data_4WNX # _entry.id 4WNX # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.287 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4WNX WWPDB D_1000203271 # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 4WNX _pdbx_database_status.recvd_initial_deposition_date 2014-10-14 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'McDougall, M.' 1 'Patel, T.' 2 'Reuten, R.' 3 'Meier, M.' 4 'Koch, M.' 5 'Stetefeld, J.' 6 # _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country UK _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev 'Nat Commun' _citation.journal_id_ASTM ? _citation.journal_id_CSD ? _citation.journal_id_ISSN 2041-1723 _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 7 _citation.language ? _citation.page_first 13515 _citation.page_last 13515 _citation.title 'Structural decoding of netrin-4 reveals a regulatory function towards mature basement membranes.' _citation.year 2016 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1038/ncomms13515 _citation.pdbx_database_id_PubMed 27901020 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Reuten, R.' 1 primary 'Patel, T.R.' 2 primary 'McDougall, M.' 3 primary 'Rama, N.' 4 primary 'Nikodemus, D.' 5 primary 'Gibert, B.' 6 primary 'Delcros, J.G.' 7 primary 'Prein, C.' 8 primary 'Meier, M.' 9 primary 'Metzger, S.' 10 primary 'Zhou, Z.' 11 primary 'Kaltenberg, J.' 12 primary 'McKee, K.K.' 13 primary 'Bald, T.' 14 primary 'Tuting, T.' 15 primary 'Zigrino, P.' 16 primary 'Djonov, V.' 17 primary 'Bloch, W.' 18 primary 'Clausen-Schaumann, H.' 19 primary 'Poschl, E.' 20 primary 'Yurchenco, P.D.' 21 primary 'Ehrbar, M.' 22 primary 'Mehlen, P.' 23 primary 'Stetefeld, J.' 24 primary 'Koch, M.' 25 # _cell.length_a 107.755 _cell.length_b 75.049 _cell.length_c 74.672 _cell.angle_alpha 90.000 _cell.angle_beta 96.070 _cell.angle_gamma 90.000 _cell.entry_id 4WNX _cell.Z_PDB 4 _cell.pdbx_unique_axis ? # _symmetry.entry_id 4WNX _symmetry.cell_setting ? _symmetry.Int_Tables_number 5 _symmetry.space_group_name_Hall ? _symmetry.space_group_name_H-M 'C 1 2 1' _symmetry.pdbx_full_space_group_name_H-M ? # 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 Netrin-4 48149.602 1 ? ? ? ? 2 non-polymer syn N-ACETYL-D-GLUCOSAMINE 221.208 6 ? ? ? ? 3 non-polymer syn 'CALCIUM ION' 40.078 1 ? ? ? ? 4 non-polymer syn 'TRIS(HYDROXYETHYL)AMINOMETHANE' 163.215 1 ? ? ? ? 5 water nat water 18.015 27 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name Beta-netrin # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code ;CEKACNPRMGNLALGRKLRADTMCGQNATELFCFYSENADLTCRQPKCDKCNAAHSHLAHPPSAMADSSFRFPRTWWQSA EDVHREKIQLDLEAEFYFTHLIMVFKSPRPAAMVLDRSQDFGKTWKPYKYFATNCSATFGLEDDVVKKGAICTSRYSNPF PCTGGEVIFRALSPPYDIENPYSAKVQEQLKITNLRVRLLKRQSCPCQINDLNAKPHHFMHYAVYDFIVKGSCFCNGHAD QCLPVEGFRPIKAPGAFHVVHGRCMCKHNTAGSHCQHCAPLYNDRPWEAADGRTGAPNECRTCKCNGHADTCHFDVNVWE ASGNRSGGVCNNCQHNTEGQHCQRCKPGFYRDLRRPFSAPDACKACSCHPVGSAILPFSSVTFCDPSNGDCPCKPGVAGP HCDRCMVGYWGFGDYGCRPCDCAGSCDPLTGDC ; _entity_poly.pdbx_seq_one_letter_code_can ;CEKACNPRMGNLALGRKLRADTMCGQNATELFCFYSENADLTCRQPKCDKCNAAHSHLAHPPSAMADSSFRFPRTWWQSA EDVHREKIQLDLEAEFYFTHLIMVFKSPRPAAMVLDRSQDFGKTWKPYKYFATNCSATFGLEDDVVKKGAICTSRYSNPF PCTGGEVIFRALSPPYDIENPYSAKVQEQLKITNLRVRLLKRQSCPCQINDLNAKPHHFMHYAVYDFIVKGSCFCNGHAD QCLPVEGFRPIKAPGAFHVVHGRCMCKHNTAGSHCQHCAPLYNDRPWEAADGRTGAPNECRTCKCNGHADTCHFDVNVWE ASGNRSGGVCNNCQHNTEGQHCQRCKPGFYRDLRRPFSAPDACKACSCHPVGSAILPFSSVTFCDPSNGDCPCKPGVAGP HCDRCMVGYWGFGDYGCRPCDCAGSCDPLTGDC ; _entity_poly.pdbx_strand_id A _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 CYS n 1 2 GLU n 1 3 LYS n 1 4 ALA n 1 5 CYS n 1 6 ASN n 1 7 PRO n 1 8 ARG n 1 9 MET n 1 10 GLY n 1 11 ASN n 1 12 LEU n 1 13 ALA n 1 14 LEU n 1 15 GLY n 1 16 ARG n 1 17 LYS n 1 18 LEU n 1 19 ARG n 1 20 ALA n 1 21 ASP n 1 22 THR n 1 23 MET n 1 24 CYS n 1 25 GLY n 1 26 GLN n 1 27 ASN n 1 28 ALA n 1 29 THR n 1 30 GLU n 1 31 LEU n 1 32 PHE n 1 33 CYS n 1 34 PHE n 1 35 TYR n 1 36 SER n 1 37 GLU n 1 38 ASN n 1 39 ALA n 1 40 ASP n 1 41 LEU n 1 42 THR n 1 43 CYS n 1 44 ARG n 1 45 GLN n 1 46 PRO n 1 47 LYS n 1 48 CYS n 1 49 ASP n 1 50 LYS n 1 51 CYS n 1 52 ASN n 1 53 ALA n 1 54 ALA n 1 55 HIS n 1 56 SER n 1 57 HIS n 1 58 LEU n 1 59 ALA n 1 60 HIS n 1 61 PRO n 1 62 PRO n 1 63 SER n 1 64 ALA n 1 65 MET n 1 66 ALA n 1 67 ASP n 1 68 SER n 1 69 SER n 1 70 PHE n 1 71 ARG n 1 72 PHE n 1 73 PRO n 1 74 ARG n 1 75 THR n 1 76 TRP n 1 77 TRP n 1 78 GLN n 1 79 SER n 1 80 ALA n 1 81 GLU n 1 82 ASP n 1 83 VAL n 1 84 HIS n 1 85 ARG n 1 86 GLU n 1 87 LYS n 1 88 ILE n 1 89 GLN n 1 90 LEU n 1 91 ASP n 1 92 LEU n 1 93 GLU n 1 94 ALA n 1 95 GLU n 1 96 PHE n 1 97 TYR n 1 98 PHE n 1 99 THR n 1 100 HIS n 1 101 LEU n 1 102 ILE n 1 103 MET n 1 104 VAL n 1 105 PHE n 1 106 LYS n 1 107 SER n 1 108 PRO n 1 109 ARG n 1 110 PRO n 1 111 ALA n 1 112 ALA n 1 113 MET n 1 114 VAL n 1 115 LEU n 1 116 ASP n 1 117 ARG n 1 118 SER n 1 119 GLN n 1 120 ASP n 1 121 PHE n 1 122 GLY n 1 123 LYS n 1 124 THR n 1 125 TRP n 1 126 LYS n 1 127 PRO n 1 128 TYR n 1 129 LYS n 1 130 TYR n 1 131 PHE n 1 132 ALA n 1 133 THR n 1 134 ASN n 1 135 CYS n 1 136 SER n 1 137 ALA n 1 138 THR n 1 139 PHE n 1 140 GLY n 1 141 LEU n 1 142 GLU n 1 143 ASP n 1 144 ASP n 1 145 VAL n 1 146 VAL n 1 147 LYS n 1 148 LYS n 1 149 GLY n 1 150 ALA n 1 151 ILE n 1 152 CYS n 1 153 THR n 1 154 SER n 1 155 ARG n 1 156 TYR n 1 157 SER n 1 158 ASN n 1 159 PRO n 1 160 PHE n 1 161 PRO n 1 162 CYS n 1 163 THR n 1 164 GLY n 1 165 GLY n 1 166 GLU n 1 167 VAL n 1 168 ILE n 1 169 PHE n 1 170 ARG n 1 171 ALA n 1 172 LEU n 1 173 SER n 1 174 PRO n 1 175 PRO n 1 176 TYR n 1 177 ASP n 1 178 ILE n 1 179 GLU n 1 180 ASN n 1 181 PRO n 1 182 TYR n 1 183 SER n 1 184 ALA n 1 185 LYS n 1 186 VAL n 1 187 GLN n 1 188 GLU n 1 189 GLN n 1 190 LEU n 1 191 LYS n 1 192 ILE n 1 193 THR n 1 194 ASN n 1 195 LEU n 1 196 ARG n 1 197 VAL n 1 198 ARG n 1 199 LEU n 1 200 LEU n 1 201 LYS n 1 202 ARG n 1 203 GLN n 1 204 SER n 1 205 CYS n 1 206 PRO n 1 207 CYS n 1 208 GLN n 1 209 ILE n 1 210 ASN n 1 211 ASP n 1 212 LEU n 1 213 ASN n 1 214 ALA n 1 215 LYS n 1 216 PRO n 1 217 HIS n 1 218 HIS n 1 219 PHE n 1 220 MET n 1 221 HIS n 1 222 TYR n 1 223 ALA n 1 224 VAL n 1 225 TYR n 1 226 ASP n 1 227 PHE n 1 228 ILE n 1 229 VAL n 1 230 LYS n 1 231 GLY n 1 232 SER n 1 233 CYS n 1 234 PHE n 1 235 CYS n 1 236 ASN n 1 237 GLY n 1 238 HIS n 1 239 ALA n 1 240 ASP n 1 241 GLN n 1 242 CYS n 1 243 LEU n 1 244 PRO n 1 245 VAL n 1 246 GLU n 1 247 GLY n 1 248 PHE n 1 249 ARG n 1 250 PRO n 1 251 ILE n 1 252 LYS n 1 253 ALA n 1 254 PRO n 1 255 GLY n 1 256 ALA n 1 257 PHE n 1 258 HIS n 1 259 VAL n 1 260 VAL n 1 261 HIS n 1 262 GLY n 1 263 ARG n 1 264 CYS n 1 265 MET n 1 266 CYS n 1 267 LYS n 1 268 HIS n 1 269 ASN n 1 270 THR n 1 271 ALA n 1 272 GLY n 1 273 SER n 1 274 HIS n 1 275 CYS n 1 276 GLN n 1 277 HIS n 1 278 CYS n 1 279 ALA n 1 280 PRO n 1 281 LEU n 1 282 TYR n 1 283 ASN n 1 284 ASP n 1 285 ARG n 1 286 PRO n 1 287 TRP n 1 288 GLU n 1 289 ALA n 1 290 ALA n 1 291 ASP n 1 292 GLY n 1 293 ARG n 1 294 THR n 1 295 GLY n 1 296 ALA n 1 297 PRO n 1 298 ASN n 1 299 GLU n 1 300 CYS n 1 301 ARG n 1 302 THR n 1 303 CYS n 1 304 LYS n 1 305 CYS n 1 306 ASN n 1 307 GLY n 1 308 HIS n 1 309 ALA n 1 310 ASP n 1 311 THR n 1 312 CYS n 1 313 HIS n 1 314 PHE n 1 315 ASP n 1 316 VAL n 1 317 ASN n 1 318 VAL n 1 319 TRP n 1 320 GLU n 1 321 ALA n 1 322 SER n 1 323 GLY n 1 324 ASN n 1 325 ARG n 1 326 SER n 1 327 GLY n 1 328 GLY n 1 329 VAL n 1 330 CYS n 1 331 ASN n 1 332 ASN n 1 333 CYS n 1 334 GLN n 1 335 HIS n 1 336 ASN n 1 337 THR n 1 338 GLU n 1 339 GLY n 1 340 GLN n 1 341 HIS n 1 342 CYS n 1 343 GLN n 1 344 ARG n 1 345 CYS n 1 346 LYS n 1 347 PRO n 1 348 GLY n 1 349 PHE n 1 350 TYR n 1 351 ARG n 1 352 ASP n 1 353 LEU n 1 354 ARG n 1 355 ARG n 1 356 PRO n 1 357 PHE n 1 358 SER n 1 359 ALA n 1 360 PRO n 1 361 ASP n 1 362 ALA n 1 363 CYS n 1 364 LYS n 1 365 ALA n 1 366 CYS n 1 367 SER n 1 368 CYS n 1 369 HIS n 1 370 PRO n 1 371 VAL n 1 372 GLY n 1 373 SER n 1 374 ALA n 1 375 ILE n 1 376 LEU n 1 377 PRO n 1 378 PHE n 1 379 SER n 1 380 SER n 1 381 VAL n 1 382 THR n 1 383 PHE n 1 384 CYS n 1 385 ASP n 1 386 PRO n 1 387 SER n 1 388 ASN n 1 389 GLY n 1 390 ASP n 1 391 CYS n 1 392 PRO n 1 393 CYS n 1 394 LYS n 1 395 PRO n 1 396 GLY n 1 397 VAL n 1 398 ALA n 1 399 GLY n 1 400 PRO n 1 401 HIS n 1 402 CYS n 1 403 ASP n 1 404 ARG n 1 405 CYS n 1 406 MET n 1 407 VAL n 1 408 GLY n 1 409 TYR n 1 410 TRP n 1 411 GLY n 1 412 PHE n 1 413 GLY n 1 414 ASP n 1 415 TYR n 1 416 GLY n 1 417 CYS n 1 418 ARG n 1 419 PRO n 1 420 CYS n 1 421 ASP n 1 422 CYS n 1 423 ALA n 1 424 GLY n 1 425 SER n 1 426 CYS n 1 427 ASP n 1 428 PRO n 1 429 LEU n 1 430 THR n 1 431 GLY n 1 432 ASP n 1 433 CYS 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 'Biological sequence' _entity_src_gen.pdbx_beg_seq_num 1 _entity_src_gen.pdbx_end_seq_num 433 _entity_src_gen.gene_src_common_name Mouse _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene Ntn4 _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 'Mus musculus' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 10090 _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 'Homo sapiens' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 9606 _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 HEK293 _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 pCEP _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code NET4_MOUSE _struct_ref.pdbx_db_accession Q9JI33 _struct_ref.pdbx_db_isoform ? _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;CEKACNPRMGNLALGRKLRADTMCGQNATELFCFYSENADLTCRQPKCDKCNAAHSHLAHPPSAMADSSFRFPRTWWQSA EDVHREKIQLDLEAEFYFTHLIMVFKSPRPAAMVLDRSQDFGKTWKPYKYFATNCSATFGLEDDVVKKGAICTSRYSNPF PCTGGEVIFRALSPPYDIENPYSAKVQEQLKITNLRVRLLKRQSCPCQINDLNAKPHHFMHYAVYDFIVKGSCFCNGHAD QCLPVEGFRPIKAPGAFHVVHGRCMCKHNTAGSHCQHCAPLYNDRPWEAADGRTGAPNECRTCKCNGHADTCHFDVNVWE ASGNRSGGVCNNCQHNTEGQHCQRCKPGFYRDLRRPFSAPDACKACSCHPVGSAILPFSSVTFCDPSNGDCPCKPGVAGP HCDRCMVGYWGFGDYGCRPCDCAGSCDPLTGDC ; _struct_ref.pdbx_align_begin 30 # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 4WNX _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 433 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession Q9JI33 _struct_ref_seq.db_align_beg 30 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 462 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 30 _struct_ref_seq.pdbx_auth_seq_align_end 462 # 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 CA non-polymer . 'CALCIUM ION' ? 'Ca 2' 40.078 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 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 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 TAM non-polymer . 'TRIS(HYDROXYETHYL)AMINOMETHANE' ? 'C7 H17 N O3' 163.215 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.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 4WNX _exptl.crystals_number 1 _exptl.details ? _exptl.method 'X-RAY DIFFRACTION' _exptl.method_details ? # _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 2.88 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 57.27 _exptl_crystal.description 'Thin Plates' _exptl_crystal.F_000 ? _exptl_crystal.id 1 _exptl_crystal.preparation ? _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.colour_lustre ? _exptl_crystal.colour_modifier ? _exptl_crystal.colour_primary ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_esd ? _exptl_crystal.density_meas_gt ? _exptl_crystal.density_meas_lt ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_meas_temp_esd ? _exptl_crystal.density_meas_temp_gt ? _exptl_crystal.density_meas_temp_lt ? _exptl_crystal.pdbx_crystal_image_url ? _exptl_crystal.pdbx_crystal_image_format ? _exptl_crystal.pdbx_mosaicity ? _exptl_crystal.pdbx_mosaicity_esd ? # _exptl_crystal_grow.apparatus ? _exptl_crystal_grow.atmosphere ? _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.details ? _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH 6.5 _exptl_crystal_grow.pressure ? _exptl_crystal_grow.pressure_esd ? _exptl_crystal_grow.seeding ? _exptl_crystal_grow.seeding_ref ? _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.temp_esd ? _exptl_crystal_grow.time ? _exptl_crystal_grow.pdbx_details 'PEG3350, calcium acetate, sodium cacodylate, NDSB-256' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.ambient_environment ? _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.ambient_temp_esd ? _diffrn.crystal_id 1 _diffrn.crystal_support ? _diffrn.crystal_treatment ? _diffrn.details ? _diffrn.id 1 _diffrn.ambient_pressure ? _diffrn.ambient_pressure_esd ? _diffrn.ambient_pressure_gt ? _diffrn.ambient_pressure_lt ? _diffrn.ambient_temp_gt ? _diffrn.ambient_temp_lt ? # _diffrn_detector.details ? _diffrn_detector.detector 'IMAGE PLATE' _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'RIGAKU RAXIS IV++' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2013-07-16 # _diffrn_radiation.collimation ? _diffrn_radiation.diffrn_id 1 _diffrn_radiation.filter_edge ? _diffrn_radiation.inhomogeneity ? _diffrn_radiation.monochromator ? _diffrn_radiation.polarisn_norm ? _diffrn_radiation.polarisn_ratio ? _diffrn_radiation.probe ? _diffrn_radiation.type ? _diffrn_radiation.xray_symbol ? _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_wavelength_list ? _diffrn_radiation.pdbx_wavelength ? _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_analyzer ? _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.54178 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.current ? _diffrn_source.details ? _diffrn_source.diffrn_id 1 _diffrn_source.power ? _diffrn_source.size ? _diffrn_source.source 'ROTATING ANODE' _diffrn_source.target ? _diffrn_source.type 'RIGAKU MICROMAX-007 HF' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 1.54178 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline ? _diffrn_source.pdbx_synchrotron_site ? # _reflns.B_iso_Wilson_estimate 40.700 _reflns.entry_id 4WNX _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 2.72 _reflns.d_resolution_low 33.49 _reflns.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.number_all ? _reflns.number_obs 14673 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.percent_possible_obs 91.75 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 3.4 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 5.0 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all ? _reflns.pdbx_Rpim_I_all ? _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half ? _reflns.pdbx_R_split ? # _refine.aniso_B[1][1] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][2] ? _refine.aniso_B[2][3] ? _refine.aniso_B[3][3] ? _refine.B_iso_max 169.800 _refine.B_iso_mean 49.9657 _refine.B_iso_min 19.980 _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.details ? _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 4WNX _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_abs_structure_details ? _refine.ls_abs_structure_Flack ? _refine.ls_abs_structure_Flack_esd ? _refine.ls_abs_structure_Rogers ? _refine.ls_abs_structure_Rogers_esd ? _refine.ls_d_res_high 2.7230 _refine.ls_d_res_low 33.49 _refine.ls_extinction_coef ? _refine.ls_extinction_coef_esd ? _refine.ls_extinction_expression ? _refine.ls_extinction_method ? _refine.ls_goodness_of_fit_all ? _refine.ls_goodness_of_fit_all_esd ? _refine.ls_goodness_of_fit_obs ? _refine.ls_goodness_of_fit_obs_esd ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 14670 _refine.ls_number_reflns_R_free 740 _refine.ls_number_reflns_R_work 13930 _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 91.7600 _refine.ls_percent_reflns_R_free 5.0400 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.2219 _refine.ls_R_factor_R_free 0.2626 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.2198 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.340 _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model 4AQS _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_R_Free_selection_details 'Random selection' _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.pdbx_solvent_vdw_probe_radii 1.1100 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.9000 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error 28.0600 _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B ? _refine.overall_SU_ML 0.4000 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? # _refine_hist.cycle_id final _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.d_res_high 2.7230 _refine_hist.d_res_low 33.49 _refine_hist.pdbx_number_atoms_ligand 189 _refine_hist.number_atoms_solvent 27 _refine_hist.number_atoms_total 3475 _refine_hist.pdbx_number_residues_total 429 _refine_hist.pdbx_B_iso_mean_ligand 120.19 _refine_hist.pdbx_B_iso_mean_solvent 32.64 _refine_hist.pdbx_number_atoms_protein 3259 _refine_hist.pdbx_number_atoms_nucleic_acid 0 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.criterion _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.number _refine_ls_restr.rejects _refine_ls_restr.type _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' ? 0.003 ? 3471 ? f_bond_d ? ? 'X-RAY DIFFRACTION' ? 0.800 ? 4691 ? f_angle_d ? ? 'X-RAY DIFFRACTION' ? 0.047 ? 496 ? f_chiral_restr ? ? 'X-RAY DIFFRACTION' ? 0.004 ? 622 ? f_plane_restr ? ? 'X-RAY DIFFRACTION' ? 21.400 ? 2096 ? f_dihedral_angle_d ? ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.R_factor_all _refine_ls_shell.R_factor_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.R_factor_R_work _refine_ls_shell.redundancy_reflns_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.wR_factor_all _refine_ls_shell.wR_factor_obs _refine_ls_shell.wR_factor_R_free _refine_ls_shell.wR_factor_R_work _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.pdbx_phase_error 'X-RAY DIFFRACTION' 2.7230 2.9331 1837 . 83 1754 58.0000 . . . 0.3962 . 0.3359 . . . . . . 5 . 'X-RAY DIFFRACTION' 2.9331 3.2281 3194 . 167 3027 100.0000 . . . 0.3093 . 0.3028 . . . . . . 5 . 'X-RAY DIFFRACTION' 3.2281 3.6947 3179 . 163 3016 100.0000 . . . 0.3000 . 0.2348 . . . . . . 5 . 'X-RAY DIFFRACTION' 3.6947 4.6529 3206 . 169 3037 100.0000 . . . 0.2129 . 0.1841 . . . . . . 5 . 'X-RAY DIFFRACTION' 4.6529 33.4933 3254 . 158 3096 100.0000 . . . 0.2370 . 0.1805 . . . . . . 5 . # _struct.entry_id 4WNX _struct.title 'Netrin 4 lacking the C-terminal Domain' _struct.pdbx_descriptor Netrin-4 _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag ? # _struct_keywords.entry_id 4WNX _struct_keywords.text 'Basement Membrane, Laminin Binding, N-linked glycosylation, Epidermal Growth Factor Like Domain, Laminin Binding Protein' _struct_keywords.pdbx_keywords 'Laminin Binding Protein' # 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 2 ? C N N 2 ? D N N 2 ? E N N 2 ? F N N 2 ? G N N 2 ? H N N 3 ? I N N 4 ? J N N 5 ? # 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 AA1 PRO A 61 ? MET A 65 ? PRO A 90 MET A 94 5 ? 5 HELX_P HELX_P2 AA2 ASN A 134 ? PHE A 139 ? ASN A 163 PHE A 168 1 ? 6 HELX_P HELX_P3 AA3 ASP A 143 ? LYS A 148 ? ASP A 172 LYS A 177 1 ? 6 HELX_P HELX_P4 AA4 SER A 173 ? ILE A 178 ? SER A 202 ILE A 207 1 ? 6 HELX_P HELX_P5 AA5 SER A 183 ? LEU A 190 ? SER A 212 LEU A 219 1 ? 8 HELX_P HELX_P6 AA6 ASP A 315 ? SER A 322 ? ASP A 344 SER A 351 1 ? 8 HELX_P HELX_P7 AA7 ALA A 359 ? ASP A 361 ? ALA A 388 ASP A 390 5 ? 3 # _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 1 SG ? ? ? 1_555 A CYS 5 SG ? ? A CYS 30 A CYS 34 1_555 ? ? ? ? ? ? ? 2.029 ? disulf2 disulf ? ? A CYS 24 SG ? ? ? 1_555 A CYS 51 SG ? ? A CYS 53 A CYS 80 1_555 ? ? ? ? ? ? ? 2.030 ? disulf3 disulf ? ? A CYS 33 SG ? ? ? 1_555 A CYS 48 SG ? ? A CYS 62 A CYS 77 1_555 ? ? ? ? ? ? ? 2.031 ? disulf4 disulf ? ? A CYS 43 SG ? ? ? 1_555 A CYS 207 SG ? ? A CYS 72 A CYS 236 1_555 ? ? ? ? ? ? ? 2.032 ? disulf5 disulf ? ? A CYS 135 SG ? ? ? 1_555 A CYS 152 SG ? ? A CYS 164 A CYS 181 1_555 ? ? ? ? ? ? ? 2.033 ? disulf6 disulf ? ? A CYS 162 SG ? ? ? 1_555 A CYS 205 SG ? ? A CYS 191 A CYS 234 1_555 ? ? ? ? ? ? ? 2.031 ? disulf7 disulf ? ? A CYS 233 SG ? ? ? 1_555 A CYS 242 SG ? ? A CYS 262 A CYS 271 1_555 ? ? ? ? ? ? ? 2.034 ? disulf8 disulf ? ? A CYS 235 SG ? ? ? 1_555 A CYS 264 SG ? ? A CYS 264 A CYS 293 1_555 ? ? ? ? ? ? ? 2.031 ? disulf9 disulf ? ? A CYS 266 SG ? ? ? 1_555 A CYS 275 SG ? ? A CYS 295 A CYS 304 1_555 ? ? ? ? ? ? ? 2.033 ? disulf10 disulf ? ? A CYS 278 SG ? ? ? 1_555 A CYS 300 SG ? ? A CYS 307 A CYS 329 1_555 ? ? ? ? ? ? ? 2.036 ? disulf11 disulf ? ? A CYS 303 SG ? ? ? 1_555 A CYS 312 SG ? ? A CYS 332 A CYS 341 1_555 ? ? ? ? ? ? ? 2.033 ? disulf12 disulf ? ? A CYS 305 SG ? ? ? 1_555 A CYS 330 SG ? ? A CYS 334 A CYS 359 1_555 ? ? ? ? ? ? ? 2.030 ? disulf13 disulf ? ? A CYS 333 SG ? ? ? 1_555 A CYS 342 SG ? ? A CYS 362 A CYS 371 1_555 ? ? ? ? ? ? ? 2.034 ? disulf14 disulf ? ? A CYS 345 SG ? ? ? 1_555 A CYS 363 SG ? ? A CYS 374 A CYS 392 1_555 ? ? ? ? ? ? ? 2.034 ? disulf15 disulf ? ? A CYS 366 SG ? ? ? 1_555 A CYS 384 SG ? ? A CYS 395 A CYS 413 1_555 ? ? ? ? ? ? ? 2.029 ? disulf16 disulf ? ? A CYS 368 SG ? ? ? 1_555 A CYS 391 SG ? ? A CYS 397 A CYS 420 1_555 ? ? ? ? ? ? ? 2.028 ? disulf17 disulf ? ? A CYS 393 SG ? ? ? 1_555 A CYS 402 SG ? ? A CYS 422 A CYS 431 1_555 ? ? ? ? ? ? ? 2.032 ? disulf18 disulf ? ? A CYS 405 SG ? ? ? 1_555 A CYS 417 SG ? ? A CYS 434 A CYS 446 1_555 ? ? ? ? ? ? ? 2.033 ? disulf19 disulf ? ? A CYS 420 SG ? ? ? 1_555 A CYS 426 SG ? ? A CYS 449 A CYS 455 1_555 ? ? ? ? ? ? ? 2.031 ? disulf20 disulf ? ? A CYS 422 SG ? ? ? 1_555 A CYS 433 SG ? ? A CYS 451 A CYS 462 1_555 ? ? ? ? ? ? ? 2.031 ? covale1 covale one ? A ASN 27 ND2 ? ? ? 1_555 D NAG . C1 ? ? A ASN 56 A NAG 503 1_555 ? ? ? ? ? ? ? 1.437 ? metalc1 metalc ? ? A ALA 64 O ? ? ? 1_555 H CA . CA ? ? A ALA 93 A CA 507 1_555 ? ? ? ? ? ? ? 2.664 ? metalc2 metalc ? ? A ASP 67 OD1 ? ? ? 1_555 H CA . CA ? ? A ASP 96 A CA 507 1_555 ? ? ? ? ? ? ? 2.438 ? metalc3 metalc ? ? A THR 75 O ? ? ? 1_555 H CA . CA ? ? A THR 104 A CA 507 1_555 ? ? ? ? ? ? ? 2.670 ? metalc4 metalc ? ? A THR 75 OG1 ? ? ? 1_555 H CA . CA ? ? A THR 104 A CA 507 1_555 ? ? ? ? ? ? ? 2.488 ? covale2 covale one ? A ASN 134 ND2 ? ? ? 1_555 F NAG . C1 ? ? A ASN 163 A NAG 505 1_555 ? ? ? ? ? ? ? 1.446 ? metalc5 metalc ? ? A TYR 225 O ? ? ? 1_555 H CA . CA ? ? A TYR 254 A CA 507 1_555 ? ? ? ? ? ? ? 2.568 ? covale3 covale one ? A ASN 324 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 353 A NAG 501 1_555 ? ? ? ? ? ? ? 1.461 ? covale4 covale both ? B NAG . O4 ? ? ? 1_555 C NAG . C1 ? ? A NAG 501 A NAG 502 1_555 ? ? ? ? ? ? ? 1.446 ? covale5 covale both ? F NAG . O4 ? ? ? 1_555 G NAG . C1 ? ? A NAG 505 A NAG 506 1_555 ? ? ? ? ? ? ? 1.443 ? metalc6 metalc ? ? H CA . CA ? ? ? 1_555 J HOH . O ? ? A CA 507 A HOH 605 1_555 ? ? ? ? ? ? ? 2.746 ? # 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 PHE 160 A . ? PHE 189 A PRO 161 A ? PRO 190 A 1 1.46 2 CYS 422 A . ? CYS 451 A ALA 423 A ? ALA 452 A 1 2.16 3 ALA 423 A . ? ALA 452 A GLY 424 A ? GLY 453 A 1 2.44 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 7 ? AA2 ? 3 ? AA3 ? 3 ? AA4 ? 4 ? AA5 ? 2 ? AA6 ? 2 ? AA7 ? 2 ? AA8 ? 2 ? AA9 ? 2 ? AB1 ? 2 ? AB2 ? 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 AA1 1 2 ? anti-parallel AA1 2 3 ? anti-parallel AA1 3 4 ? anti-parallel AA1 4 5 ? anti-parallel AA1 5 6 ? anti-parallel AA1 6 7 ? parallel AA2 1 2 ? anti-parallel AA2 2 3 ? anti-parallel AA3 1 2 ? anti-parallel AA3 2 3 ? anti-parallel AA4 1 2 ? anti-parallel AA4 2 3 ? anti-parallel AA4 3 4 ? anti-parallel AA5 1 2 ? anti-parallel AA6 1 2 ? anti-parallel AA7 1 2 ? anti-parallel AA8 1 2 ? anti-parallel AA9 1 2 ? anti-parallel AB1 1 2 ? anti-parallel AB2 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 AA1 1 TRP A 77 ? GLN A 78 ? TRP A 106 GLN A 107 AA1 2 ALA A 223 ? CYS A 233 ? ALA A 252 CYS A 262 AA1 3 GLU A 86 ? PHE A 105 ? GLU A 115 PHE A 134 AA1 4 LYS A 191 ? LYS A 201 ? LYS A 220 LYS A 230 AA1 5 ALA A 112 ? SER A 118 ? ALA A 141 SER A 147 AA1 6 LYS A 126 ? ALA A 132 ? LYS A 155 ALA A 161 AA1 7 CYS A 152 ? THR A 153 ? CYS A 181 THR A 182 AA2 1 LEU A 18 ? ALA A 20 ? LEU A 47 ALA A 49 AA2 2 GLU A 86 ? PHE A 105 ? GLU A 115 PHE A 134 AA2 3 GLU A 166 ? ARG A 170 ? GLU A 195 ARG A 199 AA3 1 GLY A 10 ? ASN A 11 ? GLY A 39 ASN A 40 AA3 2 ALA A 223 ? CYS A 233 ? ALA A 252 CYS A 262 AA3 3 TRP A 77 ? GLN A 78 ? TRP A 106 GLN A 107 AA4 1 GLU A 166 ? ARG A 170 ? GLU A 195 ARG A 199 AA4 2 GLU A 86 ? PHE A 105 ? GLU A 115 PHE A 134 AA4 3 ALA A 223 ? CYS A 233 ? ALA A 252 CYS A 262 AA4 4 GLY A 10 ? ASN A 11 ? GLY A 39 ASN A 40 AA5 1 GLU A 30 ? CYS A 33 ? GLU A 59 CYS A 62 AA5 2 CYS A 48 ? CYS A 51 ? CYS A 77 CYS A 80 AA6 1 CYS A 242 ? LEU A 243 ? CYS A 271 LEU A 272 AA6 2 ARG A 263 ? CYS A 264 ? ARG A 292 CYS A 293 AA7 1 THR A 270 ? ALA A 271 ? THR A 299 ALA A 300 AA7 2 HIS A 277 ? CYS A 278 ? HIS A 306 CYS A 307 AA8 1 CYS A 312 ? PHE A 314 ? CYS A 341 PHE A 343 AA8 2 GLY A 328 ? CYS A 330 ? GLY A 357 CYS A 359 AA9 1 PHE A 349 ? ARG A 351 ? PHE A 378 ARG A 380 AA9 2 CYS A 363 ? ALA A 365 ? CYS A 392 ALA A 394 AB1 1 VAL A 397 ? ALA A 398 ? VAL A 426 ALA A 427 AB1 2 ARG A 404 ? CYS A 405 ? ARG A 433 CYS A 434 AB2 1 TYR A 409 ? GLY A 413 ? TYR A 438 GLY A 442 AB2 2 GLY A 416 ? PRO A 419 ? GLY A 445 PRO A 448 # 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 AA1 1 2 N TRP A 77 ? N TRP A 106 O VAL A 224 ? O VAL A 253 AA1 2 3 O TYR A 225 ? O TYR A 254 N VAL A 104 ? N VAL A 133 AA1 3 4 N ILE A 88 ? N ILE A 117 O VAL A 197 ? O VAL A 226 AA1 4 5 O THR A 193 ? O THR A 222 N SER A 118 ? N SER A 147 AA1 5 6 N MET A 113 ? N MET A 142 O PHE A 131 ? O PHE A 160 AA1 6 7 N ALA A 132 ? N ALA A 161 O THR A 153 ? O THR A 182 AA2 1 2 N ARG A 19 ? N ARG A 48 O GLN A 89 ? O GLN A 118 AA2 2 3 N MET A 103 ? N MET A 132 O VAL A 167 ? O VAL A 196 AA3 1 2 N GLY A 10 ? N GLY A 39 O GLY A 231 ? O GLY A 260 AA3 2 3 O VAL A 224 ? O VAL A 253 N TRP A 77 ? N TRP A 106 AA4 1 2 O VAL A 167 ? O VAL A 196 N MET A 103 ? N MET A 132 AA4 2 3 N VAL A 104 ? N VAL A 133 O TYR A 225 ? O TYR A 254 AA4 3 4 O GLY A 231 ? O GLY A 260 N GLY A 10 ? N GLY A 39 AA5 1 2 N GLU A 30 ? N GLU A 59 O CYS A 51 ? O CYS A 80 AA6 1 2 N LEU A 243 ? N LEU A 272 O ARG A 263 ? O ARG A 292 AA7 1 2 N ALA A 271 ? N ALA A 300 O HIS A 277 ? O HIS A 306 AA8 1 2 N HIS A 313 ? N HIS A 342 O VAL A 329 ? O VAL A 358 AA9 1 2 N TYR A 350 ? N TYR A 379 O LYS A 364 ? O LYS A 393 AB1 1 2 N ALA A 398 ? N ALA A 427 O ARG A 404 ? O ARG A 433 AB2 1 2 N TRP A 410 ? N TRP A 439 O ARG A 418 ? O ARG A 447 # 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 A NAG 504 ? 1 'binding site for residue NAG A 504' AC2 Software A CA 507 ? 6 'binding site for residue CA A 507' AC3 Software A TAM 508 ? 3 'binding site for residue TAM A 508' AC4 Software A NAG 503 ? 2 'binding site for Mono-Saccharide NAG A 503 bound to ASN A 56' AC5 Software A ASN 163 ? 1 'binding site for Poly-Saccharide residues NAG A 505 through NAG A 506 bound to ASN A 163' AC6 Software A ASN 353 ? 4 'binding site for Poly-Saccharide residues NAG A 501 through NAG A 502 bound to ASN A 353' # 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 1 NAG D . ? NAG A 503 . ? 1_555 ? 2 AC2 6 ALA A 64 ? ALA A 93 . ? 1_555 ? 3 AC2 6 ASP A 67 ? ASP A 96 . ? 1_555 ? 4 AC2 6 THR A 75 ? THR A 104 . ? 1_555 ? 5 AC2 6 TYR A 225 ? TYR A 254 . ? 1_555 ? 6 AC2 6 ASP A 226 ? ASP A 255 . ? 1_555 ? 7 AC2 6 HOH J . ? HOH A 605 . ? 1_555 ? 8 AC3 3 CYS A 1 ? CYS A 30 . ? 1_555 ? 9 AC3 3 GLU A 2 ? GLU A 31 . ? 1_555 ? 10 AC3 3 ASP A 240 ? ASP A 269 . ? 1_555 ? 11 AC4 2 ASN A 27 ? ASN A 56 . ? 1_555 ? 12 AC4 2 NAG E . ? NAG A 504 . ? 1_555 ? 13 AC5 1 ASN A 134 ? ASN A 163 . ? 1_555 ? 14 AC6 4 GLU A 288 ? GLU A 317 . ? 2_656 ? 15 AC6 4 ASN A 298 ? ASN A 327 . ? 2_656 ? 16 AC6 4 TRP A 319 ? TRP A 348 . ? 1_555 ? 17 AC6 4 ASN A 324 ? ASN A 353 . ? 1_555 ? # _atom_sites.entry_id 4WNX _atom_sites.fract_transf_matrix[1][1] 0.009280 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000987 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.013325 _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] 0.013467 _atom_sites.fract_transf_vector[1] 0.000000 _atom_sites.fract_transf_vector[2] 0.000000 _atom_sites.fract_transf_vector[3] 0.000000 # loop_ _atom_type.symbol C CA H N O S # 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 . CYS A 1 1 ? 47.367 35.989 61.453 1.00 52.77 ? 30 CYS A N 1 ATOM 2 C CA . CYS A 1 1 ? 47.634 34.823 60.621 1.00 52.62 ? 30 CYS A CA 1 ATOM 3 C C . CYS A 1 1 ? 48.423 35.242 59.380 1.00 52.32 ? 30 CYS A C 1 ATOM 4 O O . CYS A 1 1 ? 47.874 35.329 58.281 1.00 52.20 ? 30 CYS A O 1 ATOM 5 C CB . CYS A 1 1 ? 46.317 34.134 60.240 1.00 51.76 ? 30 CYS A CB 1 ATOM 6 S SG . CYS A 1 1 ? 46.494 32.466 59.578 1.00 54.90 ? 30 CYS A SG 1 ATOM 7 H HA . CYS A 1 1 ? 48.172 34.190 61.122 1.00 63.14 ? 30 CYS A HA 1 ATOM 8 H HB2 . CYS A 1 1 ? 45.758 34.077 61.031 1.00 62.12 ? 30 CYS A HB2 1 ATOM 9 H HB3 . CYS A 1 1 ? 45.872 34.670 59.565 1.00 62.12 ? 30 CYS A HB3 1 ATOM 10 N N . GLU A 1 2 ? 49.713 35.507 59.570 1.00 42.10 ? 31 GLU A N 1 ATOM 11 C CA . GLU A 1 2 ? 50.558 36.028 58.499 1.00 39.53 ? 31 GLU A CA 1 ATOM 12 C C . GLU A 1 2 ? 50.642 35.064 57.321 1.00 38.88 ? 31 GLU A C 1 ATOM 13 O O . GLU A 1 2 ? 50.025 35.292 56.281 1.00 37.59 ? 31 GLU A O 1 ATOM 14 C CB . GLU A 1 2 ? 51.964 36.325 59.027 1.00 39.31 ? 31 GLU A CB 1 ATOM 15 H H . GLU A 1 2 ? 50.126 35.392 60.315 1.00 50.52 ? 31 GLU A H 1 ATOM 16 H HA . GLU A 1 2 ? 50.179 36.861 58.177 1.00 47.44 ? 31 GLU A HA 1 ATOM 17 N N . LYS A 1 3 ? 51.407 33.991 57.491 1.00 45.92 ? 32 LYS A N 1 ATOM 18 C CA . LYS A 1 3 ? 51.581 32.984 56.449 1.00 47.89 ? 32 LYS A CA 1 ATOM 19 C C . LYS A 1 3 ? 50.386 32.037 56.399 1.00 46.29 ? 32 LYS A C 1 ATOM 20 O O . LYS A 1 3 ? 49.345 32.309 56.998 1.00 46.26 ? 32 LYS A O 1 ATOM 21 C CB . LYS A 1 3 ? 52.873 32.196 56.689 1.00 51.73 ? 32 LYS A CB 1 ATOM 22 C CG . LYS A 1 3 ? 54.146 33.020 56.564 1.00 53.90 ? 32 LYS A CG 1 ATOM 23 C CD . LYS A 1 3 ? 54.492 33.328 55.110 1.00 55.31 ? 32 LYS A CD 1 ATOM 24 C CE . LYS A 1 3 ? 54.044 34.723 54.695 1.00 56.89 ? 32 LYS A CE 1 ATOM 25 N NZ . LYS A 1 3 ? 54.446 35.038 53.295 1.00 59.12 ? 32 LYS A NZ 1 ATOM 26 H H . LYS A 1 3 ? 51.842 33.821 58.213 1.00 55.11 ? 32 LYS A H 1 ATOM 27 H HA . LYS A 1 3 ? 51.652 33.426 55.588 1.00 57.46 ? 32 LYS A HA 1 ATOM 28 H HB2 . LYS A 1 3 ? 52.849 31.826 57.585 1.00 62.08 ? 32 LYS A HB2 1 ATOM 29 H HB3 . LYS A 1 3 ? 52.923 31.477 56.040 1.00 62.08 ? 32 LYS A HB3 1 ATOM 30 H HG2 . LYS A 1 3 ? 54.027 33.861 57.031 1.00 64.68 ? 32 LYS A HG2 1 ATOM 31 H HG3 . LYS A 1 3 ? 54.884 32.524 56.951 1.00 64.68 ? 32 LYS A HG3 1 ATOM 32 H HD2 . LYS A 1 3 ? 55.454 33.272 54.994 1.00 66.37 ? 32 LYS A HD2 1 ATOM 33 H HD3 . LYS A 1 3 ? 54.049 32.685 54.535 1.00 66.37 ? 32 LYS A HD3 1 ATOM 34 H HE2 . LYS A 1 3 ? 53.078 34.779 54.752 1.00 68.27 ? 32 LYS A HE2 1 ATOM 35 H HE3 . LYS A 1 3 ? 54.453 35.378 55.282 1.00 68.27 ? 32 LYS A HE3 1 ATOM 36 H HZ1 . LYS A 1 3 ? 54.173 35.857 53.077 1.00 70.94 ? 32 LYS A HZ1 1 ATOM 37 H HZ2 . LYS A 1 3 ? 55.331 34.998 53.216 1.00 70.94 ? 32 LYS A HZ2 1 ATOM 38 H HZ3 . LYS A 1 3 ? 54.079 34.453 52.734 1.00 70.94 ? 32 LYS A HZ3 1 ATOM 39 N N . ALA A 1 4 ? 50.533 30.934 55.669 1.00 25.59 ? 33 ALA A N 1 ATOM 40 C CA . ALA A 1 4 ? 49.539 29.869 55.691 1.00 25.14 ? 33 ALA A CA 1 ATOM 41 C C . ALA A 1 4 ? 49.355 29.406 57.132 1.00 25.88 ? 33 ALA A C 1 ATOM 42 O O . ALA A 1 4 ? 50.316 29.360 57.901 1.00 27.18 ? 33 ALA A O 1 ATOM 43 C CB . ALA A 1 4 ? 49.962 28.712 54.799 1.00 33.14 ? 33 ALA A CB 1 ATOM 44 H H . ALA A 1 4 ? 51.203 30.779 55.152 1.00 30.70 ? 33 ALA A H 1 ATOM 45 H HA . ALA A 1 4 ? 48.691 30.211 55.368 1.00 30.17 ? 33 ALA A HA 1 ATOM 46 H HB1 . ALA A 1 4 ? 49.283 28.021 54.834 1.00 39.77 ? 33 ALA A HB1 1 ATOM 47 H HB2 . ALA A 1 4 ? 50.059 29.035 53.889 1.00 39.77 ? 33 ALA A HB2 1 ATOM 48 H HB3 . ALA A 1 4 ? 50.808 28.361 55.117 1.00 39.77 ? 33 ALA A HB3 1 ATOM 49 N N . CYS A 1 5 ? 48.122 29.069 57.492 1.00 31.77 ? 34 CYS A N 1 ATOM 50 C CA . CYS A 1 5 ? 47.772 28.831 58.886 1.00 30.55 ? 34 CYS A CA 1 ATOM 51 C C . CYS A 1 5 ? 46.727 27.736 59.023 1.00 29.50 ? 34 CYS A C 1 ATOM 52 O O . CYS A 1 5 ? 46.200 27.246 58.031 1.00 28.54 ? 34 CYS A O 1 ATOM 53 C CB . CYS A 1 5 ? 47.248 30.119 59.507 1.00 29.78 ? 34 CYS A CB 1 ATOM 54 S SG . CYS A 1 5 ? 45.852 30.810 58.596 1.00 113.30 ? 34 CYS A SG 1 ATOM 55 H H . CYS A 1 5 ? 47.467 28.970 56.944 1.00 38.13 ? 34 CYS A H 1 ATOM 56 H HA . CYS A 1 5 ? 48.565 28.558 59.373 1.00 36.66 ? 34 CYS A HA 1 ATOM 57 H HB2 . CYS A 1 5 ? 46.955 29.938 60.414 1.00 35.73 ? 34 CYS A HB2 1 ATOM 58 H HB3 . CYS A 1 5 ? 47.959 30.779 59.514 1.00 35.73 ? 34 CYS A HB3 1 ATOM 59 N N . ASN A 1 6 ? 46.420 27.362 60.260 1.00 36.58 ? 35 ASN A N 1 ATOM 60 C CA . ASN A 1 6 ? 45.434 26.322 60.512 1.00 37.23 ? 35 ASN A CA 1 ATOM 61 C C . ASN A 1 6 ? 44.914 26.395 61.944 1.00 34.19 ? 35 ASN A C 1 ATOM 62 O O . ASN A 1 6 ? 45.692 26.619 62.869 1.00 34.20 ? 35 ASN A O 1 ATOM 63 C CB . ASN A 1 6 ? 46.038 24.943 60.247 1.00 42.59 ? 35 ASN A CB 1 ATOM 64 C CG . ASN A 1 6 ? 44.992 23.847 60.220 1.00 46.65 ? 35 ASN A CG 1 ATOM 65 O OD1 . ASN A 1 6 ? 44.745 23.186 61.228 1.00 48.60 ? 35 ASN A OD1 1 ATOM 66 N ND2 . ASN A 1 6 ? 44.367 23.652 59.063 1.00 47.61 ? 35 ASN A ND2 1 ATOM 67 H H . ASN A 1 6 ? 46.770 27.697 60.971 1.00 43.90 ? 35 ASN A H 1 ATOM 68 H HA . ASN A 1 6 ? 44.683 26.444 59.911 1.00 44.68 ? 35 ASN A HA 1 ATOM 69 H HB2 . ASN A 1 6 ? 46.485 24.953 59.386 1.00 51.11 ? 35 ASN A HB2 1 ATOM 70 H HB3 . ASN A 1 6 ? 46.673 24.735 60.949 1.00 51.11 ? 35 ASN A HB3 1 ATOM 71 H HD21 . ASN A 1 6 ? 43.765 23.041 58.998 1.00 57.14 ? 35 ASN A HD21 1 ATOM 72 H HD22 . ASN A 1 6 ? 44.564 24.136 58.381 1.00 57.14 ? 35 ASN A HD22 1 ATOM 73 N N . PRO A 1 7 ? 43.596 26.208 62.139 1.00 30.20 ? 36 PRO A N 1 ATOM 74 C CA . PRO A 1 7 ? 43.057 26.234 63.505 1.00 30.72 ? 36 PRO A CA 1 ATOM 75 C C . PRO A 1 7 ? 43.614 25.113 64.380 1.00 32.60 ? 36 PRO A C 1 ATOM 76 O O . PRO A 1 7 ? 44.294 24.221 63.873 1.00 31.50 ? 36 PRO A O 1 ATOM 77 C CB . PRO A 1 7 ? 