255 ? 0.3333 0.5304 1.0137 -0.0726 -0.0195 -0.0203 314 ARG D N 12428 C CA . ARG D 255 ? 0.3244 0.5230 0.9962 -0.0700 -0.0220 -0.0234 314 ARG D CA 12429 C C . ARG D 255 ? 0.4009 0.6047 1.0848 -0.0704 -0.0213 -0.0235 314 ARG D C 12430 O O . ARG D 255 ? 0.4522 0.6580 1.1524 -0.0719 -0.0226 -0.0251 314 ARG D O 12431 C CB . ARG D 255 ? 0.3260 0.5220 0.9928 -0.0679 -0.0288 -0.0307 314 ARG D CB 12432 C CG . ARG D 255 ? 0.5074 0.7046 1.1647 -0.0650 -0.0316 -0.0343 314 ARG D CG 12433 C CD . ARG D 255 ? 0.7328 0.9271 1.3859 -0.0627 -0.0384 -0.0416 314 ARG D CD 12434 N NE . ARG D 255 ? 0.6980 0.8930 1.3409 -0.0597 -0.0408 -0.0451 314 ARG D NE 12435 C CZ . ARG D 255 ? 0.7175 0.9159 1.3675 -0.0587 -0.0434 -0.0489 314 ARG D CZ 12436 N NH1 . ARG D 255 ? 0.6254 0.8270 1.2933 -0.0604 -0.0439 -0.0496 314 ARG D NH1 12437 N NH2 . ARG D 255 ? 0.8466 1.0453 1.4859 -0.0558 -0.0454 -0.0519 314 ARG D NH2 12438 N N . ARG D 256 ? 0.3230 0.5290 0.9986 -0.0690 -0.0195 -0.0218 315 ARG D N 12439 C CA . ARG D 256 ? 0.3905 0.6015 1.0760 -0.0690 -0.0189 -0.0219 315 ARG D CA 12440 C C . ARG D 256 ? 0.4139 0.6261 1.1015 -0.0671 -0.0252 -0.0294 315 ARG D C 12441 O O . ARG D 256 ? 0.3803 0.5892 1.0609 -0.0655 -0.0299 -0.0344 315 ARG D O 12442 C CB . ARG D 256 ? 0.3210 0.5338 0.9965 -0.0682 -0.0143 -0.0168 315 ARG D CB 12443 C CG . ARG D 256 ? 0.3198 0.5325 0.9967 -0.0701 -0.0076 -0.0091 315 ARG D CG 12444 C CD . ARG D 256 ? 0.3184 0.5318 0.9824 -0.0689 -0.0035 -0.0044 315 ARG D CD 12445 N NE . ARG D 256 ? 0.3173 0.5327 0.9883 -0.0705 0.0027 0.0026 315 ARG D NE 12446 C CZ . ARG D 256 ? 0.3167 0.5297 0.9838 -0.0714 0.0072 0.0079 315 ARG D CZ 12447 N NH1 . ARG D 256 ? 0.3842 0.5927 1.0404 -0.0710 0.0061 0.0071 315 ARG D NH1 12448 N NH2 . ARG D 256 ? 0.4559 0.6707 1.1299 -0.0725 0.0128 0.0141 315 ARG D NH2 12449 N N . THR D 257 ? 0.3235 0.5403 1.0210 -0.0671 -0.0253 -0.0302 316 THR D N 12450 C CA . THR D 257 ? 0.3247 0.5431 1.0269 -0.0655 -0.0311 -0.0373 316 THR D CA 12451 C C . THR D 257 ? 0.3248 0.5427 1.0108 -0.0622 -0.0334 -0.0403 316 THR D C 12452 O O . THR D 257 ? 0.3862 0.6030 1.0700 -0.0601 -0.0390 -0.0470 316 THR D O 12453 C CB . THR D 257 ? 0.3244 0.5481 1.0436 -0.0667 -0.0303 -0.0372 316 THR D CB 12454 O OG1 . THR D 257 ? 0.6391 0.8659 1.3537 -0.0665 -0.0258 -0.0324 316 THR D OG1 12455 C CG2 . THR D 257 ? 0.4906 0.7149 1.2267 -0.0699 -0.0280 -0.0345 316 THR D CG2 12456 N N . TYR D 258 ? 0.3234 0.5419 0.9982 -0.0618 -0.0290 -0.0354 317 TYR D N 12457 C CA . TYR D 258 ? 0.3679 0.5862 1.0270 -0.0589 -0.0304 -0.0374 317 TYR D CA 12458 C C . TYR D 258 ? 0.3241 0.5461 0.9893 -0.0574 -0.0340 -0.0426 317 TYR D C 12459 O O . TYR D 258 ? 0.3252 0.5459 0.9817 -0.0546 -0.0384 -0.0481 317 TYR D O 12460 C CB . TYR D 258 ? 0.3245 0.5376 0.9690 -0.0569 -0.0337 -0.0408 317 TYR D CB 12461 C CG . TYR D 258 ? 0.3579 0.5675 0.9928 -0.0580 -0.0297 -0.0355 317 TYR D CG 12462 C CD1 . TYR D 258 ? 0.3228 0.5311 0.9408 -0.0566 -0.0271 -0.0324 317 TYR D CD1 12463 C CD2 . TYR D 258 ? 0.3237 0.5314 0.9664 -0.0603 -0.0286 -0.0334 317 TYR D CD2 12464 C CE1 . TYR D 258 ? 0.3220 0.5273 0.9314 -0.0575 -0.0235 -0.0276 317 TYR D CE1 12465 C CE2 . TYR D 258 ? 0.3230 0.5276 0.9568 -0.0612 -0.0249 -0.0286 317 TYR D CE2 12466 C CZ . TYR D 258 ? 0.3601 0.5636 0.9775 -0.0597 -0.0224 -0.0258 317 TYR D CZ 12467 O OH . TYR D 258 ? 0.3335 0.5339 0.9421 -0.0605 -0.0189 -0.0212 317 TYR D OH 12468 N N . SER D 259 ? 0.3235 0.5499 1.0039 -0.0591 -0.0321 -0.0407 318 SER D N 12469 C CA . SER D 259 ? 0.3239 0.5545 1.0113 -0.0580 -0.0348 -0.0447 318 SER D CA 12470 C C . SER D 259 ? 0.4405 0.6759 1.1364 -0.0596 -0.0299 -0.0391 318 SER D C 12471 O O . SER D 259 ? 0.3216 0.5574 1.0263 -0.0622 -0.0256 -0.0337 318 SER D O 12472 C CB . SER D 259 ? 0.3255 0.5564 1.0276 -0.0582 -0.0400 -0.0511 318 SER D CB 12473 O OG . SER D 259 ? 0.3255 0.5613 1.0402 -0.0583 -0.0410 -0.0531 318 SER D OG 12474 N N . LYS D 260 ? 0.3689 0.6076 1.0617 -0.0580 -0.0303 -0.0403 319 LYS D N 12475 C CA . LYS D 260 ? 0.3208 0.5641 1.0212 -0.0592 -0.0259 -0.0352 319 LYS D CA 12476 C C . LYS D 260 ? 0.3213 0.5686 1.0422 -0.0606 -0.0277 -0.0380 319 LYS D C 12477 O O . LYS D 260 ? 0.4988 0.7500 1.2298 -0.0621 -0.0239 -0.0337 319 LYS D O 12478 C CB . LYS D 260 ? 0.3202 0.5653 1.0073 -0.0569 -0.0251 -0.0345 319 LYS D CB 12479 C CG . LYS D 260 ? 0.3542 0.5996 1.0355 -0.0540 -0.0308 -0.0423 319 LYS D CG 12480 C CD . LYS D 260 ? 0.3209 0.5672 0.9861 -0.0517 -0.0294 -0.0407 319 LYS D CD 12481 C CE . LYS D 260 ? 0.3667 0.6133 1.0256 -0.0486 -0.0348 -0.0484 319 LYS D CE 12482 N NZ . LYS D 260 ? 0.5856 0.8272 1.2357 -0.0469 -0.0391 -0.0538 319 LYS D NZ 12483 N N . LYS D 261 ? 0.3359 0.5823 1.0629 -0.0599 -0.0334 -0.0452 320 LYS D N 12484 C CA . LYS D 261 ? 0.4633 0.7131 1.2103 -0.0612 -0.0355 -0.0483 320 LYS D CA 12485 C C . LYS D 261 ? 0.4355 0.6846 1.1963 -0.0645 -0.0327 -0.0445 320 LYS D C 12486 O O . LYS D 261 ? 0.5416 0.7940 1.3141 -0.0666 -0.0284 -0.0397 320 LYS D O 12487 C CB . LYS D 261 ? 0.5029 0.7518 1.2523 -0.0591 -0.0428 -0.0575 320 LYS D CB 12488 C CG . LYS D 261 ? 0.7425 0.9915 1.4785 -0.0555 -0.0465 -0.0628 320 LYS D CG 12489 C CD . LYS D 261 ? 0.8428 1.0876 1.5568 -0.0535 -0.0457 -0.0613 320 LYS D CD 12490 C CE . LYS D 261 ? 0.7267 0.9717 1.4282 -0.0499 -0.0493 -0.0666 320 LYS D CE 12491 N NZ . LYS D 261 ? 0.6405 0.8814 1.3208 -0.0480 -0.0483 -0.0652 320 LYS D NZ 12492 N N . ASN D 262 ? 0.4655 0.7103 1.2246 -0.0647 -0.0351 -0.0467 321 ASN D N 12493 C CA . ASN D 262 ? 0.3987 0.6420 1.1683 -0.0677 -0.0325 -0.0431 321 ASN D CA 12494 C C . ASN D 262 ? 0.3230 0.5630 1.0799 -0.0683 -0.0276 -0.0366 321 ASN D C 12495 O O . ASN D 262 ? 0.4828 0.7183 1.2277 -0.0673 -0.0294 -0.0380 321 ASN D O 12496 C CB . ASN D 262 ? 0.4568 0.6973 1.2330 -0.0677 -0.0380 -0.0492 321 ASN D CB 12497 C CG . ASN D 262 ? 0.5886 0.8319 1.3754 -0.0665 -0.0436 -0.0565 321 ASN D CG 12498 O OD1 . ASN D 262 ? 0.5952 0.8422 1.3994 -0.0682 -0.0431 -0.0566 321 ASN D OD1 12499 N ND2 . ASN D 262 ? 0.4208 0.6622 1.1971 -0.0634 -0.0489 -0.0628 321 ASN D ND2 12500 N N . GLN D 263 ? 0.3216 0.5638 1.0809 -0.0698 -0.0214 -0.0295 322 GLN D N 12501 C CA . GLN D 263 ? 0.3205 0.5600 1.0666 -0.0700 -0.0165 -0.0231 322 GLN D CA 12502 C C . GLN D 263 ? 0.3205 0.5575 1.0735 -0.0725 -0.0132 -0.0190 322 GLN D C 12503 O O . GLN D 263 ? 0.3197 0.5544 1.0632 -0.0728 -0.0089 -0.0135 322 GLN D O 12504 C CB . GLN D 263 ? 0.3190 0.5618 1.0620 -0.0697 -0.0115 -0.0173 322 GLN D CB 12505 C CG . GLN D 263 ? 0.3189 0.5641 1.0533 -0.0671 -0.0141 -0.0205 322 GLN D CG 12506 C CD . GLN D 263 ? 0.3175 0.5663 1.0508 -0.0670 -0.0092 -0.0147 322 GLN D CD 12507 O OE1 . GLN D 263 ? 0.3165 0.5652 1.0511 -0.0684 -0.0036 -0.0077 322 GLN D OE1 12508 N NE2 . GLN D 263 ? 0.3175 0.5695 1.0484 -0.0652 -0.0113 -0.0176 322 GLN D NE2 12509 N N . VAL D 264 ? 0.3215 0.5590 1.0908 -0.0743 -0.0153 -0.0217 323 VAL D N 12510 C CA . VAL D 264 ? 0.3215 0.5572 1.0993 -0.0769 -0.0119 -0.0178 323 VAL D CA 12511 C C . VAL D 264 ? 0.3230 0.5549 1.1026 -0.0772 -0.0165 -0.0226 323 VAL D C 12512 O O . VAL D 264 ? 0.5224 0.7554 1.3145 -0.0776 -0.0209 -0.0278 323 VAL D O 12513 C CB . VAL D 264 ? 0.3214 0.5610 1.1190 -0.0792 -0.0088 -0.0151 323 VAL D CB 12514 C CG1 . VAL D 264 ? 0.3216 0.5591 1.1276 -0.0818 -0.0053 -0.0112 323 VAL D CG1 12515 C CG2 . VAL D 264 ? 0.3200 0.5632 1.1160 -0.0788 -0.0040 -0.0098 323 VAL D CG2 12516 N N . ALA D 265 ? 0.3230 0.5503 1.0901 -0.0770 -0.0156 -0.0208 324 ALA D N 12517 C CA . ALA D 265 ? 0.3242 0.5477 1.0925 -0.0775 -0.0193 -0.0244 324 ALA D CA 12518 C C . ALA D 265 ? 0.3246 0.5482 1.1093 -0.0805 -0.0167 -0.0218 324 ALA D C 12519 O O . ALA D 265 ? 0.3237 0.5496 1.1154 -0.0821 -0.0111 -0.0161 324 ALA D O 12520 C CB . ALA D 265 ? 0.3240 0.5428 1.0738 -0.0764 -0.0187 -0.0229 324 ALA D CB 12521 N N . GLU D 266 ? 0.3419 0.5632 1.1327 -0.0811 -0.0209 -0.0260 325 GLU D N 12522 C CA . GLU D 266 ? 0.3266 0.5476 1.1328 -0.0840 -0.0191 -0.0242 325 GLU D CA 12523 C C . GLU D 266 ? 0.3592 0.5784 1.1617 -0.0856 -0.0123 -0.0167 325 GLU D C 12524 O O . GLU D 266 ? 0.3256 0.5465 1.1409 -0.0878 -0.0079 -0.0127 325 GLU D O 12525 C CB . GLU D 266 ? 0.3282 0.5461 1.1375 -0.0840 -0.0249 -0.0298 325 GLU D CB 12526 C CG . GLU D 266 ? 0.4700 0.6872 1.2946 -0.0869 -0.0233 -0.0283 325 GLU D CG 12527 C CD . GLU D 266 ? 0.6213 0.8356 1.4494 -0.0867 -0.0295 -0.0341 325 GLU D CD 12528 O OE1 . GLU D 266 ? 0.6416 0.8545 1.4615 -0.0842 -0.0352 -0.0397 325 GLU D OE1 12529 O OE2 . GLU D 266 ? 0.6076 0.8207 1.4465 -0.0890 -0.0286 -0.0331 325 GLU D OE2 12530 N N . TRP D 267 ? 0.3253 0.5408 1.1104 -0.0844 -0.0114 -0.0150 326 TRP D N 12531 C CA . TRP D 267 ? 0.3246 0.5379 1.1048 -0.0856 -0.0053 -0.0083 326 TRP D CA 12532 C C . TRP D 267 ? 0.3764 0.5926 1.1569 -0.0858 0.0011 -0.0019 326 TRP D C 12533 O O . TRP D 267 ? 0.3228 0.5378 1.1032 -0.0870 0.0068 0.0040 326 TRP D O 12534 C CB . TRP D 267 ? 0.3245 0.5332 1.0854 -0.0841 -0.0062 -0.0084 326 TRP D CB 12535 C CG . TRP D 267 ? 0.3984 0.6075 1.1438 -0.0814 -0.0074 -0.0094 326 TRP D CG 12536 C CD1 . TRP D 267 ? 0.4231 0.6317 1.1615 -0.0793 -0.0134 -0.0155 326 TRP D CD1 12537 C CD2 . TRP D 267 ? 0.3222 0.5321 1.0568 -0.0806 -0.0025 -0.0041 326 TRP D CD2 12538 N NE1 . TRP D 267 ? 0.4002 0.6092 1.1242 -0.0772 -0.0124 -0.0144 326 TRP D NE1 12539 C CE2 . TRP D 267 ? 0.3220 0.5319 1.0434 -0.0780 -0.0058 -0.0074 326 TRP D CE2 12540 C CE3 . TRP D 267 ? 0.3453 0.5558 1.0800 -0.0815 0.0044 0.0031 326 TRP D CE3 12541 C CZ2 . TRP D 267 ? 0.3207 0.5312 1.0293 -0.0765 -0.0026 -0.0037 326 TRP D CZ2 12542 C CZ3 . TRP D 267 ? 0.3199 0.5309 1.0418 -0.0800 0.0075 0.0068 326 TRP D CZ3 12543 C CH2 . TRP D 267 ? 0.3197 0.5308 1.0287 -0.0776 0.0040 0.0034 326 TRP D CH2 12544 N N . GLN D 268 ? 0.3226 0.5425 1.1034 -0.0845 0.0002 -0.0032 327 GLN D N 12545 C CA . GLN D 268 ? 0.3665 0.5894 1.1475 -0.0845 0.0058 0.0026 327 GLN D CA 12546 C C . GLN D 268 ? 0.4399 0.6665 1.2413 -0.0866 0.0084 0.0044 327 GLN D C 12547 O O . GLN D 268 ? 0.3207 0.5493 1.1254 -0.0871 0.0141 0.0103 327 GLN D O 12548 C CB . GLN D 268 ? 0.3206 0.5459 1.0920 -0.0821 0.0037 0.0006 327 GLN D CB 12549 C CG . GLN D 268 ? 0.3200 0.5422 1.0701 -0.0800 0.0038 0.0015 327 GLN D CG 12550 C CD . GLN D 268 ? 0.3196 0.5437 1.0604 -0.0775 0.0004 -0.0020 327 GLN D CD 12551 O OE1 . GLN D 268 ? 0.3205 0.5459 1.0663 -0.0768 -0.0049 -0.0082 327 GLN D OE1 12552 N NE2 . GLN D 268 ? 0.3185 0.5425 1.0455 -0.0760 0.0035 0.0018 327 GLN D NE2 12553 N N . SER D 269 ? 0.4801 0.7074 1.2949 -0.0877 0.0041 -0.0007 328 SER D N 12554 C CA . SER D 269 ? 0.5150 0.7457 1.3501 -0.0897 0.0057 0.0001 328 SER D CA 12555 C C . SER D 269 ? 0.5547 0.7825 1.3996 -0.0919 0.0067 0.0007 328 SER D C 12556 O O . SER D 269 ? 0.7181 0.9450 1.5708 -0.0927 0.0105 0.0039 328 SER D O 12557 C CB . SER D 269 ? 0.3237 0.5579 1.1677 -0.0891 0.0000 -0.0064 328 SER D CB 12558 O OG . SER D 269 ? 0.5352 0.7668 1.3758 -0.0883 -0.0067 -0.0132 328 SER D OG 12559 N N . SER D 270 ? 0.4918 0.7160 1.3310 -0.0920 0.0035 -0.0021 329 SER D N 12560 C CA . SER D 270 ? 0.4170 0.6375 1.2629 -0.0937 0.0037 -0.0021 329 SER D CA 12561 C C . SER D 270 ? 0.4169 0.6342 1.2561 -0.0946 0.0092 0.0038 329 SER D C 12562 O O . SER D 270 ? 0.5138 0.7292 1.3385 -0.0935 0.0095 0.0049 329 SER D O 12563 C CB . SER D 270 ? 0.4070 0.6258 1.2535 -0.0934 -0.0037 -0.0093 329 SER D CB 12564 O OG . SER D 270 ? 0.6468 0.8612 1.4957 -0.0947 -0.0034 -0.0089 329 SER D OG 12565 N N . MSE D 271 ? 0.4370 0.6520 1.2827 -0.0956 0.0136 0.0075 330 MSE D N 12566 C CA . MSE D 271 ? 0.5713 0.7832 1.4118 -0.0963 0.0196 0.0137 330 MSE D CA 12567 C C . MSE D 271 ? 0.7044 0.9122 1.5418 -0.0972 0.0174 0.0118 330 MSE D C 12568 O O . MSE D 271 ? 0.5726 0.7786 1.4008 -0.0974 0.0201 0.0150 330 MSE D O 12569 C CB . MSE D 271 ? 0.8022 1.0131 1.6510 -0.0967 0.0251 0.0182 330 MSE D CB 12570 C CG . MSE D 271 ? 0.9171 1.1244 1.7619 -0.0973 0.0314 0.0242 330 MSE D CG 12571 SE SE . MSE D 271 ? 2.7481 2.9539 3.6044 -0.0976 0.0379 0.0292 330 MSE D SE 12572 C CE . MSE D 271 ? 0.5302 0.7351 1.4006 -0.0988 0.0314 0.0219 330 MSE D CE 12573 N N . ASN D 272 ? 0.4421 0.6484 1.2871 -0.0977 0.0125 0.0067 331 ASN D N 12574 C CA . ASN D 272 ? 0.4086 0.6109 1.2516 -0.0986 0.0100 0.0046 331 ASN D CA 12575 C C . ASN D 272 ? 0.4426 0.6454 1.2791 -0.0979 0.0034 -0.0008 331 ASN D C 12576 O O . ASN D 272 ? 0.4633 0.6632 1.2994 -0.0983 -0.0005 -0.0042 331 ASN D O 12577 C CB . ASN D 272 ? 0.5004 0.7005 1.3550 -0.0994 0.0081 0.0021 331 ASN D CB 12578 C CG . ASN D 272 ? 0.5559 0.7556 1.4180 -0.1000 0.0143 0.0070 331 ASN D CG 12579 O OD1 . ASN D 272 ? 0.3434 0.5409 1.2021 -0.1005 0.0201 0.0125 331 ASN D OD1 12580 N ND2 . ASN D 272 ? 0.6521 0.8539 1.5244 -0.0998 0.0130 0.0050 331 ASN D ND2 12581 N N . TYR D 273 ? 0.4421 0.6478 1.2714 -0.0964 0.0022 -0.0017 332 TYR D N 12582 C CA . TYR D 273 ? 0.5030 0.7068 1.3191 -0.0941 -0.0039 -0.0069 332 TYR D CA 12583 C C . TYR D 273 ? 0.4642 0.6628 1.2665 -0.0937 -0.0045 -0.0066 332 TYR D C 12584 O O . TYR D 273 ? 0.4475 0.6437 1.2466 -0.0929 -0.0103 -0.0117 332 TYR D O 12585 C CB . TYR D 273 ? 0.3532 0.5592 1.1582 -0.0919 -0.0034 -0.0063 332 TYR D CB 12586 C CG . TYR D 273 ? 0.3278 0.5319 1.1187 -0.0893 -0.0093 -0.0116 332 TYR D CG 12587 C CD1 . TYR D 273 ? 0.3457 0.5512 1.1421 -0.0883 -0.0157 -0.0183 332 TYR D CD1 12588 C CD2 . TYR D 273 ? 0.3272 0.5280 1.0994 -0.0879 -0.0084 -0.0099 332 TYR D CD2 12589 C CE1 . TYR D 273 ? 0.3290 0.5326 1.1124 -0.0857 -0.0210 -0.0231 332 TYR D CE1 12590 C CE2 . TYR D 273 ? 0.3275 0.5264 1.0869 -0.0855 -0.0136 -0.0146 332 TYR D CE2 12591 C CZ . TYR D 273 ? 0.3284 0.5287 1.0933 -0.0844 -0.0198 -0.0212 332 TYR D CZ 12592 O OH . TYR D 273 ? 0.3288 0.5270 1.0809 -0.0818 -0.0249 -0.0259 332 TYR D OH 12593 N N . CYS D 274 ? 0.4454 0.6423 1.2396 -0.0941 0.0014 -0.0006 333 CYS D N 12594 C CA . CYS D 274 ? 0.4868 0.6788 1.2674 -0.0937 0.0013 0.0001 333 CYS D CA 12595 C C . CYS D 274 ? 0.6016 0.7910 1.3908 -0.0954 -0.0007 -0.0018 333 CYS D C 12596 O O . CYS D 274 ? 0.6055 0.7916 1.3871 -0.0947 -0.0052 -0.0053 333 CYS D O 12597 C CB . CYS D 274 ? 0.3311 0.5221 1.1028 -0.0937 0.0085 0.0070 333 CYS D CB 12598 S SG . CYS D 274 ? 0.5090 0.6943 1.2618 -0.0929 0.0087 0.0082 333 CYS D SG 12599 N N . THR D 275 ? 0.5153 0.7062 1.3201 -0.0977 0.0027 0.0007 334 THR D N 12600 C CA . THR D 275 ? 0.4210 0.6098 1.2356 -0.0996 0.0014 -0.0006 334 THR D CA 12601 C C . THR D 275 ? 0.4312 0.6199 1.2519 -0.0992 -0.0066 -0.0078 334 THR D C 12602 O O . THR D 275 ? 0.4683 0.6534 1.2856 -0.0993 -0.0102 -0.0105 334 THR D O 12603 C CB . THR D 275 ? 0.4715 0.6610 1.2993 -0.1013 0.0065 0.0032 334 THR D CB 12604 O OG1 . THR D 275 ? 0.5668 0.7554 1.3888 -0.1016 0.0139 0.0099 334 THR D OG1 12605 C CG2 . THR D 275 ? 0.3386 0.5245 1.1732 -0.1022 0.0043 0.0009 334 THR D CG2 12606 N N . ASP D 276 ? 0.3344 0.5270 1.1638 -0.0987 -0.0093 -0.0110 335 ASP D N 12607 C CA . ASP D 276 ? 0.3350 0.5278 1.1721 -0.0982 -0.0167 -0.0179 335 ASP D CA 12608 C C . ASP D 276 ? 0.3974 0.5887 1.2210 -0.0954 -0.0228 -0.0230 335 ASP D C 12609 O O . ASP D 276 ? 0.4905 0.6799 1.3156 -0.0948 -0.0289 -0.0282 335 ASP D O 12610 C CB . ASP D 276 ? 0.3378 0.5333 1.1858 -0.0978 -0.0169 -0.0193 335 ASP D CB 12611 C CG . ASP D 276 ? 0.4577 0.6523 1.3132 -0.0992 -0.0107 -0.0143 335 ASP D CG 12612 O OD1 . ASP D 276 ? 0.7044 0.8954 1.5598 -0.1004 -0.0084 -0.0119 335 ASP D OD1 12613 O OD2 . ASP D 276 ? 0.4179 0.6153 1.2795 -0.0989 -0.0082 -0.0129 335 ASP D OD2 12614 N N . LYS D 277 ? 0.4758 0.6678 1.2860 -0.0936 -0.0213 -0.0215 336 LYS D N 12615 C CA . LYS D 277 ? 0.4178 0.6089 1.2163 -0.0907 -0.0270 -0.0266 336 LYS D CA 12616 C C . LYS D 277 ? 0.4077 0.5948 1.1858 -0.0890 -0.0268 -0.0255 336 LYS D C 12617 O O . LYS D 277 ? 0.4694 0.6546 1.2381 -0.0867 -0.0321 -0.0301 336 LYS D O 12618 C CB . LYS D 277 ? 0.3578 0.5533 1.1575 -0.0894 -0.0269 -0.0274 336 LYS D CB 12619 C CG . LYS D 277 ? 0.3599 0.5597 1.1792 -0.0906 -0.0279 -0.0294 336 LYS D CG 12620 C CD . LYS D 277 ? 0.4173 0.6165 1.2435 -0.0897 -0.0356 -0.0369 336 LYS D CD 12621 C CE . LYS D 277 ? 0.5204 0.7238 1.3670 -0.0911 -0.0367 -0.0390 336 LYS D CE 12622 N NZ . LYS D 277 ? 0.3341 0.5420 1.1817 -0.0900 -0.0358 -0.0392 336 LYS D NZ 12623 N N . VAL D 278 ? 0.3322 0.5179 1.1033 -0.0900 -0.0207 -0.0194 337 VAL D N 12624 C CA . VAL D 278 ? 0.3317 0.5137 1.0834 -0.0884 -0.0203 -0.0182 337 VAL D CA 12625 C C . VAL D 278 ? 0.4172 0.5950 1.1655 -0.0897 -0.0190 -0.0162 337 VAL D C 12626 O O . VAL D 278 ? 0.4633 0.6373 1.2000 -0.0883 -0.0224 -0.0185 337 VAL D O 12627 C CB . VAL D 278 ? 0.4123 0.5959 1.1539 -0.0877 -0.0148 -0.0132 337 VAL D CB 12628 C CG1 . VAL D 278 ? 0.3369 0.5255 1.0888 -0.0878 -0.0133 -0.0128 337 VAL D CG1 12629 C CG2 . VAL D 278 ? 0.3293 0.5112 1.0668 -0.0891 -0.0081 -0.0067 337 VAL D CG2 12630 N N . LYS D 279 ? 0.3324 0.5106 1.0903 -0.0921 -0.0141 -0.0118 338 LYS D N 12631 C CA . LYS D 279 ? 0.3332 0.5074 1.0887 -0.0934 -0.0127 -0.0099 338 LYS D CA 12632 C C . LYS D 279 ? 0.5035 0.6755 1.2638 -0.0935 -0.0192 -0.0154 338 LYS D C 12633 O O . LYS D 279 ? 0.5543 0.7223 1.3085 -0.0937 -0.0201 -0.0153 338 LYS D O 12634 C CB . LYS D 279 ? 0.3801 0.5554 1.1466 -0.0959 -0.0062 -0.0045 338 LYS D CB 12635 C CG . LYS D 279 ? 0.4004 0.5758 1.1577 -0.0957 0.0009 0.0018 338 LYS D CG 12636 C CD . LYS D 279 ? 0.3318 0.5083 1.1008 -0.0980 0.0073 0.0070 338 LYS D CD 12637 C CE . LYS D 279 ? 0.3709 0.5467 1.1295 -0.0975 0.0142 0.0133 338 LYS D CE 12638 N NZ . LYS D 279 ? 0.3978 0.5746 1.1676 -0.0993 0.0208 0.0184 338 LYS D NZ 12639 N N . THR D 280 ? 0.4710 0.6454 1.2423 -0.0931 -0.0239 -0.0201 339 THR D N 12640 C CA . THR D 280 ? 0.3373 0.5100 1.1150 -0.0929 -0.0306 -0.0257 339 THR D CA 12641 C C . THR D 280 ? 0.4806 0.6512 1.2455 -0.0898 -0.0368 -0.0308 339 THR D C 12642 O O . THR D 280 ? 0.6272 0.7959 1.3950 -0.0890 -0.0429 -0.0358 339 THR D O 12643 C CB . THR D 280 ? 0.3595 0.5360 1.1568 -0.0940 -0.0326 -0.0285 339 THR D CB 12644 O OG1 . THR D 280 ? 0.4273 0.6074 1.2248 -0.0925 -0.0336 -0.0303 339 THR D OG1 12645 C CG2 . THR D 280 ? 0.3378 0.5161 1.1486 -0.0971 -0.0266 -0.0236 339 THR D CG2 12646 N N . LYS D 281 ? 0.3514 0.5222 1.1023 -0.0880 -0.0353 -0.0296 340 LYS D N 12647 C CA . LYS D 281 ? 0.5871 0.7558 1.3250 -0.0849 -0.0407 -0.0342 340 LYS D CA 12648 C C . LYS D 281 ? 0.6977 0.8613 1.4235 -0.0842 -0.0425 -0.0346 340 LYS D C 12649 O O . LYS D 281 ? 0.6537 0.8153 1.3748 -0.0857 -0.0381 -0.0300 340 LYS D O 12650 C CB . LYS D 281 ? 0.4854 0.6558 1.2114 -0.0833 -0.0381 -0.0324 340 LYS D CB 12651 C CG . LYS D 281 ? 0.5793 0.7547 1.3143 -0.0830 -0.0379 -0.0335 340 LYS D CG 12652 C CD . LYS D 281 ? 0.6869 0.8634 1.4084 -0.0813 -0.0353 -0.0315 340 LYS D CD 12653 C CE . LYS D 281 ? 0.8137 0.9945 1.5413 -0.0802 -0.0369 -0.0342 340 LYS D CE 12654 N NZ . LYS D 281 ? 0.8366 1.0216 1.5805 -0.0825 -0.0331 -0.0312 340 LYS D NZ 12655 N N . ARG D 282 ? 0.7152 0.8765 1.4358 -0.0818 -0.0492 -0.0401 341 ARG D N 12656 C CA . ARG D 282 ? 0.6361 0.7923 1.3447 -0.0807 -0.0518 -0.0412 341 ARG D CA 12657 C C . ARG D 282 ? 0.6062 0.7606 1.2976 -0.0802 -0.0474 -0.0369 341 ARG D C 12658 O O . ARG D 282 ? 0.5970 0.7485 1.2827 -0.0813 -0.0450 -0.0339 341 ARG D O 12659 C CB . ARG D 282 ? 0.8109 0.9654 1.5158 -0.0776 -0.0594 -0.0479 341 ARG D CB 12660 C CG . ARG D 282 ? 1.0043 1.1536 1.7003 -0.0764 -0.0633 -0.0499 341 ARG D CG 12661 C CD . ARG D 282 ? 1.1465 1.2940 1.8369 -0.0727 -0.0703 -0.0562 341 ARG D CD 12662 N NE . ARG D 282 ? 1.3175 1.4641 1.9914 -0.0703 -0.0695 -0.0561 341 ARG D NE 12663 C CZ . ARG D 282 ? 1.3271 1.4726 1.9940 -0.0669 -0.0745 -0.0610 341 ARG D CZ 12664 N NH1 . ARG D 282 ? 1.4135 1.5585 2.0884 -0.0652 -0.0808 -0.0667 341 ARG D NH1 12665 N NH2 . ARG D 282 ? 1.1452 1.2898 1.7969 -0.0649 -0.0732 -0.0604 341 ARG D NH2 12666 N N . GLN D 283 ? 0.6643 0.8205 1.3476 -0.0785 -0.0463 -0.0368 342 GLN D N 12667 C CA . GLN D 283 ? 0.5908 0.7455 1.2575 -0.0777 -0.0425 -0.0332 342 GLN D CA 12668 C C . GLN D 283 ? 0.4258 0.5818 1.0936 -0.0802 -0.0349 -0.0264 342 GLN D C 12669 O O . GLN D 283 ? 0.4976 0.6514 1.1525 -0.0800 -0.0316 -0.0230 342 GLN D O 12670 C CB . GLN D 283 ? 0.7626 0.9192 1.4216 -0.0753 -0.0434 -0.0350 342 GLN D CB 12671 C CG . GLN D 283 ? 0.9823 1.1377 1.6392 -0.0725 -0.0506 -0.0418 342 GLN D CG 12672 C CD . GLN D 283 ? 1.0158 1.1730 1.6645 -0.0700 -0.0512 -0.0436 342 GLN D CD 12673 O OE1 . GLN D 283 ? 0.9334 1.0927 1.5775 -0.0705 -0.0463 -0.0396 342 GLN D OE1 12674 N NE2 . GLN D 283 ? 1.0029 1.1591 1.6497 -0.0673 -0.0572 -0.0496 342 GLN D NE2 12675 N N . TYR D 284 ? 0.3526 0.5118 1.0357 -0.0824 -0.0322 -0.0245 343 TYR D N 12676 C CA . TYR D 284 ? 0.4097 0.5705 1.0946 -0.0843 -0.0249 -0.0181 343 TYR D CA 12677 C C . TYR D 284 ? 0.4727 0.6324 1.1672 -0.0870 -0.0221 -0.0153 343 TYR D C 12678 O O . TYR D 284 ? 0.5578 0.7180 1.2526 -0.0884 -0.0159 -0.0099 343 TYR D O 12679 C CB . TYR D 284 ? 0.5548 0.7205 1.2487 -0.0846 -0.0225 -0.0170 343 TYR D CB 12680 C CG . TYR D 284 ? 0.4932 0.6603 1.1760 -0.0822 -0.0233 -0.0181 343 TYR D CG 12681 C CD1 . TYR D 284 ? 0.4621 0.6296 1.1440 -0.0801 -0.0294 -0.0240 343 TYR D CD1 12682 C CD2 . TYR D 284 ? 0.4378 0.6056 1.1111 -0.0819 -0.0179 -0.0133 343 TYR D CD2 12683 C CE1 . TYR D 284 ? 0.4094 0.5779 1.0808 -0.0778 -0.0300 -0.0251 343 TYR D CE1 12684 C CE2 . TYR D 284 ? 0.4914 0.6605 1.1546 -0.0797 -0.0186 -0.0143 343 TYR D CE2 12685 C CZ . TYR D 284 ? 0.4758 0.6452 1.1380 -0.0777 -0.0246 -0.0202 343 TYR D CZ 12686 O OH . TYR D 284 ? 0.5658 0.7362 1.2174 -0.0755 -0.0252 -0.0212 343 TYR D OH 12687 N N . ALA D 285 ? 0.4310 0.5891 1.1333 -0.0875 -0.0268 -0.0190 344 ALA D N 12688 C CA . ALA D 285 ? 0.4712 0.6283 1.1836 -0.0901 -0.0245 -0.0168 344 ALA D CA 12689 C C . ALA D 285 ? 0.5598 0.7131 1.2605 -0.0905 -0.0212 -0.0130 344 ALA D C 12690 O O . ALA D 285 ? 0.5323 0.6852 1.2383 -0.0926 -0.0164 -0.0090 344 ALA D O 12691 C CB . ALA D 285 ? 0.3988 0.5549 1.1214 -0.0903 -0.0308 -0.0219 344 ALA D CB 12692 N N . HIS D 286 ? 0.5609 0.7112 1.2455 -0.0885 -0.0235 -0.0144 345 HIS D N 12693 C CA . HIS D 286 ? 0.3356 0.4822 1.0078 -0.0887 -0.0208 -0.0113 345 HIS D CA 12694 C C . HIS D 286 ? 0.3936 0.5390 1.0480 -0.0864 -0.0205 -0.0110 345 HIS D C 12695 O O . HIS D 286 ? 0.4848 0.6298 1.1334 -0.0842 -0.0254 -0.0152 345 HIS D O 12696 C CB . HIS D 286 ? 0.4384 0.5812 1.1107 -0.0889 -0.0253 -0.0142 345 HIS D CB 12697 C CG . HIS D 286 ? 0.5121 0.6556 1.2010 -0.0912 -0.0253 -0.0142 345 HIS D CG 12698 N ND1 . HIS D 286 ? 0.4805 0.6232 1.1733 -0.0935 -0.0201 -0.0098 345 HIS D ND1 12699 C CD2 . HIS D 286 ? 0.4596 0.6045 1.1623 -0.0916 -0.0298 -0.0182 345 HIS D CD2 12700 C CE1 . HIS D 286 ? 0.6745 0.8181 1.3828 -0.0952 -0.0214 -0.0110 345 HIS D CE1 12701 N NE2 . HIS D 286 ? 0.6639 0.8088 1.3787 -0.0942 -0.0273 -0.0161 345 HIS D NE2 12702 N N . GLY D 287 ? 0.3334 0.4780 0.9791 -0.0868 -0.0148 -0.0060 346 GLY D N 12703 C CA . GLY D 287 ? 0.4437 0.5870 1.0724 -0.0849 -0.0140 -0.0051 346 GLY D CA 12704 C C . GLY D 287 ? 0.4947 0.6405 1.1207 -0.0850 -0.0076 -0.0001 346 GLY D C 12705 O O . GLY D 287 ? 0.4553 0.6023 1.0890 -0.0868 -0.0025 0.0040 346 GLY D O 12706 N N . ARG D 288 ? 0.3931 0.5393 1.0078 -0.0830 -0.0078 -0.0005 347 ARG D N 12707 C CA . ARG D 288 ? 0.5464 0.6947 1.1566 -0.0828 -0.0021 0.0042 347 ARG D CA 12708 C C . ARG D 288 ? 0.6178 0.7701 1.2321 -0.0819 -0.0028 0.0030 347 ARG D C 12709 O O . ARG D 288 ? 0.6314 0.7860 1.2443 -0.0818 0.0018 0.0069 347 ARG D O 12710 C CB . ARG D 288 ? 0.3948 0.5404 0.9870 -0.0814 -0.0007 0.0058 347 ARG D CB 12711 C CG . ARG D 288 ? 0.3500 0.4941 0.9314 -0.0791 -0.0060 0.0012 347 ARG D CG 12712 C CD . ARG D 288 ? 0.3664 0.5083 0.9305 -0.0777 -0.0039 0.0032 347 ARG D CD 12713 N NE . ARG D 288 ? 0.4813 0.6258 1.0421 -0.0773 0.0009 0.0071 347 ARG D NE 12714 C CZ . ARG D 288 ? 0.5557 0.6993 1.1083 -0.0773 0.0060 0.0117 347 ARG D CZ 12715 N NH1 . ARG D 288 ? 0.5977 0.7378 1.1443 -0.0778 0.0069 0.0129 347 ARG D NH1 12716 N NH2 . ARG D 288 ? 0.4581 0.6040 1.0081 -0.0767 0.0100 0.0151 347 ARG D NH2 12717 N N . ARG D 289 ? 0.4800 0.6331 1.0992 -0.0811 -0.0086 -0.0023 348 ARG D N 12718 C CA . ARG D 289 ? 0.4233 0.5800 1.0455 -0.0799 -0.0101 -0.0042 348 ARG D CA 12719 C C . ARG D 289 ? 0.4188 0.5797 1.0530 -0.0813 -0.0055 -0.0006 348 ARG D C 12720 O O . ARG D 289 ? 0.5316 0.6950 1.1621 -0.0804 -0.0032 0.0012 348 ARG D O 12721 C CB . ARG D 289 ? 0.3625 0.5193 0.9910 -0.0791 -0.0171 -0.0107 348 ARG D CB 12722 C CG . ARG D 289 ? 0.5101 0.6634 1.1252 -0.0768 -0.0220 -0.0148 348 ARG D CG 12723 C CD . ARG D 289 ? 0.5817 0.7358 1.2015 -0.0752 -0.0284 -0.0210 348 ARG D CD 12724 N NE . ARG D 289 ? 0.7502 0.9005 1.3577 -0.0728 -0.0332 -0.0250 348 ARG D NE 12725 C CZ . ARG D 289 ? 0.9783 1.1285 1.5857 -0.0706 -0.0389 -0.0306 348 ARG D CZ 12726 N NH1 . ARG D 289 ? 1.1784 1.3321 1.7974 -0.0706 -0.0406 -0.0331 348 ARG D NH1 12727 N NH2 . ARG D 289 ? 0.8748 1.0213 1.4705 -0.0684 -0.0428 -0.0338 348 ARG D NH2 12728 N N . LEU D 290 ? 0.3647 0.5262 1.0130 -0.0835 -0.0041 0.0006 349 LEU D N 12729 C CA . LEU D 290 ? 0.3470 0.5125 1.0078 -0.0849 0.0003 0.0040 349 LEU D CA 12730 C C . LEU D 290 ? 0.5143 0.6799 1.1682 -0.0849 0.0073 0.0104 349 LEU D C 12731 O O . LEU D 290 ? 0.6724 0.8412 1.3291 -0.0847 0.0104 0.0130 349 LEU D O 12732 C CB . LEU D 290 ? 0.3758 0.5415 1.0529 -0.0872 0.0005 0.0040 349 LEU D CB 12733 C CG . LEU D 290 ? 0.4959 0.6645 1.1878 -0.0877 -0.0039 -0.0005 349 LEU D CG 12734 C CD1 . LEU D 290 ? 0.5298 0.6985 1.2376 -0.0901 -0.0030 0.0001 349 LEU D CD1 12735 C CD2 . LEU D 290 ? 0.4384 0.6115 1.1345 -0.0871 -0.0023 0.0004 349 LEU D CD2 12736 N N . LEU D 291 ? 0.5058 0.6679 1.1506 -0.0851 0.0096 0.0129 350 LEU D N 12737 C CA . LEU D 291 ? 0.4017 0.5635 1.0386 -0.0848 0.0159 0.0186 350 LEU D CA 12738 C C . LEU D 291 ? 0.5414 0.7038 1.1647 -0.0826 0.0157 0.0188 350 LEU D C 12739 O O . LEU D 291 ? 0.4484 0.6124 1.0688 -0.0821 0.0205 0.0231 350 LEU D O 12740 C CB . LEU D 291 ? 0.3249 0.4825 0.9545 -0.0854 0.0178 0.0206 350 LEU D CB 12741 C CG . LEU D 291 ? 0.5430 0.7000 1.1851 -0.0876 0.0204 0.0226 350 LEU D CG 12742 C CD1 . LEU D 291 ? 0.4566 0.6093 1.0905 -0.0880 0.0212 0.0234 350 LEU D CD1 12743 C CD2 . LEU D 291 ? 0.4019 0.5615 1.0519 -0.0883 0.0270 0.0280 350 LEU D CD2 12744 N N . ASP D 292 ? 0.3533 0.5143 0.9683 -0.0812 0.0103 0.0140 351 ASP D N 12745 C CA . ASP D 292 ? 0.4092 0.5708 1.0116 -0.0790 0.0094 0.0133 351 ASP D CA 12746 C C . ASP D 292 ? 0.4397 0.6058 1.0493 -0.0786 0.0097 0.0132 351 ASP D C 12747 O O . ASP D 292 ? 0.4845 0.6521 1.0876 -0.0775 0.0128 0.0162 351 ASP D O 12748 C CB . ASP D 292 ? 0.3235 0.4825 0.9167 -0.0775 0.0033 0.0078 351 ASP D CB 12749 C CG . ASP D 292 ? 0.4785 0.6330 1.0612 -0.0775 0.0032 0.0082 351 ASP D CG 12750 O OD1 . ASP D 292 ? 0.3314 0.4849 0.9106 -0.0782 0.0083 0.0129 351 ASP D OD1 12751 O OD2 . ASP D 292 ? 0.4822 0.6342 1.0601 -0.0766 -0.0019 0.0038 351 ASP D OD2 12752 N N . LEU D 293 ? 0.4354 0.6035 1.0586 -0.0794 0.0063 0.0098 352 LEU D N 12753 C CA . LEU D 293 ? 0.3366 0.5090 0.9682 -0.0791 0.0061 0.0091 352 LEU D CA 12754 C C . LEU D 293 ? 0.4384 0.6136 1.0757 -0.0800 0.0126 0.0152 352 LEU D C 12755 O O . LEU D 293 ? 0.4189 0.5969 1.0549 -0.0790 0.0140 0.0165 352 LEU D O 12756 C CB . LEU D 293 ? 0.3238 0.4977 0.9705 -0.0801 0.0016 0.0045 352 LEU D CB 12757 C CG . LEU D 293 ? 0.3235 0.5019 0.9793 -0.0797 0.0002 0.0027 352 LEU D CG 12758 C CD1 . LEU D 293 ? 0.4181 0.5963 1.0764 -0.0787 -0.0069 -0.0044 352 LEU D CD1 12759 C CD2 . LEU D 293 ? 0.3476 0.5290 1.0205 -0.0819 0.0038 0.0057 352 LEU D CD2 12760 N N . VAL D 294 ? 0.3217 0.4957 0.9650 -0.0817 0.0166 0.0189 353 VAL D N 12761 C CA . VAL D 294 ? 0.4400 0.6160 1.0883 -0.0823 0.0231 0.0250 353 VAL D CA 12762 C C . VAL D 294 ? 0.3894 0.5644 1.0223 -0.0806 0.0268 0.0289 353 VAL D C 12763 O O . VAL D 294 ? 0.3600 0.5376 0.9930 -0.0799 0.0302 0.0324 353 VAL D O 12764 C CB . VAL D 294 ? 0.3216 0.4961 0.9792 -0.0844 0.0266 0.0278 353 VAL D CB 12765 C CG1 . VAL D 294 ? 0.3209 0.4966 0.9811 -0.0845 0.0338 0.0345 353 VAL D CG1 12766 C CG2 . VAL D 294 ? 0.3228 0.4987 0.9973 -0.0861 0.0235 0.0245 353 VAL D CG2 12767 N N . ASP D 295 ? 0.3885 0.5597 1.0082 -0.0800 0.0259 0.0283 354 ASP D N 12768 C CA . ASP D 295 ? 0.3768 0.5466 0.9811 -0.0783 0.0289 0.0316 354 ASP D CA 12769 C C . ASP D 295 ? 0.5482 0.7203 1.1451 -0.0764 0.0272 0.0303 354 ASP D C 12770 O O . ASP D 295 ? 0.4392 0.6126 1.0309 -0.0754 0.0311 0.0344 354 ASP D O 12771 C CB . ASP D 295 ? 0.3189 0.4844 0.9110 -0.0780 0.0273 0.0302 354 ASP D CB 12772 C CG . ASP D 295 ? 0.5206 0.6836 1.1132 -0.0790 0.0319 0.0343 354 ASP D CG 12773 O OD1 . ASP D 295 ? 0.4276 0.5922 1.0285 -0.0797 0.0368 0.0387 354 ASP D OD1 12774 O OD2 . ASP D 295 ? 0.5187 0.6781 1.1032 -0.0791 0.0307 0.0332 354 ASP D OD2 12775 N N . ILE D 296 ? 0.3183 0.4907 0.9146 -0.0759 0.0213 0.0246 355 ILE D N 12776 C CA . ILE D 296 ? 0.4129 0.5871 1.0014 -0.0739 0.0192 0.0227 355 ILE D CA 12777 C C . ILE D 296 ? 0.4833 0.6621 1.0820 -0.0740 0.0209 0.0243 355 ILE D C 12778 O O . ILE D 296 ? 0.3369 0.5174 0.9286 -0.0725 0.0219 0.0256 355 ILE D O 12779 C CB . ILE D 296 ? 0.3515 0.5244 0.9364 -0.0730 0.0124 0.0159 355 ILE D CB 12780 C CG1 . ILE D 296 ? 0.3681 0.5419 0.9414 -0.0708 0.0106 0.0142 355 ILE D CG1 12781 C CG2 . ILE D 296 ? 0.3476 0.5225 0.9482 -0.0742 0.0088 0.0120 355 ILE D CG2 12782 C CD1 . ILE D 296 ? 0.3744 0.5463 0.9421 -0.0695 0.0042 0.0077 355 ILE D CD1 12783 N N . HIS D 297 ? 0.3177 0.4984 0.9328 -0.0758 0.0212 0.0243 356 HIS D N 12784 C CA . HIS D 297 ? 0.3172 0.5024 0.9434 -0.0761 0.0231 0.0260 356 HIS D CA 12785 C C . HIS D 297 ? 0.3163 0.5022 0.9423 -0.0762 0.0300 0.0331 356 HIS D C 12786 O O . HIS D 297 ? 0.4400 0.6293 1.0691 -0.0756 0.0322 0.0354 356 HIS D O 12787 C CB . HIS D 297 ? 0.3183 0.5051 0.9625 -0.0780 0.0211 0.0234 356 HIS D CB 12788 C CG . HIS D 297 ? 0.3914 0.5796 1.0389 -0.0774 0.0147 0.0169 356 HIS D CG 12789 N ND1 . HIS D 297 ? 0.3188 0.5112 0.9748 -0.0772 0.0138 0.0156 356 HIS D ND1 12790 C CD2 . HIS D 297 ? 0.3200 0.5059 0.9633 -0.0769 0.0090 0.0112 356 HIS D CD2 12791 C CE1 . HIS D 297 ? 0.3741 0.5667 1.0310 -0.0765 0.0077 0.0093 356 HIS D CE1 12792 N NE2 . HIS D 297 ? 0.3425 0.5311 0.9917 -0.0762 0.0047 0.0065 356 HIS D NE2 12793 N N . ILE D 298 ? 0.3234 0.5063 0.9458 -0.0767 0.0334 0.0364 357 ILE D N 12794 C CA . ILE D 298 ? 0.4433 0.6263 1.0630 -0.0763 0.0399 0.0430 357 ILE D CA 12795 C C . ILE D 298 ? 0.4302 0.6132 1.0343 -0.0740 0.0405 0.0444 357 ILE D C 12796 O O . ILE D 298 ? 0.3513 0.5364 0.9547 -0.0730 0.0443 0.0487 357 ILE D O 12797 C CB . ILE D 298 ? 0.3540 0.5333 0.9720 -0.0771 0.0432 0.0458 357 ILE D CB 12798 C CG1 . ILE D 298 ? 0.3169 0.4969 0.9519 -0.0793 0.0446 0.0464 357 ILE D CG1 12799 C CG2 . ILE D 298 ? 0.4126 0.5911 1.0220 -0.0758 0.0491 0.0519 357 ILE D CG2 12800 C CD1 . ILE D 298 ? 0.4766 0.6529 1.1105 -0.0802 0.0476 0.0488 357 ILE D CD1 12801 N N . LEU D 299 ? 0.3429 0.5235 0.9346 -0.0731 0.0366 0.0407 358 LEU D N 12802 C CA . LEU D 299 ? 0.3489 0.5292 0.9251 -0.0709 0.0364 0.0411 358 LEU D CA 12803 C C . LEU D 299 ? 0.4755 0.6597 1.0539 -0.0699 0.0347 0.0398 358 LEU D C 12804 O O . LEU D 299 ? 0.3354 0.5211 0.9078 -0.0686 0.0375 0.0432 358 LEU D O 12805 C CB . LEU D 299 ? 0.3139 0.4908 0.8779 -0.0702 0.0321 0.0368 358 LEU D CB 12806 C CG . LEU D 299 ? 0.3131 0.4892 0.8604 -0.0681 0.0315 0.0366 358 LEU D CG 12807 C CD1 . LEU D 299 ? 