41.548 26.061 63.292 1.00 29.05 ? 36 PRO A CB 1 ATOM 78 C CG . PRO A 1 7 ? 41.310 26.478 61.881 1.00 28.07 ? 36 PRO A CG 1 ATOM 79 C CD . PRO A 1 7 ? 42.526 26.050 61.138 1.00 28.74 ? 36 PRO A CD 1 ATOM 80 H HA . PRO A 1 7 ? 43.230 27.091 63.924 1.00 36.86 ? 36 PRO A HA 1 ATOM 81 H HB2 . PRO A 1 7 ? 41.303 25.132 63.422 1.00 34.86 ? 36 PRO A HB2 1 ATOM 82 H HB3 . PRO A 1 7 ? 41.063 26.634 63.907 1.00 34.86 ? 36 PRO A HB3 1 ATOM 83 H HG2 . PRO A 1 7 ? 40.522 26.030 61.536 1.00 33.68 ? 36 PRO A HG2 1 ATOM 84 H HG3 . PRO A 1 7 ? 41.204 27.442 61.838 1.00 33.68 ? 36 PRO A HG3 1 ATOM 85 H HD2 . PRO A 1 7 ? 42.449 25.122 60.867 1.00 34.49 ? 36 PRO A HD2 1 ATOM 86 H HD3 . PRO A 1 7 ? 42.683 26.632 60.378 1.00 34.49 ? 36 PRO A HD3 1 ATOM 87 N N . ARG A 1 8 ? 43.329 25.164 65.678 1.00 48.74 ? 37 ARG A N 1 ATOM 88 C CA . ARG A 1 8 ? 43.840 24.166 66.611 1.00 50.13 ? 37 ARG A CA 1 ATOM 89 C C . ARG A 1 8 ? 43.200 22.804 66.372 1.00 48.97 ? 37 ARG A C 1 ATOM 90 O O . ARG A 1 8 ? 42.030 22.712 66.000 1.00 48.86 ? 37 ARG A O 1 ATOM 91 C CB . ARG A 1 8 ? 43.595 24.607 68.057 1.00 52.95 ? 37 ARG A CB 1 ATOM 92 C CG . ARG A 1 8 ? 42.126 24.776 68.419 1.00 54.86 ? 37 ARG A CG 1 ATOM 93 C CD . ARG A 1 8 ? 41.951 25.070 69.901 1.00 56.86 ? 37 ARG A CD 1 ATOM 94 N NE . ARG A 1 8 ? 40.547 25.258 70.259 1.00 58.49 ? 37 ARG A NE 1 ATOM 95 C CZ . ARG A 1 8 ? 39.672 24.268 70.415 1.00 59.73 ? 37 ARG A CZ 1 ATOM 96 N NH1 . ARG A 1 8 ? 40.044 23.006 70.239 1.00 59.76 ? 37 ARG A NH1 1 ATOM 97 N NH2 . ARG A 1 8 ? 38.417 24.541 70.744 1.00 60.05 ? 37 ARG A NH2 1 ATOM 98 H H . ARG A 1 8 ? 42.840 25.770 66.044 1.00 58.49 ? 37 ARG A H 1 ATOM 99 H HA . ARG A 1 8 ? 44.797 24.075 66.484 1.00 60.16 ? 37 ARG A HA 1 ATOM 100 H HB2 . ARG A 1 8 ? 43.971 23.940 68.653 1.00 63.54 ? 37 ARG A HB2 1 ATOM 101 H HB3 . ARG A 1 8 ? 44.034 25.459 68.201 1.00 63.54 ? 37 ARG A HB3 1 ATOM 102 H HG2 . ARG A 1 8 ? 41.755 25.518 67.916 1.00 65.83 ? 37 ARG A HG2 1 ATOM 103 H HG3 . ARG A 1 8 ? 41.649 23.957 68.213 1.00 65.83 ? 37 ARG A HG3 1 ATOM 104 H HD2 . ARG A 1 8 ? 42.298 24.325 70.416 1.00 68.23 ? 37 ARG A HD2 1 ATOM 105 H HD3 . ARG A 1 8 ? 42.431 25.883 70.123 1.00 68.23 ? 37 ARG A HD3 1 ATOM 106 H HE . ARG A 1 8 ? 40.268 26.063 70.378 1.00 70.19 ? 37 ARG A HE 1 ATOM 107 H HH11 . ARG A 1 8 ? 40.856 22.823 70.025 1.00 71.71 ? 37 ARG A HH11 1 ATOM 108 H HH12 . ARG A 1 8 ? 39.472 22.371 70.340 1.00 71.71 ? 37 ARG A HH12 1 ATOM 109 H HH21 . ARG A 1 8 ? 38.170 25.357 70.858 1.00 72.06 ? 37 ARG A HH21 1 ATOM 110 H HH22 . ARG A 1 8 ? 37.850 23.902 70.843 1.00 72.06 ? 37 ARG A HH22 1 ATOM 111 N N . MET A 1 9 ? 43.978 21.748 66.584 1.00 33.14 ? 38 MET A N 1 ATOM 112 C CA . MET A 1 9 ? 43.463 20.388 66.498 1.00 31.50 ? 38 MET A CA 1 ATOM 113 C C . MET A 1 9 ? 42.691 20.053 67.769 1.00 32.02 ? 38 MET A C 1 ATOM 114 O O . MET A 1 9 ? 42.976 20.600 68.835 1.00 34.32 ? 38 MET A O 1 ATOM 115 C CB . MET A 1 9 ? 44.604 19.392 66.288 1.00 30.64 ? 38 MET A CB 1 ATOM 116 C CG . MET A 1 9 ? 45.406 19.623 65.014 1.00 30.21 ? 38 MET A CG 1 ATOM 117 S SD . MET A 1 9 ? 44.511 19.162 63.519 1.00 82.93 ? 38 MET A SD 1 ATOM 118 C CE . MET A 1 9 ? 45.648 19.726 62.256 1.00 79.70 ? 38 MET A CE 1 ATOM 119 H H . MET A 1 9 ? 44.814 21.794 66.781 1.00 39.77 ? 38 MET A H 1 ATOM 120 H HA . MET A 1 9 ? 42.864 20.324 65.738 1.00 37.80 ? 38 MET A HA 1 ATOM 121 H HB2 . MET A 1 9 ? 45.216 19.457 67.038 1.00 36.77 ? 38 MET A HB2 1 ATOM 122 H HB3 . MET A 1 9 ? 44.233 18.497 66.244 1.00 36.77 ? 38 MET A HB3 1 ATOM 123 H HG2 . MET A 1 9 ? 45.630 20.565 64.950 1.00 36.25 ? 38 MET A HG2 1 ATOM 124 H HG3 . MET A 1 9 ? 46.217 19.092 65.052 1.00 36.25 ? 38 MET A HG3 1 ATOM 125 H HE1 . MET A 1 9 ? 45.273 19.531 61.383 1.00 95.64 ? 38 MET A HE1 1 ATOM 126 H HE2 . MET A 1 9 ? 45.779 20.683 62.354 1.00 95.64 ? 38 MET A HE2 1 ATOM 127 H HE3 . MET A 1 9 ? 46.494 19.264 62.364 1.00 95.64 ? 38 MET A HE3 1 ATOM 128 N N . GLY A 1 10 ? 41.716 19.156 67.660 1.00 36.95 ? 39 GLY A N 1 ATOM 129 C CA . GLY A 1 10 ? 40.913 18.772 68.807 1.00 36.51 ? 39 GLY A CA 1 ATOM 130 C C . GLY A 1 10 ? 39.964 17.630 68.504 1.00 36.87 ? 39 GLY A C 1 ATOM 131 O O . GLY A 1 10 ? 39.801 17.235 67.349 1.00 37.47 ? 39 GLY A O 1 ATOM 132 H H . GLY A 1 10 ? 41.501 18.756 66.929 1.00 44.33 ? 39 GLY A H 1 ATOM 133 H HA2 . GLY A 1 10 ? 41.497 18.500 69.532 1.00 43.82 ? 39 GLY A HA2 1 ATOM 134 H HA3 . GLY A 1 10 ? 40.391 19.533 69.104 1.00 43.82 ? 39 GLY A HA3 1 ATOM 135 N N . ASN A 1 11 ? 39.341 17.091 69.547 1.00 35.05 ? 40 ASN A N 1 ATOM 136 C CA . ASN A 1 11 ? 38.380 16.008 69.385 1.00 34.77 ? 40 ASN A CA 1 ATOM 137 C C . ASN A 1 11 ? 37.037 16.528 68.882 1.00 33.98 ? 40 ASN A C 1 ATOM 138 O O . ASN A 1 11 ? 36.340 17.259 69.586 1.00 35.36 ? 40 ASN A O 1 ATOM 139 C CB . ASN A 1 11 ? 38.193 15.262 70.706 1.00 35.23 ? 40 ASN A CB 1 ATOM 140 C CG . ASN A 1 11 ? 37.350 14.012 70.554 1.00 35.34 ? 40 ASN A CG 1 ATOM 141 O OD1 . ASN A 1 11 ? 37.008 13.611 69.442 1.00 35.34 ? 40 ASN A OD1 1 ATOM 142 N ND2 . ASN A 1 11 ? 37.019 13.380 71.675 1.00 35.79 ? 40 ASN A ND2 1 ATOM 143 H H . ASN A 1 11 ? 39.459 17.337 70.363 1.00 42.06 ? 40 ASN A H 1 ATOM 144 H HA . ASN A 1 11 ? 38.722 15.379 68.731 1.00 41.72 ? 40 ASN A HA 1 ATOM 145 H HB2 . ASN A 1 11 ? 39.062 14.998 71.047 1.00 42.27 ? 40 ASN A HB2 1 ATOM 146 H HB3 . ASN A 1 11 ? 37.751 15.847 71.340 1.00 42.27 ? 40 ASN A HB3 1 ATOM 147 H HD21 . ASN A 1 11 ? 36.541 12.666 71.641 1.00 42.95 ? 40 ASN A HD21 1 ATOM 148 H HD22 . ASN A 1 11 ? 37.282 13.685 72.434 1.00 42.95 ? 40 ASN A HD22 1 ATOM 149 N N . LEU A 1 12 ? 36.679 16.143 67.661 1.00 27.81 ? 41 LEU A N 1 ATOM 150 C CA . LEU A 1 12 ? 35.417 16.563 67.061 1.00 26.44 ? 41 LEU A CA 1 ATOM 151 C C . LEU A 1 12 ? 34.216 15.915 67.749 1.00 26.05 ? 41 LEU A C 1 ATOM 152 O O . LEU A 1 12 ? 33.074 16.314 67.526 1.00 27.32 ? 41 LEU A O 1 ATOM 153 C CB . LEU A 1 12 ? 35.404 16.227 65.567 1.00 26.62 ? 41 LEU A CB 1 ATOM 154 C CG . LEU A 1 12 ? 36.464 16.919 64.708 1.00 27.79 ? 41 LEU A CG 1 ATOM 155 C CD1 . LEU A 1 12 ? 36.395 16.418 63.273 1.00 28.50 ? 41 LEU A CD1 1 ATOM 156 C CD2 . LEU A 1 12 ? 36.301 18.432 64.751 1.00 28.38 ? 41 LEU A CD2 1 ATOM 157 H H . LEU A 1 12 ? 37.153 15.635 67.156 1.00 33.37 ? 41 LEU A H 1 ATOM 158 H HA . LEU A 1 12 ? 35.330 17.525 67.152 1.00 31.72 ? 41 LEU A HA 1 ATOM 159 H HB2 . LEU A 1 12 ? 35.533 15.270 65.470 1.00 31.94 ? 41 LEU A HB2 1 ATOM 160 H HB3 . LEU A 1 12 ? 34.537 16.472 65.208 1.00 31.94 ? 41 LEU A HB3 1 ATOM 161 H HG . LEU A 1 12 ? 37.343 16.703 65.058 1.00 33.35 ? 41 LEU A HG 1 ATOM 162 H HD11 . LEU A 1 12 ? 37.075 16.869 62.748 1.00 34.20 ? 41 LEU A HD11 1 ATOM 163 H HD12 . LEU A 1 12 ? 36.552 15.461 63.265 1.00 34.20 ? 41 LEU A HD12 1 ATOM 164 H HD13 . LEU A 1 12 ? 35.516 16.612 62.913 1.00 34.20 ? 41 LEU A HD13 1 ATOM 165 H HD21 . LEU A 1 12 ? 36.986 18.839 64.198 1.00 34.05 ? 41 LEU A HD21 1 ATOM 166 H HD22 . LEU A 1 12 ? 35.422 18.664 64.413 1.00 34.05 ? 41 LEU A HD22 1 ATOM 167 H HD23 . LEU A 1 12 ? 36.394 18.733 65.668 1.00 34.05 ? 41 LEU A HD23 1 ATOM 168 N N . ALA A 1 13 ? 34.477 14.914 68.582 1.00 21.56 ? 42 ALA A N 1 ATOM 169 C CA . ALA A 1 13 ? 33.412 14.217 69.288 1.00 21.94 ? 42 ALA A CA 1 ATOM 170 C C . ALA A 1 13 ? 32.766 15.106 70.347 1.00 22.29 ? 42 ALA A C 1 ATOM 171 O O . ALA A 1 13 ? 31.561 15.025 70.579 1.00 22.61 ? 42 ALA A O 1 ATOM 172 C CB . ALA A 1 13 ? 33.951 12.944 69.927 1.00 22.19 ? 42 ALA A CB 1 ATOM 173 H H . ALA A 1 13 ? 35.266 14.619 68.755 1.00 25.87 ? 42 ALA A H 1 ATOM 174 H HA . ALA A 1 13 ? 32.725 13.964 68.651 1.00 26.33 ? 42 ALA A HA 1 ATOM 175 H HB1 . ALA A 1 13 ? 33.228 12.494 70.392 1.00 26.63 ? 42 ALA A HB1 1 ATOM 176 H HB2 . ALA A 1 13 ? 34.307 12.369 69.232 1.00 26.63 ? 42 ALA A HB2 1 ATOM 177 H HB3 . ALA A 1 13 ? 34.653 13.179 70.554 1.00 26.63 ? 42 ALA A HB3 1 ATOM 178 N N . LEU A 1 14 ? 33.569 15.953 70.986 1.00 32.73 ? 43 LEU A N 1 ATOM 179 C CA . LEU A 1 14 ? 33.087 16.782 72.087 1.00 33.30 ? 43 LEU A CA 1 ATOM 180 C C . LEU A 1 14 ? 31.994 17.748 71.643 1.00 33.21 ? 43 LEU A C 1 ATOM 181 O O . LEU A 1 14 ? 32.121 18.417 70.619 1.00 32.62 ? 43 LEU A O 1 ATOM 182 C CB . LEU A 1 14 ? 34.240 17.578 72.709 1.00 33.67 ? 43 LEU A CB 1 ATOM 183 C CG . LEU A 1 14 ? 35.454 16.803 73.230 1.00 33.95 ? 43 LEU A CG 1 ATOM 184 C CD1 . LEU A 1 14 ? 36.394 17.737 73.974 1.00 34.57 ? 43 LEU A CD1 1 ATOM 185 C CD2 . LEU A 1 14 ? 35.038 15.648 74.119 1.00 34.45 ? 43 LEU A CD2 1 ATOM 186 H H . LEU A 1 14 ? 34.401 16.067 70.800 1.00 39.27 ? 43 LEU A H 1 ATOM 187 H HA . LEU A 1 14 ? 32.716 16.207 72.775 1.00 39.95 ? 43 LEU A HA 1 ATOM 188 H HB2 . LEU A 1 14 ? 34.568 18.199 72.040 1.00 40.40 ? 43 LEU A HB2 1 ATOM 189 H HB3 . LEU A 1 14 ? 33.884 18.080 73.459 1.00 40.40 ? 43 LEU A HB3 1 ATOM 190 H HG . LEU A 1 14 ? 35.938 16.435 72.474 1.00 40.74 ? 43 LEU A HG 1 ATOM 191 H HD11 . LEU A 1 14 ? 37.155 17.228 74.295 1.00 41.48 ? 43 LEU A HD11 1 ATOM 192 H HD12 . LEU A 1 14 ? 36.693 18.432 73.368 1.00 41.48 ? 43 LEU A HD12 1 ATOM 193 H HD13 . LEU A 1 14 ? 35.920 18.131 74.723 1.00 41.48 ? 43 LEU A HD13 1 ATOM 194 H HD21 . LEU A 1 14 ? 35.833 15.185 74.427 1.00 41.33 ? 43 LEU A HD21 1 ATOM 195 H HD22 . LEU A 1 14 ? 34.544 15.997 74.878 1.00 41.33 ? 43 LEU A HD22 1 ATOM 196 H HD23 . LEU A 1 14 ? 34.478 15.043 73.609 1.00 41.33 ? 43 LEU A HD23 1 ATOM 197 N N . GLY A 1 15 ? 30.924 17.815 72.428 1.00 35.00 ? 44 GLY A N 1 ATOM 198 C CA . GLY A 1 15 ? 29.872 18.791 72.209 1.00 35.49 ? 44 GLY A CA 1 ATOM 199 C C . GLY A 1 15 ? 28.840 18.399 71.167 1.00 35.57 ? 44 GLY A C 1 ATOM 200 O O . GLY A 1 15 ? 27.833 19.092 71.008 1.00 36.98 ? 44 GLY A O 1 ATOM 201 H H . GLY A 1 15 ? 30.785 17.299 73.101 1.00 42.00 ? 44 GLY A H 1 ATOM 202 H HA2 . GLY A 1 15 ? 29.407 18.945 73.046 1.00 42.59 ? 44 GLY A HA2 1 ATOM 203 H HA3 . GLY A 1 15 ? 30.274 19.629 71.931 1.00 42.59 ? 44 GLY A HA3 1 ATOM 204 N N . ARG A 1 16 ? 29.081 17.298 70.460 1.00 32.01 ? 45 ARG A N 1 ATOM 205 C CA . ARG A 1 16 ? 28.174 16.844 69.409 1.00 32.67 ? 45 ARG A CA 1 ATOM 206 C C . ARG A 1 16 ? 27.518 15.518 69.767 1.00 33.84 ? 45 ARG A C 1 ATOM 207 O O . ARG A 1 16 ? 28.042 14.750 70.574 1.00 35.00 ? 45 ARG A O 1 ATOM 208 C CB . ARG A 1 16 ? 28.920 16.710 68.082 1.00 31.51 ? 45 ARG A CB 1 ATOM 209 C CG . ARG A 1 16 ? 29.772 17.915 67.745 1.00 30.70 ? 45 ARG A CG 1 ATOM 210 C CD . ARG A 1 16 ? 30.211 17.901 66.296 1.00 30.24 ? 45 ARG A CD 1 ATOM 211 N NE . ARG A 1 16 ? 31.395 18.728 66.091 1.00 29.89 ? 45 ARG A NE 1 ATOM 212 C CZ . ARG A 1 16 ? 31.386 20.056 66.052 1.00 29.69 ? 45 ARG A CZ 1 ATOM 213 N NH1 . ARG A 1 16 ? 30.251 20.724 66.206 1.00 30.57 ? 45 ARG A NH1 1 ATOM 214 N NH2 . ARG A 1 16 ? 32.516 20.720 65.861 1.00 28.93 ? 45 ARG A NH2 1 ATOM 215 H H . ARG A 1 16 ? 29.768 16.792 70.572 1.00 38.41 ? 45 ARG A H 1 ATOM 216 H HA . ARG A 1 16 ? 27.472 17.503 69.292 1.00 39.21 ? 45 ARG A HA 1 ATOM 217 H HB2 . ARG A 1 16 ? 29.504 15.936 68.127 1.00 37.82 ? 45 ARG A HB2 1 ATOM 218 H HB3 . ARG A 1 16 ? 28.273 16.593 67.369 1.00 37.82 ? 45 ARG A HB3 1 ATOM 219 H HG2 . ARG A 1 16 ? 29.257 18.723 67.899 1.00 36.84 ? 45 ARG A HG2 1 ATOM 220 H HG3 . ARG A 1 16 ? 30.565 17.912 68.303 1.00 36.84 ? 45 ARG A HG3 1 ATOM 221 H HD2 . ARG A 1 16 ? 30.426 16.992 66.035 1.00 36.29 ? 45 ARG A HD2 1 ATOM 222 H HD3 . ARG A 1 16 ? 29.496 18.251 65.741 1.00 36.29 ? 45 ARG A HD3 1 ATOM 223 H HE . ARG A 1 16 ? 32.150 18.329 65.989 1.00 35.87 ? 45 ARG A HE 1 ATOM 224 H HH11 . ARG A 1 16 ? 29.514 20.298 66.331 1.00 36.68 ? 45 ARG A HH11 1 ATOM 225 H HH12 . ARG A 1 16 ? 30.251 21.584 66.181 1.00 36.68 ? 45 ARG A HH12 1 ATOM 226 H HH21 . ARG A 1 16 ? 33.255 20.291 65.761 1.00 34.72 ? 45 ARG A HH21 1 ATOM 227 H HH22 . ARG A 1 16 ? 32.511 21.579 65.836 1.00 34.72 ? 45 ARG A HH22 1 ATOM 228 N N . LYS A 1 17 ? 26.365 15.261 69.159 1.00 32.93 ? 46 LYS A N 1 ATOM 229 C CA . LYS A 1 17 ? 25.627 14.029 69.400 1.00 33.85 ? 46 LYS A CA 1 ATOM 230 C C . LYS A 1 17 ? 26.205 12.854 68.623 1.00 33.39 ? 46 LYS A C 1 ATOM 231 O O . LYS A 1 17 ? 26.148 12.826 67.395 1.00 34.30 ? 46 LYS A O 1 ATOM 232 C CB . LYS A 1 17 ? 24.155 14.200 69.022 1.00 35.46 ? 46 LYS A CB 1 ATOM 233 C CG . LYS A 1 17 ? 23.320 14.944 70.056 1.00 37.12 ? 46 LYS A CG 1 ATOM 234 C CD . LYS A 1 17 ? 21.852 15.040 69.642 1.00 37.91 ? 46 LYS A CD 1 ATOM 235 C CE . LYS A 1 17 ? 21.201 13.668 69.466 1.00 37.37 ? 46 LYS A CE 1 ATOM 236 N NZ . LYS A 1 17 ? 21.386 12.784 70.653 1.00 36.36 ? 46 LYS A NZ 1 ATOM 237 H H . LYS A 1 17 ? 25.985 15.790 68.598 1.00 39.52 ? 46 LYS A H 1 ATOM 238 H HA . LYS A 1 17 ? 25.672 13.814 70.345 1.00 40.62 ? 46 LYS A HA 1 ATOM 239 H HB2 . LYS A 1 17 ? 24.104 14.697 68.191 1.00 42.55 ? 46 LYS A HB2 1 ATOM 240 H HB3 . LYS A 1 17 ? 23.761 13.322 68.903 1.00 42.55 ? 46 LYS A HB3 1 ATOM 241 H HG2 . LYS A 1 17 ? 23.366 14.471 70.902 1.00 44.54 ? 46 LYS A HG2 1 ATOM 242 H HG3 . LYS A 1 17 ? 23.666 15.845 70.157 1.00 44.54 ? 46 LYS A HG3 1 ATOM 243 H HD2 . LYS A 1 17 ? 21.361 15.520 70.328 1.00 45.49 ? 46 LYS A HD2 1 ATOM 244 H HD3 . LYS A 1 17 ? 21.792 15.512 68.797 1.00 45.49 ? 46 LYS A HD3 1 ATOM 245 H HE2 . LYS A 1 17 ? 20.249 13.786 69.326 1.00 44.85 ? 46 LYS A HE2 1 ATOM 246 H HE3 . LYS A 1 17 ? 21.598 13.227 68.698 1.00 44.85 ? 46 LYS A HE3 1 ATOM 247 H HZ1 . LYS A 1 17 ? 20.994 11.998 70.510 1.00 43.64 ? 46 LYS A HZ1 1 ATOM 248 H HZ2 . LYS A 1 17 ? 22.254 12.652 70.801 1.00 43.64 ? 46 LYS A HZ2 1 ATOM 249 H HZ3 . LYS A 1 17 ? 21.024 13.162 71.372 1.00 43.64 ? 46 LYS A HZ3 1 ATOM 250 N N . LEU A 1 18 ? 26.762 11.888 69.344 1.00 39.58 ? 47 LEU A N 1 ATOM 251 C CA . LEU A 1 18 ? 27.086 10.599 68.753 1.00 38.12 ? 47 LEU A CA 1 ATOM 252 C C . LEU A 1 18 ? 25.830 9.745 68.762 1.00 39.50 ? 47 LEU A C 1 ATOM 253 O O . LEU A 1 18 ? 25.109 9.704 69.760 1.00 40.47 ? 47 LEU A O 1 ATOM 254 C CB . LEU A 1 18 ? 28.216 9.901 69.511 1.00 36.13 ? 47 LEU A CB 1 ATOM 255 C CG . LEU A 1 18 ? 29.596 9.934 68.848 1.00 34.56 ? 47 LEU A CG 1 ATOM 256 C CD1 . LEU A 1 18 ? 30.638 9.318 69.764 1.00 34.56 ? 47 LEU A CD1 1 ATOM 257 C CD2 . LEU A 1 18 ? 29.586 9.207 67.511 1.00 34.48 ? 47 LEU A CD2 1 ATOM 258 H H . LEU A 1 18 ? 26.962 11.954 70.178 1.00 47.50 ? 47 LEU A H 1 ATOM 259 H HA . LEU A 1 18 ? 27.366 10.725 67.833 1.00 45.75 ? 47 LEU A HA 1 ATOM 260 H HB2 . LEU A 1 18 ? 28.304 10.322 70.381 1.00 43.35 ? 47 LEU A HB2 1 ATOM 261 H HB3 . LEU A 1 18 ? 27.975 8.969 69.628 1.00 43.35 ? 47 LEU A HB3 1 ATOM 262 H HG . LEU A 1 18 ? 29.847 10.857 68.686 1.00 41.48 ? 47 LEU A HG 1 ATOM 263 H HD11 . LEU A 1 18 ? 31.502 9.350 69.324 1.00 41.48 ? 47 LEU A HD11 1 ATOM 264 H HD12 . LEU A 1 18 ? 30.669 9.823 70.591 1.00 41.48 ? 47 LEU A HD12 1 ATOM 265 H HD13 . LEU A 1 18 ? 30.393 8.397 69.946 1.00 41.48 ? 47 LEU A HD13 1 ATOM 266 H HD21 . LEU A 1 18 ? 30.474 9.249 67.123 1.00 41.38 ? 47 LEU A HD21 1 ATOM 267 H HD22 . LEU A 1 18 ? 29.332 8.283 67.657 1.00 41.38 ? 47 LEU A HD22 1 ATOM 268 H HD23 . LEU A 1 18 ? 28.947 9.638 66.923 1.00 41.38 ? 47 LEU A HD23 1 ATOM 269 N N . ARG A 1 19 ? 25.568 9.072 67.647 1.00 37.97 ? 48 ARG A N 1 ATOM 270 C CA . ARG A 1 19 ? 24.371 8.256 67.510 1.00 38.97 ? 48 ARG A CA 1 ATOM 271 C C . ARG A 1 19 ? 24.733 6.783 67.408 1.00 37.50 ? 48 ARG A C 1 ATOM 272 O O . ARG A 1 19 ? 25.773 6.424 66.858 1.00 36.68 ? 48 ARG A O 1 ATOM 273 C CB . ARG A 1 19 ? 23.565 8.698 66.287 1.00 40.56 ? 48 ARG A CB 1 ATOM 274 C CG . ARG A 1 19 ? 23.188 10.172 66.325 1.00 41.81 ? 48 ARG A CG 1 ATOM 275 C CD . ARG A 1 19 ? 22.195 10.548 65.238 1.00 43.26 ? 48 ARG A CD 1 ATOM 276 N NE . ARG A 1 19 ? 22.772 10.459 63.898 1.00 43.98 ? 48 ARG A NE 1 ATOM 277 C CZ . ARG A 1 19 ? 22.730 9.378 63.121 1.00 45.32 ? 48 ARG A CZ 1 ATOM 278 N NH1 . ARG A 1 19 ? 22.140 8.263 63.536 1.00 46.54 ? 48 ARG A NH1 1 ATOM 279 N NH2 . ARG A 1 19 ? 23.286 9.412 61.917 1.00 45.03 ? 48 ARG A NH2 1 ATOM 280 H H . ARG A 1 19 ? 26.073 9.072 66.951 1.00 45.57 ? 48 ARG A H 1 ATOM 281 H HA . ARG A 1 19 ? 23.815 8.376 68.296 1.00 46.76 ? 48 ARG A HA 1 ATOM 282 H HB2 . ARG A 1 19 ? 24.094 8.545 65.489 1.00 48.67 ? 48 ARG A HB2 1 ATOM 283 H HB3 . ARG A 1 19 ? 22.746 8.181 66.246 1.00 48.67 ? 48 ARG A HB3 1 ATOM 284 H HG2 . ARG A 1 19 ? 22.784 10.374 67.183 1.00 50.17 ? 48 ARG A HG2 1 ATOM 285 H HG3 . ARG A 1 19 ? 23.988 10.707 66.199 1.00 50.17 ? 48 ARG A HG3 1 ATOM 286 H HD2 . ARG A 1 19 ? 21.437 9.944 65.279 1.00 51.91 ? 48 ARG A HD2 1 ATOM 287 H HD3 . ARG A 1 19 ? 21.902 11.461 65.379 1.00 51.91 ? 48 ARG A HD3 1 ATOM 288 H HE . ARG A 1 19 ? 23.167 11.157 63.587 1.00 52.77 ? 48 ARG A HE 1 ATOM 289 H HH11 . ARG A 1 19 ? 21.776 8.234 64.315 1.00 55.85 ? 48 ARG A HH11 1 ATOM 290 H HH12 . ARG A 1 19 ? 22.120 7.571 63.026 1.00 55.85 ? 48 ARG A HH12 1 ATOM 291 H HH21 . ARG A 1 19 ? 23.671 10.130 61.641 1.00 54.03 ? 48 ARG A HH21 1 ATOM 292 H HH22 . ARG A 1 19 ? 23.263 8.716 61.413 1.00 54.03 ? 48 ARG A HH22 1 ATOM 293 N N . ALA A 1 20 ? 23.865 5.938 67.955 1.00 33.70 ? 49 ALA A N 1 ATOM 294 C CA . ALA A 1 20 ? 24.043 4.493 67.904 1.00 33.72 ? 49 ALA A CA 1 ATOM 295 C C . ALA A 1 20 ? 22.685 3.835 67.707 1.00 35.29 ? 49 ALA A C 1 ATOM 296 O O . ALA A 1 20 ? 21.670 4.334 68.193 1.00 35.75 ? 49 ALA A O 1 ATOM 297 C CB . ALA A 1 20 ? 24.710 3.986 69.171 1.00 33.65 ? 49 ALA A CB 1 ATOM 298 H H . ALA A 1 20 ? 23.153 6.183 68.369 1.00 40.44 ? 49 ALA A H 1 ATOM 299 H HA . ALA A 1 20 ? 24.606 4.265 67.148 1.00 40.47 ? 49 ALA A HA 1 ATOM 300 H HB1 . ALA A 1 20 ? 24.815 3.023 69.109 1.00 40.38 ? 49 ALA A HB1 1 ATOM 301 H HB2 . ALA A 1 20 ? 25.579 4.408 69.261 1.00 40.38 ? 49 ALA A HB2 1 ATOM 302 H HB3 . ALA A 1 20 ? 24.153 4.209 69.933 1.00 40.38 ? 49 ALA A HB3 1 ATOM 303 N N . ASP A 1 21 ? 22.670 2.718 66.990 1.00 36.21 ? 50 ASP A N 1 ATOM 304 C CA . ASP A 1 21 ? 21.424 2.036 66.668 1.00 38.17 ? 50 ASP A CA 1 ATOM 305 C C . ASP A 1 21 ? 20.691 1.581 67.925 1.00 40.09 ? 50 ASP A C 1 ATOM 306 O O . ASP A 1 21 ? 19.461 1.599 67.976 1.00 40.92 ? 50 ASP A O 1 ATOM 307 C CB . ASP A 1 21 ? 21.692 0.829 65.767 1.00 38.81 ? 50 ASP A CB 1 ATOM 308 C CG . ASP A 1 21 ? 22.363 1.208 64.463 1.00 38.76 ? 50 ASP A CG 1 ATOM 309 O OD1 . ASP A 1 21 ? 22.055 2.293 63.922 1.00 37.89 ? 50 ASP A OD1 1 ATOM 310 O OD2 . ASP A 1 21 ? 23.198 0.415 63.978 1.00 39.26 ? 50 ASP A OD2 1 ATOM 311 H H . ASP A 1 21 ? 23.372 2.332 66.676 1.00 43.45 ? 50 ASP A H 1 ATOM 312 H HA . ASP A 1 21 ? 20.844 2.647 66.188 1.00 45.81 ? 50 ASP A HA 1 ATOM 313 H HB2 . ASP A 1 21 ? 22.273 0.209 66.234 1.00 46.57 ? 50 ASP A HB2 1 ATOM 314 H HB3 . ASP A 1 21 ? 20.848 0.398 65.557 1.00 46.57 ? 50 ASP A HB3 1 ATOM 315 N N . THR A 1 22 ? 21.453 1.180 68.939 1.00 30.50 ? 51 THR A N 1 ATOM 316 C CA . THR A 1 22 ? 20.879 0.591 70.143 1.00 34.01 ? 51 THR A CA 1 ATOM 317 C C . THR A 1 22 ? 21.711 0.898 71.384 1.00 36.57 ? 51 THR A C 1 ATOM 318 O O . THR A 1 22 ? 22.893 1.227 71.290 1.00 37.13 ? 51 THR A O 1 ATOM 319 C CB . THR A 1 22 ? 20.756 -0.946 70.014 1.00 34.45 ? 51 THR A CB 1 ATOM 320 O OG1 . THR A 1 22 ? 22.049 -1.515 69.773 1.00 33.16 ? 51 THR A OG1 1 ATOM 321 C CG2 . THR A 1 22 ? 19.818 -1.330 68.877 1.00 35.62 ? 51 THR A CG2 1 ATOM 322 H H . THR A 1 22 ? 22.311 1.238 68.953 1.00 36.60 ? 51 THR A H 1 ATOM 323 H HA . THR A 1 22 ? 19.990 0.954 70.280 1.00 40.81 ? 51 THR A HA 1 ATOM 324 H HB . THR A 1 22 ? 20.396 -1.309 70.839 1.00 41.34 ? 51 THR A HB 1 ATOM 325 H HG1 . THR A 1 22 ? 22.371 -1.204 69.062 1.00 39.79 ? 51 THR A HG1 1 ATOM 326 H HG21 . THR A 1 22 ? 19.753 -2.295 68.812 1.00 42.75 ? 51 THR A HG21 1 ATOM 327 H HG22 . THR A 1 22 ? 18.934 -0.965 69.039 1.00 42.75 ? 51 THR A HG22 1 ATOM 328 H HG23 . THR A 1 22 ? 20.154 -0.979 68.037 1.00 42.75 ? 51 THR A HG23 1 ATOM 329 N N . MET A 1 23 ? 21.076 0.782 72.547 1.00 35.51 ? 52 MET A N 1 ATOM 330 C CA . MET A 1 23 ? 21.770 0.878 73.825 1.00 37.41 ? 52 MET A CA 1 ATOM 331 C C . MET A 1 23 ? 21.072 -0.009 74.849 1.00 38.25 ? 52 MET A C 1 ATOM 332 O O . MET A 1 23 ? 19.857 -0.197 74.791 1.00 39.95 ? 52 MET A O 1 ATOM 333 C CB . MET A 1 23 ? 21.823 2.326 74.318 1.00 39.42 ? 52 MET A CB 1 ATOM 334 C CG . MET A 1 23 ? 20.466 2.980 74.516 1.00 41.96 ? 52 MET A CG 1 ATOM 335 S SD . MET A 1 23 ? 20.597 4.575 75.343 1.00 30.30 ? 52 MET A SD 1 ATOM 336 C CE . MET A 1 23 ? 18.898 5.137 75.281 1.00 31.49 ? 52 MET A CE 1 ATOM 337 H H . MET A 1 23 ? 20.230 0.646 72.622 1.00 42.61 ? 52 MET A H 1 ATOM 338 H HA . MET A 1 23 ? 22.682 0.569 73.710 1.00 44.89 ? 52 MET A HA 1 ATOM 339 H HB2 . MET A 1 23 ? 22.286 2.346 75.170 1.00 47.31 ? 52 MET A HB2 1 ATOM 340 H HB3 . MET A 1 23 ? 22.313 2.856 73.670 1.00 47.31 ? 52 MET A HB3 1 ATOM 341 H HG2 . MET A 1 23 ? 20.051 3.121 73.650 1.00 50.35 ? 52 MET A HG2 1 ATOM 342 H HG3 . MET A 1 23 ? 19.910 2.401 75.061 1.00 50.35 ? 52 MET A HG3 1 ATOM 343 H HE1 . MET A 1 23 ? 18.838 6.007 75.705 1.00 37.79 ? 52 MET A HE1 1 ATOM 344 H HE2 . MET A 1 23 ? 18.621 5.201 74.353 1.00 37.79 ? 52 MET A HE2 1 ATOM 345 H HE3 . MET A 1 23 ? 18.338 4.500 75.750 1.00 37.79 ? 52 MET A HE3 1 ATOM 346 N N . CYS A 1 24 ? 21.844 -0.554 75.782 1.00 44.79 ? 53 CYS A N 1 ATOM 347 C CA . CYS A 1 24 ? 21.311 -1.486 76.770 1.00 47.27 ? 53 CYS A CA 1 ATOM 348 C C . CYS A 1 24 ? 20.254 -0.831 77.649 1.00 50.16 ? 53 CYS A C 1 ATOM 349 O O . CYS A 1 24 ? 20.267 0.383 77.851 1.00 50.57 ? 53 CYS A O 1 ATOM 350 C CB . CYS A 1 24 ? 22.437 -2.039 77.645 1.00 46.98 ? 53 CYS A CB 1 ATOM 351 S SG . CYS A 1 24 ? 23.200 -0.812 78.727 1.00 42.42 ? 53 CYS A SG 1 ATOM 352 H H . CYS A 1 24 ? 22.686 -0.400 75.866 1.00 53.75 ? 53 CYS A H 1 ATOM 353 H HA . CYS A 1 24 ? 20.896 -2.232 76.308 1.00 56.73 ? 53 CYS A HA 1 ATOM 354 H HB2 . CYS A 1 24 ? 22.078 -2.745 78.205 1.00 56.37 ? 53 CYS A HB2 1 ATOM 355 H HB3 . CYS A 1 24 ? 23.130 -2.398 77.070 1.00 56.37 ? 53 CYS A HB3 1 ATOM 356 N N . GLY A 1 25 ? 19.341 -1.647 78.168 1.00 36.46 ? 54 GLY A N 1 ATOM 357 C CA . GLY A 1 25 ? 18.309 -1.173 79.071 1.00 37.65 ? 54 GLY A CA 1 ATOM 358 C C . GLY A 1 25 ? 17.382 -0.165 78.422 1.00 42.58 ? 54 GLY A C 1 ATOM 359 O O . GLY A 1 25 ? 16.964 0.803 79.058 1.00 42.58 ? 54 GLY A O 1 ATOM 360 H H . GLY A 1 25 ? 19.301 -2.491 78.007 1.00 43.75 ? 54 GLY A H 1 ATOM 361 H HA2 . GLY A 1 25 ? 17.778 -1.925 79.377 1.00 45.18 ? 54 GLY A HA2 1 ATOM 362 H HA3 . GLY A 1 25 ? 18.723 -0.755 79.843 1.00 45.18 ? 54 GLY A HA3 1 ATOM 363 N N . GLN A 1 26 ? 17.067 -0.386 77.149 1.00 54.25 ? 55 GLN A N 1 ATOM 364 C CA . GLN A 1 26 ? 16.172 0.503 76.419 1.00 57.51 ? 55 GLN A CA 1 ATOM 365 C C . GLN A 1 26 ? 14.799 0.532 77.086 1.00 63.21 ? 55 GLN A C 1 ATOM 366 O O . GLN A 1 26 ? 14.248 1.602 77.346 1.00 64.98 ? 55 GLN A O 1 ATOM 367 C CB . GLN A 1 26 ? 16.045 0.059 74.960 1.00 55.27 ? 55 GLN A CB 1 ATOM 368 C CG . GLN A 1 26 ? 15.506 1.135 74.026 1.00 55.13 ? 55 GLN A CG 1 ATOM 369 C CD . GLN A 1 26 ? 16.526 2.220 73.735 1.00 55.75 ? 55 GLN A CD 1 ATOM 370 O OE1 . GLN A 1 26 ? 16.393 3.355 74.195 1.00 56.99 ? 55 GLN A OE1 1 ATOM 371 N NE2 . GLN A 1 26 ? 17.550 1.876 72.963 1.00 55.49 ? 55 GLN A NE2 1 ATOM 372 H H . GLN A 1 26 ? 17.360 -1.048 76.685 1.00 65.10 ? 55 GLN A H 1 ATOM 373 H HA . GLN A 1 26 ? 16.535 1.403 76.432 1.00 69.02 ? 55 GLN A HA 1 ATOM 374 H HB2 . GLN A 1 26 ? 16.921 -0.201 74.636 1.00 66.33 ? 55 GLN A HB2 1 ATOM 375 H HB3 . GLN A 1 26 ? 15.441 -0.698 74.916 1.00 66.33 ? 55 GLN A HB3 1 ATOM 376 H HG2 . GLN A 1 26 ? 15.254 0.726 73.184 1.00 66.16 ? 55 GLN A HG2 1 ATOM 377 H HG3 . GLN A 1 26 ? 14.733 1.553 74.437 1.00 66.16 ? 55 GLN A HG3 1 ATOM 378 H HE21 . GLN A 1 26 ? 17.608 1.075 72.657 1.00 66.59 ? 55 GLN A HE21 1 ATOM 379 H HE22 . GLN A 1 26 ? 18.156 2.455 72.769 1.00 66.59 ? 55 GLN A HE22 1 ATOM 380 N N . ASN A 1 27 ? 14.257 -0.651 77.361 1.00 85.75 ? 56 ASN A N 1 ATOM 381 C CA . ASN A 1 27 ? 12.968 -0.777 78.033 1.00 91.03 ? 56 ASN A CA 1 ATOM 382 C C . ASN A 1 27 ? 13.117 -0.757 79.554 1.00 84.59 ? 56 ASN A C 1 ATOM 383 O O . ASN A 1 27 ? 13.139 0.310 80.169 1.00 84.75 ? 56 ASN A O 1 ATOM 384 C CB . ASN A 1 27 ? 12.267 -2.065 77.597 1.00 102.77 ? 56 ASN A CB 1 ATOM 385 C CG . ASN A 1 27 ? 11.947 -2.086 76.119 1.00 113.29 ? 56 ASN A CG 1 ATOM 386 O OD1 . ASN A 1 27 ? 12.363 -1.208 75.363 1.00 115.22 ? 56 ASN A OD1 1 ATOM 387 N ND2 . ASN A 1 27 ? 11.203 -3.101 75.698 1.00 121.08 ? 56 ASN A ND2 1 ATOM 388 H H . ASN A 1 27 ? 14.622 -1.405 77.166 1.00 102.90 ? 56 ASN A H 1 ATOM 389 H HA . ASN A 1 27 ? 12.405 -0.030 77.778 1.00 109.23 ? 56 ASN A HA 1 ATOM 390 H HB2 . ASN A 1 27 ? 12.846 -2.820 77.789 1.00 123.33 ? 56 ASN A HB2 1 ATOM 391 H HB3 . ASN A 1 27 ? 11.434 -2.153 78.086 1.00 123.33 ? 56 ASN A HB3 1 ATOM 392 H HD21 . ASN A 1 27 ? 10.936 -3.695 76.259 1.00 145.30 ? 56 ASN A HD21 1 ATOM 393 N N . ALA A 1 28 ? 13.220 -1.943 80.150 1.00 63.18 ? 57 ALA A N 1 ATOM 394 C CA . ALA A 1 28 ? 13.373 -2.087 81.593 1.00 58.68 ? 57 ALA A CA 1 ATOM 395 C C . ALA A 1 28 ? 14.841 -2.293 81.950 1.00 52.96 ? 57 ALA A C 1 ATOM 396 O O . ALA A 1 28 ? 15.720 -2.155 81.100 1.00 51.55 ? 57 ALA A O 1 ATOM 397 C CB . ALA A 1 28 ? 12.532 -3.248 82.102 1.00 59.67 ? 57 ALA A CB 1 ATOM 398 H H . ALA A 1 28 ? 13.203 -2.693 79.730 1.00 75.82 ? 57 ALA A H 1 ATOM 399 H HA . ALA A 1 28 ? 13.066 -1.277 82.029 1.00 70.42 ? 57 ALA A HA 1 ATOM 400 H HB1 . ALA A 1 28 ? 12.649 -3.325 83.062 1.00 71.61 ? 57 ALA A HB1 1 ATOM 401 H HB2 . ALA A 1 28 ? 11.600 -3.076 81.894 1.00 71.61 ? 57 ALA A HB2 1 ATOM 402 H HB3 . ALA A 1 28 ? 12.824 -4.064 81.666 1.00 71.61 ? 57 ALA A HB3 1 ATOM 403 N N . THR A 1 29 ? 15.100 -2.619 83.212 1.00 45.58 ? 58 THR A N 1 ATOM 404 C CA . THR A 1 29 ? 16.461 -2.851 83.676 1.00 43.04 ? 58 THR A CA 1 ATOM 405 C C . THR A 1 29 ? 16.998 -4.167 83.121 1.00 40.33 ? 58 THR A C 1 ATOM 406 O O . THR A 1 29 ? 16.230 -5.082 82.827 1.00 40.50 ? 58 THR A O 1 ATOM 407 C CB . THR A 1 29 ? 16.531 -2.876 85.213 1.00 45.20 ? 58 THR A CB 1 ATOM 408 O OG1 . THR A 1 29 ? 15.743 -1.806 85.749 1.00 46.79 ? 58 THR A OG1 1 ATOM 409 C CG2 . THR A 1 29 ? 17.968 -2.729 85.687 1.00 44.73 ? 58 THR A CG2 1 ATOM 410 H H . THR A 1 29 ? 14.501 -2.712 83.822 1.00 54.70 ? 58 THR A H 1 ATOM 411 H HA . THR A 1 29 ? 17.032 -2.134 83.359 1.00 51.65 ? 58 THR A HA 1 ATOM 412 H HB . THR A 1 29 ? 16.188 -3.723 85.537 1.00 54.25 ? 58 THR A HB 1 ATOM 413 H HG1 . THR A 1 29 ? 15.778 -1.816 86.589 1.00 56.15 ? 58 THR A HG1 1 ATOM 414 H HG21 . THR A 1 29 ? 18.000 -2.746 86.657 1.00 53.68 ? 58 THR A HG21 1 ATOM 415 H HG22 . THR A 1 29 ? 18.507 -3.457 85.341 1.00 53.68 ? 58 THR A HG22 1 ATOM 416 H HG23 . THR A 1 29 ? 18.335 -1.888 85.375 1.00 53.68 ? 58 THR A HG23 1 ATOM 417 N N . GLU A 1 30 ? 18.317 -4.256 82.983 1.00 46.78 ? 59 GLU A N 1 ATOM 418 C CA . GLU A 1 30 ? 18.960 -5.448 82.441 1.00 45.28 ? 59 GLU A CA 1 ATOM 419 C C . GLU A 1 30 ? 20.254 -5.757 83.176 1.00 42.16 ? 59 GLU A C 1 ATOM 420 O O . GLU A 1 30 ? 21.085 -4.874 83.388 1.00 41.24 ? 59 GLU A O 1 ATOM 421 C CB . GLU A 1 30 ? 19.255 -5.271 80.950 1.00 46.08 ? 59 GLU A CB 1 ATOM 422 C CG . GLU A 1 30 ? 18.026 -5.071 80.081 1.00 48.61 ? 59 GLU A CG 1 ATOM 423 C CD . GLU A 1 30 ? 18.379 -4.854 78.621 1.00 49.92 ? 59 GLU A CD 1 ATOM 424 O OE1 . GLU A 1 30 ? 19.586 -4.842 78.295 1.00 49.66 ? 59 GLU A OE1 1 ATOM 425 O OE2 . GLU A 1 30 ? 17.449 -4.695 77.800 1.00 51.05 ? 59 GLU A OE2 1 ATOM 426 H H . GLU A 1 30 ? 18.868 -3.632 83.200 1.00 56.14 ? 59 GLU A H 1 ATOM 427 H HA . GLU A 1 30 ? 18.364 -6.206 82.544 1.00 54.34 ? 59 GLU A HA 1 ATOM 428 H HB2 . GLU A 1 30 ? 19.825 -4.495 80.836 1.00 55.30 ? 59 GLU A HB2 1 ATOM 429 H HB3 . GLU A 1 30 ? 19.715 -6.063 80.629 1.00 55.30 ? 59 GLU A HB3 1 ATOM 430 H HG2 . GLU A 1 30 ? 17.463 -5.858 80.141 1.00 58.33 ? 59 GLU A HG2 1 ATOM 431 H HG3 . GLU A 1 30 ? 17.542 -4.290 80.393 1.00 58.33 ? 59 GLU A HG3 1 ATOM 432 N N . LEU A 1 31 ? 20.416 -7.016 83.567 1.00 42.51 ? 60 LEU A N 1 ATOM 433 C CA . LEU A 1 31 ? 21.669 -7.483 84.139 1.00 40.52 ? 60 LEU A CA 1 ATOM 434 C C . LEU A 1 31 ? 22.686 -7.689 83.024 1.00 39.87 ? 60 LEU A C 1 ATOM 435 O O . LEU A 1 31 ? 22.359 -8.255 81.979 1.00 40.56 ? 60 LEU A O 1 ATOM 436 C CB . LEU A 1 31 ? 21.456 -8.781 84.921 1.00 39.74 ? 60 LEU A CB 1 ATOM 437 C CG . LEU A 1 31 ? 22.705 -9.442 85.514 1.00 37.87 ? 60 LEU A CG 1 ATOM 438 C CD1 . LEU A 1 31 ? 23.416 -8.505 86.479 1.00 37.32 ? 60 LEU A CD1 1 ATOM 439 C CD2 . LEU A 1 31 ? 22.336 -10.743 86.208 1.00 38.10 ? 60 LEU A CD2 1 ATOM 440 H H . LEU A 1 31 ? 19.809 -7.623 83.510 1.00 51.01 ? 60 LEU A H 1 ATOM 441 H HA . LEU A 1 31 ? 22.015 -6.811 84.748 1.00 48.63 ? 60 LEU A HA 1 ATOM 442 H HB2 . LEU A 1 31 ? 20.853 -8.595 85.658 1.00 47.69 ? 60 LEU A HB2 1 ATOM 443 H HB3 . LEU A 1 31 ? 21.045 -9.428 84.327 1.00 47.69 ? 60 LEU A HB3 1 ATOM 444 H HG . LEU A 1 31 ? 23.321 -9.652 84.795 1.00 45.44 ? 60 LEU A HG 1 ATOM 445 H HD11 . LEU A 1 31 ? 24.199 -8.954 86.834 1.00 44.79 ? 60 LEU A HD11 1 ATOM 446 H HD12 . LEU A 1 31 ? 23.682 -7.703 86.002 1.00 44.79 ? 60 LEU A HD12 1 ATOM 447 H HD13 . LEU A 1 31 ? 22.810 -8.276 87.201 1.00 44.79 ? 60 LEU A HD13 1 ATOM 448 H HD21 . LEU A 1 31 ? 23.140 -11.143 86.576 1.00 45.72 ? 60 LEU A HD21 1 ATOM 449 H HD22 . LEU A 1 31 ? 21.706 -10.552 86.921 1.00 45.72 ? 60 LEU A HD22 1 ATOM 450 H HD23 . LEU A 1 31 ? 21.934 -11.342 85.561 1.00 45.72 ? 60 LEU A HD23 1 ATOM 451 N N . PHE A 1 32 ? 23.913 -7.227 83.246 1.00 33.01 ? 61 PHE A N 1 ATOM 452 C CA . PHE A 1 32 ? 24.989 -7.413 82.277 1.00 32.10 ? 61 PHE A CA 1 ATOM 453 C C . PHE A 1 32 ? 26.301 -7.714 82.990 1.00 31.87 ? 61 PHE A C 1 ATOM 454 O O . PHE A 1 32 ? 26.549 -7.219 84.091 1.00 32.17 ? 61 PHE A O 1 ATOM 455 C CB . PHE A 1 32 ? 25.141 -6.177 81.382 1.00 31.45 ? 61 PHE A CB 1 ATOM 456 C CG . PHE A 1 32 ? 25.692 -4.971 82.091 1.00 31.27 ? 61 PHE A CG 1 ATOM 457 C CD1 . PHE A 1 32 ? 24.843 -4.014 82.622 1.00 31.78 ? 61 PHE A CD1 1 ATOM 458 C CD2 . PHE A 1 32 ? 27.061 -4.786 82.213 1.00 30.72 ? 61 PHE A CD2 1 ATOM 459 C CE1 . PHE A 1 32 ? 25.349 -2.901 83.270 1.00 31.72 ? 61 PHE A CE1 1 ATOM 460 C CE2 . PHE A 1 32 ? 27.570 -3.678 82.861 1.00 30.67 ? 61 PHE A CE2 1 ATOM 461 C CZ . PHE A 1 32 ? 26.714 -2.734 83.388 1.00 31.16 ? 61 PHE A CZ 1 ATOM 462 H H . PHE A 1 32 ? 24.150 -6.800 83.954 1.00 39.62 ? 61 PHE A H 1 ATOM 463 H HA . PHE A 1 32 ? 24.776 -8.170 81.710 1.00 38.52 ? 61 PHE A HA 1 ATOM 464 H HB2 . PHE A 1 32 ? 25.743 -6.392 80.653 1.00 37.73 ? 61 PHE A HB2 1 ATOM 465 H HB3 . PHE A 1 32 ? 24.269 -5.939 81.029 1.00 37.73 ? 61 PHE A HB3 1 ATOM 466 H HD1 . PHE A 1 32 ? 23.923 -4.122 82.546 1.00 38.13 ? 61 PHE A HD1 1 ATOM 467 H HD2 . PHE A 1 32 ? 27.643 -5.420 81.860 1.00 36.87 ? 61 PHE A HD2 1 ATOM 468 H HE1 . PHE A 1 32 ? 24.770 -2.267 83.625 1.00 38.06 ? 61 PHE A HE1 1 ATOM 469 H HE2 . PHE A 1 32 ? 28.490 -3.567 82.939 1.00 36.80 ? 61 PHE A HE2 1 ATOM 470 H HZ . PHE A 1 32 ? 27.055 -1.987 83.824 1.00 37.39 ? 61 PHE A HZ 1 ATOM 471 N N . CYS A 1 33 ? 27.134 -8.528 82.350 1.00 40.99 ? 62 CYS A N 1 ATOM 472 C CA . CYS A 1 33 ? 28.428 -8.908 82.901 1.00 40.74 ? 62 CYS A CA 1 ATOM 473 C C . CYS A 1 33 ? 29.538 -8.644 81.896 1.00 39.73 ? 62 CYS A C 1 ATOM 474 O O . CYS A 1 33 ? 29.310 -8.658 80.686 1.00 39.20 ? 62 CYS A O 1 ATOM 475 C CB . CYS A 1 33 ? 28.432 -10.384 83.302 1.00 41.60 ? 62 CYS A CB 1 ATOM 476 S SG . CYS A 1 33 ? 27.398 -10.775 84.731 1.00 47.06 ? 62 CYS A SG 1 ATOM 477 H H . CYS A 1 33 ? 26.969 -8.879 81.583 1.00 49.19 ? 62 CYS A H 1 ATOM 478 H HA . CYS A 1 33 ? 28.605 -8.378 83.694 1.00 48.89 ? 62 CYS A HA 1 ATOM 479 H HB2 . CYS A 1 33 ? 28.109 -10.909 82.553 1.00 49.92 ? 62 CYS A HB2 1 ATOM 480 H HB3 . CYS A 1 33 ? 29.341 -10.645 83.516 1.00 49.92 ? 62 CYS A HB3 1 ATOM 481 N N . PHE A 1 34 ? 30.737 -8.399 82.414 1.00 47.10 ? 63 PHE A N 1 ATOM 482 C CA . PHE A 1 34 ? 31.924 -8.235 81.586 1.00 46.89 ? 63 PHE A CA 1 ATOM 483 C C . PHE A 1 34 ? 32.960 -9.288 81.956 1.00 48.39 ? 63 PHE A C 1 ATOM 484 O O . PHE A 1 34 ? 33.116 -9.635 83.128 1.00 48.77 ? 63 PHE A O 1 ATOM 485 C CB . PHE A 1 34 ? 32.504 -6.828 81.742 1.00 45.56 ? 63 PHE A CB 1 ATOM 486 C CG . PHE A 1 34 ? 31.826 -5.796 80.885 1.00 43.83 ? 63 PHE A CG 1 ATOM 487 C CD1 . PHE A 1 34 ? 32.293 -5.523 79.609 1.00 42.52 ? 63 PHE A CD1 1 ATOM 488 C CD2 . PHE A 1 34 ? 30.719 -5.105 81.349 1.00 43.71 ? 63 PHE A CD2 1 ATOM 489 C CE1 . PHE A 1 34 ? 31.671 -4.577 78.815 1.00 41.68 ? 63 PHE A CE1 1 ATOM 490 C CE2 . PHE A 1 34 ? 30.094 -4.158 80.557 1.00 43.00 ? 63 PHE A CE2 1 ATOM 491 C CZ . PHE A 1 34 ? 30.571 -3.895 79.289 1.00 41.89 ? 63 PHE A CZ 1 ATOM 492 H H . PHE A 1 34 ? 30.891 -8.323 83.257 1.00 56.52 ? 63 PHE A H 1 ATOM 493 H HA . PHE A 1 34 ? 31.683 -8.361 80.655 1.00 56.27 ? 63 PHE A HA 1 ATOM 494 H HB2 . PHE A 1 34 ? 32.411 -6.553 82.668 1.00 54.67 ? 63 PHE A HB2 1 ATOM 495 H HB3 . PHE A 1 34 ? 33.443 -6.847 81.497 1.00 54.67 ? 63 PHE A HB3 1 ATOM 496 H HD1 . PHE A 1 34 ? 33.034 -5.980 79.284 1.00 51.03 ? 63 PHE A HD1 1 ATOM 497 H HD2 . PHE A 1 34 ? 30.394 -5.278 82.202 1.00 52.45 ? 63 PHE A HD2 1 ATOM 498 H HE1 . PHE A 1 34 ? 31.995 -4.402 77.961 1.00 50.02 ? 63 PHE A HE1 1 ATOM 499 H HE2 . PHE A 1 34 ? 29.353 -3.699 80.880 1.00 51.60 ? 63 PHE A HE2 1 ATOM 500 H HZ . PHE A 1 34 ? 30.152 -3.258 78.756 1.00 50.26 ? 63 PHE A HZ 1 ATOM 501 N N . TYR A 1 35 ? 33.657 -9.796 80.945 1.00 43.96 ? 64 TYR A N 1 ATOM 502 C CA . TYR A 1 35 ? 34.650 -10.845 81.134 1.00 45.22 ? 64 TYR A CA 1 ATOM 503 C C . TYR A 1 35 ? 35.960 -10.462 80.459 1.00 42.56 ? 64 TYR A C 1 ATOM 504 O O . TYR A 1 35 ? 35.985 -10.122 79.277 1.00 42.82 ? 64 TYR A O 1 ATOM 505 C CB . TYR A 1 35 ? 34.138 -12.177 80.578 1.00 48.93 ? 64 TYR A CB 1 ATOM 506 C CG . TYR A 1 35 ? 32.945 -12.741 81.322 1.00 51.76 ? 64 TYR A CG 1 ATOM 507 C CD1 . TYR A 1 35 ? 31.691 -12.151 81.215 1.00 52.45 ? 64 TYR A CD1 1 ATOM 508 C CD2 . TYR A 1 35 ? 33.071 -13.869 82.123 1.00 53.04 ? 64 TYR A CD2 1 ATOM 509 C CE1 . TYR A 1 35 ? 30.600 -12.662 81.892 1.00 53.28 ? 64 TYR A CE1 1 ATOM 510 C CE2 . TYR A 1 35 ? 31.983 -14.388 82.803 1.00 53.79 ? 64 TYR A CE2 1 ATOM 511 C CZ . TYR A 1 35 ? 30.751 -13.780 82.683 1.00 53.81 ? 64 TYR A CZ 1 ATOM 512 O OH . TYR A 1 35 ? 29.664 -14.288 83.357 1.00 54.05 ? 64 TYR A OH 1 ATOM 513 H H . TYR A 1 35 ? 33.571 -9.545 80.127 1.00 52.75 ? 64 TYR A H 1 ATOM 514 H HA . TYR A 1 35 ? 34.819 -10.957 82.083 1.00 54.27 ? 64 TYR A HA 1 ATOM 515 H HB2 . TYR A 1 35 ? 33.875 -12.048 79.653 1.00 58.72 ? 64 TYR A HB2 1 ATOM 516 H HB3 . TYR A 1 35 ? 34.853 -12.831 80.627 1.00 58.72 ? 64 TYR A HB3 1 ATOM 517 H HD1 . TYR A 1 35 ? 31.586 -11.395 80.683 1.00 62.94 ? 64 TYR A HD1 1 ATOM 518 H HD2 . TYR A 1 35 ? 33.901 -14.280 82.207 1.00 63.65 ? 64 TYR A HD2 1 ATOM 519 H HE1 . TYR A 1 35 ? 29.768 -12.254 81.812 1.00 63.94 ? 64 TYR A HE1 1 ATOM 520 H HE2 . TYR A 1 35 ? 32.083 -15.142 83.338 1.00 64.54 ? 64 TYR A HE2 1 ATOM 521 H HH . TYR A 1 35 ? 28.983 -13.823 83.196 1.00 64.86 ? 64 TYR A HH 1 ATOM 522 N N . SER A 1 36 ? 37.042 -10.514 81.227 1.00 31.08 ? 65 SER A N 1 ATOM 523 C CA . SER A 1 36 ? 38.380 -10.264 80.708 1.00 30.63 ? 65 SER A CA 1 ATOM 524 C C . SER A 1 36 ? 39.309 -11.384 81.166 1.00 34.23 ? 65 SER A C 1 ATOM 525 O O . SER A 1 36 ? 38.875 -12.311 81.852 1.00 36.05 ? 65 SER A O 1 ATOM 526 C CB . SER A 1 36 ? 38.894 -8.900 81.169 1.00 29.96 ? 65 SER A CB 1 ATOM 527 O OG . SER A 1 36 ? 38.828 -8.779 82.578 1.00 30.40 ? 65 SER A OG 1 ATOM 528 H H . SER A 1 36 ? 37.027 -10.696 82.068 1.00 37.30 ? 65 SER A H 1 ATOM 529 H HA . SER A 1 36 ? 38.353 -10.268 79.738 1.00 36.75 ? 65 SER A HA 1 ATOM 530 H HB2 . SER A 1 36 ? 39.816 -8.799 80.887 1.00 35.95 ? 65 SER A HB2 1 ATOM 531 H HB3 . SER A 1 36 ? 38.348 -8.206 80.768 1.00 35.95 ? 65 SER A HB3 1 ATOM 532 H HG . SER A 1 36 ? 39.114 -8.026 82.816 1.00 36.48 ? 65 SER A HG 1 ATOM 533 N N . GLU A 1 37 ? 40.580 -11.296 80.784 1.00 37.84 ? 66 GLU A N 1 ATOM 534 C CA . GLU A 1 37 ? 41.547 -12.351 81.076 1.00 39.85 ? 66 GLU A CA 1 ATOM 535 C C . GLU A 1 37 ? 42.783 -11.800 81.775 1.00 40.83 ? 66 GLU A C 1 ATOM 536 O O . GLU A 1 37 ? 43.102 -10.617 81.654 1.00 40.20 ? 66 GLU A O 1 ATOM 537 C CB . GLU A 1 37 ? 41.959 -13.069 79.785 1.00 40.53 ? 66 GLU A CB 1 ATOM 538 C CG . GLU A 1 37 ? 43.009 -12.342 78.945 1.00 41.73 ? 66 GLU A CG 1 ATOM 539 C CD . GLU A 1 37 ? 42.577 -10.948 78.524 1.00 42.31 ? 66 GLU A CD 1 ATOM 540 O OE1 . GLU A 1 37 ? 41.361 -10.666 78.547 1.00 42.35 ? 66 GLU A OE1 1 ATOM 541 O OE2 . GLU A 1 37 ? 43.455 -10.132 78.169 1.00 42.77 ? 66 GLU A OE2 1 ATOM 542 H H . GLU A 1 37 ? 40.910 -10.630 80.352 1.00 45.40 ? 66 GLU A H 1 ATOM 543 H HA . GLU A 1 37 ? 41.135 -13.003 81.664 1.00 47.82 ? 66 GLU A HA 1 ATOM 544 H HB2 . GLU A 1 37 ? 42.322 -13.938 80.018 1.00 48.63 ? 66 GLU A HB2 1 ATOM 545 H HB3 . GLU A 1 37 ? 41.171 -13.184 79.232 1.00 48.63 ? 66 GLU A HB3 1 ATOM 546 H HG2 . GLU A 1 37 ? 43.824 -12.258 79.464 1.00 50.07 ? 66 GLU A HG2 1 ATOM 547 H HG3 . GLU A 1 37 ? 43.180 -12.857 78.141 1.00 50.07 ? 66 GLU A HG3 1 ATOM 548 N N . ASN A 1 38 ? 43.467 -12.671 82.512 1.00 62.47 ? 67 ASN A N 1 ATOM 549 C CA . ASN A 1 38 ? 44.754 -12.339 83.113 1.00 61.31 ? 67 ASN A CA 1 ATOM 550 C C . ASN A 1 38 ? 45.887 -13.005 82.333 1.00 62.77 ? 67 ASN A C 1 ATOM 551 O O . ASN A 1 38 ? 45.662 -13.553 81.254 1.00 62.43 ? 67 ASN A O 1 ATOM 552 C CB . ASN A 1 38 ? 44.781 -12.747 84.590 1.00 62.15 ? 67 ASN A CB 1 ATOM 553 C CG . ASN A 1 38 ? 44.413 -14.201 84.810 1.00 62.99 ? 67 ASN A CG 1 ATOM 554 O OD1 . ASN A 1 38 ? 44.856 -15.088 84.080 1.00 63.71 ? 67 ASN A OD1 1 ATOM 555 N ND2 . ASN A 1 38 ? 43.594 -14.451 85.824 1.00 63.07 ? 67 ASN A ND2 1 ATOM 556 H H . ASN A 1 38 ? 43.203 -13.472 82.680 1.00 74.96 ? 67 ASN A H 1 ATOM 557 H HA . ASN A 1 38 ? 44.884 -11.378 83.066 1.00 73.57 ? 67 ASN A HA 1 ATOM 558 H HB2 . ASN A 1 38 ? 45.675 -12.608 84.940 1.00 74.58 ? 67 ASN A HB2 1 ATOM 559 H HB3 . ASN A 1 38 ? 44.146 -12.201 85.080 1.00 74.58 ? 67 ASN A HB3 1 ATOM 560 H HD21 . ASN A 1 38 ? 43.353 -15.259 85.994 1.00 75.69 ? 67 ASN A HD21 1 ATOM 561 H HD22 . ASN A 1 38 ? 43.304 -13.804 86.312 1.00 75.69 ? 67 ASN A HD22 1 ATOM 562 N N . ALA A 1 39 ? 47.099 -12.951 82.877 1.00 47.22 ? 68 ALA A N 1 ATOM 563 C CA . ALA A 1 39 ? 48.280 -13.453 82.182 1.00 48.50 ? 68 ALA A CA 1 ATOM 564 C C . ALA A 1 39 ? 48.154 -14.928 81.801 1.00 49.70 ? 68 ALA A C 1 ATOM 565 O O . ALA A 1 39 ? 48.590 -15.333 80.723 1.00 50.04 ? 68 ALA A O 1 ATOM 566 C CB . ALA A 1 39 ? 49.516 -13.241 83.043 1.00 49.23 ? 68 ALA A CB 1 ATOM 567 H H . ALA A 1 39 ? 47.265 -12.624 83.655 1.00 56.66 ? 68 ALA A H 1 ATOM 568 H HA . ALA A 1 39 ? 48.399 -12.946 81.364 1.00 58.19 ? 68 ALA A HA 1 ATOM 569 H HB1 . ALA A 1 39 ? 50.292 -13.579 82.569 1.00 59.08 ? 68 ALA A HB1 1 ATOM 570 H HB2 . ALA A 1 39 ? 49.621 -12.293 83.216 1.00 59.08 ? 68 ALA A HB2 1 ATOM 571 H HB3 . ALA A 1 39 ? 49.404 -13.720 83.879 1.00 59.08 ? 68 ALA A HB3 1 ATOM 572 N N . ASP A 1 40 ? 47.553 -15.723 82.680 1.00 60.73 ? 69 ASP A N 1 ATOM 573 C CA . ASP A 1 40 ? 47.407 -17.160 82.447 1.00 60.72 ? 69 ASP A CA 1 ATOM 574 C C . ASP A 1 40 ? 46.242 -17.481 81.510 1.00 59.52 ? 69 ASP A C 1 ATOM 575 O O . ASP A 1 40 ? 45.905 -18.648 81.312 1.00 60.75 ? 69 ASP A O 1 ATOM 576 C CB . ASP A 1 40 ? 47.214 -17.893 83.777 1.00 61.10 ? 69 ASP A CB 1 ATOM 577 H H . ASP A 1 40 ? 47.218 -15.455 83.426 1.00 72.87 ? 69 ASP A H 1 ATOM 578 H HA . ASP A 1 40 ? 48.219 -17.495 82.037 1.00 72.86 ? 69 ASP A HA 1 ATOM 579 N N . LEU A 1 41 ? 45.631 -16.440 80.947 1.00 37.86 ? 70 LEU A N 1 ATOM 580 C CA . LEU A 1 41 ? 44.468 -16.580 80.067 1.00 35.75 ? 70 LEU A CA 1 ATOM 581 C C . LEU A 1 41 ? 43.288 -17.245 80.778 1.00 36.69 ? 70 LEU A C 1 ATOM 582 O O . LEU A 1 41 ? 42.365 -17.744 80.135 1.00 37.70 ? 70 LEU A O 1 ATOM 583 C CB . LEU A 1 41 ? 44.831 -17.369 78.803 1.00 34.58 ? 70 LEU A CB 1 ATOM 584 C CG . LEU A 1 41 ? 45.969 -16.807 77.944 1.00 34.84 ? 70 LEU A CG 1 ATOM 585 C CD1 . LEU A 1 41 ? 45.996 -17.500 76.590 1.00 35.16 ? 70 LEU A CD1 1 ATOM 586 C CD2 . LEU A 1 41 ? 45.854 -15.297 77.765 1.00 34.06 ? 70 LEU A CD2 1 ATOM 587 H H . LEU A 1 41 ? 45.876 -15.624 81.061 1.00 45.43 ? 70 LEU A H 1 ATOM 588 H HA . LEU A 1 41 ? 44.183 -15.696 79.789 1.00 42.90 ? 70 LEU A HA 1 ATOM 589 H HB2 . LEU A 1 41 ? 45.088 -18.266 79.070 1.00 41.50 ? 70 LEU A HB2 1 ATOM 590 H HB3 . LEU A 1 41 ? 44.043 -17.417 78.240 1.00 41.50 ? 70 LEU A HB3 1 ATOM 591 H HG . LEU A 1 41 ? 46.813 -16.990 78.387 1.00 41.81 ? 70 LEU A HG 1 ATOM 592 H HD11 . LEU A 1 41 ? 46.722 -17.131 76.062 1.00 42.20 ? 70 LEU A HD11 1 ATOM 593 H HD12 . LEU A 1 41 ? 46.134 -18.451 76.724 1.00 42.20 ? 70 LEU A HD12 1 ATOM 594 H HD13 . LEU A 1 41 ? 45.150 -17.348 76.141 1.00 42.20 ? 70 LEU A HD13 1 ATOM 595 H HD21 . LEU A 1 41 ? 46.593 -14.988 77.218 1.00 40.87 ? 70 LEU A HD21 1 ATOM 596 H HD22 . LEU A 1 41 ? 45.011 -15.094 77.331 1.00 40.87 ? 70 LEU A HD22 1 ATOM 597 H HD23 . LEU A 1 41 ? 45.888 -14.873 78.637 1.00 40.87 ? 70 LEU A HD23 1 ATOM 598 N N . THR A 1 42 ? 43.325 -17.247 82.107 1.00 47.32 ? 71 THR A N 1 ATOM 599 C CA . THR A 1 42 ? 42.196 -17.700 82.905 1.00 46.97 ? 71 THR A CA 1 ATOM 600 C C . THR A 1 42 ? 41.179 -16.571 83.016 1.00 44.38 ? 71 THR A C 1 ATOM 601 O O . THR A 1 42 ? 41.554 -15.409 83.169 1.00 44.95 ? 71 THR A O 1 ATOM 602 C CB . THR A 1 42 ? 42.630 -18.134 84.318 1.00 48.11 ? 71 THR A CB 1 ATOM 603 O OG1 . THR A 1 42 ? 43.819 -18.930 84.238 1.00 49.37 ? 71 THR A OG1 1 ATOM 604 C CG2 . THR A 1 42 ? 41.526 -18.928 85.001 1.00 48.28 ? 71 THR A CG2 1 ATOM 605 H H . THR A 1 42 ? 44.000 -16.988 82.572 1.00 56.78 ? 71 THR A H 1 ATOM 606 H HA . THR A 1 42 ? 41.772 -18.455 82.468 1.00 56.36 ? 71 THR A HA 1 ATOM 607 H HB . THR A 1 42 ? 42.811 -17.345 84.853 1.00 57.73 ? 71 THR A HB 1 ATOM 608 H HG1 . THR A 1 42 ? 44.058 -19.168 85.008 1.00 59.24 ? 71 THR A HG1 1 ATOM 609 H HG21 . THR A 1 42 ? 41.810 -19.195 85.889 1.00 57.94 ? 71 THR A HG21 1 ATOM 610 H HG22 . THR A 1 42 ? 40.726 -18.384 85.077 1.00 57.94 ? 71 THR A HG22 1 ATOM 611 H HG23 . THR A 1 42 ? 41.320 -19.722 84.484 1.00 57.94 ? 71 THR A HG23 1 ATOM 612 N N . CYS A 1 43 ? 39.897 -16.907 82.937 1.00 33.27 ? 72 CYS A N 1 ATOM 613 C CA . CYS A 1 43 ? 38.851 -15.903 83.083 1.00 32.71 ? 72 CYS A CA 1 ATOM 614 C C . CYS A 1 43 ? 38.859 -15.324 84.491 1.00 32.94 ? 72 CYS A C 1 ATOM 615 O O . CYS A 1 43 ? 38.956 -16.057 85.475 1.00 33.52 ? 72 CYS A O 1 ATOM 616 C CB . CYS A 1 43 ? 37.479 -16.500 82.770 1.00 32.62 ? 72 CYS A CB 1 ATOM 617 S SG . CYS A 1 43 ? 37.217 -16.883 81.031 1.00 73.75 ? 72 CYS A SG 1 ATOM 618 H H . CYS A 1 43 ? 39.607 -17.705 82.802 1.00 39.92 ? 72 CYS A H 1 ATOM 619 H HA . CYS A 1 43 ? 39.016 -15.180 82.457 1.00 39.25 ? 72 CYS A HA 1 ATOM 620 H HB2 . CYS A 1 43 ? 37.377 -17.323 83.273 1.00 39.15 ? 72 CYS A HB2 1 ATOM 621 H HB3 . CYS A 1 43 ? 36.796 -15.865 83.039 1.00 39.15 ? 72 CYS A HB3 1 ATOM 622 N N . ARG A 1 44 ? 38.766 -14.002 84.576 1.00 39.87 ? 73 ARG A N 1 ATOM 623 C CA . ARG A 1 44 ? 38.691 -13.315 85.858 1.00 41.35 ? 73 ARG A CA 1 ATOM 624 C C . ARG A 1 44 ? 37.258 -13.364 86.362 1.00 42.15 ? 73 ARG A C 1 ATOM 625 O O . ARG A 1 44 ? 36.348 -13.726 85.617 1.00 42.01 ? 73 ARG A O 1 ATOM 626 C CB . ARG A 1 44 ? 39.166 -11.866 85.724 1.00 41.94 ? 73 ARG A CB 1 ATOM 627 C CG . ARG A 1 44 ? 40.399 -11.706 84.846 1.00 42.84 ? 73 ARG A CG 1 ATOM 628 C CD . ARG A 1 44 ? 40.922 -10.282 84.849 1.00 44.19 ? 73 ARG A CD 1 ATOM 629 N NE . ARG A 1 44 ? 42.193 -10.179 85.567 1.00 46.59 ? 73 ARG A NE 1 ATOM 630 C CZ . ARG A 1 44 ? 43.294 -9.588 85.104 1.00 48.26 ? 73 ARG A CZ 1 ATOM 631 N NH1 . ARG A 1 44 ? 43.319 -9.017 83.905 1.00 48.02 ? 73 ARG A NH1 1 ATOM 632 N NH2 . ARG A 1 44 ? 44.386 -9.566 85.854 1.00 49.93 ? 73 ARG A NH2 1 ATOM 633 H H . ARG A 1 44 ? 38.743 -13.475 83.897 1.00 47.85 ? 73 ARG A H 1 ATOM 634 H HA . ARG A 1 44 ? 39.260 -13.767 86.501 1.00 49.62 ? 73 ARG A HA 1 ATOM 635 H HB2 . ARG A 1 44 ? 38.453 -11.338 85.333 1.00 50.33 ? 73 ARG A HB2 1 ATOM 636 H HB3 . ARG A 1 44 ? 39.383 -11.526 86.606 1.00 50.33 ? 73 ARG A HB3 1 ATOM 637 H HG2 . ARG A 1 44 ? 41.102 -12.287 85.177 1.00 51.41 ? 73 ARG A HG2 1 ATOM 638 H HG3 . ARG A 1 44 ? 40.172 -11.943 83.933 1.00 51.41 ? 73 ARG A HG3 1 ATOM 639 H HD2 . ARG A 1 44 ? 41.066 -9.992 83.934 1.00 53.03 ? 73 ARG A HD2 1 ATOM 640 H HD3 . ARG A 1 44 ? 40.278 -9.705 85.287 1.00 53.03 ? 73 ARG A HD3 1 ATOM 641 H HE . ARG A 1 44 ? 42.233 -10.528 86.352 1.00 55.91 ? 73 ARG A HE 1 ATOM 642 H HH11 . ARG A 1 44 ? 42.615 -9.027 83.409 1.00 57.62 ? 73 ARG A HH11 1 ATOM 643 H HH12 . ARG A 1 44 ? 44.038 -8.640 83.623 1.00 57.62 ? 73 ARG A HH12 1 ATOM 644 H HH21 . ARG A 1 44 ? 44.381 -9.931 86.633 1.00 59.92 ? 73 ARG A HH21 1 ATOM 645 H HH22 . ARG A 1 44 ? 45.100 -9.184 85.563 1.00 59.92 ? 73 ARG A HH22 1 ATOM 646 N N . GLN A 1 45 ? 37.051 -13.012 87.625 1.00 47.85 ? 74 GLN A N 1 ATOM 647 C CA . GLN A 1 45 ? 35.696 -12.921 88.153 1.00 48.64 ? 74 GLN A CA 1 ATOM 648 C C . GLN A 1 45 ? 34.976 -11.757 87.471 1.00 48.00 ? 74 GLN A C 1 ATOM 649 O O . GLN A 1 45 ? 35.459 -10.626 87.504 1.00 47.84 ? 74 GLN A O 1 ATOM 650 C CB . GLN A 1 45 ? 35.711 -12.743 89.671 1.00 49.66 ? 74 GLN A CB 1 ATOM 651 C CG . GLN A 1 45 ? 36.214 -13.967 90.427 1.00 50.82 ? 74 GLN A CG 1 ATOM 652 C CD . GLN A 1 45 ? 35.342 -15.191 90.210 1.00 51.43 ? 74 GLN A CD 1 ATOM 653 O OE1 . GLN A 1 45 ? 34.119 -15.126 90.338 1.00 51.39 ? 74 GLN A OE1 1 ATOM 654 N NE2 . GLN A 1 45 ? 35.968 -16.315 89.873 1.00 51.74 ? 74 GLN A NE2 1 ATOM 655 H H . GLN A 1 45 ? 37.669 -12.823 88.192 1.00 57.42 ? 74 GLN A H 1 ATOM 656 H HA . GLN A 1 45 ? 35.216 -13.739 87.947 1.00 58.37 ? 74 GLN A HA 1 ATOM 657 H HB2 . GLN A 1 45 ? 36.291 -11.998 89.893 1.00 59.59 ? 74 GLN A HB2 1 ATOM 658 H HB3 . GLN A 1 45 ? 34.808 -12.558 89.973 1.00 59.59 ? 74 GLN A HB3 1 ATOM 659 H HG2 . GLN A 1 45 ? 37.111 -14.179 90.123 1.00 60.98 ? 74 GLN A HG2 1 ATOM 660 H HG3 . GLN A 1 45 ? 36.224 -13.770 91.377 1.00 60.98 ? 74 GLN A HG3 1 ATOM 661 H HE21 . GLN A 1 45 ? 36.824 -16.322 89.789 1.00 62.09 ? 74 GLN A HE21 1 ATOM 662 H HE22 . GLN A 1 45 ? 35.517 -17.035 89.739 1.00 62.09 ? 74 GLN A HE22 1 ATOM 663 N N . PRO A 1 46 ? 33.821 -12.028 86.841 1.00 53.90 ? 75 PRO A N 1 ATOM 664 C CA . PRO A 1 46 ? 33.182 -10.990 86.027 1.00 52.75 ? 75 PRO A CA 1 ATOM 665 C C . PRO A 1 46 ? 32.456 -9.932 86.848 1.00 53.22 ? 75 PRO A C 1 ATOM 666 O O . PRO A 1 46 ? 31.578 -10.269 87.641 1.00 53.92 ? 75 PRO A O 1 ATOM 667 C CB . PRO A 1 46 ? 32.189 -11.786 85.182 1.00 54.19 ? 75 PRO A CB 1 ATOM 668 C CG . PRO A 1 46 ? 31.796 -12.919 86.064 1.00 54.12 ? 75 PRO A CG 1 ATOM 669 C CD . PRO A 1 46 ? 33.020 -13.266 86.874 1.00 54.10 ? 75 PRO A CD 1 ATOM 670 H HA . PRO A 1 46 ? 33.832 -10.563 85.447 1.00 63.30 ? 75 PRO A HA 1 ATOM 671 H HB2 . PRO A 1 46 ? 31.422 -11.233 84.965 1.00 65.03 ? 75 PRO A HB2 1 ATOM 672 H HB3 . PRO A 1 46 ? 32.625 -12.108 84.377 1.00 65.03 ? 75 PRO A HB3 1 ATOM 673 H HG2 . PRO A 1 46 ? 31.072 -12.640 86.645 1.00 64.94 ? 75 PRO A HG2 1 ATOM 674 H HG3 . PRO A 1 46 ? 31.524 -13.674 85.519 1.00 64.94 ? 75 PRO A HG3 1 ATOM 675 H HD2 . PRO A 1 46 ? 32.771 -13.483 87.786 1.00 64.91 ? 75 PRO A HD2 1 ATOM 676 H HD3 . PRO A 1 46 ? 33.507 -13.994 86.456 1.00 64.91 ? 75 PRO A HD3 1 ATOM 677 N N . LYS A 1 47 ? 32.820 -8.668 86.656 1.00 51.73 ? 76 LYS A N 1 ATOM 678 C CA . LYS A 1 47 ? 32.081 -7.569 87.264 1.00 50.98 ? 76 LYS A CA 1 ATOM 679 C C . LYS A 1 47 ? 30.716 -7.460 86.593 1.00 49.27 ? 76 LYS A C 1 ATOM 680 O O . LYS A 1 47 ? 30.628 -7.302 85.374 1.00 48.11 ? 76 LYS A O 1 ATOM 681 C CB . LYS A 1 47 ? 32.847 -6.251 87.134 1.00 51.52 ? 76 LYS A CB 1 ATOM 682 C CG . LYS A 1 47 ? 34.134 -6.177 87.947 1.00 53.21 ? 76 LYS A CG 1 ATOM 683 C CD . LYS A 1 47 ? 33.871 -5.836 89.410 1.00 54.93 ? 76 LYS A CD 1 ATOM 684 C CE . LYS A 1 47 ? 35.137 -5.338 90.097 1.00 55.41 ? 76 LYS A CE 1 ATOM 685 N NZ . LYS A 1 47 ? 34.887 -4.840 91.481 1.00 56.14 ? 76 LYS A NZ 1 ATOM 686 H H . LYS A 1 47 ? 33.491 -8.420 86.179 1.00 62.08 ? 76 LYS A H 1 ATOM 687 H HA . LYS A 1 47 ? 31.946 -7.753 88.206 1.00 61.18 ? 76 LYS A HA 1 ATOM 688 H HB2 . LYS A 1 47 ? 33.081 -6.120 86.202 1.00 61.82 ? 76 LYS A HB2 1 ATOM 689 H HB3 . LYS A 1 47 ? 32.271 -5.528 87.430 1.00 61.82 ? 76 LYS A HB3 1 ATOM 690 H HG2 . LYS A 1 47 ? 34.581 -7.037 87.914 1.00 63.86 ? 76 LYS A HG2 1 ATOM 691 H HG3 . LYS A 1 47 ? 34.707 -5.488 87.575 1.00 63.86 ? 76 LYS A HG3 1 ATOM 692 H HD2 . LYS A 1 47 ? 33.201 -5.136 89.461 1.00 65.92 ? 76 LYS A HD2 1 ATOM 693 H HD3 . LYS A 1 47 ? 33.564 -6.630 89.875 1.00 65.92 ? 76 LYS A HD3 1 ATOM 694 H HE2 . LYS A 1 47 ? 35.775 -6.066 90.151 1.00 66.49 ? 76 LYS A HE2 1 ATOM 695 H HE3 . LYS A 1 47 ? 35.511 -4.607 89.580 1.00 66.49 ? 76 LYS A HE3 1 ATOM 696 H HZ1 . LYS A 1 47 ? 35.648 -4.560 91.846 1.00 67.36 ? 76 LYS A HZ1 1 ATOM 697 H HZ2 . LYS A 1 47 ? 34.309 -4.164 91.461 1.00 67.36 ? 76 LYS A HZ2 1 ATOM 698 H HZ3 . LYS A 1 47 ? 34.550 -5.494 91.983 1.00 67.36 ? 76 LYS A HZ3 1 ATOM 699 N N . CYS A 1 48 ? 29.659 -7.549 87.394 1.00 34.04 ? 77 CYS A N 1 ATOM 700 C CA . CYS A 1 48 ? 28.292 -7.476 86.889 1.00 33.49 ? 77 CYS A CA 1 ATOM 701 C C . CYS A 1 48 ? 27.577 -6.252 87.448 1.00 33.78 ? 77 CYS A C 1 ATOM 702 O O . CYS A 1 48 ? 27.962 -5.719 88.490 1.00 34.39 ? 77 CYS A O 1 ATOM 703 C CB . CYS A 1 48 ? 27.521 -8.748 87.245 1.00 33.83 ? 77 CYS A CB 1 ATOM 704 S SG . CYS A 1 48 ? 28.209 -10.251 86.518 1.00 99.52 ? 77 CYS A SG 1 ATOM 705 H H . CYS A 1 48 ? 29.708 -7.654 88.246 1.00 40.85 ? 77 CYS A H 1 ATOM 706 H HA . CYS A 1 48 ? 28.314 -7.397 85.922 1.00 40.19 ? 77 CYS A HA 1 ATOM 707 H HB2 . CYS A 1 48 ? 27.527 -8.856 88.209 1.00 40.60 ? 77 CYS A HB2 1 ATOM 708 H HB3 . CYS A 1 48 ? 26.608 -8.658 86.930 1.00 40.60 ? 77 CYS A HB3 1 ATOM 709 N N . ASP A 1 49 ? 26.531 -5.813 86.755 1.00 45.86 ? 78 ASP A N 1 ATOM 710 C CA . ASP A 1 49 ? 25.812 -4.606 87.142 1.00 45.84 ? 78 ASP A CA 1 ATOM 711 C C . ASP A 1 49 ? 24.490 -4.496 86.387 1.00 45.44 ? 78 ASP A C 1 ATOM 712 O O . ASP A 1 49 ? 24.232 -5.262 85.458 1.00 45.11 ? 78 ASP A O 1 ATOM 713 C CB . ASP A 1 49 ? 26.673 -3.368 86.879 1.00 46.39 ? 78 ASP A CB 1 ATOM 714 C CG . ASP A 1 49 ? 26.723 -2.425 88.066 1.00 48.66 ? 78 ASP A CG 1 ATOM 715 O OD1 . ASP A 1 49 ? 25.678 -2.229 88.722 1.00 49.71 ? 78 ASP A OD1 1 ATOM 716 O OD2 . ASP A 1 49 ? 27.813 -1.877 88.342 1.00 49.23 ? 78 ASP A OD2 1 ATOM 717 H H . ASP A 1 49 ? 26.218 -6.198 86.053 1.00 55.03 ? 78 ASP A H 1 ATOM 718 H HA . ASP A 1 49 ? 25.616 -4.643 88.092 1.00 55.00 ? 78 ASP A HA 1 ATOM 719 H HB2 . ASP A 1 49 ? 27.580 -3.650 86.681 1.00 55.67 ? 78 ASP A HB2 1 ATOM 720 H HB3 . ASP A 1 49 ? 26.305 -2.881 86.125 1.00 55.67 ? 78 ASP A HB3 1 ATOM 721 N N . LYS A 1 50 ? 23.657 -3.542 86.795 1.00 34.66 ? 79 LYS A N 1 ATOM 722 C CA . LYS A 1 50 ? 22.374 -3.305 86.142 1.00 34.99 ? 79 LYS A CA 1 ATOM 723 C C . LYS A 1 50 ? 22.452 -2.120 85.182 1.00 34.30 ? 79 LYS A C 1 ATOM 724 O O . LYS A 1 50 ? 23.133 -1.130 85.455 1.00 34.01 ? 79 LYS A O 1 ATOM 725 C CB . LYS A 1 50 ? 21.281 -3.059 87.182 1.00 36.34 ? 79 LYS A CB 1 ATOM 726 C CG . LYS A 1 50 ? 21.046 -4.229 88.125 1.00 37.16 ? 79 LYS A CG 1 ATOM 727 C CD . LYS A 1 50 ? 19.645 -4.195 88.721 1.00 38.56 ? 79 LYS A CD 1 ATOM 728 C CE . LYS A 1 50 ? 19.383 -2.915 89.504 1.00 39.33 ? 79 LYS A CE 1 ATOM 729 N NZ . LYS A 1 50 ? 17.983 -2.853 90.008 1.00 40.82 ? 79 LYS A NZ 1 ATOM 730 H H . LYS A 1 50 ? 23.814 -3.014 87.455 1.00 41.59 ? 79 LYS A H 1 ATOM 731 H HA . LYS A 1 50 ? 22.130 -4.091 85.629 1.00 41.99 ? 79 LYS A HA 1 ATOM 732 H HB2 . LYS A 1 50 ? 21.530 -2.292 87.720 1.00 43.61 ? 79 LYS A HB2 1 ATOM 733 H HB3 . LYS A 1 50 ? 20.447 -2.879 86.721 1.00 43.61 ? 79 LYS A HB3 1 ATOM 734 H HG2 . LYS A 1 50 ? 21.148 -5.060 87.635 1.00 44.59 ? 79 LYS A HG2 1 ATOM 735 H HG3 . LYS A 1 50 ? 21.687 -4.188 88.852 1.00 44.59 ? 79 LYS A HG3 1 ATOM 736 H HD2 . LYS A 1 50 ? 18.994 -4.249 88.005 1.00 46.27 ? 79 LYS A HD2 1 ATOM 737 H HD3 . LYS A 1 50 ? 19.539 -4.946 89.326 1.00 46.27 ? 79 LYS A HD3 1 ATOM 738 H HE2 . LYS A 1 50 ? 19.982 -2.878 90.266 1.00 47.19 ? 79 LYS A HE2 1 ATOM 739 H HE3 . LYS A 1 50 ? 19.531 -2.151 88.925 1.00 47.19 ? 79 LYS A HE3 1 ATOM 740 H HZ1 . LYS A 1 50 ? 17.856 -2.097 90.461 1.00 48.99 ? 79 LYS A HZ1 1 ATOM 741 H HZ2 . LYS A 1 50 ? 17.413 -2.881 89.326 1.00 48.99 ? 79 LYS A HZ2 1 ATOM 742 H HZ3 . LYS A 1 50 ? 17.824 -3.543 90.547 1.00 48.99 ? 79 LYS A HZ3 1 ATOM 743 N N . CYS A 1 51 ? 21.746 -2.233 84.059 1.00 46.32 ? 80 CYS A N 1 ATOM 744 C CA . CYS A 1 51 ? 21.691 -1.171 83.059 1.00 44.81 ? 80 CYS A CA 1 ATOM 745 C C . CYS A 1 51 ? 20.260 -0.691 82.860 1.00 45.94 ? 80 CYS A C 1 ATOM 746 O O . CYS A 1 51 ? 19.340 -1.498 82.725 1.00 45.83 ? 80 CYS A O 1 ATOM 747 C CB . CYS A 1 51 ? 22.267 -1.656 81.729 1.00 42.57 ? 80 CYS A CB 1 ATOM 748 S SG . CYS A 1 51 ? 22.058 -0.483 80.373 1.00 79.58 ? 80 CYS A SG 1 ATOM 749 H H . CYS A 1 51 ? 21.282 -2.927 83.851 1.00 55.58 ? 80 CYS A H 1 ATOM 750 H HA . CYS A 1 51 ? 22.223 -0.419 83.364 1.00 53.78 ? 80 CYS A HA 1 ATOM 751 H HB2 . CYS A 1 51 ? 23.217 -1.815 81.840 1.00 51.08 ? 80 CYS A HB2 1 ATOM 752 H HB3 . CYS A 1 51 ? 21.823 -2.481 81.479 1.00 51.08 ? 80 CYS A HB3 1 ATOM 753 N N . ASN A 1 52 ? 20.081 0.625 82.833 1.00 42.14 ? 81 ASN A N 1 ATOM 754 C CA . ASN A 1 52 ? 18.768 1.221 82.621 1.00 37.64 ? 81 ASN A CA 1 ATOM 755 C C . ASN A 1 52 ? 18.912 2.595 81.980 1.00 38.27 ? 81 ASN A C 1 ATOM 756 O O . ASN A 1 52 ? 19.577 3.476 82.523 1.00 38.97 ? 81 ASN A O 1 ATOM 757 C CB . ASN A 1 52 ? 18.004 1.324 83.944 1.00 39.04 ? 81 ASN A CB 1 ATOM 758 C CG . ASN A 1 52 ? 16.530 1.632 83.750 1.00 40.19 ? 81 ASN A CG 1 ATOM 759 O OD1 . ASN A 1 52 ? 16.158 2.456 82.916 1.00 40.02 ? 81 ASN A OD1 1 ATOM 760 N ND2 . ASN A 1 52 ? 15.682 0.965 84.523 1.00 41.45 ? 81 ASN A ND2 1 ATOM 761 H H . ASN A 1 52 ? 20.712 1.201 82.937 1.00 50.57 ? 81 ASN A H 1 ATOM 762 H HA . ASN A 1 52 ? 18.256 0.659 82.019 1.00 45.17 ? 81 ASN A HA 1 ATOM 763 H HB2 . ASN A 1 52 ? 18.075 0.480 84.416 1.00 46.85 ? 81 ASN A HB2 1 ATOM 764 H HB3 . ASN A 1 52 ? 18.392 2.036 84.478 1.00 46.85 ? 81 ASN A HB3 1 ATOM 765 H HD21 . ASN A 1 52 ? 14.836 1.103 84.452 1.00 49.74 ? 81 ASN A HD21 1 ATOM 766 H HD22 . ASN A 1 52 ? 15.978 0.395 85.095 1.00 49.74 ? 81 ASN A HD22 1 ATOM 767 N N . ALA A 1 53 ? 18.285 2.769 80.821 1.00 38.28 ? 82 ALA A N 1 ATOM 768 C CA . ALA A 1 53 ? 18.419 3.999 80.048 1.00 37.54 ? 82 ALA A CA 1 ATOM 769 C C . ALA A 1 53 ? 17.689 5.171 80.700 1.00 38.48 ? 82 ALA A C 1 ATOM 770 O O . ALA A 1 53 ? 18.114 6.320 80.580 1.00 38.06 ? 82 ALA A O 1 ATOM 771 C CB . ALA A 1 53 ? 17.902 3.784 78.636 1.00 37.28 ? 82 ALA A CB 1 ATOM 772 H H . ALA A 1 53 ? 17.771 2.183 80.457 1.00 45.93 ? 82 ALA A H 1 ATOM 773 H HA . ALA A 1 53 ? 19.359 4.231 79.989 1.00 45.04 ? 82 ALA A HA 1 ATOM 774 H HB1 . ALA A 1 53 ? 17.998 4.609 78.136 1.00 44.73 ? 82 ALA A HB1 1 ATOM 775 H HB2 . ALA A 1 53 ? 18.420 3.079 78.215 1.00 44.73 ? 82 ALA A HB2 1 ATOM 776 H HB3 . ALA A 1 53 ? 16.967 3.528 78.678 1.00 44.73 ? 82 ALA A HB3 1 ATOM 777 N N . ALA A 1 54 ? 16.590 4.873 81.387 1.00 41.12 ? 83 ALA A N 1 ATOM 778 C CA . ALA A 1 54 ? 15.755 5.907 81.991 1.00 43.10 ? 83 ALA A CA 1 ATOM 779 C C . ALA A 1 54 ? 16.468 6.641 83.125 1.00 44.15 ? 83 ALA A C 1 ATOM 780 O O . ALA A 1 54 ? 16.065 7.742 83.505 1.00 45.64 ? 83 ALA A O 1 ATOM 781 C CB . ALA A 1 54 ? 14.457 5.297 82.502 1.00 44.37 ? 83 ALA A CB 1 ATOM 782 H H . ALA A 1 54 ? 16.304 4.073 81.518 1.00 49.35 ? 83 ALA A H 1 ATOM 783 H HA . ALA A 1 54 ? 15.528 6.561 81.312 1.00 51.72 ? 83 ALA A HA 1 ATOM 784 H HB1 . ALA A 1 54 ? 13.915 5.996 82.899 1.00 53.24 ? 83 ALA A HB1 1 ATOM 785 H HB2 . ALA A 1 54 ? 13.984 4.894 81.757 1.00 53.24 ? 83 ALA A HB2 1 ATOM 786 H HB3 . ALA A 1 54 ? 14.666 4.621 83.166 1.00 53.24 ? 83 ALA A HB3 1 ATOM 787 N N . HIS A 1 55 ? 17.522 6.029 83.660 1.00 37.02 ? 84 HIS A N 1 ATOM 788 C CA . HIS A 1 55 ? 18.257 6.597 84.786 1.00 37.24 ? 84 HIS A CA 1 ATOM 789 C C . HIS A 1 55 ? 19.718 6.849 84.425 1.00 35.83 ? 84 HIS A C 1 ATOM 790 O O . HIS A 1 55 ? 20.387 5.990 83.851 1.00 34.86 ? 84 HIS A O 1 ATOM 791 C CB . HIS A 1 55 ? 18.158 5.670 85.996 1.00 38.15 ? 84 HIS A CB 1 ATOM 792 C CG . HIS A 1 55 ? 16.750 5.381 86.414 1.00 40.89 ? 84 HIS A CG 1 ATOM 793 N ND1 . HIS A 1 55 ? 15.936 4.502 85.732 1.00 40.96 ? 84 HIS A ND1 1 ATOM 794 C CD2 . HIS A 1 55 ? 16.007 5.862 87.439 1.00 41.23 ? 84 HIS A CD2 1 ATOM 795 C CE1 . HIS A 1 55 ? 14.755 4.450 86.321 1.00 42.39 ? 84 HIS A CE1 1 ATOM 796 N NE2 . HIS A 1 55 ? 14.772 5.266 87.360 1.00 42.29 ? 84 HIS A NE2 1 ATOM 797 H H . HIS A 1 55 ? 17.833 5.276 83.386 1.00 44.42 ? 84 HIS A H 1 ATOM 798 H HA . HIS A 1 55 ? 17.857 7.447 85.027 1.00 44.69 ? 84 HIS A HA 1 ATOM 799 H HB2 . HIS A 1 55 ? 18.583 4.825 85.779 1.00 45.78 ? 84 HIS A HB2 1 ATOM 800 H HB3 . HIS A 1 55 ? 18.612 6.084 86.746 1.00 45.78 ? 84 HIS A HB3 1 ATOM 801 H HD2 . HIS A 1 55 ? 16.282 6.478 88.079 1.00 49.48 ? 84 HIS A HD2 1 ATOM 802 H HE1 . HIS A 1 55 ? 14.034 3.928 86.051 1.00 50.86 ? 84 HIS A HE1 1 ATOM 803 N N . SER A 1 56 ? 20.202 8.037 84.775 1.00 41.51 ? 85 SER A N 1 ATOM 804 C CA . SER A 1 56 ? 21.542 8.477 84.401 1.00 39.60 ? 85 SER A CA 1 ATOM 805 C C . SER A 1 56 ? 22.643 7.595 84.983 1.00 38.72 ? 85 SER A C 1 ATOM 806 O O . SER A 1 56 ? 23.616 7.278 84.300 1.00 38.27 ? 85 SER A O 1 ATOM 807 C CB . SER A 1 56 ? 21.757 9.924 84.847 1.00 39.22 ? 85 SER A CB 1 ATOM 808 O OG . SER A 1 56 ? 23.113 10.305 84.700 1.00 37.74 ? 85 SER A OG 1 ATOM 809 H H . SER A 1 56 ? 19.766 8.616 85.238 1.00 49.81 ? 85 SER A H 1 ATOM 810 H HA . SER A 1 56 ? 21.620 8.449 83.434 1.00 47.52 ? 85 SER A HA 1 ATOM 811 H HB2 . SER A 1 56 ? 21.205 10.507 84.302 1.00 47.06 ? 85 SER A HB2 1 ATOM 812 H HB3 . SER A 1 56 ? 21.505 10.007 85.780 1.00 47.06 ? 85 SER A HB3 1 ATOM 813 H HG . SER A 1 56 ? 23.216 11.101 84.949 1.00 45.28 ? 85 SER A HG 1 ATOM 814 N N . HIS A 1 57 ? 22.487 7.201 86.244 1.00 35.90 ? 86 HIS A N 1 ATOM 815 C CA . HIS A 1 57 ? 23.514 6.424 86.935 1.00 35.40 ? 86 HIS A CA 1 ATOM 816 C C . HIS A 1 57 ? 23.480 4.944 86.553 1.00 34.98 ? 86 HIS A C 1 ATOM 817 O O . HIS A 1 57 ? 24.237 4.142 87.100 1.00 40.87 ? 86 HIS A O 1 ATOM 818 C CB . HIS A 1 57 ? 23.361 6.572 88.451 1.00 36.78 ? 86 HIS A CB 1 ATOM 819 C CG . HIS A 1 57 ? 22.151 5.890 89.008 1.00 37.93 ? 86 HIS A CG 1 ATOM 820 N ND1 . HIS A 1 57 ? 20.875 6.384 88.844 1.00 45.40 ? 86 HIS A ND1 1 ATOM 821 C CD2 . HIS A 1 57 ? 22.024 4.754 89.734 1.00 38.50 ? 86 HIS A CD2 1 ATOM 822 C CE1 . HIS A 1 57 ? 20.014 5.579 89.440 1.00 46.34 ? 86 HIS A CE1 1 ATOM 823 N NE2 . HIS A 1 57 ? 20.685 4.582 89.988 1.00 46.07 ? 86 HIS A NE2 1 ATOM 824 H H . HIS A 1 57 ? 21.794 7.370 86.724 1.00 43.08 ? 86 HIS A H 1 ATOM 825 H HA . HIS A 1 57 ? 24.386 6.773 86.690 1.00 42.48 ? 86 HIS A HA 1 ATOM 826 H HB2 . HIS A 1 57 ? 24.141 6.190 88.883 1.00 44.14 ? 86 HIS A HB2 1 ATOM 827 H HB3 . HIS A 1 57 ? 23.295 7.516 88.668 1.00 44.14 ? 86 HIS A HB3 1 ATOM 828 H HD2 . HIS A 1 57 ? 22.714 4.193 90.007 1.00 46.20 ? 86 HIS A HD2 1 ATOM 829 H HE1 . HIS A 1 57 ? 19.091 5.695 89.470 1.00 55.60 ? 86 HIS A HE1 1 ATOM 830 N N . LEU A 1 58 ? 22.601 4.591 85.617 1.00 34.52 ? 87 LEU A N 1 ATOM 831 C CA . LEU A 1 58 ? 22.484 3.217 85.133 1.00 34.19 ? 87 LEU A CA 1 ATOM 832 C C . LEU A 1 58 ? 22.534 3.151 83.608 1.00 33.15 ? 87 LEU A C 1 ATOM 833 O O . LEU A 1 58 ? 22.662 2.072 83.031 1.00 32.73 ? 87 LEU A O 1 ATOM 834 C CB . LEU A 1 58 ? 21.182 2.586 85.628 1.00 35.37 ? 87 LEU A CB 1 ATOM 835 C CG . LEU A 1 58 ? 21.002 2.483 87.142 1.00 36.59 ? 87 LEU A CG 1 ATOM 836 C CD1 . LEU A 1 58 ? 19.610 1.967 87.473 1.00 37.82 ? 87 LEU A CD1 1 ATOM 837 C CD2 . LEU A 1 58 ? 22.064 1.585 87.752 1.00 36.28 ? 87 LEU A CD2 1 ATOM 838 H H . LEU A 1 58 ? 22.053 5.138 85.242 1.00 41.42 ? 87 LEU A H 1 ATOM 839 H HA . LEU A 1 58 ? 23.223 2.694 85.481 1.00 41.03 ? 87 LEU A HA 1 ATOM 840 H HB2 . LEU A 1 58 ? 20.442 3.111 85.286 1.00 42.44 ? 87 LEU A HB2 1 ATOM 841 H HB3 . LEU A 1 58 ? 21.127 1.686 85.271 1.00 42.44 ? 87 LEU A HB3 1 ATOM 842 H HG . LEU A 1 58 ? 21.095 3.366 87.532 1.00 43.90 ? 87 LEU A HG 1 ATOM 843 H HD11 . LEU A 1 58 ? 19.516 1.909 88.437 1.00 45.39 ? 87 LEU A HD11 1 ATOM 844 H HD12 . LEU A 1 58 ? 18.952 2.581 87.113 1.00 45.39 ? 87 LEU A HD12 1 ATOM 845 H HD13 . LEU A 1 58 ? 19.496 1.089 87.076 1.00 45.39 ? 87 LEU A HD13 1 ATOM 846 H HD21 . LEU A 1 58 ? 21.925 1.539 88.711 1.00 43.54 ? 87 LEU A HD21 1 ATOM 847 H HD22 . LEU A 1 58 ? 21.990 0.699 87.363 1.00 43.54 ? 87 LEU A HD22 1 ATOM 848 H HD23 . LEU A 1 58 ? 22.939 1.958 87.562 1.00 43.54 ? 87 LEU A HD23 1 ATOM 849 N N . ALA A 1 59 ? 22.428 4.307 82.959 1.00 32.82 ? 88 ALA A N 1 ATOM 850 C CA . ALA A 1 59 ? 22.379 4.362 81.502 1.00 31.97 ? 88 ALA A CA 1 ATOM 851 C C . ALA A 1 59 ? 23.766 4.241 80.880 1.00 30.79 ? 88 ALA A C 1 ATOM 852 O O . ALA A 1 59 ? 24.779 4.486 81.535 1.00 30.60 ? 88 ALA A O 1 ATOM 853 C CB . ALA A 1 59 ? 21.712 5.650 81.049 1.00 32.14 ? 88 ALA A CB 1 ATOM 854 H H . ALA A 1 59 ? 22.382 5.076 83.340 1.00 39.38 ? 88 ALA A H 1 ATOM 855 H HA . ALA A 1 59 ? 21.843 3.620 81.179 1.00 38.37 ? 88 ALA A HA 1 ATOM 856 H HB1 . ALA A 1 59 ? 21.689 5.668 80.079 1.00 38.57 ? 88 ALA A HB1 1 ATOM 857 H HB2 . ALA A 1 59 ? 20.810 5.679 81.403 1.00 38.57 ? 88 ALA A HB2 1 ATOM 858 H HB3 . ALA A 1 59 ? 22.224 6.404 81.382 1.00 38.57 ? 88 ALA A HB3 1 ATOM 859 N N . HIS A 1 60 ? 23.791 3.860 79.606 1.00 32.89 ? 89 HIS A N 1 ATOM 860 C CA . HIS A 1 60 ? 25.024 3.789 78.831 1.00 31.86 ? 89 HIS A CA 1 ATOM 861 C C . HIS A 1 60 ? 24.747 4.217 77.396 1.00 31.34 ? 89 HIS A C 1 ATOM 862 O O . HIS A 1 60 ? 24.901 3.424 76.467 1.00 30.98 ? 89 HIS A O 1 ATOM 863 C CB . HIS A 1 60 ? 25.607 2.375 78.860 1.00 31.72 ? 89 HIS A CB 1 ATOM 864 C CG . HIS A 1 60 ? 26.047 1.932 80.220 1.00 32.18 ? 89 HIS A CG 1 ATOM 865 N ND1 . HIS A 1 60 ? 25.171 1.432 81.159 1.00 33.10 ? 89 HIS A ND1 1 ATOM 866 C CD2 . HIS A 1 60 ? 27.269 1.919 80.801 1.00 31.94 ? 89 HIS A CD2 1 ATOM 867 C CE1 . HIS A 1 60 ? 25.836 1.127 82.259 1.00 33.38 ? 89 HIS A CE1 1 ATOM 868 N NE2 . HIS A 1 60 ? 27.111 1.413 82.068 1.00 32.70 ? 89 HIS A NE2 1 ATOM 869 H H . HIS A 1 60 ? 23.092 3.634 79.159 1.00 39.47 ? 89 HIS A H 1 ATOM 870 H HA . HIS A 1 60 ? 25.678 4.396 79.211 1.00 38.24 ? 89 HIS A HA 1 ATOM 871 H HB2 . HIS A 1 60 ? 24.931 1.752 78.550 1.00 38.06 ? 89 HIS A HB2 1 ATOM 872 H HB3 . HIS A 1 60 ? 26.378 2.343 78.274 1.00 38.06 ? 89 HIS A HB3 1 ATOM 873 H HD2 . HIS A 1 60 ? 28.068 2.199 80.414 1.00 38.33 ? 89 HIS A HD2 1 ATOM 874 H HE1 . HIS A 1 60 ? 25.469 0.772 83.036 1.00 40.05 ? 89 HIS A HE1 1 ATOM 875 N N . PRO A 1 61 ? 24.329 5.479 77.214 1.00 38.03 ? 90 PRO A N 1 ATOM 876 C CA . PRO A 1 61 ? 23.983 6.019 75.897 1.00 37.63 ? 90 PRO A CA 1 ATOM 877 C C . PRO A 1 61 ? 25.220 6.266 75.044 1.00 36.63 ? 90 PRO A C 1 ATOM 878 O O . PRO A 1 61 ? 26.320 6.314 75.593 1.00 36.31 ? 90 PRO A O 1 ATOM 879 C CB . PRO A 1 61 ? 23.280 7.330 76.238 1.00 38.08 ? 90 PRO A CB 1 ATOM 880 C CG . PRO A 1 61 ? 23.934 7.768 77.500 1.00 38.25 ? 90 PRO A CG 1 ATOM 881 C CD . PRO A 1 61 ? 24.251 6.511 78.264 1.00 38.49 ? 90 PRO A CD 1 ATOM 882 H HA . PRO A 1 61 ? 23.372 5.428 75.430 1.00 45.15 ? 90 PRO A HA 1 ATOM 883 H HB2 . PRO A 1 61 ? 23.424 7.976 75.530 1.00 45.69 ? 90 PRO A HB2 1 ATOM 884 H HB3 . PRO A 1 61 ? 22.333 7.171 76.375 1.00 45.69 ? 90 PRO A HB3 1 ATOM 885 H HG2 . PRO A 1 61 ? 24.747 8.254 77.292 1.00 45.90 ? 90 PRO A HG2 1 ATOM 886 H HG3 . PRO A 1 61 ? 23.323 8.327 78.004 1.00 45.90 ? 90 PRO A HG3 1 ATOM 887 H HD2 . PRO A 1 61 ? 25.105 6.597 78.716 1.00 46.19 ? 90 PRO A HD2 1 ATOM 888 H HD3 . PRO A 1 61 ? 23.537 6.305 78.887 1.00 46.19 ? 90 PRO A HD3 1 ATOM 889 N N . PRO A 1 62 ? 25.044 6.435 73.723 1.00 27.48 ? 91 PRO A N 1 ATOM 890 C CA . PRO A 1 62 ? 26.181 6.656 72.822 1.00 26.64 ? 91 PRO A CA 1 ATOM 891 C C . PRO A 1 62 ? 27.022 7.865 73.216 1.00 26.24 ? 91 PRO A C 1 ATOM 892 O O . PRO A 1 62 ? 28.220 7.898 72.938 1.00 25.68 ? 91 PRO A O 1 ATOM 893 C CB . PRO A 1 62 ? 25.515 6.874 71.457 1.00 26.55 ? 91 PRO A CB 1 ATOM 894 C CG . PRO A 1 62 ? 24.102 7.235 71.762 1.00 27.31 ? 91 PRO A CG 1 ATOM 895 C CD . PRO A 1 62 ? 23.760 6.486 73.006 1.00 27.94 ? 91 PRO A CD 1 ATOM 896 H HA . PRO A 1 62 ? 26.744 5.867 72.785 1.00 31.96 ? 91 PRO A HA 1 ATOM 897 H HB2 . PRO A 1 62 ? 25.960 7.598 70.989 1.00 31.86 ? 91 PRO A HB2 1 ATOM 898 H HB3 . PRO A 1 62 ? 25.556 6.055 70.939 1.00 31.86 ? 91 PRO A HB3 1 ATOM 899 H HG2 . PRO A 1 62 ? 24.034 8.191 71.909 1.00 32.77 ? 91 PRO A HG2 1 ATOM 900 H HG3 . PRO A 1 62 ? 23.530 6.959 71.029 1.00 32.77 ? 91 PRO A HG3 1 ATOM 901 H HD2 . PRO A 1 62 ? 23.101 6.973 73.525 1.00 33.53 ? 91 PRO A HD2 1 ATOM 902 H HD3 . PRO A 1 62 ? 23.456 5.591 72.791 1.00 33.53 ? 91 PRO A HD3 1 ATOM 903 N N . SER A 1 63 ? 26.397 8.837 73.872 1.00 25.99 ? 92 SER A N 1 ATOM 904 C CA . SER A 1 63 ? 27.083 10.057 74.285 1.00 25.76 ? 92 SER A CA 1 ATOM 905 C C . SER A 1 63 ? 28.180 9.779 75.310 1.00 25.76 ? 92 SER A C 1 ATOM 906 O O . SER A 1 63 ? 29.016 10.641 75.581 1.00 25.55 ? 92 SER A O 1 ATOM 907 C CB . SER A 1 63 ? 26.080 11.061 74.857 1.00 40.04 ? 92 SER A CB 1 ATOM 908 O OG . SER A 1 63 ? 25.337 10.492 75.920 1.00 27.26 ? 92 SER A OG 1 ATOM 909 H H . SER A 1 63 ? 25.566 8.814 74.093 1.00 31.19 ? 92 SER A H 1 ATOM 910 H HA . SER A 1 63 ? 27.499 10.461 73.507 1.00 30.91 ? 92 SER A HA 1 ATOM 911 H HB2 . SER A 1 63 ? 26.563 11.834 75.189 1.00 48.04 ? 92 SER A HB2 1 ATOM 912 H HB3 . SER A 1 63 ? 25.468 11.330 74.154 1.00 48.04 ? 92 SER A HB3 1 ATOM 913 H HG . SER A 1 63 ? 24.913 9.821 75.647 1.00 32.72 ? 92 SER A HG 1 ATOM 914 N N . ALA A 1 64 ? 28.174 8.577 75.880 1.00 26.55 ? 93 ALA A N 1 ATOM 915 C CA . ALA A 1 64 ? 29.184 8.189 76.860 1.00 26.66 ? 93 ALA A CA 1 ATOM 916 C C . ALA A 1 64 ? 30.531 7.909 76.197 1.00 45.48 ? 93 ALA A C 1 ATOM 917 O O . ALA A 1 64 ? 31.526 7.663 76.879 1.00 26.07 ? 93 ALA A O 1 ATOM 918 C CB . ALA A 1 64 ? 28.720 6.972 77.638 1.00 27.24 ? 93 ALA A CB 1 ATOM 919 H H . ALA A 1 64 ? 27.593 7.966 75.716 1.00 31.86 ? 93 ALA A H 1 ATOM 920 H HA . ALA A 1 64 ? 29.307 8.916 77.490 1.00 31.99 ? 93 ALA A HA 1 ATOM 921 H HB1 . ALA A 1 64 ? 29.404 6.730 78.282 1.00 32.69 ? 93 ALA A HB1 1 ATOM 922 H HB2 . ALA A 1 64 ? 27.893 7.187 78.097 1.00 32.69 ? 93 ALA A HB2 1 ATOM 923 H HB3 . ALA A 1 64 ? 28.574 6.239 77.019 1.00 32.69 ? 93 ALA A HB3 1 ATOM 924 N N . MET A 1 65 ? 30.550 7.927 74.868 1.00 41.27 ? 94 MET A N 1 ATOM 925 C CA . MET A 1 65 ? 31.784 7.748 74.111 1.00 41.11 ? 94 MET A CA 1 ATOM 926 C C . MET A 1 65 ? 32.426 9.095 73.790 1.00 42.83 ? 94 MET A C 1 ATOM 927 O O . MET A 1 65 ? 33.639 9.186 73.601 1.00 38.68 ? 94 MET A O 1 ATOM 928 C CB . MET A 1 65 ? 31.509 6.982 72.818 1.00 38.72 ? 94 MET A CB 1 ATOM 929 C CG . MET A 1 65 ? 30.826 5.644 73.024 1.00 38.55 ? 94 MET A CG 1 ATOM 930 S SD . MET A 1 65 ? 30.550 4.754 71.479 1.00 25.91 ? 94 MET A SD 1 ATOM 931 C CE . MET A 1 65 ? 29.161 5.654 70.794 1.00 25.00 ? 94 MET A CE 1 ATOM 932 H H . MET A 1 65 ? 29.854 8.043 74.376 1.00 49.52 ? 94 MET A H 1 ATOM 933 H HA . MET A 1 65 ? 32.404 7.224 74.642 1.00 49.33 ? 94 MET A HA 1 ATOM 934 H HB2 . MET A 1 65 ? 30.936 7.522 72.251 1.00 46.46 ? 94 MET A HB2 1 ATOM 935 H HB3 . MET A 1 65 ? 32.353 6.817 72.368 1.00 46.46 ? 94 MET A HB3 1 ATOM 936 H HG2 . MET A 1 65 ? 31.382 5.090 73.594 1.00 46.27 ? 94 MET A HG2 1 ATOM 937 H HG3 . MET A 1 65 ? 29.964 5.791 73.444 1.00 46.27 ? 94 MET A HG3 1 ATOM 938 H HE1 . MET A 1 65 ? 28.918 5.258 69.942 1.00 30.00 ? 94 MET A HE1 1 ATOM 939 H HE2 . MET A 1 65 ? 28.415 5.599 71.410 1.00 30.00 ? 94 MET A HE2 1 ATOM 940 H HE3 . MET A 1 65 ? 29.418 6.581 70.666 1.00 30.00 ? 94 MET A HE3 1 ATOM 941 N N . ALA A 1 66 ? 31.600 10.136 73.729 1.00 54.03 ? 95 ALA A N 1 ATOM 942 C CA . ALA A 1 66 ? 32.056 11.469 73.347 1.00 58.99 ? 95 ALA A CA 1 ATOM 943 C C . ALA A 1 66 ? 32.460 12.319 74.548 1.00 59.85 ? 95 ALA A C 1 ATOM 944 O O . ALA A 1 66 ? 32.919 13.445 74.381 1.00 59.10 ? 95 ALA A O 1 ATOM 945 C CB . ALA A 1 66 ? 30.974 12.180 72.552 1.00 54.69 ? 95 ALA A CB 1 ATOM 946 H H . ALA A 1 66 ? 30.760 10.095 73.907 1.00 64.84 ? 95 ALA A H 1 ATOM 947 H HA . ALA A 1 66 ? 32.834 11.379 72.774 1.00 70.79 ? 95 ALA A HA 1 ATOM 948 H HB1 . ALA A 1 66 ? 31.291 13.063 72.306 1.00 65.63 ? 95 ALA A HB1 1 ATOM 949 H HB2 . ALA A 1 66 ? 30.778 11.664 71.754 1.00 65.63 ? 95 ALA A HB2 1 ATOM 950 H HB3 . ALA A 1 66 ? 30.178 12.256 73.101 1.00 65.63 ? 