0.3122 0.4869 0.8507 -0.0673 0.0369 0.0424 358 LEU D CD1 12808 C CD2 . LEU D 299 ? 0.3173 0.4903 0.8551 -0.0675 0.0265 0.0314 358 LEU D CD2 12809 N N . ASP D 300 ? 0.3468 0.5326 0.9338 -0.0706 0.0300 0.0346 359 ASP D N 12810 C CA . ASP D 300 ? 0.3136 0.5030 0.9030 -0.0697 0.0278 0.0325 359 ASP D CA 12811 C C . ASP D 300 ? 0.4721 0.6653 1.0713 -0.0700 0.0322 0.0372 359 ASP D C 12812 O O . ASP D 300 ? 0.3567 0.5525 0.9525 -0.0687 0.0324 0.0379 359 ASP D O 12813 C CB . ASP D 300 ? 0.3148 0.5049 0.9129 -0.0704 0.0220 0.0259 359 ASP D CB 12814 C CG . ASP D 300 ? 0.3154 0.5024 0.9021 -0.0693 0.0170 0.0207 359 ASP D CG 12815 O OD1 . ASP D 300 ? 0.3149 0.4999 0.8862 -0.0677 0.0177 0.0218 359 ASP D OD1 12816 O OD2 . ASP D 300 ? 0.3166 0.5029 0.9095 -0.0698 0.0124 0.0156 359 ASP D OD2 12817 N N . TYR D 301 ? 0.3132 0.5065 0.9244 -0.0717 0.0356 0.0403 360 TYR D N 12818 C CA . TYR D 301 ? 0.3127 0.5093 0.9339 -0.0720 0.0401 0.0451 360 TYR D CA 12819 C C . TYR D 301 ? 0.3116 0.5078 0.9225 -0.0704 0.0452 0.0512 360 TYR D C 12820 O O . TYR D 301 ? 0.3687 0.5680 0.9817 -0.0695 0.0476 0.0543 360 TYR D O 12821 C CB . TYR D 301 ? 0.3587 0.5553 0.9956 -0.0742 0.0425 0.0468 360 TYR D CB 12822 C CG . TYR D 301 ? 0.4263 0.6259 1.0733 -0.0743 0.0478 0.0522 360 TYR D CG 12823 C CD1 . TYR D 301 ? 0.3825 0.5864 1.0389 -0.0744 0.0468 0.0513 360 TYR D CD1 12824 C CD2 . TYR D 301 ? 0.4015 0.5996 1.0487 -0.0743 0.0538 0.0583 360 TYR D CD2 12825 C CE1 . TYR D 301 ? 0.3125 0.5191 0.9781 -0.0745 0.0516 0.0564 360 TYR D CE1 12826 C CE2 . TYR D 301 ? 0.3307 0.5313 0.9871 -0.0743 0.0587 0.0634 360 TYR D CE2 12827 C CZ . TYR D 301 ? 0.4644 0.6693 1.1300 -0.0744 0.0576 0.0625 360 TYR D CZ 12828 O OH . TYR D 301 ? 0.4839 0.6912 1.1587 -0.0742 0.0625 0.0677 360 TYR D OH 12829 N N . LEU D 302 ? 0.3482 0.5407 0.9483 -0.0699 0.0469 0.0530 361 LEU D N 12830 C CA . LEU D 302 ? 0.3105 0.5021 0.8997 -0.0682 0.0515 0.0585 361 LEU D CA 12831 C C . LEU D 302 ? 0.4443 0.6374 1.0217 -0.0662 0.0497 0.0576 361 LEU D C 12832 O O . LEU D 302 ? 0.3602 0.5545 0.9331 -0.0647 0.0532 0.0622 361 LEU D O 12833 C CB . LEU D 302 ? 0.3106 0.4978 0.8901 -0.0681 0.0529 0.0597 361 LEU D CB 12834 C CG . LEU D 302 ? 0.5027 0.6881 1.0913 -0.0696 0.0566 0.0625 361 LEU D CG 12835 C CD1 . LEU D 302 ? 0.3116 0.4925 0.8900 -0.0696 0.0564 0.0618 361 LEU D CD1 12836 C CD2 . LEU D 302 ? 0.3108 0.4975 0.9037 -0.0689 0.0629 0.0692 361 LEU D CD2 12837 N N . ILE D 303 ? 0.3181 0.5108 0.8904 -0.0660 0.0441 0.0517 362 ILE D N 12838 C CA . ILE D 303 ? 0.3094 0.5031 0.8697 -0.0640 0.0420 0.0502 362 ILE D CA 12839 C C . ILE D 303 ? 0.3816 0.5793 0.9501 -0.0640 0.0391 0.0473 362 ILE D C 12840 O O . ILE D 303 ? 0.3485 0.5476 0.9086 -0.0624 0.0375 0.0460 362 ILE D O 12841 C CB . ILE D 303 ? 0.3098 0.5001 0.8572 -0.0634 0.0378 0.0455 362 ILE D CB 12842 C CG1 . ILE D 303 ? 0.3110 0.5012 0.8660 -0.0646 0.0324 0.0390 362 ILE D CG1 12843 C CG2 . ILE D 303 ? 0.3097 0.4961 0.8494 -0.0635 0.0404 0.0481 362 ILE D CG2 12844 C CD1 . ILE D 303 ? 0.3116 0.4980 0.8557 -0.0641 0.0287 0.0348 362 ILE D CD1 12845 N N . GLY D 304 ? 0.3102 0.5098 0.8949 -0.0658 0.0386 0.0461 363 GLY D N 12846 C CA . GLY D 304 ? 0.3103 0.5140 0.9045 -0.0659 0.0360 0.0432 363 GLY D CA 12847 C C . GLY D 304 ? 0.3111 0.5145 0.9015 -0.0654 0.0296 0.0359 363 GLY D C 12848 O O . GLY D 304 ? 0.3118 0.5181 0.9036 -0.0646 0.0272 0.0334 363 GLY D O 12849 N N . ASN D 305 ? 0.3145 0.5142 0.9001 -0.0658 0.0268 0.0325 364 ASN D N 12850 C CA . ASN D 305 ? 0.3127 0.5116 0.8945 -0.0651 0.0206 0.0255 364 ASN D CA 12851 C C . ASN D 305 ? 0.3184 0.5191 0.9163 -0.0665 0.0172 0.0211 364 ASN D C 12852 O O . ASN D 305 ? 0.3143 0.5137 0.9215 -0.0683 0.0175 0.0211 364 ASN D O 12853 C CB . ASN D 305 ? 0.3132 0.5073 0.8832 -0.0647 0.0190 0.0236 364 ASN D CB 12854 C CG . ASN D 305 ? 0.3143 0.5072 0.8806 -0.0638 0.0127 0.0164 364 ASN D CG 12855 O OD1 . ASN D 305 ? 0.3145 0.5096 0.8803 -0.0626 0.0098 0.0131 364 ASN D OD1 12856 N ND2 . ASN D 305 ? 0.3151 0.5042 0.8785 -0.0643 0.0105 0.0140 364 ASN D ND2 12857 N N . GLN D 306 ? 0.3140 0.5177 0.9150 -0.0656 0.0139 0.0173 365 GLN D N 12858 C CA . GLN D 306 ? 0.4002 0.6059 1.0167 -0.0668 0.0104 0.0129 365 GLN D CA 12859 C C . GLN D 306 ? 0.3163 0.5199 0.9292 -0.0659 0.0040 0.0056 365 GLN D C 12860 O O . GLN D 306 ? 0.4788 0.6832 1.1038 -0.0668 0.0006 0.0014 365 GLN D O 12861 C CB . GLN D 306 ? 0.3146 0.5252 0.9389 -0.0665 0.0108 0.0132 365 GLN D CB 12862 C CG . GLN D 306 ? 0.3134 0.5264 0.9428 -0.0672 0.0170 0.0204 365 GLN D CG 12863 C CD . GLN D 306 ? 0.3130 0.5308 0.9492 -0.0667 0.0171 0.0205 365 GLN D CD 12864 O OE1 . GLN D 306 ? 0.3129 0.5319 0.9407 -0.0648 0.0145 0.0178 365 GLN D OE1 12865 N NE2 . GLN D 306 ? 0.3128 0.5334 0.9643 -0.0683 0.0202 0.0237 365 GLN D NE2 12866 N N . ASP D 307 ? 0.3163 0.5171 0.9127 -0.0640 0.0024 0.0040 366 ASP D N 12867 C CA . ASP D 307 ? 0.3176 0.5166 0.9089 -0.0625 -0.0037 -0.0030 366 ASP D CA 12868 C C . ASP D 307 ? 0.3186 0.5132 0.9078 -0.0631 -0.0059 -0.0053 366 ASP D C 12869 O O . ASP D 307 ? 0.5494 0.7410 1.1274 -0.0614 -0.0094 -0.0092 366 ASP D O 12870 C CB . ASP D 307 ? 0.3173 0.5158 0.8917 -0.0599 -0.0045 -0.0040 366 ASP D CB 12871 C CG . ASP D 307 ? 0.4170 0.6152 0.9887 -0.0580 -0.0105 -0.0113 366 ASP D CG 12872 O OD1 . ASP D 307 ? 0.3784 0.5783 0.9630 -0.0585 -0.0137 -0.0153 366 ASP D OD1 12873 O OD2 . ASP D 307 ? 0.4300 0.6261 0.9866 -0.0558 -0.0120 -0.0133 366 ASP D OD2 12874 N N . ARG D 308 ? 0.3581 0.5522 0.9581 -0.0654 -0.0039 -0.0029 367 ARG D N 12875 C CA . ARG D 308 ? 0.3195 0.5095 0.9184 -0.0660 -0.0058 -0.0047 367 ARG D CA 12876 C C . ARG D 308 ? 0.4231 0.6133 1.0333 -0.0663 -0.0113 -0.0108 367 ARG D C 12877 O O . ARG D 308 ? 0.3214 0.5123 0.9458 -0.0684 -0.0109 -0.0104 367 ARG D O 12878 C CB . ARG D 308 ? 0.3189 0.5079 0.9226 -0.0682 -0.0009 0.0009 367 ARG D CB 12879 C CG . ARG D 308 ? 0.3197 0.5042 0.9195 -0.0688 -0.0022 -0.0002 367 ARG D CG 12880 C CD . ARG D 308 ? 0.3194 0.5005 0.9004 -0.0671 -0.0022 0.0001 367 ARG D CD 12881 N NE . ARG D 308 ? 0.3609 0.5422 0.9346 -0.0671 0.0036 0.0064 367 ARG D NE 12882 C CZ . ARG D 308 ? 0.3465 0.5252 0.9043 -0.0658 0.0048 0.0078 367 ARG D CZ 12883 N NH1 . ARG D 308 ? 0.3183 0.4940 0.8658 -0.0644 0.0007 0.0035 367 ARG D NH1 12884 N NH2 . ARG D 308 ? 0.3162 0.4953 0.8685 -0.0658 0.0100 0.0136 367 ARG D NH2 12885 N N . HIS D 309 ? 0.3271 0.5165 0.9310 -0.0641 -0.0164 -0.0166 368 HIS D N 12886 C CA . HIS D 309 ? 0.3235 0.5131 0.9371 -0.0638 -0.0220 -0.0229 368 HIS D CA 12887 C C . HIS D 309 ? 0.3248 0.5096 0.9339 -0.0634 -0.0257 -0.0262 368 HIS D C 12888 O O . HIS D 309 ? 0.4058 0.5902 1.0255 -0.0640 -0.0293 -0.0299 368 HIS D O 12889 C CB . HIS D 309 ? 0.3240 0.5156 0.9344 -0.0614 -0.0257 -0.0276 368 HIS D CB 12890 C CG . HIS D 309 ? 0.3857 0.5750 0.9773 -0.0588 -0.0262 -0.0284 368 HIS D CG 12891 N ND1 . HIS D 309 ? 0.4520 0.6373 1.0337 -0.0569 -0.0304 -0.0330 368 HIS D ND1 12892 C CD2 . HIS D 309 ? 0.3228 0.5132 0.9036 -0.0579 -0.0229 -0.0251 368 HIS D CD2 12893 C CE1 . HIS D 309 ? 0.3249 0.5089 0.8907 -0.0549 -0.0297 -0.0325 368 HIS D CE1 12894 N NE2 . HIS D 309 ? 0.4656 0.6528 1.0305 -0.0555 -0.0252 -0.0278 368 HIS D NE2 12895 N N . HIS D 310 ? 0.5308 0.7121 1.1242 -0.0624 -0.0247 -0.0249 369 HIS D N 12896 C CA . HIS D 310 ? 0.3258 0.5024 0.9134 -0.0618 -0.0279 -0.0276 369 HIS D CA 12897 C C . HIS D 310 ? 0.3249 0.4986 0.9038 -0.0629 -0.0237 -0.0226 369 HIS D C 12898 O O . HIS D 310 ? 0.3799 0.5547 0.9533 -0.0633 -0.0188 -0.0175 369 HIS D O 12899 C CB . HIS D 310 ? 0.3766 0.5510 0.9520 -0.0587 -0.0326 -0.0330 369 HIS D CB 12900 C CG . HIS D 310 ? 0.5994 0.7749 1.1834 -0.0573 -0.0383 -0.0395 369 HIS D CG 12901 N ND1 . HIS D 310 ? 0.7112 0.8912 1.3061 -0.0576 -0.0385 -0.0405 369 HIS D ND1 12902 C CD2 . HIS D 310 ? 0.6862 0.8588 1.2691 -0.0555 -0.0440 -0.0454 369 HIS D CD2 12903 C CE1 . HIS D 310 ? 0.7524 0.9323 1.3529 -0.0560 -0.0441 -0.0468 369 HIS D CE1 12904 N NE2 . HIS D 310 ? 0.7845 0.9599 1.3779 -0.0547 -0.0476 -0.0499 369 HIS D NE2 12905 N N . PHE D 311 ? 0.4488 0.6188 1.0266 -0.0633 -0.0258 -0.0240 370 PHE D N 12906 C CA . PHE D 311 ? 0.3253 0.4920 0.8938 -0.0641 -0.0225 -0.0200 370 PHE D CA 12907 C C . PHE D 311 ? 0.4214 0.5838 0.9749 -0.0619 -0.0257 -0.0231 370 PHE D C 12908 O O . PHE D 311 ? 0.3967 0.5577 0.9502 -0.0603 -0.0311 -0.0287 370 PHE D O 12909 C CB . PHE D 311 ? 0.3256 0.4914 0.9049 -0.0666 -0.0212 -0.0180 370 PHE D CB 12910 C CG . PHE D 311 ? 0.3943 0.5640 0.9877 -0.0689 -0.0172 -0.0141 370 PHE D CG 12911 C CD1 . PHE D 311 ? 0.4053 0.5763 0.9955 -0.0697 -0.0111 -0.0081 370 PHE D CD1 12912 C CD2 . PHE D 311 ? 0.3688 0.5407 0.9787 -0.0701 -0.0194 -0.0165 370 PHE D CD2 12913 C CE1 . PHE D 311 ? 0.4882 0.6626 1.0913 -0.0715 -0.0072 -0.0043 370 PHE D CE1 12914 C CE2 . PHE D 311 ? 0.3248 0.5001 0.9477 -0.0721 -0.0155 -0.0129 370 PHE D CE2 12915 C CZ . PHE D 311 ? 0.3980 0.5745 1.0175 -0.0728 -0.0094 -0.0067 370 PHE D CZ 12916 N N . GLU D 312 ? 0.4217 0.5820 0.9626 -0.0618 -0.0223 -0.0195 371 GLU D N 12917 C CA . GLU D 312 ? 0.3337 0.4898 0.8598 -0.0598 -0.0247 -0.0218 371 GLU D CA 12918 C C . GLU D 312 ? 0.4267 0.5793 0.9492 -0.0612 -0.0229 -0.0191 371 GLU D C 12919 O O . GLU D 312 ? 0.3946 0.5480 0.9188 -0.0630 -0.0180 -0.0139 371 GLU D O 12920 C CB . GLU D 312 ? 0.3971 0.5535 0.9092 -0.0581 -0.0226 -0.0204 371 GLU D CB 12921 C CG . GLU D 312 ? 0.5739 0.7263 1.0709 -0.0557 -0.0255 -0.0235 371 GLU D CG 12922 C CD . GLU D 312 ? 0.6552 0.8076 1.1512 -0.0532 -0.0307 -0.0297 371 GLU D CD 12923 O OE1 . GLU D 312 ? 0.6086 0.7642 1.1163 -0.0534 -0.0325 -0.0318 371 GLU D OE1 12924 O OE2 . GLU D 312 ? 0.7550 0.9042 1.2386 -0.0509 -0.0331 -0.0325 371 GLU D OE2 12925 N N . SER D 313 ? 0.5262 0.6750 1.0439 -0.0601 -0.0270 -0.0228 372 SER D N 12926 C CA . SER D 313 ? 0.4261 0.5715 0.9405 -0.0613 -0.0259 -0.0208 372 SER D CA 12927 C C . SER D 313 ? 0.5948 0.7356 1.0962 -0.0592 -0.0295 -0.0241 372 SER D C 12928 O O . SER D 313 ? 0.5746 0.7146 1.0747 -0.0570 -0.0343 -0.0292 372 SER D O 12929 C CB . SER D 313 ? 0.3839 0.5295 0.9130 -0.0634 -0.0270 -0.0211 372 SER D CB 12930 O OG . SER D 313 ? 0.5308 0.6801 1.0710 -0.0656 -0.0227 -0.0170 372 SER D OG 12931 N N . PHE D 314 ? 0.6209 0.7589 1.1129 -0.0596 -0.0270 -0.0212 373 PHE D N 12932 C CA . PHE D 314 ? 0.5250 0.6584 1.0056 -0.0579 -0.0302 -0.0240 373 PHE D CA 12933 C C . PHE D 314 ? 0.6807 0.8119 1.1689 -0.0581 -0.0347 -0.0273 373 PHE D C 12934 O O . PHE D 314 ? 0.6131 0.7454 1.1126 -0.0604 -0.0336 -0.0256 373 PHE D O 12935 C CB . PHE D 314 ? 0.3282 0.4593 0.7973 -0.0584 -0.0262 -0.0198 373 PHE D CB 12936 C CG . PHE D 314 ? 0.3267 0.4594 0.7864 -0.0578 -0.0223 -0.0169 373 PHE D CG 12937 C CD1 . PHE D 314 ? 0.3271 0.4592 0.7771 -0.0553 -0.0243 -0.0197 373 PHE D CD1 12938 C CD2 . PHE D 314 ? 0.3251 0.4594 0.7854 -0.0595 -0.0166 -0.0113 373 PHE D CD2 12939 C CE1 . PHE D 314 ? 0.3611 0.4946 0.8023 -0.0547 -0.0208 -0.0170 373 PHE D CE1 12940 C CE2 . PHE D 314 ? 0.3238 0.4594 0.7754 -0.0588 -0.0132 -0.0085 373 PHE D CE2 12941 C CZ . PHE D 314 ? 0.3933 0.5285 0.8353 -0.0564 -0.0153 -0.0114 373 PHE D CZ 12942 N N . ASN D 315 ? 0.7583 0.8865 1.2402 -0.0557 -0.0396 -0.0320 374 ASN D N 12943 C CA . ASN D 315 ? 0.7865 0.9120 1.2736 -0.0555 -0.0442 -0.0353 374 ASN D CA 12944 C C . ASN D 315 ? 0.6863 0.8068 1.1598 -0.0537 -0.0461 -0.0365 374 ASN D C 12945 O O . ASN D 315 ? 0.6170 0.7352 1.0863 -0.0511 -0.0509 -0.0412 374 ASN D O 12946 C CB . ASN D 315 ? 0.7103 0.8369 1.2060 -0.0538 -0.0494 -0.0407 374 ASN D CB 12947 C CG . ASN D 315 ? 0.6531 0.7778 1.1578 -0.0541 -0.0538 -0.0435 374 ASN D CG 12948 O OD1 . ASN D 315 ? 0.6127 0.7364 1.1209 -0.0563 -0.0522 -0.0408 374 ASN D OD1 12949 N ND2 . ASN D 315 ? 0.5954 0.7195 1.1037 -0.0518 -0.0593 -0.0490 374 ASN D ND2 12950 N N . VAL D 316 ? 0.5514 0.6705 1.0184 -0.0552 -0.0423 -0.0324 375 VAL D N 12951 C CA . VAL D 316 ? 0.8332 0.9480 1.2856 -0.0536 -0.0429 -0.0327 375 VAL D CA 12952 C C . VAL D 316 ? 0.8252 0.9374 1.2777 -0.0554 -0.0420 -0.0304 375 VAL D C 12953 O O . VAL D 316 ? 0.8586 0.9668 1.3025 -0.0541 -0.0443 -0.0318 375 VAL D O 12954 C CB . VAL D 316 ? 0.6982 0.8136 1.1384 -0.0531 -0.0387 -0.0298 375 VAL D CB 12955 C CG1 . VAL D 316 ? 0.4417 0.5594 0.8847 -0.0559 -0.0326 -0.0240 375 VAL D CG1 12956 C CG2 . VAL D 316 ? 0.7909 0.9019 1.2160 -0.0512 -0.0397 -0.0307 375 VAL D CG2 12957 N N . PHE D 317 ? 0.6764 0.7909 1.1389 -0.0582 -0.0387 -0.0269 376 PHE D N 12958 C CA . PHE D 317 ? 0.5710 0.6834 1.0350 -0.0601 -0.0376 -0.0247 376 PHE D CA 12959 C C . PHE D 317 ? 0.8983 1.0096 1.3725 -0.0601 -0.0427 -0.0282 376 PHE D C 12960 O O . PHE D 317 ? 0.9831 1.0973 1.4709 -0.0613 -0.0431 -0.0287 376 PHE D O 12961 C CB . PHE D 317 ? 0.5826 0.6977 1.0524 -0.0629 -0.0316 -0.0194 376 PHE D CB 12962 C CG . PHE D 317 ? 0.8182 0.9341 1.2778 -0.0628 -0.0267 -0.0157 376 PHE D CG 12963 C CD1 . PHE D 317 ? 0.9274 1.0404 1.3720 -0.0609 -0.0271 -0.0163 376 PHE D CD1 12964 C CD2 . PHE D 317 ? 0.7801 0.8995 1.2450 -0.0644 -0.0216 -0.0116 376 PHE D CD2 12965 C CE1 . PHE D 317 ? 0.9077 1.0215 1.3430 -0.0608 -0.0227 -0.0129 376 PHE D CE1 12966 C CE2 . PHE D 317 ? 0.8046 0.9246 1.2599 -0.0641 -0.0172 -0.0082 376 PHE D CE2 12967 C CZ . PHE D 317 ? 0.9407 1.0579 1.3813 -0.0624 -0.0178 -0.0089 376 PHE D CZ 12968 N N . ASN D 318 ? 1.1128 1.2199 1.5804 -0.0586 -0.0465 -0.0308 377 ASN D N 12969 C CA . ASN D 318 ? 1.2317 1.3372 1.7072 -0.0580 -0.0520 -0.0346 377 ASN D CA 12970 C C . ASN D 318 ? 1.1785 1.2855 1.6678 -0.0610 -0.0508 -0.0327 377 ASN D C 12971 O O . ASN D 318 ? 1.0304 1.1376 1.5303 -0.0609 -0.0548 -0.0357 377 ASN D O 12972 C CB . ASN D 318 ? 1.3490 1.4494 1.8138 -0.0563 -0.0552 -0.0362 377 ASN D CB 12973 C CG . ASN D 318 ? 1.4928 1.5910 1.9626 -0.0544 -0.0619 -0.0412 377 ASN D CG 12974 O OD1 . ASN D 318 ? 1.5318 1.6320 2.0103 -0.0535 -0.0647 -0.0444 377 ASN D OD1 12975 N ND2 . ASN D 318 ? 1.4919 1.5859 1.9561 -0.0536 -0.0645 -0.0420 377 ASN D ND2 12976 N N . ASP D 319 ? 1.2485 1.3566 1.7377 -0.0634 -0.0452 -0.0277 378 ASP D N 12977 C CA . ASP D 319 ? 1.2134 1.3232 1.7155 -0.0663 -0.0430 -0.0253 378 ASP D CA 12978 C C . ASP D 319 ? 1.1090 1.2228 1.6150 -0.0681 -0.0369 -0.0211 378 ASP D C 12979 O O . ASP D 319 ? 1.1633 1.2787 1.6634 -0.0669 -0.0354 -0.0207 378 ASP D O 12980 C CB . ASP D 319 ? 1.2291 1.3356 1.7276 -0.0676 -0.0422 -0.0233 378 ASP D CB 12981 C CG . ASP D 319 ? 1.2684 1.3713 1.7660 -0.0661 -0.0484 -0.0273 378 ASP D CG 12982 O OD1 . ASP D 319 ? 1.0934 1.1968 1.5976 -0.0647 -0.0532 -0.0315 378 ASP D OD1 12983 O OD2 . ASP D 319 ? 1.4558 1.5553 1.9459 -0.0662 -0.0485 -0.0263 378 ASP D OD2 12984 N N . LEU D 320 ? 0.9239 1.0392 1.4396 -0.0707 -0.0335 -0.0179 379 LEU D N 12985 C CA . LEU D 320 ? 0.8946 1.0134 1.4147 -0.0724 -0.0275 -0.0134 379 LEU D CA 12986 C C . LEU D 320 ? 0.7584 0.8813 1.2878 -0.0721 -0.0280 -0.0148 379 LEU D C 12987 O O . LEU D 320 ? 0.6747 0.7977 1.2023 -0.0701 -0.0323 -0.0189 379 LEU D O 12988 C CB . LEU D 320 ? 0.7894 0.9074 1.2954 -0.0718 -0.0232 -0.0101 379 LEU D CB 12989 C CG . LEU D 320 ? 0.7909 0.9051 1.2870 -0.0721 -0.0218 -0.0082 379 LEU D CG 12990 C CD1 . LEU D 320 ? 0.6484 0.7628 1.1332 -0.0719 -0.0167 -0.0043 379 LEU D CD1 12991 C CD2 . LEU D 320 ? 0.6874 0.8010 1.1926 -0.0745 -0.0203 -0.0062 379 LEU D CD2 12992 N N . PRO D 321 ? 0.6303 0.7566 1.1697 -0.0741 -0.0235 -0.0114 380 PRO D N 12993 C CA . PRO D 321 ? 0.5377 0.6681 1.0865 -0.0740 -0.0235 -0.0122 380 PRO D CA 12994 C C . PRO D 321 ? 0.5968 0.7289 1.1362 -0.0725 -0.0212 -0.0110 380 PRO D C 12995 O O . PRO D 321 ? 0.6380 0.7693 1.1677 -0.0726 -0.0169 -0.0072 380 PRO D O 12996 C CB . PRO D 321 ? 0.3680 0.5008 0.9296 -0.0767 -0.0189 -0.0083 380 PRO D CB 12997 C CG . PRO D 321 ? 0.4765 0.6070 1.0306 -0.0777 -0.0145 -0.0041 380 PRO D CG 12998 C CD . PRO D 321 ? 0.5061 0.6322 1.0494 -0.0765 -0.0184 -0.0067 380 PRO D CD 12999 N N . SER D 322 ? 0.5752 0.7096 1.1173 -0.0711 -0.0241 -0.0142 381 SER D N 13000 C CA . SER D 322 ? 0.4258 0.5620 0.9598 -0.0697 -0.0221 -0.0132 381 SER D CA 13001 C C . SER D 322 ? 0.6795 0.8198 1.2218 -0.0712 -0.0170 -0.0091 381 SER D C 13002 O O . SER D 322 ? 0.5638 0.7059 1.1197 -0.0732 -0.0158 -0.0079 381 SER D O 13003 C CB . SER D 322 ? 0.3467 0.4833 0.8791 -0.0673 -0.0274 -0.0186 381 SER D CB 13004 O OG . SER D 322 ? 0.5569 0.6957 1.1041 -0.0678 -0.0305 -0.0215 381 SER D OG 13005 N N . TYR D 323 ? 0.6777 0.8195 1.2118 -0.0702 -0.0140 -0.0068 382 TYR D N 13006 C CA . TYR D 323 ? 0.5950 0.7407 1.1356 -0.0713 -0.0092 -0.0028 382 TYR D CA 13007 C C . TYR D 323 ? 0.4419 0.5903 0.9798 -0.0695 -0.0104 -0.0046 382 TYR D C 13008 O O . TYR D 323 ? 0.5493 0.6961 1.0766 -0.0674 -0.0136 -0.0077 382 TYR D O 13009 C CB . TYR D 323 ? 0.4801 0.6250 1.0135 -0.0719 -0.0032 0.0029 382 TYR D CB 13010 C CG . TYR D 323 ? 0.4763 0.6188 0.9922 -0.0701 -0.0029 0.0032 382 TYR D CG 13011 C CD1 . TYR D 323 ? 0.4406 0.5849 0.9492 -0.0688 -0.0009 0.0046 382 TYR D CD1 13012 C CD2 . TYR D 323 ? 0.5282 0.6666 1.0352 -0.0698 -0.0046 0.0020 382 TYR D CD2 13013 C CE1 . TYR D 323 ? 0.5090 0.6510 1.0019 -0.0672 -0.0006 0.0048 382 TYR D CE1 13014 C CE2 . TYR D 323 ? 0.6494 0.7856 1.1408 -0.0682 -0.0042 0.0022 382 TYR D CE2 13015 C CZ . TYR D 323 ? 0.5757 0.7137 1.0602 -0.0669 -0.0022 0.0036 382 TYR D CZ 13016 O OH . TYR D 323 ? 0.4824 0.6183 0.9517 -0.0653 -0.0019 0.0038 382 TYR D OH 13017 N N . ALA D 324 ? 0.4451 0.5976 0.9925 -0.0703 -0.0077 -0.0024 383 ALA D N 13018 C CA . ALA D 324 ? 0.5321 0.6874 1.0777 -0.0688 -0.0086 -0.0038 383 ALA D CA 13019 C C . ALA D 324 ? 0.4801 0.6351 1.0113 -0.0675 -0.0052 -0.0006 383 ALA D C 13020 O O . ALA D 324 ? 0.4545 0.6099 0.9843 -0.0684 0.0001 0.0046 383 ALA D O 13021 C CB . ALA D 324 ? 0.3809 0.5406 0.9415 -0.0701 -0.0068 -0.0024 383 ALA D CB 13022 N N . ILE D 325 ? 0.4466 0.6008 0.9672 -0.0653 -0.0082 -0.0039 384 ILE D N 13023 C CA . ILE D 325 ? 0.4048 0.5589 0.9118 -0.0639 -0.0054 -0.0013 384 ILE D CA 13024 C C . ILE D 325 ? 0.3939 0.5524 0.9054 -0.0638 -0.0026 0.0011 384 ILE D C 13025 O O . ILE D 325 ? 0.5385 0.6995 1.0561 -0.0632 -0.0053 -0.0020 384 ILE D O 13026 C CB . ILE D 325 ? 0.5397 0.6914 1.0337 -0.0614 -0.0095 -0.0057 384 ILE D CB 13027 C CG1 . ILE D 325 ? 0.4648 0.6122 0.9547 -0.0613 -0.0126 -0.0084 384 ILE D CG1 13028 C CG2 . ILE D 325 ? 0.4259 0.5774 0.9058 -0.0601 -0.0064 -0.0029 384 ILE D CG2 13029 C CD1 . ILE D 325 ? 0.3475 0.4923 0.8268 -0.0587 -0.0173 -0.0135 384 ILE D CD1 13030 N N . HIS D 326 ? 0.3811 0.5404 0.8892 -0.0643 0.0028 0.0067 385 HIS D N 13031 C CA . HIS D 326 ? 0.4095 0.5727 0.9212 -0.0642 0.0059 0.0098 385 HIS D CA 13032 C C . HIS D 326 ? 0.3899 0.5538 0.8900 -0.0619 0.0046 0.0081 385 HIS D C 13033 O O . HIS D 326 ? 0.3182 0.4809 0.8060 -0.0610 0.0072 0.0108 385 HIS D O 13034 C CB . HIS D 326 ? 0.3165 0.4801 0.8282 -0.0652 0.0122 0.0164 385 HIS D CB 13035 C CG . HIS D 326 ? 0.4424 0.6056 0.9661 -0.0674 0.0140 0.0183 385 HIS D CG 13036 N ND1 . HIS D 326 ? 0.4558 0.6186 0.9799 -0.0683 0.0194 0.0238 385 HIS D ND1 13037 C CD2 . HIS D 326 ? 0.5607 0.7239 1.0964 -0.0688 0.0112 0.0153 385 HIS D CD2 13038 C CE1 . HIS D 326 ? 0.3227 0.4851 0.8584 -0.0702 0.0200 0.0242 385 HIS D CE1 13039 N NE2 . HIS D 326 ? 0.5542 0.7169 1.0972 -0.0706 0.0150 0.0191 385 HIS D NE2 13040 N N . LEU D 327 ? 0.5304 0.6960 1.0345 -0.0610 0.0005 0.0036 386 LEU D N 13041 C CA . LEU D 327 ? 0.3921 0.5582 0.8856 -0.0587 -0.0013 0.0012 386 LEU D CA 13042 C C . LEU D 327 ? 0.4004 0.5710 0.9011 -0.0584 -0.0010 0.0013 386 LEU D C 13043 O O . LEU D 327 ? 0.5084 0.6817 1.0230 -0.0600 0.0003 0.0029 386 LEU D O 13044 C CB . LEU D 327 ? 0.3838 0.5472 0.8725 -0.0572 -0.0071 -0.0052 386 LEU D CB 13045 C CG . LEU D 327 ? 0.5417 0.7004 1.0168 -0.0562 -0.0082 -0.0063 386 LEU D CG 13046 C CD1 . LEU D 327 ? 0.6392 0.7955 1.1144 -0.0550 -0.0141 -0.0127 386 LEU D CD1 13047 C CD2 . LEU D 327 ? 0.6169 0.7751 1.0768 -0.0545 -0.0064 -0.0049 386 LEU D CD2 13048 N N . ASP D 328 ? 0.3177 0.4889 0.8087 -0.0564 -0.0022 -0.0004 387 ASP D N 13049 C CA . ASP D 328 ? 0.3175 0.4928 0.8136 -0.0557 -0.0028 -0.0012 387 ASP D CA 13050 C C . ASP D 328 ? 0.3694 0.5483 0.8741 -0.0571 0.0021 0.0045 387 ASP D C 13051 O O . ASP D 328 ? 0.3162 0.4978 0.8358 -0.0585 0.0020 0.0044 387 ASP D O 13052 C CB . ASP D 328 ? 0.3189 0.4952 0.8257 -0.0556 -0.0078 -0.0071 387 ASP D CB 13053 C CG . ASP D 328 ? 0.4863 0.6593 0.9841 -0.0536 -0.0129 -0.0131 387 ASP D CG 13054 O OD1 . ASP D 328 ? 0.6115 0.7822 1.0943 -0.0520 -0.0125 -0.0130 387 ASP D OD1 13055 O OD2 . ASP D 328 ? 0.6972 0.8697 1.2030 -0.0535 -0.0172 -0.0179 387 ASP D OD2 13056 N N . HIS D 329 ? 0.3149 0.4937 0.8106 -0.0567 0.0064 0.0095 388 HIS D N 13057 C CA . HIS D 329 ? 0.3136 0.4955 0.8162 -0.0577 0.0114 0.0154 388 HIS D CA 13058 C C . HIS D 329 ? 0.4119 0.5966 0.9088 -0.0561 0.0124 0.0167 388 HIS D C 13059 O O . HIS D 329 ? 0.3118 0.4985 0.8099 -0.0563 0.0168 0.0221 388 HIS D O 13060 C CB . HIS D 329 ? 0.3128 0.4924 0.8107 -0.0585 0.0159 0.0208 388 HIS D CB 13061 C CG . HIS D 329 ? 0.3565 0.5330 0.8584 -0.0599 0.0151 0.0197 388 HIS D CG 13062 N ND1 . HIS D 329 ? 0.3139 0.4915 0.8311 -0.0619 0.0155 0.0200 388 HIS D ND1 13063 C CD2 . HIS D 329 ? 0.3139 0.4864 0.8065 -0.0597 0.0140 0.0183 388 HIS D CD2 13064 C CE1 . HIS D 329 ? 0.4471 0.6213 0.9640 -0.0628 0.0146 0.0189 388 HIS D CE1 13065 N NE2 . HIS D 329 ? 0.3172 0.4883 0.8192 -0.0615 0.0136 0.0179 388 HIS D NE2 13066 N N . GLY D 330 ? 0.3136 0.4985 0.8042 -0.0544 0.0084 0.0118 389 GLY D N 13067 C CA . GLY D 330 ? 0.3131 0.5004 0.7970 -0.0527 0.0088 0.0124 389 GLY D CA 13068 C C . GLY D 330 ? 0.3125 0.5045 0.8081 -0.0533 0.0106 0.0147 389 GLY D C 13069 O O . GLY D 330 ? 0.3116 0.5057 0.8021 -0.0523 0.0129 0.0178 389 GLY D O 13070 N N . ARG D 331 ? 0.3130 0.5066 0.8244 -0.0550 0.0096 0.0134 390 ARG D N 13071 C CA . ARG D 331 ? 0.3125 0.5107 0.8365 -0.0557 0.0111 0.0152 390 ARG D CA 13072 C C . ARG D 331 ? 0.3116 0.5106 0.8450 -0.0575 0.0162 0.0215 390 ARG D C 13073 O O . ARG D 331 ? 0.3116 0.5135 0.8597 -0.0589 0.0171 0.0224 390 ARG D O 13074 C CB . ARG D 331 ? 0.3137 0.5135 0.8498 -0.0562 0.0065 0.0094 390 ARG D CB 13075 C CG . ARG D 331 ? 0.3143 0.5156 0.8445 -0.0540 0.0026 0.0046 390 ARG D CG 13076 C CD . ARG D 331 ? 0.3391 0.5406 0.8779 -0.0540 -0.0028 -0.0024 390 ARG D CD 13077 N NE . ARG D 331 ? 0.3621 0.5651 0.8953 -0.0518 -0.0062 -0.0069 390 ARG D NE 13078 C CZ . ARG D 331 ? 0.5048 0.7075 1.0414 -0.0508 -0.0115 -0.0137 390 ARG D CZ 13079 N NH1 . ARG D 331 ? 0.5095 0.7105 1.0551 -0.0519 -0.0140 -0.0167 390 ARG D NH1 13080 N NH2 . ARG D 331 ? 0.5013 0.7053 1.0321 -0.0486 -0.0141 -0.0176 390 ARG D NH2 13081 N N . ALA D 332 ? 0.3110 0.5072 0.8357 -0.0575 0.0196 0.0256 391 ALA D N 13082 C CA . ALA D 332 ? 0.3102 0.5067 0.8416 -0.0588 0.0248 0.0319 391 ALA D CA 13083 C C . ALA D 332 ? 0.3490 0.5474 0.8745 -0.0576 0.0291 0.0376 391 ALA D C 13084 O O . ALA D 332 ? 0.3087 0.5074 0.8225 -0.0557 0.0281 0.0368 391 ALA D O 13085 C CB . ALA D 332 ? 0.3103 0.5026 0.8368 -0.0595 0.0261 0.0331 391 ALA D CB 13086 N N . PHE D 333 ? 0.3084 0.5079 0.8420 -0.0585 0.0339 0.0432 392 PHE D N 13087 C CA . PHE D 333 ? 0.3496 0.5506 0.8785 -0.0572 0.0384 0.0493 392 PHE D CA 13088 C C . PHE D 333 ? 0.3069 0.5118 0.8356 -0.0560 0.0373 0.0488 392 PHE D C 13089 O O . PHE D 333 ? 0.3284 0.5337 0.8464 -0.0542 0.0390 0.0517 392 PHE D O 13090 C CB . PHE D 333 ? 0.3067 0.5044 0.8186 -0.0557 0.0399 0.0514 392 PHE D CB 13091 C CG . PHE D 333 ? 0.3069 0.5009 0.8180 -0.0567 0.0418 0.0529 392 PHE D CG 13092 C CD1 . PHE D 333 ? 0.4294 0.6232 0.9458 -0.0571 0.0469 0.0588 392 PHE D CD1 13093 C CD2 . PHE D 333 ? 0.3701 0.5608 0.8751 -0.0571 0.0384 0.0485 392 PHE D CD2 13094 C CE1 . PHE D 333 ? 0.3067 0.4971 0.8221 -0.0580 0.0487 0.0601 392 PHE D CE1 13095 C CE2 . PHE D 333 ? 0.3826 0.5700 0.8868 -0.0580 0.0401 0.0498 392 PHE D CE2 13096 C CZ . PHE D 333 ? 0.3073 0.4945 0.8165 -0.0584 0.0452 0.0556 392 PHE D CZ 13097 N N . GLY D 334 ? 0.3075 0.5151 0.8481 -0.0569 0.0345 0.0450 393 GLY D N 13098 C CA . GLY D 334 ? 0.3073 0.5188 0.8492 -0.0558 0.0332 0.0440 393 GLY D CA 13099 C C . GLY D 334 ? 0.3921 0.6070 0.9430 -0.0560 0.0377 0.0499 393 GLY D C 13100 O O . GLY D 334 ? 0.3060 0.5236 0.8534 -0.0546 0.0381 0.0513 393 GLY D O 13101 N N . ARG D 335 ? 0.3066 0.5212 0.8689 -0.0576 0.0411 0.0534 394 ARG D N 13102 C CA . ARG D 335 ? 0.3060 0.5236 0.8785 -0.0577 0.0455 0.0589 394 ARG D CA 13103 C C . ARG D 335 ? 0.4214 0.6367 0.9944 -0.0579 0.0509 0.0652 394 ARG D C 13104 O O . ARG D 335 ? 0.5018 0.7144 1.0781 -0.0593 0.0513 0.0646 394 ARG D O 13105 C CB . ARG D 335 ? 0.3067 0.5273 0.8977 -0.0596 0.0440 0.0564 394 ARG D CB 13106 C CG . ARG D 335 ? 0.3605 0.5837 0.9530 -0.0593 0.0386 0.0500 394 ARG D CG 13107 C CD . ARG D 335 ? 0.3065 0.5340 0.9005 -0.0581 0.0396 0.0521 394 ARG D CD 13108 N NE . ARG D 335 ? 0.3780 0.6091 0.9874 -0.0593 0.0373 0.0487 394 ARG D NE 13109 C CZ . ARG D 335 ? 0.3068 0.5410 0.9307 -0.0603 0.0405 0.0523 394 ARG D CZ 13110 N NH1 . ARG D 335 ? 0.5034 0.7372 1.1278 -0.0601 0.0461 0.0595 394 ARG D NH1 13111 N NH2 . ARG D 335 ? 0.4611 0.6985 1.0987 -0.0614 0.0380 0.0487 394 ARG D NH2 13112 N N . SER D 336 ? 0.3503 0.5668 0.9199 -0.0564 0.0552 0.0713 395 SER D N 13113 C CA . SER D 336 ? 0.3046 0.5191 0.8748 -0.0562 0.0608 0.0777 395 SER D CA 13114 C C . SER D 336 ? 0.3701 0.5873 0.9569 -0.0571 0.0644 0.0815 395 SER D C 13115 O O . SER D 336 ? 0.4738 0.6895 1.0651 -0.0572 0.0690 0.0863 395 SER D O 13116 C CB . SER D 336 ? 0.4546 0.6681 1.0095 -0.0536 0.0634 0.0823 395 SER D CB 13117 O OG . SER D 336 ? 0.3032 0.5203 0.8587 -0.0522 0.0644 0.0848 395 SER D OG 13118 N N . ASP D 337 ? 0.3291 0.5503 0.9252 -0.0576 0.0624 0.0793 396 ASP D N 13119 C CA . ASP D 337 ? 0.3578 0.5821 0.9695 -0.0583 0.0657 0.0830 396 ASP D CA 13120 C C . ASP D 337 ? 0.3288 0.5545 0.9571 -0.0608 0.0633 0.0786 396 ASP D C 13121 O O . ASP D 337 ? 0.3060 0.5347 0.9487 -0.0616 0.0652 0.0804 396 ASP D O 13122 C CB . ASP D 337 ? 0.3042 0.5323 0.9142 -0.0566 0.0661 0.0850 396 ASP D CB 13123 C CG . ASP D 337 ? 0.5664 0.7968 1.1744 -0.0567 0.0603 0.0785 396 ASP D CG 13124 O OD1 . ASP D 337 ? 0.5551 0.7835 1.1577 -0.0573 0.0560 0.0728 396 ASP D OD1 13125 O OD2 . ASP D 337 ? 0.6917 0.9259 1.3033 -0.0560 0.0600 0.0790 396 ASP D OD2 13126 N N . PHE D 338 ? 0.3064 0.5300 0.9330 -0.0621 0.0590 0.0727 397 PHE D N 13127 C CA . PHE D 338 ? 0.3073 0.5320 0.9489 -0.0644 0.0560 0.0680 397 PHE D CA 13128 C C . PHE D 338 ? 0.3081 0.5288 0.9492 -0.0658 0.0547 0.0653 397 PHE D C 13129 O O . PHE D 338 ? 0.3583 0.5762 0.9862 -0.0651 0.0520 0.0626 397 PHE D O 13130 C CB . PHE D 338 ? 0.3841 0.6116 1.0261 -0.0643 0.0503 0.0617 397 PHE D CB 13131 C CG . PHE D 338 ? 0.3085 0.5365 0.9637 -0.0664 0.0464 0.0559 397 PHE D CG 13132 C CD1 . PHE D 338 ? 0.4904 0.7206 1.1639 -0.0682 0.0483 0.0572 397 PHE D CD1 13133 C CD2 . PHE D 338 ? 0.3091 0.5354 0.9585 -0.0665 0.0408 0.0492 397 PHE D CD2 13134 C CE1 . PHE D 338 ? 0.3099 0.5406 0.9958 -0.0702 0.0446 0.0518 397 PHE D CE1 13135 C CE2 . PHE D 338 ? 0.3101 0.5368 0.9716 -0.0682 0.0370 0.0438 397 PHE D CE2 13136 C CZ . PHE D 338 ? 0.3105 0.5394 0.9902 -0.0701 0.0388 0.0451 397 PHE D CZ 13137 N N . ASP D 339 ? 0.3263 0.5469 0.9820 -0.0678 0.0565 0.0662 398 ASP D N 13138 C CA . ASP D 339 ? 0.3555 0.5727 1.0128 -0.0694 0.0549 0.0633 398 ASP D CA 13139 C C . ASP D 339 ? 0.3793 0.5981 1.0497 -0.0713 0.0502 0.0572 398 ASP D C 13140 O O . ASP D 339 ? 0.4427 0.6645 1.1285 -0.0725 0.0514 0.0579 398 ASP D O 13141 C CB . ASP D 339 ? 0.3099 0.5249 0.9729 -0.0701 0.0606 0.0688 398 ASP D CB 13142 C CG . ASP D 339 ? 0.4842 0.6980 1.1364 -0.0680 0.0658 0.0753 398 ASP D CG 13143 O OD1 . ASP D 339 ? 0.3745 0.5875 1.0113 -0.0662 0.0644 0.0750 398 ASP D OD1 13144 O OD2 . ASP D 339 ? 0.4604 0.6742 1.1198 -0.0681 0.0712 0.0808 398 ASP D OD2 13145 N N . ASP D 340 ? 0.4660 0.6829 1.1303 -0.0714 0.0450 0.0512 399 ASP D N 13146 C CA . ASP D 340 ? 0.3240 0.5420 0.9997 -0.0729 0.0400 0.0450 399 ASP D CA 13147 C C . ASP D 340 ? 0.3129 0.5283 0.9974 -0.0750 0.0406 0.0447 399 ASP D C 13148 O O . ASP D 340 ? 0.3134 0.5252 0.9904 -0.0752 0.0382 0.0420 399 ASP D O 13149 C CB . ASP D 340 ? 0.3468 0.5640 1.0119 -0.0718 0.0338 0.0385 399 ASP D CB 13150 C CG . ASP D 340 ? 0.3598 0.5783 1.0364 -0.0729 0.0285 0.0319 399 ASP D CG 13151 O OD1 . ASP D 340 ? 0.4674 0.6887 1.1606 -0.0745 0.0294 0.0323 399 ASP D OD1 13152 O OD2 . ASP D 340 ? 0.4305 0.6472 1.0998 -0.0722 0.0233 0.0263 399 ASP D OD2 13153 N N . ASP D 341 ? 0.3133 0.5305 1.0136 -0.0766 0.0439 0.0475 400 ASP D N 13154 C CA . ASP D 341 ? 0.4527 0.6675 1.1624 -0.0786 0.0453 0.0480 400 ASP D CA 13155 C C . ASP D 341 ? 0.3153 0.5294 1.0310 -0.0800 0.0393 0.0410 400 ASP D C 13156 O O . ASP D 341 ? 0.3771 0.5887 1.0979 -0.0815 0.0393 0.0404 400 ASP D O 13157 C CB . ASP D 341 ? 0.3699 0.5872 1.0959 -0.0799 0.0503 0.0525 400 ASP D CB 13158 C CG . ASP D 341 ? 0.5457 0.7632 1.2662 -0.0784 0.0567 0.0599 400 ASP D CG 13159 O OD1 . ASP D 341 ? 0.5817 0.7960 1.2880 -0.0771 0.0585 0.0624 400 ASP D OD1 13160 O OD2 . ASP D 341 ? 0.5454 0.7662 1.2758 -0.0784 0.0598 0.0632 400 ASP D OD2 13161 N N . ASP D 342 ? 0.3154 0.5316 1.0303 -0.0792 0.0340 0.0356 401 ASP D N 13162 C CA . ASP D 342 ? 0.3164 0.5318 1.0351 -0.0799 0.0277 0.0286 401 ASP D CA 13163 C C . ASP D 342 ? 0.3168 0.5273 1.0218 -0.0794 0.0254 0.0265 401 ASP D C 13164 O O . ASP D 342 ? 0.3464 0.5550 1.0556 -0.0804 0.0217 0.0222 401 ASP D O 13165 C CB . ASP D 342 ? 0.3164 0.5348 1.0351 -0.0787 0.0228 0.0235 401 ASP D CB 13166 C CG . ASP D 342 ? 0.3990 0.6218 1.1360 -0.0799 0.0228 0.0228 401 ASP D CG 13167 O OD1 . ASP D 342 ? 0.3166 0.5405 1.0650 -0.0815 0.0276 0.0274 401 ASP D OD1 13168 O OD2 . ASP D 342 ? 0.3170 0.5422 1.0571 -0.0793 0.0181 0.0175 401 ASP D OD2 13169 N N . ILE D 343 ? 0.3159 0.5246 1.0047 -0.0777 0.0275 0.0294 402 ILE D N 13170 C CA . ILE D 343 ? 0.3161 0.5204 0.9907 -0.0770 0.0256 0.0277 402 ILE D CA 13171 C C . ILE D 343 ? 0.3719 0.5730 1.0501 -0.0787 0.0282 0.0300 402 ILE D C 13172 O O . ILE D 343 ? 0.3568 0.5546 1.0306 -0.0790 0.0250 0.0267 402 ILE D O 13173 C CB . ILE D 343 ? 0.3188 0.5221 0.9756 -0.0749 0.0277 0.0307 402 ILE D CB 13174 C CG1 . ILE D 343 ? 0.4972 0.7035 1.1494 -0.0732 0.0250 0.0282 402 ILE D CG1 13175 C CG2 . ILE D 343 ? 0.3152 0.5139 0.9577 -0.0742 0.0258 0.0289 402 ILE D CG2 13176 C CD1 . ILE D 343 ? 0.3133 0.5194 0.9502 -0.0712 0.0277 0.0319 402 ILE D CD1 13177 N N . ILE D 344 ? 0.3164 0.5183 1.0024 -0.0797 0.0339 0.0357 403 ILE D N 13178 C CA . ILE D 344 ? 0.4545 0.6534 1.1438 -0.0811 0.0370 0.0384 403 ILE D CA 13179 C C . ILE D 344 ? 0.3183 0.5178 1.0251 -0.0834 0.0355 0.0359 403 ILE D C 13180 O O . ILE D 344 ? 0.5670 0.7646 1.2796 -0.0849 0.0385 0.0384 403 ILE D O 13181 C CB . ILE D 344 ? 0.3532 0.5521 1.0421 -0.0809 0.0444 0.0458 403 ILE D CB 13182 C CG1 . ILE D 344 ? 0.4908 0.6939 1.1832 -0.0799 0.0466 0.0486 403 ILE D CG1 13183 C CG2 . ILE D 344 ? 0.4021 0.5973 1.0737 -0.0795 0.0464 0.0484 403 ILE D CG2 13184 C CD1 . ILE D 344 ? 0.4019 0.6055 1.0991 -0.0799 0.0537 0.0557 403 ILE D CD1 13185 N N . LEU D 345 ? 0.3389 0.5412 1.0544 -0.0837 0.0309 0.0311 404 LEU D N 13186 C CA . LEU D 345 ? 0.5142 0.7174 1.2466 -0.0858 0.0287 0.0281 404 LEU D CA 13187 C C . LEU D 345 ? 0.3840 0.5830 1.1150 -0.0868 0.0263 0.0255 404 LEU D C 13188 O O . LEU D 345 ? 0.4960 0.6947 1.2396 -0.0888 0.0275 0.0261 404 LEU D O 13189 C CB . LEU D 345 ? 0.3201 0.5266 1.0593 -0.0854 0.0232 0.0224 404 LEU D CB 13190 C CG . LEU D 345 ? 0.3792 0.5905 1.1302 -0.0857 0.0258 0.0246 404 LEU D CG 13191 C CD1 . LEU D 345 ? 0.3200 0.5344 1.0777 -0.0853 0.0200 0.0185 404 LEU D CD1 13192 C CD2 . LEU D 345 ? 0.3201 0.5321 1.0871 -0.0879 0.0304 0.0285 404 LEU D CD2 13193 N N . PRO D 346 ? 0.3752 0.5711 1.0912 -0.0855 0.0228 0.0227 405 PRO D N 13194 C CA . PRO D 346 ? 0.3610 0.5529 1.0754 -0.0865 0.0211 0.0210 405 PRO D CA 13195 C C . PRO D 346 ? 0.4616 0.6514 1.1775 -0.0877 0.0272 0.0267 405 PRO D C 13196 O O . PRO D 346 ? 0.4011 0.5892 1.1249 -0.0894 0.0269 0.0259 405 PRO D O 13197 C CB . PRO D 346 ? 0.3217 0.5107 1.0176 -0.0845 0.0179 0.0185 405 PRO D CB 13198 C CG . PRO D 346 ? 0.3212 0.5131 1.0146 -0.0828 0.0147 0.0155 405 PRO D CG 13199 C CD . PRO D 346 ? 0.3203 0.5163 1.0222 -0.0832 0.0194 0.0198 405 PRO D CD 13200 N N . LEU D 347 ? 0.3996 0.5896 1.1080 -0.0867 0.0327 0.0322 406 LEU D N 13201 C CA . LEU D 347 ? 0.3211 0.5092 1.0310 -0.0876 0.0389 0.0379 406 LEU D CA 13202 C C . LEU D 347 ? 0.3219 0.5121 1.0509 -0.0896 0.0416 0.0396 406 LEU D C 13203 O O . LEU D 347 ? 0.4699 0.6580 1.2046 -0.0911 0.0438 0.0411 406 LEU D O 13204 C CB . LEU D 347 ? 0.3198 0.5081 1.0188 -0.0858 0.0441 0.0434 406 LEU D CB 13205 C CG . LEU D 347 ? 0.3685 0.5551 1.0689 -0.0862 0.0510 0.0497 406 LEU D CG 13206 C CD1 . LEU D 347 ? 0.3208 0.5028 1.0153 -0.0869 0.0507 0.0490 406 LEU D CD1 13207 C CD2 . LEU D 347 ? 0.4656 0.6525 1.1553 -0.0842 0.0556 0.0548 406 LEU D CD2 13208 N N . ARG D 348 ? 0.4550 0.6495 1.1938 -0.0896 0.0416 0.0395 407 ARG D N 13209 C CA . ARG D 348 ? 0.4672 0.6641 1.2245 -0.0914 0.0445 0.0414 407 ARG D CA 13210 C C . ARG D 348 ? 0.4463 0.6431 1.2164 -0.0933 0.0398 0.0362 407 ARG D C 13211 O O . ARG D 348 ? 0.4054 0.6022 1.1888 -0.0952 0.0423 0.0377 407 ARG D O 13212 C CB . ARG D 348 ? 0.3608 0.5623 1.1242 -0.0907 0.0458 0.0428 407 ARG D CB 13213 C CG . ARG D 348 ? 0.5576 0.7595 1.3109 -0.0888 0.0511 0.0487 407 ARG D CG 13214 C CD . ARG D 348 ? 0.7179 0.9243 1.4744 -0.0878 0.0507 0.0488 407 ARG D CD 13215 N NE . ARG D 348 ? 0.9228 1.1325 1.6986 -0.0895 0.0518 0.0490 407 ARG D NE 13216 C CZ . ARG D 348 ? 0.9262 1.1402 1.7090 -0.0892 0.0505 0.0479 407 ARG D CZ 13217 N NH1 . ARG D 348 ? 0.9012 1.1166 1.6729 -0.0873 0.0480 0.0464 407 ARG D NH1 13218 N NH2 . ARG D 348 ? 0.7362 0.9531 1.5371 -0.0908 0.0517 0.0481 407 ARG D NH2 13219 N N . GLN D 349 ? 0.4341 0.6308 1.2001 -0.0928 0.0330 0.0301 408 GLN D N 13220 C CA . GLN D 349 ? 0.3250 0.5217 1.1025 -0.0943 0.0278 0.0247 408 GLN D CA 13221 C C . GLN D 349 ? 0.3853 0.5774 1.1588 -0.0951 0.0263 0.0233 408 GLN D C 13222 O O . GLN D 349 ? 0.5666 0.7582 1.3526 -0.0970 0.0259 0.0223 408 GLN D O 13223 C CB . GLN D 349 ? 0.3249 0.5235 1.1004 -0.0930 0.0211 0.0185 408 GLN D CB 13224 C CG . GLN D 349 ? 0.3669 0.5704 1.1506 -0.0926 0.0216 0.0187 408 GLN D CG 13225 C CD . GLN D 349 ? 0.3979 0.6031 1.1791 -0.0912 0.0149 0.0123 408 GLN D CD 13226 O OE1 . GLN D 349 ? 0.4181 0.6208 1.1939 -0.0906 0.0095 0.0073 408 GLN D OE1 13227 N NE2 . GLN D 349 ? 0.3235 0.5328 1.1085 -0.0904 0.0152 0.0124 408 GLN D NE2 13228 N N . CYS D 350 ? 0.3915 0.5804 1.1477 -0.0937 0.0254 0.0232 409 CYS D N 13229 C CA . CYS D 350 ? 0.4838 0.6684 1.2348 -0.0942 0.0235 0.0216 409 CYS D CA 13230 C C . CYS D 350 ? 0.5064 0.6885 1.2574 -0.0953 0.0298 0.0272 409 CYS D C 13231 O O . CYS D 350 ? 0.3281 0.5078 1.0840 -0.0968 0.0293 0.0264 409 CYS D O 13232 C CB . CYS D 350 ? 0.3261 0.5080 1.0585 -0.0922 0.0200 0.0192 409 CYS D CB 13233 S SG . CYS D 350 ? 0.5444 0.7286 1.2740 -0.0904 0.0127 0.0126 409 CYS D SG 13234 N N . CYS D 351 ? 0.4454 0.6282 1.1909 -0.0944 0.0357 0.0327 410 CYS D N 13235 C CA . CYS D 351 ? 0.3260 0.5065 1.0704 -0.0950 0.0421 0.0382 410 CYS D CA 13236 C C . CYS D 351 ? 0.3944 0.5701 1.1277 -0.0950 0.0411 0.0375 410 CYS D C 13237 O O . CYS D 351 ? 0.4125 0.5860 1.1501 -0.0963 0.0440 0.0395 410 CYS D O 13238 C CB . CYS D 351 ? 0.3271 0.5089 1.0900 -0.0971 0.0454 0.0401 410 CYS D CB 13239 S SG . CYS D 351 ? 0.6128 0.7992 1.3863 -0.0969 0.0508 0.0448 410 CYS D SG 13240 N N . ILE D 352 ? 0.4504 0.6246 1.1695 -0.0935 0.0369 0.0344 411 ILE D N 13241 C CA . ILE D 352 ? 0.4174 0.5871 1.1231 -0.0931 0.0368 0.0346 411 ILE D CA 13242 C C . ILE D 352 ? 0.4371 0.6063 1.1263 -0.0909 0.0387 0.0370 411 ILE D C 13243 O O . ILE D 352 ? 0.4660 0.6379 1.1524 -0.0896 0.0375 0.0363 411 ILE D O 13244 C CB . ILE D 352 ? 0.4210 0.5886 1.1243 -0.0933 0.0297 0.0286 411 ILE D CB 13245 C CG1 . ILE D 352 ? 0.4334 0.6021 1.1281 -0.0915 0.0244 0.0244 411 ILE D CG1 13246 C CG2 . ILE D 352 ? 0.4093 0.5778 1.1297 -0.0954 0.0272 0.0258 411 ILE D CG2 13247 C CD1 . ILE D 352 ? 0.3349 0.5009 1.0244 -0.0912 0.0177 0.0188 411 ILE D CD1 13248 N N . LEU D 353 ? 0.3808 0.5466 1.0590 -0.0904 0.0418 0.0399 412 LEU D N 13249 C CA . LEU D 353 ? 0.3235 0.4887 0.9869 -0.0884 0.0446 0.0429 412 LEU D CA 13250 C C . LEU D 353 ? 0.3877 0.5486 1.0376 -0.0879 0.0453 0.0436 412 LEU D C 13251 O O . LEU D 353 ? 0.5333 0.6919 1.1858 -0.0889 0.0486 0.0460 412 LEU D O 13252 C CB . LEU D 353 ? 0.3229 0.4902 0.9908 -0.0880 0.0514 0.0488 412 LEU D CB 13253 C CG . LEU D 353 ? 0.4837 0.6505 1.1375 -0.0858 0.0551 0.0528 412 LEU D CG 13254 C CD1 . LEU D 353 ? 0.3857 0.5545 1.0314 -0.0843 0.0512 0.0502 412 LEU D CD1 13255 C CD2 . LEU D 353 ? 0.4306 0.5990 1.0908 -0.0855 0.0620 0.0588 412 LEU D CD2 13256 N N . ARG D 354 ? 0.4212 0.5808 1.0566 -0.0863 0.0422 0.0415 413 ARG D N 13257 C CA . ARG D 354 ? 0.4406 0.5962 1.0619 -0.0857 0.0425 0.0420 413 ARG D CA 13258 C C . ARG D 354 ? 0.5305 0.6850 1.1473 -0.0851 0.0496 0.0479 413 ARG D C 13259 O O . ARG D 354 ? 0.5441 0.7006 1.1590 -0.0838 0.0530 0.0513 413 ARG D O 13260 C CB . ARG D 354 ? 0.4442 0.5992 1.0511 -0.0839 0.0385 0.0390 413 ARG D CB 13261 C CG . ARG D 354 ? 0.4285 0.5795 1.0208 -0.0831 0.0381 0.0388 413 ARG D CG 13262 C CD . ARG D 354 ? 0.3900 0.5404 0.9704 -0.0816 0.0331 0.0349 413 ARG D CD 13263 N NE . ARG D 354 ? 0.4973 0.6470 1.0820 -0.0823 0.0268 0.0293 413 ARG D NE 13264 C CZ . ARG D 354 ? 0.4283 0.5796 1.0137 -0.0815 0.0219 0.0251 413 ARG D CZ 13265 N NH1 . ARG D 354 ? 0.4011 0.5550 0.9830 -0.0801 0.0226 0.0258 413 ARG D NH1 13266 N NH2 . ARG D 354 ? 0.4976 0.6479 1.0870 -0.0819 0.0163 0.0202 413 ARG D NH2 13267 N N . PRO D 355 ? 0.6044 0.7556 1.2194 -0.0858 0.0516 0.0492 414 PRO D N 13268 C CA . PRO D 355 ? 0.5135 0.6632 1.1257 -0.0853 0.0584 0.0547 414 PRO D CA 13269 C C . PRO D 355 ? 0.5203 0.6697 1.1182 -0.0830 0.0610 0.0575 414 PRO D C 13270 O O . PRO D 355 ? 0.5524 0.7023 1.1509 -0.0821 0.0667 0.0624 414 PRO D O 13271 C CB . PRO D 355 ? 0.5686 0.7144 1.1778 -0.0863 0.0579 0.0537 414 PRO D CB 13272 C CG . PRO D 355 ? 0.5053 0.6515 1.1235 -0.0880 0.0522 0.0488 414 PRO D CG 13273 C CD . PRO D 355 ? 0.6607 0.8094 1.2771 -0.0872 0.0474 0.0453 414 PRO D CD 13274 N N . SER D 356 ? 0.3878 0.5360 0.9730 -0.0820 0.0570 0.0546 415 SER D N 13275 C CA . SER D 356 ? 0.4904 0.6382 1.0617 -0.0798 0.0590 0.0568 415 SER D CA 13276 C C . SER D 356 ? 0.5876 0.7391 1.1618 -0.0788 0.0604 0.0588 415 SER D C 13277 O O . SER D 356 ? 0.4935 0.6453 1.0620 -0.0772 0.0648 0.0630 415 SER D O 13278 C CB . SER D 356 ? 0.3197 0.4656 0.8777 -0.0791 0.0539 0.0528 415 SER D CB 13279 O OG . SER D 356 ? 0.6427 0.7905 1.2048 -0.0795 0.0482 0.0482 415 SER D OG 13280 N N . THR D 357 ? 0.5229 0.6773 1.1061 -0.0796 0.0566 0.0556 416 THR D N 13281 C CA . THR D 357 ? 0.4246 0.5828 1.0117 -0.0787 0.0575 0.0570 416 THR D CA 13282 C C . THR D 357 ? 0.5909 0.7506 1.1871 -0.0787 0.0638 0.0625 416 THR D C 13283 O O . THR D 357 ? 0.5085 0.6697 1.1008 -0.0770 0.0670 0.0660 416 THR D O 13284 C CB . THR D 357 ? 0.4162 0.5772 1.0130 -0.0797 0.0522 0.0523 416 THR D CB 13285 O OG1 . THR D 357 ? 0.4483 0.6077 1.0364 -0.0794 0.0464 0.0472 416 THR D OG1 13286 C CG2 . THR D 357 ? 0.3988 0.5637 0.9986 -0.0787 0.0531 0.0537 416 THR D CG2 13287 N N . PHE D 358 ? 0.5468 0.7059 1.1548 -0.0804 0.0657 0.0633 417 PHE D N 13288 C CA . PHE D 358 ? 0.4370 0.5974 1.0550 -0.0804 0.0717 0.0683 417 PHE D CA 13289 C C . PHE D 358 ? 0.4764 0.6348 1.0847 -0.0785 0.0775 0.0736 417 PHE D C 13290 O O . PHE D 358 ? 0.4842 0.6444 1.0945 -0.0771 0.0818 0.0778 417 PHE D O 13291 C CB . PHE D 358 ? 0.4426 0.6022 1.0741 -0.0826 0.0726 0.0679 417 PHE D CB 13292 C CG . PHE D 358 ? 0.4658 0.6259 1.1065 -0.0825 0.0793 0.0733 417 PHE D CG 13293 C CD1 . PHE D 358 ? 0.5158 0.6794 1.1689 -0.0828 0.0809 0.0749 417 PHE D CD1 13294 C CD2 . PHE D 358 ? 0.4252 0.5819 1.0620 -0.0821 0.0841 0.0767 417 PHE D CD2 13295 C CE1 . PHE D 358 ? 0.5320 0.6959 1.1937 -0.0826 0.0873 0.0800 417 PHE D CE1 13296 C CE2 . PHE D 358 ? 0.4004 0.5574 1.0456 -0.0818 0.0905 0.0817 417 PHE D CE2 13297 C CZ . PHE D 358 ? 0.5400 0.7005 1.1977 -0.0820 0.0921 0.0834 417 PHE D CZ 13298 N N . GLN D 359 ? 0.5032 0.6579 1.1013 -0.0782 0.0777 0.0733 418 GLN D N 13299 C CA . GLN D 359 ? 0.5895 0.7420 1.1776 -0.0762 0.0829 0.0778 418 GLN D CA 13300 C C . GLN D 359 ? 0.5689 0.7228 1.1464 -0.0740 0.0830 0.0792 418 GLN D C 13301 O O . GLN D 359 ? 0.4161 0.5704 0.9919 -0.0722 0.0879 0.0840 418 GLN D O 13302 C CB . GLN D 359 ? 0.5849 0.7333 1.1631 -0.0764 0.0822 0.0765 418 GLN D CB 13303 C CG . GLN D 359 ? 0.6319 0.7782 1.2189 -0.0781 0.0840 0.0767 418 GLN D CG 13304 C CD . GLN D 359 ? 0.7501 0.8922 1.3261 -0.0779 0.0844 0.0763 418 GLN D CD 13305 O OE1 . GLN D 359 ? 0.7237 0.8645 1.2906 -0.0780 0.0798 0.0726 418 GLN D OE1 13306 N NE2 . GLN D 359 ? 0.6718 0.8119 1.2486 -0.0773 0.0900 0.0801 418 GLN D NE2 13307 N N . THR D 360 ? 0.4056 0.5601 0.9758 -0.0740 0.0775 0.0750 419 THR D N 13308 C CA . THR D 360 ? 0.3156 0.4716 0.8759 -0.0720 0.0768 0.0756 419 THR D CA 13309 C C . THR D 360 ? 0.3976 0.5573 0.9665 -0.0714 0.0793 0.0786 419 THR D C 13310 O O . THR D 360 ? 0.5552 0.7153 1.1182 -0.0693 0.0829 0.0827 419 THR D O 13311 C CB . THR D 360 ? 0.4537 0.6101 1.0079 -0.0724 0.0701 0.0700 419 THR D CB 13312 O OG1 . THR D 360 ? 0.4314 0.5842 0.9775 -0.0729 0.0678 0.0673 419 THR D OG1 13313 C CG2 . THR D 360 ? 0.3139 0.4715 0.8570 -0.0703 0.0696 0.0707 419 THR D CG2 13314 N N . LEU D 361 ? 0.3203 0.4826 0.9031 -0.0731 0.0774 0.0766 420 LEU D N 13315 C CA . LEU D 361 ? 0.4159 0.5819 1.0084 -0.0727 0.0795 0.0792 420 LEU D CA 13316 C C . LEU D 361 ? 0.4898 0.6554 1.0880 -0.0719 0.0865 0.0853 420 LEU D C 13317 O O . LEU D 361 ? 0.6115 0.7790 1.2096 -0.0702 0.0897 0.0892 420 LEU D O 13318 C CB . LEU D 361 ? 0.3379 0.5064 0.9448 -0.0749 0.0758 0.0754 420 LEU D CB 13319 C CG . LEU D 361 ? 0.4123 0.5820 1.0153 -0.0753 0.0690 0.0695 420 LEU D CG 13320 C CD1 . LEU D 361 ? 0.4027 0.5748 1.0210 -0.0773 0.0657 0.0660 420 LEU D CD1 13321 C CD2 . LEU D 361 ? 0.3237 0.4955 0.9178 -0.0733 0.0684 0.0703 420 LEU D CD2 13322 N N . MSE D 362 ? 0.8410 1.0041 1.4440 -0.0730 0.0889 0.0862 421 MSE D N 13323 C CA . MSE D 362 ? 1.0298 1.1921 1.6384 -0.0721 0.0957 0.0918 421 MSE D CA 13324 C C . MSE D 362 ? 0.7234 0.8836 1.3183 -0.0693 0.0996 0.0959 421 MSE D C 13325 O O . MSE D 362 ? 0.5979 0.7585 1.1950 -0.0675 0.1049 0.1010 421 MSE D O 13326 C CB . MSE D 362 ? 1.1910 1.3508 1.8073 -0.0739 0.0972 0.0913 421 MSE D CB 13327 C CG . MSE D 362 ? 1.0901 1.2519 1.7245 -0.0754 0.0994 0.0927 421 MSE D CG 13328 SE SE . MSE D 362 ? 3.0757 3.2386 3.7155 -0.0730 0.1080 0.1007 421 MSE D SE 13329 C CE . MSE D 362 ? 1.4798 1.6372 2.1104 -0.0715 0.1136 0.1041 421 MSE D CE 13330 N N . ASN D 363 ? 0.4194 0.5773 1.0002 -0.0687 0.0970 0.0936 422 ASN D N 13331 C CA . ASN D 363 ? 0.4381 0.5940 1.0050 -0.0660 0.1001 0.0970 422 ASN D CA 13332 C C . ASN D 363 ? 0.5854 0.7441 1.1486 -0.0640 0.1007 0.0993 422 ASN D C 13333 O O . ASN D 363 ? 0.7290 0.8871 1.2886 -0.0616 0.1055 0.1043 422 ASN D O 13334 C CB . ASN D 363 ? 0.3716 0.5247 0.9247 -0.0660 0.0965 0.0935 422 ASN D CB 13335 C CG . ASN D 363 ? 0.6266 0.7762 1.1805 -0.0673 0.0973 0.0925 422 ASN D CG 13336 O OD1 . ASN D 363 ? 0.5613 0.7100 1.1233 -0.0675 0.1017 0.0954 422 ASN D OD1 13337 N ND2 . ASN D 363 ? 0.6544 0.8021 1.1997 -0.0681 0.0931 0.0884 422 ASN D ND2 13338 N N . PHE D 364 ? 0.4385 0.5999 1.0021 -0.0648 0.0958 0.0958 423 PHE D N 13339 C CA . PHE D 364 ? 0.5063 0.6705 1.0664 -0.0630 0.0959 0.0976 423 PHE D CA 13340 C C . PHE D 364 ? 0.5327 0.6995 1.1051 -0.0625 0.1000 0.1019 423 PHE D C 13341 O O . PHE D 364 ? 0.5797 0.7472 1.1480 -0.0601 0.1034 0.1063 423 PHE D O 13342 C CB . PHE D 364 ? 0.4208 0.5873 0.9791 -0.0640 0.0895 0.0924 423 PHE D CB 13343 C CG . PHE D 364 ? 0.4254 0.5896 0.9692 -0.0637 0.0856 0.0888 423 PHE D CG 13344 C CD1 . PHE D 364 ? 0.4379 0.6002 0.9675 -0.0614 0.0876 0.0913 423 PHE D CD1 13345 C CD2 . PHE D 364 ? 0.3283 0.4923 0.8726 -0.0656 0.0800 0.0830 423 PHE D CD2 13346 C CE1 . PHE D 364 ? 0.4029 0.5632 0.9194 -0.0612 0.0841 0.0880 423 PHE D CE1 13347 C CE2 . PHE D 364 ? 0.3114 0.4732 0.8424 -0.0652 0.0766 0.0798 423 PHE D CE2 13348 C CZ . PHE D 364 ? 0.3106 0.4706 0.8278 -0.0631 0.0787 0.0823 423 PHE D CZ 13349 N N . TYR D 365 ? 0.4035 0.5717 0.9910 -0.0647 0.0997 0.1007 424 TYR D N 13350 C CA . TYR D 365 ? 0.4643 0.6352 1.0648 -0.0645 0.1034 0.1044 424 TYR D CA 13351 C C . TYR D 365 ? 0.5520 0.7209 1.1531 -0.0625 0.1105 0.1106 424 TYR D C 13352 O O . TYR D 365 ? 0.6066 0.7774 1.2112 -0.0608 0.1140 0.1150 424 TYR D O 13353 C CB . TYR D 365 ? 0.3151 0.4876 0.9318 -0.0674 0.1015 0.1014 424 TYR D CB 13354 C CG . TYR D 365 ? 0.5307 0.7061 1.1617 -0.0674 0.1052 0.1050 424 TYR D CG 13355 C CD1 . TYR D 365 ? 0.3702 0.5490 1.0014 -0.0661 0.1051 0.1066 424 TYR D CD1 13356 C CD2 . TYR D 365 ? 0.5171 0.6918 1.1611 -0.0686 0.1088 0.1068 424 TYR D CD2 13357 C CE1 . TYR D 365 ? 0.3433 0.5247 0.9875 -0.0660 0.1084 0.1100 424 TYR D CE1 13358 C CE2 . TYR D 365 ? 0.5211 0.6983 1.1783 -0.0686 0.1123 0.1102 424 TYR D CE2 13359 C CZ . TYR D 365 ? 0.5462 0.7268 1.2035 -0.0673 0.1121 0.1117 424 TYR D CZ 13360 O OH . TYR D 365 ? 0.5552 0.7385 1.2257 -0.0672 0.1155 0.1152 424 TYR D OH 13361 N N . SER D 366 ? 0.5596 0.7248 1.1573 -0.0626 0.1125 0.1110 425 SER D N 13362 C CA . SER D 366 ? 0.5825 0.7452 1.1809 -0.0606 0.1192 0.1165 425 SER D CA 13363 C C . SER D 366 ? 0.6697 0.8317 1.2553 -0.0571 0.1219 0.1205 425 SER D C 13364 O O . SER D 366 ? 0.7086 0.8692 1.2948 -0.0548 0.1277 0.1257 425 SER D O 13365 C CB . SER D 366 ? 0.4655 0.6243 1.0624 -0.0616 0.1202 0.1153 425 SER D CB 13366 O OG . SER D 366 ? 0.6561 0.8131 1.2397 -0.0618 0.1161 0.1117 425 SER D OG 13367 N N . THR D 367 ? 0.5354 0.6981 1.1094 -0.0566 0.1178 0.1181 426 THR D N 13368 C CA . THR D 367 ? 0.5498 0.7120 1.1112 -0.0533 0.1196 0.1215 426 THR D CA 13369 C C . THR D 367 ? 0.6134 0.7795 1.1740 -0.0530 0.1167 0.1209 426 THR D C 13370 O O . THR D 367 ? 0.5008 0.6679 1.0554 -0.0541 0.1113 0.1164 426 THR D O 13371 C CB . THR D 367 ? 0.5641 0.7232 1.1098 -0.0526 0.1177 0.1194 426 THR D CB 13372 O OG1 . THR D 367 ? 0.6558 0.8113 1.2021 -0.0530 0.1203 0.1197 426 THR D OG1 13373 C CG2 . THR D 367 ? 0.5839 0.7424 1.1172 -0.0492 0.1199 0.1231 426 THR D CG2 13374 N N . PRO D 368 ? 0.6951 0.8633 1.2620 -0.0514 0.1202 0.1254 427 PRO D N 13375 C CA . PRO D 368 ? 0.7312 0.9033 1.2986 -0.0510 0.1179 0.1253 427 PRO D CA 13376 C C . PRO D 368 ? 0.7404 0.9124 1.2917 -0.0496 0.1146 0.1237 427 PRO D C 13377 O O . PRO D 368 ? 0.7815 0.9506 1.3210 -0.0474 0.1164 0.1258 427 PRO D O 13378 C CB . PRO D 368 ? 0.7299 0.9029 1.3028 -0.0485 0.1236 0.1318 427 PRO D CB 13379 C CG . PRO D 368 ? 0.7084 0.8792 1.2908 -0.0490 0.1281 0.1339 427 PRO D CG 13380 C CD . PRO D 368 ? 0.7284 0.8954 1.3025 -0.0498 0.1268 0.1310 427 PRO D CD 13381 N N . LYS D 369 ? 0.4812 0.6562 1.0322 -0.0508 0.1096 0.1199 428 LYS D N 13382 C CA . LYS D 369 ? 0.3867 0.5620 0.9234 -0.0496 0.1061 0.1181 428 LYS D CA 13383 C C . LYS D 369 ? 0.5594 0.7315 1.0846 -0.0503 0.1030 0.1140 428 LYS D C 13384 O O . LYS D 369 ? 0.5343 0.7063 1.0471 -0.0493 0.1002 0.1124 428 LYS D O 13385 C CB . LYS D 369 ? 0.4144 0.5896 0.9427 -0.0461 0.1098 0.1236 428 LYS D CB 13386 C CG . LYS D 369 ? 0.3130 0.4912 0.8509 -0.0450 0.1128 0.1280 428 LYS D CG 13387 C CD . LYS D 369 ? 0.5685 0.7459 1.0979 -0.0412 0.1169 0.1339 428 LYS D CD 13388 C CE . LYS D 369 ? 0.6721 0.8526 1.2109 -0.0400 0.1198 0.1383 428 LYS D CE 13389 N NZ . LYS D 369 ? 0.7384 0.9227 1.2769 -0.0407 0.1157 0.1359 428 LYS D NZ 13390 N N . SER D 370 ? 0.5494 0.7191 1.0786 -0.0519 0.1035 0.1125 429 SER D N 13391 C CA . SER D 370 ? 0.4258 0.5922 0.9443 -0.0524 0.1010 0.1092 429 SER D CA 13392 C C . SER D 370 ? 0.3807 0.5480 0.8967 -0.0544 0.0946 0.1027 429 SER D C 13393 O O . SER D 370 ? 0.5640 0.7295 1.0675 -0.0540 0.0919 0.1002 429 SER D O 13394 C CB . SER D 370 ? 0.4871 0.6506 1.0108 -0.0534 0.1036 0.1096 429 SER D CB 13395 O OG . SER D 370 ? 0.5047 0.6695 1.0420 -0.0563 0.1017 0.1067 429 SER D OG 13396 N N . LEU D 371 ? 0.4858 0.6557 1.0139 -0.0565 0.0920 0.1000 430 LEU D N 13397 C CA . LEU D 371 ? 0.6037 0.7745 1.1304 -0.0582 0.0858 0.0938 430 LEU D CA 13398 C C . LEU D 371 ? 0.5069 0.6792 1.0224 -0.0566 0.0832 0.0928 430 LEU D C 13399 O O . LEU D 371 ? 0.4513 0.6220 0.9561 -0.0567 0.0796 0.0891 430 LEU D O 13400 C CB . LEU D 371 ? 0.5993 0.7730 1.1418 -0.0604 0.0839 0.0914 430 LEU D CB 13401 C CG . LEU D 371 ? 0.4423 0.6172 0.9840 -0.0618 0.0774 0.0849 430 LEU D CG 13402 C CD1 . LEU D 371 ? 0.3094 0.4809 0.8452 -0.0629 0.0744 0.0810 430 LEU D CD1 13403 C CD2 . LEU D 371 ? 0.3419 0.5200 0.8994 -0.0636 0.0757 0.0829 430 LEU D CD2 13404 N N . THR D 372 ? 0.3546 0.5297 0.8725 -0.0553 0.0852 0.0961 431 THR D N 13405 C CA . THR D 372 ? 0.5387 0.7155 1.0465 -0.0537 0.0829 0.0955 431 THR D CA 13406 C C . THR D 372 ? 0.5721 0.7462 1.0639 -0.0514 0.0844 0.0977 431 THR D C 13407 O O . THR D 372 ? 0.6940 0.8682 1.1747 -0.0506 0.0815 0.0955 431 THR D O 13408 C CB . THR D 372 ? 0.5725 0.7530 1.0872 -0.0528 0.0848 0.0987 431 THR D CB 13409 O OG1 . THR D 372 ? 0.6425 0.8225 1.1611 -0.0513 0.0907 0.1050 431 THR D OG1 13410 C CG2 . THR D 372 ? 0.3059 0.4894 0.8354 -0.0550 0.0823 0.0956 431 THR D CG2 13411 N N . LYS D 373 ? 0.5735 0.7452 1.0641 -0.0504 0.0890 0.1019 432 LYS D N 13412 C CA . LYS D 373 ? 0.5108 0.6797 0.9866 -0.0482 0.0905 0.1038 432 LYS D CA 13413 C C . LYS D 373 ? 0.3834 0.5495 0.8501 -0.0493 0.0868 0.0990 432 LYS D C 13414 O O . LYS D 373 ? 0.3842 0.5494 0.8378 -0.0480 0.0852 0.0980 432 LYS D O 13415 C CB . LYS D 373 ? 0.6381 0.8048 1.1155 -0.0467 0.0963 0.1092 432 LYS D CB 13416 C CG . LYS D 373 ? 0.6087 0.7771 1.0869 -0.0442 0.1004 0.1150 432 LYS D CG 13417 C CD . LYS D 373 ? 0.6871 0.8536 1.1698 -0.0428 0.1062 0.1201 432 LYS D CD 13418 C CE . LYS D 373 ? 0.6822 0.8502 1.1654 -0.0399 0.1101 0.1259 432 LYS D CE 13419 N NZ . LYS D 373 ? 0.6472 0.8151 1.1160 -0.0375 0.1091 0.1269 432 LYS D NZ 13420 N N . ALA D 374 ? 0.3409 0.5059 0.8148 -0.0516 0.0855 0.0961 433 ALA D N 13421 C CA . ALA D 374 ? 0.4135 0.5759 0.8803 -0.0527 0.0819 0.0914 433 ALA D CA 13422 C C . ALA D 374 ? 0.4913 0.6552 0.9538 -0.0533 0.0764 0.0864 433 ALA D C 13423 O O . ALA D 374 ? 0.5735 0.7354 1.0252 -0.0532 0.0735 0.0833 433 ALA D O 13424 C CB . ALA D 374 ? 0.3071 0.4681 0.7838 -0.0550 0.0817 0.0895 433 ALA D CB 13425 N N . LEU D 375 ? 0.5444 0.7118 1.0154 -0.0538 0.0750 0.0857 434 LEU D N 13426 C CA . LEU D 375 ? 0.5549 0.7240 1.0226 -0.0541 0.0701 0.0812 434 LEU D CA 13427 C C . LEU D 375 ? 0.5230 0.6926 0.9778 -0.0517 0.0703 0.0829 434 LEU D C 13428 O O . LEU D 375 ? 0.5098 0.6786 0.9545 -0.0514 0.0668 0.0793 434 LEU D O 13429 C CB . LEU D 375 ? 0.4031 0.5759 0.8846 -0.0552 0.0688 0.0801 434 LEU D CB 13430 C CG . LEU D 375 ? 0.4815 0.6564 0.9602 -0.0552 0.0638 0.0755 434 LEU D CG 13431 C CD1 . LEU D 375 ? 0.3062 0.4790 0.7810 -0.0564 0.0590 0.0695 434 LEU D CD1 13432 C CD2 . LEU D 375 ? 0.3057 0.4846 0.7979 -0.0560 0.0633 0.0752 434 LEU D CD2 13433 N N . HIS D 376 ? 0.4282 0.5989 0.8833 -0.0500 0.0746 0.0884 435 HIS D N 13434 C CA . HIS D 376 ? 0.4398 0.6110 0.8831 -0.0476 0.0753 0.0907 435 HIS D CA 13435 C C . HIS D 376 ? 0.5767 0.7443 1.0054 -0.0467 0.0749 0.0899 435 HIS D C 13436 O O . HIS D 376 ? 0.4316 0.5991 0.8491 -0.0457 0.0726 0.0881 435 HIS D O 13437 C CB . HIS D 376 ? 0.4768 0.6492 0.9235 -0.0458 0.0804 0.0972 435 HIS D CB 13438 C CG . HIS D 376 ? 0.5946 0.7678 1.0303 -0.0433 0.0811 0.0998 435 HIS D CG 13439 N ND1 . HIS D 376 ? 0.6568 0.8299 1.0809 -0.0428 0.0775 0.0965 435 HIS D ND1 13440 C CD2 . HIS D 376 ? 0.6166 0.7906 1.0508 -0.0410 0.0851 0.1055 435 HIS D CD2 13441 C CE1 . HIS D 376 ? 0.6466 0.8204 1.0626 -0.0404 0.0791 0.1000 435 HIS D CE1 13442 N NE2 . HIS D 376 ? 0.6083 0.7827 1.0302 -0.0392 0.0837 0.1055 435 HIS D NE2 13443 N N . GLU D 377 ? 0.4656 0.6304 0.8946 -0.0470 0.0774 0.0913 436 GLU D N 13444 C CA . GLU D 377 ? 0.5312 0.6925 0.9473 -0.0462 0.0773 0.0907 436 GLU D CA 13445 C C . GLU D 377 ? 0.4728 0.6329 0.8831 -0.0475 0.0721 0.0846 436 GLU D C 13446 O O . GLU D 377 ? 0.6136 0.7721 1.0111 -0.0464 0.0708 0.0834 436 GLU D O 13447 C CB . GLU D 377 ? 0.6082 0.7668 1.0271 -0.0464 0.0809 0.0931 436 GLU D CB 13448 C CG . GLU D 377 ? 0.8287 0.9838 1.2345 -0.0453 0.0813 0.0930 436 GLU D CG 13449 C CD . GLU D 377 ? 1.1222 1.2770 1.5180 -0.0424 0.0841 0.0972 436 GLU D CD 13450 O OE1 . GLU D 377 ? 1.1206 1.2779 1.5193 -0.0411 0.0858 0.1005 436 GLU D OE1 13451 O OE2 . GLU D 377 ? 1.1627 1.3147 1.5477 -0.0414 0.0846 0.0972 436 GLU D OE2 13452 N N . SER D 378 ? 0.4907 0.6516 0.9106 -0.0497 0.0693 0.0808 437 SER D N 13453 C CA . SER D 378 ? 0.3668 0.5265 0.7822 -0.0508 0.0643 0.0749 437 SER D CA 13454 C C . SER D 378 ? 0.5167 0.6781 0.9255 -0.0498 0.0611 0.0725 437 SER D C 13455 O O . SER D 378 ? 0.4822 0.6419 0.8797 -0.0493 0.0586 0.0697 437 SER D O 13456 C CB . SER D 378 ? 0.3380 0.4980 0.7659 -0.0531 0.0620 0.0716 437 SER D CB 13457 O OG . SER D 378 ? 0.5152 0.6735 0.9384 -0.0540 0.0573 0.0661 437 SER D OG 13458 N N . LEU D 379 ? 0.3544 0.5193 0.7702 -0.0496 0.0615 0.0738 438 LEU D N 13459 C CA . LEU D 379 ? 0.4584 0.6253 0.8688 -0.0486 0.0587 0.0718 438 LEU D CA 13460 C C . LEU D 379 ? 0.4999 0.6659 0.8958 -0.0464 0.0601 0.0742 438 LEU D C 13461 O O . LEU D 379 ? 0.5388 0.7048 0.9254 -0.0456 0.0572 0.0713 438 LEU D O 13462 C CB . LEU D 379 ? 0.4643 0.6352 0.8856 -0.0487 0.0594 0.0734 438 LEU D CB 13463 C CG . LEU D 379 ? 0.3773 0.5498 0.8132 -0.0508 0.0573 0.0703 438 LEU D CG 13464 C CD1 . LEU D 379 ? 0.3389 0.5155 0.7853 -0.0507 0.0586 0.0726 438 LEU D CD1 13465 C CD2 . LEU D 379 ? 0.4141 0.5860 0.8473 -0.0516 0.0517 0.0636 438 LEU D CD2 13466 N N . SER D 380 ? 0.5278 0.6928 0.9217 -0.0453 0.0646 0.0794 439 SER D N 13467 C CA . SER D 380 ? 0.4217 0.5858 0.8025 -0.0430 0.0663 0.0822 439 SER D CA 13468 C C . SER D 380 ? 0.4753 0.6363 0.8430 -0.0428 0.0639 0.0789 439 SER D C 13469 O O . SER D 380 ? 0.5474 0.7081 0.9036 -0.0411 0.0636 0.0793 439 SER D O 13470 C CB . SER D 380 ? 0.5326 0.6958 0.9146 -0.0418 0.0715 0.0881 439 SER D CB 13471 O OG . SER D 380 ? 0.6994 0.8654 1.0924 -0.0416 0.0740 0.0917 439 SER D OG 13472 N N . LYS D 381 ? 0.3097 0.4685 0.6792 -0.0444 0.0622 0.0756 440 LYS D N 13473 C CA . LYS D 381 ? 0.3736 0.5293 0.7313 -0.0442 0.0599 0.0723 440 LYS D CA 13474 C C . LYS D 381 ? 0.4012 0.5575 0.7543 -0.0443 0.0553 0.0672 440 LYS D C 13475 O O . LYS D 381 ? 0.6521 0.8062 0.9938 -0.0437 0.0534 0.0648 440 LYS D O 13476 C CB . LYS D 381 ? 0.4265 0.5795 0.7875 -0.0458 0.0597 0.0707 440 LYS D CB 13477 C CG . LYS D 381 ? 0.5772 0.7290 0.9408 -0.0455 0.0643 0.0753 440 LYS D CG 13478 C CD . LYS D 381 ? 0.6564 0.8050 1.0197 -0.0468 0.0639 0.0734 440 LYS D CD 13479 C CE . LYS D 381 ? 0.6675 0.8163 1.0401 -0.0490 0.0605 0.0691 440 LYS D CE 13480 N NZ . LYS D 381 ? 0.7185 0.8698 1.1058 -0.0500 0.0622 0.0710 440 LYS D NZ 13481 N N . ASP D 382 ? 0.5056 0.6648 0.8676 -0.0450 0.0534 0.0656 441 ASP D N 13482 C CA . ASP D 382 ? 0.3622 0.5222 0.7204 -0.0448 0.0491 0.0608 441 ASP D CA 13483 C C . ASP D 382 ? 0.4160 0.5770 0.7635 -0.0428 0.0497 0.0624 441 ASP D C 13484 O O . ASP D 382 ? 0.4529 0.6161 0.8025 -0.0418 0.0526 0.0669 441 ASP D O 13485 C CB . ASP D 382 ? 0.3826 0.5454 0.7537 -0.0460 0.0470 0.0585 441 ASP D CB 13486 C CG . ASP D 382 ? 0.4259 0.5891 0.7935 -0.0458 0.0422 0.0528 441 ASP D CG 13487 O OD1 . ASP D 382 ? 0.5194 0.6843 0.8813 -0.0444 0.0417 0.0529 441 ASP D OD1 13488 O OD2 . ASP D 382 ? 0.3906 0.5524 0.7610 -0.0469 0.0390 0.0483 441 ASP D OD2 13489 N N . PRO D 383 ? 0.3239 0.4832 0.6599 -0.0420 0.0469 0.0589 442 PRO D N 13490 C CA . PRO D 383 ? 0.3030 0.4628 0.6273 -0.0400 0.0473 0.0601 442 PRO D CA 13491 C C . PRO D 383 ? 0.3561 0.5196 0.6839 -0.0393 0.0468 0.0608 442 PRO D C 13492 O O . PRO D 383 ? 0.5353 0.6996 0.8550 -0.0376 0.0481 0.0632 442 PRO D O 13493 C CB . PRO D 383 ? 0.3038 0.4610 0.6177 -0.0397 0.0437 0.0550 442 PRO D CB 13494 C CG . PRO D 383 ? 0.3469 0.5015 0.6648 -0.0413 0.0426 0.0526 442 PRO D CG 13495 C CD . PRO D 383 ? 0.3044 0.4610 0.6375 -0.0429 0.0434 0.0537 442 PRO D CD 13496 N N . ALA D 384 ? 0.4622 0.6280 0.8018 -0.0405 0.0451 0.0586 443 ALA D N 13497 C CA . ALA D 384 ? 0.3032 0.4726 0.6467 -0.0399 0.0444 0.0587 443 ALA D CA 13498 C C . ALA D 384 ? 0.3509 0.5231 0.7057 -0.0402 0.0478 0.0637 443 ALA D C 13499 O O . ALA D 384 ? 0.3699 0.5454 0.7310 -0.0401 0.0473 0.0638 443 ALA D O 13500 C CB . ALA D 384 ? 0.3043 0.4745 0.6531 -0.0408 0.0399 0.0527 443 ALA D CB 13501 N N . HIS D 385 ? 0.3020 0.4729 0.6593 -0.0405 0.0513 0.0678 444 HIS D N 13502 C CA . HIS D 385 ? 0.3279 0.5010 0.6958 -0.0406 0.0550 0.0729 444 HIS D CA 13503 C C . HIS D 385 ? 0.3990 0.5744 0.7626 -0.0386 0.0570 0.0769 444 HIS D C 13504 O O . HIS D 385 ? 0.4366 0.6111 0.7873 -0.0370 0.0567 0.0773 444 HIS D O 13505 C CB . HIS D 385 ? 0.4292 0.5998 0.7986 -0.0409 0.0586 0.0764 444 HIS D CB 13506 C CG . HIS D 385 ? 0.6779 0.8465 1.0347 -0.0390 0.0611 0.0799 444 HIS D CG 13507 N ND1 . HIS D 385 ? 0.8916 1.0574 1.2358 -0.0385 0.0594 0.0774 444 HIS D ND1 13508 C CD2 . HIS D 385 ? 0.6383 0.8072 0.9935 -0.0373 0.0652 0.0858 444 HIS D CD2 13509 C CE1 . HIS D 385 ? 0.7293 0.8939 1.0647 -0.0367 0.0623 0.0815 444 HIS D CE1 13510 N NE2 . HIS D 385 ? 0.8368 1.0033 1.1786 -0.0358 0.0657 0.0866 444 HIS D NE2 13511 N N . PRO D 386 ? 0.3006 0.4791 0.6750 -0.0387 0.0589 0.0800 445 PRO D N 13512 C CA . PRO D 386 ? 0.4587 0.6387 0.8491 -0.0406 0.0595 0.0800 445 PRO D CA 13513 C C . PRO D 386 ? 0.3626 0.5438 0.7599 -0.0423 0.0550 0.0739 445 PRO D C 13514 O O . PRO D 386 ? 0.4558 0.6388 0.8498 -0.0417 0.0522 0.0711 445 PRO D O 13515 C CB . PRO D 386 ? 0.3004 0.4835 0.6971 -0.0395 0.0626 0.0852 445 PRO D CB 13516 C CG . PRO D 386 ? 0.3000 0.4843 0.6854 -0.0376 0.0616 0.0855 445 PRO D CG 13517 C CD . PRO D 386 ? 0.2999 0.4808 0.6706 -0.0368 0.0607 0.0841 445 PRO D CD 13518 N N . ILE D 387 ? 0.3531 0.5332 0.7597 -0.0442 0.0544 0.0718 446 ILE D N 13519 C CA . ILE D 387 ? 0.4186 0.5996 0.8325 -0.0458 0.0501 0.0660 446 ILE D CA 13520 C C . ILE D 387 ? 0.4873 0.6721 0.9158 -0.0466 0.0505 0.0667 446 ILE D C 13521 O O . ILE D 387 ? 0.4792 0.6662 0.9108 -0.0468 0.0471 0.0627 446 ILE D O 13522 C CB . ILE D 387 ? 0.3563 0.5343 0.7739 -0.0475 0.0491 0.0634 446 ILE D CB 13523 C CG1 . ILE D 387 ? 0.3184 0.4926 0.7219 -0.0467 0.0489 0.0628 446 ILE D CG1 13524 C CG2 . ILE D 387 ? 0.3998 0.5784 0.8244 -0.0489 0.0444 0.0572 446 ILE D CG2 13525 C CD1 . ILE D 387 ? 0.3459 0.5194 0.7366 -0.0454 0.0456 0.0592 446 ILE D CD1 13526 N N . LEU D 388 ? 0.3465 0.5322 0.7837 -0.0469 0.0547 0.0718 447 LEU D N 13527 C CA . LEU D 388 ? 0.3269 0.5161 0.7787 -0.0477 0.0556 0.0731 447 LEU D CA 13528 C C . LEU D 388 ? 0.3021 0.4935 0.7537 -0.0461 0.0596 0.0792 447 LEU D C 13529 O O . LEU D 388 ? 0.4346 0.6243 0.8794 -0.0447 0.0631 0.0838 447 LEU D O 13530 C CB . LEU D 388 ? 0.3034 0.4919 0.7685 -0.0498 0.0570 0.0735 447 LEU D CB 13531 C CG . LEU D 388 ? 0.5168 0.7039 0.9862 -0.0517 0.0528 0.0674 447 LEU D CG 13532 C CD1 . LEU D 388 ? 0.3048 0.4907 0.7858 -0.0535 0.0550 0.0688 447 LEU D CD1 13533 C CD2 . LEU D 388 ? 0.3871 0.5771 0.8628 -0.0522 0.0486 0.0627 447 LEU D CD2 13534 N N . ALA D 389 ? 0.3585 0.5537 0.8175 -0.0460 0.0590 0.0792 448 ALA D N 13535 C CA . ALA D 389 ? 0.3014 0.4990 0.7635 -0.0447 0.0630 0.0853 448 ALA D CA 13536 C C . ALA D 389 ? 0.4845 0.6815 0.9576 -0.0455 0.0673 0.0896 448 ALA D C 13537 O O . ALA D 389 ? 0.5735 0.7701 1.0575 -0.0476 0.0666 0.0873 448 ALA D O 13538 C CB . ALA D 389 ? 0.3014 0.5033 0.7705 -0.0447 0.0612 0.0839 448 ALA D CB 13539 N N . TYR D 390 ? 0.4526 0.6492 0.9227 -0.0437 0.0719 0.0959 449 TYR D N 13540 C CA . TYR D 390 ? 0.4910 0.6862 0.9691 -0.0439 0.0765 0.1004 449 TYR D CA 13541 C C . TYR D 390 ? 0.5394 0.7374 1.0353 -0.0454 0.0777 0.1012 449 TYR D C 13542 O O . TYR D 390 ? 0.4999 0.6967 1.0049 -0.0464 0.0806 0.1031 449 TYR D O 13543 C CB . TYR D 390 ? 0.3478 0.5421 0.8183 -0.0411 0.0810 0.1070 449 TYR D CB 13544 C CG . TYR D 390 ? 0.5232 0.7145 0.9768 -0.0396 0.0803 0.1068 449 TYR D CG 13545 C CD1 . TYR D 390 ? 0.3827 0.5711 0.8308 -0.0409 0.0775 0.1021 449 TYR D CD1 13546 C CD2 . TYR D 390 ? 0.4578 0.6490 0.9010 -0.0369 0.0824 0.1111 449 TYR D CD2 13547 C CE1 . TYR D 390 ? 0.5176 0.7032 0.9505 -0.0396 0.0770 0.1019 449 TYR D CE1 13548 C CE2 . TYR D 390 ? 0.3029 0.4913 0.7309 -0.0355 0.0818 0.1108 449 TYR D CE2 13549 C CZ . TYR D 390 ? 0.4853 0.6710 0.9084 -0.0369 0.0791 0.1061 449 TYR D CZ 13550 O OH . TYR D 390 ? 0.6103 0.7932 1.0186 -0.0356 0.0786 0.1058 449 TYR D OH 13551 N N . LYS D 391 ? 0.3015 0.5033 0.8024 -0.0456 0.0756 0.0996 450 LYS D N 13552 C CA . LYS D 391 ? 0.3019 0.5067 0.8199 -0.0470 0.0765 0.1001 450 LYS D CA 13553 C C . LYS D 391 ? 0.3367 0.5408 0.8656 -0.0499 0.0742 0.0954 450 LYS D C 13554 O O . LYS D 391 ? 0.4217 0.6274 0.9655 -0.0512 0.0757 0.0963 450 LYS D O 13555 C CB . LYS D 391 ? 0.3016 0.5105 0.8212 -0.0466 0.0742 0.0987 450 LYS D CB 13556 C CG . LYS D 391 ? 0.4637 0.6728 0.9748 -0.0469 0.0685 0.0922 450 LYS D CG 13557 C CD . LYS D 391 ? 0.3014 0.5147 0.8145 -0.0463 0.0664 0.0910 450 LYS D CD 13558 C CE . LYS D 391 ? 0.3969 0.6099 0.8981 -0.0459 0.0614 0.0853 450 LYS D CE 13559 N NZ . LYS D 391 ? 0.3107 0.5277 0.8144 -0.0454 0.0591 0.0835 450 LYS D NZ 13560 N N . HIS D 392 ? 0.3598 0.5613 0.8811 -0.0506 0.0707 0.0905 451 HIS D N 13561 C CA . HIS D 392 ? 0.4046 0.6050 0.9348 -0.0531 0.0682 0.0860 451 HIS D CA 13562 C C . HIS D 392 ? 0.4249 0.6223 0.9591 -0.0538 0.0720 0.0890 451 HIS D C 13563 O O . HIS D 392 ? 0.4444 0.6414 0.9894 -0.0559 0.0713 0.0868 451 HIS D O 13564 C CB . HIS D 392 ? 0.3041 0.5027 0.8245 -0.0535 0.0629 0.0796 451 HIS D CB 13565 C CG . HIS D 392 ? 0.4174 0.6189 0.9368 -0.0533 0.0586 0.0753 451 HIS D CG 13566 N ND1 . HIS D 392 ? 0.4513 0.6551 0.9829 -0.0549 0.0554 0.0709 451 HIS D ND1 13567 C CD2 . HIS D 392 ? 0.4282 0.6307 0.9359 -0.0515 0.0569 0.0746 451 HIS D CD2 13568 C CE1 . HIS D 392 ? 0.3532 0.5592 0.8805 -0.0541 0.0519 0.0676 451 HIS D CE1 13569 N NE2 . HIS D 392 ? 0.4138 0.6189 0.9264 -0.0520 0.0528 0.0698 451 HIS D NE2 13570 N N . TYR D 393 ? 0.4556 0.6510 0.9809 -0.0519 0.0759 0.0940 452 TYR D N 13571 C CA . TYR D 393 ? 0.3940 0.5863 0.9219 -0.0522 0.0799 0.0971 452 TYR D CA 13572 C C . TYR D 393 ? 0.3930 0.5869 0.9375 -0.0531 0.0836 0.1004 452 TYR D C 13573 O O . TYR D 393 ? 0.3386 0.5310 0.8915 -0.0549 0.0841 0.0993 452 TYR D O 13574 C CB . TYR D 393 ? 0.3755 0.5654 0.8902 -0.0496 0.0834 0.1019 452 TYR D CB 13575 C CG . TYR D 393 ? 