95 ALA A HB3 1 ATOM 951 N N . ASP A 1 67 ? 32.277 11.794 75.756 1.00 51.74 ? 96 ASP A N 1 ATOM 952 C CA . ASP A 1 67 ? 32.640 12.536 76.960 1.00 54.29 ? 96 ASP A CA 1 ATOM 953 C C . ASP A 1 67 ? 34.150 12.495 77.177 1.00 56.25 ? 96 ASP A C 1 ATOM 954 O O . ASP A 1 67 ? 34.872 11.831 76.433 1.00 55.80 ? 96 ASP A O 1 ATOM 955 C CB . ASP A 1 67 ? 31.908 11.976 78.182 1.00 55.86 ? 96 ASP A CB 1 ATOM 956 C CG . ASP A 1 67 ? 32.306 10.551 78.501 1.00 56.44 ? 96 ASP A CG 1 ATOM 957 O OD1 . ASP A 1 67 ? 32.907 9.887 77.631 1.00 56.94 ? 96 ASP A OD1 1 ATOM 958 O OD2 . ASP A 1 67 ? 32.010 10.094 79.624 1.00 56.38 ? 96 ASP A OD2 1 ATOM 959 H H . ASP A 1 67 ? 31.947 11.015 75.905 1.00 62.09 ? 96 ASP A H 1 ATOM 960 H HA . ASP A 1 67 ? 32.378 13.463 76.851 1.00 65.15 ? 96 ASP A HA 1 ATOM 961 H HB2 . ASP A 1 67 ? 32.116 12.526 78.954 1.00 67.04 ? 96 ASP A HB2 1 ATOM 962 H HB3 . ASP A 1 67 ? 30.953 11.991 78.012 1.00 67.04 ? 96 ASP A HB3 1 ATOM 963 N N . SER A 1 68 ? 34.618 13.207 78.198 1.00 58.37 ? 97 SER A N 1 ATOM 964 C CA . SER A 1 68 ? 36.044 13.285 78.492 1.00 59.70 ? 97 SER A CA 1 ATOM 965 C C . SER A 1 68 ? 36.639 11.901 78.734 1.00 60.62 ? 97 SER A C 1 ATOM 966 O O . SER A 1 68 ? 36.093 11.104 79.497 1.00 59.37 ? 97 SER A O 1 ATOM 967 C CB . SER A 1 68 ? 36.287 14.177 79.712 1.00 60.40 ? 97 SER A CB 1 ATOM 968 O OG . SER A 1 68 ? 35.658 13.645 80.866 1.00 60.83 ? 97 SER A OG 1 ATOM 969 H H . SER A 1 68 ? 34.125 13.659 78.739 1.00 70.04 ? 97 SER A H 1 ATOM 970 H HA . SER A 1 68 ? 36.503 13.681 77.735 1.00 71.64 ? 97 SER A HA 1 ATOM 971 H HB2 . SER A 1 68 ? 37.241 14.237 79.873 1.00 72.48 ? 97 SER A HB2 1 ATOM 972 H HB3 . SER A 1 68 ? 35.925 15.059 79.534 1.00 72.48 ? 97 SER A HB3 1 ATOM 973 H HG . SER A 1 68 ? 35.799 14.145 81.526 1.00 73.00 ? 97 SER A HG 1 ATOM 974 N N . SER A 1 69 ? 37.767 11.629 78.086 1.00 64.85 ? 98 SER A N 1 ATOM 975 C CA . SER A 1 69 ? 38.437 10.338 78.208 1.00 65.38 ? 98 SER A CA 1 ATOM 976 C C . SER A 1 69 ? 39.311 10.269 79.457 1.00 64.55 ? 98 SER A C 1 ATOM 977 O O . SER A 1 69 ? 40.246 9.469 79.526 1.00 65.40 ? 98 SER A O 1 ATOM 978 C CB . SER A 1 69 ? 39.283 10.065 76.964 1.00 65.39 ? 98 SER A CB 1 ATOM 979 O OG . SER A 1 69 ? 40.285 11.054 76.805 1.00 65.40 ? 98 SER A OG 1 ATOM 980 H H . SER A 1 69 ? 38.168 12.181 77.563 1.00 77.82 ? 98 SER A H 1 ATOM 981 H HA . SER A 1 69 ? 37.766 9.641 78.273 1.00 78.46 ? 98 SER A HA 1 ATOM 982 H HB2 . SER A 1 69 ? 39.708 9.198 77.056 1.00 78.47 ? 98 SER A HB2 1 ATOM 983 H HB3 . SER A 1 69 ? 38.708 10.071 76.183 1.00 78.47 ? 98 SER A HB3 1 ATOM 984 H HG . SER A 1 69 ? 40.742 10.892 76.119 1.00 78.48 ? 98 SER A HG 1 ATOM 985 N N . PHE A 1 70 ? 39.006 11.106 80.443 1.00 86.71 ? 99 PHE A N 1 ATOM 986 C CA . PHE A 1 70 ? 39.765 11.137 81.686 1.00 88.78 ? 99 PHE A CA 1 ATOM 987 C C . PHE A 1 70 ? 38.927 11.742 82.807 1.00 90.74 ? 99 PHE A C 1 ATOM 988 O O . PHE A 1 70 ? 39.165 12.872 83.233 1.00 91.60 ? 99 PHE A O 1 ATOM 989 C CB . PHE A 1 70 ? 41.060 11.931 81.507 1.00 88.68 ? 99 PHE A CB 1 ATOM 990 H H . PHE A 1 70 ? 38.358 11.671 80.416 1.00 104.05 ? 99 PHE A H 1 ATOM 991 H HA . PHE A 1 70 ? 39.998 10.230 81.939 1.00 106.53 ? 99 PHE A HA 1 ATOM 992 N N . ARG A 1 71 ? 37.941 10.978 83.271 1.00 64.47 ? 100 ARG A N 1 ATOM 993 C CA . ARG A 1 71 ? 37.083 11.397 84.372 1.00 65.47 ? 100 ARG A CA 1 ATOM 994 C C . ARG A 1 71 ? 37.136 10.358 85.488 1.00 64.67 ? 100 ARG A C 1 ATOM 995 O O . ARG A 1 71 ? 37.752 9.304 85.326 1.00 63.89 ? 100 ARG A O 1 ATOM 996 C CB . ARG A 1 71 ? 35.649 11.609 83.888 1.00 66.16 ? 100 ARG A CB 1 ATOM 997 C CG . ARG A 1 71 ? 35.109 10.493 83.010 1.00 66.85 ? 100 ARG A CG 1 ATOM 998 C CD . ARG A 1 71 ? 33.618 10.664 82.787 1.00 68.21 ? 100 ARG A CD 1 ATOM 999 N NE . ARG A 1 71 ? 32.875 10.528 84.036 1.00 70.10 ? 100 ARG A NE 1 ATOM 1000 C CZ . ARG A 1 71 ? 31.653 11.010 84.244 1.00 70.90 ? 100 ARG A CZ 1 ATOM 1001 N NH1 . ARG A 1 71 ? 31.018 11.674 83.287 1.00 70.54 ? 100 ARG A NH1 1 ATOM 1002 N NH2 . ARG A 1 71 ? 31.067 10.831 85.420 1.00 71.88 ? 100 ARG A NH2 1 ATOM 1003 H H . ARG A 1 71 ? 37.747 10.201 82.958 1.00 77.37 ? 100 ARG A H 1 ATOM 1004 H HA . ARG A 1 71 ? 37.409 12.239 84.728 1.00 78.56 ? 100 ARG A HA 1 ATOM 1005 H HB2 . ARG A 1 71 ? 35.068 11.682 84.662 1.00 79.40 ? 100 ARG A HB2 1 ATOM 1006 H HB3 . ARG A 1 71 ? 35.613 12.431 83.375 1.00 79.40 ? 100 ARG A HB3 1 ATOM 1007 H HG2 . ARG A 1 71 ? 35.553 10.516 82.148 1.00 80.22 ? 100 ARG A HG2 1 ATOM 1008 H HG3 . ARG A 1 71 ? 35.257 9.639 83.445 1.00 80.22 ? 100 ARG A HG3 1 ATOM 1009 H HD2 . ARG A 1 71 ? 33.447 11.548 82.425 1.00 81.85 ? 100 ARG A HD2 1 ATOM 1010 H HD3 . ARG A 1 71 ? 33.306 9.983 82.171 1.00 81.85 ? 100 ARG A HD3 1 ATOM 1011 H HE . ARG A 1 71 ? 33.254 10.107 84.683 1.00 84.12 ? 100 ARG A HE 1 ATOM 1012 H HH11 . ARG A 1 71 ? 31.394 11.793 82.523 1.00 84.64 ? 100 ARG A HH11 1 ATOM 1013 H HH12 . ARG A 1 71 ? 30.228 11.984 83.430 1.00 84.64 ? 100 ARG A HH12 1 ATOM 1014 H HH21 . ARG A 1 71 ? 31.476 10.402 86.043 1.00 86.26 ? 100 ARG A HH21 1 ATOM 1015 H HH22 . ARG A 1 71 ? 30.278 11.142 85.558 1.00 86.26 ? 100 ARG A HH22 1 ATOM 1016 N N . PHE A 1 72 ? 36.491 10.662 86.613 1.00 95.36 ? 101 PHE A N 1 ATOM 1017 C CA . PHE A 1 72 ? 36.637 9.865 87.830 1.00 95.08 ? 101 PHE A CA 1 ATOM 1018 C C . PHE A 1 72 ? 36.347 8.377 87.577 1.00 94.29 ? 101 PHE A C 1 ATOM 1019 O O . PHE A 1 72 ? 37.276 7.568 87.612 1.00 94.31 ? 101 PHE A O 1 ATOM 1020 C CB . PHE A 1 72 ? 35.739 10.423 88.938 1.00 95.66 ? 101 PHE A CB 1 ATOM 1021 H H . PHE A 1 72 ? 35.959 11.332 86.698 1.00 114.43 ? 101 PHE A H 1 ATOM 1022 H HA . PHE A 1 72 ? 37.555 9.935 88.135 1.00 114.09 ? 101 PHE A HA 1 ATOM 1023 N N . PRO A 1 73 ? 35.074 8.003 87.326 1.00 84.55 ? 102 PRO A N 1 ATOM 1024 C CA . PRO A 1 73 ? 34.880 6.655 86.786 1.00 82.79 ? 102 PRO A CA 1 ATOM 1025 C C . PRO A 1 73 ? 34.810 6.677 85.263 1.00 79.94 ? 102 PRO A C 1 ATOM 1026 O O . PRO A 1 73 ? 34.225 7.600 84.698 1.00 81.32 ? 102 PRO A O 1 ATOM 1027 C CB . PRO A 1 73 ? 33.546 6.235 87.389 1.00 83.25 ? 102 PRO A CB 1 ATOM 1028 C CG . PRO A 1 73 ? 32.774 7.504 87.432 1.00 83.76 ? 102 PRO A CG 1 ATOM 1029 C CD . PRO A 1 73 ? 33.779 8.610 87.698 1.00 84.34 ? 102 PRO A CD 1 ATOM 1030 H HA . PRO A 1 73 ? 35.583 6.055 87.081 1.00 99.35 ? 102 PRO A HA 1 ATOM 1031 H HB2 . PRO A 1 73 ? 33.113 5.583 86.815 1.00 99.91 ? 102 PRO A HB2 1 ATOM 1032 H HB3 . PRO A 1 73 ? 33.682 5.879 88.281 1.00 99.91 ? 102 PRO A HB3 1 ATOM 1033 H HG2 . PRO A 1 73 ? 32.334 7.643 86.579 1.00 100.51 ? 102 PRO A HG2 1 ATOM 1034 H HG3 . PRO A 1 73 ? 32.121 7.460 88.148 1.00 100.51 ? 102 PRO A HG3 1 ATOM 1035 H HD2 . PRO A 1 73 ? 33.593 9.378 87.136 1.00 101.21 ? 102 PRO A HD2 1 ATOM 1036 H HD3 . PRO A 1 73 ? 33.777 8.849 88.638 1.00 101.21 ? 102 PRO A HD3 1 ATOM 1037 N N . ARG A 1 74 ? 35.400 5.682 84.611 1.00 52.24 ? 103 ARG A N 1 ATOM 1038 C CA . ARG A 1 74 ? 35.312 5.577 83.160 1.00 53.30 ? 103 ARG A CA 1 ATOM 1039 C C . ARG A 1 74 ? 33.874 5.302 82.732 1.00 56.37 ? 103 ARG A C 1 ATOM 1040 O O . ARG A 1 74 ? 33.186 4.481 83.337 1.00 59.16 ? 103 ARG A O 1 ATOM 1041 C CB . ARG A 1 74 ? 36.230 4.472 82.642 1.00 53.10 ? 103 ARG A CB 1 ATOM 1042 C CG . ARG A 1 74 ? 37.585 4.957 82.161 1.00 52.60 ? 103 ARG A CG 1 ATOM 1043 C CD . ARG A 1 74 ? 38.456 3.789 81.733 1.00 52.58 ? 103 ARG A CD 1 ATOM 1044 N NE . ARG A 1 74 ? 38.991 3.959 80.386 1.00 51.15 ? 103 ARG A NE 1 ATOM 1045 C CZ . ARG A 1 74 ? 39.744 3.058 79.761 1.00 49.70 ? 103 ARG A CZ 1 ATOM 1046 N NH1 . ARG A 1 74 ? 40.056 1.915 80.360 1.00 49.74 ? 103 ARG A NH1 1 ATOM 1047 N NH2 . ARG A 1 74 ? 40.187 3.298 78.535 1.00 48.51 ? 103 ARG A NH2 1 ATOM 1048 H H . ARG A 1 74 ? 35.857 5.057 84.984 1.00 62.69 ? 103 ARG A H 1 ATOM 1049 H HA . ARG A 1 74 ? 35.592 6.415 82.762 1.00 63.96 ? 103 ARG A HA 1 ATOM 1050 H HB2 . ARG A 1 74 ? 36.382 3.834 83.356 1.00 63.72 ? 103 ARG A HB2 1 ATOM 1051 H HB3 . ARG A 1 74 ? 35.794 4.030 81.896 1.00 63.72 ? 103 ARG A HB3 1 ATOM 1052 H HG2 . ARG A 1 74 ? 37.465 5.545 81.399 1.00 63.12 ? 103 ARG A HG2 1 ATOM 1053 H HG3 . ARG A 1 74 ? 38.034 5.425 82.882 1.00 63.12 ? 103 ARG A HG3 1 ATOM 1054 H HD2 . ARG A 1 74 ? 39.203 3.708 82.346 1.00 63.10 ? 103 ARG A HD2 1 ATOM 1055 H HD3 . ARG A 1 74 ? 37.926 2.976 81.746 1.00 63.10 ? 103 ARG A HD3 1 ATOM 1056 H HE . ARG A 1 74 ? 38.803 4.686 79.966 1.00 61.39 ? 103 ARG A HE 1 ATOM 1057 H HH11 . ARG A 1 74 ? 39.771 1.755 81.156 1.00 59.69 ? 103 ARG A HH11 1 ATOM 1058 H HH12 . ARG A 1 74 ? 40.543 1.335 79.953 1.00 59.69 ? 103 ARG A HH12 1 ATOM 1059 H HH21 . ARG A 1 74 ? 39.987 4.037 78.143 1.00 58.22 ? 103 ARG A HH21 1 ATOM 1060 H HH22 . ARG A 1 74 ? 40.674 2.715 78.132 1.00 58.22 ? 103 ARG A HH22 1 ATOM 1061 N N . THR A 1 75 ? 33.431 5.994 81.686 1.00 29.03 ? 104 THR A N 1 ATOM 1062 C CA . THR A 1 75 ? 32.088 5.808 81.143 1.00 28.93 ? 104 THR A CA 1 ATOM 1063 C C . THR A 1 75 ? 32.156 5.132 79.779 1.00 28.21 ? 104 THR A C 1 ATOM 1064 O O . THR A 1 75 ? 33.164 5.230 79.078 1.00 30.53 ? 104 THR A O 1 ATOM 1065 C CB . THR A 1 75 ? 31.346 7.143 81.004 1.00 28.98 ? 104 THR A CB 1 ATOM 1066 O OG1 . THR A 1 75 ? 32.027 7.972 80.054 1.00 28.27 ? 104 THR A OG1 1 ATOM 1067 C CG2 . THR A 1 75 ? 31.272 7.854 82.346 1.00 29.84 ? 104 THR A CG2 1 ATOM 1068 H H . THR A 1 75 ? 33.895 6.585 81.267 1.00 34.83 ? 104 THR A H 1 ATOM 1069 H HA . THR A 1 75 ? 31.579 5.238 81.740 1.00 34.71 ? 104 THR A HA 1 ATOM 1070 H HB . THR A 1 75 ? 30.441 6.977 80.695 1.00 34.77 ? 104 THR A HB 1 ATOM 1071 H HG21 . THR A 1 75 ? 30.801 8.696 82.250 1.00 35.80 ? 104 THR A HG21 1 ATOM 1072 H HG22 . THR A 1 75 ? 30.799 7.300 82.988 1.00 35.80 ? 104 THR A HG22 1 ATOM 1073 H HG23 . THR A 1 75 ? 32.166 8.028 82.679 1.00 35.80 ? 104 THR A HG23 1 ATOM 1074 N N . TRP A 1 76 ? 31.077 4.454 79.402 1.00 60.03 ? 105 TRP A N 1 ATOM 1075 C CA . TRP A 1 76 ? 31.040 3.743 78.132 1.00 26.60 ? 105 TRP A CA 1 ATOM 1076 C C . TRP A 1 76 ? 29.614 3.554 77.631 1.00 26.78 ? 105 TRP A C 1 ATOM 1077 O O . TRP A 1 76 ? 28.688 3.356 78.417 1.00 27.42 ? 105 TRP A O 1 ATOM 1078 C CB . TRP A 1 76 ? 31.724 2.377 78.267 1.00 45.07 ? 105 TRP A CB 1 ATOM 1079 C CG . TRP A 1 76 ? 30.902 1.347 78.993 1.00 46.16 ? 105 TRP A CG 1 ATOM 1080 C CD1 . TRP A 1 76 ? 29.998 0.485 78.443 1.00 46.80 ? 105 TRP A CD1 1 ATOM 1081 C CD2 . TRP A 1 76 ? 30.914 1.068 80.399 1.00 27.94 ? 105 TRP A CD2 1 ATOM 1082 N NE1 . TRP A 1 76 ? 29.444 -0.309 79.417 1.00 28.06 ? 105 TRP A NE1 1 ATOM 1083 C CE2 . TRP A 1 76 ? 29.991 0.029 80.627 1.00 28.39 ? 105 TRP A CE2 1 ATOM 1084 C CE3 . TRP A 1 76 ? 31.614 1.597 81.486 1.00 38.36 ? 105 TRP A CE3 1 ATOM 1085 C CZ2 . TRP A 1 76 ? 29.749 -0.490 81.896 1.00 29.12 ? 105 TRP A CZ2 1 ATOM 1086 C CZ3 . TRP A 1 76 ? 31.372 1.080 82.746 1.00 29.03 ? 105 TRP A CZ3 1 ATOM 1087 C CH2 . TRP A 1 76 ? 30.449 0.048 82.940 1.00 29.43 ? 105 TRP A CH2 1 ATOM 1088 H H . TRP A 1 76 ? 30.354 4.391 79.863 1.00 72.03 ? 105 TRP A H 1 ATOM 1089 H HA . TRP A 1 76 ? 31.525 4.257 77.468 1.00 31.92 ? 105 TRP A HA 1 ATOM 1090 H HB2 . TRP A 1 76 ? 31.912 2.033 77.380 1.00 54.09 ? 105 TRP A HB2 1 ATOM 1091 H HB3 . TRP A 1 76 ? 32.554 2.491 78.757 1.00 54.09 ? 105 TRP A HB3 1 ATOM 1092 H HD1 . TRP A 1 76 ? 29.786 0.443 77.538 1.00 56.16 ? 105 TRP A HD1 1 ATOM 1093 H HE1 . TRP A 1 76 ? 28.852 -0.919 79.288 1.00 33.67 ? 105 TRP A HE1 1 ATOM 1094 H HE3 . TRP A 1 76 ? 32.229 2.284 81.365 1.00 46.03 ? 105 TRP A HE3 1 ATOM 1095 H HZ2 . TRP A 1 76 ? 29.136 -1.177 82.029 1.00 34.94 ? 105 TRP A HZ2 1 ATOM 1096 H HZ3 . TRP A 1 76 ? 31.832 1.424 83.477 1.00 34.84 ? 105 TRP A HZ3 1 ATOM 1097 H HH2 . TRP A 1 76 ? 30.308 -0.280 83.799 1.00 35.31 ? 105 TRP A HH2 1 ATOM 1098 N N . TRP A 1 77 ? 29.446 3.631 76.315 1.00 26.80 ? 106 TRP A N 1 ATOM 1099 C CA . TRP A 1 77 ? 28.196 3.247 75.677 1.00 27.04 ? 106 TRP A CA 1 ATOM 1100 C C . TRP A 1 77 ? 28.132 1.730 75.587 1.00 27.28 ? 106 TRP A C 1 ATOM 1101 O O . TRP A 1 77 ? 29.161 1.078 75.425 1.00 27.01 ? 106 TRP A O 1 ATOM 1102 C CB . TRP A 1 77 ? 28.085 3.871 74.287 1.00 26.55 ? 106 TRP A CB 1 ATOM 1103 C CG . TRP A 1 77 ? 27.129 3.163 73.383 1.00 28.50 ? 106 TRP A CG 1 ATOM 1104 C CD1 . TRP A 1 77 ? 25.777 3.343 73.306 1.00 30.02 ? 106 TRP A CD1 1 ATOM 1105 C CD2 . TRP A 1 77 ? 27.455 2.157 72.418 1.00 29.74 ? 106 TRP A CD2 1 ATOM 1106 N NE1 . TRP A 1 77 ? 25.243 2.509 72.353 1.00 31.32 ? 106 TRP A NE1 1 ATOM 1107 C CE2 . TRP A 1 77 ? 26.253 1.771 71.794 1.00 31.49 ? 106 TRP A CE2 1 ATOM 1108 C CE3 . TRP A 1 77 ? 28.647 1.545 72.023 1.00 30.60 ? 106 TRP A CE3 1 ATOM 1109 C CZ2 . TRP A 1 77 ? 26.211 0.801 70.796 1.00 32.69 ? 106 TRP A CZ2 1 ATOM 1110 C CZ3 . TRP A 1 77 ? 28.603 0.584 71.034 1.00 31.69 ? 106 TRP A CZ3 1 ATOM 1111 C CH2 . TRP A 1 77 ? 27.394 0.221 70.432 1.00 32.67 ? 106 TRP A CH2 1 ATOM 1112 H H . TRP A 1 77 ? 30.049 3.904 75.766 1.00 32.16 ? 106 TRP A H 1 ATOM 1113 H HA . TRP A 1 77 ? 27.449 3.557 76.214 1.00 32.45 ? 106 TRP A HA 1 ATOM 1114 H HB2 . TRP A 1 77 ? 27.783 4.788 74.379 1.00 31.86 ? 106 TRP A HB2 1 ATOM 1115 H HB3 . TRP A 1 77 ? 28.959 3.853 73.866 1.00 31.86 ? 106 TRP A HB3 1 ATOM 1116 H HD1 . TRP A 1 77 ? 25.289 3.942 73.824 1.00 36.03 ? 106 TRP A HD1 1 ATOM 1117 H HE1 . TRP A 1 77 ? 24.411 2.459 72.142 1.00 37.58 ? 106 TRP A HE1 1 ATOM 1118 H HE3 . TRP A 1 77 ? 29.455 1.781 72.419 1.00 36.72 ? 106 TRP A HE3 1 ATOM 1119 H HZ2 . TRP A 1 77 ? 25.408 0.557 70.394 1.00 39.23 ? 106 TRP A HZ2 1 ATOM 1120 H HZ3 . TRP A 1 77 ? 29.391 0.170 70.764 1.00 38.03 ? 106 TRP A HZ3 1 ATOM 1121 H HH2 . TRP A 1 77 ? 27.395 -0.430 69.768 1.00 39.20 ? 106 TRP A HH2 1 ATOM 1122 N N . GLN A 1 78 ? 26.929 1.172 75.686 1.00 27.37 ? 107 GLN A N 1 ATOM 1123 C CA . GLN A 1 78 ? 26.750 -0.276 75.635 1.00 30.01 ? 107 GLN A CA 1 ATOM 1124 C C . GLN A 1 78 ? 25.482 -0.634 74.876 1.00 33.68 ? 107 GLN A C 1 ATOM 1125 O O . GLN A 1 78 ? 24.383 -0.245 75.268 1.00 34.72 ? 107 GLN A O 1 ATOM 1126 C CB . GLN A 1 78 ? 26.700 -0.856 77.048 1.00 30.65 ? 107 GLN A CB 1 ATOM 1127 C CG . GLN A 1 78 ? 26.465 -2.354 77.100 1.00 28.65 ? 107 GLN A CG 1 ATOM 1128 C CD . GLN A 1 78 ? 26.485 -2.889 78.515 1.00 29.19 ? 107 GLN A CD 1 ATOM 1129 O OE1 . GLN A 1 78 ? 27.385 -2.581 79.295 1.00 29.06 ? 107 GLN A OE1 1 ATOM 1130 N NE2 . GLN A 1 78 ? 25.483 -3.688 78.858 1.00 29.90 ? 107 GLN A NE2 1 ATOM 1131 H H . GLN A 1 78 ? 26.197 1.613 75.784 1.00 32.85 ? 107 GLN A H 1 ATOM 1132 H HA . GLN A 1 78 ? 27.503 -0.673 75.171 1.00 36.01 ? 107 GLN A HA 1 ATOM 1133 H HB2 . GLN A 1 78 ? 27.545 -0.675 77.488 1.00 36.78 ? 107 GLN A HB2 1 ATOM 1134 H HB3 . GLN A 1 78 ? 25.979 -0.428 77.534 1.00 36.78 ? 107 GLN A HB3 1 ATOM 1135 H HG2 . GLN A 1 78 ? 25.597 -2.554 76.715 1.00 34.38 ? 107 GLN A HG2 1 ATOM 1136 H HG3 . GLN A 1 78 ? 27.163 -2.803 76.599 1.00 34.38 ? 107 GLN A HG3 1 ATOM 1137 H HE21 . GLN A 1 78 ? 24.868 -3.876 78.287 1.00 35.88 ? 107 GLN A HE21 1 ATOM 1138 H HE22 . GLN A 1 78 ? 25.449 -4.018 79.651 1.00 35.88 ? 107 GLN A HE22 1 ATOM 1139 N N . SER A 1 79 ? 25.646 -1.389 73.794 1.00 43.47 ? 108 SER A N 1 ATOM 1140 C CA . SER A 1 79 ? 24.532 -1.755 72.927 1.00 44.14 ? 108 SER A CA 1 ATOM 1141 C C . SER A 1 79 ? 23.550 -2.688 73.625 1.00 44.91 ? 108 SER A C 1 ATOM 1142 O O . SER A 1 79 ? 23.841 -3.228 74.694 1.00 44.70 ? 108 SER A O 1 ATOM 1143 C CB . SER A 1 79 ? 25.051 -2.420 71.653 1.00 45.03 ? 108 SER A CB 1 ATOM 1144 O OG . SER A 1 79 ? 25.597 -3.696 71.934 1.00 46.23 ? 108 SER A OG 1 ATOM 1145 H H . SER A 1 79 ? 26.403 -1.706 73.538 1.00 52.16 ? 108 SER A H 1 ATOM 1146 H HA . SER A 1 79 ? 24.053 -0.951 72.673 1.00 52.97 ? 108 SER A HA 1 ATOM 1147 H HB2 . SER A 1 79 ? 24.315 -2.523 71.029 1.00 54.04 ? 108 SER A HB2 1 ATOM 1148 H HB3 . SER A 1 79 ? 25.741 -1.861 71.263 1.00 54.04 ? 108 SER A HB3 1 ATOM 1149 H HG . SER A 1 79 ? 25.878 -4.050 71.226 1.00 55.48 ? 108 SER A HG 1 ATOM 1150 N N . ALA A 1 80 ? 22.385 -2.874 73.010 1.00 34.45 ? 109 ALA A N 1 ATOM 1151 C CA . ALA A 1 80 ? 21.404 -3.836 73.500 1.00 35.45 ? 109 ALA A CA 1 ATOM 1152 C C . ALA A 1 80 ? 21.986 -5.244 73.434 1.00 35.70 ? 109 ALA A C 1 ATOM 1153 O O . ALA A 1 80 ? 22.976 -5.478 72.742 1.00 34.38 ? 109 ALA A O 1 ATOM 1154 C CB . ALA A 1 80 ? 20.123 -3.749 72.691 1.00 35.62 ? 109 ALA A CB 1 ATOM 1155 H H . ALA A 1 80 ? 22.138 -2.452 72.303 1.00 41.35 ? 109 ALA A H 1 ATOM 1156 H HA . ALA A 1 80 ? 21.194 -3.637 74.425 1.00 42.54 ? 109 ALA A HA 1 ATOM 1157 H HB1 . ALA A 1 80 ? 19.488 -4.397 73.036 1.00 42.74 ? 109 ALA A HB1 1 ATOM 1158 H HB2 . ALA A 1 80 ? 19.759 -2.854 72.773 1.00 42.74 ? 109 ALA A HB2 1 ATOM 1159 H HB3 . ALA A 1 80 ? 20.323 -3.943 71.762 1.00 42.74 ? 109 ALA A HB3 1 ATOM 1160 N N . GLU A 1 81 ? 21.376 -6.178 74.158 1.00 43.39 ? 110 GLU A N 1 ATOM 1161 C CA . GLU A 1 81 ? 21.885 -7.544 74.214 1.00 44.07 ? 110 GLU A CA 1 ATOM 1162 C C . GLU A 1 81 ? 21.628 -8.298 72.915 1.00 45.07 ? 110 GLU A C 1 ATOM 1163 O O . GLU A 1 81 ? 20.628 -8.067 72.235 1.00 45.33 ? 110 GLU A O 1 ATOM 1164 C CB . GLU A 1 81 ? 21.258 -8.300 75.387 1.00 45.28 ? 110 GLU A CB 1 ATOM 1165 C CG . GLU A 1 81 ? 21.796 -7.886 76.747 1.00 46.53 ? 110 GLU A CG 1 ATOM 1166 C CD . GLU A 1 81 ? 23.276 -8.185 76.907 1.00 47.61 ? 110 GLU A CD 1 ATOM 1167 O OE1 . GLU A 1 81 ? 23.722 -9.260 76.451 1.00 47.96 ? 110 GLU A OE1 1 ATOM 1168 O OE2 . GLU A 1 81 ? 23.995 -7.339 77.481 1.00 47.96 ? 110 GLU A OE2 1 ATOM 1169 H H . GLU A 1 81 ? 20.666 -6.046 74.625 1.00 52.06 ? 110 GLU A H 1 ATOM 1170 H HA . GLU A 1 81 ? 22.844 -7.515 74.357 1.00 52.88 ? 110 GLU A HA 1 ATOM 1171 H HB2 . GLU A 1 81 ? 20.301 -8.140 75.386 1.00 54.34 ? 110 GLU A HB2 1 ATOM 1172 H HB3 . GLU A 1 81 ? 21.432 -9.248 75.277 1.00 54.34 ? 110 GLU A HB3 1 ATOM 1173 H HG2 . GLU A 1 81 ? 21.669 -6.931 76.860 1.00 55.83 ? 110 GLU A HG2 1 ATOM 1174 H HG3 . GLU A 1 81 ? 21.316 -8.369 77.438 1.00 55.83 ? 110 GLU A HG3 1 ATOM 1175 N N . ASP A 1 82 ? 22.546 -9.203 72.588 1.00 61.76 ? 111 ASP A N 1 ATOM 1176 C CA . ASP A 1 82 ? 22.450 -10.025 71.385 1.00 62.54 ? 111 ASP A CA 1 ATOM 1177 C C . ASP A 1 82 ? 22.256 -9.176 70.135 1.00 62.49 ? 111 ASP A C 1 ATOM 1178 O O . ASP A 1 82 ? 21.173 -9.149 69.551 1.00 64.98 ? 111 ASP A O 1 ATOM 1179 C CB . ASP A 1 82 ? 21.307 -11.036 71.517 1.00 63.42 ? 111 ASP A CB 1 ATOM 1180 C CG . ASP A 1 82 ? 21.611 -12.133 72.521 1.00 63.75 ? 111 ASP A CG 1 ATOM 1181 O OD1 . ASP A 1 82 ? 22.784 -12.556 72.609 1.00 62.87 ? 111 ASP A OD1 1 ATOM 1182 O OD2 . ASP A 1 82 ? 20.676 -12.575 73.222 1.00 64.84 ? 111 ASP A OD2 1 ATOM 1183 H H . ASP A 1 82 ? 23.249 -9.363 73.057 1.00 74.11 ? 111 ASP A H 1 ATOM 1184 H HA . ASP A 1 82 ? 23.276 -10.523 71.280 1.00 75.05 ? 111 ASP A HA 1 ATOM 1185 H HB2 . ASP A 1 82 ? 20.507 -10.573 71.811 1.00 76.10 ? 111 ASP A HB2 1 ATOM 1186 H HB3 . ASP A 1 82 ? 21.153 -11.453 70.654 1.00 76.10 ? 111 ASP A HB3 1 ATOM 1187 N N . VAL A 1 83 ? 23.317 -8.480 69.738 1.00 41.73 ? 112 VAL A N 1 ATOM 1188 C CA . VAL A 1 83 ? 23.334 -7.734 68.488 1.00 40.68 ? 112 VAL A CA 1 ATOM 1189 C C . VAL A 1 83 ? 24.744 -7.767 67.914 1.00 42.90 ? 112 VAL A C 1 ATOM 1190 O O . VAL A 1 83 ? 25.722 -7.622 68.648 1.00 43.96 ? 112 VAL A O 1 ATOM 1191 C CB . VAL A 1 83 ? 22.874 -6.270 68.680 1.00 38.64 ? 112 VAL A CB 1 ATOM 1192 C CG1 . VAL A 1 83 ? 23.781 -5.536 69.658 1.00 37.41 ? 112 VAL A CG1 1 ATOM 1193 C CG2 . VAL A 1 83 ? 22.824 -5.541 67.344 1.00 37.95 ? 112 VAL A CG2 1 ATOM 1194 H H . VAL A 1 83 ? 24.050 -8.425 70.184 1.00 50.08 ? 112 VAL A H 1 ATOM 1195 H HA . VAL A 1 83 ? 22.737 -8.160 67.852 1.00 48.82 ? 112 VAL A HA 1 ATOM 1196 H HB . VAL A 1 83 ? 21.977 -6.270 69.050 1.00 46.37 ? 112 VAL A HB 1 ATOM 1197 H HG11 . VAL A 1 83 ? 23.466 -4.623 69.755 1.00 44.89 ? 112 VAL A HG11 1 ATOM 1198 H HG12 . VAL A 1 83 ? 23.753 -5.989 70.515 1.00 44.89 ? 112 VAL A HG12 1 ATOM 1199 H HG13 . VAL A 1 83 ? 24.686 -5.538 69.310 1.00 44.89 ? 112 VAL A HG13 1 ATOM 1200 H HG21 . VAL A 1 83 ? 22.533 -4.628 67.493 1.00 45.54 ? 112 VAL A HG21 1 ATOM 1201 H HG22 . VAL A 1 83 ? 23.710 -5.547 66.948 1.00 45.54 ? 112 VAL A HG22 1 ATOM 1202 H HG23 . VAL A 1 83 ? 22.197 -5.997 66.759 1.00 45.54 ? 112 VAL A HG23 1 ATOM 1203 N N . HIS A 1 84 ? 24.843 -7.977 66.606 1.00 46.09 ? 113 HIS A N 1 ATOM 1204 C CA . HIS A 1 84 ? 26.133 -8.007 65.924 1.00 46.92 ? 113 HIS A CA 1 ATOM 1205 C C . HIS A 1 84 ? 26.260 -6.808 64.998 1.00 46.85 ? 113 HIS A C 1 ATOM 1206 O O . HIS A 1 84 ? 27.285 -6.126 64.984 1.00 46.90 ? 113 HIS A O 1 ATOM 1207 C CB . HIS A 1 84 ? 26.298 -9.307 65.135 1.00 48.55 ? 113 HIS A CB 1 ATOM 1208 C CG . HIS A 1 84 ? 26.554 -10.506 65.994 1.00 49.27 ? 113 HIS A CG 1 ATOM 1209 N ND1 . HIS A 1 84 ? 26.973 -11.713 65.478 1.00 49.72 ? 113 HIS A ND1 1 ATOM 1210 C CD2 . HIS A 1 84 ? 26.452 -10.684 67.333 1.00 48.82 ? 113 HIS A CD2 1 ATOM 1211 C CE1 . HIS A 1 84 ? 27.118 -12.584 66.462 1.00 49.18 ? 113 HIS A CE1 1 ATOM 1212 N NE2 . HIS A 1 84 ? 26.808 -11.984 67.597 1.00 48.69 ? 113 HIS A NE2 1 ATOM 1213 H H . HIS A 1 84 ? 24.171 -8.107 66.085 1.00 55.31 ? 113 HIS A H 1 ATOM 1214 H HA . HIS A 1 84 ? 26.843 -7.959 66.582 1.00 56.30 ? 113 HIS A HA 1 ATOM 1215 H HB2 . HIS A 1 84 ? 25.486 -9.471 64.630 1.00 58.25 ? 113 HIS A HB2 1 ATOM 1216 H HB3 . HIS A 1 84 ? 27.049 -9.210 64.528 1.00 58.25 ? 113 HIS A HB3 1 ATOM 1217 H HD2 . HIS A 1 84 ? 26.191 -10.045 67.956 1.00 58.59 ? 113 HIS A HD2 1 ATOM 1218 H HE1 . HIS A 1 84 ? 27.391 -13.468 66.370 1.00 59.02 ? 113 HIS A HE1 1 ATOM 1219 N N . ARG A 1 85 ? 25.210 -6.555 64.227 1.00 57.10 ? 114 ARG A N 1 ATOM 1220 C CA . ARG A 1 85 ? 25.191 -5.422 63.315 1.00 54.77 ? 114 ARG A CA 1 ATOM 1221 C C . ARG A 1 85 ? 24.868 -4.148 64.087 1.00 51.37 ? 114 ARG A C 1 ATOM 1222 O O . ARG A 1 85 ? 23.735 -3.945 64.526 1.00 49.48 ? 114 ARG A O 1 ATOM 1223 C CB . ARG A 1 85 ? 24.177 -5.651 62.194 1.00 55.51 ? 114 ARG A CB 1 ATOM 1224 C CG . ARG A 1 85 ? 24.144 -7.088 61.697 1.00 56.49 ? 114 ARG A CG 1 ATOM 1225 C CD . ARG A 1 85 ? 23.481 -7.208 60.336 1.00 57.70 ? 114 ARG A CD 1 ATOM 1226 N NE . ARG A 1 85 ? 24.296 -6.611 59.281 1.00 58.23 ? 114 ARG A NE 1 ATOM 1227 C CZ . ARG A 1 85 ? 25.394 -7.167 58.776 1.00 59.13 ? 114 ARG A CZ 1 ATOM 1228 N NH1 . ARG A 1 85 ? 25.825 -8.337 59.231 1.00 59.39 ? 114 ARG A NH1 1 ATOM 1229 N NH2 . ARG A 1 85 ? 26.068 -6.548 57.817 1.00 59.47 ? 114 ARG A NH2 1 ATOM 1230 H H . ARG A 1 85 ? 24.492 -7.028 64.214 1.00 68.53 ? 114 ARG A H 1 ATOM 1231 H HA . ARG A 1 85 ? 26.069 -5.320 62.915 1.00 65.73 ? 114 ARG A HA 1 ATOM 1232 H HB2 . ARG A 1 85 ? 23.291 -5.428 62.521 1.00 66.61 ? 114 ARG A HB2 1 ATOM 1233 H HB3 . ARG A 1 85 ? 24.405 -5.081 61.443 1.00 66.61 ? 114 ARG A HB3 1 ATOM 1234 H HG2 . ARG A 1 85 ? 25.053 -7.419 61.620 1.00 67.79 ? 114 ARG A HG2 1 ATOM 1235 H HG3 . ARG A 1 85 ? 23.643 -7.631 62.326 1.00 67.79 ? 114 ARG A HG3 1 ATOM 1236 H HD2 . ARG A 1 85 ? 23.352 -8.146 60.125 1.00 69.24 ? 114 ARG A HD2 1 ATOM 1237 H HD3 . ARG A 1 85 ? 22.627 -6.748 60.356 1.00 69.24 ? 114 ARG A HD3 1 ATOM 1238 H HE . ARG A 1 85 ? 24.049 -5.850 58.965 1.00 69.87 ? 114 ARG A HE 1 ATOM 1239 H HH11 . ARG A 1 85 ? 25.391 -8.743 59.853 1.00 71.27 ? 114 ARG A HH11 1 ATOM 1240 H HH12 . ARG A 1 85 ? 26.536 -8.691 58.902 1.00 71.27 ? 114 ARG A HH12 1 ATOM 1241 H HH21 . ARG A 1 85 ? 25.794 -5.789 57.519 1.00 71.36 ? 114 ARG A HH21 1 ATOM 1242 H HH22 . ARG A 1 85 ? 26.779 -6.906 57.491 1.00 71.36 ? 114 ARG A HH22 1 ATOM 1243 N N . GLU A 1 86 ? 25.875 -3.299 64.256 1.00 44.46 ? 115 GLU A N 1 ATOM 1244 C CA . GLU A 1 86 ? 25.719 -2.049 64.989 1.00 43.10 ? 115 GLU A CA 1 ATOM 1245 C C . GLU A 1 86 ? 26.453 -0.935 64.260 1.00 40.03 ? 115 GLU A C 1 ATOM 1246 O O . GLU A 1 86 ? 27.434 -1.185 63.556 1.00 38.81 ? 115 GLU A O 1 ATOM 1247 C CB . GLU A 1 86 ? 26.247 -2.191 66.419 1.00 43.51 ? 115 GLU A CB 1 ATOM 1248 C CG . GLU A 1 86 ? 25.915 -1.022 67.336 1.00 43.86 ? 115 GLU A CG 1 ATOM 1249 C CD . GLU A 1 86 ? 24.429 -0.891 67.616 1.00 45.58 ? 115 GLU A CD 1 ATOM 1250 O OE1 . GLU A 1 86 ? 23.666 -1.818 67.271 1.00 46.72 ? 115 GLU A OE1 1 ATOM 1251 O OE2 . GLU A 1 86 ? 24.021 0.142 68.189 1.00 45.92 ? 115 GLU A OE2 1 ATOM 1252 H H . GLU A 1 86 ? 26.669 -3.426 63.951 1.00 53.35 ? 115 GLU A H 1 ATOM 1253 H HA . GLU A 1 86 ? 24.778 -1.818 65.033 1.00 51.72 ? 115 GLU A HA 1 ATOM 1254 H HB2 . GLU A 1 86 ? 25.864 -2.991 66.812 1.00 52.22 ? 115 GLU A HB2 1 ATOM 1255 H HB3 . GLU A 1 86 ? 27.213 -2.274 66.386 1.00 52.22 ? 115 GLU A HB3 1 ATOM 1256 H HG2 . GLU A 1 86 ? 26.369 -1.148 68.183 1.00 52.64 ? 115 GLU A HG2 1 ATOM 1257 H HG3 . GLU A 1 86 ? 26.214 -0.199 66.918 1.00 52.64 ? 115 GLU A HG3 1 ATOM 1258 N N . LYS A 1 87 ? 25.974 0.292 64.435 1.00 35.38 ? 116 LYS A N 1 ATOM 1259 C CA . LYS A 1 87 ? 26.526 1.439 63.728 1.00 34.91 ? 116 LYS A CA 1 ATOM 1260 C C . LYS A 1 87 ? 26.648 2.649 64.643 1.00 33.19 ? 116 LYS A C 1 ATOM 1261 O O . LYS A 1 87 ? 25.668 3.084 65.248 1.00 34.24 ? 116 LYS A O 1 ATOM 1262 C CB . LYS A 1 87 ? 25.650 1.787 62.522 1.00 36.88 ? 116 LYS A CB 1 ATOM 1263 C CG . LYS A 1 87 ? 26.118 2.999 61.725 1.00 37.41 ? 116 LYS A CG 1 ATOM 1264 C CD . LYS A 1 87 ? 25.170 3.324 60.577 1.00 38.76 ? 116 LYS A CD 1 ATOM 1265 C CE . LYS A 1 87 ? 23.805 3.778 61.074 1.00 39.99 ? 116 LYS A CE 1 ATOM 1266 N NZ . LYS A 1 87 ? 22.906 4.165 59.954 1.00 40.69 ? 116 LYS A NZ 1 ATOM 1267 H H . LYS A 1 87 ? 25.324 0.487 64.963 1.00 42.46 ? 116 LYS A H 1 ATOM 1268 H HA . LYS A 1 87 ? 27.412 1.216 63.403 1.00 41.89 ? 116 LYS A HA 1 ATOM 1269 H HB2 . LYS A 1 87 ? 25.637 1.027 61.919 1.00 44.26 ? 116 LYS A HB2 1 ATOM 1270 H HB3 . LYS A 1 87 ? 24.751 1.970 62.834 1.00 44.26 ? 116 LYS A HB3 1 ATOM 1271 H HG2 . LYS A 1 87 ? 26.158 3.770 62.312 1.00 44.89 ? 116 LYS A HG2 1 ATOM 1272 H HG3 . LYS A 1 87 ? 26.994 2.816 61.352 1.00 44.89 ? 116 LYS A HG3 1 ATOM 1273 H HD2 . LYS A 1 87 ? 25.550 4.039 60.042 1.00 46.51 ? 116 LYS A HD2 1 ATOM 1274 H HD3 . LYS A 1 87 ? 25.045 2.530 60.033 1.00 46.51 ? 116 LYS A HD3 1 ATOM 1275 H HE2 . LYS A 1 87 ? 23.386 3.051 61.561 1.00 47.99 ? 116 LYS A HE2 1 ATOM 1276 H HE3 . LYS A 1 87 ? 23.917 4.548 61.653 1.00 47.99 ? 116 LYS A HE3 1 ATOM 1277 H HZ1 . LYS A 1 87 ? 22.118 4.426 60.274 1.00 48.82 ? 116 LYS A HZ1 1 ATOM 1278 H HZ2 . LYS A 1 87 ? 23.267 4.835 59.493 1.00 48.82 ? 116 LYS A HZ2 1 ATOM 1279 H HZ3 . LYS A 1 87 ? 22.783 3.472 59.409 1.00 48.82 ? 116 LYS A HZ3 1 ATOM 1280 N N . ILE A 1 88 ? 27.862 3.181 64.738 1.00 25.45 ? 117 ILE A N 1 ATOM 1281 C CA . ILE A 1 88 ? 28.112 4.436 65.434 1.00 24.93 ? 117 ILE A CA 1 ATOM 1282 C C . ILE A 1 88 ? 28.414 5.502 64.386 1.00 24.54 ? 117 ILE A C 1 ATOM 1283 O O . ILE A 1 88 ? 29.226 5.277 63.487 1.00 24.41 ? 117 ILE A O 1 ATOM 1284 C CB . ILE A 1 88 ? 29.281 4.318 66.428 1.00 24.58 ? 117 ILE A CB 1 ATOM 1285 C CG1 . ILE A 1 88 ? 29.041 3.153 67.394 1.00 25.01 ? 117 ILE A CG1 1 ATOM 1286 C CG2 . ILE A 1 88 ? 29.454 5.620 67.199 1.00 24.20 ? 117 ILE A CG2 1 ATOM 1287 C CD1 . ILE A 1 88 ? 30.234 2.815 68.264 1.00 24.81 ? 117 ILE A CD1 1 ATOM 1288 H H . ILE A 1 88 ? 28.569 2.826 64.401 1.00 30.54 ? 117 ILE A H 1 ATOM 1289 H HA . ILE A 1 88 ? 27.317 4.700 65.923 1.00 29.91 ? 117 ILE A HA 1 ATOM 1290 H HB . ILE A 1 88 ? 30.095 4.143 65.930 1.00 29.50 ? 117 ILE A HB 1 ATOM 1291 H HG12 . ILE A 1 88 ? 28.302 3.381 67.980 1.00 30.01 ? 117 ILE A HG12 1 ATOM 1292 H HG13 . ILE A 1 88 ? 28.818 2.362 66.878 1.00 30.01 ? 117 ILE A HG13 1 ATOM 1293 H HG21 . ILE A 1 88 ? 30.194 5.524 67.818 1.00 29.04 ? 117 ILE A HG21 1 ATOM 1294 H HG22 . ILE A 1 88 ? 29.639 6.336 66.571 1.00 29.04 ? 117 ILE A HG22 1 ATOM 1295 H HG23 . ILE A 1 88 ? 28.637 5.809 67.686 1.00 29.04 ? 117 ILE A HG23 1 ATOM 1296 H HD11 . ILE A 1 88 ? 30.002 2.072 68.843 1.00 29.77 ? 117 ILE A HD11 1 ATOM 1297 H HD12 . ILE A 1 88 ? 30.980 2.571 67.695 1.00 29.77 ? 117 ILE A HD12 1 ATOM 1298 H HD13 . ILE A 1 88 ? 30.464 3.592 68.798 1.00 29.77 ? 117 ILE A HD13 1 ATOM 1299 N N . GLN A 1 89 ? 27.766 6.657 64.502 1.00 27.72 ? 118 GLN A N 1 ATOM 1300 C CA . GLN A 1 89 ? 27.877 7.696 63.483 1.00 28.60 ? 118 GLN A CA 1 ATOM 1301 C C . GLN A 1 89 ? 27.922 9.095 64.092 1.00 28.75 ? 118 GLN A C 1 ATOM 1302 O O . GLN A 1 89 ? 27.182 9.405 65.027 1.00 28.65 ? 118 GLN A O 1 ATOM 1303 C CB . GLN A 1 89 ? 26.709 7.590 62.502 1.00 29.33 ? 118 GLN A CB 1 ATOM 1304 C CG . GLN A 1 89 ? 26.799 8.536 61.319 1.00 29.57 ? 118 GLN A CG 1 ATOM 1305 C CD . GLN A 1 89 ? 25.684 8.317 60.314 1.00 31.68 ? 118 GLN A CD 1 ATOM 1306 O OE1 . GLN A 1 89 ? 25.028 7.273 60.313 1.00 32.64 ? 118 GLN A OE1 1 ATOM 1307 N NE2 . GLN A 1 89 ? 25.460 9.304 59.454 1.00 32.27 ? 118 GLN A NE2 1 ATOM 1308 H H . GLN A 1 89 ? 27.255 6.864 65.162 1.00 33.27 ? 118 GLN A H 1 ATOM 1309 H HA . GLN A 1 89 ? 28.699 7.562 62.985 1.00 34.32 ? 118 GLN A HA 1 ATOM 1310 H HB2 . GLN A 1 89 ? 26.677 6.685 62.154 1.00 35.19 ? 118 GLN A HB2 1 ATOM 1311 H HB3 . GLN A 1 89 ? 25.886 7.788 62.976 1.00 35.19 ? 118 GLN A HB3 1 ATOM 1312 H HG2 . GLN A 1 89 ? 26.740 9.450 61.638 1.00 35.48 ? 118 GLN A HG2 1 ATOM 1313 H HG3 . GLN A 1 89 ? 27.644 8.397 60.864 1.00 35.48 ? 118 GLN A HG3 1 ATOM 1314 H HE21 . GLN A 1 89 ? 25.937 10.019 59.486 1.00 38.73 ? 118 GLN A HE21 1 ATOM 1315 H HE22 . GLN A 1 89 ? 24.839 9.228 58.864 1.00 38.73 ? 118 GLN A HE22 1 ATOM 1316 N N . LEU A 1 90 ? 28.800 9.929 63.542 1.00 32.68 ? 119 LEU A N 1 ATOM 1317 C CA . LEU A 1 90 ? 28.987 11.298 64.009 1.00 32.22 ? 119 LEU A CA 1 ATOM 1318 C C . LEU A 1 90 ? 28.721 12.287 62.883 1.00 32.23 ? 119 LEU A C 1 ATOM 1319 O O . LEU A 1 90 ? 29.508 12.391 61.944 1.00 31.24 ? 119 LEU A O 1 ATOM 1320 C CB . LEU A 1 90 ? 30.407 11.487 64.548 1.00 31.10 ? 119 LEU A CB 1 ATOM 1321 C CG . LEU A 1 90 ? 30.805 12.912 64.937 1.00 30.34 ? 119 LEU A CG 1 ATOM 1322 C CD1 . LEU A 1 90 ? 29.887 13.455 66.021 1.00 30.71 ? 119 LEU A CD1 1 ATOM 1323 C CD2 . LEU A 1 90 ? 32.255 12.952 65.390 1.00 29.61 ? 119 LEU A CD2 1 ATOM 1324 H H . LEU A 1 90 ? 29.310 9.720 62.882 1.00 39.21 ? 119 LEU A H 1 ATOM 1325 H HA . LEU A 1 90 ? 28.362 11.479 64.728 1.00 38.66 ? 119 LEU A HA 1 ATOM 1326 H HB2 . LEU A 1 90 ? 30.507 10.934 65.339 1.00 37.33 ? 119 LEU A HB2 1 ATOM 1327 H HB3 . LEU A 1 90 ? 31.032 11.190 63.868 1.00 37.33 ? 119 LEU A HB3 1 ATOM 1328 H HG . LEU A 1 90 ? 30.719 13.485 64.160 1.00 36.41 ? 119 LEU A HG 1 ATOM 1329 H HD11 . LEU A 1 90 ? 30.164 14.357 66.246 1.00 36.85 ? 119 LEU A HD11 1 ATOM 1330 H HD12 . LEU A 1 90 ? 28.976 13.461 65.689 1.00 36.85 ? 119 LEU A HD12 1 ATOM 1331 H HD13 . LEU A 1 90 ? 29.951 12.884 66.803 1.00 36.85 ? 119 LEU A HD13 1 ATOM 1332 H HD21 . LEU A 1 90 ? 32.485 13.863 65.632 1.00 35.53 ? 119 LEU A HD21 1 ATOM 1333 H HD22 . LEU A 1 90 ? 32.362 12.369 66.158 1.00 35.53 ? 119 LEU A HD22 1 ATOM 1334 H HD23 . LEU A 1 90 ? 32.821 12.649 64.663 1.00 35.53 ? 119 LEU A HD23 1 ATOM 1335 N N . ASP A 1 91 ? 27.610 13.011 62.984 1.00 39.48 ? 120 ASP A N 1 ATOM 1336 C CA . ASP A 1 91 ? 27.241 14.006 61.982 1.00 40.15 ? 120 ASP A CA 1 ATOM 1337 C C . ASP A 1 91 ? 27.773 15.384 62.359 1.00 39.27 ? 120 ASP A C 1 ATOM 1338 O O . ASP A 1 91 ? 27.588 15.841 63.488 1.00 40.32 ? 120 ASP A O 1 ATOM 1339 C CB . ASP A 1 91 ? 25.723 14.059 61.818 1.00 41.08 ? 120 ASP A CB 1 ATOM 1340 C CG . ASP A 1 91 ? 25.129 12.715 61.446 1.00 40.72 ? 120 ASP A CG 1 ATOM 1341 O OD1 . ASP A 1 91 ? 25.841 11.903 60.818 1.00 39.54 ? 120 ASP A OD1 1 ATOM 1342 O OD2 . ASP A 1 91 ? 23.952 12.470 61.782 1.00 41.96 ? 120 ASP A OD2 1 ATOM 1343 H H . ASP A 1 91 ? 27.047 12.943 63.631 1.00 47.37 ? 120 ASP A H 1 ATOM 1344 H HA . ASP A 1 91 ? 27.629 13.756 61.129 1.00 48.18 ? 120 ASP A HA 1 ATOM 1345 H HB2 . ASP A 1 91 ? 25.323 14.342 62.656 1.00 49.29 ? 120 ASP A HB2 1 ATOM 1346 H HB3 . ASP A 1 91 ? 25.502 14.690 61.115 1.00 49.29 ? 120 ASP A HB3 1 ATOM 1347 N N . LEU A 1 92 ? 28.431 16.039 61.407 1.00 28.40 ? 121 LEU A N 1 ATOM 1348 C CA . LEU A 1 92 ? 28.985 17.373 61.621 1.00 25.68 ? 121 LEU A CA 1 ATOM 1349 C C . LEU A 1 92 ? 28.120 18.435 60.946 1.00 26.77 ? 121 LEU A C 1 ATOM 1350 O O . LEU A 1 92 ? 27.617 18.228 59.840 1.00 27.20 ? 121 LEU A O 1 ATOM 1351 C CB . LEU A 1 92 ? 30.420 17.439 61.097 1.00 22.13 ? 121 LEU A CB 1 ATOM 1352 C CG . LEU A 1 92 ? 31.343 16.337 61.628 1.00 21.92 ? 121 LEU A CG 1 ATOM 1353 C CD1 . LEU A 1 92 ? 32.723 16.434 60.999 1.00 21.61 ? 121 LEU A CD1 1 ATOM 1354 C CD2 . LEU A 1 92 ? 31.443 16.401 63.144 1.00 21.98 ? 121 LEU A CD2 1 ATOM 1355 H H . LEU A 1 92 ? 28.571 15.728 60.617 1.00 34.08 ? 121 LEU A H 1 ATOM 1356 H HA . LEU A 1 92 ? 29.003 17.560 62.573 1.00 30.82 ? 121 LEU A HA 1 ATOM 1357 H HB2 . LEU A 1 92 ? 30.401 17.365 60.130 1.00 26.56 ? 121 LEU A HB2 1 ATOM 1358 H HB3 . LEU A 1 92 ? 30.805 18.292 61.351 1.00 26.56 ? 121 LEU A HB3 1 ATOM 1359 H HG . LEU A 1 92 ? 30.969 15.474 61.390 1.00 26.30 ? 121 LEU A HG 1 ATOM 1360 H HD11 . LEU A 1 92 ? 33.282 15.726 61.355 1.00 25.93 ? 121 LEU A HD11 1 ATOM 1361 H HD12 . LEU A 1 92 ? 32.639 16.340 60.038 1.00 25.93 ? 121 LEU A HD12 1 ATOM 1362 H HD13 . LEU A 1 92 ? 33.107 17.299 61.215 1.00 25.93 ? 121 LEU A HD13 1 ATOM 1363 H HD21 . LEU A 1 92 ? 32.031 15.693 63.451 1.00 26.37 ? 121 LEU A HD21 1 ATOM 1364 H HD22 . LEU A 1 92 ? 31.801 17.265 63.401 1.00 26.37 ? 121 LEU A HD22 1 ATOM 1365 H HD23 . LEU A 1 92 ? 30.558 16.283 63.524 1.00 26.37 ? 121 LEU A HD23 1 ATOM 1366 N N . GLU A 1 93 ? 27.951 19.570 61.620 1.00 37.67 ? 122 GLU A N 1 ATOM 1367 C CA . GLU A 1 93 ? 27.117 20.656 61.112 1.00 38.93 ? 122 GLU A CA 1 ATOM 1368 C C . GLU A 1 93 ? 27.800 21.418 59.978 1.00 38.38 ? 122 GLU A C 1 ATOM 1369 O O . GLU A 1 93 ? 27.210 22.321 59.384 1.00 37.92 ? 122 GLU A O 1 ATOM 1370 C CB . GLU A 1 93 ? 26.743 21.626 62.241 1.00 38.95 ? 122 GLU A CB 1 ATOM 1371 C CG . GLU A 1 93 ? 27.890 22.485 62.784 1.00 40.41 ? 122 GLU A CG 1 ATOM 1372 C CD . GLU A 1 93 ? 28.870 21.716 63.651 1.00 40.61 ? 122 GLU A CD 1 ATOM 1373 O OE1 . GLU A 1 93 ? 28.553 20.576 64.050 1.00 41.93 ? 122 GLU A OE1 1 ATOM 1374 O OE2 . GLU A 1 93 ? 29.961 22.254 63.936 1.00 39.46 ? 122 GLU A OE2 1 ATOM 1375 H H . GLU A 1 93 ? 28.313 19.736 62.383 1.00 45.20 ? 122 GLU A H 1 ATOM 1376 H HA . GLU A 1 93 ? 26.295 20.279 60.761 1.00 46.71 ? 122 GLU A HA 1 ATOM 1377 H HB2 . GLU A 1 93 ? 26.058 22.229 61.912 1.00 46.74 ? 