0.4130 0.6005 0.9117 -0.0489 0.0803 0.0988 452 TYR D CG 13576 C CD1 . TYR D 393 ? 0.4294 0.6156 0.9265 -0.0507 0.0758 0.0927 452 TYR D CD1 13577 C CD2 . TYR D 393 ? 0.5535 0.7399 1.0387 -0.0464 0.0820 0.1020 452 TYR D CD2 13578 C CE1 . TYR D 393 ? 0.5099 0.6937 0.9925 -0.0501 0.0732 0.0900 452 TYR D CE1 13579 C CE2 . TYR D 393 ? 0.4581 0.6422 0.9288 -0.0458 0.0793 0.0992 452 TYR D CE2 13580 C CZ . TYR D 393 ? 0.4081 0.5910 0.8777 -0.0477 0.0750 0.0932 452 TYR D CZ 13581 O OH . TYR D 393 ? 0.5129 0.6935 0.9683 -0.0470 0.0725 0.0905 452 TYR D OH 13582 N N . PRO D 394 ? 0.4747 0.6716 1.0241 -0.0518 0.0863 0.1046 453 PRO D N 13583 C CA . PRO D 394 ? 0.4374 0.6357 1.0033 -0.0529 0.0896 0.1073 453 PRO D CA 13584 C C . PRO D 394 ? 0.5091 0.7095 1.0882 -0.0557 0.0859 0.1021 453 PRO D C 13585 O O . PRO D 394 ? 0.6899 0.8902 1.2822 -0.0573 0.0879 0.1028 453 PRO D O 13586 C CB . PRO D 394 ? 0.3447 0.5459 0.9120 -0.0508 0.0926 0.1124 453 PRO D CB 13587 C CG . PRO D 394 ? 0.3037 0.5061 0.8581 -0.0495 0.0890 0.1103 453 PRO D CG 13588 C CD . PRO D 394 ? 0.3036 0.5024 0.8445 -0.0495 0.0867 0.1072 453 PRO D CD 13589 N N . ALA D 395 ? 0.6934 0.8954 1.2686 -0.0562 0.0806 0.0969 454 ALA D N 13590 C CA . ALA D 395 ? 0.5984 0.8024 1.1850 -0.0587 0.0764 0.0913 454 ALA D CA 13591 C C . ALA D 395 ? 0.5561 0.7570 1.1453 -0.0606 0.0749 0.0879 454 ALA D C 13592 O O . ALA D 395 ? 0.7508 0.9525 1.3538 -0.0627 0.0741 0.0859 454 ALA D O 13593 C CB . ALA D 395 ? 0.5294 0.7354 1.1092 -0.0583 0.0711 0.0863 454 ALA D CB 13594 N N . MSE D 396 ? 0.4548 0.6521 1.0307 -0.0599 0.0745 0.0874 455 MSE D N 13595 C CA . MSE D 396 ? 0.4590 0.6530 1.0354 -0.0615 0.0731 0.0845 455 MSE D CA 13596 C C . MSE D 396 ? 0.7306 0.9231 1.3161 -0.0622 0.0782 0.0887 455 MSE D C 13597 O O . MSE D 396 ? 0.7599 0.9514 1.3545 -0.0643 0.0773 0.0864 455 MSE D O 13598 C CB . MSE D 396 ? 0.3071 0.4977 0.8663 -0.0604 0.0715 0.0831 455 MSE D CB 13599 C CG . MSE D 396 ? 0.8503 1.0402 1.4055 -0.0615 0.0654 0.0762 455 MSE D CG 13600 SE SE . MSE D 396 ? 1.1491 1.3352 1.6817 -0.0597 0.0635 0.0747 455 MSE D SE 13601 C CE . MSE D 396 ? 0.5861 0.7719 1.1189 -0.0612 0.0557 0.0657 455 MSE D CE 13602 N N . GLU D 397 ? 0.5193 0.7114 1.1018 -0.0603 0.0834 0.0949 456 GLU D N 13603 C CA . GLU D 397 ? 0.4821 0.6728 1.0729 -0.0604 0.0888 0.0995 456 GLU D CA 13604 C C . GLU D 397 ? 0.4682 0.6617 1.0776 -0.0622 0.0896 0.0994 456 GLU D C 13605 O O . GLU D 397 ? 0.4638 0.6559 1.0829 -0.0638 0.0913 0.0996 456 GLU D O 13606 C CB . GLU D 397 ? 0.4783 0.6684 1.0623 -0.0575 0.0941 0.1061 456 GLU D CB 13607 C CG . GLU D 397 ? 0.3847 0.5716 0.9509 -0.0556 0.0941 0.1067 456 GLU D CG 13608 C CD . GLU D 397 ? 0.4318 0.6147 0.9952 -0.0564 0.0949 0.1058 456 GLU D CD 13609 O OE1 . GLU D 397 ? 0.5541 0.7360 1.1284 -0.0576 0.0977 0.1072 456 GLU D OE1 13610 O OE2 . GLU D 397 ? 0.5170 0.6974 1.0671 -0.0559 0.0928 0.1038 456 GLU D OE2 13611 N N . ARG D 398 ? 0.4622 0.6596 1.0764 -0.0620 0.0881 0.0990 457 ARG D N 13612 C CA . ARG D 398 ? 0.5007 0.7013 1.1326 -0.0637 0.0885 0.0987 457 ARG D CA 13613 C C . ARG D 398 ? 0.4423 0.6427 1.0828 -0.0666 0.0841 0.0926 457 ARG D C 13614 O O . ARG D 398 ? 0.5372 0.7381 1.1923 -0.0683 0.0856 0.0928 457 ARG D O 13615 C CB . ARG D 398 ? 0.3085 0.5134 0.9421 -0.0628 0.0871 0.0988 457 ARG D CB 13616 C CG . ARG D 398 ? 0.3091 0.5175 0.9610 -0.0645 0.0875 0.0986 457 ARG D CG 13617 C CD . ARG D 398 ? 0.3908 0.6035 1.0432 -0.0635 0.0858 0.0983 457 ARG D CD 13618 N NE . ARG D 398 ? 0.4948 0.7083 1.1392 -0.0638 0.0795 0.0921 457 ARG D NE 13619 C CZ . ARG D 398 ? 0.4652 0.6792 1.0958 -0.0618 0.0778 0.0920 457 ARG D CZ 13620 N NH1 . ARG D 398 ? 0.4316 0.6455 1.0548 -0.0594 0.0819 0.0978 457 ARG D NH1 13621 N NH2 . ARG D 398 ? 0.4581 0.6726 1.0822 -0.0621 0.0722 0.0860 457 ARG D NH2 13622 N N . ARG D 399 ? 0.3098 0.5094 0.9411 -0.0669 0.0787 0.0872 458 ARG D N 13623 C CA . ARG D 399 ? 0.4514 0.6506 1.0891 -0.0692 0.0738 0.0810 458 ARG D CA 13624 C C . ARG D 399 ? 0.4633 0.6586 1.1020 -0.0704 0.0752 0.0811 458 ARG D C 13625 O O . ARG D 399 ? 0.4506 0.6458 1.1008 -0.0726 0.0736 0.0783 458 ARG D O 13626 C CB . ARG D 399 ? 0.3395 0.5386 0.9658 -0.0687 0.0678 0.0755 458 ARG D CB 13627 C CG . ARG D 399 ? 0.4365 0.6397 1.0639 -0.0680 0.0653 0.0738 458 ARG D CG 13628 C CD . ARG D 399 ? 0.3670 0.5695 0.9793 -0.0667 0.0607 0.0698 458 ARG D CD 13629 N NE . ARG D 399 ? 0.3648 0.5708 0.9749 -0.0654 0.0596 0.0698 458 ARG D NE 13630 C CZ . ARG D 399 ? 0.3078 0.5136 0.9040 -0.0638 0.0567 0.0675 458 ARG D CZ 13631 N NH1 . ARG D 399 ? 0.3465 0.5488 0.9301 -0.0634 0.0546 0.0651 458 ARG D NH1 13632 N NH2 . ARG D 399 ? 0.3072 0.5164 0.9021 -0.0626 0.0559 0.0677 458 ARG D NH2 13633 N N . LEU D 400 ? 0.3413 0.5334 0.9678 -0.0689 0.0781 0.0843 459 LEU D N 13634 C CA . LEU D 400 ? 0.4297 0.6179 1.0555 -0.0698 0.0799 0.0848 459 LEU D CA 13635 C C . LEU D 400 ? 0.6083 0.7968 1.2495 -0.0710 0.0844 0.0881 459 LEU D C 13636 O O . LEU D 400 ? 0.3141 0.5009 0.9625 -0.0729 0.0836 0.0859 459 LEU D O 13637 C CB . LEU D 400 ? 0.3848 0.5699 0.9950 -0.0676 0.0829 0.0883 459 LEU D CB 13638 C CG . LEU D 400 ? 0.4179 0.5988 1.0254 -0.0681 0.0852 0.0893 459 LEU D CG 13639 C CD1 . LEU D 400 ? 0.3128 0.4918 0.9187 -0.0699 0.0800 0.0833 459 LEU D CD1 13640 C CD2 . LEU D 400 ? 0.3116 0.4899 0.9042 -0.0656 0.0885 0.0932 459 LEU D CD2 13641 N N . ALA D 401 ? 0.5691 0.7595 1.2152 -0.0697 0.0891 0.0933 460 ALA D N 13642 C CA . ALA D 401 ? 0.4260 0.6168 1.0869 -0.0706 0.0938 0.0969 460 ALA D CA 13643 C C . ALA D 401 ? 0.5455 0.7387 1.2227 -0.0733 0.0907 0.0928 460 ALA D C 13644 O O . ALA D 401 ? 0.5294 0.7215 1.2174 -0.0750 0.0925 0.0931 460 ALA D O 13645 C CB . ALA D 401 ? 0.3661 0.5589 1.0289 -0.0685 0.0989 0.1030 460 ALA D CB 13646 N N . LYS D 402 ? 0.4752 0.6717 1.1538 -0.0737 0.0860 0.0890 461 LYS D N 13647 C CA . LYS D 402 ? 0.4566 0.6556 1.1501 -0.0760 0.0824 0.0846 461 LYS D CA 13648 C C . LYS D 402 ? 0.4265 0.6229 1.1205 -0.0780 0.0783 0.0794 461 LYS D C 13649 O O . LYS D 402 ? 0.5001 0.6971 1.2080 -0.0802 0.0775 0.0774 461 LYS D O 13650 C CB . LYS D 402 ? 0.3137 0.5166 1.0067 -0.0756 0.0781 0.0814 461 LYS D CB 13651 C CG . LYS D 402 ? 0.3842 0.5902 1.0792 -0.0740 0.0817 0.0862 461 LYS D CG 13652 C CD . LYS D 402 ? 0.4086 0.6182 1.1019 -0.0735 0.0771 0.0826 461 LYS D CD 13653 C CE . LYS D 402 ? 0.4745 0.6879 1.1741 -0.0724 0.0804 0.0869 461 LYS D CE 13654 N NZ . LYS D 402 ? 0.5156 0.7327 1.2147 -0.0721 0.0759 0.0831 461 LYS D NZ 13655 N N . ILE D 403 ? 0.4076 0.6011 1.0863 -0.0772 0.0758 0.0773 462 ILE D N 13656 C CA . ILE D 403 ? 0.3711 0.5618 1.0483 -0.0787 0.0719 0.0727 462 ILE D CA 13657 C C . ILE D 403 ? 0.5249 0.7129 1.2088 -0.0799 0.0760 0.0753 462 ILE D C 13658 O O . ILE D 403 ? 0.5179 0.7051 1.2108 -0.0820 0.0737 0.0721 462 ILE D O 13659 C CB . ILE D 403 ? 0.3152 0.5031 0.9737 -0.0773 0.0691 0.0707 462 ILE D CB 13660 C CG1 . ILE D 403 ? 0.3143 0.5047 0.9671 -0.0764 0.0640 0.0667 462 ILE D CG1 13661 C CG2 . ILE D 403 ? 0.3161 0.5005 0.9724 -0.0787 0.0663 0.0671 462 ILE D CG2 13662 C CD1 . ILE D 403 ? 0.3610 0.5493 0.9948 -0.0745 0.0627 0.0663 462 ILE D CD1 13663 N N . MSE D 404 ? 0.6514 0.8378 1.3309 -0.0784 0.0820 0.0812 463 MSE D N 13664 C CA . MSE D 404 ? 0.6986 0.8823 1.3835 -0.0792 0.0867 0.0843 463 MSE D CA 13665 C C . MSE D 404 ? 0.6579 0.8436 1.3622 -0.0812 0.0881 0.0845 463 MSE D C 13666 O O . MSE D 404 ? 0.5562 0.7399 1.2677 -0.0830 0.0883 0.0833 463 MSE D O 13667 C CB . MSE D 404 ? 0.5068 0.6889 1.1841 -0.0768 0.0931 0.0908 463 MSE D CB 13668 C CG . MSE D 404 ? 0.3792 0.5593 1.0374 -0.0746 0.0924 0.0912 463 MSE D CG 13669 SE SE . MSE D 404 ? 1.2683 1.4433 1.9146 -0.0754 0.0896 0.0876 463 MSE D SE 13670 C CE . MSE D 404 ? 0.4236 0.6003 1.0678 -0.0768 0.0803 0.0794 463 MSE D CE 13671 N N . SER D 405 ? 0.3300 0.5196 1.0426 -0.0808 0.0891 0.0861 464 SER D N 13672 C CA . SER D 405 ? 0.4373 0.6293 1.1689 -0.0826 0.0908 0.0867 464 SER D CA 13673 C C . SER D 405 ? 0.5260 0.7185 1.2670 -0.0852 0.0851 0.0804 464 SER D C 13674 O O . SER D 405 ? 0.5842 0.7760 1.3375 -0.0870 0.0864 0.0803 464 SER D O 13675 C CB . SER D 405 ? 0.3212 0.5175 1.0585 -0.0816 0.0921 0.0889 464 SER D CB 13676 O OG . SER D 405 ? 0.6255 0.8212 1.3534 -0.0789 0.0970 0.0947 464 SER D OG 13677 N N . HIS D 406 ? 0.5010 0.6943 1.2350 -0.0852 0.0787 0.0751 465 HIS D N 13678 C CA . HIS D 406 ? 0.4622 0.6559 1.2036 -0.0873 0.0727 0.0688 465 HIS D CA 13679 C C . HIS D 406 ? 0.5059 0.6953 1.2449 -0.0885 0.0723 0.0674 465 HIS D C 13680 O O . HIS D 406 ? 0.4037 0.5929 1.1539 -0.0906 0.0699 0.0643 465 HIS D O 13681 C CB . HIS D 406 ? 0.3195 0.5145 1.0518 -0.0865 0.0663 0.0637 465 HIS D CB 13682 C CG . HIS D 406 ? 0.4056 0.6048 1.1400 -0.0854 0.0662 0.0644 465 HIS D CG 13683 N ND1 . HIS D 406 ? 0.4733 0.6759 1.2227 -0.0861 0.0690 0.0668 465 HIS D ND1 13684 C CD2 . HIS D 406 ? 0.4975 0.6981 1.2206 -0.0836 0.0636 0.0631 465 HIS D CD2 13685 C CE1 . HIS D 406 ? 0.5005 0.7064 1.2477 -0.0847 0.0681 0.0669 465 HIS D CE1 13686 N NE2 . HIS D 406 ? 0.6659 0.8707 1.3971 -0.0832 0.0648 0.0646 465 HIS D NE2 13687 N N . ILE D 407 ? 0.3750 0.5610 1.0993 -0.0871 0.0744 0.0698 466 ILE D N 13688 C CA . ILE D 407 ? 0.4010 0.5828 1.1212 -0.0879 0.0744 0.0690 466 ILE D CA 13689 C C . ILE D 407 ? 0.6018 0.7824 1.3334 -0.0891 0.0800 0.0728 466 ILE D C 13690 O O . ILE D 407 ? 0.4291 0.6078 1.1669 -0.0909 0.0788 0.0707 466 ILE D O 13691 C CB . ILE D 407 ? 0.3213 0.4999 1.0223 -0.0859 0.0755 0.0706 466 ILE D CB 13692 C CG1 . ILE D 407 ? 0.3203 0.4995 1.0098 -0.0850 0.0695 0.0662 466 ILE D CG1 13693 C CG2 . ILE D 407 ? 0.3977 0.5720 1.0949 -0.0867 0.0765 0.0706 466 ILE D CG2 13694 C CD1 . ILE D 407 ? 0.3669 0.5437 1.0379 -0.0829 0.0705 0.0679 466 ILE D CD1 13695 N N . LEU D 408 ? 0.5490 0.7306 1.2833 -0.0879 0.0862 0.0786 467 LEU D N 13696 C CA . LEU D 408 ? 0.4413 0.6212 1.1849 -0.0882 0.0918 0.0824 467 LEU D CA 13697 C C . LEU D 408 ? 0.5317 0.7117 1.2886 -0.0897 0.0893 0.0792 467 LEU D C 13698 O O . LEU D 408 ? 0.5745 0.7512 1.3360 -0.0904 0.0909 0.0794 467 LEU D O 13699 C CB . LEU D 408 ? 0.4717 0.6516 1.2124 -0.0856 0.0980 0.0886 467 LEU D CB 13700 C CG . LEU D 408 ? 0.4711 0.6471 1.2160 -0.0846 0.1037 0.0926 467 LEU D CG 13701 C CD1 . LEU D 408 ? 0.3618 0.5334 1.1017 -0.0850 0.1056 0.0930 467 LEU D CD1 13702 C CD2 . LEU D 408 ? 0.3992 0.5753 1.1403 -0.0816 0.1095 0.0986 467 LEU D CD2 13703 N N . GLU D 409 ? 0.4998 0.6838 1.2629 -0.0902 0.0853 0.0763 468 GLU D N 13704 C CA . GLU D 409 ? 0.5147 0.6993 1.2905 -0.0916 0.0823 0.0727 468 GLU D CA 13705 C C . GLU D 409 ? 0.5060 0.6890 1.2838 -0.0937 0.0772 0.0674 468 GLU D C 13706 O O . GLU D 409 ? 0.5999 0.7810 1.3863 -0.0948 0.0765 0.0657 468 GLU D O 13707 C CB . GLU D 409 ? 0.5064 0.6957 1.2873 -0.0914 0.0790 0.0705 468 GLU D CB 13708 C CG . GLU D 409 ? 0.5770 0.7679 1.3580 -0.0894 0.0839 0.0757 468 GLU D CG 13709 C CD . GLU D 409 ? 0.9479 1.1437 1.7320 -0.0892 0.0805 0.0735 468 GLU D CD 13710 O OE1 . GLU D 409 ? 1.1174 1.3154 1.9025 -0.0904 0.0744 0.0679 468 GLU D OE1 13711 O OE2 . GLU D 409 ? 0.9874 1.1848 1.7726 -0.0876 0.0839 0.0773 468 GLU D OE2 13712 N N . CYS D 410 ? 0.4104 0.5941 1.1801 -0.0941 0.0736 0.0649 469 CYS D N 13713 C CA . CYS D 410 ? 0.5064 0.6884 1.2764 -0.0959 0.0688 0.0601 469 CYS D CA 13714 C C . CYS D 410 ? 0.5893 0.7665 1.3572 -0.0962 0.0726 0.0626 469 CYS D C 13715 O O . CYS D 410 ? 0.6414 0.8164 1.4142 -0.0977 0.0701 0.0597 469 CYS D O 13716 C CB . CYS D 410 ? 0.4108 0.5919 1.1650 -0.0947 0.0641 0.0570 469 CYS D CB 13717 S SG . CYS D 410 ? 0.6609 0.8460 1.4154 -0.0941 0.0572 0.0516 469 CYS D SG 13718 N N . PHE D 411 ? 0.6364 0.8119 1.3966 -0.0947 0.0788 0.0681 470 PHE D N 13719 C CA . PHE D 411 ? 0.5709 0.7419 1.3284 -0.0947 0.0832 0.0710 470 PHE D CA 13720 C C . PHE D 411 ? 0.5875 0.7566 1.3558 -0.0949 0.0855 0.0718 470 PHE D C 13721 O O . PHE D 411 ? 0.6274 0.7932 1.3980 -0.0959 0.0858 0.0711 470 PHE D O 13722 C CB . PHE D 411 ? 0.5031 0.6728 1.2504 -0.0925 0.0894 0.0768 470 PHE D CB 13723 C CG . PHE D 411 ? 0.4544 0.6236 1.1870 -0.0917 0.0876 0.0761 470 PHE D CG 13724 C CD1 . PHE D 411 ? 0.4038 0.5724 1.1302 -0.0924 0.0807 0.0705 470 PHE D CD1 13725 C CD2 . PHE D 411 ? 0.4035 0.5712 1.1243 -0.0894 0.0924 0.0808 470 PHE D CD2 13726 C CE1 . PHE D 411 ? 0.5175 0.6840 1.2263 -0.0908 0.0787 0.0696 470 PHE D CE1 13727 C CE2 . PHE D 411 ? 0.5311 0.6968 1.2345 -0.0878 0.0903 0.0798 470 PHE D CE2 13728 C CZ . PHE D 411 ? 0.5745 0.7396 1.2719 -0.0886 0.0835 0.0742 470 PHE D CZ 13729 N N . GLU D 412 ? 0.4311 0.6024 1.2061 -0.0940 0.0872 0.0735 471 GLU D N 13730 C CA . GLU D 412 ? 0.3836 0.5533 1.1691 -0.0940 0.0899 0.0747 471 GLU D CA 13731 C C . GLU D 412 ? 0.4264 0.5969 1.2228 -0.0961 0.0843 0.0692 471 GLU D C 13732 O O . GLU D 412 ? 0.6231 0.7911 1.4270 -0.0968 0.0854 0.0690 471 GLU D O 13733 C CB . GLU D 412 ? 0.3443 0.5159 1.1329 -0.0922 0.0939 0.0787 471 GLU D CB 13734 C CG . GLU D 412 ? 0.3436 0.5136 1.1225 -0.0897 0.1003 0.0848 471 GLU D CG 13735 C CD . GLU D 412 ? 0.5987 0.7708 1.3806 -0.0878 0.1038 0.0886 471 GLU D CD 13736 O OE1 . GLU D 412 ? 0.6904 0.8659 1.4798 -0.0884 0.1006 0.0862 471 GLU D OE1 13737 O OE2 . GLU D 412 ? 0.5669 0.7369 1.3433 -0.0855 0.1098 0.0940 471 GLU D OE2 13738 N N . SER D 413 ? 0.4655 0.6393 1.2627 -0.0969 0.0781 0.0647 472 SER D N 13739 C CA . SER D 413 ? 0.4767 0.6515 1.2838 -0.0985 0.0722 0.0590 472 SER D CA 13740 C C . SER D 413 ? 0.4607 0.6331 1.2658 -0.1001 0.0680 0.0551 472 SER D C 13741 O O . SER D 413 ? 0.7870 0.9577 1.6002 -0.1013 0.0660 0.0525 472 SER D O 13742 C CB . SER D 413 ? 0.4752 0.6547 1.2844 -0.0984 0.0674 0.0556 472 SER D CB 13743 O OG . SER D 413 ? 0.7333 0.9137 1.5521 -0.0997 0.0615 0.0501 472 SER D OG 13744 N N . ARG D 414 ? 0.4658 0.6381 1.2601 -0.1001 0.0666 0.0547 473 ARG D N 13745 C CA . ARG D 414 ? 0.4755 0.6458 1.2671 -0.1015 0.0621 0.0508 473 ARG D CA 13746 C C . ARG D 414 ? 0.5495 0.7157 1.3330 -0.1015 0.0660 0.0538 473 ARG D C 13747 O O . ARG D 414 ? 0.5258 0.6895 1.3084 -0.1027 0.0632 0.0512 473 ARG D O 13748 C CB . ARG D 414 ? 0.5477 0.7207 1.3336 -0.1016 0.0563 0.0469 473 ARG D CB 13749 C CG . ARG D 414 ? 0.5747 0.7487 1.3675 -0.1027 0.0487 0.0403 473 ARG D CG 13750 C CD . ARG D 414 ? 0.4849 0.6604 1.2905 -0.1027 0.0481 0.0390 473 ARG D CD 13751 N NE . ARG D 414 ? 0.7424 0.9215 1.5491 -0.1015 0.0501 0.0411 473 ARG D NE 13752 C CZ . ARG D 414 ? 0.9311 1.1139 1.7386 -0.1011 0.0456 0.0376 473 ARG D CZ 13753 N NH1 . ARG D 414 ? 0.9976 1.1810 1.8050 -0.1017 0.0388 0.0319 473 ARG D NH1 13754 N NH2 . ARG D 414 ? 0.9007 1.0868 1.7091 -0.1000 0.0480 0.0399 473 ARG D NH2 13755 N N . GLY D 415 ? 0.5010 0.6663 1.2783 -0.1000 0.0725 0.0594 474 GLY D N 13756 C CA . GLY D 415 ? 0.3727 0.5343 1.1417 -0.0999 0.0764 0.0622 474 GLY D CA 13757 C C . GLY D 415 ? 0.5835 0.7455 1.3406 -0.0998 0.0746 0.0616 474 GLY D C 13758 O O . GLY D 415 ? 0.6939 0.8579 1.4489 -0.1002 0.0686 0.0574 474 GLY D O 13759 N N . VAL D 416 ? 0.5337 0.6933 1.2816 -0.0988 0.0796 0.0657 475 VAL D N 13760 C CA . VAL D 416 ? 0.4969 0.6548 1.2272 -0.0972 0.0784 0.0655 475 VAL D CA 13761 C C . VAL D 416 ? 0.4853 0.6404 1.2076 -0.0979 0.0726 0.0608 475 VAL D C 13762 O O . VAL D 416 ? 0.4422 0.5965 1.1507 -0.0966 0.0693 0.0590 475 VAL D O 13763 C CB . VAL D 416 ? 0.6134 0.7687 1.3349 -0.0955 0.0854 0.0711 475 VAL D CB 13764 C CG1 . VAL D 416 ? 0.6508 0.8087 1.3735 -0.0938 0.0902 0.0756 475 VAL D CG1 13765 C CG2 . VAL D 416 ? 0.5841 0.7367 1.3130 -0.0968 0.0895 0.0730 475 VAL D CG2 13766 N N . ALA D 417 ? 0.5311 0.6846 1.2619 -0.0999 0.0713 0.0590 476 ALA D N 13767 C CA . ALA D 417 ? 0.5031 0.6534 1.2259 -0.1005 0.0663 0.0550 476 ALA D CA 13768 C C . ALA D 417 ? 0.4204 0.5723 1.1436 -0.1008 0.0582 0.0490 476 ALA D C 13769 O O . ALA D 417 ? 0.5695 0.7189 1.2825 -0.1005 0.0537 0.0459 476 ALA D O 13770 C CB . ALA D 417 ? 0.4897 0.6376 1.2209 -0.1024 0.0678 0.0552 476 ALA D CB 13771 N N . GLU D 418 ? 0.4857 0.6414 1.2201 -0.1012 0.0562 0.0475 477 GLU D N 13772 C CA . GLU D 418 ? 0.6338 0.7910 1.3685 -0.1012 0.0485 0.0417 477 GLU D CA 13773 C C . GLU D 418 ? 0.6085 0.7683 1.3355 -0.0993 0.0473 0.0414 477 GLU D C 13774 O O . GLU D 418 ? 0.6555 0.8158 1.3780 -0.0986 0.0412 0.0368 477 GLU D O 13775 C CB . GLU D 418 ? 0.3944 0.5539 1.1475 -0.1032 0.0456 0.0387 477 GLU D CB 13776 C CG . GLU D 418 ? 0.6223 0.7846 1.3908 -0.1043 0.0509 0.0423 477 GLU D CG 13777 C CD . GLU D 418 ? 0.9455 1.1083 1.7282 -0.1056 0.0472 0.0386 477 GLU D CD 13778 O OE1 . GLU D 418 ? 1.0455 1.2079 1.8295 -0.1064 0.0409 0.0336 477 GLU D OE1 13779 O OE2 . GLU D 418 ? 0.8710 1.0340 1.6618 -0.1053 0.0505 0.0406 477 GLU D OE2 13780 N N . VAL D 419 ? 0.5001 0.6614 1.2254 -0.0982 0.0530 0.0462 478 VAL D N 13781 C CA . VAL D 419 ? 0.5462 0.7098 1.2636 -0.0963 0.0522 0.0463 478 VAL D CA 13782 C C . VAL D 419 ? 0.6253 0.7860 1.3231 -0.0945 0.0518 0.0467 478 VAL D C 13783 O O . VAL D 419 ? 0.6293 0.7904 1.3185 -0.0934 0.0470 0.0432 478 VAL D O 13784 C CB . VAL D 419 ? 0.3281 0.4947 1.0519 -0.0958 0.0583 0.0514 478 VAL D CB 13785 C CG1 . VAL D 419 ? 0.4908 0.6606 1.2340 -0.0975 0.0582 0.0506 478 VAL D CG1 13786 C CG2 . VAL D 419 ? 0.3523 0.5165 1.0723 -0.0953 0.0655 0.0572 478 VAL D CG2 13787 N N . LEU D 420 ? 0.4667 0.6247 1.1575 -0.0941 0.0569 0.0508 479 LEU D N 13788 C CA . LEU D 420 ? 0.4012 0.5564 1.0738 -0.0924 0.0571 0.0515 479 LEU D CA 13789 C C . LEU D 420 ? 0.4847 0.6364 1.1511 -0.0930 0.0526 0.0476 479 LEU D C 13790 O O . LEU D 420 ? 0.6593 0.8079 1.3221 -0.0934 0.0552 0.0494 479 LEU D O 13791 C CB . LEU D 420 ? 0.3271 0.4808 0.9947 -0.0914 0.0644 0.0574 479 LEU D CB 13792 C CG . LEU D 420 ? 0.5231 0.6798 1.1954 -0.0903 0.0694 0.0618 479 LEU D CG 13793 C CD1 . LEU D 420 ? 0.4665 0.6211 1.1341 -0.0892 0.0766 0.0675 479 LEU D CD1 13794 C CD2 . LEU D 420 ? 0.5601 0.7191 1.2239 -0.0886 0.0668 0.0607 479 LEU D CD2 13795 N N . VAL D 421 ? 0.5349 0.6872 1.1998 -0.0930 0.0458 0.0424 480 VAL D N 13796 C CA . VAL D 421 ? 0.4184 0.5675 1.0776 -0.0934 0.0409 0.0385 480 VAL D CA 13797 C C . VAL D 421 ? 0.5685 0.7166 1.2122 -0.0915 0.0368 0.0358 480 VAL D C 13798 O O . VAL D 421 ? 0.6593 0.8100 1.3008 -0.0903 0.0355 0.0349 480 VAL D O 13799 C CB . VAL D 421 ? 0.4279 0.5779 1.1010 -0.0951 0.0361 0.0342 480 VAL D CB 13800 C CG1 . VAL D 421 ? 0.4742 0.6272 1.1504 -0.0944 0.0309 0.0301 480 VAL D CG1 13801 C CG2 . VAL D 421 ? 0.5552 0.7014 1.2241 -0.0958 0.0323 0.0312 480 VAL D CG2 13802 N N . ALA D 422 ? 0.5248 0.6692 1.1576 -0.0913 0.0351 0.0345 481 ALA D N 13803 C CA . ALA D 422 ? 0.4170 0.5599 1.0343 -0.0895 0.0316 0.0322 481 ALA D CA 13804 C C . ALA D 422 ? 0.5526 0.6957 1.1712 -0.0893 0.0241 0.0262 481 ALA D C 13805 O O . ALA D 422 ? 0.7014 0.8445 1.3100 -0.0876 0.0210 0.0239 481 ALA D O 13806 C CB . ALA D 422 ? 0.3306 0.4694 0.9355 -0.0891 0.0332 0.0336 481 ALA D CB 13807 N N . GLU D 423 ? 0.5861 0.7292 1.2169 -0.0908 0.0213 0.0237 482 GLU D N 13808 C CA . GLU D 423 ? 0.5844 0.7278 1.2184 -0.0905 0.0142 0.0180 482 GLU D CA 13809 C C . GLU D 423 ? 0.5124 0.6586 1.1651 -0.0922 0.0132 0.0167 482 GLU D C 13810 O O . GLU D 423 ? 0.5919 0.7379 1.2538 -0.0939 0.0168 0.0194 482 GLU D O 13811 C CB . GLU D 423 ? 0.6774 0.8167 1.3036 -0.0904 0.0100 0.0151 482 GLU D CB 13812 C CG . GLU D 423 ? 0.9281 1.0672 1.5544 -0.0894 0.0026 0.0092 482 GLU D CG 13813 C CD . GLU D 423 ? 0.9474 1.0827 1.5706 -0.0896 -0.0018 0.0063 482 GLU D CD 13814 O OE1 . GLU D 423 ? 0.9143 1.0466 1.5304 -0.0900 0.0008 0.0087 482 GLU D OE1 13815 O OE2 . GLU D 423 ? 0.9625 1.0977 1.5908 -0.0892 -0.0077 0.0015 482 GLU D OE2 13816 N N . TYR D 424 ? 0.5928 0.7412 1.2510 -0.0916 0.0084 0.0126 483 TYR D N 13817 C CA . TYR D 424 ? 0.5192 0.6704 1.1954 -0.0932 0.0073 0.0112 483 TYR D CA 13818 C C . TYR D 424 ? 0.5419 0.6912 1.2243 -0.0938 0.0013 0.0064 483 TYR D C 13819 O O . TYR D 424 ? 0.5354 0.6829 1.2100 -0.0924 -0.0042 0.0023 483 TYR D O 13820 C CB . TYR D 424 ? 0.3660 0.5213 1.0470 -0.0922 0.0058 0.0095 483 TYR D CB 13821 C CG . TYR D 424 ? 0.4200 0.5783 1.1198 -0.0937 0.0044 0.0077 483 TYR D CG 13822 C CD1 . TYR D 424 ? 0.3318 0.4920 1.0438 -0.0956 0.0097 0.0117 483 TYR D CD1 13823 C CD2 . TYR D 424 ? 0.3326 0.4916 1.0380 -0.0932 -0.0024 0.0019 483 TYR D CD2 13824 C CE1 . TYR D 424 ? 0.3326 0.4955 1.0622 -0.0970 0.0085 0.0100 483 TYR D CE1 13825 C CE2 . TYR D 424 ? 0.3334 0.4951 1.0563 -0.0946 -0.0038 0.0000 483 TYR D CE2 13826 C CZ . TYR D 424 ? 0.4427 0.6065 1.1778 -0.0966 0.0017 0.0042 483 TYR D CZ 13827 O OH . TYR D 424 ? 0.5467 0.7133 1.2996 -0.0980 0.0003 0.0024 483 TYR D OH 13828 N N . ASN D 425 ? 0.5779 0.7275 1.2743 -0.0960 0.0026 0.0072 484 ASN D N 13829 C CA . ASN D 425 ? 0.6577 0.8057 1.3614 -0.0967 -0.0029 0.0029 484 ASN D CA 13830 C C . ASN D 425 ? 0.6603 0.8115 1.3835 -0.0983 -0.0037 0.0015 484 ASN D C 13831 O O . ASN D 425 ? 0.4431 0.5958 1.1762 -0.1001 0.0016 0.0053 484 ASN D O 13832 C CB . ASN D 425 ? 0.3984 0.5424 1.0981 -0.0978 -0.0012 0.0048 484 ASN D CB 13833 C CG . ASN D 425 ? 0.4799 0.6221 1.1656 -0.0973 0.0044 0.0095 484 ASN D CG 13834 O OD1 . ASN D 425 ? 0.6956 0.8379 1.3847 -0.0985 0.0105 0.0141 484 ASN D OD1 13835 N ND2 . ASN D 425 ? 0.5283 0.6688 1.1984 -0.0953 0.0023 0.0084 484 ASN D ND2 13836 N N . ASN D 426 ? 0.7316 0.8839 1.4604 -0.0976 -0.0102 -0.0039 485 ASN D N 13837 C CA . ASN D 426 ? 0.5624 0.7177 1.3098 -0.0990 -0.0117 -0.0059 485 ASN D CA 13838 C C . ASN D 426 ? 0.7510 0.9042 1.5077 -0.1004 -0.0150 -0.0083 485 ASN D C 13839 O O . ASN D 426 ? 0.7695 0.9202 1.5215 -0.0993 -0.0212 -0.0126 485 ASN D O 13840 C CB . ASN D 426 ? 0.4784 0.6365 1.2276 -0.0972 -0.0167 -0.0104 485 ASN D CB 13841 C CG . ASN D 426 ? 0.6589 0.8208 1.4275 -0.0985 -0.0178 -0.0123 485 ASN D CG 13842 O OD1 . ASN D 426 ? 0.7484 0.9096 1.5275 -0.0995 -0.0216 -0.0155 485 ASN D OD1 13843 N ND2 . ASN D 426 ? 0.5789 0.7447 1.3523 -0.0987 -0.0142 -0.0101 485 ASN D ND2 13844 N N . PRO D 427 ? 0.8212 0.9751 1.5906 -0.1029 -0.0109 -0.0054 486 PRO D N 13845 C CA . PRO D 427 ? 0.8439 0.9960 1.6235 -0.1045 -0.0137 -0.0074 486 PRO D CA 13846 C C . PRO D 427 ? 0.7557 0.9086 1.5433 -0.1037 -0.0216 -0.0139 486 PRO D C 13847 O O . PRO D 427 ? 0.5539 0.7107 1.3544 -0.1041 -0.0224 -0.0154 486 PRO D O 13848 C CB . PRO D 427 ? 0.7496 0.9039 1.5443 -0.1070 -0.0077 -0.0035 486 PRO D CB 13849 C CG . PRO D 427 ? 0.7045 0.8605 1.4932 -0.1066 -0.0008 0.0017 486 PRO D CG 13850 C CD . PRO D 427 ? 0.6914 0.8470 1.4636 -0.1041 -0.0028 0.0006 486 PRO D CD 13851 C C1 . NAG E . ? 0.3513 0.4525 0.3310 -0.0063 0.0439 0.0278 601 NAG A C1 13852 C C2 . NAG E . ? 0.7044 0.8065 0.6849 -0.0068 0.0459 0.0327 601 NAG A C2 13853 C C3 . NAG E . ? 0.4792 0.5840 0.4722 -0.0081 0.0461 0.0356 601 NAG A C3 13854 C C4 . NAG E . ? 0.4748 0.5830 0.4737 -0.0079 0.0449 0.0362 601 NAG A C4 13855 C C5 . NAG E . ? 0.6938 0.8010 0.6911 -0.0075 0.0429 0.0310 601 NAG A C5 13856 C C6 . NAG E . ? 0.6013 0.7119 0.6033 -0.0071 0.0417 0.0312 601 NAG A C6 13857 C C7 . NAG E . ? 1.2756 1.3719 1.2542 -0.0081 0.0466 0.0292 601 NAG A C7 13858 C C8 . NAG E . ? 1.3374 1.4305 1.3096 -0.0082 0.0478 0.0287 601 NAG A C8 13859 N N2 . NAG E . ? 0.9605 1.0592 0.9358 -0.0071 0.0470 0.0319 601 NAG A N2 13860 O O3 . NAG E . ? 0.7074 0.8131 0.7004 -0.0081 0.0480 0.0404 601 NAG A O3 13861 O O4 . NAG E . ? 0.6676 0.7785 0.6772 -0.0089 0.0454 0.0394 601 NAG A O4 13862 O O5 . NAG E . ? 0.5640 0.6686 0.5489 -0.0061 0.0429 0.0286 601 NAG A O5 13863 O O6 . NAG E . ? 0.6273 0.7412 0.6329 -0.0070 0.0429 0.0365 601 NAG A O6 13864 O O7 . NAG E . ? 1.2475 1.3443 1.2340 -0.0089 0.0452 0.0271 601 NAG A O7 13865 C C1 . NAG F . ? 0.6983 0.8120 0.7122 -0.0088 0.0468 0.0447 602 NAG A C1 13866 C C2 . NAG F . ? 0.5244 0.6398 0.5515 -0.0103 0.0467 0.0456 602 NAG A C2 13867 C C3 . NAG F . ? 0.4371 0.5552 0.4691 -0.0100 0.0485 0.0514 602 NAG A C3 13868 C C4 . NAG F . ? 0.6253 0.7418 0.6509 -0.0093 0.0504 0.0542 602 NAG A C4 13869 C C5 . NAG F . ? 0.6191 0.7338 0.6316 -0.0080 0.0502 0.0528 602 NAG A C5 13870 C C6 . NAG F . ? 0.5936 0.7064 0.5995 -0.0073 0.0519 0.0550 602 NAG A C6 13871 C C7 . NAG F . ? 0.7737 0.8897 0.8130 -0.0118 0.0433 0.0394 602 NAG A C7 13872 C C8 . NAG F . ? 0.5525 0.6703 0.5971 -0.0118 0.0413 0.0367 602 NAG A C8 13873 N N2 . NAG F . ? 0.8265 0.9435 0.8593 -0.0106 0.0448 0.0429 602 NAG A N2 13874 O O3 . NAG F . ? 0.6683 0.7876 0.7123 -0.0114 0.0486 0.0522 602 NAG A O3 13875 O O4 . NAG F . ? 0.7129 0.8317 0.7419 -0.0086 0.0520 0.0596 602 NAG A O4 13876 O O5 . NAG F . ? 0.6710 0.7831 0.6798 -0.0085 0.0487 0.0474 602 NAG A O5 13877 O O6 . NAG F . ? 0.7605 0.8713 0.7705 -0.0086 0.0524 0.0542 602 NAG A O6 13878 O O7 . NAG F . ? 0.6406 0.7544 0.6815 -0.0128 0.0436 0.0384 602 NAG A O7 13879 C C1 . BMA G . ? 0.7676 0.8868 0.8047 -0.0093 0.0534 0.0624 603 BMA A C1 13880 C C2 . BMA G . ? 0.8372 0.9574 0.8707 -0.0075 0.0553 0.0677 603 BMA A C2 13881 C C3 . BMA G . ? 0.9097 1.0303 0.9512 -0.0078 0.0571 0.0711 603 BMA A C3 13882 C C4 . BMA G . ? 0.8606 0.9833 0.9147 -0.0091 0.0568 0.0710 603 BMA A C4 13883 C C5 . BMA G . ? 1.0056 1.1271 1.0619 -0.0109 0.0547 0.0655 603 BMA A C5 13884 C C6 . BMA G . ? 1.2075 1.3310 1.2761 -0.0123 0.0541 0.0651 603 BMA A C6 13885 O O2 . BMA G . ? 0.8144 0.9374 0.8481 -0.0064 0.0552 0.0701 603 BMA A O2 13886 O O3 . BMA G . ? 0.7124 0.8341 0.7516 -0.0059 0.0588 0.0762 603 BMA A O3 13887 O O4 . BMA G . ? 0.9263 1.0489 0.9873 -0.0094 0.0585 0.0738 603 BMA A O4 13888 O O5 . BMA G . ? 0.8558 0.9772 0.9046 -0.0104 0.0531 0.0627 603 BMA A O5 13889 O O6 . BMA G . ? 1.2442 1.3709 1.3157 -0.0114 0.0542 0.0678 603 BMA A O6 13890 C C1 . NAG H . ? 0.4036 0.4956 0.6206 -0.0488 0.0488 0.0402 604 NAG A C1 13891 C C2 . NAG H . ? 0.4250 0.5175 0.6437 -0.0485 0.0532 0.0439 604 NAG A C2 13892 C C3 . NAG H . ? 0.4441 0.5353 0.6679 -0.0498 0.0534 0.0438 604 NAG A C3 13893 C C4 . NAG H . ? 0.4262 0.5185 0.6600 -0.0512 0.0509 0.0424 604 NAG A C4 13894 C C5 . NAG H . ? 0.5230 0.6150 0.7548 -0.0513 0.0465 0.0388 604 NAG A C5 13895 C C6 . NAG H . ? 0.6082 0.7016 0.8501 -0.0523 0.0439 0.0375 604 NAG A C6 13896 C C7 . NAG H . ? 0.5651 0.6579 0.7708 -0.0458 0.0572 0.0470 604 NAG A C7 13897 C C8 . NAG H . ? 0.6309 0.7222 0.8268 -0.0445 0.0591 0.0477 604 NAG A C8 13898 N N2 . NAG H . ? 0.5520 0.6434 0.7611 -0.0472 0.0553 0.0449 604 NAG A N2 13899 O O3 . NAG H . ? 0.6557 0.7475 0.8817 -0.0493 0.0575 0.0472 604 NAG A O3 13900 O O4 . NAG H . ? 0.9389 1.0296 1.1760 -0.0523 0.0509 0.0422 604 NAG A O4 13901 O O5 . NAG H . ? 0.6225 0.7157 0.8492 -0.0500 0.0468 0.0391 604 NAG A O5 13902 O O6 . NAG H . ? 0.8339 0.9253 1.0747 -0.0529 0.0398 0.0337 604 NAG A O6 13903 O O7 . NAG H . ? 0.4419 0.5371 0.6522 -0.0455 0.0574 0.0481 604 NAG A O7 13904 C C1 . NAG I . ? 1.2012 1.2930 1.4490 -0.0534 0.0514 0.0431 605 NAG A C1 13905 C C2 . NAG I . ? 1.1862 1.2761 1.4365 -0.0548 0.0482 0.0404 605 NAG A C2 13906 C C3 . NAG I . ? 1.2294 1.3206 1.4917 -0.0561 0.0487 0.0414 605 NAG A C3 13907 C C4 . NAG I . ? 1.3742 1.4660 1.6391 -0.0558 0.0537 0.0453 605 NAG A C4 13908 C C5 . NAG I . ? 1.3846 1.4781 1.6462 -0.0542 0.0566 0.0478 605 NAG A C5 13909 C C6 . NAG I . ? 1.5410 1.6348 1.8039 -0.0534 0.0616 0.0516 605 NAG A C6 13910 C C7 . NAG I . ? 0.9873 1.0738 1.2295 -0.0551 0.0410 0.0342 605 NAG A C7 13911 C C8 . NAG I . ? 0.8851 0.9709 1.1251 -0.0549 0.0366 0.0306 605 NAG A C8 13912 N N2 . NAG I . ? 1.1133 1.2025 1.3609 -0.0549 0.0437 0.0368 605 NAG A N2 13913 O O3 . NAG I . ? 1.2343 1.3235 1.4986 -0.0574 0.0459 0.0391 605 NAG A O3 13914 O O4 . NAG I . ? 1.3134 1.4065 1.5899 -0.0569 0.0543 0.0463 605 NAG A O4 13915 O O5 . NAG I . ? 1.2798 1.3721 1.5302 -0.0531 0.0558 0.0466 605 NAG A O5 13916 O O6 . NAG I . ? 1.6895 1.7832 1.9614 -0.0545 0.0627 0.0525 605 NAG A O6 13917 O O7 . NAG I . ? 0.9294 1.0139 1.1683 -0.0555 0.0422 0.0346 605 NAG A O7 13918 NI NI . NI J . ? 0.5681 0.6132 0.6118 -0.0379 0.0444 0.0093 606 NI A NI 13919 C C1 . NAG K . ? 0.5910 0.6792 1.0738 -0.0873 0.0033 0.0164 601 NAG B C1 13920 C C2 . NAG K . ? 0.7293 0.8187 1.2058 -0.0868 0.0097 0.0202 601 NAG B C2 13921 C C3 . NAG K . ? 0.6870 0.7762 1.1680 -0.0883 0.0157 0.0239 601 NAG B C3 13922 C C4 . NAG K . ? 0.6698 0.7611 1.1676 -0.0899 0.0159 0.0239 601 NAG B C4 13923 C C5 . NAG K . ? 0.8414 0.9314 1.3445 -0.0904 0.0091 0.0199 601 NAG B C5 13924 C C6 . NAG K . ? 0.9823 1.0744 1.5024 -0.0920 0.0087 0.0195 601 NAG B C6 13925 C C7 . NAG K . ? 0.7416 0.8255 1.1933 -0.0852 0.0089 0.0201 601 NAG B C7 13926 C C8 . NAG K . ? 0.5042 0.5864 0.9404 -0.0835 0.0088 0.0200 601 NAG B C8 13927 N N2 . NAG K . ? 0.9233 1.0105 1.3841 -0.0853 0.0095 0.0201 601 NAG B N2 13928 O O3 . NAG K . ? 1.0494 1.1400 1.5259 -0.0876 0.0215 0.0273 601 NAG B O3 13929 O O4 . NAG K . ? 0.7496 0.8415 1.2541 -0.0912 0.0220 0.0275 601 NAG B O4 13930 O O5 . NAG K . ? 0.5499 0.6402 1.0484 -0.0888 0.0038 0.0166 601 NAG B O5 13931 O O6 . NAG K . ? 0.7907 0.8858 1.3180 -0.0926 0.0145 0.0227 601 NAG B O6 13932 O O7 . NAG K . ? 0.8090 0.8911 1.2647 -0.0864 0.0085 0.0202 601 NAG B O7 13933 C C1 . NAG L . ? 0.6238 0.7164 1.1279 -0.0912 0.0290 0.0317 602 NAG B C1 13934 C C2 . NAG L . ? 0.5176 0.6095 1.0311 -0.0929 0.0324 0.0336 602 NAG B C2 13935 C C3 . NAG L . ? 0.6766 0.7690 1.1890 -0.0926 0.0402 0.0382 602 NAG B C3 13936 C C4 . NAG L . ? 0.8297 0.9201 1.3258 -0.0910 0.0421 0.0394 602 NAG B C4 13937 C C5 . NAG L . ? 0.6919 0.7832 1.1797 -0.0895 0.0382 0.0372 602 NAG B C5 13938 C C6 . NAG L . ? 0.7643 0.8534 1.2359 -0.0880 0.0395 0.0380 602 NAG B C6 13939 C C7 . NAG L . ? 0.8507 0.9435 1.3858 -0.0954 0.0256 0.0295 602 NAG B C7 13940 C C8 . NAG L . ? 0.6025 0.6980 1.1543 -0.0967 0.0238 0.0281 602 NAG B C8 13941 N N2 . NAG L . ? 0.7830 0.8771 1.3122 -0.0943 0.0302 0.0322 602 NAG B N2 13942 O O3 . NAG L . ? 0.9453 1.0365 1.4651 -0.0940 0.0435 0.0399 602 NAG B O3 13943 O O4 . NAG L . ? 1.0092 1.1001 1.5040 -0.0903 0.0492 0.0435 602 NAG B O4 13944 O O5 . NAG L . ? 0.5075 0.5981 0.9967 -0.0899 0.0312 0.0331 602 NAG B O5 13945 O O6 . NAG L . ? 1.1052 1.1941 1.5741 -0.0874 0.0464 0.0420 602 NAG B O6 13946 O O7 . NAG L . ? 0.9836 1.0732 1.5110 -0.0954 0.0229 0.0281 602 NAG B O7 13947 C C1 . BMA M . ? 1.1878 1.2788 1.6875 -0.0904 0.0558 0.0473 603 BMA B C1 13948 C C2 . BMA M . ? 1.3599 1.4521 1.8543 -0.0886 0.0614 0.0508 603 BMA B C2 13949 C C3 . BMA M . ? 1.4101 1.4999 1.9008 -0.0881 0.0677 0.0541 603 BMA B C3 13950 C C4 . BMA M . ? 1.5018 1.5911 2.0049 -0.0898 0.0699 0.0550 603 BMA B C4 13951 C C5 . BMA M . ? 1.3690 1.4571 1.8758 -0.0916 0.0637 0.0513 603 BMA B C5 13952 C C6 . BMA M . ? 1.3814 1.4691 1.9009 -0.0935 0.0654 0.0519 603 BMA B C6 13953 O O2 . BMA M . ? 1.5192 1.6147 2.0248 -0.0887 0.0635 0.0523 603 BMA B O2 13954 O O3 . BMA M . ? 1.3317 1.4225 1.8191 -0.0863 0.0732 0.0575 603 BMA B O3 13955 O O4 . BMA M . ? 1.5296 1.6162 2.0280 -0.0892 0.0754 0.0577 603 BMA B O4 13956 O O5 . BMA M . ? 1.1462 1.2369 1.6575 -0.0920 0.0582 0.0484 603 BMA B O5 13957 O O6 . BMA M . ? 1.2268 1.3176 1.7593 -0.0938 0.0679 0.0536 603 BMA B O6 13958 C C1 . NAG N . ? 0.5343 0.5352 1.0126 -0.1195 0.0672 0.0460 604 NAG B C1 13959 C C2 . NAG N . ? 0.5821 0.5822 1.0546 -0.1179 0.0769 0.0487 604 NAG B C2 13960 C C3 . NAG N . ? 0.5198 0.5158 0.9872 -0.1181 0.0816 0.0498 604 NAG B C3 13961 C C4 . NAG N . ? 0.7461 0.7415 1.2289 -0.1205 0.0810 0.0496 604 NAG B C4 13962 C C5 . NAG N . ? 0.7427 0.7391 1.2309 -0.1221 0.0710 0.0469 604 NAG B C5 13963 C C6 . NAG N . ? 0.4417 0.4380 0.9464 -0.1245 0.0698 0.0464 604 NAG B C6 13964 C C7 . NAG N . ? 0.5044 0.5080 0.9637 -0.1144 0.0796 0.0497 604 NAG B C7 13965 C C8 . NAG N . ? 0.4841 0.4876 0.9270 -0.1122 0.0794 0.0496 604 NAG B C8 13966 N N2 . NAG N . ? 0.4319 0.4324 0.8895 -0.1156 0.0770 0.0488 604 NAG B N2 13967 O O3 . NAG N . ? 0.5680 0.5633 1.0315 -0.1164 0.0909 0.0523 604 NAG B O3 13968 O O4 . NAG N . ? 1.0432 1.0357 1.5267 -0.1206 0.0886 0.0515 604 NAG B O4 13969 O O5 . NAG N . ? 0.4062 0.4066 0.8992 -0.1217 0.0672 0.0459 604 NAG B O5 13970 O O6 . NAG N . ? 0.6927 0.6929 1.2124 -0.1256 0.0656 0.0452 604 NAG B O6 13971 O O7 . NAG N . ? 0.5696 0.5758 1.0431 -0.1151 0.0821 0.0506 604 NAG B O7 13972 C C1 . NAG O . ? 1.2455 1.2383 1.7429 -0.1214 0.0951 0.0533 605 NAG B C1 13973 C C2 . NAG O . ? 0.9845 0.9737 1.4843 -0.1230 0.0958 0.0532 605 NAG B C2 13974 C C3 . NAG O . ? 1.0574 1.0467 1.5723 -0.1238 0.1032 0.0552 605 NAG B C3 13975 C C4 . NAG O . ? 1.2611 1.2502 1.7713 -0.1214 0.1126 0.0578 605 NAG B C4 13976 C C5 . NAG O . ? 1.4257 1.4184 1.9327 -0.1199 0.1110 0.0578 605 NAG B C5 13977 C C6 . NAG O . ? 1.3065 1.2989 1.8068 -0.1171 0.1197 0.0602 605 NAG B C6 13978 C C7 . NAG O . ? 1.1040 1.0899 1.5999 -0.1255 0.0831 0.0497 605 NAG B C7 13979 C C8 . NAG O . ? 1.1379 1.1198 1.6184 -0.1240 0.0891 0.0510 605 NAG B C8 13980 N N2 . NAG O . ? 0.9355 0.9248 1.4400 -0.1250 0.0867 0.0507 605 NAG B N2 13981 O O3 . NAG O . ? 1.0018 0.9874 1.5177 -0.1251 0.1045 0.0552 605 NAG B O3 13982 O O4 . NAG O . ? 1.2936 1.2832 1.8190 -0.1221 0.1192 0.0598 605 NAG B O4 13983 O O5 . NAG O . ? 1.4586 1.4511 1.9515 -0.1193 0.1040 0.0558 605 NAG B O5 13984 O O6 . NAG O . ? 1.0529 1.0476 1.5683 -0.1172 0.1250 0.0622 605 NAG B O6 13985 O O7 . NAG O . ? 1.1450 1.1309 1.6452 -0.1271 0.0753 0.0476 605 NAG B O7 13986 NI NI . NI P . ? 0.4829 0.4637 0.6646 -0.0883 -0.0060 0.0288 606 NI B NI 13987 C C1 . NAG Q . ? 0.5402 0.5403 0.8120 0.0334 -0.1316 -0.1024 601 NAG C C1 13988 C C2 . NAG Q . ? 0.5345 0.5276 0.7961 0.0395 -0.1350 -0.1049 601 NAG C C2 13989 C C3 . NAG Q . ? 0.7556 0.7469 1.0103 0.0441 -0.1349 -0.1088 601 NAG C C3 13990 C C4 . NAG Q . ? 0.9755 0.9702 1.2406 0.0448 -0.1372 -0.1126 601 NAG C C4 13991 C C5 . NAG Q . ? 0.9862 0.9880 1.2620 0.0383 -0.1339 -0.1097 601 NAG C C5 13992 C C6 . NAG Q . ? 0.8550 0.8603 1.1427 0.0387 -0.1365 -0.1133 601 NAG C C6 13993 C C7 . NAG Q . ? 0.5110 0.4967 0.7595 0.0404 -0.1356 -0.1007 601 NAG C C7 13994 C C8 . NAG Q . ? 0.5735 0.5566 0.8292 0.0443 -0.1424 -0.1047 601 NAG C C8 13995 N N2 . NAG Q . ? 0.5996 0.5899 0.8512 0.0384 -0.1323 -0.1011 601 NAG C N2 13996 O O3 . NAG Q . ? 0.8532 0.8376 1.0996 0.0502 -0.1387 -0.1115 601 NAG C O3 13997 O O4 . NAG Q . ? 0.7954 0.7899 1.0518 0.0467 -0.1341 -0.1139 601 NAG C O4 13998 O O5 . NAG Q . ? 1.0834 1.0861 1.3651 0.0346 -0.1343 -0.1062 601 NAG C O5 13999 O O6 . NAG Q . ? 1.2129 1.2163 1.4959 0.0438 -0.1381 -0.1179 601 NAG C O6 14000 O O7 . NAG Q . ? 0.6987 0.6823 0.9390 0.0394 -0.1333 -0.0974 601 NAG C O7 14001 C C1 . NAG R . ? 0.6468 0.6369 0.8996 0.0533 -0.1382 -0.1191 602 NAG C C1 14002 C C2 . NAG R . ? 0.5362 0.5277 0.7831 0.0546 -0.1350 -0.1208 602 NAG C C2 14003 C C3 . NAG R . ? 0.6917 0.6783 0.9341 0.0620 -0.1392 -0.1267 602 NAG C C3 14004 C C4 . NAG R . ? 0.8744 0.8538 1.1075 0.0666 -0.1417 -0.1272 602 NAG C C4 14005 C C5 . NAG R . ? 0.9105 0.8891 1.1501 0.0647 -0.1447 -0.1250 602 NAG C C5 14006 C C6 . NAG R . ? 1.0342 1.0059 1.2642 0.0687 -0.1467 -0.1247 602 NAG C C6 14007 C C7 . NAG R . ? 0.7328 0.7351 0.9865 0.0463 -0.1271 -0.1170 602 NAG C C7 14008 C C8 . NAG R . ? 0.8006 0.8096 1.0653 0.0423 -0.1255 -0.1166 602 NAG C C8 14009 N N2 . NAG R . ? 0.5639 0.5621 0.8203 0.0503 -0.1328 -0.1202 602 NAG C N2 14010 O O3 . NAG R . ? 0.6495 0.6369 0.8848 0.0632 -0.1358 -0.1280 602 NAG C O3 14011 O O4 . NAG R . ? 1.0714 1.0462 1.3019 0.0737 -0.1461 -0.1329 602 NAG C O4 14012 O O5 . NAG R . ? 0.8602 0.8437 1.1033 0.0576 -0.1403 -0.1195 602 NAG C O5 14013 O O6 . NAG R . ? 1.1804 1.1468 1.4080 0.0760 -0.1518 -0.1300 602 NAG C O6 14014 O O7 . NAG R . ? 0.8555 0.8560 1.0982 0.0459 -0.1233 -0.1144 602 NAG C O7 14015 C C1 . BMA S . ? 1.1750 1.1449 1.3974 0.0805 -0.1479 -0.1375 603 BMA C C1 14016 C C2 . BMA S . ? 1.0995 1.0618 1.3164 0.0880 -0.1531 -0.1412 603 BMA C C2 14017 C C3 . BMA S . ? 0.9143 0.8721 1.1181 0.0935 -0.1514 -0.1439 603 BMA C C3 14018 C C4 . BMA S . ? 1.1153 1.0771 1.3206 0.0933 -0.1493 -0.1466 603 BMA C C4 14019 C C5 . BMA S . ? 1.0335 1.0027 1.2436 0.0853 -0.1441 -0.1420 603 BMA C C5 14020 C C6 . BMA S . ? 0.8659 0.8395 1.0775 0.0847 -0.1417 -0.1441 603 BMA C C6 14021 O O2 . BMA S . ? 0.9607 0.9228 1.1874 0.0911 -0.1590 -0.1458 603 BMA C O2 14022 O O3 . BMA S . ? 0.8171 0.7679 1.0165 0.1011 -0.1564 -0.1480 603 BMA C O3 14023 O O4 . BMA S . ? 1.1182 1.0759 1.3105 0.0979 -0.1471 -0.1486 603 BMA C O4 14024 O O5 . BMA S . ? 0.9485 0.9216 1.1718 0.0810 -0.1463 -0.1402 603 BMA C O5 14025 O O6 . BMA S . ? 0.7091 0.6874 0.9188 0.0785 -0.1356 -0.1393 603 BMA C O6 14026 C C1 . NAG T . ? 0.7354 0.7090 0.6891 0.0520 -0.0059 -0.0880 604 NAG C C1 14027 C C2 . NAG T . ? 0.5652 0.5327 0.5107 0.0582 -0.0065 -0.0929 604 NAG C C2 14028 C C3 . NAG T . ? 0.6898 0.6557 0.6243 0.0593 -0.0025 -0.0933 604 NAG C C3 14029 C C4 . NAG T . ? 0.6935 0.6655 0.6298 0.0562 -0.0013 -0.0918 604 NAG C C4 14030 C C5 . NAG T . ? 0.6292 0.6072 0.5744 0.0503 -0.0009 -0.0870 604 NAG C C5 14031 C C6 . NAG T . ? 0.5387 0.5229 0.4868 0.0472 0.0000 -0.0852 604 NAG C C6 14032 C C7 . NAG T . ? 0.5480 0.5067 0.4947 0.0647 -0.0116 -0.0971 604 NAG C C7 14033 C C8 . NAG T . ? 0.7070 0.6599 0.6510 0.0673 -0.0123 -0.0975 604 NAG C C8 14034 N N2 . NAG T . ? 0.4363 0.3981 0.3799 0.0610 -0.0077 -0.0939 604 NAG C N2 14035 O O3 . NAG T . ? 0.7282 0.6885 0.6552 0.0652 -0.0032 -0.0980 604 NAG C O3 14036 O O4 . NAG T . ? 0.9556 0.9262 0.8817 0.0567 0.0027 -0.0915 604 NAG C O4 14037 O O5 . NAG T . ? 0.6101 0.5891 0.5653 0.0496 -0.0047 -0.0870 604 NAG C O5 14038 O O6 . NAG T . ? 0.6618 0.6470 0.6125 0.0496 -0.0028 -0.0886 604 NAG C O6 14039 O O7 . NAG T . ? 0.6094 0.5700 0.5610 0.0659 -0.0145 -0.0995 604 NAG C O7 14040 C C1 . NAG U . ? 0.6847 0.6555 0.6058 0.0592 0.0030 -0.0943 605 NAG C C1 14041 C C2 . NAG U . ? 0.7005 0.6720 0.6131 0.0577 0.0074 -0.0924 605 NAG C C2 14042 C C3 . NAG U . ? 1.0628 1.0343 0.9692 0.0605 0.0079 -0.0956 605 NAG C C3 14043 C C4 . NAG U . ? 1.1650 1.1303 1.0661 0.0667 0.0061 -0.1009 605 NAG C C4 14044 C C5 . NAG U . ? 0.8786 0.8434 0.7889 0.0679 0.0017 -0.1024 605 NAG C C5 14045 C C6 . NAG U . ? 0.8326 0.7909 0.7381 0.0743 -0.0002 -0.1076 605 NAG C C6 14046 C C7 . NAG U . ? 0.9076 0.8849 0.8250 0.0491 0.0112 -0.0840 605 NAG C C7 14047 C C8 . NAG U . ? 0.9413 0.9250 0.8646 0.0436 0.0124 -0.0793 605 NAG C C8 14048 N N2 . NAG U . ? 0.7339 0.7113 0.6518 0.0520 0.0089 -0.0875 605 NAG C N2 14049 O O3 . NAG U . ? 0.9862 0.9576 0.8837 0.0596 0.0120 -0.0940 605 NAG C O3 14050 O O4 . NAG U . ? 1.1097 1.0753 1.0059 0.0694 0.0061 -0.1040 605 NAG C O4 14051 O O5 . NAG U . ? 0.9437 0.9084 0.8591 0.0650 0.0016 -0.0992 605 NAG C O5 14052 O O6 . NAG U . ? 1.0787 1.0366 0.9791 0.0776 -0.0004 -0.1113 605 NAG C O6 14053 O O7 . NAG U . ? 0.8571 0.8294 0.7694 0.0509 0.0124 -0.0846 605 NAG C O7 14054 C C1 . NAG V . ? 0.6425 0.7641 1.0873 -0.0717 0.0266 0.0299 601 NAG D C1 14055 C C2 . NAG V . ? 0.7939 0.9174 1.2410 -0.0717 0.0328 0.0351 601 NAG D C2 14056 C C3 . NAG V . ? 0.7713 0.8955 1.2076 -0.0698 0.0345 0.0366 601 NAG D C3 14057 C C4 . NAG V . ? 0.5535 0.6744 0.9753 -0.0689 0.0332 0.0352 601 NAG D C4 14058 C C5 . NAG V . ? 0.5076 0.6267 0.9282 -0.0690 0.0272 0.0302 601 NAG D C5 14059 C C6 . NAG V . ? 0.6619 0.7776 1.0690 -0.0681 0.0258 0.0288 601 NAG D C6 14060 C C7 . NAG V . ? 1.1104 1.2377 1.5798 -0.0736 0.0384 0.0398 601 NAG D C7 14061 C C8 . NAG V . ? 1.0083 1.1328 1.4710 -0.0735 0.0423 0.0427 601 NAG D C8 14062 N N2 . NAG V . ? 0.9755 1.1021 1.4368 -0.0726 0.0339 0.0361 601 NAG D N2 14063 O O3 . NAG V . ? 0.7737 0.8992 1.2115 -0.0696 0.0402 0.0415 601 NAG D O3 14064 O O4 . NAG V . ? 0.6349 0.7552 1.0450 -0.0674 0.0361 0.0377 601 NAG D O4 14065 O O5 . NAG V . ? 0.6865 0.8050 1.1175 -0.0707 0.0258 0.0291 601 NAG D O5 14066 O O6 . NAG V . ? 0.6799 0.7957 1.0760 -0.0666 0.0275 0.0301 601 NAG D O6 14067 O O7 . NAG V . ? 1.1032 1.2332 1.5847 -0.0744 0.0394 0.0407 601 NAG D O7 14068 C C1 . NAG W . ? 0.5958 0.7165 1.0020 -0.0667 0.0414 0.0421 602 NAG D C1 14069 C C2 . NAG W . ? 0.4175 0.5381 0.8113 -0.0648 0.0414 0.0422 602 NAG D C2 14070 C C3 . NAG W . ? 0.7037 0.8249 1.0938 -0.0638 0.0470 0.0470 602 NAG D C3 14071 C C4 . NAG W . ? 0.7145 0.8388 1.1164 -0.0642 0.0501 0.0501 602 NAG D C4 14072 C C5 . NAG W . ? 0.6451 0.7693 1.0592 -0.0661 0.0499 0.0497 602 NAG D C5 14073 C C6 . NAG W . ? 0.4746 0.6018 0.9013 -0.0665 0.0526 0.0524 602 NAG D C6 14074 C C7 . NAG W . ? 0.7723 0.8895 1.1501 -0.0637 0.0342 0.0356 602 NAG D C7 14075 C C8 . NAG W . ? 0.7265 0.8402 1.0930 -0.0632 0.0320 0.0333 602 NAG D C8 14076 N N2 . NAG W . ? 0.7592 0.8768 1.1421 -0.0644 0.0386 0.0394 602 NAG D N2 14077 O O3 . NAG W . ? 0.8162 0.9376 1.1955 -0.0621 0.0469 0.0471 602 NAG D O3 14078 O O4 . NAG W . ? 0.7033 0.8277 1.1018 -0.0630 0.0554 0.0548 602 NAG D O4 14079 O O5 . NAG W . ? 0.4922 0.6160 0.9093 -0.0670 0.0444 0.0449 602 NAG D O5 14080 O O6 . NAG W . ? 0.8487 0.9788 1.2774 -0.0660 0.0507 0.0514 602 NAG D O6 14081 O O7 . NAG W . ? 0.7151 0.8345 1.0972 -0.0634 0.0321 0.0340 602 NAG D O7 14082 C C1 . BMA X . ? 1.0669 1.1918 1.4612 -0.0615 0.0601 0.0591 603 BMA D C1 14083 C C2 . BMA X . ? 1.4227 1.5466 1.8223 -0.0618 0.0648 0.0627 603 BMA D C2 14084 C C3 . BMA X . ? 1.5465 1.6722 1.9475 -0.0602 0.0697 0.0675 603 BMA D C3 14085 C C4 . BMA X . ? 1.5774 1.7030 1.9659 -0.0581 0.0702 0.0684 603 BMA D C4 14086 C C5 . BMA X . ? 1.4181 1.5448 1.8027 -0.0582 0.0652 0.0646 603 BMA D C5 14087 C C6 . BMA X . ? 1.3411 1.4676 1.7131 -0.0563 0.0655 0.0653 603 BMA D C6 14088 O O2 . BMA X . ? 1.5961 1.7167 1.9865 -0.0614 0.0658 0.0627 603 BMA D O2 14089 O O3 . BMA X . ? 1.6936 1.8179 2.0976 -0.0599 0.0744 0.0709 603 BMA D O3 14090 O O4 . BMA X . ? 1.5557 1.6831 1.9460 -0.0565 0.0743 0.0728 603 BMA D O4 14091 O O5 . BMA X . ? 1.3128 1.4375 1.6956 -0.0596 0.0611 0.0603 603 BMA D O5 14092 O O6 . BMA X . ? 1.4014 1.5249 1.7637 -0.0557 0.0666 0.0655 603 BMA D O6 14093 C C1 . NAG Y . ? 0.5247 0.6804 0.7106 -0.0194 0.0227 0.0236 604 NAG D C1 14094 C C2 . NAG Y . ? 0.3115 0.4682 0.4930 -0.0193 0.0262 0.0301 604 NAG D C2 14095 C C3 . NAG Y . ? 0.5824 0.7392 0.7508 -0.0172 0.0265 0.0304 604 NAG D C3 14096 C C4 . NAG Y . ? 0.4026 0.5556 0.5592 -0.0161 0.0247 0.0255 604 NAG D C4 14097 C C5 . NAG Y . ? 0.4320 0.5841 0.5939 -0.0162 0.0213 0.0193 604 NAG D C5 14098 C C6 . NAG Y . ? 0.3172 0.4652 0.4683 -0.0149 0.0197 0.0144 604 NAG D C6 14099 C C7 . NAG Y . ? 0.7537 0.9141 0.9574 -0.0220 0.0291 0.0367 604 NAG D C7 14100 C C8 . NAG Y . ? 0.8064 0.9707 1.0213 -0.0227 0.0310 0.0413 604 NAG D C8 14101 N N2 . NAG Y . ? 0.5970 0.7573 0.7902 -0.0203 0.0279 0.0345 604 NAG D N2 14102 O O3 . NAG Y . ? 0.6465 0.8037 0.8102 -0.0170 0.0296 0.0363 604 NAG D O3 14103 O O4 . NAG Y . ? 0.9858 1.1376 1.1283 -0.0143 0.0251 0.0254 604 NAG D O4 14104 O O5 . NAG Y . ? 0.4451 0.5972 0.6192 -0.0181 0.0212 0.0195 604 NAG D O5 14105 O O6 . NAG Y . ? 0.7676 0.9126 0.9108 -0.0151 0.0216 0.0166 604 NAG D O6 14106 O O7 . NAG Y . ? 0.9530 1.1106 1.1573 -0.0229 0.0288 0.0351 604 NAG D O7 14107 C C1 . NAG Z . ? 1.1381 1.2882 1.2671 -0.0130 0.0266 0.0272 605 NAG D C1 14108 C C2 . NAG Z . ? 1.1447 1.2949 1.2639 -0.0110 0.0250 0.0238 605 NAG D C2 14109 C C3 . NAG Z . ? 1.2518 1.4001 1.3564 -0.0097 0.0267 0.0259 605 NAG D C3 14110 C C4 . NAG Z . ? 1.3436 1.4941 1.4494 -0.0100 0.0296 0.0329 605 NAG D C4 14111 C C5 . NAG Z . ? 1.3725 1.5230 1.4889 -0.0119 0.0310 0.0358 605 NAG D C5 14112 C C6 . NAG Z . ? 1.1585 1.3112 1.2774 -0.0120 0.0338 0.0426 605 NAG D C6 14113 C C7 . NAG Z . ? 0.9625 1.1117 1.0839 -0.0097 0.0197 0.0132 605 NAG D C7 14114 C C8 . NAG Z . ? 0.7282 0.8742 0.8475 -0.0089 0.0170 0.0065 605 NAG D C8 14115 N N2 . NAG Z . ? 1.0818 1.2294 1.1998 -0.0105 0.0222 0.0172 605 NAG D N2 14116 O O3 . NAG Z . ? 1.2671 1.4158 1.3627 -0.0078 0.0254 0.0231 605 NAG D O3 14117 O O4 . NAG Z . ? 1.3885 1.5372 1.4811 -0.0088 0.0310 0.0348 605 NAG D O4 14118 O O5 . NAG Z . ? 1.3617 1.5139 1.4913 -0.0132 0.0294 0.0336 605 NAG D O5 14119 O O6 . NAG Z . ? 0.8062 0.9586 0.9346 -0.0137 0.0352 0.0451 605 NAG D O6 14120 O O7 . NAG Z . ? 0.8727 1.0257 0.9986 -0.0096 0.0198 0.0149 605 NAG D O7 14121 O O . HOH AA . ? 0.3146 0.3576 0.3603 -0.0395 0.0434 0.0091 701 HOH A O 14122 O O . HOH AA . ? 0.3361 0.4216 0.2965 -0.0096 0.0579 0.0410 702 HOH A O 14123 O O . HOH AA . ? 0.5465 0.6375 0.5787 -0.0193 0.0503 0.0336 703 HOH A O 14124 O O . HOH AA . ? 0.3991 0.4916 0.4771 -0.0204 0.0699 0.0600 704 HOH A O 14125 O O . HOH AA . ? 0.3407 0.4125 0.3826 -0.0268 0.0668 0.0368 705 HOH A O 14126 O O . HOH AA . ? 0.4689 0.5350 0.4330 -0.0120 0.0478 0.0074 706 HOH A O 14127 O O . HOH AA . ? 0.3100 0.3943 0.5182 -0.0508 0.0453 0.0353 707 HOH A O 14128 O O . HOH AA . ? 0.4399 0.4647 0.3869 -0.0205 0.0590 -0.0069 708 HOH A O 14129 O O . HOH AA . ? 0.4617 0.4890 0.3223 -0.0066 0.0727 -0.0027 709 HOH A O 14130 O O . HOH AA . ? 0.4586 0.5074 0.5032 -0.0382 0.0490 0.0129 710 HOH A O 14131 O O . HOH AA . ? 0.5533 0.6487 0.8492 -0.0587 0.0562 0.0485 711 HOH A O 14132 O O . HOH AA . ? 0.2999 0.3856 0.2842 -0.0045 0.0706 0.0638 712 HOH A O 14133 O O . HOH AA . ? 0.3960 0.4614 0.4938 -0.0410 0.0574 0.0300 713 HOH A O 14134 O O . HOH AA . ? 0.4864 0.5138 0.4308 -0.0233 0.0650 -0.0029 714 HOH A O 14135 O O . HOH AA . ? 0.4447 0.5226 0.4986 -0.0259 0.0661 0.0421 715 HOH A O 14136 O O . HOH AA . ? 0.3079 0.3892 0.4338 -0.0385 0.0554 0.0376 716 HOH A O 14137 O O . HOH AA . ? 0.5398 0.6032 0.4608 -0.0095 0.0593 0.0193 717 HOH A O 14138 O O . HOH AA . ? 0.4949 0.5344 0.3792 -0.0010 0.0571 -0.0095 718 HOH A O 14139 O O . HOH AA . ? 0.3154 0.3937 0.3570 -0.0237 0.0442 0.0185 719 HOH A O 14140 O O . HOH AA . ? 0.3100 0.3713 0.3196 -0.0271 0.0591 0.0214 720 HOH A O 14141 O O . HOH AA . ? 0.3691 0.3999 0.4159 -0.0328 0.0251 -0.0041 721 HOH A O 14142 O O . HOH AA . ? 0.4687 0.5605 0.4299 0.0132 0.0724 0.0883 722 HOH A O 14143 O O . HOH AA . ? 0.6796 0.6832 0.4892 0.0149 0.0697 -0.0331 723 HOH A O 14144 O O . HOH AA . ? 0.3556 0.3990 0.3395 -0.0278 0.0588 0.0073 724 HOH A O 14145 O O . HOH AA . ? 0.5932 0.6358 0.5868 -0.0334 0.0653 0.0085 725 HOH A O 14146 O O . HOH AA . ? 0.5194 0.5706 0.5221 -0.0300 0.0603 0.0145 726 HOH A O 14147 O O . HOH AA . ? 0.3580 0.4281 0.4772 -0.0425 0.0545 0.0319 727 HOH A O 14148 O O . HOH AA . ? 0.5025 0.5540 0.3193 0.0027 0.0713 0.0295 728 HOH A O 14149 O O . HOH AA . ? 0.4688 0.5229 0.4611 -0.0180 0.0433 -0.0005 729 HOH A O 14150 O O . HOH AA . ? 0.4507 0.5211 0.4990 -0.0258 0.0401 0.0111 730 HOH A O 14151 O O . HOH AA . ? 0.5116 0.5629 0.4491 -0.0066 0.0472 -0.0068 731 HOH A O 14152 O O . HOH AA . ? 0.3495 0.4474 0.3659 -0.0015 0.0721 0.0791 732 HOH A O 14153 O O . HOH AA . ? 0.4630 0.5366 0.5316 -0.0287 0.0388 0.0136 733 HOH A O 14154 O O . HOH AA . ? 0.4082 0.4768 0.3407 -0.0046 0.0721 0.0473 734 HOH A O 14155 O O . HOH AA . ? 0.4505 0.5135 0.6306 -0.0325 -0.0085 -0.0167 735 HOH A O 14156 O O . HOH AA . ? 0.5080 0.5968 0.5747 -0.0199 0.0705 0.0574 736 HOH A O 14157 O O . HOH AA . ? 0.5109 0.5484 0.5125 -0.0235 0.0413 -0.0052 737 HOH A O 14158 O O . HOH AA . ? 0.4231 0.4818 0.4373 -0.0290 0.0666 0.0235 738 HOH A O 14159 O O . HOH AA . ? 0.3702 0.4402 0.3829 -0.0233 0.0653 0.0339 739 HOH A O 14160 O O . HOH AA . ? 0.6006 0.6489 0.5156 0.0003 0.0462 -0.0146 740 HOH A O 14161 O O . HOH AA . ? 0.4897 0.5462 0.4750 -0.0152 0.0427 -0.0015 741 HOH A O 14162 O O . HOH AA . ? 0.4482 0.5233 0.5724 -0.0410 0.0548 0.0344 742 HOH A O 14163 O O . HOH AA . ? 0.4089 0.5092 0.5693 -0.0356 0.0568 0.0495 743 HOH A O 14164 O O . HOH AA . ? 0.5596 0.6209 0.4102 0.0025 0.0606 0.0164 744 HOH A O 14165 O O . HOH AA . ? 0.5073 0.5842 0.5899 -0.0329 0.0596 0.0365 745 HOH A O 14166 O O . HOH AA . ? 0.4859 0.5506 0.3765 0.0012 0.0513 0.0035 746 HOH A O 14167 O O . HOH AA . ? 0.4600 0.5293 0.5347 -0.0343 0.0640 0.0341 747 HOH A O 14168 O O . HOH AA . ? 0.6537 0.6601 0.6255 -0.0247 0.0442 -0.0125 748 HOH A O 14169 O O . HOH AA . ? 0.4333 0.5009 0.2665 0.0072 0.0670 0.0512 749 HOH A O 14170 O O . HOH AA . ? 0.4474 0.5179 0.5236 -0.0347 0.0492 0.0241 750 HOH A O 14171 O O . HOH AA . ? 0.5294 0.5996 0.5435 -0.0174 0.0753 0.0415 751 HOH A O 14172 O O . HOH AA . ? 0.6262 0.6721 0.5242 0.0020 0.0493 -0.0144 752 HOH A O 14173 O O . HOH AA . ? 0.4908 0.5332 0.4956 -0.0346 0.0589 0.0087 753 HOH A O 14174 O O . HOH AA . ? 0.4893 0.5485 0.5036 -0.0255 0.0487 0.0114 754 HOH A O 14175 O O . HOH AA . ? 0.5882 0.6353 0.5732 -0.0286 0.0640 0.0120 755 HOH A O 14176 O O . HOH AA . ? 0.5446 0.5760 0.4718 -0.0211 0.0709 0.0015 756 HOH A O 14177 O O . HOH AA . ? 0.5953 0.6647 0.6644 -0.0343 0.0548 0.0275 757 HOH A O 14178 O O . HOH AA . ? 0.7261 0.7784 0.8069 -0.0283 0.0200 -0.0064 758 HOH A O 14179 O O . HOH AA . ? 0.6612 0.7285 0.7462 -0.0337 0.0728 0.0385 759 HOH A O 14180 O O . HOH AA . ? 0.4660 0.5509 0.5422 -0.0199 0.0760 0.0584 760 HOH A O 14181 O O . HOH AA . ? 0.4871 0.5420 0.5189 -0.0332 0.0531 0.0154 761 HOH A O 14182 O O . HOH AA . ? 0.5469 0.6607 0.5925 -0.0131 0.0522 0.0546 762 HOH A O 14183 O O . HOH AA . ? 0.4821 0.5832 0.7064 -0.0319 -0.0021 -0.0128 763 HOH A O 14184 O O . HOH AA . ? 0.5469 0.6367 0.5264 -0.0072 0.0408 0.0130 764 HOH A O 14185 O O . HOH AA . ? 0.4822 0.5785 0.4911 0.0039 0.0747 0.0846 765 HOH A O 14186 O O . HOH AA . ? 0.5902 0.6223 0.4588 -0.0102 0.0756 0.0054 766 HOH A O 14187 O O . HOH AA . ? 0.6561 0.7491 0.9535 -0.0607 0.0486 0.0426 767 HOH A O 14188 O O . HOH AA . ? 0.3984 0.4638 0.4050 -0.0248 0.0634 0.0280 768 HOH A O 14189 O O . HOH AA . ? 0.7248 0.8070 0.7891 -0.0177 0.0775 0.0572 769 HOH A O 14190 O O . HOH AA . ? 0.5652 0.6449 0.7284 -0.0284 0.0031 -0.0130 770 HOH A O 14191 O O . HOH AA . ? 0.5039 0.6023 0.7429 -0.0330 -0.0077 -0.0167 771 HOH A O 14192 O O . HOH AA . ? 0.7026 0.7561 0.5337 0.0014 0.0718 0.0344 772 HOH A O 14193 O O . HOH AA . ? 0.6361 0.6921 0.7918 -0.0547 0.0386 0.0245 773 HOH A O 14194 O O . HOH AA . ? 0.3385 0.4184 0.4297 -0.0296 0.0695 0.0469 774 HOH A O 14195 O O . HOH AA . ? 0.4871 0.5801 0.7428 -0.0517 0.0203 0.0179 775 HOH A O 14196 O O . HOH AA . ? 0.8491 0.9117 0.6678 0.0064 0.0677 0.0429 776 HOH A O 14197 O O . HOH BA . ? 0.3562 0.3939 0.7319 -0.0928 0.0084 0.0257 701 HOH B O 14198 O O . HOH BA . ? 0.3990 0.4222 0.6499 -0.0768 -0.0126 0.0172 702 HOH B O 14199 O O . HOH BA . ? 0.3982 0.4226 0.8875 -0.1140 0.0481 0.0406 703 HOH B O 14200 O O . HOH BA . ? 0.3697 0.3904 0.6509 -0.0857 0.0621 0.0423 704 HOH B O 14201 O O . HOH BA . ? 0.3482 0.3596 0.5172 -0.0718 -0.0056 0.0197 705 HOH B O 14202 O O . HOH BA . ? 0.4546 0.4823 0.8564 -0.0996 0.0003 0.0245 706 HOH B O 14203 O O . HOH BA . ? 0.4569 0.4775 0.9640 -0.1096 -0.0441 0.0088 707 HOH B O 14204 O O . HOH BA . ? 0.3702 0.3830 0.6767 -0.0933 0.0516 0.0403 708 HOH B O 14205 O O . HOH BA . ? 0.3892 0.4369 0.7371 -0.0632 -0.0510 -0.0118 709 HOH B O 14206 O O . HOH BA . ? 0.3888 0.4046 0.6333 -0.0831 0.0579 0.0396 710 HOH B O 14207 O O . HOH BA . ? 0.4160 0.4208 0.5818 -0.0785 0.0396 0.0323 711 HOH B O 14208 O O . HOH BA . ? 0.5177 0.5075 0.6714 -0.0771 -0.0221 0.0223 712 HOH B O 14209 O O . HOH BA . ? 0.6298 0.6587 0.7920 -0.0683 0.0353 0.0275 713 HOH B O 14210 O O . HOH BA . ? 0.5307 0.5575 1.0810 -0.1217 0.0252 0.0320 714 HOH B O 14211 O O . HOH BA . ? 0.3344 0.4011 0.6919 -0.0791 0.0173 0.0251 715 HOH B O 14212 O O . HOH BA . ? 0.4506 0.5008 0.6994 -0.0586 -0.0143 0.0025 716 HOH B O 14213 O O . HOH BA . ? 0.3765 0.3811 0.5536 -0.0761 -0.0085 0.0217 717 HOH B O 14214 O O . HOH BA . ? 0.3595 0.3782 0.6265 -0.0861 0.0476 0.0378 718 HOH B O 14215 O O . HOH BA . ? 0.3541 0.3547 0.5199 -0.0662 -0.0357 0.0128 719 HOH B O 14216 O O . HOH BA . ? 0.4091 0.4198 0.7220 -0.0958 0.0199 0.0321 720 HOH B O 14217 O O . HOH BA . ? 0.5463 0.5410 0.7034 -0.0684 -0.0375 0.0151 721 HOH B O 14218 O O . HOH BA . ? 0.7229 0.7866 1.0316 -0.0729 0.0592 0.0447 722 HOH B O 14219 O O . HOH BA . ? 0.5454 0.5427 0.7870 -0.0892 0.0618 0.0409 723 HOH B O 14220 O O . HOH BA . ? 0.3995 0.4260 0.6480 -0.0807 0.0460 0.0362 724 HOH B O 14221 O O . HOH BA . ? 0.5772 0.6007 0.7386 -0.0695 0.0524 0.0328 725 HOH B O 14222 O O . HOH BA . ? 0.4458 0.4501 0.7395 -0.0947 0.0036 0.0284 726 HOH B O 14223 O O . HOH BA . ? 0.5649 0.5872 0.7254 -0.0707 0.0419 0.0302 727 HOH B O 14224 O O . HOH BA . ? 0.4696 0.4682 0.5981 -0.0687 -0.0180 0.0184 728 HOH B O 14225 O O . HOH BA . ? 0.4808 0.4804 0.6937 -0.0860 0.0067 0.0283 729 HOH B O 14226 O O . HOH BA . ? 0.4504 0.4607 0.6829 -0.0718 -0.0381 0.0108 730 HOH B O 14227 O O . HOH BA . ? 0.4252 0.4475 0.6410 -0.0782 0.0258 0.0292 731 HOH B O 14228 O O . HOH BA . ? 0.5170 0.5241 0.8749 -0.1021 0.0547 0.0422 732 HOH B O 14229 O O . HOH BA . ? 0.6769 0.6980 0.9134 -0.0380 -0.0638 -0.0231 733 HOH B O 14230 O O . HOH BA . ? 0.6007 0.6487 0.8029 -0.0639 0.0602 0.0381 734 HOH B O 14231 O O . HOH BA . ? 0.4550 0.4414 0.5698 -0.0787 0.0076 0.0277 735 HOH B O 14232 O O . HOH BA . ? 0.5511 0.6223 1.1680 -0.0708 -0.1163 -0.0562 736 HOH B O 14233 O O . HOH BA . ? 0.4887 0.4726 0.8991 -0.1182 0.0442 0.0405 737 HOH B O 14234 O O . HOH BA . ? 0.5596 0.5813 0.7226 -0.0522 -0.0225 0.0017 738 HOH B O 14235 O O . HOH BA . ? 0.7958 0.7852 1.1186 -0.0851 -0.0780 0.0076 739 HOH B O 14236 O O . HOH BA . ? 0.5121 0.5249 0.6534 -0.0642 -0.0099 0.0149 740 HOH B O 14237 O O . HOH BA . ? 0.3847 0.3593 0.5486 -0.0888 -0.0042 0.0301 741 HOH B O 14238 O O . HOH BA . ? 0.5026 0.5100 0.7837 -0.0929 0.0314 0.0348 742 HOH B O 14239 O O . HOH BA . ? 0.5023 0.5251 0.7366 -0.0807 0.0314 0.0317 743 HOH B O 14240 O O . HOH BA . ? 0.4968 0.5133 0.7276 -0.0720 -0.0273 0.0124 744 HOH B O 14241 O O . HOH BA . ? 0.5467 0.5660 0.7857 -0.0822 0.0173 0.0282 745 HOH B O 14242 O O . HOH BA . ? 0.6837 0.7308 0.9860 -0.0643 -0.0312 -0.0015 746 HOH B O 14243 O O . HOH BA . ? 0.6668 0.6769 0.9367 -0.0899 0.0444 0.0375 747 HOH B O 14244 O O . HOH BA . ? 0.6540 0.6564 0.8039 -0.0486 -0.0460 -0.0004 748 HOH B O 14245 O O . HOH BA . ? 0.5357 0.5393 0.6992 -0.0733 -0.0131 0.0200 749 HOH B O 14246 O O . HOH BA . ? 0.8613 0.9463 1.1083 -0.0520 0.0716 0.0551 750 HOH B O 14247 O O . HOH BA . ? 0.5629 0.5882 0.7279 -0.0561 -0.0142 0.0061 751 HOH B O 14248 O O . HOH BA . ? 0.6269 0.6033 0.7594 -0.0640 -0.0633 0.0148 752 HOH B O 14249 O O . HOH BA . ? 0.5354 0.5618 0.9822 -0.1031 0.0853 0.0532 753 HOH B O 14250 O O . HOH BA . ? 0.6811 0.7003 0.9408 -0.0557 0.1435 0.0651 754 HOH B O 14251 O O . HOH CA . ? 0.3809 0.3581 0.5504 0.0222 -0.1009 -0.0665 701 HOH C O 14252 O O . HOH CA . ? 0.5280 0.4557 0.5141 0.0856 -0.0489 -0.1047 702 HOH C O 14253 O O . HOH CA . ? 0.4136 0.3236 0.4038 0.0776 -0.0591 -0.0799 703 HOH C O 14254 O O . HOH CA . ? 0.3867 0.3510 0.5374 0.0316 -0.1059 -0.0683 704 HOH C O 14255 O O . HOH CA . ? 0.4333 0.3596 0.5175 0.0319 -0.1225 -0.0374 705 HOH C O 14256 O O . HOH CA . ? 0.3837 0.3582 0.4945 0.0341 -0.0749 -0.0743 706 HOH C O 14257 O O . HOH CA . ? 0.4090 0.3341 0.3923 0.0708 -0.0428 -0.0842 707 HOH C O 14258 O O . HOH CA . ? 0.4724 0.4422 0.4099 0.0486 0.0034 -0.0821 708 HOH C O 14259 O O . HOH CA . ? 0.4936 0.4273 0.5170 0.0429 -0.0611 -0.0548 709 HOH C O 14260 O O . HOH CA . ? 0.4426 0.3786 0.3884 0.0608 -0.0115 -0.0808 710 HOH C O 14261 O O . HOH CA . ? 0.4983 0.4293 0.4257 0.0586 -0.0005 -0.0760 711 HOH C O 14262 O O . HOH CA . ? 0.4045 0.4353 0.4981 -0.0017 -0.0176 -0.0468 712 HOH C O 14263 O O . HOH CA . ? 0.3720 0.3427 0.3699 0.0178 -0.0096 -0.0482 713 HOH C O 14264 O O . HOH CA . ? 0.4627 0.3608 0.4654 0.1103 -0.0819 -0.1112 714 HOH C O 14265 O O . HOH CA . ? 0.4618 0.3734 0.4704 0.0621 -0.0734 -0.0599 715 HOH C O 14266 O O . HOH CA . ? 0.5497 0.5290 0.6149 -0.0030 -0.0406 -0.0307 716 HOH C O 14267 O O . HOH CA . ? 0.3907 0.3405 0.3963 0.0443 -0.0349 -0.0683 717 HOH C O 14268 O O . HOH CA . ? 0.3750 0.3601 0.5541 0.0064 -0.0947 -0.0535 718 HOH C O 14269 O O . HOH CA . ? 0.6245 0.5286 0.5646 0.0930 -0.0323 -0.0979 719 HOH C O 14270 O O . HOH CA . ? 0.4418 0.4253 0.5748 0.0113 -0.0739 -0.0536 720 HOH C O 14271 O O . HOH CA . ? 0.4953 0.3675 0.5486 0.1344 -0.1422 -0.1146 721 HOH C O 14272 O O . HOH CA . ? 0.4017 0.3678 0.4910 0.0396 -0.0713 -0.0748 722 HOH C O 14273 O O . HOH CA . ? 0.3910 0.3732 0.4124 0.0500 -0.0335 -0.0921 723 HOH C O 14274 O O . HOH CA . ? 0.4228 0.3163 0.3902 0.0906 -0.0567 -0.0828 724 HOH C O 14275 O O . HOH CA . ? 0.4232 0.4625 0.5802 -0.0066 -0.0357 -0.0500 725 HOH C O 14276 O O . HOH CA . ? 0.4372 0.3996 0.5159 0.0248 -0.0667 -0.0543 726 HOH C O 14277 O O . HOH CA . ? 0.7334 0.5963 0.6797 0.1275 -0.0682 -0.1024 727 HOH C O 14278 O O . HOH CA . ? 0.5873 0.5661 0.5382 0.0036 0.0287 -0.0355 728 HOH C O 14279 O O . HOH CA . ? 0.4550 0.4559 0.5048 -0.0079 -0.0105 -0.0314 729 HOH C O 14280 O O . HOH CA . ? 0.5365 0.3731 0.5796 0.1671 -0.1734 -0.1172 730 HOH C O 14281 O O . HOH CA . ? 0.6541 0.6194 0.8405 0.0184 -0.1233 -0.0576 731 HOH C O 14282 O O . HOH CA . ? 0.5978 0.5384 0.6215 0.0194 -0.0618 -0.0312 732 HOH C O 14283 O O . HOH CA . ? 0.6788 0.5985 0.5985 0.0611 0.0008 -0.0725 733 HOH C O 14284 O O . HOH CA . ? 0.3859 0.3266 0.4414 0.0315 -0.0782 -0.0465 734 HOH C O 14285 O O . HOH CA . ? 0.6446 0.6356 0.6233 -0.0072 0.0229 -0.0272 735 HOH C O 14286 O O . HOH CA . ? 0.3747 0.3571 0.4696 0.0212 -0.0569 -0.0616 736 HOH C O 14287 O O . HOH CA . ? 0.5275 0.4969 0.5557 0.0086 -0.0281 -0.0375 737 HOH C O 14288 O O . HOH CA . ? 0.5645 0.6046 0.7103 -0.0127 -0.0265 -0.0404 738 HOH C O 14289 O O . HOH CA . ? 0.6014 0.4668 0.5894 0.1012 -0.1107 -0.0622 739 HOH C O 14290 O O . HOH CA . ? 0.4147 0.3075 0.4793 0.0711 -0.1470 -0.0524 740 HOH C O 14291 O O . HOH CA . ? 0.4398 0.3504 0.4051 0.0394 -0.0516 -0.0304 741 HOH C O 14292 O O . HOH CA . ? 0.4317 0.3507 0.4078 0.0682 -0.0409 -0.0764 742 HOH C O 14293 O O . HOH CA . ? 0.5519 0.4718 0.5496 0.0539 -0.0559 -0.0577 743 HOH C O 14294 O O . HOH CA . ? 0.7753 0.6024 0.7000 0.1881 -0.0965 -0.1324 744 HOH C O 14295 O O . HOH CA . ? 0.8787 0.8416 0.7584 0.0739 0.0096 -0.1080 745 HOH C O 14296 O O . HOH CA . ? 0.3757 0.3322 0.4363 0.0166 -0.0636 -0.0402 746 HOH C O 14297 O O . HOH CA . ? 0.4209 0.3456 0.4187 0.0407 -0.0542 -0.0447 747 HOH C O 14298 O O . HOH CA . ? 0.4783 0.4242 0.4259 0.0356 0.0031 -0.0573 748 HOH C O 14299 O O . HOH CA . ? 0.5187 0.4764 0.5175 0.0016 -0.0250 -0.0228 749 HOH C O 14300 O O . HOH CA . ? 0.5271 0.4694 0.4983 0.0608 -0.0244 -0.0840 750 HOH C O 14301 O O . HOH CA . ? 0.4108 0.3177 0.4170 0.0730 -0.0746 -0.0700 751 HOH C O 14302 O O . HOH CA . ? 0.5104 0.4499 0.5180 0.0201 -0.0505 -0.0312 752 HOH C O 14303 O O . HOH CA . ? 0.6870 0.5336 0.7532 0.1785 -0.1802 -0.1436 753 HOH C O 14304 O O . HOH CA . ? 0.6977 0.6729 0.7572 -0.0067 -0.0433 -0.0245 754 HOH C O 14305 O O . HOH CA . ? 0.6407 0.5782 0.6281 0.0483 -0.0319 -0.0653 755 HOH C O 14306 O O . HOH CA . ? 0.5117 0.5190 0.5525 0.0335 -0.0263 -0.0815 756 HOH C O 14307 O O . HOH CA . ? 0.5410 0.5033 0.5575 0.0677 -0.0457 -0.1043 757 HOH C O 14308 O O . HOH CA . ? 0.4647 0.3681 0.4501 0.0895 -0.0624 -0.0896 758 HOH C O 14309 O O . HOH CA . ? 0.5101 0.5150 0.6352 0.0106 -0.0521 -0.0604 759 HOH C O 14310 O O . HOH CA . ? 0.4826 0.4519 0.5449 0.0232 -0.0501 -0.0557 760 HOH C O 14311 O O . HOH CA . ? 0.5202 0.4986 0.5497 0.0580 -0.0425 -0.1008 761 HOH C O 14312 O O . HOH CA . ? 0.5234 0.5061 0.4942 0.0005 0.0200 -0.0333 762 HOH C O 14313 O O . HOH CA . ? 0.4438 0.3290 0.3907 0.0806 -0.0478 -0.0624 763 HOH C O 14314 O O . HOH CA . ? 0.7659 0.6031 0.6632 0.1694 -0.0571 -0.1376 764 HOH C O 14315 O O . HOH CA . ? 0.5620 0.4571 0.5567 0.0660 -0.0870 -0.0480 765 HOH C O 14316 O O . HOH CA . ? 0.6775 0.5897 0.6760 0.0432 -0.0766 -0.0353 766 HOH C O 14317 O O . HOH CA . ? 0.7270 0.7033 0.6817 0.0031 0.0259 -0.0345 767 HOH C O 14318 O O . HOH CA . ? 0.6108 0.5453 0.5877 0.0271 -0.0278 -0.0373 768 HOH C O 14319 O O . HOH CA . ? 0.5076 0.4636 0.5120 0.0333 -0.0272 -0.0589 769 HOH C O 14320 O O . HOH CA . ? 0.7551 0.5959 0.7978 0.1817 -0.1732 -0.1396 770 HOH C O 14321 O O . HOH CA . ? 0.5324 0.4524 0.4438 0.0643 0.0043 -0.0770 771 HOH C O 14322 O O . HOH CA . ? 0.5496 0.4487 0.5535 0.0854 -0.0801 -0.0788 772 HOH C O 14323 O O . HOH CA . ? 0.4953 0.4175 0.4939 0.0396 -0.0598 -0.0408 773 HOH C O 14324 O O . HOH CA . ? 0.5451 0.5443 0.5864 0.0023 -0.0113 -0.0418 774 HOH C O 14325 O O . HOH CA . ? 0.5944 0.5346 0.8836 0.0657 -0.2089 -0.1063 775 HOH C O 14326 O O . HOH CA . ? 0.4095 0.3459 0.3715 0.0596 -0.0203 -0.0791 776 HOH C O 14327 O O . HOH CA . ? 0.4507 0.3611 0.4283 0.0750 -0.0493 -0.0776 777 HOH C O 14328 O O . HOH CA . ? 0.4319 0.3524 0.4455 0.0590 -0.0667 -0.0642 778 HOH C O 14329 O O . HOH CA . ? 0.4961 0.4972 0.6642 -0.0085 -0.0689 -0.0418 779 HOH C O 14330 O O . HOH CA . ? 0.6146 0.5151 0.6199 0.0752 -0.0817 -0.0664 780 HOH C O 14331 O O . HOH CA . ? 0.4957 0.5313 0.5481 -0.0136 0.0099 -0.0258 781 HOH C O 14332 O O . HOH CA . ? 0.5244 0.4836 0.5213 0.0031 -0.0201 -0.0256 782 HOH C O 14333 O O . HOH CA . ? 0.4599 0.4259 0.4761 0.0247 -0.0256 -0.0542 783 HOH C O 14334 O O . HOH CA . ? 0.5906 0.4725 0.5780 0.0803 -0.0943 -0.0529 784 HOH C O 14335 O O . HOH CA . ? 0.8388 0.6695 0.8748 0.1427 -0.1958 -0.0734 785 HOH C O 14336 O O . HOH CA . ? 0.4494 0.4331 0.5311 0.0236 -0.0499 -0.0642 786 HOH C O 14337 O O . HOH CA . ? 1.0382 0.9139 0.9825 0.1171 -0.0562 -0.1025 787 HOH C O 14338 O O . HOH CA . ? 0.5900 0.5191 0.5902 0.0294 -0.0562 -0.0340 788 HOH C O 14339 O O . HOH CA . ? 0.7789 0.6647 0.8219 0.0741 -0.1426 -0.0479 789 HOH C O 14340 O O . HOH CA . ? 0.6596 0.6838 0.8159 0.0319 -0.0668 -0.0966 790 HOH C O 14341 O O . HOH CA . ? 0.4918 0.4231 0.5050 0.0298 -0.0629 -0.0362 791 HOH C O 14342 O O . HOH CA . ? 0.6687 0.5621 0.6503 0.0646 -0.0792 -0.0447 792 HOH C O 14343 O O . HOH CA . ? 0.6091 0.4987 0.6722 0.0785 -0.1465 -0.0584 793 HOH C O 14344 O O . HOH CA . ? 0.7353 0.6790 0.6528 0.0710 -0.0023 -0.0975 794 HOH C O 14345 O O . HOH CA . ? 0.5615 0.5639 0.7801 0.0368 -0.1075 -0.1014 795 HOH C O 14346 O O . HOH CA . ? 0.7836 0.7942 1.0050 -0.0159 -0.0804 -0.0429 796 HOH C O 14347 O O . HOH CA . ? 0.4346 0.4167 0.5067 0.0285 -0.0477 -0.0687 797 HOH C O 14348 O O . HOH CA . ? 0.5894 0.5907 0.5908 -0.0044 0.0134 -0.0321 798 HOH C O 14349 O O . HOH CA . ? 0.6291 0.6178 0.6377 -0.0029 0.0022 -0.0319 799 HOH C O 14350 O O . HOH DA . ? 0.3350 0.5124 0.6777 -0.0370 0.0449 0.0623 701 HOH D O 14351 O O . HOH DA . ? 0.3107 0.5014 0.7283 -0.0426 0.0135 0.0188 702 HOH D O 14352 O O . HOH DA . ? 0.3245 0.5090 0.6526 -0.0329 0.0260 0.0371 703 HOH D O 14353 O O . HOH DA . ? 0.5343 0.7428 1.1058 -0.0608 0.0416 0.0521 704 HOH D O 14354 O O . HOH DA . ? 0.3456 0.4763 0.6308 -0.0229 -0.0213 -0.0367 705 HOH D O 14355 O O . HOH DA . ? 0.3209 0.5731 1.1079 -0.0715 -0.0192 -0.0283 706 HOH D O 14356 O O . HOH DA . ? 0.3072 0.4649 0.6885 -0.0499 0.0367 0.0442 707 HOH D O 14357 O O . HOH DA . ? 0.3190 0.5207 0.9760 -0.0726 0.0016 0.0023 708 HOH D O 14358 O O . HOH DA . ? 