122 GLU A HB2 1 ATOM 1378 H HB3 . GLU A 1 93 ? 26.390 21.110 62.983 1.00 46.74 ? 122 GLU A HB3 1 ATOM 1379 H HG2 . GLU A 1 93 ? 28.383 22.858 62.037 1.00 48.49 ? 122 GLU A HG2 1 ATOM 1380 H HG3 . GLU A 1 93 ? 27.517 23.202 63.322 1.00 48.49 ? 122 GLU A HG3 1 ATOM 1381 N N . ALA A 1 94 ? 29.043 21.051 59.683 1.00 38.28 ? 123 ALA A N 1 ATOM 1382 C CA . ALA A 1 94 ? 29.806 21.694 58.621 1.00 39.82 ? 123 ALA A CA 1 ATOM 1383 C C . ALA A 1 94 ? 30.956 20.792 58.198 1.00 40.37 ? 123 ALA A C 1 ATOM 1384 O O . ALA A 1 94 ? 31.120 19.697 58.736 1.00 41.69 ? 123 ALA A O 1 ATOM 1385 C CB . ALA A 1 94 ? 30.329 23.044 59.081 1.00 40.47 ? 123 ALA A CB 1 ATOM 1386 H H . ALA A 1 94 ? 29.471 20.425 60.089 1.00 45.94 ? 123 ALA A H 1 ATOM 1387 H HA . ALA A 1 94 ? 29.231 21.835 57.853 1.00 47.79 ? 123 ALA A HA 1 ATOM 1388 H HB1 . ALA A 1 94 ? 30.832 23.450 58.358 1.00 48.57 ? 123 ALA A HB1 1 ATOM 1389 H HB2 . ALA A 1 94 ? 29.577 23.609 59.319 1.00 48.57 ? 123 ALA A HB2 1 ATOM 1390 H HB3 . ALA A 1 94 ? 30.903 22.914 59.852 1.00 48.57 ? 123 ALA A HB3 1 ATOM 1391 N N . GLU A 1 95 ? 31.741 21.248 57.229 1.00 42.75 ? 124 GLU A N 1 ATOM 1392 C CA . GLU A 1 95 ? 32.893 20.488 56.761 1.00 41.46 ? 124 GLU A CA 1 ATOM 1393 C C . GLU A 1 95 ? 34.081 20.672 57.700 1.00 39.04 ? 124 GLU A C 1 ATOM 1394 O O . GLU A 1 95 ? 34.452 21.799 58.032 1.00 39.25 ? 124 GLU A O 1 ATOM 1395 C CB . GLU A 1 95 ? 33.271 20.910 55.341 1.00 42.06 ? 124 GLU A CB 1 ATOM 1396 C CG . GLU A 1 95 ? 32.171 20.669 54.318 1.00 43.25 ? 124 GLU A CG 1 ATOM 1397 C CD . GLU A 1 95 ? 32.555 21.126 52.925 1.00 44.09 ? 124 GLU A CD 1 ATOM 1398 O OE1 . GLU A 1 95 ? 33.498 21.936 52.801 1.00 43.83 ? 124 GLU A OE1 1 ATOM 1399 O OE2 . GLU A 1 95 ? 31.915 20.673 51.952 1.00 44.96 ? 124 GLU A OE2 1 ATOM 1400 H H . GLU A 1 95 ? 31.628 21.998 56.824 1.00 51.30 ? 124 GLU A H 1 ATOM 1401 H HA . GLU A 1 95 ? 32.666 19.545 56.744 1.00 49.75 ? 124 GLU A HA 1 ATOM 1402 H HB2 . GLU A 1 95 ? 33.474 21.858 55.341 1.00 50.47 ? 124 GLU A HB2 1 ATOM 1403 H HB3 . GLU A 1 95 ? 34.051 20.405 55.062 1.00 50.47 ? 124 GLU A HB3 1 ATOM 1404 H HG2 . GLU A 1 95 ? 31.977 19.719 54.279 1.00 51.90 ? 124 GLU A HG2 1 ATOM 1405 H HG3 . GLU A 1 95 ? 31.377 21.158 54.586 1.00 51.90 ? 124 GLU A HG3 1 ATOM 1406 N N . PHE A 1 96 ? 34.670 19.556 58.120 1.00 23.97 ? 125 PHE A N 1 ATOM 1407 C CA . PHE A 1 96 ? 35.828 19.568 59.009 1.00 21.68 ? 125 PHE A CA 1 ATOM 1408 C C . PHE A 1 96 ? 36.955 18.711 58.447 1.00 21.59 ? 125 PHE A C 1 ATOM 1409 O O . PHE A 1 96 ? 36.730 17.863 57.583 1.00 21.70 ? 125 PHE A O 1 ATOM 1410 C CB . PHE A 1 96 ? 35.448 19.058 60.399 1.00 20.75 ? 125 PHE A CB 1 ATOM 1411 C CG . PHE A 1 96 ? 34.600 20.012 61.189 1.00 20.69 ? 125 PHE A CG 1 ATOM 1412 C CD1 . PHE A 1 96 ? 33.241 20.115 60.949 1.00 20.82 ? 125 PHE A CD1 1 ATOM 1413 C CD2 . PHE A 1 96 ? 35.161 20.792 62.187 1.00 20.63 ? 125 PHE A CD2 1 ATOM 1414 C CE1 . PHE A 1 96 ? 32.459 20.987 61.681 1.00 20.90 ? 125 PHE A CE1 1 ATOM 1415 C CE2 . PHE A 1 96 ? 34.384 21.666 62.923 1.00 20.71 ? 125 PHE A CE2 1 ATOM 1416 C CZ . PHE A 1 96 ? 33.031 21.764 62.669 1.00 20.85 ? 125 PHE A CZ 1 ATOM 1417 H H . PHE A 1 96 ? 34.413 18.765 57.900 1.00 28.77 ? 125 PHE A H 1 ATOM 1418 H HA . PHE A 1 96 ? 36.154 20.477 59.097 1.00 26.02 ? 125 PHE A HA 1 ATOM 1419 H HB2 . PHE A 1 96 ? 34.951 18.231 60.303 1.00 24.90 ? 125 PHE A HB2 1 ATOM 1420 H HB3 . PHE A 1 96 ? 36.260 18.897 60.905 1.00 24.90 ? 125 PHE A HB3 1 ATOM 1421 H HD1 . PHE A 1 96 ? 32.851 19.595 60.284 1.00 24.98 ? 125 PHE A HD1 1 ATOM 1422 H HD2 . PHE A 1 96 ? 36.072 20.730 62.361 1.00 24.76 ? 125 PHE A HD2 1 ATOM 1423 H HE1 . PHE A 1 96 ? 31.547 21.052 61.508 1.00 25.08 ? 125 PHE A HE1 1 ATOM 1424 H HE2 . PHE A 1 96 ? 34.772 22.187 63.587 1.00 24.85 ? 125 PHE A HE2 1 ATOM 1425 H HZ . PHE A 1 96 ? 32.506 22.352 63.163 1.00 25.02 ? 125 PHE A HZ 1 ATOM 1426 N N . TYR A 1 97 ? 38.167 18.943 58.945 1.00 27.98 ? 126 TYR A N 1 ATOM 1427 C CA . TYR A 1 97 ? 39.310 18.098 58.625 1.00 28.07 ? 126 TYR A CA 1 ATOM 1428 C C . TYR A 1 97 ? 39.428 16.967 59.641 1.00 28.09 ? 126 TYR A C 1 ATOM 1429 O O . TYR A 1 97 ? 39.492 17.208 60.847 1.00 27.47 ? 126 TYR A O 1 ATOM 1430 C CB . TYR A 1 97 ? 40.605 18.919 58.598 1.00 28.57 ? 126 TYR A CB 1 ATOM 1431 C CG . TYR A 1 97 ? 41.159 19.204 57.215 1.00 29.76 ? 126 TYR A CG 1 ATOM 1432 C CD1 . TYR A 1 97 ? 40.338 19.213 56.092 1.00 30.35 ? 126 TYR A CD1 1 ATOM 1433 C CD2 . TYR A 1 97 ? 42.512 19.460 57.036 1.00 30.17 ? 126 TYR A CD2 1 ATOM 1434 C CE1 . TYR A 1 97 ? 40.849 19.469 54.834 1.00 30.78 ? 126 TYR A CE1 1 ATOM 1435 C CE2 . TYR A 1 97 ? 43.031 19.719 55.783 1.00 30.78 ? 126 TYR A CE2 1 ATOM 1436 C CZ . TYR A 1 97 ? 42.197 19.723 54.686 1.00 31.23 ? 126 TYR A CZ 1 ATOM 1437 O OH . TYR A 1 97 ? 42.715 19.980 53.438 1.00 31.65 ? 126 TYR A OH 1 ATOM 1438 H H . TYR A 1 97 ? 38.354 19.593 59.476 1.00 33.58 ? 126 TYR A H 1 ATOM 1439 H HA . TYR A 1 97 ? 39.181 17.705 57.748 1.00 33.68 ? 126 TYR A HA 1 ATOM 1440 H HB2 . TYR A 1 97 ? 40.437 19.772 59.028 1.00 34.28 ? 126 TYR A HB2 1 ATOM 1441 H HB3 . TYR A 1 97 ? 41.286 18.436 59.092 1.00 34.28 ? 126 TYR A HB3 1 ATOM 1442 H HD1 . TYR A 1 97 ? 39.429 19.042 56.189 1.00 36.42 ? 126 TYR A HD1 1 ATOM 1443 H HD2 . TYR A 1 97 ? 43.078 19.458 57.773 1.00 36.20 ? 126 TYR A HD2 1 ATOM 1444 H HE1 . TYR A 1 97 ? 40.288 19.473 54.093 1.00 36.94 ? 126 TYR A HE1 1 ATOM 1445 H HE2 . TYR A 1 97 ? 43.939 19.889 55.680 1.00 36.93 ? 126 TYR A HE2 1 ATOM 1446 H HH . TYR A 1 97 ? 43.542 20.116 53.493 1.00 37.98 ? 126 TYR A HH 1 ATOM 1447 N N . PHE A 1 98 ? 39.449 15.737 59.140 1.00 25.05 ? 127 PHE A N 1 ATOM 1448 C CA . PHE A 1 98 ? 39.613 14.553 59.976 1.00 25.19 ? 127 PHE A CA 1 ATOM 1449 C C . PHE A 1 98 ? 40.997 13.959 59.756 1.00 24.46 ? 127 PHE A C 1 ATOM 1450 O O . PHE A 1 98 ? 41.374 13.649 58.624 1.00 24.77 ? 127 PHE A O 1 ATOM 1451 C CB . PHE A 1 98 ? 38.524 13.525 59.665 1.00 27.16 ? 127 PHE A CB 1 ATOM 1452 C CG . PHE A 1 98 ? 38.809 12.152 60.205 1.00 28.80 ? 127 PHE A CG 1 ATOM 1453 C CD1 . PHE A 1 98 ? 38.545 11.845 61.529 1.00 29.34 ? 127 PHE A CD1 1 ATOM 1454 C CD2 . PHE A 1 98 ? 39.329 11.165 59.385 1.00 30.13 ? 127 PHE A CD2 1 ATOM 1455 C CE1 . PHE A 1 98 ? 38.802 10.580 62.027 1.00 30.54 ? 127 PHE A CE1 1 ATOM 1456 C CE2 . PHE A 1 98 ? 39.588 9.900 59.877 1.00 31.50 ? 127 PHE A CE2 1 ATOM 1457 C CZ . PHE A 1 98 ? 39.324 9.607 61.200 1.00 31.73 ? 127 PHE A CZ 1 ATOM 1458 H H . PHE A 1 98 ? 39.369 15.558 58.302 1.00 30.06 ? 127 PHE A H 1 ATOM 1459 H HA . PHE A 1 98 ? 39.536 14.807 60.909 1.00 30.22 ? 127 PHE A HA 1 ATOM 1460 H HB2 . PHE A 1 98 ? 37.689 13.828 60.054 1.00 32.59 ? 127 PHE A HB2 1 ATOM 1461 H HB3 . PHE A 1 98 ? 38.431 13.451 58.703 1.00 32.59 ? 127 PHE A HB3 1 ATOM 1462 H HD1 . PHE A 1 98 ? 38.193 12.497 62.091 1.00 35.20 ? 127 PHE A HD1 1 ATOM 1463 H HD2 . PHE A 1 98 ? 39.510 11.357 58.493 1.00 36.15 ? 127 PHE A HD2 1 ATOM 1464 H HE1 . PHE A 1 98 ? 38.623 10.386 62.919 1.00 36.65 ? 127 PHE A HE1 1 ATOM 1465 H HE2 . PHE A 1 98 ? 39.940 9.246 59.317 1.00 37.80 ? 127 PHE A HE2 1 ATOM 1466 H HZ . PHE A 1 98 ? 39.498 8.756 61.532 1.00 38.08 ? 127 PHE A HZ 1 ATOM 1467 N N . THR A 1 99 ? 41.749 13.802 60.842 1.00 26.39 ? 128 THR A N 1 ATOM 1468 C CA . THR A 1 99 ? 43.139 13.368 60.755 1.00 26.93 ? 128 THR A CA 1 ATOM 1469 C C . THR A 1 99 ? 43.347 11.937 61.237 1.00 27.40 ? 128 THR A C 1 ATOM 1470 O O . THR A 1 99 ? 44.121 11.187 60.639 1.00 32.07 ? 128 THR A O 1 ATOM 1471 C CB . THR A 1 99 ? 44.062 14.291 61.570 1.00 27.31 ? 128 THR A CB 1 ATOM 1472 O OG1 . THR A 1 99 ? 43.651 14.295 62.943 1.00 26.81 ? 128 THR A OG1 1 ATOM 1473 C CG2 . THR A 1 99 ? 44.020 15.710 61.019 1.00 26.58 ? 128 THR A CG2 1 ATOM 1474 H H . THR A 1 99 ? 41.475 13.942 61.645 1.00 31.67 ? 128 THR A H 1 ATOM 1475 H HA . THR A 1 99 ? 43.421 13.412 59.827 1.00 32.31 ? 128 THR A HA 1 ATOM 1476 H HB . THR A 1 99 ? 44.974 13.968 61.510 1.00 32.78 ? 128 THR A HB 1 ATOM 1477 H HG1 . THR A 1 99 ? 44.152 14.798 63.392 1.00 32.18 ? 128 THR A HG1 1 ATOM 1478 H HG21 . THR A 1 99 ? 44.604 16.285 61.538 1.00 31.89 ? 128 THR A HG21 1 ATOM 1479 H HG22 . THR A 1 99 ? 44.314 15.715 60.094 1.00 31.89 ? 128 THR A HG22 1 ATOM 1480 H HG23 . THR A 1 99 ? 43.116 16.057 61.063 1.00 31.89 ? 128 THR A HG23 1 ATOM 1481 N N . HIS A 1 100 ? 42.668 11.553 62.314 1.00 32.72 ? 129 HIS A N 1 ATOM 1482 C CA . HIS A 1 100 ? 42.916 10.245 62.909 1.00 35.25 ? 129 HIS A CA 1 ATOM 1483 C C . HIS A 1 100 ? 41.939 9.916 64.045 1.00 33.15 ? 129 HIS A C 1 ATOM 1484 O O . HIS A 1 100 ? 41.540 10.787 64.817 1.00 32.62 ? 129 HIS A O 1 ATOM 1485 C CB . HIS A 1 100 ? 44.380 10.187 63.379 1.00 39.28 ? 129 HIS A CB 1 ATOM 1486 C CG . HIS A 1 100 ? 44.561 9.891 64.832 1.00 40.11 ? 129 HIS A CG 1 ATOM 1487 N ND1 . HIS A 1 100 ? 45.012 10.837 65.728 1.00 39.93 ? 129 HIS A ND1 1 ATOM 1488 C CD2 . HIS A 1 100 ? 44.405 8.747 65.539 1.00 41.43 ? 129 HIS A CD2 1 ATOM 1489 C CE1 . HIS A 1 100 ? 45.102 10.294 66.928 1.00 41.22 ? 129 HIS A CE1 1 ATOM 1490 N NE2 . HIS A 1 100 ? 44.739 9.027 66.841 1.00 42.09 ? 129 HIS A NE2 1 ATOM 1491 H H . HIS A 1 100 ? 42.069 12.023 62.714 1.00 39.26 ? 129 HIS A H 1 ATOM 1492 H HA . HIS A 1 100 ? 42.803 9.569 62.223 1.00 42.31 ? 129 HIS A HA 1 ATOM 1493 H HB2 . HIS A 1 100 ? 44.838 9.492 62.879 1.00 47.14 ? 129 HIS A HB2 1 ATOM 1494 H HB3 . HIS A 1 100 ? 44.797 11.044 63.200 1.00 47.14 ? 129 HIS A HB3 1 ATOM 1495 H HD2 . HIS A 1 100 ? 44.113 7.928 65.208 1.00 49.72 ? 129 HIS A HD2 1 ATOM 1496 H HE1 . HIS A 1 100 ? 45.373 10.731 67.703 1.00 49.46 ? 129 HIS A HE1 1 ATOM 1497 N N . LEU A 1 101 ? 41.560 8.640 64.119 1.00 28.72 ? 130 LEU A N 1 ATOM 1498 C CA . LEU A 1 101 ? 40.509 8.161 65.019 1.00 28.61 ? 130 LEU A CA 1 ATOM 1499 C C . LEU A 1 101 ? 41.043 7.183 66.065 1.00 29.31 ? 130 LEU A C 1 ATOM 1500 O O . LEU A 1 101 ? 41.956 6.403 65.789 1.00 29.51 ? 130 LEU A O 1 ATOM 1501 C CB . LEU A 1 101 ? 39.399 7.488 64.202 1.00 28.61 ? 130 LEU A CB 1 ATOM 1502 C CG . LEU A 1 101 ? 38.411 6.554 64.911 1.00 28.74 ? 130 LEU A CG 1 ATOM 1503 C CD1 . LEU A 1 101 ? 37.457 7.331 65.797 1.00 28.42 ? 130 LEU A CD1 1 ATOM 1504 C CD2 . LEU A 1 101 ? 37.644 5.735 63.890 1.00 28.97 ? 130 LEU A CD2 1 ATOM 1505 H H . LEU A 1 101 ? 41.908 8.014 63.643 1.00 34.47 ? 130 LEU A H 1 ATOM 1506 H HA . LEU A 1 101 ? 40.122 8.919 65.485 1.00 34.33 ? 130 LEU A HA 1 ATOM 1507 H HB2 . LEU A 1 101 ? 38.871 8.190 63.789 1.00 34.33 ? 130 LEU A HB2 1 ATOM 1508 H HB3 . LEU A 1 101 ? 39.824 6.965 63.504 1.00 34.33 ? 130 LEU A HB3 1 ATOM 1509 H HG . LEU A 1 101 ? 38.907 5.940 65.474 1.00 34.49 ? 130 LEU A HG 1 ATOM 1510 H HD11 . LEU A 1 101 ? 36.849 6.710 66.227 1.00 34.10 ? 130 LEU A HD11 1 ATOM 1511 H HD12 . LEU A 1 101 ? 37.970 7.811 66.467 1.00 34.10 ? 130 LEU A HD12 1 ATOM 1512 H HD13 . LEU A 1 101 ? 36.958 7.958 65.250 1.00 34.10 ? 130 LEU A HD13 1 ATOM 1513 H HD21 . LEU A 1 101 ? 37.025 5.151 64.356 1.00 34.77 ? 130 LEU A HD21 1 ATOM 1514 H HD22 . LEU A 1 101 ? 37.157 6.335 63.305 1.00 34.77 ? 130 LEU A HD22 1 ATOM 1515 H HD23 . LEU A 1 101 ? 38.272 5.206 63.374 1.00 34.77 ? 130 LEU A HD23 1 ATOM 1516 N N . ILE A 1 102 ? 40.451 7.221 67.257 1.00 27.90 ? 131 ILE A N 1 ATOM 1517 C CA . ILE A 1 102 ? 40.785 6.283 68.326 1.00 28.32 ? 131 ILE A CA 1 ATOM 1518 C C . ILE A 1 102 ? 39.520 5.782 69.014 1.00 29.24 ? 131 ILE A C 1 ATOM 1519 O O . ILE A 1 102 ? 38.811 6.554 69.661 1.00 31.55 ? 131 ILE A O 1 ATOM 1520 C CB . ILE A 1 102 ? 41.702 6.922 69.397 1.00 27.28 ? 131 ILE A CB 1 ATOM 1521 C CG1 . ILE A 1 102 ? 42.988 7.456 68.764 1.00 27.44 ? 131 ILE A CG1 1 ATOM 1522 C CG2 . ILE A 1 102 ? 42.030 5.908 70.496 1.00 27.78 ? 131 ILE A CG2 1 ATOM 1523 C CD1 . ILE A 1 102 ? 43.860 8.255 69.726 1.00 27.70 ? 131 ILE A CD1 1 ATOM 1524 H H . ILE A 1 102 ? 39.844 7.789 67.474 1.00 33.49 ? 131 ILE A H 1 ATOM 1525 H HA . ILE A 1 102 ? 41.248 5.519 67.947 1.00 33.99 ? 131 ILE A HA 1 ATOM 1526 H HB . ILE A 1 102 ? 41.228 7.666 69.800 1.00 32.73 ? 131 ILE A HB 1 ATOM 1527 H HG12 . ILE A 1 102 ? 43.512 6.706 68.442 1.00 32.93 ? 131 ILE A HG12 1 ATOM 1528 H HG13 . ILE A 1 102 ? 42.754 8.036 68.023 1.00 32.93 ? 131 ILE A HG13 1 ATOM 1529 H HG21 . ILE A 1 102 ? 42.604 6.330 71.154 1.00 33.34 ? 131 ILE A HG21 1 ATOM 1530 H HG22 . ILE A 1 102 ? 41.204 5.618 70.914 1.00 33.34 ? 131 ILE A HG22 1 ATOM 1531 H HG23 . ILE A 1 102 ? 42.484 5.148 70.099 1.00 33.34 ? 131 ILE A HG23 1 ATOM 1532 H HD11 . ILE A 1 102 ? 44.652 8.558 69.255 1.00 33.24 ? 131 ILE A HD11 1 ATOM 1533 H HD12 . ILE A 1 102 ? 43.355 9.017 70.050 1.00 33.24 ? 131 ILE A HD12 1 ATOM 1534 H HD13 . ILE A 1 102 ? 44.114 7.686 70.469 1.00 33.24 ? 131 ILE A HD13 1 ATOM 1535 N N . MET A 1 103 ? 39.247 4.489 68.869 1.00 26.01 ? 132 MET A N 1 ATOM 1536 C CA . MET A 1 103 ? 38.191 3.833 69.630 1.00 26.98 ? 132 MET A CA 1 ATOM 1537 C C . MET A 1 103 ? 38.814 3.044 70.773 1.00 28.07 ? 132 MET A C 1 ATOM 1538 O O . MET A 1 103 ? 39.959 2.603 70.677 1.00 29.48 ? 132 MET A O 1 ATOM 1539 C CB . MET A 1 103 ? 37.358 2.913 68.737 1.00 26.30 ? 132 MET A CB 1 ATOM 1540 C CG . MET A 1 103 ? 36.407 3.652 67.809 1.00 25.52 ? 132 MET A CG 1 ATOM 1541 S SD . MET A 1 103 ? 35.327 2.544 66.880 1.00 25.84 ? 132 MET A SD 1 ATOM 1542 C CE . MET A 1 103 ? 34.212 1.989 68.166 1.00 26.07 ? 132 MET A CE 1 ATOM 1543 H H . MET A 1 103 ? 39.665 3.965 68.330 1.00 31.21 ? 132 MET A H 1 ATOM 1544 H HA . MET A 1 103 ? 37.600 4.509 69.998 1.00 32.38 ? 132 MET A HA 1 ATOM 1545 H HB2 . MET A 1 103 ? 37.958 2.385 68.188 1.00 31.56 ? 132 MET A HB2 1 ATOM 1546 H HB3 . MET A 1 103 ? 36.828 2.328 69.301 1.00 31.56 ? 132 MET A HB3 1 ATOM 1547 H HG2 . MET A 1 103 ? 35.848 4.243 68.337 1.00 30.62 ? 132 MET A HG2 1 ATOM 1548 H HG3 . MET A 1 103 ? 36.926 4.168 67.172 1.00 30.62 ? 132 MET A HG3 1 ATOM 1549 H HE1 . MET A 1 103 ? 33.568 1.374 67.782 1.00 31.28 ? 132 MET A HE1 1 ATOM 1550 H HE2 . MET A 1 103 ? 34.726 1.542 68.858 1.00 31.28 ? 132 MET A HE2 1 ATOM 1551 H HE3 . MET A 1 103 ? 33.753 2.758 68.540 1.00 31.28 ? 132 MET A HE3 1 ATOM 1552 N N . VAL A 1 104 ? 38.057 2.875 71.852 1.00 31.77 ? 133 VAL A N 1 ATOM 1553 C CA . VAL A 1 104 ? 38.530 2.154 73.028 1.00 31.65 ? 133 VAL A CA 1 ATOM 1554 C C . VAL A 1 104 ? 37.406 1.286 73.571 1.00 32.93 ? 133 VAL A C 1 ATOM 1555 O O . VAL A 1 104 ? 36.504 1.776 74.249 1.00 33.34 ? 133 VAL A O 1 ATOM 1556 C CB . VAL A 1 104 ? 39.019 3.115 74.129 1.00 31.13 ? 133 VAL A CB 1 ATOM 1557 C CG1 . VAL A 1 104 ? 39.523 2.339 75.339 1.00 32.05 ? 133 VAL A CG1 1 ATOM 1558 C CG2 . VAL A 1 104 ? 40.112 4.029 73.595 1.00 31.12 ? 133 VAL A CG2 1 ATOM 1559 H H . VAL A 1 104 ? 37.254 3.174 71.929 1.00 38.12 ? 133 VAL A H 1 ATOM 1560 H HA . VAL A 1 104 ? 39.268 1.577 72.776 1.00 37.98 ? 133 VAL A HA 1 ATOM 1561 H HB . VAL A 1 104 ? 38.277 3.670 74.416 1.00 37.36 ? 133 VAL A HB 1 ATOM 1562 H HG11 . VAL A 1 104 ? 39.824 2.967 76.014 1.00 38.47 ? 133 VAL A HG11 1 ATOM 1563 H HG12 . VAL A 1 104 ? 38.799 1.797 75.690 1.00 38.47 ? 133 VAL A HG12 1 ATOM 1564 H HG13 . VAL A 1 104 ? 40.260 1.770 75.064 1.00 38.47 ? 133 VAL A HG13 1 ATOM 1565 H HG21 . VAL A 1 104 ? 40.402 4.622 74.306 1.00 37.35 ? 133 VAL A HG21 1 ATOM 1566 H HG22 . VAL A 1 104 ? 40.857 3.486 73.293 1.00 37.35 ? 133 VAL A HG22 1 ATOM 1567 H HG23 . VAL A 1 104 ? 39.757 4.546 72.855 1.00 37.35 ? 133 VAL A HG23 1 ATOM 1568 N N . PHE A 1 105 ? 37.468 -0.006 73.267 1.00 35.54 ? 134 PHE A N 1 ATOM 1569 C CA . PHE A 1 105 ? 36.412 -0.938 73.646 1.00 35.76 ? 134 PHE A CA 1 ATOM 1570 C C . PHE A 1 105 ? 36.565 -1.442 75.076 1.00 35.96 ? 134 PHE A C 1 ATOM 1571 O O . PHE A 1 105 ? 37.668 -1.778 75.510 1.00 36.25 ? 134 PHE A O 1 ATOM 1572 C CB . PHE A 1 105 ? 36.393 -2.130 72.688 1.00 35.61 ? 134 PHE A CB 1 ATOM 1573 C CG . PHE A 1 105 ? 35.829 -1.811 71.335 1.00 35.82 ? 134 PHE A CG 1 ATOM 1574 C CD1 . PHE A 1 105 ? 36.614 -1.218 70.361 1.00 36.27 ? 134 PHE A CD1 1 ATOM 1575 C CD2 . PHE A 1 105 ? 34.512 -2.110 71.035 1.00 36.10 ? 134 PHE A CD2 1 ATOM 1576 C CE1 . PHE A 1 105 ? 36.094 -0.928 69.115 1.00 36.48 ? 134 PHE A CE1 1 ATOM 1577 C CE2 . PHE A 1 105 ? 33.987 -1.821 69.792 1.00 36.52 ? 134 PHE A CE2 1 ATOM 1578 C CZ . PHE A 1 105 ? 34.780 -1.230 68.830 1.00 36.40 ? 134 PHE A CZ 1 ATOM 1579 H H . PHE A 1 105 ? 38.117 -0.371 72.837 1.00 42.65 ? 134 PHE A H 1 ATOM 1580 H HA . PHE A 1 105 ? 35.556 -0.487 73.579 1.00 42.91 ? 134 PHE A HA 1 ATOM 1581 H HB2 . PHE A 1 105 ? 37.302 -2.445 72.563 1.00 42.74 ? 134 PHE A HB2 1 ATOM 1582 H HB3 . PHE A 1 105 ? 35.851 -2.834 73.076 1.00 42.74 ? 134 PHE A HB3 1 ATOM 1583 H HD1 . PHE A 1 105 ? 37.502 -1.013 70.548 1.00 43.52 ? 134 PHE A HD1 1 ATOM 1584 H HD2 . PHE A 1 105 ? 33.974 -2.509 71.680 1.00 43.32 ? 134 PHE A HD2 1 ATOM 1585 H HE1 . PHE A 1 105 ? 36.631 -0.529 68.468 1.00 43.78 ? 134 PHE A HE1 1 ATOM 1586 H HE2 . PHE A 1 105 ? 33.100 -2.026 69.602 1.00 43.82 ? 134 PHE A HE2 1 ATOM 1587 H HZ . PHE A 1 105 ? 34.427 -1.035 67.992 1.00 43.69 ? 134 PHE A HZ 1 ATOM 1588 N N . LYS A 1 106 ? 35.451 -1.492 75.803 1.00 36.43 ? 135 LYS A N 1 ATOM 1589 C CA . LYS A 1 106 ? 35.426 -2.131 77.113 1.00 36.56 ? 135 LYS A CA 1 ATOM 1590 C C . LYS A 1 106 ? 35.234 -3.628 76.925 1.00 36.25 ? 135 LYS A C 1 ATOM 1591 O O . LYS A 1 106 ? 35.879 -4.440 77.588 1.00 38.01 ? 135 LYS A O 1 ATOM 1592 C CB . LYS A 1 106 ? 34.313 -1.561 77.991 1.00 37.39 ? 135 LYS A CB 1 ATOM 1593 C CG . LYS A 1 106 ? 34.282 -2.179 79.379 1.00 38.81 ? 135 LYS A CG 1 ATOM 1594 C CD . LYS A 1 106 ? 33.311 -1.467 80.307 1.00 39.57 ? 135 LYS A CD 1 ATOM 1595 C CE . LYS A 1 106 ? 33.240 -2.157 81.662 1.00 40.32 ? 135 LYS A CE 1 ATOM 1596 N NZ . LYS A 1 106 ? 34.587 -2.450 82.231 1.00 40.44 ? 135 LYS A NZ 1 ATOM 1597 H H . LYS A 1 106 ? 34.696 -1.162 75.558 1.00 43.71 ? 135 LYS A H 1 ATOM 1598 H HA . LYS A 1 106 ? 36.274 -1.985 77.560 1.00 43.88 ? 135 LYS A HA 1 ATOM 1599 H HB2 . LYS A 1 106 ? 34.448 -0.606 78.092 1.00 44.87 ? 135 LYS A HB2 1 ATOM 1600 H HB3 . LYS A 1 106 ? 33.457 -1.732 77.568 1.00 44.87 ? 135 LYS A HB3 1 ATOM 1601 H HG2 . LYS A 1 106 ? 34.005 -3.106 79.308 1.00 46.57 ? 135 LYS A HG2 1 ATOM 1602 H HG3 . LYS A 1 106 ? 35.168 -2.125 79.771 1.00 46.57 ? 135 LYS A HG3 1 ATOM 1603 H HD2 . LYS A 1 106 ? 33.610 -0.554 80.445 1.00 47.48 ? 135 LYS A HD2 1 ATOM 1604 H HD3 . LYS A 1 106 ? 32.425 -1.476 79.914 1.00 47.48 ? 135 LYS A HD3 1 ATOM 1605 H HE2 . LYS A 1 106 ? 32.770 -1.581 82.285 1.00 48.38 ? 135 LYS A HE2 1 ATOM 1606 H HE3 . LYS A 1 106 ? 32.766 -2.997 81.564 1.00 48.38 ? 135 LYS A HE3 1 ATOM 1607 H HZ1 . LYS A 1 106 ? 34.502 -2.852 83.021 1.00 48.53 ? 135 LYS A HZ1 1 ATOM 1608 H HZ2 . LYS A 1 106 ? 35.039 -2.984 81.682 1.00 48.53 ? 135 LYS A HZ2 1 ATOM 1609 H HZ3 . LYS A 1 106 ? 35.043 -1.693 82.339 1.00 48.53 ? 135 LYS A HZ3 1 ATOM 1610 N N . SER A 1 107 ? 34.331 -3.981 76.016 1.00 26.95 ? 136 SER A N 1 ATOM 1611 C CA . SER A 1 107 ? 34.134 -5.367 75.617 1.00 27.28 ? 136 SER A CA 1 ATOM 1612 C C . SER A 1 107 ? 35.260 -5.760 74.673 1.00 27.23 ? 136 SER A C 1 ATOM 1613 O O . SER A 1 107 ? 36.098 -4.928 74.332 1.00 26.93 ? 136 SER A O 1 ATOM 1614 C CB . SER A 1 107 ? 32.774 -5.546 74.941 1.00 27.33 ? 136 SER A CB 1 ATOM 1615 O OG . SER A 1 107 ? 32.765 -4.937 73.661 1.00 26.97 ? 136 SER A OG 1 ATOM 1616 H H . SER A 1 107 ? 33.813 -3.427 75.611 1.00 32.34 ? 136 SER A H 1 ATOM 1617 H HA . SER A 1 107 ? 34.170 -5.940 76.399 1.00 32.73 ? 136 SER A HA 1 ATOM 1618 H HB2 . SER A 1 107 ? 32.594 -6.494 74.842 1.00 32.80 ? 136 SER A HB2 1 ATOM 1619 H HB3 . SER A 1 107 ? 32.091 -5.134 75.492 1.00 32.80 ? 136 SER A HB3 1 ATOM 1620 H HG . SER A 1 107 ? 32.014 -5.042 73.299 1.00 32.36 ? 136 SER A HG 1 ATOM 1621 N N . PRO A 1 108 ? 35.301 -7.033 74.260 1.00 41.88 ? 137 PRO A N 1 ATOM 1622 C CA . PRO A 1 108 ? 36.278 -7.385 73.226 1.00 37.97 ? 137 PRO A CA 1 ATOM 1623 C C . PRO A 1 108 ? 35.988 -6.651 71.925 1.00 35.23 ? 137 PRO A C 1 ATOM 1624 O O . PRO A 1 108 ? 34.823 -6.411 71.610 1.00 37.26 ? 137 PRO A O 1 ATOM 1625 C CB . PRO A 1 108 ? 36.093 -8.895 73.065 1.00 32.48 ? 137 PRO A CB 1 ATOM 1626 C CG . PRO A 1 108 ? 35.496 -9.346 74.358 1.00 32.68 ? 137 PRO A CG 1 ATOM 1627 C CD . PRO A 1 108 ? 34.619 -8.218 74.803 1.00 36.23 ? 137 PRO A CD 1 ATOM 1628 H HA . PRO A 1 108 ? 37.181 -7.192 73.522 1.00 45.56 ? 137 PRO A HA 1 ATOM 1629 H HB2 . PRO A 1 108 ? 35.491 -9.075 72.326 1.00 38.97 ? 137 PRO A HB2 1 ATOM 1630 H HB3 . PRO A 1 108 ? 36.955 -9.317 72.917 1.00 38.97 ? 137 PRO A HB3 1 ATOM 1631 H HG2 . PRO A 1 108 ? 34.974 -10.150 74.214 1.00 39.22 ? 137 PRO A HG2 1 ATOM 1632 H HG3 . PRO A 1 108 ? 36.202 -9.506 75.005 1.00 39.22 ? 137 PRO A HG3 1 ATOM 1633 H HD2 . PRO A 1 108 ? 33.733 -8.306 74.419 1.00 43.48 ? 137 PRO A HD2 1 ATOM 1634 H HD3 . PRO A 1 108 ? 34.586 -8.176 75.772 1.00 43.48 ? 137 PRO A HD3 1 ATOM 1635 N N . ARG A 1 109 ? 37.032 -6.292 71.187 1.00 27.28 ? 138 ARG A N 1 ATOM 1636 C CA . ARG A 1 109 ? 36.860 -5.608 69.914 1.00 27.02 ? 138 ARG A CA 1 ATOM 1637 C C . ARG A 1 109 ? 36.093 -6.506 68.950 1.00 27.41 ? 138 ARG A C 1 ATOM 1638 O O . ARG A 1 109 ? 36.127 -7.728 69.081 1.00 27.95 ? 138 ARG A O 1 ATOM 1639 C CB . ARG A 1 109 ? 38.218 -5.216 69.331 1.00 33.24 ? 138 ARG A CB 1 ATOM 1640 C CG . ARG A 1 109 ? 38.897 -4.090 70.090 1.00 35.24 ? 138 ARG A CG 1 ATOM 1641 C CD . ARG A 1 109 ? 40.348 -3.925 69.678 1.00 39.20 ? 138 ARG A CD 1 ATOM 1642 N NE . ARG A 1 109 ? 41.164 -5.060 70.097 1.00 27.58 ? 138 ARG A NE 1 ATOM 1643 C CZ . ARG A 1 109 ? 42.477 -5.148 69.912 1.00 28.03 ? 138 ARG A CZ 1 ATOM 1644 N NH1 . ARG A 1 109 ? 43.136 -4.164 69.314 1.00 27.88 ? 138 ARG A NH1 1 ATOM 1645 N NH2 . ARG A 1 109 ? 43.132 -6.223 70.327 1.00 28.71 ? 138 ARG A NH2 1 ATOM 1646 H H . ARG A 1 109 ? 37.852 -6.434 71.403 1.00 32.74 ? 138 ARG A H 1 ATOM 1647 H HA . ARG A 1 109 ? 36.343 -4.799 70.052 1.00 32.43 ? 138 ARG A HA 1 ATOM 1648 H HB2 . ARG A 1 109 ? 38.804 -5.988 69.355 1.00 39.89 ? 138 ARG A HB2 1 ATOM 1649 H HB3 . ARG A 1 109 ? 38.093 -4.924 68.414 1.00 39.89 ? 138 ARG A HB3 1 ATOM 1650 H HG2 . ARG A 1 109 ? 38.434 -3.257 69.908 1.00 42.29 ? 138 ARG A HG2 1 ATOM 1651 H HG3 . ARG A 1 109 ? 38.873 -4.285 71.040 1.00 42.29 ? 138 ARG A HG3 1 ATOM 1652 H HD2 . ARG A 1 109 ? 40.399 -3.855 68.711 1.00 47.04 ? 138 ARG A HD2 1 ATOM 1653 H HD3 . ARG A 1 109 ? 40.708 -3.124 70.090 1.00 47.04 ? 138 ARG A HD3 1 ATOM 1654 H HE . ARG A 1 109 ? 40.769 -5.715 70.489 1.00 33.09 ? 138 ARG A HE 1 ATOM 1655 H HH11 . ARG A 1 109 ? 42.714 -3.466 69.043 1.00 33.45 ? 138 ARG A HH11 1 ATOM 1656 H HH12 . ARG A 1 109 ? 43.986 -4.225 69.196 1.00 33.45 ? 138 ARG A HH12 1 ATOM 1657 H HH21 . ARG A 1 109 ? 42.708 -6.862 70.716 1.00 34.45 ? 138 ARG A HH21 1 ATOM 1658 H HH22 . ARG A 1 109 ? 43.982 -6.281 70.209 1.00 34.45 ? 138 ARG A HH22 1 ATOM 1659 N N . PRO A 1 110 ? 35.388 -5.904 67.981 1.00 31.53 ? 139 PRO A N 1 ATOM 1660 C CA . PRO A 1 110 ? 34.577 -6.707 67.061 1.00 32.02 ? 139 PRO A CA 1 ATOM 1661 C C . PRO A 1 110 ? 35.420 -7.608 66.167 1.00 32.63 ? 139 PRO A C 1 ATOM 1662 O O . PRO A 1 110 ? 36.529 -7.238 65.784 1.00 32.59 ? 139 PRO A O 1 ATOM 1663 C CB . PRO A 1 110 ? 33.842 -5.651 66.231 1.00 31.69 ? 139 PRO A CB 1 ATOM 1664 C CG . PRO A 1 110 ? 34.714 -4.457 66.289 1.00 31.11 ? 139 PRO A CG 1 ATOM 1665 C CD . PRO A 1 110 ? 35.338 -4.470 67.648 1.00 30.94 ? 139 PRO A CD 1 ATOM 1666 H HA . PRO A 1 110 ? 33.934 -7.242 67.551 1.00 38.42 ? 139 PRO A HA 1 ATOM 1667 H HB2 . PRO A 1 110 ? 33.744 -5.962 65.317 1.00 38.03 ? 139 PRO A HB2 1 ATOM 1668 H HB3 . PRO A 1 110 ? 32.977 -5.466 66.627 1.00 38.03 ? 139 PRO A HB3 1 ATOM 1669 H HG2 . PRO A 1 110 ? 35.395 -4.518 65.601 1.00 37.33 ? 139 PRO A HG2 1 ATOM 1670 H HG3 . PRO A 1 110 ? 34.178 -3.658 66.168 1.00 37.33 ? 139 PRO A HG3 1 ATOM 1671 H HD2 . PRO A 1 110 ? 36.234 -4.099 67.613 1.00 37.13 ? 139 PRO A HD2 1 ATOM 1672 H HD3 . PRO A 1 110 ? 34.780 -3.994 68.282 1.00 37.13 ? 139 PRO A HD3 1 ATOM 1673 N N . ALA A 1 111 ? 34.890 -8.782 65.843 1.00 32.71 ? 140 ALA A N 1 ATOM 1674 C CA . ALA A 1 111 ? 35.560 -9.691 64.926 1.00 33.46 ? 140 ALA A CA 1 ATOM 1675 C C . ALA A 1 111 ? 35.614 -9.082 63.528 1.00 33.56 ? 140 ALA A C 1 ATOM 1676 O O . ALA A 1 111 ? 36.414 -9.499 62.689 1.00 34.15 ? 140 ALA A O 1 ATOM 1677 C CB . ALA A 1 111 ? 34.850 -11.031 64.897 1.00 34.20 ? 140 ALA A CB 1 ATOM 1678 H H . ALA A 1 111 ? 34.139 -9.075 66.143 1.00 39.25 ? 140 ALA A H 1 ATOM 1679 H HA . ALA A 1 111 ? 36.470 -9.837 65.229 1.00 40.15 ? 140 ALA A HA 1 ATOM 1680 H HB1 . ALA A 1 111 ? 35.313 -11.620 64.281 1.00 41.04 ? 140 ALA A HB1 1 ATOM 1681 H HB2 . ALA A 1 111 ? 34.860 -11.412 65.790 1.00 41.04 ? 140 ALA A HB2 1 ATOM 1682 H HB3 . ALA A 1 111 ? 33.936 -10.897 64.604 1.00 41.04 ? 140 ALA A HB3 1 ATOM 1683 N N . ALA A 1 112 ? 34.760 -8.092 63.286 1.00 33.38 ? 141 ALA A N 1 ATOM 1684 C CA . ALA A 1 112 ? 34.731 -7.400 62.004 1.00 34.85 ? 141 ALA A CA 1 ATOM 1685 C C . ALA A 1 112 ? 34.035 -6.048 62.123 1.00 35.17 ? 141 ALA A C 1 ATOM 1686 O O . ALA A 1 112 ? 33.012 -5.920 62.795 1.00 35.23 ? 141 ALA A O 1 ATOM 1687 C CB . ALA A 1 112 ? 34.039 -8.256 60.959 1.00 35.87 ? 141 ALA A CB 1 ATOM 1688 H H . ALA A 1 112 ? 34.183 -7.801 63.853 1.00 40.05 ? 141 ALA A H 1 ATOM 1689 H HA . ALA A 1 112 ? 35.642 -7.244 61.708 1.00 41.82 ? 141 ALA A HA 1 ATOM 1690 H HB1 . ALA A 1 112 ? 34.031 -7.778 60.115 1.00 43.05 ? 141 ALA A HB1 1 ATOM 1691 H HB2 . ALA A 1 112 ? 34.525 -9.090 60.862 1.00 43.05 ? 141 ALA A HB2 1 ATOM 1692 H HB3 . ALA A 1 112 ? 33.130 -8.434 61.248 1.00 43.05 ? 141 ALA A HB3 1 ATOM 1693 N N . MET A 1 113 ? 34.594 -5.043 61.457 1.00 35.58 ? 142 MET A N 1 ATOM 1694 C CA . MET A 1 113 ? 34.023 -3.702 61.455 1.00 34.88 ? 142 MET A CA 1 ATOM 1695 C C . MET A 1 113 ? 34.667 -2.873 60.350 1.00 34.15 ? 142 MET A C 1 ATOM 1696 O O . MET A 1 113 ? 35.782 -3.170 59.920 1.00 34.56 ? 142 MET A O 1 ATOM 1697 C CB . MET A 1 113 ? 34.221 -3.022 62.812 1.00 34.75 ? 142 MET A CB 1 ATOM 1698 C CG . MET A 1 113 ? 35.676 -2.901 63.236 1.00 35.07 ? 142 MET A CG 1 ATOM 1699 S SD . MET A 1 113 ? 35.914 -1.912 64.725 1.00 38.44 ? 142 MET A SD 1 ATOM 1700 C CE . MET A 1 113 ? 35.737 -0.263 64.057 1.00 34.07 ? 142 MET A CE 1 ATOM 1701 H H . MET A 1 113 ? 35.315 -5.114 60.994 1.00 42.70 ? 142 MET A H 1 ATOM 1702 H HA . MET A 1 113 ? 33.069 -3.765 61.288 1.00 41.86 ? 142 MET A HA 1 ATOM 1703 H HB2 . MET A 1 113 ? 33.850 -2.126 62.770 1.00 41.70 ? 142 MET A HB2 1 ATOM 1704 H HB3 . MET A 1 113 ? 33.757 -3.537 63.491 1.00 41.70 ? 142 MET A HB3 1 ATOM 1705 H HG2 . MET A 1 113 ? 36.026 -3.789 63.410 1.00 42.09 ? 142 MET A HG2 1 ATOM 1706 H HG3 . MET A 1 113 ? 36.178 -2.483 62.519 1.00 42.09 ? 142 MET A HG3 1 ATOM 1707 H HE1 . MET A 1 113 ? 35.846 0.381 64.774 1.00 40.88 ? 142 MET A HE1 1 ATOM 1708 H HE2 . MET A 1 113 ? 36.417 -0.123 63.380 1.00 40.88 ? 142 MET A HE2 1 ATOM 1709 H HE3 . MET A 1 113 ? 34.855 -0.175 63.664 1.00 40.88 ? 142 MET A HE3 1 ATOM 1710 N N . VAL A 1 114 ? 33.967 -1.837 59.896 1.00 31.09 ? 143 VAL A N 1 ATOM 1711 C CA . VAL A 1 114 ? 34.488 -0.966 58.847 1.00 30.81 ? 143 VAL A CA 1 ATOM 1712 C C . VAL A 1 114 ? 34.265 0.502 59.188 1.00 30.00 ? 143 VAL A C 1 ATOM 1713 O O . VAL A 1 114 ? 33.308 0.858 59.879 1.00 29.51 ? 143 VAL A O 1 ATOM 1714 C CB . VAL A 1 114 ? 33.842 -1.271 57.476 1.00 31.80 ? 143 VAL A CB 1 ATOM 1715 C CG1 . VAL A 1 114 ? 33.863 -2.770 57.204 1.00 33.09 ? 143 VAL A CG1 1 ATOM 1716 C CG2 . VAL A 1 114 ? 32.414 -0.749 57.405 1.00 31.87 ? 143 VAL A CG2 1 ATOM 1717 H H . VAL A 1 114 ? 33.185 -1.617 60.179 1.00 37.31 ? 143 VAL A H 1 ATOM 1718 H HA . VAL A 1 114 ? 35.443 -1.111 58.765 1.00 36.98 ? 143 VAL A HA 1 ATOM 1719 H HB . VAL A 1 114 ? 34.356 -0.833 56.779 1.00 38.16 ? 143 VAL A HB 1 ATOM 1720 H HG11 . VAL A 1 114 ? 33.454 -2.939 56.341 1.00 39.71 ? 143 VAL A HG11 1 ATOM 1721 H HG12 . VAL A 1 114 ? 34.783 -3.077 57.201 1.00 39.71 ? 143 VAL A HG12 1 ATOM 1722 H HG13 . VAL A 1 114 ? 33.364 -3.223 57.902 1.00 39.71 ? 143 VAL A HG13 1 ATOM 1723 H HG21 . VAL A 1 114 ? 32.044 -0.958 56.534 1.00 38.24 ? 143 VAL A HG21 1 ATOM 1724 H HG22 . VAL A 1 114 ? 31.888 -1.175 58.100 1.00 38.24 ? 143 VAL A HG22 1 ATOM 1725 H HG23 . VAL A 1 114 ? 32.423 0.212 57.539 1.00 38.24 ? 143 VAL A HG23 1 ATOM 1726 N N . LEU A 1 115 ? 35.161 1.341 58.683 1.00 29.99 ? 144 LEU A N 1 ATOM 1727 C CA . LEU A 1 115 ? 35.118 2.779 58.910 1.00 30.13 ? 144 LEU A CA 1 ATOM 1728 C C . LEU A 1 115 ? 35.020 3.500 57.573 1.00 32.79 ? 144 LEU A C 1 ATOM 1729 O O . LEU A 1 115 ? 35.708 3.138 56.618 1.00 33.78 ? 144 LEU A O 1 ATOM 1730 C CB . LEU A 1 115 ? 36.364 3.228 59.677 1.00 28.77 ? 144 LEU A CB 1 ATOM 1731 C CG . LEU A 1 115 ? 36.590 4.727 59.872 1.00 27.55 ? 144 LEU A CG 1 ATOM 1732 C CD1 . LEU A 1 115 ? 35.547 5.323 60.802 1.00 27.33 ? 144 LEU A CD1 1 ATOM 1733 C CD2 . LEU A 1 115 ? 37.989 4.970 60.407 1.00 27.22 ? 144 LEU A CD2 1 ATOM 1734 H H . LEU A 1 115 ? 35.823 1.093 58.192 1.00 35.99 ? 144 LEU A H 1 ATOM 1735 H HA . LEU A 1 115 ? 34.335 3.000 59.438 1.00 36.16 ? 144 LEU A HA 1 ATOM 1736 H HB2 . LEU A 1 115 ? 36.328 2.832 60.561 1.00 34.53 ? 144 LEU A HB2 1 ATOM 1737 H HB3 . LEU A 1 115 ? 37.141 2.885 59.208 1.00 34.53 ? 144 LEU A HB3 1 ATOM 1738 H HG . LEU A 1 115 ? 36.515 5.173 59.013 1.00 33.06 ? 144 LEU A HG 1 ATOM 1739 H HD11 . LEU A 1 115 ? 35.720 6.272 60.903 1.00 32.80 ? 144 LEU A HD11 1 ATOM 1740 H HD12 . LEU A 1 115 ? 34.667 5.185 60.418 1.00 32.80 ? 144 LEU A HD12 1 ATOM 1741 H HD13 . LEU A 1 115 ? 35.605 4.882 61.664 1.00 32.80 ? 144 LEU A HD13 1 ATOM 1742 H HD21 . LEU A 1 115 ? 38.119 5.924 60.527 1.00 32.67 ? 144 LEU A HD21 1 ATOM 1743 H HD22 . LEU A 1 115 ? 38.084 4.514 61.258 1.00 32.67 ? 144 LEU A HD22 1 ATOM 1744 H HD23 . LEU A 1 115 ? 38.634 4.624 59.771 1.00 32.67 ? 144 LEU A HD23 1 ATOM 1745 N N . ASP A 1 116 ? 34.168 4.518 57.503 1.00 33.94 ? 145 ASP A N 1 ATOM 1746 C CA . ASP A 1 116 ? 34.019 5.296 56.277 1.00 36.32 ? 145 ASP A CA 1 ATOM 1747 C C . ASP A 1 116 ? 33.539 6.717 56.568 1.00 35.77 ? 145 ASP A C 1 ATOM 1748 O O . ASP A 1 116 ? 33.213 7.058 57.707 1.00 35.63 ? 145 ASP A O 1 ATOM 1749 C CB . ASP A 1 116 ? 33.061 4.596 55.305 1.00 38.50 ? 145 ASP A CB 1 ATOM 1750 C CG . ASP A 1 116 ? 31.754 4.190 55.953 1.00 39.51 ? 145 ASP A CG 1 ATOM 1751 O OD1 . ASP A 1 116 ? 31.333 4.852 56.921 1.00 39.54 ? 145 ASP A OD1 1 ATOM 1752 O OD2 . ASP A 1 116 ? 31.142 3.206 55.487 1.00 40.29 ? 145 ASP A OD2 1 ATOM 1753 H H . ASP A 1 116 ? 33.665 4.778 58.150 1.00 40.73 ? 145 ASP A H 1 ATOM 1754 H HA . ASP A 1 116 ? 34.885 5.361 55.843 1.00 43.59 ? 145 ASP A HA 1 ATOM 1755 H HB2 . ASP A 1 116 ? 32.857 5.200 54.573 1.00 46.19 ? 145 ASP A HB2 1 ATOM 1756 H HB3 . ASP A 1 116 ? 33.487 3.794 54.964 1.00 46.19 ? 145 ASP A HB3 1 ATOM 1757 N N . ARG A 1 117 ? 33.503 7.534 55.519 1.00 35.13 ? 146 ARG A N 1 ATOM 1758 C CA . ARG A 1 117 ? 33.210 8.956 55.636 1.00 33.54 ? 146 ARG A CA 1 ATOM 1759 C C . ARG A 1 117 ? 32.163 9.380 54.621 1.00 34.06 ? 146 ARG A C 1 ATOM 1760 O O . ARG A 1 117 ? 32.012 8.747 53.577 1.00 33.53 ? 146 ARG A O 1 ATOM 1761 C CB . ARG A 1 117 ? 34.481 9.775 55.418 1.00 32.93 ? 146 ARG A CB 1 ATOM 1762 C CG . ARG A 1 117 ? 34.987 9.714 53.977 1.00 34.07 ? 146 ARG A CG 1 ATOM 1763 C CD . ARG A 1 117 ? 36.324 10.404 53.812 1.00 34.31 ? 146 ARG A CD 1 ATOM 1764 N NE . ARG A 1 117 ? 36.939 10.132 52.515 1.00 34.83 ? 146 ARG A NE 1 ATOM 1765 C CZ . ARG A 1 117 ? 37.511 8.980 52.181 1.00 35.13 ? 146 ARG A CZ 1 ATOM 1766 N NH1 . ARG A 1 117 ? 37.540 7.970 53.041 1.00 35.11 ? 146 ARG A NH1 1 ATOM 1767 N NH2 . ARG A 1 117 ? 38.046 8.831 50.978 1.00 35.77 ? 146 ARG A NH2 1 ATOM 1768 H H . ARG A 1 117 ? 33.649 7.280 54.711 1.00 42.16 ? 146 ARG A H 1 ATOM 1769 H HA . ARG A 1 117 ? 32.871 9.144 56.525 1.00 40.25 ? 146 ARG A HA 1 ATOM 1770 H HB2 . ARG A 1 117 ? 34.299 10.703 55.632 1.00 39.51 ? 146 ARG A HB2 1 ATOM 1771 H HB3 . ARG A 1 117 ? 35.181 9.432 55.996 1.00 39.51 ? 146 ARG A HB3 1 ATOM 1772 H HG2 . ARG A 1 117 ? 35.092 8.786 53.715 1.00 40.88 ? 146 ARG A HG2 1 ATOM 1773 H HG3 . ARG A 1 117 ? 34.347 10.154 53.396 1.00 40.88 ? 146 ARG A HG3 1 ATOM 1774 H HD2 . ARG A 1 117 ? 36.197 11.363 53.889 1.00 41.17 ? 146 ARG A HD2 1 ATOM 1775 H HD3 . ARG A 1 117 ? 36.929 10.092 54.503 1.00 41.17 ? 146 ARG A HD3 1 ATOM 1776 H HE . ARG A 1 117 ? 36.930 10.761 51.928 1.00 41.79 ? 146 ARG A HE 1 ATOM 1777 H HH11 . ARG A 1 117 ? 37.194 8.061 53.823 1.00 42.13 ? 146 ARG A HH11 1 ATOM 1778 H HH12 . ARG A 1 117 ? 37.909 7.226 52.818 1.00 42.13 ? 146 ARG A HH12 1 ATOM 1779 H HH21 . ARG A 1 117 ? 38.027 9.482 50.416 1.00 42.93 ? 146 ARG A HH21 1 ATOM 1780 H HH22 . ARG A 1 117 ? 38.413 8.085 50.760 1.00 42.93 ? 146 ARG A HH22 1 ATOM 1781 N N . SER A 1 118 ? 31.453 10.460 54.929 1.00 47.40 ? 147 SER A N 1 ATOM 1782 C CA . SER A 1 118 ? 30.597 11.127 53.955 1.00 46.56 ? 147 SER A CA 1 ATOM 1783 C C . SER A 1 118 ? 31.071 12.563 53.788 1.00 45.66 ? 147 SER A C 1 ATOM 1784 O O . SER A 1 118 ? 31.186 13.310 54.760 1.00 45.11 ? 147 SER A O 1 ATOM 1785 C CB . SER A 1 118 ? 29.131 11.089 54.383 1.00 45.38 ? 147 SER A CB 1 ATOM 1786 O OG . SER A 1 118 ? 28.334 11.895 53.534 1.00 44.59 ? 147 SER A OG 1 ATOM 1787 H H . SER A 1 118 ? 31.450 10.831 55.705 1.00 56.88 ? 147 SER A H 1 ATOM 1788 H HA . SER A 1 118 ? 30.676 10.678 53.098 1.00 55.87 ? 147 SER A HA 1 ATOM 1789 H HB2 . SER A 1 118 ? 28.813 10.174 54.339 1.00 54.45 ? 147 SER A HB2 1 ATOM 1790 H HB3 . SER A 1 118 ? 29.059 11.421 55.292 1.00 54.45 ? 147 SER A HB3 1 ATOM 1791 H HG . SER A 1 118 ? 28.386 11.619 52.743 1.00 53.50 ? 147 SER A HG 1 ATOM 1792 N N . GLN A 1 119 ? 31.354 12.933 52.545 1.00 47.81 ? 148 GLN A N 1 ATOM 1793 C CA . GLN A 1 119 ? 31.899 14.245 52.231 1.00 48.86 ? 148 GLN A CA 1 ATOM 1794 C C . GLN A 1 119 ? 30.795 15.228 51.844 1.00 48.84 ? 148 GLN A C 1 ATOM 1795 O O . GLN A 1 119 ? 31.068 16.391 51.548 1.00 47.30 ? 148 GLN A O 1 ATOM 1796 C CB . GLN A 1 119 ? 32.919 14.121 51.098 1.00 49.50 ? 148 GLN A CB 1 ATOM 1797 C CG . GLN A 1 119 ? 34.041 15.136 51.152 1.00 49.29 ? 148 GLN A CG 1 ATOM 1798 C CD . GLN A 1 119 ? 35.200 14.760 50.250 1.00 50.70 ? 148 GLN A CD 1 ATOM 1799 O OE1 . GLN A 1 119 ? 36.363 14.939 50.612 1.00 50.16 ? 148 GLN A OE1 1 ATOM 1800 N NE2 . GLN A 1 119 ? 34.890 14.234 49.069 1.00 52.51 ? 148 GLN A NE2 1 ATOM 1801 H H . GLN A 1 119 ? 31.236 12.433 51.856 1.00 57.37 ? 148 GLN A H 1 ATOM 1802 H HA . GLN A 1 119 ? 32.356 14.595 53.012 1.00 58.63 ? 148 GLN A HA 1 ATOM 1803 H HB2 . GLN A 1 119 ? 33.319 13.238 51.137 1.00 59.40 ? 148 GLN A HB2 1 ATOM 1804 H HB3 . GLN A 1 119 ? 32.459 14.234 50.252 1.00 59.40 ? 148 GLN A HB3 1 ATOM 1805 H HG2 . GLN A 1 119 ? 33.703 15.998 50.863 1.00 59.15 ? 148 GLN A HG2 1 ATOM 1806 H HG3 . GLN A 1 119 ? 34.373 15.195 52.061 1.00 59.15 ? 148 GLN A HG3 1 ATOM 1807 H HE21 . GLN A 1 119 ? 34.066 14.123 48.851 1.00 63.01 ? 148 GLN A HE21 1 ATOM 1808 H HE22 . GLN A 1 119 ? 35.514 14.005 48.523 1.00 63.01 ? 148 GLN A HE22 1 ATOM 1809 N N . ASP A 1 120 ? 29.551 14.753 51.857 1.00 41.16 ? 149 ASP A N 1 ATOM 1810 C CA . ASP A 1 120 ? 28.417 15.544 51.394 1.00 40.75 ? 149 ASP A CA 1 ATOM 1811 C C . ASP A 1 120 ? 27.202 15.384 52.306 1.00 42.99 ? 149 ASP A C 1 ATOM 1812 O O . ASP A 1 120 ? 26.077 15.207 51.837 1.00 45.50 ? 149 ASP A O 1 ATOM 1813 C CB . ASP A 1 120 ? 28.057 15.150 49.959 1.00 39.68 ? 149 ASP A CB 1 ATOM 1814 C CG . ASP A 1 120 ? 27.778 13.668 49.815 1.00 39.46 ? 149 ASP A CG 1 ATOM 1815 O OD1 . ASP A 1 120 ? 28.124 12.905 50.739 1.00 39.21 ? 149 ASP A OD1 1 ATOM 1816 O OD2 . ASP A 1 120 ? 27.224 13.263 48.771 1.00 40.19 ? 149 ASP A OD2 1 ATOM 1817 H H . ASP A 1 120 ? 29.337 13.967 52.134 1.00 49.39 ? 149 ASP A H 1 ATOM 1818 H HA . ASP A 1 120 ? 28.667 16.481 51.392 1.00 48.90 ? 149 ASP A HA 1 ATOM 1819 H HB2 . ASP A 1 120 ? 27.260 15.633 49.689 1.00 47.61 ? 149 ASP A HB2 1 ATOM 1820 H HB3 . ASP A 1 120 ? 28.797 15.375 49.374 1.00 47.61 ? 149 ASP A HB3 1 ATOM 1821 N N . PHE A 1 121 ? 27.444 15.439 53.612 1.00 31.77 ? 150 PHE A N 1 ATOM 1822 C CA . PHE A 1 121 ? 26.375 15.493 54.606 1.00 32.54 ? 150 PHE A CA 1 ATOM 1823 C C . PHE A 1 121 ? 25.444 14.279 54.552 1.00 33.35 ? 150 PHE A C 1 ATOM 1824 O O . PHE A 1 121 ? 24.252 14.389 54.838 1.00 33.45 ? 150 PHE A O 1 ATOM 1825 C CB . PHE A 1 121 ? 25.575 16.785 54.434 1.00 34.26 ? 150 PHE A CB 1 ATOM 1826 C CG . PHE A 1 121 ? 26.418 18.026 54.526 1.00 35.06 ? 150 PHE A CG 1 ATOM 1827 C CD1 . PHE A 1 121 ? 26.686 18.608 55.755 1.00 35.00 ? 150 PHE A CD1 1 ATOM 1828 C CD2 . PHE A 1 121 ? 26.957 18.601 53.386 1.00 34.89 ? 150 PHE A CD2 1 ATOM 1829 C CE1 . PHE A 1 121 ? 27.468 19.744 55.844 1.00 34.10 ? 150 PHE A CE1 1 ATOM 1830 C CE2 . PHE A 1 121 ? 27.739 19.737 53.469 1.00 33.77 ? 150 PHE A CE2 1 ATOM 1831 C CZ . PHE A 1 121 ? 27.996 20.309 54.699 1.00 33.49 ? 150 PHE A CZ 1 ATOM 1832 H H . PHE A 1 121 ? 28.233 15.447 53.953 1.00 38.12 ? 150 PHE A H 1 ATOM 1833 H HA . PHE A 1 121 ? 26.777 15.513 55.489 1.00 39.05 ? 150 PHE A HA 1 ATOM 1834 H HB2 . PHE A 1 121 ? 25.150 16.777 53.562 1.00 41.11 ? 150 PHE A HB2 1 ATOM 1835 H HB3 . PHE A 1 121 ? 24.900 16.831 55.129 1.00 41.11 ? 150 PHE A HB3 1 ATOM 1836 H HD1 . PHE A 1 121 ? 26.334 18.231 56.529 1.00 42.00 ? 150 PHE A HD1 1 ATOM 1837 H HD2 . PHE A 1 121 ? 26.788 18.219 52.555 1.00 41.87 ? 150 PHE A HD2 1 ATOM 1838 H HE1 . PHE A 1 121 ? 27.639 20.128 56.673 1.00 40.92 ? 150 PHE A HE1 1 ATOM 1839 H HE2 . PHE A 1 121 ? 28.093 20.116 52.697 1.00 40.53 ? 150 PHE A HE2 1 ATOM 1840 H HZ . PHE A 1 121 ? 28.521 21.074 54.756 1.00 40.19 ? 150 PHE A HZ 1 ATOM 1841 N N . GLY A 1 122 ? 25.995 13.125 54.180 1.00 46.70 ? 151 GLY A N 1 ATOM 1842 C CA . GLY A 1 122 ? 25.282 11.861 54.279 1.00 48.20 ? 151 GLY A CA 1 ATOM 1843 C C . GLY A 1 122 ? 24.653 11.352 52.995 1.00 49.53 ? 151 GLY A C 1 ATOM 1844 O O . GLY A 1 122 ? 23.997 10.309 52.997 1.00 50.70 ? 151 GLY A O 1 ATOM 1845 H H . GLY A 1 122 ? 26.791 13.051 53.863 1.00 56.04 ? 151 GLY A H 1 ATOM 1846 H HA2 . GLY A 1 122 ? 25.897 11.182 54.597 1.00 57.84 ? 151 GLY A HA2 1 ATOM 1847 H HA3 . GLY A 1 122 ? 24.575 11.954 54.937 1.00 57.84 ? 151 GLY A HA3 1 ATOM 1848 N N . LYS A 1 123 ? 24.843 12.075 51.897 1.00 43.70 ? 152 LYS A N 1 ATOM 1849 C CA . LYS A 1 123 ? 24.291 11.654 50.613 1.00 44.15 ? 152 LYS A CA 1 ATOM 1850 C C . LYS A 1 123 ? 25.026 10.426 50.082 1.00 43.95 ? 152 LYS A C 1 ATOM 1851 O O . LYS A 1 123 ? 24.413 9.529 49.503 1.00 44.64 ? 152 LYS A O 1 ATOM 1852 C CB . LYS A 1 123 ? 24.365 12.793 49.595 1.00 43.95 ? 152 LYS A CB 1 ATOM 1853 H H . LYS A 1 123 ? 25.286 12.811 51.867 1.00 52.44 ? 152 LYS A H 1 ATOM 1854 H HA . LYS A 1 123 ? 23.357 11.418 50.732 1.00 52.97 ? 152 LYS A HA 1 ATOM 1855 N N . THR A 1 124 ? 26.339 10.391 50.290 1.00 54.42 ? 153 THR A N 1 ATOM 1856 C CA . THR A 1 124 ? 27.171 9.282 49.834 1.00 55.90 ? 153 THR A CA 1 ATOM 1857 C C . THR A 1 124 ? 28.247 8.950 50.862 1.00 56.00 ? 153 THR A C 1 ATOM 1858 O O . THR A 1 124 ? 28.614 9.791 51.682 1.00 55.73 ? 153 THR A O 1 ATOM 1859 C CB . THR A 1 124 ? 27.854 9.601 48.490 1.00 56.83 ? 153 THR A CB 1 ATOM 1860 O OG1 . THR A 1 124 ? 28.739 10.716 48.652 1.00 56.51 ? 153 THR A OG1 1 ATOM 1861 C CG2 . THR A 1 124 ? 26.822 9.926 47.422 1.00 57.48 ? 153 THR A CG2 1 ATOM 1862 H H . THR A 1 124 ? 26.778 11.007 50.700 1.00 65.30 ? 153 THR A H 1 ATOM 1863 H HA . THR A 1 124 ? 26.616 8.496 49.712 1.00 67.08 ? 153 THR A HA 1 ATOM 1864 H HB . THR A 1 124 ? 28.362 8.828 48.197 1.00 68.19 ? 153 THR A HB 1 ATOM 1865 H HG1 . THR A 1 124 ? 28.308 11.390 48.908 1.00 67.82 ? 153 THR A HG1 1 ATOM 1866 H HG21 . THR A 1 124 ? 27.264 10.124 46.583 1.00 68.97 ? 153 THR A HG21 1 ATOM 1867 H HG22 . THR A 1 124 ? 26.228 9.170 47.295 1.00 68.97 ? 153 THR A HG22 1 ATOM 1868 H HG23 . THR A 1 124 ? 26.297 10.696 47.692 1.00 68.97 ? 153 THR A HG23 1 ATOM 1869 N N . TRP A 1 125 ? 28.747 7.720 50.807 1.00 37.39 ? 154 TRP A N 1 ATOM 1870 C CA . TRP A 1 125 ? 29.785 7.262 51.724 1.00 35.72 ? 154 TRP A CA 1 ATOM 1871 C C . TRP A 1 125 ? 30.906 6.576 50.955 1.00 34.95 ? 154 TRP A C 1 ATOM 1872 O O . TRP A 1 125 ? 30.675 6.013 49.886 1.00 35.66 ? 154 TRP A O 1 ATOM 1873 C CB . TRP A 1 125 ? 29.201 6.304 52.762 1.00 36.53 ? 154 TRP A CB 1 ATOM 1874 C CG . TRP A 1 125 ? 28.106 6.903 53.585 1.00 36.69 ? 154 TRP A CG 1 ATOM 1875 C CD1 . TRP A 1 125 ? 26.789 7.009 53.245 1.00 37.03 ? 154 TRP A CD1 1 ATOM 1876 C CD2 . TRP A 1 125 ? 28.231 7.474 54.892 1.00 36.63 ? 154 TRP A CD2 1 ATOM 1877 N NE1 . TRP A 1 125 ? 26.086 7.613 54.259 1.00 36.70 ? 154 TRP A NE1 1 ATOM 1878 C CE2 . TRP A 1 125 ? 26.948 7.909 55.281 1.00 36.54 ? 154 TRP A CE2 1 ATOM 1879 C CE3 . TRP A 1 125 ? 29.302 7.660 55.771 1.00 36.92 ? 154 TRP A CE3 1 ATOM 1880 C CZ2 . TRP A 1 125 ? 26.708 8.519 56.510 1.00 36.44 ? 154 TRP A CZ2 1 ATOM 1881 C CZ3 . TRP A 1 125 ? 29.061 8.266 56.991 1.00 36.43 ? 154 TRP A CZ3 1 ATOM 1882 C CH2 . TRP A 1 125 ? 27.775 8.688 57.349 1.00 36.19 ? 154 TRP A CH2 1 ATOM 1883 H H . TRP A 1 125 ? 28.498 7.124 50.239 1.00 44.86 ? 154 TRP A H 1 ATOM 1884 H HA . TRP A 1 125 ? 30.159 8.025 52.191 1.00 42.86 ? 154 TRP A HA 1 ATOM 1885 H HB2 . TRP A 1 125 ? 28.838 5.529 52.304 1.00 43.84 ? 154 TRP A HB2 1 ATOM 1886 H HB3 . TRP A 1 125 ? 29.908 6.027 53.365 1.00 43.84 ? 154 TRP A HB3 1 ATOM 1887 H HD1 . TRP A 1 125 ? 26.421 6.716 52.443 1.00 44.44 ? 154 TRP A HD1 1 ATOM 1888 H HE1 . TRP A 1 125 ? 25.242 7.780 54.252 1.00 44.04 ? 154 TRP A HE1 1 ATOM 1889 H HE3 . TRP A 1 125 ? 30.159 7.383 55.540 1.00 44.30 ? 154 TRP A HE3 1 ATOM 1890 H HZ2 . TRP A 1 125 ? 25.855 8.800 56.752 1.00 43.72 ? 154 TRP A HZ2 1 ATOM 1891 H HZ3 . TRP A 1 125 ? 29.766 8.396 57.583 1.00 43.71 ? 154 TRP A HZ3 1 ATOM 1892 H HH2 . TRP A 1 125 ? 27.644 9.093 58.176 1.00 43.42 ? 154 TRP A HH2 1 ATOM 1893 N N . LYS A 1 126 ? 32.116 6.623 51.505 1.00 50.14 ? 155 LYS A N 1 ATOM 1894 C CA . LYS A 1 126 ? 33.266 5.981 50.875 1.00 49.08 ? 155 LYS A CA 1 ATOM 1895 C C . LYS A 1 126 ? 34.240 5.439 51.932 1.00 46.55 ? 155 LYS A C 1 ATOM 1896 O O . LYS A 1 126 ? 34.534 6.127 52.910 1.00 45.27 ? 155 LYS A O 1 ATOM 1897 C CB . LYS A 1 126 ? 33.976 6.961 49.935 1.00 49.43 ? 155 LYS A CB 1 ATOM 1898 C CG . LYS A 1 126 ? 34.307 8.319 50.541 1.00 48.25 ? 155 LYS A CG 1 ATOM 1899 C CD . LYS A 1 126 ? 34.346 9.409 49.474 1.00 48.18 ? 155 LYS A CD 1 ATOM 1900 C CE . LYS A 1 126 ? 35.312 9.075 48.343 1.00 49.36 ? 155 LYS A CE 1 ATOM 1901 N NZ . LYS A 1 126 ? 35.323 10.128 47.287 1.00 50.08 ? 155 LYS A NZ 1 ATOM 1902 H H . LYS A 1 126 ? 32.298 7.021 52.245 1.00 60.17 ? 155 LYS A H 1 ATOM 1903 H HA . LYS A 1 126 ? 32.956 5.231 50.344 1.00 58.89 ? 155 LYS A HA 1 ATOM 1904 H HB2 . LYS A 1 126 ? 34.810 6.560 49.645 1.00 59.31 ? 155 LYS A HB2 1 ATOM 1905 H HB3 . LYS A 1 126 ? 33.405 7.116 49.166 1.00 59.31 ? 155 LYS A HB3 1 ATOM 1906 H HG2 . LYS A 1 126 ? 33.628 8.555 51.192 1.00 57.91 ? 155 LYS A HG2 1 ATOM 1907 H HG3 . LYS A 1 126 ? 35.179 8.277 50.964 1.00 57.91 ? 155 LYS A HG3 1 ATOM 1908 H HD2 . LYS A 1 126 ? 33.460 9.511 49.092 1.00 57.82 ? 155 LYS A HD2 1 ATOM 1909 H HD3 . LYS A 1 126 ? 34.633 10.241 49.880 1.00 57.82 ? 155 LYS A HD3 1 ATOM 1910 H HE2 . LYS A 1 126 ? 36.210 8.999 48.703 1.00 59.23 ? 155 LYS A HE2 1 ATOM 1911 H HE3 . LYS A 1 126 ? 35.045 8.238 47.932 1.00 59.23 ? 155 LYS A HE3 1 ATOM 1912 H HZ1 . LYS A 1 126 ? 34.510 10.215 46.935 1.00 60.10 ? 155 LYS A HZ1 1 ATOM 1913 H HZ2 . LYS A 1 126 ? 35.571 10.908 47.638 1.00 60.10 ? 155 LYS A HZ2 1 ATOM 1914 H HZ3 . LYS A 1 126 ? 35.895 9.906 46.642 1.00 60.10 ? 155 LYS A HZ3 1 ATOM 1915 N N . PRO A 1 127 ? 34.742 4.202 51.738 1.00 39.90 ? 156 PRO A N 1 ATOM 1916 C CA . PRO A 1 127 ? 35.569 3.524 52.750 1.00 39.10 ? 156 PRO A CA 1 ATOM 1917 C C . PRO A 1 127 ? 36.811 4.279 53.220 1.00 39.74 ? 156 PRO A C 1 ATOM 1918 O O . PRO A 1 127 ? 37.336 5.146 52.522 1.00 39.58 ? 156 PRO A O 1 ATOM 1919 C CB . PRO A 1 127 ? 35.993 2.235 52.039 1.00 39.07 ? 156 PRO A CB 1 ATOM 1920 C CG . PRO A 1 127 ? 34.927 1.978 51.066 1.00 39.26 ? 156 PRO A CG 1 ATOM 1921 C CD . PRO A 1 127 ? 34.487 3.321 50.583 1.00 39.37 ? 156 PRO A CD 1 ATOM 1922 H HA . PRO A 1 127 ? 35.027 3.295 53.522 1.00 46.92 ? 156 PRO A HA 1 ATOM 1923 H HB2 . PRO A 1 127 ? 36.843 2.371 51.592 1.00 46.89 ? 156 PRO A HB2 1 ATOM 1924 H HB3 . PRO A 1 127 ? 36.054 1.510 52.682 1.00 46.89 ? 156 PRO A HB3 1 ATOM 1925 H HG2 . PRO A 1 127 ? 35.277 1.450 50.332 1.00 47.11 ? 156 PRO A HG2 1 ATOM 1926 H HG3 . PRO A 1 127 ? 34.194 1.515 51.501 1.00 47.11 ? 156 PRO A HG3 1 ATOM 1927 H HD2 . PRO A 1 127 ? 35.020 3.599 49.822 1.00 47.24 ? 156 PRO A HD2 1 ATOM 1928 H HD3 . PRO A 1 127 ? 33.541 3.310 50.369 1.00 47.24 ? 156 PRO A HD3 1 ATOM 1929 N N . TYR A 1 128 ? 37.265 3.920 54.418 1.00 35.85 ? 157 TYR A N 1 ATOM 1930 C CA . TYR A 1 128 ? 38.500 4.438 54.993 1.00 36.26 ? 157 TYR A CA 1 ATOM 1931 C C . TYR A 1 128 ? 39.432 3.284 55.326 1.00 35.27 ? 157 TYR A C 1 ATOM 1932 O O . TYR A 1 128 ? 40.601 3.272 54.938 1.00 36.17 ? 157 TYR A O 1 ATOM 1933 C CB . TYR A 1 128 ? 38.212 5.243 56.267 1.00 36.77 ? 157 TYR A CB 1 ATOM 1934 C CG . TYR A 1 128 ? 38.444 6.736 56.180 1.00 37.13 ? 157 TYR A CG 1 ATOM 1935 C CD1 . TYR A 1 128 ? 39.474 7.267 55.414 1.00 37.65 ? 157 TYR A CD1 1 ATOM 1936 C CD2 . TYR A 1 128 ? 37.634 7.616 56.885 1.00 36.50 ? 157 TYR A CD2 1 ATOM 1937 C CE1 . TYR A 1 128 ? 39.681 8.628 55.346 1.00 37.05 ? 157 TYR A CE1 1 ATOM 1938 C CE2 . TYR A 1 128 ? 37.835 8.976 56.823 1.00 35.94 ? 157 TYR A CE2 1 ATOM 1939 C CZ . TYR A 1 128 ? 38.861 9.476 56.056 1.00 36.28 ? 157 TYR A CZ 1 ATOM 1940 O OH . TYR A 1 128 ? 39.060 10.832 55.990 1.00 35.99 ? 157 TYR A OH 1 ATOM 1941 H H . TYR A 1 128 ? 36.861 3.360 54.930 1.00 43.02 ? 157 TYR A H 1 ATOM 1942 H HA . TYR A 1 128 ? 38.941 5.018 54.353 1.00 43.51 ? 157 TYR A HA 1 ATOM 1943 H HB2 . TYR A 1 128 ? 37.282 5.109 56.508 1.00 44.12 ? 157 TYR A HB2 1 ATOM 1944 H HB3 . TYR A 1 128 ? 38.780 4.904 56.976 1.00 44.12 ? 157 TYR A HB3 1 ATOM 1945 H HD1 . TYR A 1 128 ? 40.030 6.695 54.935 1.00 45.17 ? 157 TYR A HD1 1 ATOM 1946 H HD2 . TYR A 1 128 ? 36.941 7.280 57.406 1.00 43.80 ? 157 TYR A HD2 1 ATOM 1947 H HE1 . TYR A 1 128 ? 40.372 8.971 54.827 1.00 44.47 ? 157 TYR A HE1 1 ATOM 1948 H HE2 . TYR A 1 128 ? 37.283 9.553 57.299 1.00 43.13 ? 157 TYR A HE2 1 ATOM 1949 H HH . TYR A 1 128 ? 39.709 11.004 55.485 1.00 43.18 ? 157 TYR A HH 1 ATOM 1950 N N . LYS A 1 129 ? 38.894 2.309 56.051 1.00 26.75 ? 158 LYS A N 1 ATOM 1951 C CA . LYS A 1 129 ? 39.689 1.197 56.546 1.00 27.29 ? 158 LYS A CA 1 ATOM 1952 C C . LYS A 1 129 ? 38.792 0.062 57.019 1.00 63.79 ? 158 LYS A C 1 ATOM 1953 O O . LYS A 1 129 ? 37.800 0.293 57.712 1.00 26.98 ? 158 LYS A O 1 ATOM 1954 C CB . LYS A 1 129 ? 40.589 1.658 57.693 1.00 26.80 ? 158 LYS A CB 1 ATOM 1955 C CG . LYS A 1 129 ? 41.748 0.726 57.997 1.00 27.49 ? 158 LYS A CG 1 ATOM 1956 C CD . LYS A 1 129 ? 42.883 0.923 57.007 1.00 28.16 ? 158 LYS A CD 1 ATOM 1957 C CE . LYS A 1 129 ? 44.063 0.022 57.324 1.00 28.98 ? 158 LYS A CE 1 ATOM 1958 N NZ . LYS A 1 129 ? 45.172 0.195 56.345 1.00 42.92 ? 158 LYS A NZ 1 ATOM 1959 H H . LYS A 1 129 ? 38.064 2.270 56.270 1.00 32.10 ? 158 LYS A H 1 ATOM 1960 H HA . LYS A 1 129 ? 40.253 0.863 55.831 1.00 32.75 ? 158 LYS A HA 1 ATOM 1961 H HB2 . LYS A 1 129 ? 40.960 2.525 57.467 1.00 32.16 ? 158 LYS A HB2 1 ATOM 1962 H HB3 . LYS A 1 129 ? 40.052 1.733 58.498 1.00 32.16 ? 158 LYS A HB3 1 ATOM 1963 H HG2 . LYS A 1 129 ? 42.084 0.912 58.888 1.00 32.99 ? 158 LYS A HG2 1 ATOM 1964 H HG3 . LYS A 1 129 ? 41.445 -0.193 57.936 1.00 32.99 ? 158 LYS A HG3 1 ATOM 1965 H HD2 . LYS A 1 129 ? 42.569 0.709 56.114 1.00 33.79 ? 158 LYS A HD2 1 ATOM 1966 H HD3 . LYS A 1 129 ? 43.185 1.844 57.045 1.00 33.79 ? 158 LYS A HD3 1 ATOM 1967 H HE2 . LYS A 1 129 ? 44.401 0.238 58.206 1.00 34.78 ? 158 LYS A HE2 1 ATOM 1968 H HE3 . LYS A 1 129 ? 43.775 -0.904 57.294 1.00 34.78 ? 158 LYS A HE3 1 ATOM 1969 H HZ1 . LYS A 1 129 ? 45.849 -0.344 56.555 1.00 51.51 ? 158 LYS A HZ1 1 ATOM 1970 H HZ2 . LYS A 1 129 ? 44.888 -0.003 55.526 1.00 51.51 ? 158 LYS A HZ2 1 ATOM 1971 H HZ3 . LYS A 1 129 ? 45.459 1.037 56.357 1.00 51.51 ? 158 LYS A HZ3 1 ATOM 1972 N N . TYR A 1 130 ? 39.144 -1.161 56.635 1.00 28.46 ? 159 TYR A N 1 ATOM 1973 C CA . TYR A 1 130 ? 38.444 -2.351 57.102 1.00 28.81 ? 159 TYR A CA 1 ATOM 1974 C C . TYR A 1 130 ? 39.207 -2.988 58.260 1.00 28.80 ? 159 TYR A C 1 ATOM 1975 O O . TYR A 1 130 ? 40.433 -2.894 58.332 1.00 28.99 ? 159 TYR A O 1 ATOM 1976 C CB . TYR A 1 130 ? 38.270 -3.355 55.961 1.00 29.94 ? 159 TYR A CB 1 ATOM 1977 C CG . TYR A 1 130 ? 37.316 -2.895 54.881 1.00 30.09 ? 159 TYR A CG 1 ATOM 1978 C CD1 . TYR A 1 130 ? 37.718 -1.987 53.912 1.00 30.12 ? 159 TYR A CD1 1 ATOM 1979 C CD2 . TYR A 1 130 ? 36.015 -3.374 54.829 1.00 30.31 ? 159 TYR A CD2 1 ATOM 1980 C CE1 . TYR A 1 130 ? 36.848 -1.565 52.924 1.00 30.33 ? 159 TYR A CE1 1 ATOM 1981 C CE2 . TYR A 1 130 ? 35.138 -2.958 53.846 1.00 30.58 ? 159 TYR A CE2 1 ATOM 1982 C CZ . TYR A 1 130 ? 35.559 -2.055 52.895 1.00 30.58 ? 159 TYR A CZ 1 ATOM 1983 O OH . TYR A 1 130 ? 34.689 -1.640 51.913 1.00 30.90 ? 159 TYR A OH 1 ATOM 1984 H H . TYR A 1 130 ? 39.794 -1.329 56.097 1.00 34.15 ? 159 TYR A H 1 ATOM 1985 H HA . TYR A 1 130 ? 37.563 -2.099 57.421 1.00 34.57 ? 159 TYR A HA 1 ATOM 1986 H HB2 . TYR A 1 130 ? 39.134 -3.510 55.548 1.00 35.92 ? 159 TYR A HB2 1 ATOM 1987 H HB3 . TYR A 1 130 ? 37.926 -4.186 56.326 1.00 35.92 ? 159 TYR A HB3 1 ATOM 1988 H HD1 . TYR A 1 130 ? 38.586 -1.654 53.929 1.00 36.14 ? 159 TYR A HD1 1 ATOM 1989 H HD2 . TYR A 1 130 ? 35.727 -3.984 55.469 1.00 36.37 ? 159 TYR A HD2 1 ATOM 1990 H HE1 . TYR A 1 130 ? 37.131 -0.955 52.281 1.00 36.39 ? 159 TYR A HE1 1 ATOM 1991 H HE2 . TYR A 1 130 ? 34.268 -3.288 53.824 1.00 36.69 ? 159 TYR A HE2 1 ATOM 1992 H HH . TYR A 1 130 ? 33.944 -2.014 52.013 1.00 37.08 ? 159 TYR A HH 1 ATOM 1993 N N . PHE A 1 131 ? 38.474 -3.633 59.163 1.00 34.85 ? 160 PHE A N 1 ATOM 1994 C CA . PHE A 1 131 ? 39.072 -4.296 60.316 1.00 34.08 ? 160 PHE A CA 1 ATOM 1995 C C . PHE A 1 131 ? 38.455 -5.675 60.497 1.00 35.14 ? 160 PHE A C 1 ATOM 1996 O O . PHE A 1 131 ? 37.234 -5.815 60.531 1.00 34.92 ? 160 PHE A O 1 ATOM 1997 C CB . PHE A 1 131 ? 38.874 -3.466 61.585 1.00 32.14 ? 160 PHE A CB 1 ATOM 1998 C CG . PHE A 1 131 ? 39.329 -2.041 61.457 1.00 31.03 ? 160 PHE A CG 1 ATOM 1999 C CD1 . PHE A 1 131 ? 38.485 -1.075 60.936 1.00 30.26 ? 160 PHE A CD1 1 ATOM 2000 C CD2 . PHE A 1 131 ? 40.597 -1.665 61.868 1.00 30.93 ? 160 PHE A CD2 1 ATOM 2001 C CE1 . PHE A 1 131 ? 38.901 0.236 60.820 1.00 29.66 ? 160 PHE A CE1 1 ATOM 2002 C CE2 . PHE A 1 131 ? 41.017 -0.355 61.756 1.00 30.36 ? 160 PHE A CE2 1 ATOM 2003 C CZ . PHE A 1 131 ? 40.168 0.596 61.231 1.00 29.80 ? 160 PHE A CZ 1 ATOM 2004 H H . PHE A 1 131 ? 37.618 -3.701 59.129 1.00 41.82 ? 160 PHE A H 1 ATOM 2005 H HA . PHE A 1 131 ? 40.024 -4.404 60.167 1.00 40.89 ? 160 PHE A HA 1 ATOM 2006 H HB2 . PHE A 1 131 ? 37.930 -3.457 61.808 1.00 38.57 ? 160 PHE A HB2 1 ATOM 2007 H HB3 . PHE A 1 131 ? 39.378 -3.874 62.306 1.00 38.57 ? 160 PHE A HB3 1 ATOM 2008 H HD1 . PHE A 1 131 ? 37.631 -1.313 60.657 1.00 36.31 ? 160 PHE A HD1 1 ATOM 2009 H HD2 . PHE A 1 131 ? 41.173 -2.304 62.222 1.00 37.12 ? 160 PHE A HD2 1 ATOM 2010 H HE1 . PHE A 1 131 ? 38.326 0.876 60.466 1.00 35.59 ? 160 PHE A HE1 1 ATOM 2011 H HE2 . PHE A 1 131 ? 41.871 -0.115 62.033 1.00 36.43 ? 160 PHE A HE2 1 ATOM 2012 H HZ . PHE A 1 131 ? 40.448 1.479 61.154 1.00 35.76 ? 160 PHE A HZ 1 ATOM 2013 N N . ALA A 1 132 ? 39.303 -6.691 60.620 1.00 33.77 ? 161 ALA A N 1 ATOM 2014 C CA . ALA A 1 132 ? 38.834 -8.061 60.792 1.00 34.66 ? 161 ALA A CA 1 ATOM 2015 C C . ALA A 1 132 ? 39.952 -8.969 61.284 1.00 35.27 ? 161 ALA A C 1 ATOM 2016 O O . ALA A 1 132 ? 41.131 -8.669 61.110 1.00 36.26 ? 161 ALA A O 1 ATOM 2017 C CB . ALA A 1 132 ? 38.270 -8.591 59.488 1.00 35.82 ? 161 ALA A CB 1 ATOM 2018 H H . ALA A 1 132 ? 40.160 -6.612 60.608 1.00 40.52 ? 161 ALA A H 1 ATOM 2019 H HA . ALA A 1 132 ? 38.125 -8.072 61.453 1.00 41.59 ? 161 ALA A HA 1 ATOM 2020 H HB1 . ALA A 1 132 ? 37.964 -9.502 59.624 1.00 42.99 ? 161 ALA A HB1 1 ATOM 2021 H HB2 . ALA A 1 132 ? 37.528 -8.030 59.214 1.00 42.99 ? 161 ALA A HB2 1 ATOM 2022 H HB3 . ALA A 1 132 ? 38.966 -8.572 58.813 1.00 42.99 ? 161 ALA A HB3 1 ATOM 2023 N N . THR A 1 133 ? 39.572 -10.083 61.900 1.00 31.60 ? 162 THR A N 1 ATOM 2024 C CA . THR A 1 133 ? 40.540 -11.073 62.355 1.00 32.28 ? 162 THR A CA 1 ATOM 2025 C C . THR A 1 133 ? 41.234 -11.725 61.162 1.00 33.45 ? 162 THR A C 1 ATOM 2026 O O . THR A 1 133 ? 42.338 -12.255 61.287 1.00 34.12 ? 162 THR A O 1 ATOM 2027 C CB . THR A 1 133 ? 39.872 -12.154 63.221 1.00 32.43 ? 162 THR A CB 1 ATOM 2028 O OG1 . THR A 1 133 ? 38.779 -12.741 62.503 1.00 41.76 ? 162 THR A OG1 1 ATOM 2029 C CG2 . THR A 1 133 ? 39.355 -11.551 64.521 1.00 31.45 ? 162 THR A CG2 1 ATOM 2030 H H . THR A 1 133 ? 38.754 -10.290 62.067 1.00 37.92 ? 162 THR A H 1 ATOM 2031 H HA . THR A 1 133 ? 41.215 -10.632 62.893 1.00 38.74 ? 162 THR A HA 1 ATOM 2032 H HB . THR A 1 133 ? 40.521 -12.841 63.439 1.00 38.92 ? 162 THR A HB 1 ATOM 2033 H HG1 . THR A 1 133 ? 38.411 -13.332 62.972 1.00 50.11 ? 162 THR A HG1 1 ATOM 2034 H HG21 . THR A 1 133 ? 38.935 -12.238 65.061 1.00 37.74 ? 162 THR A HG21 1 ATOM 2035 H HG22 . THR A 1 133 ? 40.090 -11.161 65.020 1.00 37.74 ? 162 THR A HG22 1 ATOM 2036 H HG23 . THR A 1 133 ? 38.703 -10.859 64.328 1.00 37.74 ? 162 THR A HG23 1 ATOM 2037 N N . ASN A 1 134 ? 40.580 -11.680 60.005 1.00 39.91 ? 163 ASN A N 1 ATOM 2038 C CA . ASN A 1 134 ? 41.189 -12.123 58.757 1.00 41.96 ? 163 ASN A CA 1 ATOM 2039 C C . ASN A 1 134 ? 40.581 -11.364 57.585 1.00 41.03 ? 163 ASN A C 1 ATOM 2040 O O . ASN A 1 134 ? 39.451 -11.632 57.177 1.00 41.17 ? 163 ASN A O 1 ATOM 2041 C CB . ASN A 1 134 ? 41.010 -13.629 58.562 1.00 49.68 ? 163 ASN A CB 1 ATOM 2042 C CG . ASN A 1 134 ? 41.945 -14.193 57.512 1.00 54.40 ? 163 ASN A CG 1 ATOM 2043 O OD1 . ASN A 1 134 ? 41.763 -13.967 56.316 1.00 56.56 ? 163 ASN A OD1 1 ATOM 2044 N ND2 . ASN A 1 134 ? 42.953 -14.936 57.956 1.00 54.49 ? 163 ASN A ND2 1 ATOM 2045 H H . ASN A 1 134 ? 39.774 -11.393 59.917 1.00 47.89 ? 163 ASN A H 1 ATOM 2046 H HA . ASN A 1 134 ? 42.140 -11.932 58.781 1.00 50.35 ? 163 ASN A HA 1 ATOM 2047 H HB2 . ASN A 1 134 ? 41.192 -14.081 59.401 1.00 59.62 ? 163 ASN A HB2 1 ATOM 2048 H HB3 . ASN A 1 134 ? 40.099 -13.806 58.280 1.00 59.62 ? 163 ASN A HB3 1 ATOM 2049 H HD21 . ASN A 1 134 ? 43.047 -15.065 58.801 1.00 65.39 ? 163 ASN A HD21 1 ATOM 2050 N N . CYS A 1 135 ? 41.341 -10.414 57.050 1.00 70.35 ? 164 CYS A N 1 ATOM 2051 C CA . CYS A 1 135 ? 40.851 -9.548 55.984 1.00 67.13 ? 164 CYS A CA 1 ATOM 2052 C C . CYS A 1 135 ? 40.518 -10.326 54.716 1.00 65.16 ? 164 CYS A C 1 ATOM 2053 O O . CYS A 1 135 ? 39.591 -9.974 53.989 1.00 64.06 ? 164 CYS A O 1 ATOM 2054 C CB . CYS A 1 135 ? 41.886 -8.467 55.668 1.00 66.68 ? 164 CYS A CB 1 ATOM 2055 S SG . CYS A 1 135 ? 42.179 -7.299 57.015 1.00 54.05 ? 164 CYS A SG 1 ATOM 2056 H H . CYS A 1 135 ? 42.150 -10.250 57.289 1.00 84.42 ? 164 CYS A H 1 ATOM 2057 H HA . CYS A 1 135 ? 40.041 -9.107 56.285 1.00 80.56 ? 164 CYS A HA 1 ATOM 2058 H HB2 . CYS A 1 135 ? 42.731 -8.896 55.462 1.00 80.01 ? 164 CYS A HB2 1 ATOM 2059 H HB3 . CYS A 1 135 ? 41.580 -7.960 54.900 1.00 80.01 ? 164 CYS A HB3 1 ATOM 2060 N N . SER A 1 136 ? 41.279 -11.384 54.456 1.00 54.79 ? 165 SER A N 1 ATOM 2061 C CA . SER A 1 136 ? 41.102 -12.171 53.241 1.00 53.88 ? 165 SER A CA 1 ATOM 2062 C C . SER A 1 136 ? 39.842 -13.032 53.296 1.00 52.20 ? 165 SER A C 1 ATOM 2063 O O . SER A 1 136 ? 39.137 -13.175 52.299 1.00 53.75 ? 165 SER A O 1 ATOM 2064 C CB . SER A 1 136 ? 42.326 -13.056 53.003 1.00 54.51 ? 165 SER A CB 1 ATOM 2065 O OG . SER A 1 136 ? 43.497 -12.271 52.860 1.00 53.97 ? 165 SER A OG 1 ATOM 2066 H H . SER A 1 136 ? 41.908 -11.667 54.969 1.00 65.75 ? 165 SER A H 1 ATOM 2067 H HA . SER A 1 136 ? 41.018 -11.569 52.486 1.00 64.65 ? 165 SER A HA 1 ATOM 2068 H HB2 . SER A 1 136 ? 42.437 -13.653 53.760 1.00 65.41 ? 165 SER A HB2 1 ATOM 2069 H HB3 . SER A 1 136 ? 42.191 -13.571 52.192 1.00 65.41 ? 165 SER A HB3 1 ATOM 2070 H HG . SER A 1 136 ? 44.162 -12.767 52.730 1.00 64.77 ? 165 SER A HG 1 ATOM 2071 N N . ALA A 1 137 ? 39.563 -13.604 54.462 1.00 68.91 ? 166 ALA A N 1 ATOM 2072 C CA . ALA A 1 137 ? 38.414 -14.488 54.624 1.00 38.77 ? 166 ALA A CA 1 ATOM 2073 C C . ALA A 1 137 ? 37.119 -13.705 54.827 1.00 37.77 ? 166 ALA A C 1 ATOM 2074 O O . ALA A 1 137 ? 36.049 -14.141 54.399 1.00 38.30 ? 166 ALA A O 1 ATOM 2075 C CB . ALA A 1 137 ? 38.642 -15.436 55.791 1.00 48.48 ? 166 ALA A CB 1 ATOM 2076 H H . ALA A 1 137 ? 40.026 -13.496 55.179 1.00 82.69 ? 166 ALA A H 1 ATOM 2077 H HA . ALA A 1 137 ? 38.315 -15.023 53.820 1.00 46.52 ? 166 ALA A HA 1 ATOM 2078 H HB1 . ALA A 1 137 ? 37.869 -16.015 55.882 1.00 58.18 ? 166 ALA A HB1 1 ATOM 2079 H HB2 . ALA A 1 137 ? 39.434 -15.967 55.616 1.00 58.18 ? 166 ALA A HB2 1 ATOM 2080 H HB3 . ALA A 1 137 ? 38.764 -14.916 56.600 1.00 58.18 ? 166 ALA A HB3 1 ATOM 2081 N N . THR A 1 138 ? 37.222 -12.552 55.480 1.00 47.73 ? 167 THR A N 1 ATOM 2082 C CA . THR A 1 138 ? 36.049 -11.759 55.834 1.00 45.29 ? 167 THR A CA 1 ATOM 2083 C C . THR A 1 138 ? 35.638 -10.785 54.728 1.00 42.83 ? 167 THR A C 1 ATOM 2084 O O . THR A 1 138 ? 34.453 -10.666 54.415 1.00 42.34 ? 167 THR A O 1 ATOM 2085 C CB . THR A 1 138 ? 36.294 -10.962 57.132 1.00 44.77 ? 167 THR A CB 1 ATOM 2086 O OG1 . THR A 1 138 ? 36.657 -11.863 58.186 1.00 45.04 ? 167 THR A OG1 1 ATOM 2087 C CG2 . THR A 1 138 ? 35.046 -10.191 57.547 1.00 44.20 ? 167 THR A CG2 1 ATOM 2088 H H . THR A 1 138 ? 37.967 -12.204 55.732 1.00 57.28 ? 167 THR A H 1 ATOM 2089 H HA . THR A 1 138 ? 35.303 -12.359 55.991 1.00 54.35 ? 167 THR A HA 1 ATOM 2090 H HB . THR A 1 138 ? 37.013 -10.327 56.990 1.00 53.72 ? 167 THR A HB 1 ATOM 2091 H HG1 . THR A 1 138 ? 37.358 -12.278 57.981 1.00 54.05 ? 167 THR A HG1 1 ATOM 2092 H HG21 . THR A 1 138 ? 35.219 -9.697 58.364 1.00 53.04 ? 167 THR A HG21 1 ATOM 2093 H HG22 . THR A 1 138 ? 34.795 -9.567 56.848 1.00 53.04 ? 167 THR A HG22 1 ATOM 2094 H HG23 . THR A 1 138 ? 34.312 -10.807 57.700 1.00 53.04 ? 167 THR A HG23 1 ATOM 2095 N N . PHE A 1 139 ? 36.615 -10.096 54.140 1.00 36.15 ? 168 PHE A N 1 ATOM 2096 C CA . PHE A 1 139 ? 36.337 -9.041 53.163 1.00 36.03 ? 168 PHE A CA 1 ATOM 2097 C C . PHE A 1 139 ? 36.995 -9.282 51.807 1.00 37.29 ? 168 PHE A C 1 ATOM 2098 O O . PHE A 1 139 ? 36.736 -8.551 50.851 1.00 37.44 ? 168 PHE A O 1 ATOM 2099 C CB . PHE A 1 139 ? 36.795 -7.685 53.704 1.00 34.97 ? 168 PHE A CB 1 ATOM 2100 C CG . PHE A 1 139 ? 36.027 -7.220 54.906 1.00 34.81 ? 168 PHE A CG 1 ATOM 2101 C CD1 . PHE A 1 139 ? 34.747 -6.711 54.771 1.00 34.98 ? 168 PHE A CD1 1 ATOM 2102 C CD2 . PHE A 1 139 ? 36.588 -7.281 56.169 1.00 34.67 ? 168 PHE A CD2 1 ATOM 2103 C CE1 . PHE A 1 139 ? 34.038 -6.279 55.874 1.00 34.46 ? 168 PHE A CE1 1 ATOM 2104 C CE2 . PHE A 1 139 ? 35.884 -6.850 57.275 1.00 34.30 ? 168 PHE A CE2 1 ATOM 2105 C CZ . PHE A 1 139 ? 34.608 -6.348 57.127 1.00 34.21 ? 168 PHE A CZ 1 ATOM 2106 H H . PHE A 1 139 ? 37.453 -10.221 54.290 1.00 43.38 ? 168 PHE A H 1 ATOM 2107 H HA . PHE A 1 139 ? 35.378 -8.994 53.021 1.00 43.23 ? 168 PHE A HA 1 ATOM 2108 H HB2 . PHE A 1 139 ? 37.730 -7.750 53.957 1.00 41.97 ? 168 PHE A HB2 1 ATOM 2109 H HB3 . PHE A 1 139 ? 36.688 -7.018 53.008 1.00 41.97 ? 168 PHE A HB3 1 ATOM 2110 H HD1 . PHE A 1 139 ? 34.358 -6.663 53.927 1.00 41.98 ? 168 PHE A HD1 1 ATOM 2111 H HD2 . PHE A 1 139 ? 37.448 -7.619 56.275 1.00 41.60 ? 168 PHE A HD2 1 ATOM 2112 H HE1 . PHE A 1 139 ? 33.178 -5.941 55.772 1.00 41.35 ? 168 PHE A HE1 1 ATOM 2113 H HE2 . PHE A 1 139 ? 36.270 -6.897 58.120 1.00 41.16 ? 168 PHE A HE2 1 ATOM 2114 H HZ . PHE A 1 139 ? 34.133 -6.058 57.872 1.00 41.05 ? 168 PHE A HZ 1 ATOM 2115 N N . GLY A 1 140 ? 37.846 -10.298 51.718 1.00 40.49 ? 169 GLY A N 1 ATOM 2116 C CA . GLY A 1 140 ? 38.579 -10.548 50.491 1.00 42.19 ? 169 GLY A CA 1 ATOM 2117 C C . GLY A 1 140 ? 39.566 -9.430 50.213 1.00 42.38 ? 169 GLY A C 1 ATOM 2118 O O . GLY A 1 140 ? 39.913 -9.161 49.062 1.00 43.57 ? 169 GLY A O 1 ATOM 2119 H H . GLY A 1 140 ? 38.014 -10.853 52.353 1.00 48.59 ? 169 GLY A H 1 ATOM 2120 H HA2 . GLY A 1 140 ? 39.067 -11.383 50.565 1.00 50.63 ? 169 GLY A HA2 1 ATOM 2121 H HA3 . GLY A 1 140 ? 37.961 -10.612 49.746 1.00 50.63 ? 169 GLY A HA3 1 ATOM 2122 N N . LEU A 1 141 ? 40.005 -8.770 51.281 1.00 37.15 ? 170 LEU A N 1 ATOM 2123 C CA . LEU A 1 141 ? 40.967 -7.681 51.187 1.00 36.65 ? 170 LEU A CA 1 ATOM 2124 C C . LEU A 1 141 ? 42.320 -8.125 51.724 1.00 37.04 ? 170 LEU A C 1 ATOM 2125 O O . LEU A 1 141 ? 42.410 -9.095 52.476 1.00 37.26 ? 170 LEU A O 1 ATOM 2126 C CB . LEU A 1 141 ? 40.466 -6.460 51.958 1.00 35.00 ? 170 LEU A CB 1 ATOM 2127 C CG . LEU A 1 141 ? 39.137 -5.880 51.472 1.00 34.60 ? 170 LEU A CG 1 ATOM 2128 C CD1 . LEU A 1 141 ? 38.580 -4.898 52.487 1.00 33.08 ? 170 LEU A CD1 1 ATOM 2129 C CD2 . LEU A 1 141 ? 39.310 -5.209 50.119 1.00 35.15 ? 170 LEU A CD2 1 ATOM 2130 H H . LEU A 1 141 ? 39.754 -8.940 52.086 1.00 44.58 ? 170 LEU A H 1 ATOM 2131 H HA . LEU A 1 141 ? 41.077 -7.430 50.256 1.00 43.98 ? 170 LEU A HA 1 ATOM 2132 H HB2 . LEU A 1 141 ? 40.352 -6.709 52.888 1.00 42.01 ? 170 LEU A HB2 1 ATOM 2133 H HB3 . LEU A 1 141 ? 41.132 -5.758 51.889 1.00 42.01 ? 170 LEU A HB3 1 ATOM 2134 H HG . LEU A 1 141 ? 38.496 -6.601 51.369 1.00 41.52 ? 170 LEU A HG 1 ATOM 2135 H HD11 . LEU A 1 141 ? 37.739 -4.546 52.156 1.00 39.69 ? 170 LEU A HD11 1 ATOM 2136 H HD12 . LEU A 1 141 ? 38.437 -5.361 53.327 1.00 39.69 ? 170 LEU A HD12 1 ATOM 2137 H HD13 . LEU A 1 141 ? 39.216 -4.177 52.610 1.00 39.69 ? 170 LEU A HD13 1 ATOM 2138 H HD21 . LEU A 1 141 ? 38.455 -4.851 49.833 1.00 42.18 ? 170 LEU A HD21 1 ATOM 2139 H HD22 . LEU A 1 141 ? 39.958 -4.493 50.203 1.00 42.18 ? 170 LEU A HD22 1 ATOM 2140 H HD23 . LEU A 1 141 ? 39.624 -5.867 49.479 1.00 42.18 ? 170 LEU A HD23 1 ATOM 2141 N N . GLU A 1 142 ? 43.371 -7.414 51.328 1.00 52.58 ? 171 GLU A N 1 ATOM 2142 C CA . GLU A 1 142 ? 44.714 -7.695 51.818 1.00 53.20 ? 171 GLU A CA 1 ATOM 2143 C C . GLU A 1 142 ? 44.946 -7.024 53.170 1.00 50.41 ? 171 GLU A C 1 ATOM 2144 O O . GLU A 1 142 ? 44.347 -5.993 53.472 1.00 48.04 ? 171 GLU A O 1 ATOM 2145 C CB . GLU A 1 142 ? 45.757 -7.233 50.800 1.00 53.34 ? 171 GLU A CB 1 ATOM 2146 C CG . GLU A 1 142 ? 45.745 -8.046 49.513 1.00 55.01 ? 171 GLU A CG 1 ATOM 2147 C CD . GLU A 1 142 ? 46.740 -7.538 48.487 1.00 56.30 ? 171 GLU A CD 1 ATOM 2148 O OE1 . GLU A 1 142 ? 47.445 -8.371 47.877 1.00 58.94 ? 171 GLU A OE1 1 ATOM 2149 O OE2 . GLU A 1 142 ? 46.811 -6.307 48.284 1.00 55.92 ? 171 GLU A OE2 1 ATOM 2150 H H . GLU A 1 142 ? 43.332 -6.760 50.771 1.00 63.10 ? 171 GLU A H 1 ATOM 2151 H HA . GLU A 1 142 ? 44.814 -8.653 51.937 1.00 63.83 ? 171 GLU A HA 1 ATOM 2152 H HB2 . GLU A 1 142 ? 45.582 -6.307 50.569 1.00 64.00 ? 171 GLU A HB2 1 ATOM 2153 H HB3 . GLU A 1 142 ? 46.639 -7.314 51.195 1.00 64.00 ? 171 GLU A HB3 1 ATOM 2154 H HG2 . GLU A 1 142 ? 45.971 -8.967 49.719 1.00 66.01 ? 171 GLU A HG2 1 ATOM 2155 H HG3 . GLU A 1 142 ? 44.860 -8.001 49.119 1.00 66.01 ? 171 GLU A HG3 1 ATOM 2156 N N . ASP A 1 143 ? 45.810 -7.626 53.981 1.00 41.52 ? 172 ASP A N 1 ATOM 2157 C CA . ASP A 1 143 ? 46.132 -7.108 55.307 1.00 41.13 ? 172 ASP A CA 1 ATOM 2158 C C . ASP A 1 143 ? 47.333 -6.168 55.233 1.00 43.46 ? 172 ASP A C 1 ATOM 2159 O O . ASP A 1 143 ? 48.357 -6.510 54.642 1.00 45.18 ? 172 ASP A O 1 ATOM 2160 C CB . ASP A 1 143 ? 46.415 -8.267 56.264 1.00 40.81 ? 172 ASP A CB 1 ATOM 2161 C CG . ASP A 1 143 ? 46.280 -7.874 57.717 1.00 39.19 ? 172 ASP A CG 1 ATOM 2162 O OD1 . ASP A 1 143 ? 46.549 -6.700 58.047 1.00 38.84 ? 172 ASP A OD1 1 ATOM 2163 O OD2 . ASP A 1 143 ? 45.907 -8.744 58.531 1.00 38.24 ? 172 ASP A OD2 1 ATOM 2164 H H . ASP A 1 143 ? 46.230 -8.350 53.783 1.00 49.82 ? 172 ASP A H 1 ATOM 2165 H HA . ASP A 1 143 ? 45.374 -6.608 55.650 1.00 49.35 ? 172 ASP A HA 1 ATOM 2166 H HB2 . ASP A 1 143 ? 45.784 -8.983 56.087 1.00 48.97 ? 172 ASP A HB2 1 ATOM 2167 H HB3 . ASP A 1 143 ? 47.321 -8.580 56.120 1.00 48.97 ? 172 ASP A HB3 1 ATOM 2168 N N . ASP A 1 144 ? 47.214 -4.987 55.837 1.00 40.14 ? 173 ASP A N 1 ATOM 2169 C CA . ASP A 1 144 ? 48.265 -3.976 55.731 1.00 42.06 ? 173 ASP A CA 1 ATOM 2170 C C . ASP A 1 144 ? 49.495 -4.314 56.573 1.00 43.88 ? 173 ASP A C 1 ATOM 2171 O O . ASP A 1 144 ? 50.516 -3.633 56.479 1.00 43.63 ? 173 ASP A O 1 ATOM 2172 C CB . ASP A 1 144 ? 47.732 -2.592 56.126 1.00 41.13 ? 173 ASP A CB 1 ATOM 2173 C CG . ASP A 1 144 ? 47.272 -2.521 57.571 1.00 40.28 ? 173 ASP A CG 1 ATOM 2174 O OD1 . ASP A 1 144 ? 47.387 -3.528 58.301 1.00 40.67 ? 173 ASP A OD1 1 ATOM 2175 O OD2 . ASP A 1 144 ? 46.797 -1.441 57.983 1.00 39.28 ? 173 ASP A OD2 1 ATOM 2176 H H . ASP A 1 144 ? 46.538 -4.747 56.311 1.00 48.17 ? 173 ASP A H 1 ATOM 2177 H HA . ASP A 1 144 ? 48.551 -3.926 54.806 1.00 50.47 ? 173 ASP A HA 1 ATOM 2178 H HB2 . ASP A 1 144 ? 48.436 -1.937 56.003 1.00 49.36 ? 173 ASP A HB2 1 ATOM 2179 H HB3 . ASP A 1 144 ? 46.975 -2.374 55.560 1.00 49.36 ? 173 ASP A HB3 1 ATOM 2180 N N . VAL A 1 145 ? 49.396 -5.352 57.400 1.00 52.86 ? 174 VAL A N 1 ATOM 2181 C CA . VAL A 1 145 ? 50.549 -5.809 58.168 1.00 53.83 ? 174 VAL A CA 1 ATOM 2182 C C . VAL A 1 145 ? 51.549 -6.507 57.242 1.00 55.12 ? 174 VAL A C 1 ATOM 2183 O O . VAL A 1 145 ? 52.698 -6.741 57.620 1.00 54.75 ? 174 VAL A O 1 ATOM 2184 C CB . VAL A 1 145 ? 50.144 -6.767 59.320 1.00 39.73 ? 174 VAL A CB 1 ATOM 2185 C CG1 . VAL A 1 145 ? 49.081 -6.129 60.205 1.00 38.19 ? 174 VAL A CG1 1 ATOM 2186 C CG2 . VAL A 1 145 ? 49.653 -8.100 58.784 1.00 40.53 ? 174 VAL A CG2 1 ATOM 2187 H H . VAL A 1 145 ? 48.678 -5.805 57.533 1.00 63.43 ? 174 VAL A H 1 ATOM 2188 H HA . VAL A 1 145 ? 50.991 -5.040 58.560 1.00 64.59 ? 174 VAL A HA 1 ATOM 2189 H HB . VAL A 1 145 ? 50.924 -6.939 59.871 1.00 47.67 ? 174 VAL A HB 1 ATOM 2190 H HG11 . VAL A 1 145 ? 48.848 -6.748 60.914 1.00 45.83 ? 174 VAL A HG11 1 ATOM 2191 H HG12 . VAL A 1 145 ? 49.436 -5.310 60.584 1.00 45.83 ? 174 VAL A HG12 1 ATOM 2192 H HG13 . VAL A 1 145 ? 48.299 -5.932 59.666 1.00 45.83 ? 174 VAL A HG13 1 ATOM 2193 H HG21 . VAL A 1 145 ? 49.411 -8.670 59.531 1.00 48.64 ? 174 VAL A HG21 1 ATOM 2194 H HG22 . VAL A 1 145 ? 48.880 -7.948 58.219 1.00 48.64 ? 174 VAL A HG22 1 ATOM 2195 H HG23 . VAL A 1 145 ? 50.364 -8.514 58.269 1.00 48.64 ? 174 VAL A HG23 1 ATOM 2196 N N . VAL A 1 146 ? 51.100 -6.834 56.030 1.00 56.47 ? 175 VAL A N 1 ATOM 2197 C CA . VAL A 1 146 ? 51.946 -7.479 55.030 1.00 57.93 ? 175 VAL A CA 1 ATOM 2198 C C . VAL A 1 146 ? 52.082 -6.618 53.778 1.00 56.97 ? 175 VAL A C 1 ATOM 2199 O O . VAL A 1 146 ? 53.185 -6.416 53.271 1.00 57.61 ? 175 VAL A O 1 ATOM 2200 C CB . VAL A 1 146 ? 51.386 -8.855 54.611 1.00 59.34 ? 175 VAL A CB 1 ATOM 2201 C CG1 . VAL A 1 146 ? 52.395 -9.603 53.750 1.00 61.73 ? 175 VAL A CG1 1 ATOM 2202 C CG2 . VAL A 1 146 ? 51.013 -9.683 55.828 1.00 58.68 ? 175 VAL A CG2 1 ATOM 2203 H H . VAL A 1 146 ? 50.297 -6.689 55.760 1.00 67.77 ? 175 VAL A H 1 ATOM 2204 H HA . VAL A 1 146 ? 52.832 -7.614 55.402 1.00 69.52 ? 175 VAL A HA 1 ATOM 2205 H HB . VAL A 1 146 ? 50.583 -8.721 54.083 1.00 71.20 ? 175 VAL A HB 1 ATOM 2206 H HG11 . VAL A 1 146 ? 52.021 -10.462 53.499 1.00 74.07 ? 175 VAL A HG11 1 ATOM 2207 H HG12 . VAL A 1 146 ? 52.582 -9.079 52.955 1.00 74.07 ? 175 VAL A HG12 1 ATOM 2208 H HG13 . VAL A 1 146 ? 53.210 -9.733 54.260 1.00 74.07 ? 175 VAL A HG13 1 ATOM 2209 H HG21 . VAL A 1 146 ? 50.665 -10.539 55.532 1.00 70.42 ? 175 VAL A HG21 1 ATOM 2210 H HG22 . VAL A 1 146 ? 51.805 -9.817 56.372 1.00 70.42 ? 175 VAL A HG22 1 ATOM 2211 H HG23 . VAL A 1 146 ? 50.337 -9.209 56.337 1.00 70.42 ? 175 VAL A HG23 1 ATOM 2212 N N . LYS A 1 147 ? 50.955 -6.114 53.282 1.00 65.12 ? 176 LYS A N 1 ATOM 2213 C CA . LYS A 1 147 ? 50.930 -5.427 51.994 1.00 66.32 ? 176 LYS A CA 1 ATOM 2214 C C . LYS A 1 147 ? 51.520 -4.022 52.067 1.00 66.88 ? 176 LYS A C 1 ATOM 2215 O O . LYS A 1 147 ? 52.006 -3.498 51.064 1.00 67.82 ? 176 LYS A O 1 ATOM 2216 C CB . LYS A 1 147 ? 49.497 -5.360 51.456 1.00 65.22 ? 176 LYS A CB 1 ATOM 2217 C CG . LYS A 1 147 ? 49.378 -4.810 50.035 1.00 65.65 ? 176 LYS A CG 1 ATOM 2218 C CD . LYS A 1 147 ? 50.204 -5.617 49.038 1.00 67.25 ? 176 LYS A CD 1 ATOM 2219 C CE . LYS A 1 147 ? 