0.3463 0.5403 0.7558 -0.0422 0.0340 0.0484 709 HOH D O 14359 O O . HOH DA . ? 0.3148 0.4795 0.7097 -0.0453 0.0055 0.0066 710 HOH D O 14360 O O . HOH DA . ? 0.3198 0.5145 0.7177 -0.0304 -0.0124 -0.0199 711 HOH D O 14361 O O . HOH DA . ? 0.3516 0.5564 0.8070 -0.0442 0.0150 0.0219 712 HOH D O 14362 O O . HOH DA . ? 0.5276 0.6884 0.7080 -0.0157 0.0179 0.0163 713 HOH D O 14363 O O . HOH DA . ? 0.3238 0.5382 1.1395 -0.0937 0.0399 0.0351 714 HOH D O 14364 O O . HOH DA . ? 0.4119 0.6028 0.7243 -0.0285 0.0244 0.0365 715 HOH D O 14365 O O . HOH DA . ? 0.4904 0.6942 0.9700 -0.0418 0.0741 0.1015 716 HOH D O 14366 O O . HOH DA . ? 0.3099 0.5248 0.9270 -0.0656 0.0347 0.0421 717 HOH D O 14367 O O . HOH DA . ? 0.3798 0.5837 0.8723 -0.0507 0.0422 0.0571 718 HOH D O 14368 O O . HOH DA . ? 0.4169 0.5360 0.6901 -0.0433 0.0154 0.0129 719 HOH D O 14369 O O . HOH DA . ? 0.3690 0.6225 1.1128 -0.0699 0.0060 0.0038 720 HOH D O 14370 O O . HOH DA . ? 0.4796 0.6488 0.8507 -0.0264 -0.0255 -0.0393 721 HOH D O 14371 O O . HOH DA . ? 0.3956 0.6272 0.9777 -0.0541 0.0496 0.0673 722 HOH D O 14372 O O . HOH DA . ? 0.3855 0.6385 0.9720 -0.0484 0.0115 0.0177 723 HOH D O 14373 O O . HOH DA . ? 0.5037 0.6974 0.8517 -0.0329 0.0239 0.0356 724 HOH D O 14374 O O . HOH DA . ? 0.3843 0.5968 0.7274 -0.0264 0.0215 0.0365 725 HOH D O 14375 O O . HOH DA . ? 0.3789 0.5011 0.7321 -0.0370 -0.0283 -0.0325 726 HOH D O 14376 O O . HOH DA . ? 0.5538 0.7218 0.8435 -0.0323 0.0444 0.0611 727 HOH D O 14377 O O . HOH DA . ? 0.3092 0.4669 0.5990 -0.0362 0.0344 0.0432 728 HOH D O 14378 O O . HOH DA . ? 0.5008 0.6056 0.8224 -0.0559 0.0108 0.0129 729 HOH D O 14379 O O . HOH DA . ? 1.3016 1.4934 2.0918 -0.0978 0.0405 0.0352 730 HOH D O 14380 O O . HOH DA . ? 0.4575 0.6735 1.2723 -0.0934 0.0278 0.0235 731 HOH D O 14381 O O . HOH DA . ? 0.5883 0.7493 1.1575 -0.0749 0.0135 0.0175 732 HOH D O 14382 O O . HOH DA . ? 0.5367 0.6722 0.7565 -0.0272 0.0122 0.0047 733 HOH D O 14383 O O . HOH DA . ? 0.4941 0.7048 1.3404 -0.0941 -0.0148 -0.0191 734 HOH D O 14384 O O . HOH DA . ? 0.3796 0.5652 0.9336 -0.0622 0.0010 0.0032 735 HOH D O 14385 O O . HOH DA . ? 0.8109 0.8962 1.1533 -0.0557 -0.0214 -0.0097 736 HOH D O 14386 O O . HOH DA . ? 0.6103 0.7614 0.6930 -0.0072 0.0349 0.0445 737 HOH D O 14387 O O . HOH DA . ? 0.5447 0.7519 1.1283 -0.0621 0.0146 0.0188 738 HOH D O 14388 O O . HOH DA . ? 0.5839 0.6807 0.8005 -0.0155 -0.0230 -0.0436 739 HOH D O 14389 O O . HOH DA . ? 0.5279 0.6797 1.1072 -0.0742 -0.0129 -0.0066 740 HOH D O 14390 O O . HOH DA . ? 0.4441 0.6391 0.6738 -0.0154 0.0264 0.0440 741 HOH D O 14391 O O . HOH DA . ? 0.5743 0.7532 0.7788 -0.0031 -0.0080 -0.0278 742 HOH D O # _database_PDB_caveat.id 1 _database_PDB_caveat.text 'CHIRALITY ERROR ON C1 CENTER OF B BMA 603' # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 SER 1 60 ? ? ? A . n A 1 2 LEU 2 61 ? ? ? A . n A 1 3 PRO 3 62 62 PRO PRO A . n A 1 4 HIS 4 63 63 HIS HIS A . n A 1 5 GLN 5 64 64 GLN GLN A . n A 1 6 PRO 6 65 65 PRO PRO A . n A 1 7 ILE 7 66 66 ILE ILE A . n A 1 8 PRO 8 67 67 PRO PRO A . n A 1 9 PRO 9 68 68 PRO PRO A . n A 1 10 SER 10 69 69 SER SER A . n A 1 11 LEU 11 70 70 LEU LEU A . n A 1 12 GLY 12 71 71 GLY GLY A . n A 1 13 GLU 13 72 72 GLU GLU A . n A 1 14 LYS 14 73 73 LYS LYS A . n A 1 15 ASP 15 74 74 ASP ASP A . n A 1 16 LEU 16 75 75 LEU LEU A . n A 1 17 SER 17 76 76 SER SER A . n A 1 18 ASP 18 77 77 ASP ASP A . n A 1 19 PRO 19 78 78 PRO PRO A . n A 1 20 PHE 20 79 79 PHE PHE A . n A 1 21 ASN 21 80 80 ASN ASN A . n A 1 22 PHE 22 81 81 PHE PHE A . n A 1 23 LEU 23 82 82 LEU LEU A . n A 1 24 PHE 24 83 83 PHE PHE A . n A 1 25 SER 25 84 84 SER SER A . n A 1 26 SER 26 85 85 SER SER A . n A 1 27 ASN 27 86 86 ASN ASN A . n A 1 28 LYS 28 87 87 LYS LYS A . n A 1 29 ILE 29 88 88 ILE ILE A . n A 1 30 THR 30 89 89 THR THR A . n A 1 31 LEU 31 90 90 LEU LEU A . n A 1 32 ARG 32 91 91 ARG ARG A . n A 1 33 LYS 33 92 92 LYS LYS A . n A 1 34 LEU 34 93 93 LEU LEU A . n A 1 35 TYR 35 94 94 TYR TYR A . n A 1 36 ASP 36 95 95 ASP ASP A . n A 1 37 LEU 37 96 96 LEU LEU A . n A 1 38 THR 38 97 97 THR THR A . n A 1 39 LYS 39 98 98 LYS LYS A . n A 1 40 ASN 40 99 99 ASN ASN A . n A 1 41 VAL 41 100 100 VAL VAL A . n A 1 42 ASP 42 101 101 ASP ASP A . n A 1 43 PHE 43 102 102 PHE PHE A . n A 1 44 ASP 44 103 103 ASP ASP A . n A 1 45 GLN 45 104 104 GLN GLN A . n A 1 46 LEU 46 105 105 LEU LEU A . n A 1 47 ARG 47 106 106 ARG ARG A . n A 1 48 GLN 48 107 107 GLN GLN A . n A 1 49 ASN 49 108 108 ASN ASN A . n A 1 50 GLU 50 109 109 GLU GLU A . n A 1 51 CYS 51 110 110 CYS CYS A . n A 1 52 LYS 52 111 111 LYS LYS A . n A 1 53 LYS 53 112 112 LYS LYS A . n A 1 54 ASN 54 113 113 ASN ASN A . n A 1 55 ILE 55 114 114 ILE ILE A . n A 1 56 THR 56 115 115 THR THR A . n A 1 57 LEU 57 116 116 LEU LEU A . n A 1 58 SER 58 117 117 SER SER A . n A 1 59 LYS 59 118 118 LYS LYS A . n A 1 60 PHE 60 119 119 PHE PHE A . n A 1 61 TRP 61 120 120 TRP TRP A . n A 1 62 GLU 62 121 121 GLU GLU A . n A 1 63 LYS 63 122 ? ? ? A . n A 1 64 SER 64 123 ? ? ? A . n A 1 65 GLU 65 124 ? ? ? A . n A 1 66 GLN 66 125 ? ? ? A . n A 1 67 ARG 67 126 ? ? ? A . n A 1 68 ASN 68 127 ? ? ? A . n A 1 69 VAL 69 128 ? ? ? A . n A 1 70 PRO 70 129 129 PRO PRO A . n A 1 71 GLU 71 130 130 GLU GLU A . n A 1 72 ASP 72 131 131 ASP ASP A . n A 1 73 ASP 73 132 132 ASP ASP A . n A 1 74 ASN 74 133 133 ASN ASN A . n A 1 75 TRP 75 134 134 TRP TRP A . n A 1 76 GLU 76 135 135 GLU GLU A . n A 1 77 ARG 77 136 136 ARG ARG A . n A 1 78 PHE 78 137 137 PHE PHE A . n A 1 79 TYR 79 138 138 TYR TYR A . n A 1 80 SER 80 139 139 SER SER A . n A 1 81 ASN 81 140 140 ASN ASN A . n A 1 82 ILE 82 141 141 ILE ILE A . n A 1 83 GLY 83 142 142 GLY GLY A . n A 1 84 SER 84 143 143 SER SER A . n A 1 85 CYS 85 144 144 CYS CYS A . n A 1 86 SER 86 145 145 SER SER A . n A 1 87 VAL 87 146 146 VAL VAL A . n A 1 88 TYR 88 147 147 TYR TYR A . n A 1 89 SER 89 148 148 SER SER A . n A 1 90 ASP 90 149 149 ASP ASP A . n A 1 91 ASP 91 150 150 ASP ASP A . n A 1 92 GLN 92 151 151 GLN GLN A . n A 1 93 MSE 93 152 152 MSE MSE A . n A 1 94 ILE 94 153 153 ILE ILE A . n A 1 95 ASP 95 154 154 ASP ASP A . n A 1 96 ASN 96 155 155 ASN ASN A . n A 1 97 LEU 97 156 156 LEU LEU A . n A 1 98 LEU 98 157 157 LEU LEU A . n A 1 99 HIS 99 158 158 HIS HIS A . n A 1 100 ASP 100 159 159 ASP ASP A . n A 1 101 LEU 101 160 160 LEU LEU A . n A 1 102 ASN 102 161 161 ASN ASN A . n A 1 103 THR 103 162 162 THR THR A . n A 1 104 SER 104 163 163 SER SER A . n A 1 105 PRO 105 164 164 PRO PRO A . n A 1 106 ILE 106 165 165 ILE ILE A . n A 1 107 LYS 107 166 166 LYS LYS A . n A 1 108 HIS 108 167 167 HIS HIS A . n A 1 109 VAL 109 168 168 VAL VAL A . n A 1 110 HIS 110 169 169 HIS HIS A . n A 1 111 ILE 111 170 170 ILE ILE A . n A 1 112 MSE 112 171 171 MSE MSE A . n A 1 113 ASP 113 172 172 ASP ASP A . n A 1 114 GLY 114 173 173 GLY GLY A . n A 1 115 GLY 115 174 ? ? ? A . n A 1 116 THR 116 175 175 THR THR A . n A 1 117 GLN 117 176 176 GLN GLN A . n A 1 118 VAL 118 177 177 VAL VAL A . n A 1 119 LYS 119 178 178 LYS LYS A . n A 1 120 PHE 120 179 179 PHE PHE A . n A 1 121 VAL 121 180 180 VAL VAL A . n A 1 122 PHE 122 181 181 PHE PHE A . n A 1 123 THR 123 182 182 THR THR A . n A 1 124 PHE 124 183 183 PHE PHE A . n A 1 125 LYS 125 184 184 LYS LYS A . n A 1 126 ASN 126 185 185 ASN ASN A . n A 1 127 ASP 127 186 186 ASP ASP A . n A 1 128 LYS 128 187 187 LYS LYS A . n A 1 129 GLN 129 188 188 GLN GLN A . n A 1 130 ALA 130 189 189 ALA ALA A . n A 1 131 VAL 131 190 190 VAL VAL A . n A 1 132 PHE 132 191 191 PHE PHE A . n A 1 133 LYS 133 192 192 LYS LYS A . n A 1 134 PRO 134 193 193 PRO PRO A . n A 1 135 MSE 135 194 194 MSE MSE A . n A 1 136 ARG 136 195 195 ARG ARG A . n A 1 137 PHE 137 196 196 PHE PHE A . n A 1 138 GLY 138 197 197 GLY GLY A . n A 1 139 ARG 139 198 198 ARG ARG A . n A 1 140 ASP 140 199 199 ASP ASP A . n A 1 141 TYR 141 200 200 TYR TYR A . n A 1 142 GLU 142 201 201 GLU GLU A . n A 1 143 SER 143 202 202 SER SER A . n A 1 144 ASP 144 203 203 ASP ASP A . n A 1 145 PRO 145 204 204 PRO PRO A . n A 1 146 ASN 146 205 205 ASN ASN A . n A 1 147 HIS 147 206 206 HIS HIS A . n A 1 148 PHE 148 207 207 PHE PHE A . n A 1 149 TYR 149 208 208 TYR TYR A . n A 1 150 PHE 150 209 209 PHE PHE A . n A 1 151 SER 151 210 210 SER SER A . n A 1 152 ASP 152 211 211 ASP ASP A . n A 1 153 PHE 153 212 212 PHE PHE A . n A 1 154 GLU 154 213 213 GLU GLU A . n A 1 155 ARG 155 214 214 ARG ARG A . n A 1 156 HIS 156 215 215 HIS HIS A . n A 1 157 HIS 157 216 216 HIS HIS A . n A 1 158 ALA 158 217 217 ALA ALA A . n A 1 159 GLU 159 218 218 GLU GLU A . n A 1 160 ILE 160 219 219 ILE ILE A . n A 1 161 ALA 161 220 220 ALA ALA A . n A 1 162 THR 162 221 221 THR THR A . n A 1 163 PHE 163 222 222 PHE PHE A . n A 1 164 HIS 164 223 223 HIS HIS A . n A 1 165 LEU 165 224 224 LEU LEU A . n A 1 166 ASP 166 225 225 ASP ASP A . n A 1 167 ARG 167 226 226 ARG ARG A . n A 1 168 VAL 168 227 227 VAL VAL A . n A 1 169 LEU 169 228 228 LEU LEU A . n A 1 170 GLY 170 229 229 GLY GLY A . n A 1 171 PHE 171 230 230 PHE PHE A . n A 1 172 ARG 172 231 231 ARG ARG A . n A 1 173 ARG 173 232 232 ARG ARG A . n A 1 174 ALA 174 233 233 ALA ALA A . n A 1 175 ILE 175 234 234 ILE ILE A . n A 1 176 PRO 176 235 235 PRO PRO A . n A 1 177 THR 177 236 236 THR THR A . n A 1 178 VAL 178 237 237 VAL VAL A . n A 1 179 GLY 179 238 238 GLY GLY A . n A 1 180 ARG 180 239 239 ARG ARG A . n A 1 181 VAL 181 240 240 VAL VAL A . n A 1 182 LEU 182 241 241 LEU LEU A . n A 1 183 ASN 183 242 242 ASN ASN A . n A 1 184 MSE 184 243 243 MSE MSE A . n A 1 185 THR 185 244 244 THR THR A . n A 1 186 THR 186 245 245 THR THR A . n A 1 187 GLU 187 246 246 GLU GLU A . n A 1 188 LEU 188 247 247 LEU LEU A . n A 1 189 PHE 189 248 248 PHE PHE A . n A 1 190 GLU 190 249 249 GLU GLU A . n A 1 191 LYS 191 250 250 LYS LYS A . n A 1 192 ALA 192 251 251 ALA ALA A . n A 1 193 GLU 193 252 252 GLU GLU A . n A 1 194 LYS 194 253 253 LYS LYS A . n A 1 195 LYS 195 254 254 LYS LYS A . n A 1 196 LEU 196 255 255 LEU LEU A . n A 1 197 LYS 197 256 256 LYS LYS A . n A 1 198 LYS 198 257 257 LYS LYS A . n A 1 199 THR 199 258 258 THR THR A . n A 1 200 PHE 200 259 259 PHE PHE A . n A 1 201 PHE 201 260 260 PHE PHE A . n A 1 202 PHE 202 261 261 PHE PHE A . n A 1 203 SER 203 262 262 SER SER A . n A 1 204 PRO 204 263 263 PRO PRO A . n A 1 205 ALA 205 264 264 ALA ALA A . n A 1 206 LYS 206 265 265 LYS LYS A . n A 1 207 ASN 207 266 266 ASN ASN A . n A 1 208 PHE 208 267 267 PHE PHE A . n A 1 209 CYS 209 268 268 CYS CYS A . n A 1 210 PHE 210 269 269 PHE PHE A . n A 1 211 VAL 211 270 270 VAL VAL A . n A 1 212 SER 212 271 271 SER SER A . n A 1 213 ARG 213 272 272 ARG ARG A . n A 1 214 CYS 214 273 273 CYS CYS A . n A 1 215 ASP 215 274 274 ASP ASP A . n A 1 216 TYR 216 275 275 TYR TYR A . n A 1 217 TYR 217 276 276 TYR TYR A . n A 1 218 CYS 218 277 277 CYS CYS A . n A 1 219 ASP 219 278 278 ASP ASP A . n A 1 220 THR 220 279 279 THR THR A . n A 1 221 THR 221 280 280 THR THR A . n A 1 222 HIS 222 281 281 HIS HIS A . n A 1 223 ALA 223 282 282 ALA ALA A . n A 1 224 ILE 224 283 283 ILE ILE A . n A 1 225 CYS 225 284 284 CYS CYS A . n A 1 226 GLY 226 285 285 GLY GLY A . n A 1 227 LEU 227 286 286 LEU LEU A . n A 1 228 PRO 228 287 287 PRO PRO A . n A 1 229 ASP 229 288 288 ASP ASP A . n A 1 230 MSE 230 289 289 MSE MSE A . n A 1 231 LYS 231 290 290 LYS LYS A . n A 1 232 GLU 232 291 291 GLU GLU A . n A 1 233 GLY 233 292 292 GLY GLY A . n A 1 234 SER 234 293 293 SER SER A . n A 1 235 VAL 235 294 294 VAL VAL A . n A 1 236 GLN 236 295 295 GLN GLN A . n A 1 237 VAL 237 296 296 VAL VAL A . n A 1 238 PHE 238 297 297 PHE PHE A . n A 1 239 LEU 239 298 298 LEU LEU A . n A 1 240 PRO 240 299 299 PRO PRO A . n A 1 241 ASP 241 300 300 ASP ASP A . n A 1 242 GLU 242 301 301 GLU GLU A . n A 1 243 SER 243 302 302 SER SER A . n A 1 244 ALA 244 303 303 ALA ALA A . n A 1 245 VAL 245 304 304 VAL VAL A . n A 1 246 PRO 246 305 305 PRO PRO A . n A 1 247 ARG 247 306 306 ARG ARG A . n A 1 248 LYS 248 307 307 LYS LYS A . n A 1 249 HIS 249 308 308 HIS HIS A . n A 1 250 ASN 250 309 309 ASN ASN A . n A 1 251 ARG 251 310 310 ARG ARG A . n A 1 252 SER 252 311 311 SER SER A . n A 1 253 PRO 253 312 312 PRO PRO A . n A 1 254 TYR 254 313 313 TYR TYR A . n A 1 255 ARG 255 314 314 ARG ARG A . n A 1 256 ARG 256 315 315 ARG ARG A . n A 1 257 THR 257 316 316 THR THR A . n A 1 258 TYR 258 317 317 TYR TYR A . n A 1 259 SER 259 318 318 SER SER A . n A 1 260 LYS 260 319 319 LYS LYS A . n A 1 261 LYS 261 320 320 LYS LYS A . n A 1 262 ASN 262 321 321 ASN ASN A . n A 1 263 GLN 263 322 322 GLN GLN A . n A 1 264 VAL 264 323 323 VAL VAL A . n A 1 265 ALA 265 324 324 ALA ALA A . n A 1 266 GLU 266 325 325 GLU GLU A . n A 1 267 TRP 267 326 326 TRP TRP A . n A 1 268 GLN 268 327 327 GLN GLN A . n A 1 269 SER 269 328 328 SER SER A . n A 1 270 SER 270 329 329 SER SER A . n A 1 271 MSE 271 330 330 MSE MSE A . n A 1 272 ASN 272 331 331 ASN ASN A . n A 1 273 TYR 273 332 332 TYR TYR A . n A 1 274 CYS 274 333 333 CYS CYS A . n A 1 275 THR 275 334 334 THR THR A . n A 1 276 ASP 276 335 335 ASP ASP A . n A 1 277 LYS 277 336 336 LYS LYS A . n A 1 278 VAL 278 337 337 VAL VAL A . n A 1 279 LYS 279 338 338 LYS LYS A . n A 1 280 THR 280 339 339 THR THR A . n A 1 281 LYS 281 340 340 LYS LYS A . n A 1 282 ARG 282 341 341 ARG ARG A . n A 1 283 GLN 283 342 342 GLN GLN A . n A 1 284 TYR 284 343 343 TYR TYR A . n A 1 285 ALA 285 344 344 ALA ALA A . n A 1 286 HIS 286 345 345 HIS HIS A . n A 1 287 GLY 287 346 346 GLY GLY A . n A 1 288 ARG 288 347 347 ARG ARG A . n A 1 289 ARG 289 348 348 ARG ARG A . n A 1 290 LEU 290 349 349 LEU LEU A . n A 1 291 LEU 291 350 350 LEU LEU A . n A 1 292 ASP 292 351 351 ASP ASP A . n A 1 293 LEU 293 352 352 LEU LEU A . n A 1 294 VAL 294 353 353 VAL VAL A . n A 1 295 ASP 295 354 354 ASP ASP A . n A 1 296 ILE 296 355 355 ILE ILE A . n A 1 297 HIS 297 356 356 HIS HIS A . n A 1 298 ILE 298 357 357 ILE ILE A . n A 1 299 LEU 299 358 358 LEU LEU A . n A 1 300 ASP 300 359 359 ASP ASP A . n A 1 301 TYR 301 360 360 TYR TYR A . n A 1 302 LEU 302 361 361 LEU LEU A . n A 1 303 ILE 303 362 362 ILE ILE A . n A 1 304 GLY 304 363 363 GLY GLY A . n A 1 305 ASN 305 364 364 ASN ASN A . n A 1 306 GLN 306 365 365 GLN GLN A . n A 1 307 ASP 307 366 366 ASP ASP A . n A 1 308 ARG 308 367 367 ARG ARG A . n A 1 309 HIS 309 368 368 HIS HIS A . n A 1 310 HIS 310 369 369 HIS HIS A . n A 1 311 PHE 311 370 370 PHE PHE A . n A 1 312 GLU 312 371 371 GLU GLU A . n A 1 313 SER 313 372 372 SER SER A . n A 1 314 PHE 314 373 373 PHE PHE A . n A 1 315 ASN 315 374 374 ASN ASN A . n A 1 316 VAL 316 375 375 VAL VAL A . n A 1 317 PHE 317 376 376 PHE PHE A . n A 1 318 ASN 318 377 377 ASN ASN A . n A 1 319 ASP 319 378 378 ASP ASP A . n A 1 320 LEU 320 379 379 LEU LEU A . n A 1 321 PRO 321 380 380 PRO PRO A . n A 1 322 SER 322 381 381 SER SER A . n A 1 323 TYR 323 382 382 TYR TYR A . n A 1 324 ALA 324 383 383 ALA ALA A . n A 1 325 ILE 325 384 384 ILE ILE A . n A 1 326 HIS 326 385 385 HIS HIS A . n A 1 327 LEU 327 386 386 LEU LEU A . n A 1 328 ASP 328 387 387 ASP ASP A . n A 1 329 HIS 329 388 388 HIS HIS A . n A 1 330 GLY 330 389 389 GLY GLY A . n A 1 331 ARG 331 390 390 ARG ARG A . n A 1 332 ALA 332 391 391 ALA ALA A . n A 1 333 PHE 333 392 392 PHE PHE A . n A 1 334 GLY 334 393 393 GLY GLY A . n A 1 335 ARG 335 394 394 ARG ARG A . n A 1 336 SER 336 395 395 SER SER A . n A 1 337 ASP 337 396 396 ASP ASP A . n A 1 338 PHE 338 397 397 PHE PHE A . n A 1 339 ASP 339 398 398 ASP ASP A . n A 1 340 ASP 340 399 399 ASP ASP A . n A 1 341 ASP 341 400 400 ASP ASP A . n A 1 342 ASP 342 401 401 ASP ASP A . n A 1 343 ILE 343 402 402 ILE ILE A . n A 1 344 ILE 344 403 403 ILE ILE A . n A 1 345 LEU 345 404 404 LEU LEU A . n A 1 346 PRO 346 405 405 PRO PRO A . n A 1 347 LEU 347 406 406 LEU LEU A . n A 1 348 ARG 348 407 407 ARG ARG A . n A 1 349 GLN 349 408 408 GLN GLN A . n A 1 350 CYS 350 409 409 CYS CYS A . n A 1 351 CYS 351 410 410 CYS CYS A . n A 1 352 ILE 352 411 411 ILE ILE A . n A 1 353 LEU 353 412 412 LEU LEU A . n A 1 354 ARG 354 413 413 ARG ARG A . n A 1 355 PRO 355 414 414 PRO PRO A . n A 1 356 SER 356 415 415 SER SER A . n A 1 357 THR 357 416 416 THR THR A . n A 1 358 PHE 358 417 417 PHE PHE A . n A 1 359 GLN 359 418 418 GLN GLN A . n A 1 360 THR 360 419 419 THR THR A . n A 1 361 LEU 361 420 420 LEU LEU A . n A 1 362 MSE 362 421 421 MSE MSE A . n A 1 363 ASN 363 422 422 ASN ASN A . n A 1 364 PHE 364 423 423 PHE PHE A . n A 1 365 TYR 365 424 424 TYR TYR A . n A 1 366 SER 366 425 425 SER SER A . n A 1 367 THR 367 426 426 THR THR A . n A 1 368 PRO 368 427 427 PRO PRO A . n A 1 369 LYS 369 428 428 LYS LYS A . n A 1 370 SER 370 429 429 SER SER A . n A 1 371 LEU 371 430 430 LEU LEU A . n A 1 372 THR 372 431 431 THR THR A . n A 1 373 LYS 373 432 432 LYS LYS A . n A 1 374 ALA 374 433 433 ALA ALA A . n A 1 375 LEU 375 434 434 LEU LEU A . n A 1 376 HIS 376 435 435 HIS HIS A . n A 1 377 GLU 377 436 436 GLU GLU A . n A 1 378 SER 378 437 437 SER SER A . n A 1 379 LEU 379 438 438 LEU LEU A . n A 1 380 SER 380 439 439 SER SER A . n A 1 381 LYS 381 440 440 LYS LYS A . n A 1 382 ASP 382 441 441 ASP ASP A . n A 1 383 PRO 383 442 442 PRO PRO A . n A 1 384 ALA 384 443 443 ALA ALA A . n A 1 385 HIS 385 444 444 HIS HIS A . n A 1 386 PRO 386 445 445 PRO PRO A . n A 1 387 ILE 387 446 446 ILE ILE A . n A 1 388 LEU 388 447 447 LEU LEU A . n A 1 389 ALA 389 448 448 ALA ALA A . n A 1 390 TYR 390 449 449 TYR TYR A . n A 1 391 LYS 391 450 450 LYS LYS A . n A 1 392 HIS 392 451 451 HIS HIS A . n A 1 393 TYR 393 452 452 TYR TYR A . n A 1 394 PRO 394 453 453 PRO PRO A . n A 1 395 ALA 395 454 454 ALA ALA A . n A 1 396 MSE 396 455 455 MSE MSE A . n A 1 397 GLU 397 456 456 GLU GLU A . n A 1 398 ARG 398 457 457 ARG ARG A . n A 1 399 ARG 399 458 458 ARG ARG A . n A 1 400 LEU 400 459 459 LEU LEU A . n A 1 401 ALA 401 460 460 ALA ALA A . n A 1 402 LYS 402 461 461 LYS LYS A . n A 1 403 ILE 403 462 462 ILE ILE A . n A 1 404 MSE 404 463 463 MSE MSE A . n A 1 405 SER 405 464 464 SER SER A . n A 1 406 HIS 406 465 465 HIS HIS A . n A 1 407 ILE 407 466 466 ILE ILE A . n A 1 408 LEU 408 467 467 LEU LEU A . n A 1 409 GLU 409 468 468 GLU GLU A . n A 1 410 CYS 410 469 469 CYS CYS A . n A 1 411 PHE 411 470 470 PHE PHE A . n A 1 412 GLU 412 471 471 GLU GLU A . n A 1 413 SER 413 472 472 SER SER A . n A 1 414 ARG 414 473 473 ARG ARG A . n A 1 415 GLY 415 474 474 GLY GLY A . n A 1 416 VAL 416 475 475 VAL VAL A . n A 1 417 ALA 417 476 476 ALA ALA A . n A 1 418 GLU 418 477 477 GLU GLU A . n A 1 419 VAL 419 478 478 VAL VAL A . n A 1 420 LEU 420 479 479 LEU LEU A . n A 1 421 VAL 421 480 480 VAL VAL A . n A 1 422 ALA 422 481 481 ALA ALA A . n A 1 423 GLU 423 482 482 GLU GLU A . n A 1 424 TYR 424 483 483 TYR TYR A . n A 1 425 ASN 425 484 484 ASN ASN A . n A 1 426 ASN 426 485 485 ASN ASN A . n A 1 427 PRO 427 486 486 PRO PRO A . n A 1 428 ASP 428 487 487 ASP ASP A . n A 1 429 VAL 429 488 ? ? ? A . n A 1 430 SER 430 489 ? ? ? A . n A 1 431 ASP 431 490 ? ? ? A . n A 1 432 ALA 432 491 ? ? ? A . n A 1 433 GLU 433 492 ? ? ? A . n A 1 434 GLN 434 493 ? ? ? A . n A 1 435 ASN 435 494 ? ? ? A . n A 1 436 ASP 436 495 ? ? ? A . n A 1 437 GLU 437 496 ? ? ? A . n A 1 438 GLU 438 497 ? ? ? A . n A 1 439 GLN 439 498 ? ? ? A . n A 1 440 SER 440 499 ? ? ? A . n A 1 441 GLU 441 500 ? ? ? A . n A 1 442 GLU 442 501 ? ? ? A . n A 1 443 HIS 443 502 ? ? ? A . n A 1 444 GLN 444 503 ? ? ? A . n A 1 445 ASP 445 504 ? ? ? A . n A 1 446 LYS 446 505 ? ? ? A . n A 1 447 LYS 447 506 ? ? ? A . n A 1 448 ASP 448 507 ? ? ? A . n A 1 449 ASP 449 508 ? ? ? A . n A 1 450 LYS 450 509 ? ? ? A . n A 1 451 LYS 451 510 ? ? ? A . n A 1 452 THR 452 511 ? ? ? A . n A 1 453 VAL 453 512 ? ? ? A . n B 1 1 SER 1 60 ? ? ? B . n B 1 2 LEU 2 61 ? ? ? B . n B 1 3 PRO 3 62 62 PRO PRO B . n B 1 4 HIS 4 63 63 HIS HIS B . n B 1 5 GLN 5 64 64 GLN GLN B . n B 1 6 PRO 6 65 65 PRO PRO B . n B 1 7 ILE 7 66 66 ILE ILE B . n B 1 8 PRO 8 67 67 PRO PRO B . n B 1 9 PRO 9 68 68 PRO PRO B . n B 1 10 SER 10 69 69 SER SER B . n B 1 11 LEU 11 70 70 LEU LEU B . n B 1 12 GLY 12 71 71 GLY GLY B . n B 1 13 GLU 13 72 72 GLU GLU B . n B 1 14 LYS 14 73 73 LYS LYS B . n B 1 15 ASP 15 74 74 ASP ASP B . n B 1 16 LEU 16 75 75 LEU LEU B . n B 1 17 SER 17 76 76 SER SER B . n B 1 18 ASP 18 77 77 ASP ASP B . n B 1 19 PRO 19 78 78 PRO PRO B . n B 1 20 PHE 20 79 79 PHE PHE B . n B 1 21 ASN 21 80 80 ASN ASN B . n B 1 22 PHE 22 81 81 PHE PHE B . n B 1 23 LEU 23 82 82 LEU LEU B . n B 1 24 PHE 24 83 83 PHE PHE B . n B 1 25 SER 25 84 84 SER SER B . n B 1 26 SER 26 85 85 SER SER B . n B 1 27 ASN 27 86 86 ASN ASN B . n B 1 28 LYS 28 87 87 LYS LYS B . n B 1 29 ILE 29 88 88 ILE ILE B . n B 1 30 THR 30 89 89 THR THR B . n B 1 31 LEU 31 90 90 LEU LEU B . n B 1 32 ARG 32 91 91 ARG ARG B . n B 1 33 LYS 33 92 92 LYS LYS B . n B 1 34 LEU 34 93 93 LEU LEU B . n B 1 35 TYR 35 94 94 TYR TYR B . n B 1 36 ASP 36 95 95 ASP ASP B . n B 1 37 LEU 37 96 96 LEU LEU B . n B 1 38 THR 38 97 97 THR THR B . n B 1 39 LYS 39 98 98 LYS LYS B . n B 1 40 ASN 40 99 99 ASN ASN B . n B 1 41 VAL 41 100 100 VAL VAL B . n B 1 42 ASP 42 101 101 ASP ASP B . n B 1 43 PHE 43 102 102 PHE PHE B . n B 1 44 ASP 44 103 103 ASP ASP B . n B 1 45 GLN 45 104 104 GLN GLN B . n B 1 46 LEU 46 105 105 LEU LEU B . n B 1 47 ARG 47 106 106 ARG ARG B . n B 1 48 GLN 48 107 107 GLN GLN B . n B 1 49 ASN 49 108 108 ASN ASN B . n B 1 50 GLU 50 109 109 GLU GLU B . n B 1 51 CYS 51 110 110 CYS CYS B . n B 1 52 LYS 52 111 111 LYS LYS B . n B 1 53 LYS 53 112 112 LYS LYS B . n B 1 54 ASN 54 113 113 ASN ASN B . n B 1 55 ILE 55 114 114 ILE ILE B . n B 1 56 THR 56 115 115 THR THR B . n B 1 57 LEU 57 116 116 LEU LEU B . n B 1 58 SER 58 117 117 SER SER B . n B 1 59 LYS 59 118 118 LYS LYS B . n B 1 60 PHE 60 119 119 PHE PHE B . n B 1 61 TRP 61 120 120 TRP TRP B . n B 1 62 GLU 62 121 121 GLU GLU B . n B 1 63 LYS 63 122 122 LYS LYS B . n B 1 64 SER 64 123 123 SER SER B . n B 1 65 GLU 65 124 124 GLU GLU B . n B 1 66 GLN 66 125 125 GLN GLN B . n B 1 67 ARG 67 126 126 ARG ARG B . n B 1 68 ASN 68 127 127 ASN ASN B . n B 1 69 VAL 69 128 128 VAL VAL B . n B 1 70 PRO 70 129 129 PRO PRO B . n B 1 71 GLU 71 130 130 GLU GLU B . n B 1 72 ASP 72 131 131 ASP ASP B . n B 1 73 ASP 73 132 132 ASP ASP B . n B 1 74 ASN 74 133 133 ASN ASN B . n B 1 75 TRP 75 134 134 TRP TRP B . n B 1 76 GLU 76 135 135 GLU GLU B . n B 1 77 ARG 77 136 136 ARG ARG B . n B 1 78 PHE 78 137 137 PHE PHE B . n B 1 79 TYR 79 138 138 TYR TYR B . n B 1 80 SER 80 139 139 SER SER B . n B 1 81 ASN 81 140 140 ASN ASN B . n B 1 82 ILE 82 141 141 ILE ILE B . n B 1 83 GLY 83 142 142 GLY GLY B . n B 1 84 SER 84 143 143 SER SER B . n B 1 85 CYS 85 144 144 CYS CYS B . n B 1 86 SER 86 145 145 SER SER B . n B 1 87 VAL 87 146 146 VAL VAL B . n B 1 88 TYR 88 147 147 TYR TYR B . n B 1 89 SER 89 148 148 SER SER B . n B 1 90 ASP 90 149 149 ASP ASP B . n B 1 91 ASP 91 150 150 ASP ASP B . n B 1 92 GLN 92 151 151 GLN GLN B . n B 1 93 MSE 93 152 152 MSE MSE B . n B 1 94 ILE 94 153 153 ILE ILE B . n B 1 95 ASP 95 154 154 ASP ASP B . n B 1 96 ASN 96 155 155 ASN ASN B . n B 1 97 LEU 97 156 156 LEU LEU B . n B 1 98 LEU 98 157 157 LEU LEU B . n B 1 99 HIS 99 158 158 HIS HIS B . n B 1 100 ASP 100 159 159 ASP ASP B . n B 1 101 LEU 101 160 160 LEU LEU B . n B 1 102 ASN 102 161 161 ASN ASN B . n B 1 103 THR 103 162 162 THR THR B . n B 1 104 SER 104 163 163 SER SER B . n B 1 105 PRO 105 164 164 PRO PRO B . n B 1 106 ILE 106 165 165 ILE ILE B . n B 1 107 LYS 107 166 166 LYS LYS B . n B 1 108 HIS 108 167 167 HIS HIS B . n B 1 109 VAL 109 168 168 VAL VAL B . n B 1 110 HIS 110 169 169 HIS HIS B . n B 1 111 ILE 111 170 170 ILE ILE B . n B 1 112 MSE 112 171 171 MSE MSE B . n B 1 113 ASP 113 172 172 ASP ASP B . n B 1 114 GLY 114 173 173 GLY GLY B . n B 1 115 GLY 115 174 174 GLY GLY B . n B 1 116 THR 116 175 175 THR THR B . n B 1 117 GLN 117 176 176 GLN GLN B . n B 1 118 VAL 118 177 177 VAL VAL B . n B 1 119 LYS 119 178 178 LYS LYS B . n B 1 120 PHE 120 179 179 PHE PHE B . n B 1 121 VAL 121 180 180 VAL VAL B . n B 1 122 PHE 122 181 181 PHE PHE B . n B 1 123 THR 123 182 182 THR THR B . n B 1 124 PHE 124 183 183 PHE PHE B . n B 1 125 LYS 125 184 184 LYS LYS B . n B 1 126 ASN 126 185 185 ASN ASN B . n B 1 127 ASP 127 186 186 ASP ASP B . n B 1 128 LYS 128 187 187 LYS LYS B . n B 1 129 GLN 129 188 188 GLN GLN B . n B 1 130 ALA 130 189 189 ALA ALA B . n B 1 131 VAL 131 190 190 VAL VAL B . n B 1 132 PHE 132 191 191 PHE PHE B . n B 1 133 LYS 133 192 192 LYS LYS B . n B 1 134 PRO 134 193 193 PRO PRO B . n B 1 135 MSE 135 194 194 MSE MSE B . n B 1 136 ARG 136 195 195 ARG ARG B . n B 1 137 PHE 137 196 196 PHE PHE B . n B 1 138 GLY 138 197 197 GLY GLY B . n B 1 139 ARG 139 198 198 ARG ARG B . n B 1 140 ASP 140 199 199 ASP ASP B . n B 1 141 TYR 141 200 200 TYR TYR B . n B 1 142 GLU 142 201 201 GLU GLU B . n B 1 143 SER 143 202 202 SER SER B . n B 1 144 ASP 144 203 203 ASP ASP B . n B 1 145 PRO 145 204 204 PRO PRO B . n B 1 146 ASN 146 205 205 ASN ASN B . n B 1 147 HIS 147 206 206 HIS HIS B . n B 1 148 PHE 148 207 207 PHE PHE B . n B 1 149 TYR 149 208 208 TYR TYR B . n B 1 150 PHE 150 209 209 PHE PHE B . n B 1 151 SER 151 210 210 SER SER B . n B 1 152 ASP 152 211 211 ASP ASP B . n B 1 153 PHE 153 212 212 PHE PHE B . n B 1 154 GLU 154 213 213 GLU GLU B . n B 1 155 ARG 155 214 214 ARG ARG B . n B 1 156 HIS 156 215 215 HIS HIS B . n B 1 157 HIS 157 216 216 HIS HIS B . n B 1 158 ALA 158 217 217 ALA ALA B . n B 1 159 GLU 159 218 218 GLU GLU B . n B 1 160 ILE 160 219 219 ILE ILE B . n B 1 161 ALA 161 220 220 ALA ALA B . n B 1 162 THR 162 221 221 THR THR B . n B 1 163 PHE 163 222 222 PHE PHE B . n B 1 164 HIS 164 223 223 HIS HIS B . n B 1 165 LEU 165 224 224 LEU LEU B . n B 1 166 ASP 166 225 225 ASP ASP B . n B 1 167 ARG 167 226 226 ARG ARG B . n B 1 168 VAL 168 227 227 VAL VAL B . n B 1 169 LEU 169 228 228 LEU LEU B . n B 1 170 GLY 170 229 229 GLY GLY B . n B 1 171 PHE 171 230 230 PHE PHE B . n B 1 172 ARG 172 231 231 ARG ARG B . n B 1 173 ARG 173 232 232 ARG ARG B . n B 1 174 ALA 174 233 233 ALA ALA B . n B 1 175 ILE 175 234 234 ILE ILE B . n B 1 176 PRO 176 235 235 PRO PRO B . n B 1 177 THR 177 236 236 THR THR B . n B 1 178 VAL 178 237 237 VAL VAL B . n B 1 179 GLY 179 238 238 GLY GLY B . n B 1 180 ARG 180 239 239 ARG ARG B . n B 1 181 VAL 181 240 240 VAL VAL B . n B 1 182 LEU 182 241 241 LEU LEU B . n B 1 183 ASN 183 242 242 ASN ASN B . n B 1 184 MSE 184 243 243 MSE MSE B . n B 1 185 THR 185 244 244 THR THR B . n B 1 186 THR 186 245 245 THR THR B . n B 1 187 GLU 187 246 246 GLU GLU B . n B 1 188 LEU 188 247 247 LEU LEU B . n B 1 189 PHE 189 248 248 PHE PHE B . n B 1 190 GLU 190 249 249 GLU GLU B . n B 1 191 LYS 191 250 250 LYS LYS B . n B 1 192 ALA 192 251 251 ALA ALA B . n B 1 193 GLU 193 252 252 GLU GLU B . n B 1 194 LYS 194 253 253 LYS LYS B . n B 1 195 LYS 195 254 254 LYS LYS B . n B 1 196 LEU 196 255 255 LEU LEU B . n B 1 197 LYS 197 256 256 LYS LYS B . n B 1 198 LYS 198 257 257 LYS LYS B . n B 1 199 THR 199 258 258 THR THR B . n B 1 200 PHE 200 259 259 PHE PHE B . n B 1 201 PHE 201 260 260 PHE PHE B . n B 1 202 PHE 202 261 261 PHE PHE B . n B 1 203 SER 203 262 262 SER SER B . n B 1 204 PRO 204 263 263 PRO PRO B . n B 1 205 ALA 205 264 264 ALA ALA B . n B 1 206 LYS 206 265 265 LYS LYS B . n B 1 207 ASN 207 266 266 ASN ASN B . n B 1 208 PHE 208 267 267 PHE PHE B . n B 1 209 CYS 209 268 268 CYS CYS B . n B 1 210 PHE 210 269 269 PHE PHE B . n B 1 211 VAL 211 270 270 VAL VAL B . n B 1 212 SER 212 271 271 SER SER B . n B 1 213 ARG 213 272 272 ARG ARG B . n B 1 214 CYS 214 273 273 CYS CYS B . n B 1 215 ASP 215 274 274 ASP ASP B . n B 1 216 TYR 216 275 275 TYR TYR B . n B 1 217 TYR 217 276 276 TYR TYR B . n B 1 218 CYS 218 277 277 CYS CYS B . n B 1 219 ASP 219 278 278 ASP ASP B . n B 1 220 THR 220 279 279 THR THR B . n B 1 221 THR 221 280 280 THR THR B . n B 1 222 HIS 222 281 281 HIS HIS B . n B 1 223 ALA 223 282 282 ALA ALA B . n B 1 224 ILE 224 283 283 ILE ILE B . n B 1 225 CYS 225 284 284 CYS CYS B . n B 1 226 GLY 226 285 285 GLY GLY B . n B 1 227 LEU 227 286 286 LEU LEU B . n B 1 228 PRO 228 287 287 PRO PRO B . n B 1 229 ASP 229 288 288 ASP ASP B . n B 1 230 MSE 230 289 289 MSE MSE B . n B 1 231 LYS 231 290 290 LYS LYS B . n B 1 232 GLU 232 291 291 GLU GLU B . n B 1 233 GLY 233 292 292 GLY GLY B . n B 1 234 SER 234 293 293 SER SER B . n B 1 235 VAL 235 294 294 VAL VAL B . n B 1 236 GLN 236 295 295 GLN GLN B . n B 1 237 VAL 237 296 296 VAL VAL B . n B 1 238 PHE 238 297 297 PHE PHE B . n B 1 239 LEU 239 298 298 LEU LEU B . n B 1 240 PRO 240 299 299 PRO PRO B . n B 1 241 ASP 241 300 300 ASP ASP B . n B 1 242 GLU 242 301 301 GLU GLU B . n B 1 243 SER 243 302 302 SER SER B . n B 1 244 ALA 244 303 303 ALA ALA B . n B 1 245 VAL 245 304 304 VAL VAL B . n B 1 246 PRO 246 305 305 PRO PRO B . n B 1 247 ARG 247 306 306 ARG ARG B . n B 1 248 LYS 248 307 307 LYS LYS B . n B 1 249 HIS 249 308 308 HIS HIS B . n B 1 250 ASN 250 309 309 ASN ASN B . n B 1 251 ARG 251 310 310 ARG ARG B . n B 1 252 SER 252 311 311 SER SER B . n B 1 253 PRO 253 312 312 PRO PRO B . n B 1 254 TYR 254 313 313 TYR TYR B . n B 1 255 ARG 255 314 314 ARG ARG B . n B 1 256 ARG 256 315 315 ARG ARG B . n B 1 257 THR 257 316 316 THR THR B . n B 1 258 TYR 258 317 317 TYR TYR B . n B 1 259 SER 259 318 318 SER SER B . n B 1 260 LYS 260 319 319 LYS LYS B . n B 1 261 LYS 261 320 320 LYS LYS B . n B 1 262 ASN 262 321 321 ASN ASN B . n B 1 263 GLN 263 322 322 GLN GLN B . n B 1 264 VAL 264 323 323 VAL VAL B . n B 1 265 ALA 265 324 324 ALA ALA B . n B 1 266 GLU 266 325 325 GLU GLU B . n B 1 267 TRP 267 326 326 TRP TRP B . n B 1 268 GLN 268 327 327 GLN GLN B . n B 1 269 SER 269 328 328 SER SER B . n B 1 270 SER 270 329 329 SER SER B . n B 1 271 MSE 271 330 330 MSE MSE B . n B 1 272 ASN 272 331 331 ASN ASN B . n B 1 273 TYR 273 332 332 TYR TYR B . n B 1 274 CYS 274 333 333 CYS CYS B . n B 1 275 THR 275 334 334 THR THR B . n B 1 276 ASP 276 335 335 ASP ASP B . n B 1 277 LYS 277 336 336 LYS LYS B . n B 1 278 VAL 278 337 337 VAL VAL B . n B 1 279 LYS 279 338 338 LYS LYS B . n B 1 280 THR 280 339 339 THR THR B . n B 1 281 LYS 281 340 340 LYS LYS B . n B 1 282 ARG 282 341 341 ARG ARG B . n B 1 283 GLN 283 342 342 GLN GLN B . n B 1 284 TYR 284 343 343 TYR TYR B . n B 1 285 ALA 285 344 344 ALA ALA B . n B 1 286 HIS 286 345 345 HIS HIS B . n B 1 287 GLY 287 346 346 GLY GLY B . n B 1 288 ARG 288 347 347 ARG ARG B . n B 1 289 ARG 289 348 348 ARG ARG B . n B 1 290 LEU 290 349 349 LEU LEU B . n B 1 291 LEU 291 350 350 LEU LEU B . n B 1 292 ASP 292 351 351 ASP ASP B . n B 1 293 LEU 293 352 352 LEU LEU B . n B 1 294 VAL 294 353 353 VAL VAL B . n B 1 295 ASP 295 354 354 ASP ASP B . n B 1 296 ILE 296 355 355 ILE ILE B . n B 1 297 HIS 297 356 356 HIS HIS B . n B 1 298 ILE 298 357 357 ILE ILE B . n B 1 299 LEU 299 358 358 LEU LEU B . n B 1 300 ASP 300 359 359 ASP ASP B . n B 1 301 TYR 301 360 360 TYR TYR B . n B 1 302 LEU 302 361 361 LEU LEU B . n B 1 303 ILE 303 362 362 ILE ILE B . n B 1 304 GLY 304 363 363 GLY GLY B . n B 1 305 ASN 305 364 364 ASN ASN B . n B 1 306 GLN 306 365 365 GLN GLN B . n B 1 307 ASP 307 366 366 ASP ASP B . n B 1 308 ARG 308 367 367 ARG ARG B . n B 1 309 HIS 309 368 368 HIS HIS B . n B 1 310 HIS 310 369 369 HIS HIS B . n B 1 311 PHE 311 370 370 PHE PHE B . n B 1 312 GLU 312 371 371 GLU GLU B . n B 1 313 SER 313 372 372 SER SER B . n B 1 314 PHE 314 373 373 PHE PHE B . n B 1 315 ASN 315 374 374 ASN ASN B . n B 1 316 VAL 316 375 375 VAL VAL B . n B 1 317 PHE 317 376 376 PHE PHE B . n B 1 318 ASN 318 377 377 ASN ASN B . n B 1 319 ASP 319 378 378 ASP ASP B . n B 1 320 LEU 320 379 379 LEU LEU B . n B 1 321 PRO 321 380 380 PRO PRO B . n B 1 322 SER 322 381 381 SER SER B . n B 1 323 TYR 323 382 382 TYR TYR B . n B 1 324 ALA 324 383 383 ALA ALA B . n B 1 325 ILE 325 384 384 ILE ILE B . n B 1 326 HIS 326 385 385 HIS HIS B . n B 1 327 LEU 327 386 386 LEU LEU B . n B 1 328 ASP 328 387 387 ASP ASP B . n B 1 329 HIS 329 388 388 HIS HIS B . n B 1 330 GLY 330 389 389 GLY GLY B . n B 1 331 ARG 331 390 390 ARG ARG B . n B 1 332 ALA 332 391 391 ALA ALA B . n B 1 333 PHE 333 392 392 PHE PHE B . n B 1 334 GLY 334 393 393 GLY GLY B . n B 1 335 ARG 335 394 394 ARG ARG B . n B 1 336 SER 336 395 395 SER SER B . n B 1 337 ASP 337 396 396 ASP ASP B . n B 1 338 PHE 338 397 397 PHE PHE B . n B 1 339 ASP 339 398 398 ASP ASP B . n B 1 340 ASP 340 399 399 ASP ASP B . n B 1 341 ASP 341 400 400 ASP ASP B . n B 1 342 ASP 342 401 401 ASP ASP B . n B 1 343 ILE 343 402 402 ILE ILE B . n B 1 344 ILE 344 403 403 ILE ILE B . n B 1 345 LEU 345 404 404 LEU LEU B . n B 1 346 PRO 346 405 405 PRO PRO B . n B 1 347 LEU 347 406 406 LEU LEU B . n B 1 348 ARG 348 407 407 ARG ARG B . n B 1 349 GLN 349 408 408 GLN GLN B . n B 1 350 CYS 350 409 409 CYS CYS B . n B 1 351 CYS 351 410 410 CYS CYS B . n B 1 352 ILE 352 411 411 ILE ILE B . n B 1 353 LEU 353 412 412 LEU LEU B . n B 1 354 ARG 354 413 413 ARG ARG B . n B 1 355 PRO 355 414 414 PRO PRO B . n B 1 356 SER 356 415 415 SER SER B . n B 1 357 THR 357 416 416 THR THR B . n B 1 358 PHE 358 417 417 PHE PHE B . n B 1 359 GLN 359 418 418 GLN GLN B . n B 1 360 THR 360 419 419 THR THR B . n B 1 361 LEU 361 420 420 LEU LEU B . n B 1 362 MSE 362 421 421 MSE MSE B . n B 1 363 ASN 363 422 422 ASN ASN B . n B 1 364 PHE 364 423 423 PHE PHE B . n B 1 365 TYR 365 424 424 TYR TYR B . n B 1 366 SER 366 425 425 SER SER B . n B 1 367 THR 367 426 426 THR THR B . n B 1 368 PRO 368 427 427 PRO PRO B . n B 1 369 LYS 369 428 428 LYS LYS B . n B 1 370 SER 370 429 429 SER SER B . n B 1 371 LEU 371 430 430 LEU LEU B . n B 1 372 THR 372 431 431 THR THR B . n B 1 373 LYS 373 432 432 LYS LYS B . n B 1 374 ALA 374 433 433 ALA ALA B . n B 1 375 LEU 375 434 434 LEU LEU B . n B 1 376 HIS 376 435 435 HIS HIS B . n B 1 377 GLU 377 436 436 GLU GLU B . n B 1 378 SER 378 437 437 SER SER B . n B 1 379 LEU 379 438 438 LEU LEU B . n B 1 380 SER 380 439 439 SER SER B . n B 1 381 LYS 381 440 440 LYS LYS B . n B 1 382 ASP 382 441 441 ASP ASP B . n B 1 383 PRO 383 442 442 PRO PRO B . n B 1 384 ALA 384 443 443 ALA ALA B . n B 1 385 HIS 385 444 444 HIS HIS B . n B 1 386 PRO 386 445 445 PRO PRO B . n B 1 387 ILE 387 446 446 ILE ILE B . n B 1 388 LEU 388 447 447 LEU LEU B . n B 1 389 ALA 389 448 448 ALA ALA B . n B 1 390 TYR 390 449 449 TYR TYR B . n B 1 391 LYS 391 450 450 LYS LYS B . n B 1 392 HIS 392 451 451 HIS HIS B . n B 1 393 TYR 393 452 452 TYR TYR B . n B 1 394 PRO 394 453 453 PRO PRO B . n B 1 395 ALA 395 454 454 ALA ALA B . n B 1 396 MSE 396 455 455 MSE MSE B . n B 1 397 GLU 397 456 456 GLU GLU B . n B 1 398 ARG 398 457 457 ARG ARG B . n B 1 399 ARG 399 458 458 ARG ARG B . n B 1 400 LEU 400 459 459 LEU LEU B . n B 1 401 ALA 401 460 460 ALA ALA B . n B 1 402 LYS 402 461 461 LYS LYS B . n B 1 403 ILE 403 462 462 ILE ILE B . n B 1 404 MSE 404 463 463 MSE MSE B . n B 1 405 SER 405 464 464 SER SER B . n B 1 406 HIS 406 465 465 HIS HIS B . n B 1 407 ILE 407 466 466 ILE ILE B . n B 1 408 LEU 408 467 467 LEU LEU B . n B 1 409 GLU 409 468 468 GLU GLU B . n B 1 410 CYS 410 469 469 CYS CYS B . n B 1 411 PHE 411 470 470 PHE PHE B . n B 1 412 GLU 412 471 471 GLU GLU B . n B 1 413 SER 413 472 472 SER SER B . n B 1 414 ARG 414 473 473 ARG ARG B . n B 1 415 GLY 415 474 474 GLY GLY B . n B 1 416 VAL 416 475 475 VAL VAL B . n B 1 417 ALA 417 476 476 ALA ALA B . n B 1 418 GLU 418 477 477 GLU GLU B . n B 1 419 VAL 419 478 478 VAL VAL B . n B 1 420 LEU 420 479 479 LEU LEU B . n B 1 421 VAL 421 480 480 VAL VAL B . n B 1 422 ALA 422 481 481 ALA ALA B . n B 1 423 GLU 423 482 482 GLU GLU B . n B 1 424 TYR 424 483 483 TYR TYR B . n B 1 425 ASN 425 484 484 ASN ASN B . n B 1 426 ASN 426 485 485 ASN ASN B . n B 1 427 PRO 427 486 486 PRO PRO B . n B 1 428 ASP 428 487 487 ASP ASP B . n B 1 429 VAL 429 488 ? ? ? B . n B 1 430 SER 430 489 ? ? ? B . n B 1 431 ASP 431 490 ? ? ? B . n B 1 432 ALA 432 491 ? ? ? B . n B 1 433 GLU 433 492 ? ? ? B . n B 1 434 GLN 434 493 ? ? ? B . n B 1 435 ASN 435 494 ? ? ? B . n B 1 436 ASP 436 495 ? ? ? B . n B 1 437 GLU 437 496 ? ? ? B . n B 1 438 GLU 438 497 ? ? ? B . n B 1 439 GLN 439 498 ? ? ? B . n B 1 440 SER 440 499 ? ? ? B . n B 1 441 GLU 441 500 ? ? ? B . n B 1 442 GLU 442 501 ? ? ? B . n B 1 443 HIS 443 502 ? ? ? B . n B 1 444 GLN 444 503 ? ? ? B . n B 1 445 ASP 445 504 ? ? ? B . n B 1 446 LYS 446 505 ? ? ? B . n B 1 447 LYS 447 506 ? ? ? B . n B 1 448 ASP 448 507 ? ? ? B . n B 1 449 ASP 449 508 ? ? ? B . n B 1 450 LYS 450 509 ? ? ? B . n B 1 451 LYS 451 510 ? ? ? B . n B 1 452 THR 452 511 ? ? ? B . n B 1 453 VAL 453 512 ? ? ? B . n C 1 1 SER 1 60 ? ? ? C . n C 1 2 LEU 2 61 ? ? ? C . n C 1 3 PRO 3 62 62 PRO PRO C . n C 1 4 HIS 4 63 63 HIS HIS C . n C 1 5 GLN 5 64 64 GLN GLN C . n C 1 6 PRO 6 65 65 PRO PRO C . n C 1 7 ILE 7 66 66 ILE ILE C . n C 1 8 PRO 8 67 67 PRO PRO C . n C 1 9 PRO 9 68 68 PRO PRO C . n C 1 10 SER 10 69 69 SER SER C . n C 1 11 LEU 11 70 70 LEU LEU C . n C 1 12 GLY 12 71 71 GLY GLY C . n C 1 13 GLU 13 72 72 GLU GLU C . n C 1 14 LYS 14 73 73 LYS LYS C . n C 1 15 ASP 15 74 74 ASP ASP C . n C 1 16 LEU 16 75 75 LEU LEU C . n C 1 17 SER 17 76 76 SER SER C . n C 1 18 ASP 18 77 77 ASP ASP C . n C 1 19 PRO 19 78 78 PRO PRO C . n C 1 20 PHE 20 79 79 PHE PHE C . n C 1 21 ASN 21 80 80 ASN ASN C . n C 1 22 PHE 22 81 81 PHE PHE C . n C 1 23 LEU 23 82 82 LEU LEU C . n C 1 24 PHE 24 83 83 PHE PHE C . n C 1 25 SER 25 84 84 SER SER C . n C 1 26 SER 26 85 85 SER SER C . n C 1 27 ASN 27 86 86 ASN ASN C . n C 1 28 LYS 28 87 87 LYS LYS C . n C 1 29 ILE 29 88 88 ILE ILE C . n C 1 30 THR 30 89 89 THR THR C . n C 1 31 LEU 31 90 90 LEU LEU C . n C 1 32 ARG 32 91 91 ARG ARG C . n C 1 33 LYS 33 92 92 LYS LYS C . n C 1 34 LEU 34 93 93 LEU LEU C . n C 1 35 TYR 35 94 94 TYR TYR C . n C 1 36 ASP 36 95 95 ASP ASP C . n C 1 37 LEU 37 96 96 LEU LEU C . n C 1 38 THR 38 97 97 THR THR C . n C 1 39 LYS 39 98 98 LYS LYS C . n C 1 40 ASN 40 99 99 ASN ASN C . n C 1 41 VAL 41 100 100 VAL VAL C . n C 1 42 ASP 42 101 101 ASP ASP C . n C 1 43 PHE 43 102 102 PHE PHE C . n C 1 44 ASP 44 103 103 ASP ASP C . n C 1 45 GLN 45 104 104 GLN GLN C . n C 1 46 LEU 46 105 105 LEU LEU C . n C 1 47 ARG 47 106 106 ARG ARG C . n C 1 48 GLN 48 107 107 GLN GLN C . n C 1 49 ASN 49 108 108 ASN ASN C . n C 1 50 GLU 50 109 109 GLU GLU C . n C 1 51 CYS 51 110 110 CYS CYS C . n C 1 52 LYS 52 111 111 LYS LYS C . n C 1 53 LYS 53 112 112 LYS LYS C . n C 1 54 ASN 54 113 113 ASN ASN C . n C 1 55 ILE 55 114 114 ILE ILE C . n C 1 56 THR 56 115 115 THR THR C . n C 1 57 LEU 57 116 116 LEU LEU C . n C 1 58 SER 58 117 117 SER SER C . n C 1 59 LYS 59 118 118 LYS LYS C . n C 1 60 PHE 60 119 119 PHE PHE C . n C 1 61 TRP 61 120 120 TRP TRP C . n C 1 62 GLU 62 121 ? ? ? C . n C 1 63 LYS 63 122 ? ? ? C . n C 1 64 SER 64 123 ? ? ? C . n C 1 65 GLU 65 124 ? ? ? C . n C 1 66 GLN 66 125 ? ? ? C . n C 1 67 ARG 67 126 ? ? ? C . n C 1 68 ASN 68 127 ? ? ? C . n C 1 69 VAL 69 128 ? ? ? C . n C 1 70 PRO 70 129 ? ? ? C . n C 1 71 GLU 71 130 130 GLU GLU C . n C 1 72 ASP 72 131 131 ASP ASP C . n C 1 73 ASP 73 132 132 ASP ASP C . n C 1 74 ASN 74 133 133 ASN ASN C . n C 1 75 TRP 75 134 134 TRP TRP C . n C 1 76 GLU 76 135 135 GLU GLU C . n C 1 77 ARG 77 136 136 ARG ARG C . n C 1 78 PHE 78 137 137 PHE PHE C . n C 1 79 TYR 79 138 138 TYR TYR C . n C 1 80 SER 80 139 139 SER SER C . n C 1 81 ASN 81 140 140 ASN ASN C . n C 1 82 ILE 82 141 141 ILE ILE C . n C 1 83 GLY 83 142 142 GLY GLY C . n C 1 84 SER 84 143 143 SER SER C . n C 1 85 CYS 85 144 144 CYS CYS C . n C 1 86 SER 86 145 145 SER SER C . n C 1 87 VAL 87 146 146 VAL VAL C . n C 1 88 TYR 88 147 147 TYR TYR C . n C 1 89 SER 89 148 148 SER SER C . n C 1 90 ASP 90 149 149 ASP ASP C . n C 1 91 ASP 91 150 150 ASP ASP C . n C 1 92 GLN 92 151 151 GLN GLN C . n C 1 93 MSE 93 152 152 MSE MSE C . n C 1 94 ILE 94 153 153 ILE ILE C . n C 1 95 ASP 95 154 154 ASP ASP C . n C 1 96 ASN 96 155 155 ASN ASN C . n C 1 97 LEU 97 156 156 LEU LEU C . n C 1 98 LEU 98 157 157 LEU LEU C . n C 1 99 HIS 99 158 158 HIS HIS C . n C 1 100 ASP 100 159 159 ASP ASP C . n C 1 101 LEU 101 160 160 LEU LEU C . n C 1 102 ASN 102 161 161 ASN ASN C . n C 1 103 THR 103 162 162 THR THR C . n C 1 104 SER 104 163 163 SER SER C . n C 1 105 PRO 105 164 164 PRO PRO C . n C 1 106 ILE 106 165 165 ILE ILE C . n C 1 107 LYS 107 166 166 LYS LYS C . n C 1 108 HIS 108 167 167 HIS HIS C . n C 1 109 VAL 109 168 168 VAL VAL C . n C 1 110 HIS 110 169 169 HIS HIS C . n C 1 111 ILE 111 170 170 ILE ILE C . n C 1 112 MSE 112 171 171 MSE MSE C . n C 1 113 ASP 113 172 172 ASP ASP C . n C 1 114 GLY 114 173 173 GLY GLY C . n C 1 115 GLY 115 174 174 GLY GLY C . n C 1 116 THR 116 175 175 THR THR C . n C 1 117 GLN 117 176 176 GLN GLN C . n C 1 118 VAL 118 177 177 VAL VAL C . n C 1 119 LYS 119 178 178 LYS LYS C . n C 1 120 PHE 120 179 179 PHE PHE C . n C 1 121 VAL 121 180 180 VAL VAL C . n C 1 122 PHE 122 181 181 PHE PHE C . n C 1 123 THR 123 182 182 THR THR C . n C 1 124 PHE 124 183 183 PHE PHE C . n C 1 125 LYS 125 184 184 LYS LYS C . n C 1 126 ASN 126 185 185 ASN ASN C . n C 1 127 ASP 127 186 186 ASP ASP C . n C 1 128 LYS 128 187 187 LYS LYS C . n C 1 129 GLN 129 188 188 GLN GLN C . n C 1 130 ALA 130 189 189 ALA ALA C . n C 1 131 VAL 131 190 190 VAL VAL C . n C 1 132 PHE 132 191 191 PHE PHE C . n C 1 133 LYS 133 192 192 LYS LYS C . n C 1 134 PRO 134 193 193 PRO PRO C . n C 1 135 MSE 135 194 194 MSE MSE C . n C 1 136 ARG 136 195 195 ARG ARG C . n C 1 137 PHE 137 196 196 PHE PHE C . n C 1 138 GLY 138 197 197 GLY GLY C . n C 1 139 ARG 139 198 198 ARG ARG C . n C 1 140 ASP 140 199 199 ASP ASP C . n C 1 141 TYR 141 200 200 TYR TYR C . n C 1 142 GLU 142 201 201 GLU GLU C . n C 1 143 SER 143 202 202 SER SER C . n C 1 144 ASP 144 203 203 ASP ASP C . n C 1 145 PRO 145 204 204 PRO PRO C . n C 1 146 ASN 146 205 205 ASN ASN C . n C 1 147 HIS 147 206 206 HIS HIS C . n C 1 148 PHE 148 207 207 PHE PHE C . n C 1 149 TYR 149 208 208 TYR TYR C . n C 1 150 PHE 150 209 209 PHE PHE C . n C 1 151 SER 151 210 210 SER SER C . n C 1 152 ASP 152 211 211 ASP ASP C . n C 1 153 PHE 153 212 212 PHE PHE C . n C 1 154 GLU 154 213 213 GLU GLU C . n C 1 155 ARG 155 214 214 ARG ARG C . n C 1 156 HIS 156 215 215 HIS HIS C . n C 1 157 HIS 157 216 216 HIS HIS C . n C 1 158 ALA 158 217 217 ALA ALA C . n C 1 159 GLU 159 218 218 GLU GLU C . n C 1 160 ILE 160 219 219 ILE ILE C . n C 1 161 ALA 161 220 220 ALA ALA C . n C 1 162 THR 162 221 221 THR THR C . n C 1 163 PHE 163 222 222 PHE PHE C . n C 1 164 HIS 164 223 223 HIS HIS C . n C 1 165 LEU 165 224 224 LEU LEU C . n C 1 166 ASP 166 225 225 ASP ASP C . n C 1 167 ARG 167 226 226 ARG ARG C . n C 1 168 VAL 168 227 227 VAL VAL C . n C 1 169 LEU 169 228 228 LEU LEU C . n C 1 170 GLY 170 229 229 GLY GLY C . n C 1 171 PHE 171 230 230 PHE PHE C . n C 1 172 ARG 172 231 231 ARG ARG C . n C 1 173 ARG 173 232 232 ARG ARG C . n C 1 174 ALA 174 233 233 ALA ALA C . n C 1 175 ILE 175 234 234 ILE ILE C . n C 1 176 PRO 176 235 235 PRO PRO C . n C 1 177 THR 177 236 236 THR THR C . n C 1 178 VAL 178 237 237 VAL VAL C . n C 1 179 GLY 179 238 238 GLY GLY C . n C 1 180 ARG 180 239 239 ARG ARG C . n C 1 181 VAL 181 240 240 VAL VAL C . n C 1 182 LEU 182 241 241 LEU LEU C . n C 1 183 ASN 183 242 242 ASN ASN C . n C 1 184 MSE 184 243 243 MSE MSE C . n C 1 185 THR 185 244 244 THR THR C . n C 1 186 THR 186 245 245 THR THR C . n C 1 187 GLU 187 246 246 GLU GLU C . n C 1 188 LEU 188 247 247 LEU LEU C . n C 1 189 PHE 189 248 248 PHE PHE C . n C 1 190 GLU 190 249 249 GLU GLU C . n C 1 191 LYS 191 250 250 LYS LYS C . n C 1 192 ALA 192 251 251 ALA ALA C . n C 1 193 GLU 193 252 252 GLU GLU C . n C 1 194 LYS 194 253 253 LYS LYS C . n C 1 195 LYS 195 254 254 LYS LYS C . n C 1 196 LEU 196 255 255 LEU LEU C . n C 1 197 LYS 197 256 256 LYS LYS C . n C 1 198 LYS 198 257 257 LYS LYS C . n C 1 199 THR 199 258 258 THR THR C . n C 1 200 PHE 200 259 259 PHE PHE C . n C 1 201 PHE 201 260 260 PHE PHE C . n C 1 202 PHE 202 261 261 PHE PHE C . n C 1 203 SER 203 262 262 SER SER C . n C 1 204 PRO 204 263 263 PRO PRO C . n C 1 205 ALA 205 264 264 ALA ALA C . n C 1 206 LYS 206 265 265 LYS LYS C . n C 1 207 ASN 207 266 266 ASN ASN C . n C 1 208 PHE 208 267 267 PHE PHE C . n C 1 209 CYS 209 268 268 CYS CYS C . n C 1 210 PHE 210 269 269 PHE PHE C . n C 1 211 VAL 211 270 270 VAL VAL C . n C 1 212 SER 212 271 271 SER SER C . n C 1 213 ARG 213 272 272 ARG ARG C . n C 1 214 CYS 214 273 273 CYS CYS C . n C 1 215 ASP 215 274 274 ASP ASP C . n C 1 216 TYR 216 275 275 TYR TYR C . n C 1 217 TYR 217 276 276 TYR TYR C . n C 1 218 CYS 218 277 277 CYS CYS C . n C 1 219 ASP 219 278 278 ASP ASP C . n C 1 220 THR 220 279 279 THR THR C . n C 1 221 THR 221 280 280 THR THR C . n C 1 222 HIS 222 281 281 HIS HIS C . n C 1 223 ALA 223 282 282 ALA ALA C . n C 1 224 ILE 224 283 283 ILE ILE C . n C 1 225 CYS 225 284 284 CYS CYS C . n C 1 226 GLY 226 285 285 GLY GLY C . n C 1 227 LEU 227 286 286 LEU LEU C . n C 1 228 PRO 228 287 287 PRO PRO C . n C 1 229 ASP 229 288 288 ASP ASP C . n C 1 230 MSE 230 289 289 MSE MSE C . n C 1 231 LYS 231 290 290 LYS LYS C . n C 1 232 GLU 232 291 291 GLU GLU C . n C 1 233 GLY 233 292 292 GLY GLY C . n C 1 234 SER 234 293 293 SER SER C . n C 1 235 VAL 235 294 294 VAL VAL C . n C 1 236 GLN 236 295 295 GLN GLN C . n C 1 237 VAL 237 296 296 VAL VAL C . n C 1 238 PHE 238 297 297 PHE PHE C . n C 1 239 LEU 239 298 298 LEU LEU C . n C 1 240 PRO 240 299 299 PRO PRO C . n C 1 241 ASP 241 300 300 ASP ASP C . n C 1 242 GLU 242 301 301 GLU GLU C . n C 1 243 SER 243 302 302 SER SER C . n C 1 244 ALA 244 303 303 ALA ALA C . n C 1 245 VAL 245 304 304 VAL VAL C . n C 1 246 PRO 246 305 305 PRO PRO C . n C 1 247 ARG 247 306 306 ARG ARG C . n C 1 248 LYS 248 307 307 LYS LYS C . n C 1 249 HIS 249 308 308 HIS HIS C . n C 1 250 ASN 250 309 309 ASN ASN C . n C 1 251 ARG 251 310 310 ARG ARG C . n C 1 252 SER 252 311 311 SER SER C . n C 1 253 PRO 253 312 312 PRO PRO C . n C 1 254 TYR 254 313 313 TYR TYR C . n C 1 255 ARG 255 314 314 ARG ARG C . n C 1 256 ARG 256 315 315 ARG ARG C . n C 1 257 THR 257 316 316 THR THR C . n C 1 258 TYR 258 317 317 TYR TYR C . n C 1 259 SER 259 318 318 SER SER C . n C 1 260 LYS 260 319 319 LYS LYS C . n C 1 261 LYS 261 320 320 LYS LYS C . n C 1 262 ASN 262 321 321 ASN ASN C . n C 1 263 GLN 263 322 322 GLN GLN C . n C 1 264 VAL 264 323 323 VAL VAL C . n C 1 265 ALA 265 324 324 ALA ALA C . n C 1 266 GLU 266 325 325 GLU GLU C . n C 1 267 TRP 267 326 326 TRP TRP C . n C 1 268 GLN 268 327 327 GLN GLN C . n C 1 269 SER 269 328 328 SER SER C . n C 1 270 SER 270 329 329 SER SER C . n C 1 271 MSE 271 330 330 MSE MSE C . n C 1 272 ASN 272 331 331 ASN ASN C . n C 1 273 TYR 273 332 332 TYR TYR C . n C 1 274 CYS 274 333 333 CYS CYS C . n C 1 275 THR 275 334 334 THR THR C . n C 1 276 ASP 276 335 335 ASP ASP C . n C 1 277 LYS 277 336 336 LYS LYS C . n C 1 278 VAL 278 337 337 VAL VAL C . n C 1 279 LYS 279 338 338 LYS LYS C . n C 1 280 THR 280 339 339 THR THR C . n C 1 281 LYS 281 340 340 LYS LYS C . n C 1 282 ARG 282 341 341 ARG ARG C . n C 1 283 GLN 283 342 342 GLN GLN C . n C 1 284 TYR 284 343 343 TYR TYR C . n C 1 285 ALA 285 344 344 ALA ALA C . n C 1 286 HIS 286 345 345 HIS HIS C . n C 1 287 GLY 287 346 346 GLY GLY C . n C 1 288 ARG 288 347 347 ARG ARG C . n C 1 289 ARG 289 348 348 ARG ARG C . n C 1 290 LEU 290 349 349 LEU LEU C . n C 1 291 LEU 291 350 350 LEU LEU C . n C 1 292 ASP 292 351 351 ASP ASP C . n C 1 293 LEU 293 352 352 LEU LEU C . n C 1 294 VAL 294 353 353 VAL VAL C . n C 1 295 ASP 295 354 354 ASP ASP C . n C 1 296 ILE 296 355 355 ILE ILE C . n C 1 297 HIS 297 356 356 HIS HIS C . n C 1 298 ILE 298 357 357 ILE ILE C . n C 1 299 LEU 299 358 358 LEU LEU C . n C 1 300 ASP 300 359 359 ASP ASP C . n C 1 301 TYR 301 360 360 TYR TYR C . n C 1 302 LEU 302 361 361 LEU LEU C . n C 1 303 ILE 303 362 362 ILE ILE C . n C 1 304 GLY 304 363 363 GLY GLY C . n C 1 305 ASN 305 364 364 ASN ASN C . n C 1 306 GLN 306 365 365 GLN GLN C . n C 1 307 ASP 307 366 366 ASP ASP C . n C 1 308 ARG 308 367 367 ARG ARG C . n C 1 309 HIS 309 368 368 HIS HIS C . n C 1 310 HIS 310 369 369 HIS HIS C . n C 1 311 PHE 311 370 370 PHE PHE C . n C 1 312 GLU 312 371 371 GLU GLU C . n C 1 313 SER 313 372 372 SER SER C . n C 1 314 PHE 314 373 373 PHE PHE C . n C 1 315 ASN 315 374 374 ASN ASN C . n C 1 316 VAL 316 375 375 VAL VAL C . n C 1 317 PHE 317 376 376 PHE PHE C . n C 1 318 ASN 318 377 377 ASN ASN C . n C 1 319 ASP 319 378 378 ASP ASP C . n C 1 320 LEU 320 379 379 LEU LEU C . n C 1 321 PRO 321 380 380 PRO PRO C . n C 1 322 SER 322 381 381 SER SER C . n C 1 323 TYR 323 382 382 TYR TYR C . n C 1 324 ALA 324 383 383 ALA ALA C . n C 1 325 ILE 325 384 384 ILE ILE C . n C 1 326 HIS 326 385 385 HIS HIS C . n C 1 327 LEU 327 386 386 LEU LEU C . n C 1 328 ASP 328 387 387 ASP ASP C . n C 1 329 HIS 329 388 388 HIS HIS C . n C 1 330 GLY 330 389 389 GLY GLY C . n C 1 331 ARG 331 390 390 ARG ARG C . n C 1 332 ALA 332 391 391 ALA ALA C . n C 1 333 PHE 333 392 392 PHE PHE C . n C 1 334 GLY 334 393 393 GLY GLY C . n C 1 335 ARG 335 394 394 ARG ARG C . n C 1 336 SER 336 395 395 SER SER C . n C 1 337 ASP 337 396 396 ASP ASP C . n C 1 338 PHE 338 397 397 PHE PHE C . n C 1 339 ASP 339 398 398 ASP ASP C . n C 1 340 ASP 340 399 399 ASP ASP C . n C 1 341 ASP 341 400 400 ASP ASP C . n C 1 342 ASP 342 401 401 ASP ASP C . n C 1 343 ILE 343 402 402 ILE ILE C . n C 1 344 ILE 344 403 403 ILE ILE C . n C 1 345 LEU 345 404 404 LEU LEU C . n C 1 346 PRO 346 405 405 PRO PRO C . n C 1 347 LEU 347 406 406 LEU LEU C . n C 1 348 ARG 348 407 407 ARG ARG C . n C 1 349 GLN 349 408 408 GLN GLN C . n C 1 350 CYS 350 409 409 CYS CYS C . n C 1 351 CYS 351 410 410 CYS CYS C . n C 1 352 ILE 352 411 411 ILE ILE C . n C 1 353 LEU 353 412 412 LEU LEU C . n C 1 354 ARG 354 413 413 ARG ARG C . n C 1 355 PRO 355 414 414 PRO PRO C . n C 1 356 SER 356 415 415 SER SER C . n C 1 357 THR 357 416 416 THR THR C . n C 1 358 PHE 358 417 417 PHE PHE C . n C 1 359 GLN 359 418 418 GLN GLN C . n C 1 360 THR 360 419 419 THR THR C . n C 1 361 LEU 361 420 420 LEU LEU C . n C 1 362 MSE 362 421 421 MSE MSE C . n C 1 363 ASN 363 422 422 ASN ASN C . n C 1 364 PHE 364 423 423 PHE PHE C . n C 1 365 TYR 365 424 424 TYR TYR C . n C 1 366 SER 366 425 425 SER SER C . n C 1 367 THR 367 426 426 THR THR C . n C 1 368 PRO 368 427 427 PRO PRO C . n C 1 369 LYS 369 428 428 LYS LYS C . n C 1 370 SER 370 429 429 SER SER C . n C 1 371 LEU 371 430 430 LEU LEU C . n C 1 372 THR 372 431 431 THR THR C . n C 1 373 LYS 373 432 432 LYS LYS C . n C 1 374 ALA 374 433 433 ALA ALA C . n C 1 375 LEU 375 434 434 LEU LEU C . n C 1 376 HIS 376 435 435 HIS HIS C . n C 1 377 GLU 377 436 436 GLU GLU C . n C 1 378 SER 378 437 437 SER SER C . n C 1 379 LEU 379 438 438 LEU LEU C . n C 1 380 SER 380 439 439 SER SER C . n C 1 381 LYS 381 440 440 LYS LYS C . n C 1 382 ASP 382 441 441 ASP ASP C . n C 1 383 PRO 383 442 442 PRO PRO C . n C 1 384 ALA 384 443 443 ALA ALA C . n C 1 385 HIS 385 444 444 HIS HIS C . n C 1 386 PRO 386 445 445 PRO PRO C . n C 1 387 ILE 387 446 446 ILE ILE C . n C 1 388 LEU 388 447 447 LEU LEU C . n C 1 389 ALA 389 448 448 ALA ALA C . n C 1 390 TYR 390 449 449 TYR TYR C . n C 1 391 LYS 391 450 450 LYS LYS C . n C 1 392 HIS 392 451 451 HIS HIS C . n C 1 393 TYR 393 452 452 TYR TYR C . n C 1 394 PRO 394 453 453 PRO PRO C . n C 1 395 ALA 395 454 454 ALA ALA C . n C 1 396 MSE 396 455 455 MSE MSE C . n C 1 397 GLU 397 456 456 GLU GLU C . n C 1 398 ARG 398 457 457 ARG ARG C . n C 1 399 ARG 399 458 458 ARG ARG C . n C 1 400 LEU 400 459 459 LEU LEU C . n C 1 401 ALA 401 460 460 ALA ALA C . n C 1 402 LYS 402 461 461 LYS LYS C . n C 1 403 ILE 403 462 462 ILE ILE C . n C 1 404 MSE 404 463 463 MSE MSE C . n C 1 405 SER 405 464 464 SER SER C . n C 1 406 HIS 406 465 465 HIS HIS C . n C 1 407 ILE 407 466 466 ILE ILE C . n C 1 408 LEU 408 467 467 LEU LEU C . n C 1 409 GLU 409 468 468 GLU GLU C . n C 1 410 CYS 410 469 469 CYS CYS C . n C 1 411 PHE 411 470 470 PHE PHE C . n C 1 412 GLU 412 471 471 GLU GLU C . n C 1 413 SER 413 472 472 SER SER C . n C 1 414 ARG 414 473 473 ARG ARG C . n C 1 415 GLY 415 474 474 GLY GLY C . n C 1 416 VAL 416 475 475 VAL VAL C . n C 1 417 ALA 417 476 476 ALA ALA C . n C 1 418 GLU 418 477 477 GLU GLU C . n C 1 419 VAL 419 478 478 VAL VAL C . n C 1 420 LEU 420 479 479 LEU LEU C . n C 1 421 VAL 421 480 480 VAL VAL C . n C 1 422 ALA 422 481 481 ALA ALA C . n C 1 423 GLU 423 482 482 GLU GLU C . n C 1 424 TYR 424 483 483 TYR TYR C . n C 1 425 ASN 425 484 484 ASN ASN C . n C 1 426 ASN 426 485 485 ASN ASN C . n C 1 427 PRO 427 486 486 PRO PRO C . n C 1 428 ASP 428 487 487 ASP ASP C . n C 1 429 VAL 429 488 488 VAL VAL C . n C 1 430 SER 430 489 489 SER SER C . n C 1 431 ASP 431 490 ? ? ? C . n C 1 432 ALA 432 491 ? ? ? C . n C 1 433 GLU 433 492 ? ? ? C . n C 1 434 GLN 434 493 ? ? ? C . n C 1 435 ASN 435 494 ? ? ? C . n C 1 436 ASP 436 495 ? ? ? C . n C 1 437 GLU 437 496 ? ? ? C . n C 1 438 GLU 438 497 ? ? ? C . n C 1 439 GLN 439 498 ? ? ? C . n C 1 440 SER 440 499 ? ? ? C . n C 1 441 GLU 441 500 ? ? ? C . n C 1 442 GLU 442 501 ? ? ? C . n C 1 443 HIS 443 502 ? ? ? C . n C 1 444 GLN 444 503 ? ? ? C . n C 1 445 ASP 445 504 ? ? ? C . n C 1 446 LYS 446 505 ? ? ? C . n C 1 447 LYS 447 506 ? ? ? C . n C 1 448 ASP 448 507 ? ? ? C . n C 1 449 ASP 449 508 ? ? ? C . n C 1 450 LYS 450 509 ? ? ? C . n C 1 451 LYS 451 510 ? ? ? C . n C 1 452 THR 452 511 ? ? ? C . n C 1 453 VAL 453 512 ? ? ? C . n D 1 1 SER 1 60 ? ? ? D . n D 1 2 LEU 2 61 61 LEU LEU D . n D 1 3 PRO 3 62 62 PRO PRO D . n D 1 4 HIS 4 63 63 HIS HIS D . n D 1 5 GLN 5 64 64 GLN GLN D . n D 1 6 PRO 6 65 65 PRO PRO D . n D 1 7 ILE 7 66 66 ILE ILE D . n D 1 8 PRO 8 67 67 PRO PRO D . n D 1 9 PRO 9 68 68 PRO PRO D . n D 1 10 SER 10 69 69 SER SER D . n D 1 11 LEU 11 70 70 LEU LEU D . n D 1 12 GLY 12 71 71 GLY GLY D . n D 1 13 GLU 13 72 72 GLU GLU D . n D 1 14 LYS 14 73 73 LYS LYS D . n D 1 15 ASP 15 74 74 ASP ASP D . n D 1 16 LEU 16 75 75 LEU LEU D . n D 1 17 SER 17 76 76 SER SER D . n D 1 18 ASP 18 77 77 ASP ASP D . n D 1 19 PRO 19 78 78 PRO PRO D . n D 1 20 PHE 20 79 79 PHE PHE D . n D 1 21 ASN 21 80 80 ASN ASN D . n D 1 22 PHE 22 81 81 PHE PHE D . n D 1 23 LEU 23 82 82 LEU LEU D . n D 1 24 PHE 24 83 83 PHE PHE D . n D 1 25 SER 25 84 84 SER SER D . n D 1 26 SER 26 85 85 SER SER D . n D 1 27 ASN 27 86 86 ASN ASN D . n D 1 28 LYS 28 87 87 LYS LYS D . n D 1 29 ILE 29 88 88 ILE ILE D . n D 1 30 THR 30 89 89 THR THR D . n D 1 31 LEU 31 90 90 LEU LEU D . n D 1 32 ARG 32 91 91 ARG ARG D . n D 1 33 LYS 33 92 92 LYS LYS D . n D 1 34 LEU 34 93 93 LEU LEU D . n D 1 35 TYR 35 94 94 TYR TYR D . n D 1 36 ASP 36 95 95 ASP ASP D . n D 1 37 LEU 37 96 96 LEU LEU D . n D 1 38 THR 38 97 97 THR THR D . n D 1 39 LYS 39 98 98 LYS LYS D . n D 1 40 ASN 40 99 99 ASN ASN D . n D 1 41 VAL 41 100 100 VAL VAL D . n D 1 42 ASP 42 101 101 ASP ASP D . n D 1 43 PHE 43 102 102 PHE PHE D . n D 1 44 ASP 44 103 103 ASP ASP D . n D 1 45 GLN 45 104 104 GLN GLN D . n D 1 46 LEU 46 105 105 LEU LEU D . n D 1 47 ARG 47 106 106 ARG ARG D . n D 1 48 GLN 48 107 107 GLN GLN D . n D 1 49 ASN 49 108 108 ASN ASN D . n D 1 50 GLU 50 109 109 GLU GLU D . n D 1 51 CYS 51 110 110 CYS CYS D . n D 1 52 LYS 52 111 111 LYS LYS D . n D 1 53 LYS 53 112 112 LYS LYS D . n D 1 54 ASN 54 113 113 ASN ASN D . n D 1 55 ILE 55 114 114 ILE ILE D . n D 1 56 THR 56 115 115 THR THR D . n D 1 57 LEU 57 116 116 LEU LEU D . n D 1 58 SER 58 117 117 SER SER D . n D 1 59 LYS 59 118 118 LYS LYS D . n D 1 60 PHE 60 119 119 PHE PHE D . n D 1 61 TRP 61 120 ? ? ? D . n D 1 62 GLU 62 121 ? ? ? D . n D 1 63 LYS 63 122 ? ? ? D . n D 1 64 SER 64 123 ? ? ? D . n D 1 65 GLU 65 124 ? ? ? D . n D 1 66 GLN 66 125 ? ? ? D . n D 1 67 ARG 67 126 ? ? ? D . n D 1 68 ASN 68 127 ? ? ? D . n D 1 69 VAL 69 128 ? ? ? D . n D 1 70 PRO 70 129 ? ? ? D . n D 1 71 GLU 71 130 130 GLU GLU D . n D 1 72 ASP 72 131 131 ASP ASP D . n D 1 73 ASP 73 132 132 ASP ASP D . n D 1 74 ASN 74 133 133 ASN ASN D . n D 1 75 TRP 75 134 134 TRP TRP D . n D 1 76 GLU 76 135 135 GLU GLU D . n D 1 77 ARG 77 136 136 ARG ARG D . n D 1 78 PHE 78 137 137 PHE PHE D . n D 1 79 TYR 79 138 138 TYR TYR D . n D 1 80 SER 80 139 139 SER SER D . n D 1 81 ASN 81 140 140 ASN ASN D . n D 1 82 ILE 82 141 141 ILE ILE D . n D 1 83 GLY 83 142 142 GLY GLY D . n D 1 84 SER 84 143 143 SER SER D . n D 1 85 CYS 85 144 144 CYS CYS D . n D 1 86 SER 86 145 145 SER SER D . n D 1 87 VAL 87 146 146 VAL VAL D . n D 1 88 TYR 88 147 147 TYR TYR D . n D 1 89 SER 89 148 148 SER SER D . n D 1 90 ASP 90 149 149 ASP ASP D . n D 1 91 ASP 91 150 150 ASP ASP D . n D 1 92 GLN 92 151 151 GLN GLN D . n D 1 93 MSE 93 152 152 MSE MSE D . n D 1 94 ILE 94 153 153 ILE ILE D . n D 1 95 ASP 95 154 154 ASP ASP D . n D 1 96 ASN 96 155 155 ASN ASN D . n D 1 97 LEU 97 156 156 LEU LEU D . n D 1 98 LEU 98 157 157 LEU LEU D . n D 1 99 HIS 99 158 158 HIS HIS D . n D 1 100 ASP 100 159 159 ASP ASP D . n D 1 101 LEU 101 160 160 LEU LEU D . n D 1 102 ASN 102 161 161 ASN ASN D . n D 1 103 THR 103 162 162 THR THR D . n D 1 104 SER 104 163 163 SER SER D . n D 1 105 PRO 105 164 164 PRO PRO D . n D 1 106 ILE 106 165 165 ILE ILE D . n D 1 107 LYS 107 166 166 LYS LYS D . n D 1 108 HIS 108 167 167 HIS HIS D . n D 1 109 VAL 109 168 168 VAL VAL D . n D 1 110 HIS 110 169 169 HIS HIS D . n D 1 111 ILE 111 170 170 ILE ILE D . n D 1 112 MSE 112 171 171 MSE MSE D . n D 1 113 ASP 113 172 172 ASP ASP D . n D 1 114 GLY 114 173 173 GLY GLY D . n D 1 115 GLY 115 174 174 GLY GLY D . n D 1 116 THR 116 175 175 THR THR D . n D 1 117 GLN 117 176 176 GLN GLN D . n D 1 118 VAL 118 177 177 VAL VAL D . n D 1 119 LYS 119 178 178 LYS LYS D . n D 1 120 PHE 120 179 179 PHE PHE D . n D 1 121 VAL 121 180 180 VAL VAL D . n D 1 122 PHE 122 181 181 PHE PHE D . n D 1 123 THR 123 182 182 THR THR D . n D 1 124 PHE 124 183 183 PHE PHE D . n D 1 125 LYS 125 184 184 LYS LYS D . n D 1 126 ASN 126 185 185 ASN ASN D . n D 1 127 ASP 127 186 186 ASP ASP D . n D 1 128 LYS 128 187 187 LYS LYS D . n D 1 129 GLN 129 188 188 GLN GLN D . n D 1 130 ALA 130 189 189 ALA ALA D . n D 1 131 VAL 131 190 190 VAL VAL D . n D 1 132 PHE 132 191 191 PHE PHE D . n D 1 133 LYS 133 192 192 LYS LYS D . n D 1 134 PRO 134 193 193 PRO PRO D . n D 1 135 MSE 135 194 194 MSE MSE D . n D 1 136 ARG 136 195 195 ARG ARG D . n D 1 137 PHE 137 196 196 PHE PHE D . n D 1 138 GLY 138 197 197 GLY GLY D . n D 1 139 ARG 139 198 198 ARG ARG D . n D 1 140 ASP 140 199 199 ASP ASP D . n D 1 141 TYR 141 200 200 TYR TYR D . n D 1 142 GLU 142 201 201 GLU GLU D . n D 1 143 SER 143 202 202 SER SER D . n D 1 144 ASP 144 203 203 ASP ASP D . n D 1 145 PRO 145 204 204 PRO PRO D . n D 1 146 ASN 146 205 205 ASN ASN D . n D 1 147 HIS 147 206 206 HIS HIS D . n D 1 148 PHE 148 207 207 PHE PHE D . n D 1 149 TYR 149 208 208 TYR TYR D . n D 1 150 PHE 150 209 209 PHE PHE D . n D 1 151 SER 151 210 210 SER SER D . n D 1 152 ASP 152 211 211 ASP ASP D . n D 1 153 PHE 153 212 212 PHE PHE D . n D 1 154 GLU 154 213 213 GLU GLU D . n D 1 155 ARG 155 214 214 ARG ARG D . n D 1 156 HIS 156 215 215 HIS HIS D . n D 1 157 HIS 157 216 216 HIS HIS D . n D 1 158 ALA 158 217 217 ALA ALA D . n D 1 159 GLU 159 218 218 GLU GLU D . n D 1 160 ILE 160 219 219 ILE ILE D . n D 1 161 ALA 161 220 220 ALA ALA D . n D 1 162 THR 162 221 221 THR THR D . n D 1 163 PHE 163 222 222 PHE PHE D . n D 1 164 HIS 164 223 223 HIS HIS D . n D 1 165 LEU 165 224 224 LEU LEU D . n D 1 166 ASP 166 225 225 ASP ASP D . n D 1 167 ARG 167 226 226 ARG ARG D . n D 1 168 VAL 168 227 227 VAL VAL D . n D 1 169 LEU 169 228 228 LEU LEU D . n D 1 170 GLY 170 229 229 GLY GLY D . n D 1 171 PHE 171 230 230 PHE PHE D . n D 1 172 ARG 172 231 231 ARG ARG D . n D 1 173 ARG 173 232 232 ARG ARG D . n D 1 174 ALA 174 233 233 ALA ALA D . n D 1 175 ILE 175 234 234 ILE ILE D . n D 1 176 PRO 176 235 235 PRO PRO D . n D 1 177 THR 177 236 236 THR THR D . n D 1 178 VAL 178 237 237 VAL VAL D . n D 1 179 GLY 179 238 238 GLY GLY D . n D 1 180 ARG 180 239 239 ARG ARG D . n D 1 181 VAL 181 240 240 VAL VAL D . n D 1 182 LEU 182 241 241 LEU LEU D . n D 1 183 ASN 183 242 242 ASN ASN D . n D 1 184 MSE 184 243 243 MSE MSE D . n D 1 185 THR 185 244 244 THR THR D . n D 1 186 THR 186 245 245 THR THR D . n D 1 187 GLU 187 246 246 GLU GLU D . n D 1 188 LEU 188 247 247 LEU LEU D . n D 1 189 PHE 189 248 248 PHE PHE D . n D 1 190 GLU 190 249 249 GLU GLU D . n D 1 191 LYS 191 250 250 LYS LYS D . n D 1 192 ALA 192 251 251 ALA ALA D . n D 1 193 GLU 193 252 252 GLU GLU D . n D 1 194 LYS 194 253 253 LYS LYS D . n D 1 195 LYS 195 254 254 LYS LYS D . n D 1 196 LEU 196 255 255 LEU LEU D . n D 1 197 LYS 197 256 256 LYS LYS D . n D 1 198 LYS 198 257 257 LYS LYS D . n D 1 199 THR 199 258 258 THR THR D . n D 1 200 PHE 200 259 259 PHE PHE D . n D 1 201 PHE 201 260 260 PHE PHE D . n D 1 202 PHE 202 261 261 PHE PHE D . n D 1 203 SER 203 262 262 SER SER D . n D 1 204 PRO 204 263 263 PRO PRO D . n D 1 205 ALA 205 264 264 ALA ALA D . n D 1 206 LYS 206 265 265 LYS LYS D . n D 1 207 ASN 207 266 266 ASN ASN D . n D 1 208 PHE 208 267 267 PHE PHE D . n D 1 209 CYS 209 268 268 CYS CYS D . n D 1 210 PHE 210 269 269 PHE PHE D . n D 1 211 VAL 211 270 270 VAL VAL D . n D 1 212 SER 212 271 271 SER SER D . n D 1 213 ARG 213 272 272 ARG ARG D . n D 1 214 CYS 214 273 273 CYS CYS D . n D 1 215 ASP 215 274 274 ASP ASP D . n D 1 216 TYR 216 275 275 TYR TYR D . n D 1 217 TYR 217 276 276 TYR TYR D . n D 1 218 CYS 218 277 277 CYS CYS D . n D 1 219 ASP 219 278 278 ASP ASP D . n D 1 220 THR 220 279 279 THR THR D . n D 1 221 THR 221 280 280 THR THR D . n D 1 222 HIS 222 281 281 HIS HIS D . n D 1 223 ALA 223 282 282 ALA ALA D . n D 1 224 ILE 224 283 283 ILE ILE D . n D 1 225 CYS 225 284 284 CYS CYS D . n D 1 226 GLY 226 285 285 GLY GLY D . n D 1 227 LEU 227 286 286 LEU LEU D . n D 1 228 PRO 228 287 287 PRO PRO D . n D 1 229 ASP 229 288 288 ASP ASP D . n D 1 230 MSE 230 289 289 MSE MSE D . n D 1 231 LYS 231 290 290 LYS LYS D . n D 1 232 GLU 232 291 291 GLU GLU D . n D 1 233 GLY 233 292 292 GLY GLY D . n D 1 234 SER 234 293 293 SER SER D . n D 1 235 VAL 235 294 294 VAL VAL D . n D 1 236 GLN 236 295 295 GLN GLN D . n D 1 237 VAL 237 296 296 VAL VAL D . n D 1 238 PHE 238 297 297 PHE PHE D . n D 1 239 LEU 239 298 298 LEU LEU D . n D 1 240 PRO 240 299 299 PRO PRO D . n D 1 241 ASP 241 300 300 ASP ASP D . n D 1 242 GLU 242 301 301 GLU GLU D . n D 1 243 SER 243 302 302 SER SER D . n D 1 244 ALA 244 303 303 ALA ALA D . n D 1 245 VAL 245 304 304 VAL VAL D . n D 1 246 PRO 246 305 305 PRO PRO D . n D 1 247 ARG 247 306 306 ARG ARG D . n D 1 248 LYS 248 307 307 LYS LYS D . n D 1 249 HIS 249 308 308 HIS HIS D . n D 1 250 ASN 250 309 309 ASN ASN D . n D 1 251 ARG 251 310 310 ARG ARG D . n D 1 252 SER 252 311 311 SER SER D . n D 1 253 PRO 253 312 312 PRO PRO D . n D 1 254 TYR 254 313 313 TYR TYR D . n D 1 255 ARG 255 314 314 ARG ARG D . n D 1 256 ARG 