50.049 -5.094 47.620 1.00 67.62 ? 176 LYS A CE 1 ATOM 2220 N NZ . LYS A 1 147 ? 48.680 -5.313 47.081 1.00 67.50 ? 176 LYS A NZ 1 ATOM 2221 H H . LYS A 1 147 ? 50.190 -6.157 53.673 1.00 78.14 ? 176 LYS A H 1 ATOM 2222 H HA . LYS A 1 147 ? 51.459 -5.937 51.360 1.00 79.59 ? 176 LYS A HA 1 ATOM 2223 H HB2 . LYS A 1 147 ? 49.123 -6.255 51.458 1.00 78.27 ? 176 LYS A HB2 1 ATOM 2224 H HB3 . LYS A 1 147 ? 48.974 -4.787 52.039 1.00 78.27 ? 176 LYS A HB3 1 ATOM 2225 H HG2 . LYS A 1 147 ? 48.449 -4.846 49.757 1.00 78.78 ? 176 LYS A HG2 1 ATOM 2226 H HG3 . LYS A 1 147 ? 49.696 -3.894 50.020 1.00 78.78 ? 176 LYS A HG3 1 ATOM 2227 H HD2 . LYS A 1 147 ? 51.142 -5.560 49.281 1.00 80.70 ? 176 LYS A HD2 1 ATOM 2228 H HD3 . LYS A 1 147 ? 49.910 -6.541 49.054 1.00 80.70 ? 176 LYS A HD3 1 ATOM 2229 H HE2 . LYS A 1 147 ? 50.227 -4.141 47.613 1.00 81.15 ? 176 LYS A HE2 1 ATOM 2230 H HE3 . LYS A 1 147 ? 50.678 -5.555 47.042 1.00 81.15 ? 176 LYS A HE3 1 ATOM 2231 H HZ1 . LYS A 1 147 ? 48.493 -6.183 47.070 1.00 81.00 ? 176 LYS A HZ1 1 ATOM 2232 H HZ2 . LYS A 1 147 ? 48.083 -4.895 47.590 1.00 81.00 ? 176 LYS A HZ2 1 ATOM 2233 H HZ3 . LYS A 1 147 ? 48.626 -4.995 46.251 1.00 81.00 ? 176 LYS A HZ3 1 ATOM 2234 N N . LYS A 1 148 ? 51.474 -3.415 53.248 1.00 67.24 ? 177 LYS A N 1 ATOM 2235 C CA . LYS A 1 148 ? 52.040 -2.085 53.451 1.00 69.07 ? 177 LYS A CA 1 ATOM 2236 C C . LYS A 1 148 ? 51.368 -1.057 52.546 1.00 68.42 ? 177 LYS A C 1 ATOM 2237 O O . LYS A 1 148 ? 52.030 -0.385 51.755 1.00 72.33 ? 177 LYS A O 1 ATOM 2238 C CB . LYS A 1 148 ? 53.550 -2.100 53.196 1.00 69.35 ? 177 LYS A CB 1 ATOM 2239 H H . LYS A 1 148 ? 51.119 -3.755 53.954 1.00 80.68 ? 177 LYS A H 1 ATOM 2240 H HA . LYS A 1 148 ? 51.893 -1.816 54.371 1.00 82.88 ? 177 LYS A HA 1 ATOM 2241 N N . GLY A 1 149 ? 50.049 -0.945 52.669 1.00 54.54 ? 178 GLY A N 1 ATOM 2242 C CA . GLY A 1 149 ? 49.278 -0.017 51.862 1.00 51.63 ? 178 GLY A CA 1 ATOM 2243 C C . GLY A 1 149 ? 47.831 -0.441 51.683 1.00 48.41 ? 178 GLY A C 1 ATOM 2244 O O . GLY A 1 149 ? 47.021 0.311 51.143 1.00 46.13 ? 178 GLY A O 1 ATOM 2245 H H . GLY A 1 149 ? 49.575 -1.404 53.220 1.00 65.45 ? 178 GLY A H 1 ATOM 2246 H HA2 . GLY A 1 149 ? 49.289 0.858 52.281 1.00 61.96 ? 178 GLY A HA2 1 ATOM 2247 H HA3 . GLY A 1 149 ? 49.684 0.060 50.984 1.00 61.96 ? 178 GLY A HA3 1 ATOM 2248 N N . ALA A 1 150 ? 47.506 -1.648 52.137 1.00 38.69 ? 179 ALA A N 1 ATOM 2249 C CA . ALA A 1 150 ? 46.165 -2.200 51.971 1.00 37.69 ? 179 ALA A CA 1 ATOM 2250 C C . ALA A 1 150 ? 45.112 -1.368 52.694 1.00 32.69 ? 179 ALA A C 1 ATOM 2251 O O . ALA A 1 150 ? 45.439 -0.434 53.427 1.00 31.80 ? 179 ALA A O 1 ATOM 2252 C CB . ALA A 1 150 ? 46.127 -3.630 52.467 1.00 34.89 ? 179 ALA A CB 1 ATOM 2253 H H . ALA A 1 150 ? 48.049 -2.172 52.548 1.00 46.43 ? 179 ALA A H 1 ATOM 2254 H HA . ALA A 1 150 ? 45.943 -2.206 51.026 1.00 45.23 ? 179 ALA A HA 1 ATOM 2255 H HB1 . ALA A 1 150 ? 45.230 -3.980 52.349 1.00 41.87 ? 179 ALA A HB1 1 ATOM 2256 H HB2 . ALA A 1 150 ? 46.759 -4.158 51.955 1.00 41.87 ? 179 ALA A HB2 1 ATOM 2257 H HB3 . ALA A 1 150 ? 46.367 -3.644 53.406 1.00 41.87 ? 179 ALA A HB3 1 ATOM 2258 N N . ILE A 1 151 ? 43.847 -1.721 52.481 1.00 32.49 ? 180 ILE A N 1 ATOM 2259 C CA . ILE A 1 151 ? 42.724 -0.991 53.062 1.00 31.22 ? 180 ILE A CA 1 ATOM 2260 C C . ILE A 1 151 ? 42.131 -1.730 54.267 1.00 30.79 ? 180 ILE A C 1 ATOM 2261 O O . ILE A 1 151 ? 41.335 -1.167 55.017 1.00 29.79 ? 180 ILE A O 1 ATOM 2262 C CB . ILE A 1 151 ? 41.622 -0.745 52.006 1.00 31.33 ? 180 ILE A CB 1 ATOM 2263 C CG1 . ILE A 1 151 ? 40.664 0.353 52.473 1.00 30.07 ? 180 ILE A CG1 1 ATOM 2264 C CG2 . ILE A 1 151 ? 40.872 -2.033 51.696 1.00 32.16 ? 180 ILE A CG2 1 ATOM 2265 C CD1 . ILE A 1 151 ? 39.735 0.853 51.388 1.00 30.18 ? 180 ILE A CD1 1 ATOM 2266 H H . ILE A 1 151 ? 43.609 -2.391 51.997 1.00 38.99 ? 180 ILE A H 1 ATOM 2267 H HA . ILE A 1 151 ? 43.039 -0.126 53.370 1.00 37.46 ? 180 ILE A HA 1 ATOM 2268 H HB . ILE A 1 151 ? 42.049 -0.443 51.190 1.00 37.59 ? 180 ILE A HB 1 ATOM 2269 H HG12 . ILE A 1 151 ? 40.117 0.005 53.195 1.00 36.08 ? 180 ILE A HG12 1 ATOM 2270 H HG13 . ILE A 1 151 ? 41.184 1.108 52.790 1.00 36.08 ? 180 ILE A HG13 1 ATOM 2271 H HG21 . ILE A 1 151 ? 40.188 -1.848 51.033 1.00 38.59 ? 180 ILE A HG21 1 ATOM 2272 H HG22 . ILE A 1 151 ? 41.499 -2.688 51.353 1.00 38.59 ? 180 ILE A HG22 1 ATOM 2273 H HG23 . ILE A 1 151 ? 40.462 -2.363 52.511 1.00 38.59 ? 180 ILE A HG23 1 ATOM 2274 H HD11 . ILE A 1 151 ? 39.162 1.543 51.757 1.00 36.21 ? 180 ILE A HD11 1 ATOM 2275 H HD12 . ILE A 1 151 ? 40.266 1.217 50.662 1.00 36.21 ? 180 ILE A HD12 1 ATOM 2276 H HD13 . ILE A 1 151 ? 39.197 0.113 51.067 1.00 36.21 ? 180 ILE A HD13 1 ATOM 2277 N N . CYS A 1 152 ? 42.511 -2.994 54.439 1.00 36.99 ? 181 CYS A N 1 ATOM 2278 C CA . CYS A 1 152 ? 42.054 -3.793 55.576 1.00 38.02 ? 181 CYS A CA 1 ATOM 2279 C C . CYS A 1 152 ? 43.211 -4.074 56.532 1.00 37.90 ? 181 CYS A C 1 ATOM 2280 O O . CYS A 1 152 ? 44.377 -3.988 56.145 1.00 39.14 ? 181 CYS A O 1 ATOM 2281 C CB . CYS A 1 152 ? 41.431 -5.104 55.094 1.00 39.47 ? 181 CYS A CB 1 ATOM 2282 S SG . CYS A 1 152 ? 40.664 -6.090 56.401 1.00 51.25 ? 181 CYS A SG 1 ATOM 2283 H H . CYS A 1 152 ? 43.039 -3.417 53.907 1.00 44.39 ? 181 CYS A H 1 ATOM 2284 H HA . CYS A 1 152 ? 41.376 -3.297 56.061 1.00 45.62 ? 181 CYS A HA 1 ATOM 2285 H HB2 . CYS A 1 152 ? 40.746 -4.900 54.439 1.00 47.37 ? 181 CYS A HB2 1 ATOM 2286 H HB3 . CYS A 1 152 ? 42.124 -5.646 54.685 1.00 47.37 ? 181 CYS A HB3 1 ATOM 2287 N N . THR A 1 153 ? 42.886 -4.412 57.779 1.00 38.85 ? 182 THR A N 1 ATOM 2288 C CA . THR A 1 153 ? 43.911 -4.669 58.787 1.00 34.80 ? 182 THR A CA 1 ATOM 2289 C C . THR A 1 153 ? 43.408 -5.539 59.937 1.00 45.08 ? 182 THR A C 1 ATOM 2290 O O . THR A 1 153 ? 42.288 -5.371 60.419 1.00 44.87 ? 182 THR A O 1 ATOM 2291 C CB . THR A 1 153 ? 44.460 -3.347 59.371 1.00 34.05 ? 182 THR A CB 1 ATOM 2292 O OG1 . THR A 1 153 ? 45.456 -3.632 60.361 1.00 41.82 ? 182 THR A OG1 1 ATOM 2293 C CG2 . THR A 1 153 ? 43.346 -2.509 59.992 1.00 32.93 ? 182 THR A CG2 1 ATOM 2294 H H . THR A 1 153 ? 42.080 -4.499 58.066 1.00 46.62 ? 182 THR A H 1 ATOM 2295 H HA . THR A 1 153 ? 44.651 -5.135 58.366 1.00 41.76 ? 182 THR A HA 1 ATOM 2296 H HB . THR A 1 153 ? 44.863 -2.829 58.657 1.00 40.87 ? 182 THR A HB 1 ATOM 2297 H HG1 . THR A 1 153 ? 46.089 -4.063 60.017 1.00 50.18 ? 182 THR A HG1 1 ATOM 2298 H HG21 . THR A 1 153 ? 43.712 -1.686 60.351 1.00 39.51 ? 182 THR A HG21 1 ATOM 2299 H HG22 . THR A 1 153 ? 42.681 -2.292 59.320 1.00 39.51 ? 182 THR A HG22 1 ATOM 2300 H HG23 . THR A 1 153 ? 42.920 -3.004 60.709 1.00 39.51 ? 182 THR A HG23 1 ATOM 2301 N N . SER A 1 154 ? 44.254 -6.474 60.362 1.00 32.89 ? 183 SER A N 1 ATOM 2302 C CA . SER A 1 154 ? 43.974 -7.319 61.521 1.00 32.64 ? 183 SER A CA 1 ATOM 2303 C C . SER A 1 154 ? 44.760 -6.838 62.738 1.00 32.22 ? 183 SER A C 1 ATOM 2304 O O . SER A 1 154 ? 44.792 -7.501 63.775 1.00 32.15 ? 183 SER A O 1 ATOM 2305 C CB . SER A 1 154 ? 44.316 -8.779 61.213 1.00 33.71 ? 183 SER A CB 1 ATOM 2306 O OG . SER A 1 154 ? 45.689 -8.926 60.896 1.00 35.23 ? 183 SER A OG 1 ATOM 2307 H H . SER A 1 154 ? 45.010 -6.642 59.989 1.00 39.47 ? 183 SER A H 1 ATOM 2308 H HA . SER A 1 154 ? 43.029 -7.268 61.732 1.00 39.17 ? 183 SER A HA 1 ATOM 2309 H HB2 . SER A 1 154 ? 44.113 -9.321 61.992 1.00 40.45 ? 183 SER A HB2 1 ATOM 2310 H HB3 . SER A 1 154 ? 43.784 -9.074 60.457 1.00 40.45 ? 183 SER A HB3 1 ATOM 2311 H HG . SER A 1 154 ? 45.879 -8.461 60.222 1.00 42.28 ? 183 SER A HG 1 ATOM 2312 N N . ARG A 1 155 ? 45.392 -5.678 62.600 1.00 34.69 ? 184 ARG A N 1 ATOM 2313 C CA . ARG A 1 155 ? 46.216 -5.111 63.658 1.00 35.60 ? 184 ARG A CA 1 ATOM 2314 C C . ARG A 1 155 ? 45.391 -4.756 64.894 1.00 34.07 ? 184 ARG A C 1 ATOM 2315 O O . ARG A 1 155 ? 45.921 -4.704 66.005 1.00 34.33 ? 184 ARG A O 1 ATOM 2316 C CB . ARG A 1 155 ? 46.946 -3.871 63.133 1.00 37.05 ? 184 ARG A CB 1 ATOM 2317 C CG . ARG A 1 155 ? 47.847 -3.192 64.146 1.00 38.55 ? 184 ARG A CG 1 ATOM 2318 C CD . ARG A 1 155 ? 48.643 -2.059 63.517 1.00 39.36 ? 184 ARG A CD 1 ATOM 2319 N NE . ARG A 1 155 ? 49.720 -2.541 62.651 1.00 40.65 ? 184 ARG A NE 1 ATOM 2320 C CZ . ARG A 1 155 ? 49.633 -2.691 61.330 1.00 41.46 ? 184 ARG A CZ 1 ATOM 2321 N NH1 . ARG A 1 155 ? 48.510 -2.403 60.683 1.00 41.79 ? 184 ARG A NH1 1 ATOM 2322 N NH2 . ARG A 1 155 ? 50.681 -3.135 60.649 1.00 36.06 ? 184 ARG A NH2 1 ATOM 2323 H H . ARG A 1 155 ? 45.358 -5.194 61.890 1.00 41.63 ? 184 ARG A H 1 ATOM 2324 H HA . ARG A 1 155 ? 46.884 -5.763 63.921 1.00 42.72 ? 184 ARG A HA 1 ATOM 2325 H HB2 . ARG A 1 155 ? 47.497 -4.132 62.379 1.00 44.46 ? 184 ARG A HB2 1 ATOM 2326 H HB3 . ARG A 1 155 ? 46.286 -3.221 62.845 1.00 44.46 ? 184 ARG A HB3 1 ATOM 2327 H HG2 . ARG A 1 155 ? 47.303 -2.822 64.859 1.00 46.26 ? 184 ARG A HG2 1 ATOM 2328 H HG3 . ARG A 1 155 ? 48.473 -3.841 64.503 1.00 46.26 ? 184 ARG A HG3 1 ATOM 2329 H HD2 . ARG A 1 155 ? 48.047 -1.513 62.980 1.00 47.24 ? 184 ARG A HD2 1 ATOM 2330 H HD3 . ARG A 1 155 ? 49.041 -1.523 64.221 1.00 47.24 ? 184 ARG A HD3 1 ATOM 2331 H HE . ARG A 1 155 ? 50.468 -2.743 63.024 1.00 48.78 ? 184 ARG A HE 1 ATOM 2332 H HH11 . ARG A 1 155 ? 47.826 -2.113 61.117 1.00 50.14 ? 184 ARG A HH11 1 ATOM 2333 H HH12 . ARG A 1 155 ? 48.467 -2.504 59.831 1.00 50.14 ? 184 ARG A HH12 1 ATOM 2334 H HH21 . ARG A 1 155 ? 51.412 -3.325 61.060 1.00 43.27 ? 184 ARG A HH21 1 ATOM 2335 H HH22 . ARG A 1 155 ? 50.628 -3.235 59.796 1.00 43.27 ? 184 ARG A HH22 1 ATOM 2336 N N . TYR A 1 156 ? 44.095 -4.525 64.695 1.00 33.14 ? 185 TYR A N 1 ATOM 2337 C CA . TYR A 1 156 ? 43.205 -4.107 65.777 1.00 32.19 ? 185 TYR A CA 1 ATOM 2338 C C . TYR A 1 156 ? 41.954 -4.978 65.857 1.00 31.59 ? 185 TYR A C 1 ATOM 2339 O O . TYR A 1 156 ? 40.841 -4.462 65.958 1.00 30.41 ? 185 TYR A O 1 ATOM 2340 C CB . TYR A 1 156 ? 42.792 -2.645 65.590 1.00 30.06 ? 185 TYR A CB 1 ATOM 2341 C CG . TYR A 1 156 ? 43.951 -1.688 65.424 1.00 30.19 ? 185 TYR A CG 1 ATOM 2342 C CD1 . TYR A 1 156 ? 44.668 -1.240 66.524 1.00 30.22 ? 185 TYR A CD1 1 ATOM 2343 C CD2 . TYR A 1 156 ? 44.319 -1.223 64.169 1.00 30.41 ? 185 TYR A CD2 1 ATOM 2344 C CE1 . TYR A 1 156 ? 45.724 -0.363 66.379 1.00 30.47 ? 185 TYR A CE1 1 ATOM 2345 C CE2 . TYR A 1 156 ? 45.373 -0.346 64.015 1.00 30.62 ? 185 TYR A CE2 1 ATOM 2346 C CZ . TYR A 1 156 ? 46.072 0.082 65.124 1.00 30.65 ? 185 TYR A CZ 1 ATOM 2347 O OH . TYR A 1 156 ? 47.125 0.956 64.980 1.00 30.98 ? 185 TYR A OH 1 ATOM 2348 H H . TYR A 1 156 ? 43.702 -4.604 63.934 1.00 39.77 ? 185 TYR A H 1 ATOM 2349 H HA . TYR A 1 156 ? 43.677 -4.181 66.621 1.00 38.62 ? 185 TYR A HA 1 ATOM 2350 H HB2 . TYR A 1 156 ? 42.238 -2.577 64.797 1.00 36.08 ? 185 TYR A HB2 1 ATOM 2351 H HB3 . TYR A 1 156 ? 42.286 -2.363 66.368 1.00 36.08 ? 185 TYR A HB3 1 ATOM 2352 H HD1 . TYR A 1 156 ? 44.436 -1.538 67.373 1.00 36.26 ? 185 TYR A HD1 1 ATOM 2353 H HD2 . TYR A 1 156 ? 43.849 -1.510 63.420 1.00 36.50 ? 185 TYR A HD2 1 ATOM 2354 H HE1 . TYR A 1 156 ? 46.197 -0.073 67.126 1.00 36.57 ? 185 TYR A HE1 1 ATOM 2355 H HE2 . TYR A 1 156 ? 45.610 -0.044 63.168 1.00 36.74 ? 185 TYR A HE2 1 ATOM 2356 H HH . TYR A 1 156 ? 47.232 1.147 64.169 1.00 37.17 ? 185 TYR A HH 1 ATOM 2357 N N . SER A 1 157 ? 42.137 -6.295 65.822 1.00 40.47 ? 186 SER A N 1 ATOM 2358 C CA . SER A 1 157 ? 41.006 -7.220 65.795 1.00 40.38 ? 186 SER A CA 1 ATOM 2359 C C . SER A 1 157 ? 41.202 -8.433 66.701 1.00 41.78 ? 186 SER A C 1 ATOM 2360 O O . SER A 1 157 ? 40.291 -9.247 66.853 1.00 41.14 ? 186 SER A O 1 ATOM 2361 C CB . SER A 1 157 ? 40.752 -7.688 64.362 1.00 39.66 ? 186 SER A CB 1 ATOM 2362 O OG . SER A 1 157 ? 40.527 -6.585 63.503 1.00 38.40 ? 186 SER A OG 1 ATOM 2363 H H . SER A 1 157 ? 42.906 -6.679 65.814 1.00 48.56 ? 186 SER A H 1 ATOM 2364 H HA . SER A 1 157 ? 40.213 -6.750 66.097 1.00 48.46 ? 186 SER A HA 1 ATOM 2365 H HB2 . SER A 1 157 ? 41.528 -8.179 64.048 1.00 47.59 ? 186 SER A HB2 1 ATOM 2366 H HB3 . SER A 1 157 ? 39.970 -8.262 64.351 1.00 47.59 ? 186 SER A HB3 1 ATOM 2367 H HG . SER A 1 157 ? 40.389 -6.854 62.720 1.00 46.09 ? 186 SER A HG 1 ATOM 2368 N N . ASN A 1 158 ? 42.382 -8.557 67.301 1.00 44.02 ? 187 ASN A N 1 ATOM 2369 C CA . ASN A 1 158 ? 42.660 -9.669 68.203 1.00 45.31 ? 187 ASN A CA 1 ATOM 2370 C C . ASN A 1 158 ? 41.708 -9.665 69.399 1.00 43.21 ? 187 ASN A C 1 ATOM 2371 O O . ASN A 1 158 ? 41.445 -8.607 69.969 1.00 42.67 ? 187 ASN A O 1 ATOM 2372 C CB . ASN A 1 158 ? 44.107 -9.610 68.692 1.00 47.98 ? 187 ASN A CB 1 ATOM 2373 C CG . ASN A 1 158 ? 45.107 -9.869 67.584 1.00 50.22 ? 187 ASN A CG 1 ATOM 2374 O OD1 . ASN A 1 158 ? 44.772 -9.803 66.401 1.00 51.13 ? 187 ASN A OD1 1 ATOM 2375 N ND2 . ASN A 1 158 ? 46.345 -10.167 67.961 1.00 51.15 ? 187 ASN A ND2 1 ATOM 2376 H H . ASN A 1 158 ? 43.039 -8.010 67.201 1.00 52.82 ? 187 ASN A H 1 ATOM 2377 H HA . ASN A 1 158 ? 42.538 -10.504 67.724 1.00 54.38 ? 187 ASN A HA 1 ATOM 2378 H HB2 . ASN A 1 158 ? 44.282 -8.729 69.056 1.00 57.58 ? 187 ASN A HB2 1 ATOM 2379 H HB3 . ASN A 1 158 ? 44.237 -10.285 69.377 1.00 57.58 ? 187 ASN A HB3 1 ATOM 2380 H HD21 . ASN A 1 158 ? 46.949 -10.322 67.369 1.00 61.39 ? 187 ASN A HD21 1 ATOM 2381 H HD22 . ASN A 1 158 ? 46.542 -10.205 68.797 1.00 61.39 ? 187 ASN A HD22 1 ATOM 2382 N N . PRO A 1 159 ? 41.179 -10.843 69.781 1.00 40.27 ? 188 PRO A N 1 ATOM 2383 C CA . PRO A 1 159 ? 40.290 -10.891 70.949 1.00 39.28 ? 188 PRO A CA 1 ATOM 2384 C C . PRO A 1 159 ? 40.976 -10.404 72.220 1.00 39.22 ? 188 PRO A C 1 ATOM 2385 O O . PRO A 1 159 ? 40.346 -9.746 73.047 1.00 38.82 ? 188 PRO A O 1 ATOM 2386 C CB . PRO A 1 159 ? 39.929 -12.377 71.061 1.00 39.09 ? 188 PRO A CB 1 ATOM 2387 C CG . PRO A 1 159 ? 40.145 -12.928 69.702 1.00 39.54 ? 188 PRO A CG 1 ATOM 2388 C CD . PRO A 1 159 ? 41.290 -12.158 69.125 1.00 40.08 ? 188 PRO A CD 1 ATOM 2389 H HA . PRO A 1 159 ? 39.486 -10.371 70.790 1.00 47.14 ? 188 PRO A HA 1 ATOM 2390 H HB2 . PRO A 1 159 ? 40.513 -12.808 71.704 1.00 46.90 ? 188 PRO A HB2 1 ATOM 2391 H HB3 . PRO A 1 159 ? 39.000 -12.469 71.325 1.00 46.90 ? 188 PRO A HB3 1 ATOM 2392 H HG2 . PRO A 1 159 ? 40.366 -13.871 69.765 1.00 47.44 ? 188 PRO A HG2 1 ATOM 2393 H HG3 . PRO A 1 159 ? 39.345 -12.800 69.169 1.00 47.44 ? 188 PRO A HG3 1 ATOM 2394 H HD2 . PRO A 1 159 ? 42.132 -12.581 69.354 1.00 48.10 ? 188 PRO A HD2 1 ATOM 2395 H HD3 . PRO A 1 159 ? 41.187 -12.067 68.165 1.00 48.10 ? 188 PRO A HD3 1 ATOM 2396 N N . PHE A 1 160 ? 42.255 -10.734 72.367 1.00 44.18 ? 189 PHE A N 1 ATOM 2397 C CA . PHE A 1 160 ? 43.050 -10.259 73.493 1.00 44.40 ? 189 PHE A CA 1 ATOM 2398 C C . PHE A 1 160 ? 43.716 -8.931 73.135 1.00 43.41 ? 189 PHE A C 1 ATOM 2399 O O . PHE A 1 160 ? 44.339 -8.820 72.079 1.00 43.22 ? 189 PHE A O 1 ATOM 2400 C CB . PHE A 1 160 ? 44.108 -11.295 73.881 1.00 45.83 ? 189 PHE A CB 1 ATOM 2401 C CG . PHE A 1 160 ? 43.538 -12.617 74.321 1.00 46.38 ? 189 PHE A CG 1 ATOM 2402 C CD1 . PHE A 1 160 ? 42.355 -12.676 75.040 1.00 46.22 ? 189 PHE A CD1 1 ATOM 2403 C CD2 . PHE A 1 160 ? 44.188 -13.801 74.015 1.00 47.15 ? 189 PHE A CD2 1 ATOM 2404 C CE1 . PHE A 1 160 ? 41.833 -13.890 75.445 1.00 46.38 ? 189 PHE A CE1 1 ATOM 2405 C CE2 . PHE A 1 160 ? 43.669 -15.018 74.417 1.00 47.17 ? 189 PHE A CE2 1 ATOM 2406 C CZ . PHE A 1 160 ? 42.490 -15.061 75.133 1.00 46.73 ? 189 PHE A CZ 1 ATOM 2407 H H . PHE A 1 160 ? 42.690 -11.237 71.822 1.00 53.02 ? 189 PHE A H 1 ATOM 2408 H HA . PHE A 1 160 ? 42.470 -10.114 74.258 1.00 53.28 ? 189 PHE A HA 1 ATOM 2409 H HB2 . PHE A 1 160 ? 44.679 -11.460 73.114 1.00 54.99 ? 189 PHE A HB2 1 ATOM 2410 H HB3 . PHE A 1 160 ? 44.637 -10.942 74.613 1.00 54.99 ? 189 PHE A HB3 1 ATOM 2411 H HD1 . PHE A 1 160 ? 41.908 -11.889 75.253 1.00 55.47 ? 189 PHE A HD1 1 ATOM 2412 H HD2 . PHE A 1 160 ? 44.983 -13.778 73.533 1.00 56.57 ? 189 PHE A HD2 1 ATOM 2413 H HE1 . PHE A 1 160 ? 41.038 -13.916 75.927 1.00 55.65 ? 189 PHE A HE1 1 ATOM 2414 H HE2 . PHE A 1 160 ? 44.114 -15.807 74.206 1.00 56.60 ? 189 PHE A HE2 1 ATOM 2415 H HZ . PHE A 1 160 ? 42.139 -15.878 75.405 1.00 56.07 ? 189 PHE A HZ 1 ATOM 2416 N N . PRO A 1 161 ? 43.603 -7.916 74.010 1.00 37.32 ? 190 PRO A N 1 ATOM 2417 C CA . PRO A 1 161 ? 42.932 -7.914 75.315 1.00 37.17 ? 190 PRO A CA 1 ATOM 2418 C C . PRO A 1 161 ? 41.414 -7.835 75.191 1.00 37.30 ? 190 PRO A C 1 ATOM 2419 O O . PRO A 1 161 ? 40.905 -7.103 74.344 1.00 37.91 ? 190 PRO A O 1 ATOM 2420 C CB . PRO A 1 161 ? 43.493 -6.662 75.988 1.00 36.99 ? 190 PRO A CB 1 ATOM 2421 C CG . PRO A 1 161 ? 43.768 -5.734 74.861 1.00 36.75 ? 190 PRO A CG 1 ATOM 2422 C CD . PRO A 1 161 ? 44.156 -6.590 73.680 1.00 37.11 ? 190 PRO A CD 1 ATOM 2423 H HA . PRO A 1 161 ? 43.178 -8.699 75.829 1.00 44.61 ? 190 PRO A HA 1 ATOM 2424 H HB2 . PRO A 1 161 ? 42.832 -6.287 76.591 1.00 44.39 ? 190 PRO A HB2 1 ATOM 2425 H HB3 . PRO A 1 161 ? 44.310 -6.881 76.463 1.00 44.39 ? 190 PRO A HB3 1 ATOM 2426 H HG2 . PRO A 1 161 ? 42.968 -5.223 74.661 1.00 44.09 ? 190 PRO A HG2 1 ATOM 2427 H HG3 . PRO A 1 161 ? 44.497 -5.140 75.102 1.00 44.09 ? 190 PRO A HG3 1 ATOM 2428 H HD2 . PRO A 1 161 ? 43.750 -6.249 72.868 1.00 44.54 ? 190 PRO A HD2 1 ATOM 2429 H HD3 . PRO A 1 161 ? 45.122 -6.638 73.601 1.00 44.54 ? 190 PRO A HD3 1 ATOM 2430 N N . CYS A 1 162 ? 40.705 -8.582 76.032 1.00 41.07 ? 191 CYS A N 1 ATOM 2431 C CA . CYS A 1 162 ? 39.246 -8.604 76.007 1.00 40.58 ? 191 CYS A CA 1 ATOM 2432 C C . CYS A 1 162 ? 38.639 -7.310 76.546 1.00 40.15 ? 191 CYS A C 1 ATOM 2433 O O . CYS A 1 162 ? 37.421 -7.134 76.522 1.00 40.43 ? 191 CYS A O 1 ATOM 2434 C CB . CYS A 1 162 ? 38.719 -9.790 76.813 1.00 41.14 ? 191 CYS A CB 1 ATOM 2435 S SG . CYS A 1 162 ? 39.102 -11.402 76.103 1.00 39.43 ? 191 CYS A SG 1 ATOM 2436 H H . CYS A 1 162 ? 41.050 -9.091 76.634 1.00 49.28 ? 191 CYS A H 1 ATOM 2437 H HA . CYS A 1 162 ? 38.950 -8.712 75.089 1.00 48.70 ? 191 CYS A HA 1 ATOM 2438 H HB2 . CYS A 1 162 ? 39.109 -9.760 77.701 1.00 49.37 ? 191 CYS A HB2 1 ATOM 2439 H HB3 . CYS A 1 162 ? 37.754 -9.719 76.877 1.00 49.37 ? 191 CYS A HB3 1 ATOM 2440 N N . THR A 1 163 ? 39.487 -6.413 77.039 1.00 34.69 ? 192 THR A N 1 ATOM 2441 C CA . THR A 1 163 ? 39.028 -5.124 77.538 1.00 34.79 ? 192 THR A CA 1 ATOM 2442 C C . THR A 1 163 ? 40.117 -4.072 77.370 1.00 34.55 ? 192 THR A C 1 ATOM 2443 O O . THR A 1 163 ? 41.306 -4.374 77.474 1.00 34.72 ? 192 THR A O 1 ATOM 2444 C CB . THR A 1 163 ? 38.611 -5.209 79.023 1.00 36.17 ? 192 THR A CB 1 ATOM 2445 O OG1 . THR A 1 163 ? 38.111 -3.940 79.461 1.00 36.76 ? 192 THR A OG1 1 ATOM 2446 C CG2 . THR A 1 163 ? 39.788 -5.620 79.897 1.00 37.19 ? 192 THR A CG2 1 ATOM 2447 H H . THR A 1 163 ? 40.337 -6.528 77.095 1.00 41.63 ? 192 THR A H 1 ATOM 2448 H HA . THR A 1 163 ? 38.255 -4.842 77.024 1.00 41.75 ? 192 THR A HA 1 ATOM 2449 H HB . THR A 1 163 ? 37.915 -5.877 79.120 1.00 43.41 ? 192 THR A HB 1 ATOM 2450 H HG1 . THR A 1 163 ? 37.443 -3.721 79.002 1.00 44.11 ? 192 THR A HG1 1 ATOM 2451 H HG21 . THR A 1 163 ? 39.510 -5.669 80.825 1.00 44.63 ? 192 THR A HG21 1 ATOM 2452 H HG22 . THR A 1 163 ? 40.119 -6.489 79.621 1.00 44.63 ? 192 THR A HG22 1 ATOM 2453 H HG23 . THR A 1 163 ? 40.504 -4.970 79.816 1.00 44.63 ? 192 THR A HG23 1 ATOM 2454 N N . GLY A 1 164 ? 39.703 -2.838 77.102 1.00 29.62 ? 193 GLY A N 1 ATOM 2455 C CA . GLY A 1 164 ? 40.638 -1.745 76.915 1.00 29.62 ? 193 GLY A CA 1 ATOM 2456 C C . GLY A 1 164 ? 41.343 -1.781 75.572 1.00 29.26 ? 193 GLY A C 1 ATOM 2457 O O . GLY A 1 164 ? 42.167 -0.915 75.280 1.00 29.29 ? 193 GLY A O 1 ATOM 2458 H H . GLY A 1 164 ? 38.878 -2.610 77.023 1.00 35.54 ? 193 GLY A H 1 ATOM 2459 H HA2 . GLY A 1 164 ? 40.163 -0.902 76.987 1.00 35.55 ? 193 GLY A HA2 1 ATOM 2460 H HA3 . GLY A 1 164 ? 41.311 -1.776 77.613 1.00 35.55 ? 193 GLY A HA3 1 ATOM 2461 N N . GLY A 1 165 ? 41.028 -2.782 74.755 1.00 30.32 ? 194 GLY A N 1 ATOM 2462 C CA . GLY A 1 165 ? 41.601 -2.883 73.425 1.00 34.02 ? 194 GLY A CA 1 ATOM 2463 C C . GLY A 1 165 ? 41.174 -1.710 72.563 1.00 33.08 ? 194 GLY A C 1 ATOM 2464 O O . GLY A 1 165 ? 40.000 -1.336 72.558 1.00 29.39 ? 194 GLY A O 1 ATOM 2465 H H . GLY A 1 165 ? 40.481 -3.416 74.951 1.00 36.38 ? 194 GLY A H 1 ATOM 2466 H HA2 . GLY A 1 165 ? 42.570 -2.891 73.484 1.00 40.83 ? 194 GLY A HA2 1 ATOM 2467 H HA3 . GLY A 1 165 ? 41.307 -3.705 73.002 1.00 40.83 ? 194 GLY A HA3 1 ATOM 2468 N N . GLU A 1 166 ? 42.127 -1.130 71.837 1.00 38.42 ? 195 GLU A N 1 ATOM 2469 C CA . GLU A 1 166 ? 41.865 0.059 71.033 1.00 38.45 ? 195 GLU A CA 1 ATOM 2470 C C . GLU A 1 166 ? 41.927 -0.227 69.537 1.00 38.46 ? 195 GLU A C 1 ATOM 2471 O O . GLU A 1 166 ? 42.717 -1.053 69.082 1.00 40.90 ? 195 GLU A O 1 ATOM 2472 C CB . GLU A 1 166 ? 42.864 1.164 71.383 1.00 39.50 ? 195 GLU A CB 1 ATOM 2473 C CG . GLU A 1 166 ? 44.312 0.839 71.036 1.00 41.83 ? 195 GLU A CG 1 ATOM 2474 C CD . GLU A 1 166 ? 45.252 1.994 71.318 1.00 44.37 ? 195 GLU A CD 1 ATOM 2475 O OE1 . GLU A 1 166 ? 46.424 1.925 70.889 1.00 45.90 ? 195 GLU A OE1 1 ATOM 2476 O OE2 . GLU A 1 166 ? 44.821 2.973 71.966 1.00 44.67 ? 195 GLU A OE2 1 ATOM 2477 H H . GLU A 1 166 ? 42.939 -1.410 71.793 1.00 46.10 ? 195 GLU A H 1 ATOM 2478 H HA . GLU A 1 166 ? 40.975 0.386 71.237 1.00 46.14 ? 195 GLU A HA 1 ATOM 2479 H HB2 . GLU A 1 166 ? 42.620 1.969 70.900 1.00 47.40 ? 195 GLU A HB2 1 ATOM 2480 H HB3 . GLU A 1 166 ? 42.821 1.331 72.338 1.00 47.40 ? 195 GLU A HB3 1 ATOM 2481 H HG2 . GLU A 1 166 ? 44.602 0.080 71.566 1.00 50.19 ? 195 GLU A HG2 1 ATOM 2482 H HG3 . GLU A 1 166 ? 44.371 0.627 70.091 1.00 50.19 ? 195 GLU A HG3 1 ATOM 2483 N N . VAL A 1 167 ? 41.079 0.467 68.783 1.00 27.48 ? 196 VAL A N 1 ATOM 2484 C CA . VAL A 1 167 ? 41.115 0.436 67.325 1.00 27.46 ? 196 VAL A CA 1 ATOM 2485 C C . VAL A 1 167 ? 41.497 1.827 66.834 1.00 27.24 ? 196 VAL A C 1 ATOM 2486 O O . VAL A 1 167 ? 41.031 2.830 67.376 1.00 26.94 ? 196 VAL A O 1 ATOM 2487 C CB . VAL A 1 167 ? 39.761 0.011 66.725 1.00 27.35 ? 196 VAL A CB 1 ATOM 2488 C CG1 . VAL A 1 167 ? 39.833 -0.026 65.204 1.00 27.51 ? 196 VAL A CG1 1 ATOM 2489 C CG2 . VAL A 1 167 ? 39.344 -1.348 67.271 1.00 27.61 ? 196 VAL A CG2 1 ATOM 2490 H H . VAL A 1 167 ? 40.462 0.975 69.100 1.00 32.98 ? 196 VAL A H 1 ATOM 2491 H HA . VAL A 1 167 ? 41.793 -0.192 67.031 1.00 32.95 ? 196 VAL A HA 1 ATOM 2492 H HB . VAL A 1 167 ? 39.084 0.658 66.979 1.00 32.82 ? 196 VAL A HB 1 ATOM 2493 H HG11 . VAL A 1 167 ? 38.969 -0.296 64.853 1.00 33.01 ? 196 VAL A HG11 1 ATOM 2494 H HG12 . VAL A 1 167 ? 40.062 0.858 64.877 1.00 33.01 ? 196 VAL A HG12 1 ATOM 2495 H HG13 . VAL A 1 167 ? 40.513 -0.664 64.936 1.00 33.01 ? 196 VAL A HG13 1 ATOM 2496 H HG21 . VAL A 1 167 ? 38.491 -1.596 66.881 1.00 33.14 ? 196 VAL A HG21 1 ATOM 2497 H HG22 . VAL A 1 167 ? 40.019 -2.003 67.034 1.00 33.14 ? 196 VAL A HG22 1 ATOM 2498 H HG23 . VAL A 1 167 ? 39.263 -1.289 68.235 1.00 33.14 ? 196 VAL A HG23 1 ATOM 2499 N N . ILE A 1 168 ? 42.343 1.884 65.810 1.00 27.47 ? 197 ILE A N 1 ATOM 2500 C CA . ILE A 1 168 ? 42.891 3.153 65.347 1.00 27.35 ? 197 ILE A CA 1 ATOM 2501 C C . ILE A 1 168 ? 42.958 3.219 63.825 1.00 27.49 ? 197 ILE A C 1 ATOM 2502 O O . ILE A 1 168 ? 43.196 2.218 63.150 1.00 27.96 ? 197 ILE A O 1 ATOM 2503 C CB . ILE A 1 168 ? 44.307 3.392 65.929 1.00 27.78 ? 197 ILE A CB 1 ATOM 2504 C CG1 . ILE A 1 168 ? 44.246 3.451 67.458 1.00 27.77 ? 197 ILE A CG1 1 ATOM 2505 C CG2 . ILE A 1 168 ? 44.915 4.684 65.378 1.00 27.76 ? 197 ILE A CG2 1 ATOM 2506 C CD1 . ILE A 1 168 ? 45.593 3.580 68.135 1.00 28.38 ? 197 ILE A CD1 1 ATOM 2507 H H . ILE A 1 168 ? 42.616 1.200 65.366 1.00 32.96 ? 197 ILE A H 1 ATOM 2508 H HA . ILE A 1 168 ? 42.317 3.873 65.652 1.00 32.83 ? 197 ILE A HA 1 ATOM 2509 H HB . ILE A 1 168 ? 44.875 2.649 65.671 1.00 33.33 ? 197 ILE A HB 1 ATOM 2510 H HG12 . ILE A 1 168 ? 43.712 4.218 67.718 1.00 33.33 ? 197 ILE A HG12 1 ATOM 2511 H HG13 . ILE A 1 168 ? 43.830 2.638 67.784 1.00 33.33 ? 197 ILE A HG13 1 ATOM 2512 H HG21 . ILE A 1 168 ? 45.798 4.805 65.760 1.00 33.31 ? 197 ILE A HG21 1 ATOM 2513 H HG22 . ILE A 1 168 ? 44.978 4.616 64.412 1.00 33.31 ? 197 ILE A HG22 1 ATOM 2514 H HG23 . ILE A 1 168 ? 44.344 5.430 65.620 1.00 33.31 ? 197 ILE A HG23 1 ATOM 2515 H HD11 . ILE A 1 168 ? 45.462 3.610 69.096 1.00 34.06 ? 197 ILE A HD11 1 ATOM 2516 H HD12 . ILE A 1 168 ? 46.139 2.814 67.899 1.00 34.06 ? 197 ILE A HD12 1 ATOM 2517 H HD13 . ILE A 1 168 ? 46.021 4.397 67.833 1.00 34.06 ? 197 ILE A HD13 1 ATOM 2518 N N . PHE A 1 169 ? 42.736 4.419 63.300 1.00 27.18 ? 198 PHE A N 1 ATOM 2519 C CA . PHE A 1 169 ? 42.972 4.710 61.897 1.00 27.40 ? 198 PHE A CA 1 ATOM 2520 C C . PHE A 1 169 ? 43.566 6.102 61.769 1.00 49.68 ? 198 PHE A C 1 ATOM 2521 O O . PHE A 1 169 ? 43.137 7.028 62.454 1.00 26.78 ? 198 PHE A O 1 ATOM 2522 C CB . PHE A 1 169 ? 41.684 4.619 61.082 1.00 27.25 ? 198 PHE A CB 1 ATOM 2523 C CG . PHE A 1 169 ? 41.816 5.176 59.694 1.00 27.47 ? 198 PHE A CG 1 ATOM 2524 C CD1 . PHE A 1 169 ? 42.412 4.432 58.691 1.00 28.19 ? 198 PHE A CD1 1 ATOM 2525 C CD2 . PHE A 1 169 ? 41.358 6.448 59.396 1.00 27.07 ? 198 PHE A CD2 1 ATOM 2526 C CE1 . PHE A 1 169 ? 42.541 4.942 57.414 1.00 28.53 ? 198 PHE A CE1 1 ATOM 2527 C CE2 . PHE A 1 169 ? 41.486 6.964 58.121 1.00 27.32 ? 198 PHE A CE2 1 ATOM 2528 C CZ . PHE A 1 169 ? 42.078 6.211 57.130 1.00 28.06 ? 198 PHE A CZ 1 ATOM 2529 H H . PHE A 1 169 ? 42.443 5.092 63.748 1.00 32.62 ? 198 PHE A H 1 ATOM 2530 H HA . PHE A 1 169 ? 43.607 4.071 61.537 1.00 32.88 ? 198 PHE A HA 1 ATOM 2531 H HB2 . PHE A 1 169 ? 41.426 3.687 61.006 1.00 32.70 ? 198 PHE A HB2 1 ATOM 2532 H HB3 . PHE A 1 169 ? 40.988 5.118 61.538 1.00 32.70 ? 198 PHE A HB3 1 ATOM 2533 H HD1 . PHE A 1 169 ? 42.726 3.576 58.877 1.00 33.83 ? 198 PHE A HD1 1 ATOM 2534 H HD2 . PHE A 1 169 ? 40.958 6.960 60.062 1.00 32.48 ? 198 PHE A HD2 1 ATOM 2535 H HE1 . PHE A 1 169 ? 42.941 4.433 56.747 1.00 34.24 ? 198 PHE A HE1 1 ATOM 2536 H HE2 . PHE A 1 169 ? 41.172 7.819 57.931 1.00 32.79 ? 198 PHE A HE2 1 ATOM 2537 H HZ . PHE A 1 169 ? 42.164 6.556 56.270 1.00 33.68 ? 198 PHE A HZ 1 ATOM 2538 N N . ARG A 1 170 ? 44.553 6.240 60.890 1.00 56.30 ? 199 ARG A N 1 ATOM 2539 C CA . ARG A 1 170 ? 45.210 7.520 60.664 1.00 57.97 ? 199 ARG A CA 1 ATOM 2540 C C . ARG A 1 170 ? 45.073 7.943 59.206 1.00 59.36 ? 199 ARG A C 1 ATOM 2541 O O . ARG A 1 170 ? 45.595 7.287 58.305 1.00 58.65 ? 199 ARG A O 1 ATOM 2542 C CB . ARG A 1 170 ? 46.686 7.440 61.058 1.00 59.28 ? 199 ARG A CB 1 ATOM 2543 C CG . ARG A 1 170 ? 46.925 6.946 62.479 1.00 58.47 ? 199 ARG A CG 1 ATOM 2544 C CD . ARG A 1 170 ? 48.408 6.746 62.754 1.00 57.24 ? 199 ARG A CD 1 ATOM 2545 N NE . ARG A 1 170 ? 48.650 6.152 64.067 1.00 56.06 ? 199 ARG A NE 1 ATOM 2546 C CZ . ARG A 1 170 ? 49.856 5.878 64.555 1.00 57.73 ? 199 ARG A CZ 1 ATOM 2547 N NH1 . ARG A 1 170 ? 50.944 6.144 63.842 1.00 59.29 ? 199 ARG A NH1 1 ATOM 2548 N NH2 . ARG A 1 170 ? 49.977 5.336 65.760 1.00 58.25 ? 199 ARG A NH2 1 ATOM 2549 H H . ARG A 1 170 ? 44.864 5.599 60.407 1.00 67.55 ? 199 ARG A H 1 ATOM 2550 H HA . ARG A 1 170 ? 44.786 8.196 61.215 1.00 69.57 ? 199 ARG A HA 1 ATOM 2551 H HB2 . ARG A 1 170 ? 47.138 6.831 60.453 1.00 71.14 ? 199 ARG A HB2 1 ATOM 2552 H HB3 . ARG A 1 170 ? 47.077 8.325 60.984 1.00 71.14 ? 199 ARG A HB3 1 ATOM 2553 H HG2 . ARG A 1 170 ? 46.584 7.600 63.108 1.00 70.17 ? 199 ARG A HG2 1 ATOM 2554 H HG3 . ARG A 1 170 ? 46.476 6.095 62.602 1.00 70.17 ? 199 ARG A HG3 1 ATOM 2555 H HD2 . ARG A 1 170 ? 48.779 6.155 62.082 1.00 68.69 ? 199 ARG A HD2 1 ATOM 2556 H HD3 . ARG A 1 170 ? 48.855 7.607 62.726 1.00 68.69 ? 199 ARG A HD3 1 ATOM 2557 H HE . ARG A 1 170 ? 47.967 5.967 64.556 1.00 67.27 ? 199 ARG A HE 1 ATOM 2558 H HH11 . ARG A 1 170 ? 50.871 6.494 63.061 1.00 71.14 ? 199 ARG A HH11 1 ATOM 2559 H HH12 . ARG A 1 170 ? 51.722 5.965 64.162 1.00 71.14 ? 199 ARG A HH12 1 ATOM 2560 H HH21 . ARG A 1 170 ? 49.275 5.162 66.226 1.00 69.89 ? 199 ARG A HH21 1 ATOM 2561 H HH22 . ARG A 1 170 ? 50.757 5.159 66.076 1.00 69.89 ? 199 ARG A HH22 1 ATOM 2562 N N . ALA A 1 171 ? 44.360 9.042 58.982 1.00 43.53 ? 200 ALA A N 1 ATOM 2563 C CA . ALA A 1 171 ? 44.194 9.579 57.639 1.00 45.72 ? 200 ALA A CA 1 ATOM 2564 C C . ALA A 1 171 ? 45.525 10.098 57.114 1.00 49.85 ? 200 ALA A C 1 ATOM 2565 O O . ALA A 1 171 ? 45.841 9.940 55.935 1.00 50.36 ? 200 ALA A O 1 ATOM 2566 C CB . ALA A 1 171 ? 43.152 10.683 57.630 1.00 43.44 ? 200 ALA A CB 1 ATOM 2567 H H . ALA A 1 171 ? 43.962 9.496 59.594 1.00 52.24 ? 200 ALA A H 1 ATOM 2568 H HA . ALA A 1 171 ? 43.891 8.872 57.049 1.00 54.86 ? 200 ALA A HA 1 ATOM 2569 H HB1 . ALA A 1 171 ? 43.060 11.022 56.727 1.00 52.13 ? 200 ALA A HB1 1 ATOM 2570 H HB2 . ALA A 1 171 ? 42.305 10.319 57.935 1.00 52.13 ? 200 ALA A HB2 1 ATOM 2571 H HB3 . ALA A 1 171 ? 43.440 11.393 58.224 1.00 52.13 ? 200 ALA A HB3 1 ATOM 2572 N N . LEU A 1 172 ? 46.305 10.718 57.996 1.00 51.18 ? 201 LEU A N 1 ATOM 2573 C CA . LEU A 1 172 ? 47.632 11.205 57.636 1.00 55.84 ? 201 LEU A CA 1 ATOM 2574 C C . LEU A 1 172 ? 48.597 10.039 57.427 1.00 56.09 ? 201 LEU A C 1 ATOM 2575 O O . LEU A 1 172 ? 49.577 9.884 58.157 1.00 55.87 ? 201 LEU A O 1 ATOM 2576 C CB . LEU A 1 172 ? 48.170 12.156 58.713 1.00 59.98 ? 201 LEU A CB 1 ATOM 2577 C CG . LEU A 1 172 ? 47.704 13.614 58.656 1.00 62.63 ? 201 LEU A CG 1 ATOM 2578 C CD1 . LEU A 1 172 ? 48.248 14.303 57.412 1.00 63.88 ? 201 LEU A CD1 1 ATOM 2579 C CD2 . LEU A 1 172 ? 46.191 13.714 58.708 1.00 62.98 ? 201 LEU A CD2 1 ATOM 2580 H H . LEU A 1 172 ? 46.086 10.870 58.813 1.00 61.41 ? 201 LEU A H 1 ATOM 2581 H HA . LEU A 1 172 ? 47.573 11.699 56.803 1.00 67.01 ? 201 LEU A HA 1 ATOM 2582 H HB2 . LEU A 1 172 ? 47.909 11.808 59.580 1.00 71.98 ? 201 LEU A HB2 1 ATOM 2583 H HB3 . LEU A 1 172 ? 49.138 12.164 58.651 1.00 71.98 ? 201 LEU A HB3 1 ATOM 2584 H HG . LEU A 1 172 ? 48.056 14.082 59.429 1.00 75.16 ? 201 LEU A HG 1 ATOM 2585 H HD11 . LEU A 1 172 ? 47.939 15.223 57.400 1.00 76.66 ? 201 LEU A HD11 1 ATOM 2586 H HD12 . LEU A 1 172 ? 49.218 14.280 57.437 1.00 76.66 ? 201 LEU A HD12 1 ATOM 2587 H HD13 . LEU A 1 172 ? 47.926 13.836 56.626 1.00 76.66 ? 201 LEU A HD13 1 ATOM 2588 H HD21 . LEU A 1 172 ? 45.935 14.649 58.669 1.00 75.58 ? 201 LEU A HD21 1 ATOM 2589 H HD22 . LEU A 1 172 ? 45.817 13.237 57.950 1.00 75.58 ? 201 LEU A HD22 1 ATOM 2590 H HD23 . LEU A 1 172 ? 45.877 13.319 59.536 1.00 75.58 ? 201 LEU A HD23 1 ATOM 2591 N N . SER A 1 173 ? 48.305 9.213 56.428 1.00 90.45 ? 202 SER A N 1 ATOM 2592 C CA . SER A 1 173 ? 49.176 8.104 56.068 1.00 91.53 ? 202 SER A CA 1 ATOM 2593 C C . SER A 1 173 ? 50.456 8.646 55.435 1.00 92.54 ? 202 SER A C 1 ATOM 2594 O O . SER A 1 173 ? 50.507 9.820 55.072 1.00 88.88 ? 202 SER A O 1 ATOM 2595 C CB . SER A 1 173 ? 48.452 7.152 55.113 1.00 91.89 ? 202 SER A CB 1 ATOM 2596 O OG . SER A 1 173 ? 47.385 6.490 55.771 1.00 91.48 ? 202 SER A OG 1 ATOM 2597 H H . SER A 1 173 ? 47.601 9.276 55.938 1.00 108.54 ? 202 SER A H 1 ATOM 2598 H HA . SER A 1 173 ? 49.416 7.611 56.868 1.00 109.84 ? 202 SER A HA 1 ATOM 2599 H HB2 . SER A 1 173 ? 48.096 7.662 54.369 1.00 110.27 ? 202 SER A HB2 1 ATOM 2600 H HB3 . SER A 1 173 ? 49.083 6.490 54.790 1.00 110.27 ? 202 SER A HB3 1 ATOM 2601 H HG . SER A 1 173 ? 46.996 5.971 55.237 1.00 109.78 ? 202 SER A HG 1 ATOM 2602 N N . PRO A 1 174 ? 51.497 7.801 55.314 1.00 106.67 ? 203 PRO A N 1 ATOM 2603 C CA . PRO A 1 174 ? 52.773 8.214 54.716 1.00 108.37 ? 203 PRO A CA 1 ATOM 2604 C C . PRO A 1 174 ? 52.658 9.027 53.420 1.00 108.84 ? 203 PRO A C 1 ATOM 2605 O O . PRO A 1 174 ? 53.459 9.941 53.223 1.00 109.41 ? 203 PRO A O 1 ATOM 2606 C CB . PRO A 1 174 ? 53.482 6.877 54.443 1.00 109.85 ? 203 PRO A CB 1 ATOM 2607 C CG . PRO A 1 174 ? 52.625 5.795 55.088 1.00 109.15 ? 203 PRO A CG 1 ATOM 2608 C CD . PRO A 1 174 ? 51.622 6.480 55.949 1.00 107.26 ? 203 PRO A CD 1 ATOM 2609 H HA . PRO A 1 174 ? 53.293 8.720 55.361 1.00 130.04 ? 203 PRO A HA 1 ATOM 2610 H HB2 . PRO A 1 174 ? 53.544 6.734 53.485 1.00 131.83 ? 203 PRO A HB2 1 ATOM 2611 H HB3 . PRO A 1 174 ? 54.366 6.892 54.842 1.00 131.83 ? 203 PRO A HB3 1 ATOM 2612 H HG2 . PRO A 1 174 ? 52.179 5.284 54.394 1.00 130.98 ? 203 PRO A HG2 1 ATOM 2613 H HG3 . PRO A 1 174 ? 53.189 5.216 55.623 1.00 130.98 ? 203 PRO A HG3 1 ATOM 2614 H HD2 . PRO A 1 174 ? 50.774 6.009 55.925 1.00 128.72 ? 203 PRO A HD2 1 ATOM 2615 H HD3 . PRO A 1 174 ? 51.956 6.569 56.856 1.00 128.72 ? 203 PRO A HD3 1 ATOM 2616 N N . PRO A 1 175 ? 51.692 8.701 52.545 1.00 80.26 ? 204 PRO A N 1 ATOM 2617 C CA . PRO A 1 175 ? 51.548 9.506 51.325 1.00 74.99 ? 204 PRO A CA 1 ATOM 2618 C C . PRO A 1 175 ? 51.000 10.917 51.561 1.00 72.37 ? 204 PRO A C 1 ATOM 2619 O O . PRO A 1 175 ? 51.276 11.811 50.760 1.00 68.58 ? 204 PRO A O 1 ATOM 2620 C CB . PRO A 1 175 ? 50.558 8.691 50.481 1.00 72.20 ? 204 PRO A CB 1 ATOM 2621 C CG . PRO A 1 175 ? 50.599 7.316 51.043 1.00 72.84 ? 204 PRO A CG 1 ATOM 2622 C CD . PRO A 1 175 ? 50.851 7.493 52.500 1.00 75.38 ? 204 PRO A CD 1 ATOM 2623 H HA . PRO A 1 175 ? 52.396 9.564 50.858 1.00 89.99 ? 204 PRO A HA 1 ATOM 2624 H HB2 . PRO A 1 175 ? 49.669 9.069 50.567 1.00 86.65 ? 204 PRO A HB2 1 ATOM 2625 H HB3 . PRO A 1 175 ? 50.842 8.691 49.554 1.00 86.65 ? 204 PRO A HB3 1 ATOM 2626 H HG2 . PRO A 1 175 ? 49.747 6.877 50.894 1.00 87.40 ? 204 PRO A HG2 1 ATOM 2627 H HG3 . PRO A 1 175 ? 51.320 6.816 50.629 1.00 87.40 ? 204 PRO A HG3 1 ATOM 2628 H HD2 . PRO A 1 175 ? 50.018 7.641 52.973 1.00 90.46 ? 204 PRO A HD2 1 ATOM 2629 H HD3 . PRO A 1 175 ? 51.334 6.730 52.855 1.00 90.46 ? 204 PRO A HD3 1 ATOM 2630 N N . TYR A 1 176 ? 50.245 11.109 52.640 1.00 67.72 ? 205 TYR A N 1 ATOM 2631 C CA . TYR A 1 176 ? 49.473 12.336 52.828 1.00 73.39 ? 205 TYR A CA 1 ATOM 2632 C C . TYR A 1 176 ? 50.085 13.337 53.813 1.00 69.39 ? 205 TYR A C 1 ATOM 2633 O O . TYR A 1 176 ? 49.651 14.488 53.867 1.00 68.40 ? 205 TYR A O 1 ATOM 2634 C CB . TYR A 1 176 ? 48.055 11.984 53.286 1.00 82.16 ? 205 TYR A CB 1 ATOM 2635 C CG . TYR A 1 176 ? 47.288 11.139 52.292 1.00 92.48 ? 205 TYR A CG 1 ATOM 2636 C CD1 . TYR A 1 176 ? 46.825 11.683 51.101 1.00 97.26 ? 205 TYR A CD1 1 ATOM 2637 C CD2 . TYR A 1 176 ? 47.022 9.801 52.546 1.00 97.58 ? 205 TYR A CD2 1 ATOM 2638 C CE1 . TYR A 1 176 ? 46.123 10.917 50.190 1.00 101.45 ? 205 TYR A CE1 1 ATOM 2639 C CE2 . TYR A 1 176 ? 