256 315 315 ARG ARG D . n D 1 257 THR 257 316 316 THR THR D . n D 1 258 TYR 258 317 317 TYR TYR D . n D 1 259 SER 259 318 318 SER SER D . n D 1 260 LYS 260 319 319 LYS LYS D . n D 1 261 LYS 261 320 320 LYS LYS D . n D 1 262 ASN 262 321 321 ASN ASN D . n D 1 263 GLN 263 322 322 GLN GLN D . n D 1 264 VAL 264 323 323 VAL VAL D . n D 1 265 ALA 265 324 324 ALA ALA D . n D 1 266 GLU 266 325 325 GLU GLU D . n D 1 267 TRP 267 326 326 TRP TRP D . n D 1 268 GLN 268 327 327 GLN GLN D . n D 1 269 SER 269 328 328 SER SER D . n D 1 270 SER 270 329 329 SER SER D . n D 1 271 MSE 271 330 330 MSE MSE D . n D 1 272 ASN 272 331 331 ASN ASN D . n D 1 273 TYR 273 332 332 TYR TYR D . n D 1 274 CYS 274 333 333 CYS CYS D . n D 1 275 THR 275 334 334 THR THR D . n D 1 276 ASP 276 335 335 ASP ASP D . n D 1 277 LYS 277 336 336 LYS LYS D . n D 1 278 VAL 278 337 337 VAL VAL D . n D 1 279 LYS 279 338 338 LYS LYS D . n D 1 280 THR 280 339 339 THR THR D . n D 1 281 LYS 281 340 340 LYS LYS D . n D 1 282 ARG 282 341 341 ARG ARG D . n D 1 283 GLN 283 342 342 GLN GLN D . n D 1 284 TYR 284 343 343 TYR TYR D . n D 1 285 ALA 285 344 344 ALA ALA D . n D 1 286 HIS 286 345 345 HIS HIS D . n D 1 287 GLY 287 346 346 GLY GLY D . n D 1 288 ARG 288 347 347 ARG ARG D . n D 1 289 ARG 289 348 348 ARG ARG D . n D 1 290 LEU 290 349 349 LEU LEU D . n D 1 291 LEU 291 350 350 LEU LEU D . n D 1 292 ASP 292 351 351 ASP ASP D . n D 1 293 LEU 293 352 352 LEU LEU D . n D 1 294 VAL 294 353 353 VAL VAL D . n D 1 295 ASP 295 354 354 ASP ASP D . n D 1 296 ILE 296 355 355 ILE ILE D . n D 1 297 HIS 297 356 356 HIS HIS D . n D 1 298 ILE 298 357 357 ILE ILE D . n D 1 299 LEU 299 358 358 LEU LEU D . n D 1 300 ASP 300 359 359 ASP ASP D . n D 1 301 TYR 301 360 360 TYR TYR D . n D 1 302 LEU 302 361 361 LEU LEU D . n D 1 303 ILE 303 362 362 ILE ILE D . n D 1 304 GLY 304 363 363 GLY GLY D . n D 1 305 ASN 305 364 364 ASN ASN D . n D 1 306 GLN 306 365 365 GLN GLN D . n D 1 307 ASP 307 366 366 ASP ASP D . n D 1 308 ARG 308 367 367 ARG ARG D . n D 1 309 HIS 309 368 368 HIS HIS D . n D 1 310 HIS 310 369 369 HIS HIS D . n D 1 311 PHE 311 370 370 PHE PHE D . n D 1 312 GLU 312 371 371 GLU GLU D . n D 1 313 SER 313 372 372 SER SER D . n D 1 314 PHE 314 373 373 PHE PHE D . n D 1 315 ASN 315 374 374 ASN ASN D . n D 1 316 VAL 316 375 375 VAL VAL D . n D 1 317 PHE 317 376 376 PHE PHE D . n D 1 318 ASN 318 377 377 ASN ASN D . n D 1 319 ASP 319 378 378 ASP ASP D . n D 1 320 LEU 320 379 379 LEU LEU D . n D 1 321 PRO 321 380 380 PRO PRO D . n D 1 322 SER 322 381 381 SER SER D . n D 1 323 TYR 323 382 382 TYR TYR D . n D 1 324 ALA 324 383 383 ALA ALA D . n D 1 325 ILE 325 384 384 ILE ILE D . n D 1 326 HIS 326 385 385 HIS HIS D . n D 1 327 LEU 327 386 386 LEU LEU D . n D 1 328 ASP 328 387 387 ASP ASP D . n D 1 329 HIS 329 388 388 HIS HIS D . n D 1 330 GLY 330 389 389 GLY GLY D . n D 1 331 ARG 331 390 390 ARG ARG D . n D 1 332 ALA 332 391 391 ALA ALA D . n D 1 333 PHE 333 392 392 PHE PHE D . n D 1 334 GLY 334 393 393 GLY GLY D . n D 1 335 ARG 335 394 394 ARG ARG D . n D 1 336 SER 336 395 395 SER SER D . n D 1 337 ASP 337 396 396 ASP ASP D . n D 1 338 PHE 338 397 397 PHE PHE D . n D 1 339 ASP 339 398 398 ASP ASP D . n D 1 340 ASP 340 399 399 ASP ASP D . n D 1 341 ASP 341 400 400 ASP ASP D . n D 1 342 ASP 342 401 401 ASP ASP D . n D 1 343 ILE 343 402 402 ILE ILE D . n D 1 344 ILE 344 403 403 ILE ILE D . n D 1 345 LEU 345 404 404 LEU LEU D . n D 1 346 PRO 346 405 405 PRO PRO D . n D 1 347 LEU 347 406 406 LEU LEU D . n D 1 348 ARG 348 407 407 ARG ARG D . n D 1 349 GLN 349 408 408 GLN GLN D . n D 1 350 CYS 350 409 409 CYS CYS D . n D 1 351 CYS 351 410 410 CYS CYS D . n D 1 352 ILE 352 411 411 ILE ILE D . n D 1 353 LEU 353 412 412 LEU LEU D . n D 1 354 ARG 354 413 413 ARG ARG D . n D 1 355 PRO 355 414 414 PRO PRO D . n D 1 356 SER 356 415 415 SER SER D . n D 1 357 THR 357 416 416 THR THR D . n D 1 358 PHE 358 417 417 PHE PHE D . n D 1 359 GLN 359 418 418 GLN GLN D . n D 1 360 THR 360 419 419 THR THR D . n D 1 361 LEU 361 420 420 LEU LEU D . n D 1 362 MSE 362 421 421 MSE MSE D . n D 1 363 ASN 363 422 422 ASN ASN D . n D 1 364 PHE 364 423 423 PHE PHE D . n D 1 365 TYR 365 424 424 TYR TYR D . n D 1 366 SER 366 425 425 SER SER D . n D 1 367 THR 367 426 426 THR THR D . n D 1 368 PRO 368 427 427 PRO PRO D . n D 1 369 LYS 369 428 428 LYS LYS D . n D 1 370 SER 370 429 429 SER SER D . n D 1 371 LEU 371 430 430 LEU LEU D . n D 1 372 THR 372 431 431 THR THR D . n D 1 373 LYS 373 432 432 LYS LYS D . n D 1 374 ALA 374 433 433 ALA ALA D . n D 1 375 LEU 375 434 434 LEU LEU D . n D 1 376 HIS 376 435 435 HIS HIS D . n D 1 377 GLU 377 436 436 GLU GLU D . n D 1 378 SER 378 437 437 SER SER D . n D 1 379 LEU 379 438 438 LEU LEU D . n D 1 380 SER 380 439 439 SER SER D . n D 1 381 LYS 381 440 440 LYS LYS D . n D 1 382 ASP 382 441 441 ASP ASP D . n D 1 383 PRO 383 442 442 PRO PRO D . n D 1 384 ALA 384 443 443 ALA ALA D . n D 1 385 HIS 385 444 444 HIS HIS D . n D 1 386 PRO 386 445 445 PRO PRO D . n D 1 387 ILE 387 446 446 ILE ILE D . n D 1 388 LEU 388 447 447 LEU LEU D . n D 1 389 ALA 389 448 448 ALA ALA D . n D 1 390 TYR 390 449 449 TYR TYR D . n D 1 391 LYS 391 450 450 LYS LYS D . n D 1 392 HIS 392 451 451 HIS HIS D . n D 1 393 TYR 393 452 452 TYR TYR D . n D 1 394 PRO 394 453 453 PRO PRO D . n D 1 395 ALA 395 454 454 ALA ALA D . n D 1 396 MSE 396 455 455 MSE MSE D . n D 1 397 GLU 397 456 456 GLU GLU D . n D 1 398 ARG 398 457 457 ARG ARG D . n D 1 399 ARG 399 458 458 ARG ARG D . n D 1 400 LEU 400 459 459 LEU LEU D . n D 1 401 ALA 401 460 460 ALA ALA D . n D 1 402 LYS 402 461 461 LYS LYS D . n D 1 403 ILE 403 462 462 ILE ILE D . n D 1 404 MSE 404 463 463 MSE MSE D . n D 1 405 SER 405 464 464 SER SER D . n D 1 406 HIS 406 465 465 HIS HIS D . n D 1 407 ILE 407 466 466 ILE ILE D . n D 1 408 LEU 408 467 467 LEU LEU D . n D 1 409 GLU 409 468 468 GLU GLU D . n D 1 410 CYS 410 469 469 CYS CYS D . n D 1 411 PHE 411 470 470 PHE PHE D . n D 1 412 GLU 412 471 471 GLU GLU D . n D 1 413 SER 413 472 472 SER SER D . n D 1 414 ARG 414 473 473 ARG ARG D . n D 1 415 GLY 415 474 474 GLY GLY D . n D 1 416 VAL 416 475 475 VAL VAL D . n D 1 417 ALA 417 476 476 ALA ALA D . n D 1 418 GLU 418 477 477 GLU GLU D . n D 1 419 VAL 419 478 478 VAL VAL D . n D 1 420 LEU 420 479 479 LEU LEU D . n D 1 421 VAL 421 480 480 VAL VAL D . n D 1 422 ALA 422 481 481 ALA ALA D . n D 1 423 GLU 423 482 482 GLU GLU D . n D 1 424 TYR 424 483 483 TYR TYR D . n D 1 425 ASN 425 484 484 ASN ASN D . n D 1 426 ASN 426 485 485 ASN ASN D . n D 1 427 PRO 427 486 486 PRO PRO D . n D 1 428 ASP 428 487 ? ? ? D . n D 1 429 VAL 429 488 ? ? ? D . n D 1 430 SER 430 489 ? ? ? D . n D 1 431 ASP 431 490 ? ? ? D . n D 1 432 ALA 432 491 ? ? ? D . n D 1 433 GLU 433 492 ? ? ? D . n D 1 434 GLN 434 493 ? ? ? D . n D 1 435 ASN 435 494 ? ? ? D . n D 1 436 ASP 436 495 ? ? ? D . n D 1 437 GLU 437 496 ? ? ? D . n D 1 438 GLU 438 497 ? ? ? D . n D 1 439 GLN 439 498 ? ? ? D . n D 1 440 SER 440 499 ? ? ? D . n D 1 441 GLU 441 500 ? ? ? D . n D 1 442 GLU 442 501 ? ? ? D . n D 1 443 HIS 443 502 ? ? ? D . n D 1 444 GLN 444 503 ? ? ? D . n D 1 445 ASP 445 504 ? ? ? D . n D 1 446 LYS 446 505 ? ? ? D . n D 1 447 LYS 447 506 ? ? ? D . n D 1 448 ASP 448 507 ? ? ? D . n D 1 449 ASP 449 508 ? ? ? D . n D 1 450 LYS 450 509 ? ? ? D . n D 1 451 LYS 451 510 ? ? ? D . n D 1 452 THR 452 511 ? ? ? D . n D 1 453 VAL 453 512 ? ? ? D . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code E 2 NAG 1 601 601 NAG NAG A . F 2 NAG 2 602 602 NAG NAG A . G 3 BMA 3 603 603 BMA BMA A . H 2 NAG 1 604 604 NAG NAG A . I 2 NAG 2 605 605 NAG NAG A . J 4 NI 1 606 1 NI NI A . K 2 NAG 1 601 601 NAG NAG B . L 2 NAG 2 602 602 NAG NAG B . M 3 BMA 3 603 603 BMA BMA B . N 2 NAG 1 604 604 NAG NAG B . O 2 NAG 2 605 605 NAG NAG B . P 4 NI 1 606 2 NI NI B . Q 2 NAG 1 601 601 NAG NAG C . R 2 NAG 2 602 602 NAG NAG C . S 3 BMA 3 603 603 BMA BMA C . T 2 NAG 1 604 604 NAG NAG C . U 2 NAG 2 605 605 NAG NAG C . V 2 NAG 1 601 601 NAG NAG D . W 2 NAG 2 602 602 NAG NAG D . X 3 BMA 3 603 603 BMA BMA D . Y 2 NAG 1 604 604 NAG NAG D . Z 2 NAG 2 605 605 NAG NAG D . AA 5 HOH 1 701 1 HOH HOH A . AA 5 HOH 2 702 3 HOH HOH A . AA 5 HOH 3 703 11 HOH HOH A . AA 5 HOH 4 704 18 HOH HOH A . AA 5 HOH 5 705 21 HOH HOH A . AA 5 HOH 6 706 22 HOH HOH A . AA 5 HOH 7 707 25 HOH HOH A . AA 5 HOH 8 708 26 HOH HOH A . AA 5 HOH 9 709 28 HOH HOH A . AA 5 HOH 10 710 29 HOH HOH A . AA 5 HOH 11 711 30 HOH HOH A . AA 5 HOH 12 712 32 HOH HOH A . AA 5 HOH 13 713 35 HOH HOH A . AA 5 HOH 14 714 37 HOH HOH A . AA 5 HOH 15 715 42 HOH HOH A . AA 5 HOH 16 716 44 HOH HOH A . AA 5 HOH 17 717 45 HOH HOH A . AA 5 HOH 18 718 47 HOH HOH A . AA 5 HOH 19 719 57 HOH HOH A . AA 5 HOH 20 720 58 HOH HOH A . AA 5 HOH 21 721 61 HOH HOH A . AA 5 HOH 22 722 68 HOH HOH A . AA 5 HOH 23 723 70 HOH HOH A . AA 5 HOH 24 724 74 HOH HOH A . AA 5 HOH 25 725 78 HOH HOH A . AA 5 HOH 26 726 83 HOH HOH A . AA 5 HOH 27 727 85 HOH HOH A . AA 5 HOH 28 728 91 HOH HOH A . AA 5 HOH 29 729 92 HOH HOH A . AA 5 HOH 30 730 93 HOH HOH A . AA 5 HOH 31 731 96 HOH HOH A . AA 5 HOH 32 732 100 HOH HOH A . AA 5 HOH 33 733 101 HOH HOH A . AA 5 HOH 34 734 109 HOH HOH A . AA 5 HOH 35 735 115 HOH HOH A . AA 5 HOH 36 736 118 HOH HOH A . AA 5 HOH 37 737 120 HOH HOH A . AA 5 HOH 38 738 133 HOH HOH A . AA 5 HOH 39 739 142 HOH HOH A . AA 5 HOH 40 740 144 HOH HOH A . AA 5 HOH 41 741 145 HOH HOH A . AA 5 HOH 42 742 149 HOH HOH A . AA 5 HOH 43 743 155 HOH HOH A . AA 5 HOH 44 744 157 HOH HOH A . AA 5 HOH 45 745 158 HOH HOH A . AA 5 HOH 46 746 160 HOH HOH A . AA 5 HOH 47 747 166 HOH HOH A . AA 5 HOH 48 748 169 HOH HOH A . AA 5 HOH 49 749 170 HOH HOH A . AA 5 HOH 50 750 172 HOH HOH A . AA 5 HOH 51 751 173 HOH HOH A . AA 5 HOH 52 752 178 HOH HOH A . AA 5 HOH 53 753 179 HOH HOH A . AA 5 HOH 54 754 180 HOH HOH A . AA 5 HOH 55 755 183 HOH HOH A . AA 5 HOH 56 756 185 HOH HOH A . AA 5 HOH 57 757 196 HOH HOH A . AA 5 HOH 58 758 199 HOH HOH A . AA 5 HOH 59 759 206 HOH HOH A . AA 5 HOH 60 760 207 HOH HOH A . AA 5 HOH 61 761 212 HOH HOH A . AA 5 HOH 62 762 215 HOH HOH A . AA 5 HOH 63 763 219 HOH HOH A . AA 5 HOH 64 764 228 HOH HOH A . AA 5 HOH 65 765 231 HOH HOH A . AA 5 HOH 66 766 234 HOH HOH A . AA 5 HOH 67 767 236 HOH HOH A . AA 5 HOH 68 768 239 HOH HOH A . AA 5 HOH 69 769 245 HOH HOH A . AA 5 HOH 70 770 246 HOH HOH A . AA 5 HOH 71 771 247 HOH HOH A . AA 5 HOH 72 772 251 HOH HOH A . AA 5 HOH 73 773 253 HOH HOH A . AA 5 HOH 74 774 256 HOH HOH A . AA 5 HOH 75 775 263 HOH HOH A . AA 5 HOH 76 776 268 HOH HOH A . BA 5 HOH 1 701 8 HOH HOH B . BA 5 HOH 2 702 13 HOH HOH B . BA 5 HOH 3 703 24 HOH HOH B . BA 5 HOH 4 704 27 HOH HOH B . BA 5 HOH 5 705 33 HOH HOH B . BA 5 HOH 6 706 49 HOH HOH B . BA 5 HOH 7 707 51 HOH HOH B . BA 5 HOH 8 708 56 HOH HOH B . BA 5 HOH 9 709 62 HOH HOH B . BA 5 HOH 10 710 63 HOH HOH B . BA 5 HOH 11 711 80 HOH HOH B . BA 5 HOH 12 712 82 HOH HOH B . BA 5 HOH 13 713 87 HOH HOH B . BA 5 HOH 14 714 90 HOH HOH B . BA 5 HOH 15 715 95 HOH HOH B . BA 5 HOH 16 716 97 HOH HOH B . BA 5 HOH 17 717 98 HOH HOH B . BA 5 HOH 18 718 103 HOH HOH B . BA 5 HOH 19 719 104 HOH HOH B . BA 5 HOH 20 720 105 HOH HOH B . BA 5 HOH 21 721 108 HOH HOH B . BA 5 HOH 22 722 125 HOH HOH B . BA 5 HOH 23 723 126 HOH HOH B . BA 5 HOH 24 724 130 HOH HOH B . BA 5 HOH 25 725 135 HOH HOH B . BA 5 HOH 26 726 139 HOH HOH B . BA 5 HOH 27 727 147 HOH HOH B . BA 5 HOH 28 728 150 HOH HOH B . BA 5 HOH 29 729 152 HOH HOH B . BA 5 HOH 30 730 154 HOH HOH B . BA 5 HOH 31 731 162 HOH HOH B . BA 5 HOH 32 732 175 HOH HOH B . BA 5 HOH 33 733 177 HOH HOH B . BA 5 HOH 34 734 181 HOH HOH B . BA 5 HOH 35 735 182 HOH HOH B . BA 5 HOH 36 736 187 HOH HOH B . BA 5 HOH 37 737 190 HOH HOH B . BA 5 HOH 38 738 200 HOH HOH B . BA 5 HOH 39 739 201 HOH HOH B . BA 5 HOH 40 740 202 HOH HOH B . BA 5 HOH 41 741 204 HOH HOH B . BA 5 HOH 42 742 209 HOH HOH B . BA 5 HOH 43 743 218 HOH HOH B . BA 5 HOH 44 744 221 HOH HOH B . BA 5 HOH 45 745 223 HOH HOH B . BA 5 HOH 46 746 225 HOH HOH B . BA 5 HOH 47 747 244 HOH HOH B . BA 5 HOH 48 748 249 HOH HOH B . BA 5 HOH 49 749 250 HOH HOH B . BA 5 HOH 50 750 255 HOH HOH B . BA 5 HOH 51 751 258 HOH HOH B . BA 5 HOH 52 752 266 HOH HOH B . BA 5 HOH 53 753 269 HOH HOH B . BA 5 HOH 54 754 270 HOH HOH B . CA 5 HOH 1 701 2 HOH HOH C . CA 5 HOH 2 702 4 HOH HOH C . CA 5 HOH 3 703 6 HOH HOH C . CA 5 HOH 4 704 7 HOH HOH C . CA 5 HOH 5 705 9 HOH HOH C . CA 5 HOH 6 706 10 HOH HOH C . CA 5 HOH 7 707 12 HOH HOH C . CA 5 HOH 8 708 14 HOH HOH C . CA 5 HOH 9 709 15 HOH HOH C . CA 5 HOH 10 710 16 HOH HOH C . CA 5 HOH 11 711 17 HOH HOH C . CA 5 HOH 12 712 19 HOH HOH C . CA 5 HOH 13 713 31 HOH HOH C . CA 5 HOH 14 714 34 HOH HOH C . CA 5 HOH 15 715 36 HOH HOH C . CA 5 HOH 16 716 38 HOH HOH C . CA 5 HOH 17 717 39 HOH HOH C . CA 5 HOH 18 718 40 HOH HOH C . CA 5 HOH 19 719 46 HOH HOH C . CA 5 HOH 20 720 48 HOH HOH C . CA 5 HOH 21 721 50 HOH HOH C . CA 5 HOH 22 722 52 HOH HOH C . CA 5 HOH 23 723 53 HOH HOH C . CA 5 HOH 24 724 54 HOH HOH C . CA 5 HOH 25 725 55 HOH HOH C . CA 5 HOH 26 726 59 HOH HOH C . CA 5 HOH 27 727 60 HOH HOH C . CA 5 HOH 28 728 64 HOH HOH C . CA 5 HOH 29 729 66 HOH HOH C . CA 5 HOH 30 730 67 HOH HOH C . CA 5 HOH 31 731 69 HOH HOH C . CA 5 HOH 32 732 72 HOH HOH C . CA 5 HOH 33 733 73 HOH HOH C . CA 5 HOH 34 734 75 HOH HOH C . CA 5 HOH 35 735 76 HOH HOH C . CA 5 HOH 36 736 84 HOH HOH C . CA 5 HOH 37 737 89 HOH HOH C . CA 5 HOH 38 738 94 HOH HOH C . CA 5 HOH 39 739 99 HOH HOH C . CA 5 HOH 40 740 102 HOH HOH C . CA 5 HOH 41 741 107 HOH HOH C . CA 5 HOH 42 742 110 HOH HOH C . CA 5 HOH 43 743 111 HOH HOH C . CA 5 HOH 44 744 113 HOH HOH C . CA 5 HOH 45 745 116 HOH HOH C . CA 5 HOH 46 746 117 HOH HOH C . CA 5 HOH 47 747 121 HOH HOH C . CA 5 HOH 48 748 122 HOH HOH C . CA 5 HOH 49 749 127 HOH HOH C . CA 5 HOH 50 750 131 HOH HOH C . CA 5 HOH 51 751 132 HOH HOH C . CA 5 HOH 52 752 134 HOH HOH C . CA 5 HOH 53 753 136 HOH HOH C . CA 5 HOH 54 754 137 HOH HOH C . CA 5 HOH 55 755 138 HOH HOH C . CA 5 HOH 56 756 140 HOH HOH C . CA 5 HOH 57 757 141 HOH HOH C . CA 5 HOH 58 758 151 HOH HOH C . CA 5 HOH 59 759 153 HOH HOH C . CA 5 HOH 60 760 156 HOH HOH C . CA 5 HOH 61 761 161 HOH HOH C . CA 5 HOH 62 762 164 HOH HOH C . CA 5 HOH 63 763 165 HOH HOH C . CA 5 HOH 64 764 167 HOH HOH C . CA 5 HOH 65 765 171 HOH HOH C . CA 5 HOH 66 766 174 HOH HOH C . CA 5 HOH 67 767 176 HOH HOH C . CA 5 HOH 68 768 184 HOH HOH C . CA 5 HOH 69 769 186 HOH HOH C . CA 5 HOH 70 770 188 HOH HOH C . CA 5 HOH 71 771 192 HOH HOH C . CA 5 HOH 72 772 193 HOH HOH C . CA 5 HOH 73 773 194 HOH HOH C . CA 5 HOH 74 774 197 HOH HOH C . CA 5 HOH 75 775 198 HOH HOH C . CA 5 HOH 76 776 203 HOH HOH C . CA 5 HOH 77 777 205 HOH HOH C . CA 5 HOH 78 778 208 HOH HOH C . CA 5 HOH 79 779 210 HOH HOH C . CA 5 HOH 80 780 211 HOH HOH C . CA 5 HOH 81 781 214 HOH HOH C . CA 5 HOH 82 782 216 HOH HOH C . CA 5 HOH 83 783 217 HOH HOH C . CA 5 HOH 84 784 222 HOH HOH C . CA 5 HOH 85 785 224 HOH HOH C . CA 5 HOH 86 786 227 HOH HOH C . CA 5 HOH 87 787 230 HOH HOH C . CA 5 HOH 88 788 233 HOH HOH C . CA 5 HOH 89 789 237 HOH HOH C . CA 5 HOH 90 790 240 HOH HOH C . CA 5 HOH 91 791 241 HOH HOH C . CA 5 HOH 92 792 242 HOH HOH C . CA 5 HOH 93 793 243 HOH HOH C . CA 5 HOH 94 794 254 HOH HOH C . CA 5 HOH 95 795 257 HOH HOH C . CA 5 HOH 96 796 261 HOH HOH C . CA 5 HOH 97 797 262 HOH HOH C . CA 5 HOH 98 798 264 HOH HOH C . CA 5 HOH 99 799 265 HOH HOH C . DA 5 HOH 1 701 5 HOH HOH D . DA 5 HOH 2 702 20 HOH HOH D . DA 5 HOH 3 703 23 HOH HOH D . DA 5 HOH 4 704 41 HOH HOH D . DA 5 HOH 5 705 43 HOH HOH D . DA 5 HOH 6 706 65 HOH HOH D . DA 5 HOH 7 707 71 HOH HOH D . DA 5 HOH 8 708 77 HOH HOH D . DA 5 HOH 9 709 79 HOH HOH D . DA 5 HOH 10 710 81 HOH HOH D . DA 5 HOH 11 711 86 HOH HOH D . DA 5 HOH 12 712 88 HOH HOH D . DA 5 HOH 13 713 106 HOH HOH D . DA 5 HOH 14 714 112 HOH HOH D . DA 5 HOH 15 715 114 HOH HOH D . DA 5 HOH 16 716 119 HOH HOH D . DA 5 HOH 17 717 123 HOH HOH D . DA 5 HOH 18 718 124 HOH HOH D . DA 5 HOH 19 719 128 HOH HOH D . DA 5 HOH 20 720 129 HOH HOH D . DA 5 HOH 21 721 143 HOH HOH D . DA 5 HOH 22 722 146 HOH HOH D . DA 5 HOH 23 723 148 HOH HOH D . DA 5 HOH 24 724 159 HOH HOH D . DA 5 HOH 25 725 163 HOH HOH D . DA 5 HOH 26 726 168 HOH HOH D . DA 5 HOH 27 727 189 HOH HOH D . DA 5 HOH 28 728 191 HOH HOH D . DA 5 HOH 29 729 195 HOH HOH D . DA 5 HOH 30 730 213 HOH HOH D . DA 5 HOH 31 731 220 HOH HOH D . DA 5 HOH 32 732 226 HOH HOH D . DA 5 HOH 33 733 229 HOH HOH D . DA 5 HOH 34 734 232 HOH HOH D . DA 5 HOH 35 735 235 HOH HOH D . DA 5 HOH 36 736 238 HOH HOH D . DA 5 HOH 37 737 248 HOH HOH D . DA 5 HOH 38 738 252 HOH HOH D . DA 5 HOH 39 739 259 HOH HOH D . DA 5 HOH 40 740 260 HOH HOH D . DA 5 HOH 41 741 267 HOH HOH D . DA 5 HOH 42 742 271 HOH HOH D . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 C ASN 54 C ASN 113 ? ASN 'GLYCOSYLATION SITE' 2 C ASN 183 C ASN 242 ? ASN 'GLYCOSYLATION SITE' 3 D ASN 54 D ASN 113 ? ASN 'GLYCOSYLATION SITE' 4 A ASN 183 A ASN 242 ? ASN 'GLYCOSYLATION SITE' 5 D ASN 183 D ASN 242 ? ASN 'GLYCOSYLATION SITE' 6 A ASN 54 A ASN 113 ? ASN 'GLYCOSYLATION SITE' 7 B ASN 183 B ASN 242 ? ASN 'GLYCOSYLATION SITE' 8 B ASN 54 B ASN 113 ? ASN 'GLYCOSYLATION SITE' 9 A MSE 93 A MSE 152 ? MET SELENOMETHIONINE 10 A MSE 112 A MSE 171 ? MET SELENOMETHIONINE 11 A MSE 135 A MSE 194 ? MET SELENOMETHIONINE 12 A MSE 184 A MSE 243 ? MET SELENOMETHIONINE 13 A MSE 230 A MSE 289 ? MET SELENOMETHIONINE 14 A MSE 271 A MSE 330 ? MET SELENOMETHIONINE 15 A MSE 362 A MSE 421 ? MET SELENOMETHIONINE 16 A MSE 396 A MSE 455 ? MET SELENOMETHIONINE 17 A MSE 404 A MSE 463 ? MET SELENOMETHIONINE 18 B MSE 93 B MSE 152 ? MET SELENOMETHIONINE 19 B MSE 112 B MSE 171 ? MET SELENOMETHIONINE 20 B MSE 135 B MSE 194 ? MET SELENOMETHIONINE 21 B MSE 184 B MSE 243 ? MET SELENOMETHIONINE 22 B MSE 230 B MSE 289 ? MET SELENOMETHIONINE 23 B MSE 271 B MSE 330 ? MET SELENOMETHIONINE 24 B MSE 362 B MSE 421 ? MET SELENOMETHIONINE 25 B MSE 396 B MSE 455 ? MET SELENOMETHIONINE 26 B MSE 404 B MSE 463 ? MET SELENOMETHIONINE 27 C MSE 93 C MSE 152 ? MET SELENOMETHIONINE 28 C MSE 112 C MSE 171 ? MET SELENOMETHIONINE 29 C MSE 135 C MSE 194 ? MET SELENOMETHIONINE 30 C MSE 184 C MSE 243 ? MET SELENOMETHIONINE 31 C MSE 230 C MSE 289 ? MET SELENOMETHIONINE 32 C MSE 271 C MSE 330 ? MET SELENOMETHIONINE 33 C MSE 362 C MSE 421 ? MET SELENOMETHIONINE 34 C MSE 396 C MSE 455 ? MET SELENOMETHIONINE 35 C MSE 404 C MSE 463 ? MET SELENOMETHIONINE 36 D MSE 93 D MSE 152 ? MET SELENOMETHIONINE 37 D MSE 112 D MSE 171 ? MET SELENOMETHIONINE 38 D MSE 135 D MSE 194 ? MET SELENOMETHIONINE 39 D MSE 184 D MSE 243 ? MET SELENOMETHIONINE 40 D MSE 230 D MSE 289 ? MET SELENOMETHIONINE 41 D MSE 271 D MSE 330 ? MET SELENOMETHIONINE 42 D MSE 362 D MSE 421 ? MET SELENOMETHIONINE 43 D MSE 396 D MSE 455 ? MET SELENOMETHIONINE 44 D MSE 404 D MSE 463 ? MET SELENOMETHIONINE # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_defined_assembly ? dimeric 2 2 author_defined_assembly ? trimeric 3 3 author_defined_assembly ? dimeric 2 4 author_defined_assembly ? monomeric 1 5 software_defined_assembly PISA trimeric 3 6 software_defined_assembly PISA pentameric 5 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,B,E,F,G,H,I,J,K,L,M,N,O,P,AA,BA 2 1 A,B,C,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,AA,BA,CA 3 1 B,C,K,L,M,N,O,P,Q,R,S,T,U,BA,CA 4 1 D,V,W,X,Y,Z,DA 5 2 D,V,W,X,Y,Z,DA 5 1 A,B,E,F,G,H,I,J,K,L,M,N,O,P,AA,BA 6 3 B,C,K,L,M,N,O,P,Q,R,S,T,U,BA,CA 6 1 A,B,C,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,AA,BA,CA # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 5 'ABSA (A^2)' 5000 ? 5 MORE 10 ? 5 'SSA (A^2)' 36750 ? 6 'ABSA (A^2)' 4970 ? 6 MORE 8 ? 6 'SSA (A^2)' 37490 ? # loop_ _pdbx_struct_oper_list.id _pdbx_struct_oper_list.type _pdbx_struct_oper_list.name _pdbx_struct_oper_list.symmetry_operation _pdbx_struct_oper_list.matrix[1][1] _pdbx_struct_oper_list.matrix[1][2] _pdbx_struct_oper_list.matrix[1][3] _pdbx_struct_oper_list.vector[1] _pdbx_struct_oper_list.matrix[2][1] _pdbx_struct_oper_list.matrix[2][2] _pdbx_struct_oper_list.matrix[2][3] _pdbx_struct_oper_list.vector[2] _pdbx_struct_oper_list.matrix[3][1] _pdbx_struct_oper_list.matrix[3][2] _pdbx_struct_oper_list.matrix[3][3] _pdbx_struct_oper_list.vector[3] 1 'identity operation' 1_555 x,y,z 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 2 'crystal symmetry operation' 1_655 x+1,y,z 1.0000000000 0.0000000000 0.0000000000 78.7860000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 3 'crystal symmetry operation' 3_645 -x+1,y-1/2,-z+1/2 -1.0000000000 0.0000000000 0.0000000000 78.7860000000 0.0000000000 1.0000000000 0.0000000000 -78.6530000000 0.0000000000 0.0000000000 -1.0000000000 84.3805000000 # _pdbx_struct_conn_angle.id 1 _pdbx_struct_conn_angle.ptnr1_label_atom_id NE2 _pdbx_struct_conn_angle.ptnr1_label_alt_id ? _pdbx_struct_conn_angle.ptnr1_label_asym_id A _pdbx_struct_conn_angle.ptnr1_label_comp_id HIS _pdbx_struct_conn_angle.ptnr1_label_seq_id 222 _pdbx_struct_conn_angle.ptnr1_auth_atom_id ? _pdbx_struct_conn_angle.ptnr1_auth_asym_id A _pdbx_struct_conn_angle.ptnr1_auth_comp_id HIS _pdbx_struct_conn_angle.ptnr1_auth_seq_id 281 _pdbx_struct_conn_angle.ptnr1_PDB_ins_code ? _pdbx_struct_conn_angle.ptnr1_symmetry 1_555 _pdbx_struct_conn_angle.ptnr2_label_atom_id NI _pdbx_struct_conn_angle.ptnr2_label_alt_id ? _pdbx_struct_conn_angle.ptnr2_label_asym_id J _pdbx_struct_conn_angle.ptnr2_label_comp_id NI _pdbx_struct_conn_angle.ptnr2_label_seq_id . _pdbx_struct_conn_angle.ptnr2_auth_atom_id ? _pdbx_struct_conn_angle.ptnr2_auth_asym_id A _pdbx_struct_conn_angle.ptnr2_auth_comp_id NI _pdbx_struct_conn_angle.ptnr2_auth_seq_id 606 _pdbx_struct_conn_angle.ptnr2_PDB_ins_code ? _pdbx_struct_conn_angle.ptnr2_symmetry 1_555 _pdbx_struct_conn_angle.ptnr3_label_atom_id O _pdbx_struct_conn_angle.ptnr3_label_alt_id ? _pdbx_struct_conn_angle.ptnr3_label_asym_id AA _pdbx_struct_conn_angle.ptnr3_label_comp_id HOH _pdbx_struct_conn_angle.ptnr3_label_seq_id . _pdbx_struct_conn_angle.ptnr3_auth_atom_id ? _pdbx_struct_conn_angle.ptnr3_auth_asym_id A _pdbx_struct_conn_angle.ptnr3_auth_comp_id HOH _pdbx_struct_conn_angle.ptnr3_auth_seq_id 710 _pdbx_struct_conn_angle.ptnr3_PDB_ins_code ? _pdbx_struct_conn_angle.ptnr3_symmetry 1_555 _pdbx_struct_conn_angle.value 135.5 _pdbx_struct_conn_angle.value_esd ? # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2013-06-26 2 'Structure model' 1 1 2013-07-10 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Database references' # _pdbx_refine_tls.pdbx_refine_id 'X-RAY DIFFRACTION' _pdbx_refine_tls.id 1 _pdbx_refine_tls.details ? _pdbx_refine_tls.method refined _pdbx_refine_tls.origin_x 11.4164 _pdbx_refine_tls.origin_y 48.7857 _pdbx_refine_tls.origin_z 52.4373 _pdbx_refine_tls.T[1][1] 0.3261 _pdbx_refine_tls.T[2][2] 0.4034 _pdbx_refine_tls.T[3][3] 0.5801 _pdbx_refine_tls.T[1][2] -0.0472 _pdbx_refine_tls.T[1][3] -0.0070 _pdbx_refine_tls.T[2][3] -0.0049 _pdbx_refine_tls.L[1][1] -0.0421 _pdbx_refine_tls.L[2][2] 0.0721 _pdbx_refine_tls.L[3][3] 0.0421 _pdbx_refine_tls.L[1][2] -0.1653 _pdbx_refine_tls.L[1][3] -0.0132 _pdbx_refine_tls.L[2][3] 0.0265 _pdbx_refine_tls.S[1][1] 0.0382 _pdbx_refine_tls.S[1][2] -0.0163 _pdbx_refine_tls.S[1][3] -0.1639 _pdbx_refine_tls.S[2][1] -0.0385 _pdbx_refine_tls.S[2][2] -0.0335 _pdbx_refine_tls.S[2][3] 0.1888 _pdbx_refine_tls.S[3][1] 0.0064 _pdbx_refine_tls.S[3][2] -0.0601 _pdbx_refine_tls.S[3][3] -0.0077 # _pdbx_refine_tls_group.pdbx_refine_id 'X-RAY DIFFRACTION' _pdbx_refine_tls_group.id 1 _pdbx_refine_tls_group.refine_tls_id 1 _pdbx_refine_tls_group.beg_auth_asym_id ? _pdbx_refine_tls_group.beg_auth_seq_id ? _pdbx_refine_tls_group.beg_label_asym_id ? _pdbx_refine_tls_group.beg_label_seq_id ? _pdbx_refine_tls_group.end_auth_asym_id ? _pdbx_refine_tls_group.end_auth_seq_id ? _pdbx_refine_tls_group.end_label_asym_id ? _pdbx_refine_tls_group.end_label_seq_id ? _pdbx_refine_tls_group.selection ? _pdbx_refine_tls_group.selection_details all # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal HKL-2000 'data collection' . ? 1 PHENIX 'model building' . ? 2 PHENIX refinement '(phenix.refine: 1.8.1_1168)' ? 3 HKL-2000 'data reduction' . ? 4 HKL-2000 'data scaling' . ? 5 PHENIX phasing . ? 6 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 O B THR 419 ? ? O B HOH 722 ? ? 1.97 2 1 ND2 C ASN 113 ? ? C2 C NAG 601 ? ? 1.99 3 1 N B PHE 423 ? ? O B HOH 722 ? ? 2.12 4 1 OD1 B ASP 150 ? ? NH1 B ARG 231 ? ? 2.12 5 1 CG C ASN 113 ? ? C1 C NAG 601 ? ? 2.13 6 1 NH1 B ARG 306 ? ? OE2 B GLU 371 ? ? 2.15 7 1 NH1 D ARG 306 ? ? OE2 D GLU 371 ? ? 2.16 8 1 NH1 A ARG 306 ? ? OE1 A GLU 371 ? ? 2.18 9 1 ND2 C ASN 242 ? ? C2 C NAG 604 ? ? 2.18 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 ASN A 80 ? ? -85.74 38.74 2 1 PHE A 83 ? ? -132.41 -81.60 3 1 SER A 84 ? ? 78.29 152.60 4 1 LYS A 111 ? ? -61.60 -70.20 5 1 GLU A 130 ? ? -19.98 54.48 6 1 ARG A 195 ? ? -108.56 -79.60 7 1 LEU A 247 ? ? -109.96 -67.24 8 1 SER A 271 ? ? 59.06 -165.10 9 1 ASP A 366 ? ? -95.21 35.16 10 1 ASP A 378 ? ? 66.84 -76.41 11 1 LEU A 379 ? ? -35.72 149.42 12 1 ASP A 387 ? ? 53.19 71.42 13 1 ASN B 80 ? ? -86.33 38.21 14 1 LYS B 111 ? ? -59.44 -73.68 15 1 GLU B 121 ? ? -47.31 59.04 16 1 LYS B 122 ? ? -175.96 -40.60 17 1 GLU B 124 ? ? 60.96 -23.40 18 1 GLU B 130 ? ? 31.36 51.75 19 1 ASP B 149 ? ? 62.77 96.53 20 1 ARG B 195 ? ? -118.41 -80.35 21 1 LEU B 247 ? ? -109.63 -67.05 22 1 SER B 271 ? ? 59.81 -165.45 23 1 ASP B 366 ? ? -94.98 35.76 24 1 ASP B 387 ? ? 54.10 71.20 25 1 LYS B 428 ? ? 72.24 -0.03 26 1 ASN C 80 ? ? -86.48 40.54 27 1 LYS C 111 ? ? -59.87 -71.83 28 1 THR C 175 ? ? -124.61 -54.45 29 1 ARG C 195 ? ? -121.21 -81.48 30 1 LEU C 247 ? ? -109.57 -66.61 31 1 SER C 271 ? ? 58.76 -166.63 32 1 ASP C 366 ? ? -94.88 35.72 33 1 ASN C 377 ? ? -50.90 -81.65 34 1 ASP C 378 ? ? -54.27 -77.25 35 1 LEU C 379 ? ? -28.24 148.47 36 1 ASP C 387 ? ? 54.87 71.20 37 1 ASN D 80 ? ? -86.10 37.74 38 1 LYS D 111 ? ? -60.31 -72.09 39 1 ASP D 149 ? ? -165.67 97.34 40 1 THR D 175 ? ? -123.95 -66.32 41 1 ARG D 195 ? ? -114.25 -80.84 42 1 LEU D 247 ? ? -109.99 -67.24 43 1 SER D 271 ? ? 60.27 -164.76 44 1 LYS D 320 ? ? -76.97 -70.05 45 1 ASP D 366 ? ? -94.86 35.46 46 1 ASP D 378 ? ? -127.12 -169.05 47 1 LEU D 379 ? ? 66.84 151.43 48 1 ASP D 387 ? ? 52.99 71.94 # _pdbx_validate_chiral.id 1 _pdbx_validate_chiral.PDB_model_num 1 _pdbx_validate_chiral.auth_atom_id C1 _pdbx_validate_chiral.label_alt_id ? _pdbx_validate_chiral.auth_asym_id B _pdbx_validate_chiral.auth_comp_id BMA _pdbx_validate_chiral.auth_seq_id 603 _pdbx_validate_chiral.PDB_ins_code ? _pdbx_validate_chiral.details PLANAR _pdbx_validate_chiral.omega . # loop_ _pdbx_unobs_or_zero_occ_residues.id _pdbx_unobs_or_zero_occ_residues.PDB_model_num _pdbx_unobs_or_zero_occ_residues.polymer_flag _pdbx_unobs_or_zero_occ_residues.occupancy_flag _pdbx_unobs_or_zero_occ_residues.auth_asym_id _pdbx_unobs_or_zero_occ_residues.auth_comp_id _pdbx_unobs_or_zero_occ_residues.auth_seq_id _pdbx_unobs_or_zero_occ_residues.PDB_ins_code _pdbx_unobs_or_zero_occ_residues.label_asym_id _pdbx_unobs_or_zero_occ_residues.label_comp_id _pdbx_unobs_or_zero_occ_residues.label_seq_id 1 1 Y 1 A SER 60 ? A SER 1 2 1 Y 1 A LEU 61 ? A LEU 2 3 1 Y 1 A LYS 122 ? A LYS 63 4 1 Y 1 A SER 123 ? A SER 64 5 1 Y 1 A GLU 124 ? A GLU 65 6 1 Y 1 A GLN 125 ? A GLN 66 7 1 Y 1 A ARG 126 ? A ARG 67 8 1 Y 1 A ASN 127 ? A ASN 68 9 1 Y 1 A VAL 128 ? A VAL 69 10 1 Y 1 A GLY 174 ? A GLY 115 11 1 Y 1 A VAL 488 ? A VAL 429 12 1 Y 1 A SER 489 ? A SER 430 13 1 Y 1 A ASP 490 ? A ASP 431 14 1 Y 1 A ALA 491 ? A ALA 432 15 1 Y 1 A GLU 492 ? A GLU 433 16 1 Y 1 A GLN 493 ? A GLN 434 17 1 Y 1 A ASN 494 ? A ASN 435 18 1 Y 1 A ASP 495 ? A ASP 436 19 1 Y 1 A GLU 496 ? A GLU 437 20 1 Y 1 A GLU 497 ? A GLU 438 21 1 Y 1 A GLN 498 ? A GLN 439 22 1 Y 1 A SER 499 ? A SER 440 23 1 Y 1 A GLU 500 ? A GLU 441 24 1 Y 1 A GLU 501 ? A GLU 442 25 1 Y 1 A HIS 502 ? A HIS 443 26 1 Y 1 A GLN 503 ? A GLN 444 27 1 Y 1 A ASP 504 ? A ASP 445 28 1 Y 1 A LYS 505 ? A LYS 446 29 1 Y 1 A LYS 506 ? A LYS 447 30 1 Y 1 A ASP 507 ? A ASP 448 31 1 Y 1 A ASP 508 ? A ASP 449 32 1 Y 1 A LYS 509 ? A LYS 450 33 1 Y 1 A LYS 510 ? A LYS 451 34 1 Y 1 A THR 511 ? A THR 452 35 1 Y 1 A VAL 512 ? A VAL 453 36 1 Y 1 B SER 60 ? B SER 1 37 1 Y 1 B LEU 61 ? B LEU 2 38 1 Y 1 B VAL 488 ? B VAL 429 39 1 Y 1 B SER 489 ? B SER 430 40 1 Y 1 B ASP 490 ? B ASP 431 41 1 Y 1 B ALA 491 ? B ALA 432 42 1 Y 1 B GLU 492 ? B GLU 433 43 1 Y 1 B GLN 493 ? B GLN 434 44 1 Y 1 B ASN 494 ? B ASN 435 45 1 Y 1 B ASP 495 ? B ASP 436 46 1 Y 1 B GLU 496 ? B GLU 437 47 1 Y 1 B GLU 497 ? B GLU 438 48 1 Y 1 B GLN 498 ? B GLN 439 49 1 Y 1 B SER 499 ? B SER 440 50 1 Y 1 B GLU 500 ? B GLU 441 51 1 Y 1 B GLU 501 ? B GLU 442 52 1 Y 1 B HIS 502 ? B HIS 443 53 1 Y 1 B GLN 503 ? B GLN 444 54 1 Y 1 B ASP 504 ? B ASP 445 55 1 Y 1 B LYS 505 ? B LYS 446 56 1 Y 1 B LYS 506 ? B LYS 447 57 1 Y 1 B ASP 507 ? B ASP 448 58 1 Y 1 B ASP 508 ? B ASP 449 59 1 Y 1 B LYS 509 ? B LYS 450 60 1 Y 1 B LYS 510 ? B LYS 451 61 1 Y 1 B THR 511 ? B THR 452 62 1 Y 1 B VAL 512 ? B VAL 453 63 1 Y 1 C SER 60 ? C SER 1 64 1 Y 1 C LEU 61 ? C LEU 2 65 1 Y 1 C GLU 121 ? C GLU 62 66 1 Y 1 C LYS 122 ? C LYS 63 67 1 Y 1 C SER 123 ? C SER 64 68 1 Y 1 C GLU 124 ? C GLU 65 69 1 Y 1 C GLN 125 ? C GLN 66 70 1 Y 1 C ARG 126 ? C ARG 67 71 1 Y 1 C ASN 127 ? C ASN 68 72 1 Y 1 C VAL 128 ? C VAL 69 73 1 Y 1 C PRO 129 ? C PRO 70 74 1 Y 1 C ASP 490 ? C ASP 431 75 1 Y 1 C ALA 491 ? C ALA 432 76 1 Y 1 C GLU 492 ? C GLU 433 77 1 Y 1 C GLN 493 ? C GLN 434 78 1 Y 1 C ASN 494 ? C ASN 435 79 1 Y 1 C ASP 495 ? C ASP 436 80 1 Y 1 C GLU 496 ? C GLU 437 81 1 Y 1 C GLU 497 ? C GLU 438 82 1 Y 1 C GLN 498 ? C GLN 439 83 1 Y 1 C SER 499 ? C SER 440 84 1 Y 1 C GLU 500 ? C GLU 441 85 1 Y 1 C GLU 501 ? C GLU 442 86 1 Y 1 C HIS 502 ? C HIS 443 87 1 Y 1 C GLN 503 ? C GLN 444 88 1 Y 1 C ASP 504 ? C ASP 445 89 1 Y 1 C LYS 505 ? C LYS 446 90 1 Y 1 C LYS 506 ? C LYS 447 91 1 Y 1 C ASP 507 ? C ASP 448 92 1 Y 1 C ASP 508 ? C ASP 449 93 1 Y 1 C LYS 509 ? C LYS 450 94 1 Y 1 C LYS 510 ? C LYS 451 95 1 Y 1 C THR 511 ? C THR 452 96 1 Y 1 C VAL 512 ? C VAL 453 97 1 Y 1 D SER 60 ? D SER 1 98 1 Y 1 D TRP 120 ? D TRP 61 99 1 Y 1 D GLU 121 ? D GLU 62 100 1 Y 1 D LYS 122 ? D LYS 63 101 1 Y 1 D SER 123 ? D SER 64 102 1 Y 1 D GLU 124 ? D GLU 65 103 1 Y 1 D GLN 125 ? D GLN 66 104 1 Y 1 D ARG 126 ? D ARG 67 105 1 Y 1 D ASN 127 ? D ASN 68 106 1 Y 1 D VAL 128 ? D VAL 69 107 1 Y 1 D PRO 129 ? D PRO 70 108 1 Y 1 D ASP 487 ? D ASP 428 109 1 Y 1 D VAL 488 ? D VAL 429 110 1 Y 1 D SER 489 ? D SER 430 111 1 Y 1 D ASP 490 ? D ASP 431 112 1 Y 1 D ALA 491 ? D ALA 432 113 1 Y 1 D GLU 492 ? D GLU 433 114 1 Y 1 D GLN 493 ? D GLN 434 115 1 Y 1 D ASN 494 ? D ASN 435 116 1 Y 1 D ASP 495 ? D ASP 436 117 1 Y 1 D GLU 496 ? D GLU 437 118 1 Y 1 D GLU 497 ? D GLU 438 119 1 Y 1 D GLN 498 ? D GLN 439 120 1 Y 1 D SER 499 ? D SER 440 121 1 Y 1 D GLU 500 ? D GLU 441 122 1 Y 1 D GLU 501 ? D GLU 442 123 1 Y 1 D HIS 502 ? D HIS 443 124 1 Y 1 D GLN 503 ? D GLN 444 125 1 Y 1 D ASP 504 ? D ASP 445 126 1 Y 1 D LYS 505 ? D LYS 446 127 1 Y 1 D LYS 506 ? D LYS 447 128 1 Y 1 D ASP 507 ? D ASP 448 129 1 Y 1 D ASP 508 ? D ASP 449 130 1 Y 1 D LYS 509 ? D LYS 450 131 1 Y 1 D LYS 510 ? D LYS 451 132 1 Y 1 D THR 511 ? D THR 452 133 1 Y 1 D VAL 512 ? D VAL 453 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 BETA-D-MANNOSE BMA 4 'NICKEL (II) ION' NI 5 water HOH #