46.321 9.027 51.641 1.00 101.74 ? 205 TYR A CE2 1 ATOM 2640 C CZ . TYR A 1 176 ? 45.873 9.590 50.465 1.00 104.23 ? 205 TYR A CZ 1 ATOM 2641 O OH . TYR A 1 176 ? 45.174 8.825 49.561 1.00 107.62 ? 205 TYR A OH 1 ATOM 2642 H H . TYR A 1 176 ? 50.162 10.541 53.282 1.00 81.26 ? 205 TYR A H 1 ATOM 2643 H HA . TYR A 1 176 ? 49.399 12.784 51.970 1.00 88.07 ? 205 TYR A HA 1 ATOM 2644 H HB2 . TYR A 1 176 ? 48.109 11.488 54.117 1.00 98.59 ? 205 TYR A HB2 1 ATOM 2645 H HB3 . TYR A 1 176 ? 47.558 12.805 53.424 1.00 98.59 ? 205 TYR A HB3 1 ATOM 2646 H HD1 . TYR A 1 176 ? 46.992 12.579 50.912 1.00 116.71 ? 205 TYR A HD1 1 ATOM 2647 H HD2 . TYR A 1 176 ? 47.323 9.418 53.338 1.00 117.09 ? 205 TYR A HD2 1 ATOM 2648 H HE1 . TYR A 1 176 ? 45.820 11.295 49.396 1.00 121.74 ? 205 TYR A HE1 1 ATOM 2649 H HE2 . TYR A 1 176 ? 46.151 8.131 51.825 1.00 122.09 ? 205 TYR A HE2 1 ATOM 2650 H HH . TYR A 1 176 ? 45.093 8.040 49.851 1.00 129.15 ? 205 TYR A HH 1 ATOM 2651 N N . ASP A 1 177 ? 51.076 12.914 54.594 1.00 90.33 ? 206 ASP A N 1 ATOM 2652 C CA . ASP A 1 177 ? 51.688 13.814 55.573 1.00 89.85 ? 206 ASP A CA 1 ATOM 2653 C C . ASP A 1 177 ? 52.635 14.803 54.896 1.00 89.89 ? 206 ASP A C 1 ATOM 2654 O O . ASP A 1 177 ? 52.761 15.948 55.332 1.00 88.77 ? 206 ASP A O 1 ATOM 2655 C CB . ASP A 1 177 ? 52.425 13.025 56.662 1.00 92.07 ? 206 ASP A CB 1 ATOM 2656 C CG . ASP A 1 177 ? 53.382 11.990 56.100 1.00 95.01 ? 206 ASP A CG 1 ATOM 2657 O OD1 . ASP A 1 177 ? 53.934 12.208 55.002 1.00 96.23 ? 206 ASP A OD1 1 ATOM 2658 O OD2 . ASP A 1 177 ? 53.584 10.952 56.766 1.00 95.56 ? 206 ASP A OD2 1 ATOM 2659 H H . ASP A 1 177 ? 51.410 12.122 54.579 1.00 108.39 ? 206 ASP A H 1 ATOM 2660 H HA . ASP A 1 177 ? 50.986 14.326 56.005 1.00 107.82 ? 206 ASP A HA 1 ATOM 2661 H HB2 . ASP A 1 177 ? 52.938 13.643 57.205 1.00 110.49 ? 206 ASP A HB2 1 ATOM 2662 H HB3 . ASP A 1 177 ? 51.773 12.562 57.212 1.00 110.49 ? 206 ASP A HB3 1 ATOM 2663 N N . ILE A 1 178 ? 53.303 14.355 53.837 1.00 96.02 ? 207 ILE A N 1 ATOM 2664 C CA . ILE A 1 178 ? 54.096 15.248 53.001 1.00 94.98 ? 207 ILE A CA 1 ATOM 2665 C C . ILE A 1 178 ? 53.121 15.920 52.027 1.00 92.56 ? 207 ILE A C 1 ATOM 2666 O O . ILE A 1 178 ? 51.924 15.636 52.068 1.00 93.58 ? 207 ILE A O 1 ATOM 2667 C CB . ILE A 1 178 ? 55.247 14.482 52.275 1.00 79.35 ? 207 ILE A CB 1 ATOM 2668 C CG1 . ILE A 1 178 ? 56.495 15.362 52.147 1.00 79.90 ? 207 ILE A CG1 1 ATOM 2669 C CG2 . ILE A 1 178 ? 54.815 13.952 50.910 1.00 79.79 ? 207 ILE A CG2 1 ATOM 2670 C CD1 . ILE A 1 178 ? 57.758 14.583 51.808 1.00 81.49 ? 207 ILE A CD1 1 ATOM 2671 H H . ILE A 1 178 ? 53.314 13.534 53.581 1.00 115.23 ? 207 ILE A H 1 ATOM 2672 H HA . ILE A 1 178 ? 54.494 15.937 53.556 1.00 113.97 ? 207 ILE A HA 1 ATOM 2673 H HB . ILE A 1 178 ? 55.482 13.717 52.824 1.00 95.22 ? 207 ILE A HB 1 ATOM 2674 H HG12 . ILE A 1 178 ? 56.349 16.012 51.442 1.00 95.88 ? 207 ILE A HG12 1 ATOM 2675 H HG13 . ILE A 1 178 ? 56.644 15.818 52.990 1.00 95.88 ? 207 ILE A HG13 1 ATOM 2676 H HG21 . ILE A 1 178 ? 55.562 13.486 50.502 1.00 95.74 ? 207 ILE A HG21 1 ATOM 2677 H HG22 . ILE A 1 178 ? 54.070 13.343 51.030 1.00 95.74 ? 207 ILE A HG22 1 ATOM 2678 H HG23 . ILE A 1 178 ? 54.546 14.699 50.353 1.00 95.74 ? 207 ILE A HG23 1 ATOM 2679 H HD11 . ILE A 1 178 ? 58.502 15.202 51.743 1.00 97.79 ? 207 ILE A HD11 1 ATOM 2680 H HD12 . ILE A 1 178 ? 57.926 13.935 52.509 1.00 97.79 ? 207 ILE A HD12 1 ATOM 2681 H HD13 . ILE A 1 178 ? 57.630 14.129 50.960 1.00 97.79 ? 207 ILE A HD13 1 ATOM 2682 N N . GLU A 1 179 ? 53.624 16.817 51.181 1.00 80.27 ? 208 GLU A N 1 ATOM 2683 C CA . GLU A 1 179 ? 52.798 17.616 50.262 1.00 75.77 ? 208 GLU A CA 1 ATOM 2684 C C . GLU A 1 179 ? 51.934 18.646 50.993 1.00 73.02 ? 208 GLU A C 1 ATOM 2685 O O . GLU A 1 179 ? 51.825 18.639 52.218 1.00 75.61 ? 208 GLU A O 1 ATOM 2686 C CB . GLU A 1 179 ? 51.879 16.733 49.401 1.00 74.62 ? 208 GLU A CB 1 ATOM 2687 C CG . GLU A 1 179 ? 52.565 15.593 48.673 1.00 75.87 ? 208 GLU A CG 1 ATOM 2688 C CD . GLU A 1 179 ? 51.651 14.914 47.670 1.00 76.27 ? 208 GLU A CD 1 ATOM 2689 O OE1 . GLU A 1 179 ? 50.419 15.102 47.763 1.00 75.05 ? 208 GLU A OE1 1 ATOM 2690 O OE2 . GLU A 1 179 ? 52.163 14.189 46.789 1.00 77.27 ? 208 GLU A OE2 1 ATOM 2691 H H . GLU A 1 179 ? 54.465 16.989 51.117 1.00 96.32 ? 208 GLU A H 1 ATOM 2692 H HA . GLU A 1 179 ? 53.385 18.100 49.662 1.00 90.92 ? 208 GLU A HA 1 ATOM 2693 H HB2 . GLU A 1 179 ? 51.200 16.345 49.975 1.00 89.54 ? 208 GLU A HB2 1 ATOM 2694 H HB3 . GLU A 1 179 ? 51.455 17.293 48.731 1.00 89.54 ? 208 GLU A HB3 1 ATOM 2695 H HG2 . GLU A 1 179 ? 53.334 15.939 48.193 1.00 91.04 ? 208 GLU A HG2 1 ATOM 2696 H HG3 . GLU A 1 179 ? 52.849 14.928 49.320 1.00 91.04 ? 208 GLU A HG3 1 ATOM 2697 N N . ASN A 1 180 ? 51.328 19.534 50.210 1.00 50.77 ? 209 ASN A N 1 ATOM 2698 C CA . ASN A 1 180 ? 50.435 20.568 50.725 1.00 48.05 ? 209 ASN A CA 1 ATOM 2699 C C . ASN A 1 180 ? 49.150 19.966 51.299 1.00 44.76 ? 209 ASN A C 1 ATOM 2700 O O . ASN A 1 180 ? 48.427 19.275 50.586 1.00 45.46 ? 209 ASN A O 1 ATOM 2701 C CB . ASN A 1 180 ? 50.106 21.560 49.603 1.00 49.54 ? 209 ASN A CB 1 ATOM 2702 C CG . ASN A 1 180 ? 49.086 22.606 50.014 1.00 49.88 ? 209 ASN A CG 1 ATOM 2703 O OD1 . ASN A 1 180 ? 48.864 22.853 51.198 1.00 49.89 ? 209 ASN A OD1 1 ATOM 2704 N ND2 . ASN A 1 180 ? 48.463 23.236 49.025 1.00 50.09 ? 209 ASN A ND2 1 ATOM 2705 H H . ASN A 1 180 ? 51.421 19.559 49.356 1.00 60.93 ? 209 ASN A H 1 ATOM 2706 H HA . ASN A 1 180 ? 50.885 21.053 51.434 1.00 57.66 ? 209 ASN A HA 1 ATOM 2707 H HB2 . ASN A 1 180 ? 50.918 22.021 49.342 1.00 59.45 ? 209 ASN A HB2 1 ATOM 2708 H HB3 . ASN A 1 180 ? 49.744 21.071 48.847 1.00 59.45 ? 209 ASN A HB3 1 ATOM 2709 H HD21 . ASN A 1 180 ? 47.876 23.839 49.201 1.00 60.11 ? 209 ASN A HD21 1 ATOM 2710 H HD22 . ASN A 1 180 ? 48.648 23.042 48.208 1.00 60.11 ? 209 ASN A HD22 1 ATOM 2711 N N . PRO A 1 181 ? 48.854 20.230 52.586 1.00 39.26 ? 210 PRO A N 1 ATOM 2712 C CA . PRO A 1 181 ? 47.663 19.624 53.198 1.00 36.91 ? 210 PRO A CA 1 ATOM 2713 C C . PRO A 1 181 ? 46.334 20.101 52.613 1.00 35.48 ? 210 PRO A C 1 ATOM 2714 O O . PRO A 1 181 ? 45.308 19.464 52.859 1.00 34.96 ? 210 PRO A O 1 ATOM 2715 C CB . PRO A 1 181 ? 47.774 20.043 54.671 1.00 35.94 ? 210 PRO A CB 1 ATOM 2716 C CG . PRO A 1 181 ? 48.622 21.258 54.661 1.00 36.13 ? 210 PRO A CG 1 ATOM 2717 C CD . PRO A 1 181 ? 49.612 21.034 53.562 1.00 37.85 ? 210 PRO A CD 1 ATOM 2718 H HA . PRO A 1 181 ? 47.710 18.657 53.137 1.00 44.29 ? 210 PRO A HA 1 ATOM 2719 H HB2 . PRO A 1 181 ? 46.892 20.243 55.022 1.00 43.13 ? 210 PRO A HB2 1 ATOM 2720 H HB3 . PRO A 1 181 ? 48.196 19.334 55.182 1.00 43.13 ? 210 PRO A HB3 1 ATOM 2721 H HG2 . PRO A 1 181 ? 48.075 22.037 54.476 1.00 43.35 ? 210 PRO A HG2 1 ATOM 2722 H HG3 . PRO A 1 181 ? 49.073 21.349 55.515 1.00 43.35 ? 210 PRO A HG3 1 ATOM 2723 H HD2 . PRO A 1 181 ? 49.880 21.879 53.169 1.00 45.42 ? 210 PRO A HD2 1 ATOM 2724 H HD3 . PRO A 1 181 ? 50.376 20.535 53.891 1.00 45.42 ? 210 PRO A HD3 1 ATOM 2725 N N . TYR A 1 182 ? 46.352 21.196 51.857 1.00 42.90 ? 211 TYR A N 1 ATOM 2726 C CA . TYR A 1 182 ? 45.121 21.788 51.336 1.00 40.71 ? 211 TYR A CA 1 ATOM 2727 C C . TYR A 1 182 ? 44.898 21.482 49.858 1.00 37.87 ? 211 TYR A C 1 ATOM 2728 O O . TYR A 1 182 ? 43.909 21.922 49.271 1.00 37.49 ? 211 TYR A O 1 ATOM 2729 C CB . TYR A 1 182 ? 45.136 23.298 51.561 1.00 41.23 ? 211 TYR A CB 1 ATOM 2730 C CG . TYR A 1 182 ? 45.328 23.670 53.011 1.00 41.82 ? 211 TYR A CG 1 ATOM 2731 C CD1 . TYR A 1 182 ? 44.309 23.480 53.935 1.00 41.47 ? 211 TYR A CD1 1 ATOM 2732 C CD2 . TYR A 1 182 ? 46.528 24.201 53.460 1.00 42.85 ? 211 TYR A CD2 1 ATOM 2733 C CE1 . TYR A 1 182 ? 44.480 23.813 55.263 1.00 41.75 ? 211 TYR A CE1 1 ATOM 2734 C CE2 . TYR A 1 182 ? 46.708 24.538 54.785 1.00 43.12 ? 211 TYR A CE2 1 ATOM 2735 C CZ . TYR A 1 182 ? 45.681 24.341 55.682 1.00 42.74 ? 211 TYR A CZ 1 ATOM 2736 O OH . TYR A 1 182 ? 45.856 24.675 57.004 1.00 43.48 ? 211 TYR A OH 1 ATOM 2737 H H . TYR A 1 182 ? 47.066 21.617 51.630 1.00 51.48 ? 211 TYR A H 1 ATOM 2738 H HA . TYR A 1 182 ? 44.368 21.424 51.829 1.00 48.85 ? 211 TYR A HA 1 ATOM 2739 H HB2 . TYR A 1 182 ? 45.866 23.686 51.053 1.00 49.47 ? 211 TYR A HB2 1 ATOM 2740 H HB3 . TYR A 1 182 ? 44.291 23.671 51.265 1.00 49.47 ? 211 TYR A HB3 1 ATOM 2741 H HD1 . TYR A 1 182 ? 43.498 23.123 53.654 1.00 49.76 ? 211 TYR A HD1 1 ATOM 2742 H HD2 . TYR A 1 182 ? 47.223 24.335 52.856 1.00 51.41 ? 211 TYR A HD2 1 ATOM 2743 H HE1 . TYR A 1 182 ? 43.789 23.682 55.871 1.00 50.11 ? 211 TYR A HE1 1 ATOM 2744 H HE2 . TYR A 1 182 ? 47.518 24.894 55.071 1.00 51.75 ? 211 TYR A HE2 1 ATOM 2745 H HH . TYR A 1 182 ? 46.629 24.983 57.123 1.00 52.17 ? 211 TYR A HH 1 ATOM 2746 N N . SER A 1 183 ? 45.814 20.729 49.259 1.00 50.41 ? 212 SER A N 1 ATOM 2747 C CA . SER A 1 183 ? 45.682 20.341 47.860 1.00 51.66 ? 212 SER A CA 1 ATOM 2748 C C . SER A 1 183 ? 44.427 19.498 47.644 1.00 52.08 ? 212 SER A C 1 ATOM 2749 O O . SER A 1 183 ? 43.824 19.009 48.600 1.00 52.74 ? 212 SER A O 1 ATOM 2750 C CB . SER A 1 183 ? 46.919 19.571 47.400 1.00 53.03 ? 212 SER A CB 1 ATOM 2751 O OG . SER A 1 183 ? 47.084 18.380 48.149 1.00 52.97 ? 212 SER A OG 1 ATOM 2752 H H . SER A 1 183 ? 46.523 20.428 49.642 1.00 60.50 ? 212 SER A H 1 ATOM 2753 H HA . SER A 1 183 ? 45.605 21.140 47.315 1.00 61.99 ? 212 SER A HA 1 ATOM 2754 H HB2 . SER A 1 183 ? 46.818 19.342 46.463 1.00 63.64 ? 212 SER A HB2 1 ATOM 2755 H HB3 . SER A 1 183 ? 47.702 20.130 47.521 1.00 63.64 ? 212 SER A HB3 1 ATOM 2756 H HG . SER A 1 183 ? 47.173 18.563 48.964 1.00 63.57 ? 212 SER A HG 1 ATOM 2757 N N . ALA A 1 184 ? 44.039 19.332 46.383 1.00 41.56 ? 213 ALA A N 1 ATOM 2758 C CA . ALA A 1 184 ? 42.843 18.571 46.040 1.00 41.70 ? 213 ALA A CA 1 ATOM 2759 C C . ALA A 1 184 ? 42.970 17.117 46.479 1.00 42.25 ? 213 ALA A C 1 ATOM 2760 O O . ALA A 1 184 ? 41.990 16.497 46.891 1.00 40.34 ? 213 ALA A O 1 ATOM 2761 C CB . ALA A 1 184 ? 42.582 18.647 44.544 1.00 43.13 ? 213 ALA A CB 1 ATOM 2762 H H . ALA A 1 184 ? 44.455 19.654 45.703 1.00 49.87 ? 213 ALA A H 1 ATOM 2763 H HA . ALA A 1 184 ? 42.080 18.957 46.498 1.00 50.03 ? 213 ALA A HA 1 ATOM 2764 H HB1 . ALA A 1 184 ? 41.784 18.136 44.337 1.00 51.75 ? 213 ALA A HB1 1 ATOM 2765 H HB2 . ALA A 1 184 ? 42.454 19.575 44.293 1.00 51.75 ? 213 ALA A HB2 1 ATOM 2766 H HB3 . ALA A 1 184 ? 43.344 18.278 44.072 1.00 51.75 ? 213 ALA A HB3 1 ATOM 2767 N N . LYS A 1 185 ? 44.183 16.581 46.393 1.00 49.69 ? 214 LYS A N 1 ATOM 2768 C CA . LYS A 1 185 ? 44.426 15.181 46.722 1.00 52.78 ? 214 LYS A CA 1 ATOM 2769 C C . LYS A 1 185 ? 44.224 14.912 48.210 1.00 52.90 ? 214 LYS A C 1 ATOM 2770 O O . LYS A 1 185 ? 43.727 13.852 48.594 1.00 51.02 ? 214 LYS A O 1 ATOM 2771 C CB . LYS A 1 185 ? 45.842 14.776 46.307 1.00 55.28 ? 214 LYS A CB 1 ATOM 2772 C CG . LYS A 1 185 ? 46.107 13.280 46.380 1.00 57.96 ? 214 LYS A CG 1 ATOM 2773 C CD . LYS A 1 185 ? 47.497 12.937 45.864 1.00 61.99 ? 214 LYS A CD 1 ATOM 2774 C CE . LYS A 1 185 ? 47.702 11.434 45.755 1.00 65.52 ? 214 LYS A CE 1 ATOM 2775 N NZ . LYS A 1 185 ? 47.553 10.745 47.066 1.00 66.38 ? 214 LYS A NZ 1 ATOM 2776 H H . LYS A 1 185 ? 44.886 17.010 46.146 1.00 59.63 ? 214 LYS A H 1 ATOM 2777 H HA . LYS A 1 185 ? 43.799 14.628 46.230 1.00 63.34 ? 214 LYS A HA 1 ATOM 2778 H HB2 . LYS A 1 185 ? 45.991 15.058 45.391 1.00 66.34 ? 214 LYS A HB2 1 ATOM 2779 H HB3 . LYS A 1 185 ? 46.477 15.217 46.893 1.00 66.34 ? 214 LYS A HB3 1 ATOM 2780 H HG2 . LYS A 1 185 ? 46.044 12.987 47.303 1.00 69.55 ? 214 LYS A HG2 1 ATOM 2781 H HG3 . LYS A 1 185 ? 45.456 12.812 45.834 1.00 69.55 ? 214 LYS A HG3 1 ATOM 2782 H HD2 . LYS A 1 185 ? 47.615 13.324 44.983 1.00 74.39 ? 214 LYS A HD2 1 ATOM 2783 H HD3 . LYS A 1 185 ? 48.161 13.290 46.477 1.00 74.39 ? 214 LYS A HD3 1 ATOM 2784 H HE2 . LYS A 1 185 ? 47.042 11.067 45.146 1.00 78.62 ? 214 LYS A HE2 1 ATOM 2785 H HE3 . LYS A 1 185 ? 48.596 11.259 45.422 1.00 78.62 ? 214 LYS A HE3 1 ATOM 2786 H HZ1 . LYS A 1 185 ? 47.679 9.869 46.966 1.00 79.66 ? 214 LYS A HZ1 1 ATOM 2787 H HZ2 . LYS A 1 185 ? 48.153 11.059 47.644 1.00 79.66 ? 214 LYS A HZ2 1 ATOM 2788 H HZ3 . LYS A 1 185 ? 46.737 10.884 47.392 1.00 79.66 ? 214 LYS A HZ3 1 ATOM 2789 N N . VAL A 1 186 ? 44.610 15.875 49.042 1.00 41.75 ? 215 VAL A N 1 ATOM 2790 C CA . VAL A 1 186 ? 44.535 15.709 50.491 1.00 43.93 ? 215 VAL A CA 1 ATOM 2791 C C . VAL A 1 186 ? 43.133 16.000 51.023 1.00 45.18 ? 215 VAL A C 1 ATOM 2792 O O . VAL A 1 186 ? 42.669 15.330 51.946 1.00 47.89 ? 215 VAL A O 1 ATOM 2793 C CB . VAL A 1 186 ? 45.550 16.617 51.211 1.00 43.97 ? 215 VAL A CB 1 ATOM 2794 C CG1 . VAL A 1 186 ? 45.461 16.439 52.721 1.00 43.63 ? 215 VAL A CG1 1 ATOM 2795 C CG2 . VAL A 1 186 ? 46.962 16.309 50.735 1.00 44.97 ? 215 VAL A CG2 1 ATOM 2796 H H . VAL A 1 186 ? 44.922 16.637 48.792 1.00 50.09 ? 215 VAL A H 1 ATOM 2797 H HA . VAL A 1 186 ? 44.751 14.789 50.712 1.00 52.72 ? 215 VAL A HA 1 ATOM 2798 H HB . VAL A 1 186 ? 45.355 17.544 51.002 1.00 52.76 ? 215 VAL A HB 1 ATOM 2799 H HG11 . VAL A 1 186 ? 46.110 17.021 53.146 1.00 52.36 ? 215 VAL A HG11 1 ATOM 2800 H HG12 . VAL A 1 186 ? 44.566 16.670 53.013 1.00 52.36 ? 215 VAL A HG12 1 ATOM 2801 H HG13 . VAL A 1 186 ? 45.652 15.513 52.941 1.00 52.36 ? 215 VAL A HG13 1 ATOM 2802 H HG21 . VAL A 1 186 ? 47.585 16.890 51.199 1.00 53.96 ? 215 VAL A HG21 1 ATOM 2803 H HG22 . VAL A 1 186 ? 47.166 15.381 50.931 1.00 53.96 ? 215 VAL A HG22 1 ATOM 2804 H HG23 . VAL A 1 186 ? 47.014 16.464 49.779 1.00 53.96 ? 215 VAL A HG23 1 ATOM 2805 N N . GLN A 1 187 ? 42.465 16.998 50.451 1.00 49.08 ? 216 GLN A N 1 ATOM 2806 C CA . GLN A 1 187 ? 41.108 17.336 50.870 1.00 45.23 ? 216 GLN A CA 1 ATOM 2807 C C . GLN A 1 187 ? 40.181 16.142 50.694 1.00 42.33 ? 216 GLN A C 1 ATOM 2808 O O . GLN A 1 187 ? 39.305 15.893 51.523 1.00 40.74 ? 216 GLN A O 1 ATOM 2809 C CB . GLN A 1 187 ? 40.567 18.528 50.082 1.00 44.17 ? 216 GLN A CB 1 ATOM 2810 C CG . GLN A 1 187 ? 41.106 19.872 50.539 1.00 43.08 ? 216 GLN A CG 1 ATOM 2811 C CD . GLN A 1 187 ? 40.303 21.041 49.998 1.00 42.27 ? 216 GLN A CD 1 ATOM 2812 O OE1 . GLN A 1 187 ? 39.155 20.883 49.579 1.00 41.85 ? 216 GLN A OE1 1 ATOM 2813 N NE2 . GLN A 1 187 ? 40.904 22.225 50.008 1.00 42.00 ? 216 GLN A NE2 1 ATOM 2814 H H . GLN A 1 187 ? 42.774 17.493 49.819 1.00 58.90 ? 216 GLN A H 1 ATOM 2815 H HA . GLN A 1 187 ? 41.116 17.575 51.810 1.00 54.28 ? 216 GLN A HA 1 ATOM 2816 H HB2 . GLN A 1 187 ? 40.805 18.417 49.148 1.00 53.00 ? 216 GLN A HB2 1 ATOM 2817 H HB3 . GLN A 1 187 ? 39.602 18.550 50.173 1.00 53.00 ? 216 GLN A HB3 1 ATOM 2818 H HG2 . GLN A 1 187 ? 41.078 19.911 51.508 1.00 51.69 ? 216 GLN A HG2 1 ATOM 2819 H HG3 . GLN A 1 187 ? 42.021 19.968 50.229 1.00 51.69 ? 216 GLN A HG3 1 ATOM 2820 H HE21 . GLN A 1 187 ? 41.706 22.297 50.309 1.00 50.40 ? 216 GLN A HE21 1 ATOM 2821 H HE22 . GLN A 1 187 ? 40.492 22.919 49.712 1.00 50.40 ? 216 GLN A HE22 1 ATOM 2822 N N . GLU A 1 188 ? 40.385 15.412 49.602 1.00 59.81 ? 217 GLU A N 1 ATOM 2823 C CA . GLU A 1 188 ? 39.638 14.191 49.328 1.00 62.06 ? 217 GLU A CA 1 ATOM 2824 C C . GLU A 1 188 ? 39.733 13.224 50.500 1.00 61.39 ? 217 GLU A C 1 ATOM 2825 O O . GLU A 1 188 ? 38.766 12.539 50.835 1.00 61.17 ? 217 GLU A O 1 ATOM 2826 C CB . GLU A 1 188 ? 40.165 13.533 48.045 1.00 64.46 ? 217 GLU A CB 1 ATOM 2827 C CG . GLU A 1 188 ? 39.883 12.036 47.898 1.00 65.99 ? 217 GLU A CG 1 ATOM 2828 C CD . GLU A 1 188 ? 38.404 11.707 47.854 1.00 67.16 ? 217 GLU A CD 1 ATOM 2829 O OE1 . GLU A 1 188 ? 38.062 10.505 47.900 1.00 67.69 ? 217 GLU A OE1 1 ATOM 2830 O OE2 . GLU A 1 188 ? 37.583 12.643 47.763 1.00 67.65 ? 217 GLU A OE2 1 ATOM 2831 H H . GLU A 1 188 ? 40.962 15.607 48.994 1.00 71.77 ? 217 GLU A H 1 ATOM 2832 H HA . GLU A 1 188 ? 38.704 14.413 49.193 1.00 74.47 ? 217 GLU A HA 1 ATOM 2833 H HB2 . GLU A 1 188 ? 39.760 13.980 47.285 1.00 77.35 ? 217 GLU A HB2 1 ATOM 2834 H HB3 . GLU A 1 188 ? 41.127 13.651 48.014 1.00 77.35 ? 217 GLU A HB3 1 ATOM 2835 H HG2 . GLU A 1 188 ? 40.284 11.721 47.073 1.00 79.19 ? 217 GLU A HG2 1 ATOM 2836 H HG3 . GLU A 1 188 ? 40.271 11.568 48.653 1.00 79.19 ? 217 GLU A HG3 1 ATOM 2837 N N . GLN A 1 189 ? 40.906 13.180 51.122 1.00 38.91 ? 218 GLN A N 1 ATOM 2838 C CA . GLN A 1 189 ? 41.164 12.241 52.203 1.00 39.12 ? 218 GLN A CA 1 ATOM 2839 C C . GLN A 1 189 ? 40.728 12.790 53.561 1.00 34.32 ? 218 GLN A C 1 ATOM 2840 O O . GLN A 1 189 ? 40.130 12.071 54.358 1.00 35.43 ? 218 GLN A O 1 ATOM 2841 C CB . GLN A 1 189 ? 42.652 11.884 52.241 1.00 44.07 ? 218 GLN A CB 1 ATOM 2842 C CG . GLN A 1 189 ? 42.965 10.608 53.007 1.00 48.40 ? 218 GLN A CG 1 ATOM 2843 C CD . GLN A 1 189 ? 42.402 9.367 52.336 1.00 52.81 ? 218 GLN A CD 1 ATOM 2844 O OE1 . GLN A 1 189 ? 42.063 9.385 51.151 1.00 54.65 ? 218 GLN A OE1 1 ATOM 2845 N NE2 . GLN A 1 189 ? 42.296 8.282 53.096 1.00 54.21 ? 218 GLN A NE2 1 ATOM 2846 H H . GLN A 1 189 ? 41.574 13.688 50.933 1.00 46.70 ? 218 GLN A H 1 ATOM 2847 H HA . GLN A 1 189 ? 40.666 11.426 52.038 1.00 46.95 ? 218 GLN A HA 1 ATOM 2848 H HB2 . GLN A 1 189 ? 42.967 11.767 51.331 1.00 52.88 ? 218 GLN A HB2 1 ATOM 2849 H HB3 . GLN A 1 189 ? 43.136 12.610 52.665 1.00 52.88 ? 218 GLN A HB3 1 ATOM 2850 H HG2 . GLN A 1 189 ? 43.928 10.505 53.069 1.00 58.08 ? 218 GLN A HG2 1 ATOM 2851 H HG3 . GLN A 1 189 ? 42.580 10.670 53.895 1.00 58.08 ? 218 GLN A HG3 1 ATOM 2852 H HE21 . GLN A 1 189 ? 42.540 8.309 53.920 1.00 65.05 ? 218 GLN A HE21 1 ATOM 2853 H HE22 . GLN A 1 189 ? 41.983 7.554 52.763 1.00 65.05 ? 218 GLN A HE22 1 ATOM 2854 N N . LEU A 1 190 ? 41.021 14.061 53.819 1.00 26.68 ? 219 LEU A N 1 ATOM 2855 C CA . LEU A 1 190 ? 40.809 14.634 55.147 1.00 26.04 ? 219 LEU A CA 1 ATOM 2856 C C . LEU A 1 190 ? 39.414 15.227 55.352 1.00 25.73 ? 219 LEU A C 1 ATOM 2857 O O . LEU A 1 190 ? 38.794 15.005 56.392 1.00 25.48 ? 219 LEU A O 1 ATOM 2858 C CB . LEU A 1 190 ? 41.861 15.711 55.423 1.00 25.89 ? 219 LEU A CB 1 ATOM 2859 C CG . LEU A 1 190 ? 43.328 15.270 55.371 1.00 26.36 ? 219 LEU A CG 1 ATOM 2860 C CD1 . LEU A 1 190 ? 44.230 16.393 55.862 1.00 26.27 ? 219 LEU A CD1 1 ATOM 2861 C CD2 . LEU A 1 190 ? 43.577 14.001 56.177 1.00 26.50 ? 219 LEU A CD2 1 ATOM 2862 H H . LEU A 1 190 ? 41.343 14.613 53.244 1.00 32.02 ? 219 LEU A H 1 ATOM 2863 H HA . LEU A 1 190 ? 40.928 13.933 55.806 1.00 31.25 ? 219 LEU A HA 1 ATOM 2864 H HB2 . LEU A 1 190 ? 41.751 16.418 54.768 1.00 31.07 ? 219 LEU A HB2 1 ATOM 2865 H HB3 . LEU A 1 190 ? 41.702 16.070 56.310 1.00 31.07 ? 219 LEU A HB3 1 ATOM 2866 H HG . LEU A 1 190 ? 43.564 15.084 54.448 1.00 31.63 ? 219 LEU A HG 1 ATOM 2867 H HD11 . LEU A 1 190 ? 45.153 16.096 55.822 1.00 31.52 ? 219 LEU A HD11 1 ATOM 2868 H HD12 . LEU A 1 190 ? 44.106 17.168 55.294 1.00 31.52 ? 219 LEU A HD12 1 ATOM 2869 H HD13 . LEU A 1 190 ? 43.992 16.611 56.777 1.00 31.52 ? 219 LEU A HD13 1 ATOM 2870 H HD21 . LEU A 1 190 ? 44.515 13.764 56.112 1.00 31.80 ? 219 LEU A HD21 1 ATOM 2871 H HD22 . LEU A 1 190 ? 43.340 14.164 57.103 1.00 31.80 ? 219 LEU A HD22 1 ATOM 2872 H HD23 . LEU A 1 190 ? 43.029 13.286 55.817 1.00 31.80 ? 219 LEU A HD23 1 ATOM 2873 N N . LYS A 1 191 ? 38.921 15.980 54.374 1.00 38.93 ? 220 LYS A N 1 ATOM 2874 C CA . LYS A 1 191 ? 37.658 16.695 54.543 1.00 38.73 ? 220 LYS A CA 1 ATOM 2875 C C . LYS A 1 191 ? 36.473 15.735 54.653 1.00 35.61 ? 220 LYS A C 1 ATOM 2876 O O . LYS A 1 191 ? 36.305 14.846 53.817 1.00 36.13 ? 220 LYS A O 1 ATOM 2877 C CB . LYS A 1 191 ? 37.435 17.672 53.386 1.00 40.75 ? 220 LYS A CB 1 ATOM 2878 C CG . LYS A 1 191 ? 36.281 18.634 53.622 1.00 41.00 ? 220 LYS A CG 1 ATOM 2879 C CD . LYS A 1 191 ? 36.280 19.784 52.628 1.00 41.69 ? 220 LYS A CD 1 ATOM 2880 C CE . LYS A 1 191 ? 35.904 19.327 51.229 1.00 44.12 ? 220 LYS A CE 1 ATOM 2881 N NZ . LYS A 1 191 ? 35.756 20.480 50.297 1.00 46.12 ? 220 LYS A NZ 1 ATOM 2882 H H . LYS A 1 191 ? 39.295 16.095 53.608 1.00 46.72 ? 220 LYS A H 1 ATOM 2883 H HA . LYS A 1 191 ? 37.698 17.211 55.364 1.00 46.48 ? 220 LYS A HA 1 ATOM 2884 H HB2 . LYS A 1 191 ? 38.240 18.198 53.260 1.00 48.90 ? 220 LYS A HB2 1 ATOM 2885 H HB3 . LYS A 1 191 ? 37.241 17.166 52.582 1.00 48.90 ? 220 LYS A HB3 1 ATOM 2886 H HG2 . LYS A 1 191 ? 35.443 18.155 53.530 1.00 49.20 ? 220 LYS A HG2 1 ATOM 2887 H HG3 . LYS A 1 191 ? 36.356 19.007 54.515 1.00 49.20 ? 220 LYS A HG3 1 ATOM 2888 H HD2 . LYS A 1 191 ? 35.635 20.450 52.911 1.00 50.03 ? 220 LYS A HD2 1 ATOM 2889 H HD3 . LYS A 1 191 ? 37.168 20.173 52.590 1.00 50.03 ? 220 LYS A HD3 1 ATOM 2890 H HE2 . LYS A 1 191 ? 36.600 18.745 50.885 1.00 52.94 ? 220 LYS A HE2 1 ATOM 2891 H HE3 . LYS A 1 191 ? 35.058 18.853 51.264 1.00 52.94 ? 220 LYS A HE3 1 ATOM 2892 H HZ1 . LYS A 1 191 ? 35.536 20.189 49.485 1.00 55.34 ? 220 LYS A HZ1 1 ATOM 2893 H HZ2 . LYS A 1 191 ? 35.118 21.028 50.590 1.00 55.34 ? 220 LYS A HZ2 1 ATOM 2894 H HZ3 . LYS A 1 191 ? 36.522 20.930 50.245 1.00 55.34 ? 220 LYS A HZ3 1 ATOM 2895 N N . ILE A 1 192 ? 35.656 15.929 55.688 1.00 29.95 ? 221 ILE A N 1 ATOM 2896 C CA . ILE A 1 192 ? 34.480 15.093 55.925 1.00 26.49 ? 221 ILE A CA 1 ATOM 2897 C C . ILE A 1 192 ? 33.330 15.894 56.531 1.00 26.55 ? 221 ILE A C 1 ATOM 2898 O O . ILE A 1 192 ? 33.541 16.950 57.131 1.00 26.23 ? 221 ILE A O 1 ATOM 2899 C CB . ILE A 1 192 ? 34.795 13.909 56.872 1.00 55.23 ? 221 ILE A CB 1 ATOM 2900 C CG1 . ILE A 1 192 ? 35.253 14.406 58.249 1.00 25.94 ? 221 ILE A CG1 1 ATOM 2901 C CG2 . ILE A 1 192 ? 35.854 13.008 56.264 1.00 54.98 ? 221 ILE A CG2 1 ATOM 2902 C CD1 . ILE A 1 192 ? 35.207 13.340 59.321 1.00 25.95 ? 221 ILE A CD1 1 ATOM 2903 H H . ILE A 1 192 ? 35.764 16.547 56.276 1.00 35.95 ? 221 ILE A H 1 ATOM 2904 H HA . ILE A 1 192 ? 34.178 14.727 55.079 1.00 31.78 ? 221 ILE A HA 1 ATOM 2905 H HB . ILE A 1 192 ? 33.985 13.389 56.990 1.00 66.28 ? 221 ILE A HB 1 ATOM 2906 H HG12 . ILE A 1 192 ? 36.168 14.720 58.180 1.00 31.12 ? 221 ILE A HG12 1 ATOM 2907 H HG13 . ILE A 1 192 ? 34.675 15.134 58.528 1.00 31.12 ? 221 ILE A HG13 1 ATOM 2908 H HG21 . ILE A 1 192 ? 36.034 12.276 56.874 1.00 65.98 ? 221 ILE A HG21 1 ATOM 2909 H HG22 . ILE A 1 192 ? 35.527 12.663 55.418 1.00 65.98 ? 221 ILE A HG22 1 ATOM 2910 H HG23 . ILE A 1 192 ? 36.663 13.525 56.119 1.00 65.98 ? 221 ILE A HG23 1 ATOM 2911 H HD11 . ILE A 1 192 ? 35.508 13.723 60.160 1.00 31.14 ? 221 ILE A HD11 1 ATOM 2912 H HD12 . ILE A 1 192 ? 34.295 13.022 59.411 1.00 31.14 ? 221 ILE A HD12 1 ATOM 2913 H HD13 . ILE A 1 192 ? 35.789 12.608 59.063 1.00 31.14 ? 221 ILE A HD13 1 ATOM 2914 N N . THR A 1 193 ? 32.115 15.378 56.365 1.00 30.13 ? 222 THR A N 1 ATOM 2915 C CA . THR A 1 193 ? 30.931 15.932 57.016 1.00 30.44 ? 222 THR A CA 1 ATOM 2916 C C . THR A 1 193 ? 30.362 14.919 58.003 1.00 30.68 ? 222 THR A C 1 ATOM 2917 O O . THR A 1 193 ? 29.637 15.282 58.931 1.00 30.91 ? 222 THR A O 1 ATOM 2918 C CB . THR A 1 193 ? 29.843 16.315 55.998 1.00 31.16 ? 222 THR A CB 1 ATOM 2919 O OG1 . THR A 1 193 ? 29.575 15.201 55.138 1.00 31.71 ? 222 THR A OG1 1 ATOM 2920 C CG2 . THR A 1 193 ? 30.286 17.504 55.161 1.00 30.95 ? 222 THR A CG2 1 ATOM 2921 H H . THR A 1 193 ? 31.948 14.694 55.872 1.00 36.15 ? 222 THR A H 1 ATOM 2922 H HA . THR A 1 193 ? 31.181 16.730 57.508 1.00 36.53 ? 222 THR A HA 1 ATOM 2923 H HB . THR A 1 193 ? 29.032 16.559 56.471 1.00 37.39 ? 222 THR A HB 1 ATOM 2924 H HG1 . THR A 1 193 ? 30.272 14.982 54.725 1.00 38.05 ? 222 THR A HG1 1 ATOM 2925 H HG21 . THR A 1 193 ? 29.594 17.736 54.523 1.00 37.14 ? 222 THR A HG21 1 ATOM 2926 H HG22 . THR A 1 193 ? 30.456 18.267 55.734 1.00 37.14 ? 222 THR A HG22 1 ATOM 2927 H HG23 . THR A 1 193 ? 31.099 17.285 54.678 1.00 37.14 ? 222 THR A HG23 1 ATOM 2928 N N . ASN A 1 194 ? 30.696 13.648 57.793 1.00 34.29 ? 223 ASN A N 1 ATOM 2929 C CA . ASN A 1 194 ? 30.275 12.579 58.690 1.00 34.50 ? 223 ASN A CA 1 ATOM 2930 C C . ASN A 1 194 ? 31.390 11.565 58.885 1.00 34.10 ? 223 ASN A C 1 ATOM 2931 O O . ASN A 1 194 ? 32.332 11.502 58.096 1.00 33.89 ? 223 ASN A O 1 ATOM 2932 C CB . ASN A 1 194 ? 29.036 11.864 58.151 1.00 35.39 ? 223 ASN A CB 1 ATOM 2933 C CG . ASN A 1 194 ? 27.954 12.820 57.704 1.00 36.00 ? 223 ASN A CG 1 ATOM 2934 O OD1 . ASN A 1 194 ? 26.956 13.011 58.398 1.00 36.51 ? 223 ASN A OD1 1 ATOM 2935 N ND2 . ASN A 1 194 ? 28.142 13.426 56.538 1.00 36.06 ? 223 ASN A ND2 1 ATOM 2936 H H . ASN A 1 194 ? 31.171 13.377 57.130 1.00 41.15 ? 223 ASN A H 1 ATOM 2937 H HA . ASN A 1 194 ? 30.055 12.957 59.555 1.00 41.39 ? 223 ASN A HA 1 ATOM 2938 H HB2 . ASN A 1 194 ? 29.290 11.322 57.388 1.00 42.47 ? 223 ASN A HB2 1 ATOM 2939 H HB3 . ASN A 1 194 ? 28.668 11.301 58.850 1.00 42.47 ? 223 ASN A HB3 1 ATOM 2940 H HD21 . ASN A 1 194 ? 27.555 13.979 56.241 1.00 43.27 ? 223 ASN A HD21 1 ATOM 2941 H HD22 . ASN A 1 194 ? 28.852 13.264 56.080 1.00 43.27 ? 223 ASN A HD22 1 ATOM 2942 N N . LEU A 1 195 ? 31.269 10.771 59.942 1.00 27.16 ? 224 LEU A N 1 ATOM 2943 C CA . LEU A 1 195 ? 32.196 9.682 60.201 1.00 26.93 ? 224 LEU A CA 1 ATOM 2944 C C . LEU A 1 195 ? 31.409 8.528 60.800 1.00 27.36 ? 224 LEU A C 1 ATOM 2945 O O . LEU A 1 195 ? 30.755 8.684 61.831 1.00 27.48 ? 224 LEU A O 1 ATOM 2946 C CB . LEU A 1 195 ? 33.317 10.127 61.141 1.00 26.34 ? 224 LEU A CB 1 ATOM 2947 C CG . LEU A 1 195 ? 34.488 9.155 61.290 1.00 26.17 ? 224 LEU A CG 1 ATOM 2948 C CD1 . LEU A 1 195 ? 35.297 9.075 60.002 1.00 26.21 ? 224 LEU A CD1 1 ATOM 2949 C CD2 . LEU A 1 195 ? 35.370 9.564 62.455 1.00 25.82 ? 224 LEU A CD2 1 ATOM 2950 H H . LEU A 1 195 ? 30.647 10.846 60.532 1.00 32.60 ? 224 LEU A H 1 ATOM 2951 H HA . LEU A 1 195 ? 32.591 9.386 59.367 1.00 32.32 ? 224 LEU A HA 1 ATOM 2952 H HB2 . LEU A 1 195 ? 33.677 10.965 60.811 1.00 31.61 ? 224 LEU A HB2 1 ATOM 2953 H HB3 . LEU A 1 195 ? 32.939 10.263 62.024 1.00 31.61 ? 224 LEU A HB3 1 ATOM 2954 H HG . LEU A 1 195 ? 34.139 8.269 61.477 1.00 31.40 ? 224 LEU A HG 1 ATOM 2955 H HD11 . LEU A 1 195 ? 36.030 8.453 60.128 1.00 31.46 ? 224 LEU A HD11 1 ATOM 2956 H HD12 . LEU A 1 195 ? 34.720 8.767 59.286 1.00 31.46 ? 224 LEU A HD12 1 ATOM 2957 H HD13 . LEU A 1 195 ? 35.644 9.957 59.793 1.00 31.46 ? 224 LEU A HD13 1 ATOM 2958 H HD21 . LEU A 1 195 ? 36.105 8.934 62.530 1.00 30.98 ? 224 LEU A HD21 1 ATOM 2959 H HD22 . LEU A 1 195 ? 35.714 10.456 62.291 1.00 30.98 ? 224 LEU A HD22 1 ATOM 2960 H HD23 . LEU A 1 195 ? 34.842 9.556 63.268 1.00 30.98 ? 224 LEU A HD23 1 ATOM 2961 N N . ARG A 1 196 ? 31.470 7.372 60.147 1.00 31.86 ? 225 ARG A N 1 ATOM 2962 C CA . ARG A 1 196 ? 30.623 6.243 60.509 1.00 32.41 ? 225 ARG A CA 1 ATOM 2963 C C . ARG A 1 196 ? 31.422 4.966 60.731 1.00 32.32 ? 225 ARG A C 1 ATOM 2964 O O . ARG A 1 196 ? 32.259 4.585 59.911 1.00 32.32 ? 225 ARG A O 1 ATOM 2965 C CB . ARG A 1 196 ? 29.568 6.018 59.424 1.00 33.25 ? 225 ARG A CB 1 ATOM 2966 C CG . ARG A 1 196 ? 28.746 4.749 59.588 1.00 33.98 ? 225 ARG A CG 1 ATOM 2967 C CD . ARG A 1 196 ? 27.757 4.589 58.449 1.00 35.00 ? 225 ARG A CD 1 ATOM 2968 N NE . ARG A 1 196 ? 28.425 4.374 57.169 1.00 35.16 ? 225 ARG A NE 1 ATOM 2969 C CZ . ARG A 1 196 ? 27.793 4.254 56.006 1.00 36.12 ? 225 ARG A CZ 1 ATOM 2970 N NH1 . ARG A 1 196 ? 26.472 4.336 55.952 1.00 37.00 ? 225 ARG A NH1 1 ATOM 2971 N NH2 . ARG A 1 196 ? 28.485 4.057 54.894 1.00 36.35 ? 225 ARG A NH2 1 ATOM 2972 H H . ARG A 1 196 ? 31.998 7.216 59.487 1.00 38.23 ? 225 ARG A H 1 ATOM 2973 H HA . ARG A 1 196 ? 30.160 6.451 61.336 1.00 38.89 ? 225 ARG A HA 1 ATOM 2974 H HB2 . ARG A 1 196 ? 28.954 6.769 59.430 1.00 39.90 ? 225 ARG A HB2 1 ATOM 2975 H HB3 . ARG A 1 196 ? 30.015 5.970 58.564 1.00 39.90 ? 225 ARG A HB3 1 ATOM 2976 H HG2 . ARG A 1 196 ? 29.337 3.980 59.588 1.00 40.78 ? 225 ARG A HG2 1 ATOM 2977 H HG3 . ARG A 1 196 ? 28.249 4.793 60.420 1.00 40.78 ? 225 ARG A HG3 1 ATOM 2978 H HD2 . ARG A 1 196 ? 27.188 3.823 58.626 1.00 42.00 ? 225 ARG A HD2 1 ATOM 2979 H HD3 . ARG A 1 196 ? 27.220 5.394 58.378 1.00 42.00 ? 225 ARG A HD3 1 ATOM 2980 H HE . ARG A 1 196 ? 29.283 4.322 57.167 1.00 42.20 ? 225 ARG A HE 1 ATOM 2981 H HH11 . ARG A 1 196 ? 26.019 4.463 56.671 1.00 44.40 ? 225 ARG A HH11 1 ATOM 2982 H HH12 . ARG A 1 196 ? 26.067 4.259 55.197 1.00 44.40 ? 225 ARG A HH12 1 ATOM 2983 H HH21 . ARG A 1 196 ? 29.343 4.005 54.925 1.00 43.63 ? 225 ARG A HH21 1 ATOM 2984 H HH22 . ARG A 1 196 ? 28.077 3.982 54.141 1.00 43.63 ? 225 ARG A HH22 1 ATOM 2985 N N . VAL A 1 197 ? 31.143 4.318 61.857 1.00 36.39 ? 226 VAL A N 1 ATOM 2986 C CA . VAL A 1 197 ? 31.694 3.010 62.177 1.00 36.43 ? 226 VAL A CA 1 ATOM 2987 C C . VAL A 1 197 ? 30.577 1.981 62.093 1.00 37.18 ? 226 VAL A C 1 ATOM 2988 O O . VAL A 1 197 ? 29.516 2.171 62.687 1.00 37.50 ? 226 VAL A O 1 ATOM 2989 C CB . VAL A 1 197 ? 32.321 2.988 63.582 1.00 35.96 ? 226 VAL A CB 1 ATOM 2990 C CG1 . VAL A 1 197 ? 32.725 1.576 63.974 1.00 36.10 ? 226 VAL A CG1 1 ATOM 2991 C CG2 . VAL A 1 197 ? 33.523 3.919 63.637 1.00 35.37 ? 226 VAL A CG2 1 ATOM 2992 H H . VAL A 1 197 ? 30.622 4.626 62.467 1.00 43.67 ? 226 VAL A H 1 ATOM 2993 H HA . VAL A 1 197 ? 32.378 2.777 61.529 1.00 43.71 ? 226 VAL A HA 1 ATOM 2994 H HB . VAL A 1 197 ? 31.667 3.303 64.226 1.00 43.15 ? 226 VAL A HB 1 ATOM 2995 H HG11 . VAL A 1 197 ? 33.116 1.594 64.862 1.00 43.32 ? 226 VAL A HG11 1 ATOM 2996 H HG12 . VAL A 1 197 ? 31.938 1.010 63.970 1.00 43.32 ? 226 VAL A HG12 1 ATOM 2997 H HG13 . VAL A 1 197 ? 33.374 1.244 63.333 1.00 43.32 ? 226 VAL A HG13 1 ATOM 2998 H HG21 . VAL A 1 197 ? 33.903 3.891 64.529 1.00 42.45 ? 226 VAL A HG21 1 ATOM 2999 H HG22 . VAL A 1 197 ? 34.180 3.623 62.988 1.00 42.45 ? 226 VAL A HG22 1 ATOM 3000 H HG23 . VAL A 1 197 ? 33.233 4.821 63.429 1.00 42.45 ? 226 VAL A HG23 1 ATOM 3001 N N . ARG A 1 198 ? 30.814 0.898 61.357 1.00 40.29 ? 227 ARG A N 1 ATOM 3002 C CA . ARG A 1 198 ? 29.829 -0.171 61.227 1.00 41.12 ? 227 ARG A CA 1 ATOM 3003 C C . ARG A 1 198 ? 30.369 -1.486 61.775 1.00 41.13 ? 227 ARG A C 1 ATOM 3004 O O . ARG A 1 198 ? 31.162 -2.166 61.125 1.00 41.27 ? 227 ARG A O 1 ATOM 3005 C CB . ARG A 1 198 ? 29.410 -0.338 59.764 1.00 41.92 ? 227 ARG A CB 1 ATOM 3006 C CG . ARG A 1 198 ? 28.448 0.735 59.287 1.00 42.25 ? 227 ARG A CG 1 ATOM 3007 C CD . ARG A 1 198 ? 27.846 0.417 57.927 1.00 43.32 ? 227 ARG A CD 1 ATOM 3008 N NE . ARG A 1 198 ? 28.750 0.738 56.822 1.00 43.22 ? 227 ARG A NE 1 ATOM 3009 C CZ . ARG A 1 198 ? 29.434 -0.151 56.103 1.00 43.63 ? 227 ARG A CZ 1 ATOM 3010 N NH1 . ARG A 1 198 ? 29.338 -1.453 56.348 1.00 44.12 ? 227 ARG A NH1 1 ATOM 3011 N NH2 . ARG A 1 198 ? 30.221 0.268 55.122 1.00 43.66 ? 227 ARG A NH2 1 ATOM 3012 H H . ARG A 1 198 ? 31.542 0.759 60.921 1.00 48.35 ? 227 ARG A H 1 ATOM 3013 H HA . ARG A 1 198 ? 29.040 0.065 61.739 1.00 49.34 ? 227 ARG A HA 1 ATOM 3014 H HB2 . ARG A 1 198 ? 30.201 -0.299 59.205 1.00 50.30 ? 227 ARG A HB2 1 ATOM 3015 H HB3 . ARG A 1 198 ? 28.974 -1.198 59.659 1.00 50.30 ? 227 ARG A HB3 1 ATOM 3016 H HG2 . ARG A 1 198 ? 27.722 0.816 59.925 1.00 50.70 ? 227 ARG A HG2 1 ATOM 3017 H HG3 . ARG A 1 198 ? 28.923 1.578 59.215 1.00 50.70 ? 227 ARG A HG3 1 ATOM 3018 H HD2 . ARG A 1 198 ? 27.643 -0.530 57.884 1.00 51.98 ? 227 ARG A HD2 1 ATOM 3019 H HD3 . ARG A 1 198 ? 27.034 0.936 57.811 1.00 51.98 ? 227 ARG A HD3 1 ATOM 3020 H HE . ARG A 1 198 ? 28.848 1.568 56.620 1.00 51.87 ? 227 ARG A HE 1 ATOM 3021 H HH11 . ARG A 1 198 ? 28.830 -1.736 56.982 1.00 52.94 ? 227 ARG A HH11 1 ATOM 3022 H HH12 . ARG A 1 198 ? 29.787 -2.014 55.874 1.00 52.94 ? 227 ARG A HH12 1 ATOM 3023 H HH21 . ARG A 1 198 ? 30.290 1.109 54.955 1.00 52.39 ? 227 ARG A HH21 1 ATOM 3024 H HH22 . ARG A 1 198 ? 30.666 -0.301 54.654 1.00 52.39 ? 227 ARG A HH22 1 ATOM 3025 N N . LEU A 1 199 ? 29.932 -1.832 62.982 1.00 30.15 ? 228 LEU A N 1 ATOM 3026 C CA . LEU A 1 199 ? 30.324 -3.080 63.625 1.00 30.20 ? 228 LEU A CA 1 ATOM 3027 C C . LEU A 1 199 ? 29.531 -4.236 63.020 1.00 31.15 ? 228 LEU A C 1 ATOM 3028 O O . LEU A 1 199 ? 28.310 -4.149 62.890 1.00 31.80 ? 228 LEU A O 1 ATOM 3029 C CB . LEU A 1 199 ? 30.093 -2.998 65.136 1.00 29.93 ? 228 LEU A CB 1 ATOM 3030 C CG . LEU A 1 199 ? 30.528 -1.684 65.797 1.00 29.27 ? 228 LEU A CG 1 ATOM 3031 C CD1 . LEU A 1 199 ? 30.223 -1.700 67.286 1.00 29.26 ? 228 LEU A CD1 1 ATOM 3032 C CD2 . LEU A 1 199 ? 32.005 -1.413 65.559 1.00 28.65 ? 228 LEU A CD2 1 ATOM 3033 H H . LEU A 1 199 ? 29.399 -1.352 63.456 1.00 36.18 ? 228 LEU A H 1 ATOM 3034 H HA . LEU A 1 199 ? 31.268 -3.241 63.468 1.00 36.25 ? 228 LEU A HA 1 ATOM 3035 H HB2 . LEU A 1 199 ? 29.146 -3.111 65.308 1.00 35.92 ? 228 LEU A HB2 1 ATOM 3036 H HB3 . LEU A 1 199 ? 30.588 -3.716 65.562 1.00 35.92 ? 228 LEU A HB3 1 ATOM 3037 H HG . LEU A 1 199 ? 30.026 -0.955 65.401 1.00 35.12 ? 228 LEU A HG 1 ATOM 3038 H HD11 . LEU A 1 199 ? 30.509 -0.858 67.675 1.00 35.11 ? 228 LEU A HD11 1 ATOM 3039 H HD12 . LEU A 1 199 ? 29.268 -1.816 67.411 1.00 35.11 ? 228 LEU A HD12 1 ATOM 3040 H HD13 . LEU A 1 199 ? 30.703 -2.435 67.698 1.00 35.11 ? 228 LEU A HD13 1 ATOM 3041 H HD21 . LEU A 1 199 ? 32.246 -0.578 65.989 1.00 34.39 ? 228 LEU A HD21 1 ATOM 3042 H HD22 . LEU A 1 199 ? 32.524 -2.141 65.935 1.00 34.39 ? 228 LEU A HD22 1 ATOM 3043 H HD23 . LEU A 1 199 ? 32.164 -1.352 64.604 1.00 34.39 ? 228 LEU A HD23 1 ATOM 3044 N N . LEU A 1 200 ? 30.222 -5.317 62.662 1.00 34.52 ? 229 LEU A N 1 ATOM 3045 C CA . LEU A 1 200 ? 29.612 -6.401 61.892 1.00 35.18 ? 229 LEU A CA 1 ATOM 3046 C C . LEU A 1 200 ? 29.447 -7.702 62.675 1.00 35.18 ? 229 LEU A C 1 ATOM 3047 O O . LEU A 1 200 ? 28.549 -8.493 62.384 1.00 36.11 ? 229 LEU A O 1 ATOM 3048 C CB . LEU A 1 200 ? 30.442 -6.669 60.637 1.00 35.72 ? 229 LEU A CB 1 ATOM 3049 C CG . LEU A 1 200 ? 30.641 -5.465 59.713 1.00 35.61 ? 229 LEU A CG 1 ATOM 3050 C CD1 . LEU A 1 200 ? 31.525 -5.850 58.539 1.00 36.18 ? 229 LEU A CD1 1 ATOM 3051 C CD2 . LEU A 1 200 ? 29.309 -4.913 59.223 1.00 36.23 ? 229 LEU A CD2 1 ATOM 3052 H H . LEU A 1 200 ? 31.051 -5.447 62.852 1.00 41.42 ? 229 LEU A H 1 ATOM 3053 H HA . LEU A 1 200 ? 28.730 -6.118 61.605 1.00 42.21 ? 229 LEU A HA 1 ATOM 3054 H HB2 . LEU A 1 200 ? 31.321 -6.976 60.909 1.00 42.86 ? 229 LEU A HB2 1 ATOM 3055 H HB3 . LEU A 1 200 ? 30.003 -7.363 60.120 1.00 42.86 ? 229 LEU A HB3 1 ATOM 3056 H HG . LEU A 1 200 ? 31.092 -4.762 60.206 1.00 42.73 ? 229 LEU A HG 1 ATOM 3057 H HD11 . LEU A 1 200 ? 31.641 -5.076 57.965 1.00 43.41 ? 229 LEU A HD11 1 ATOM 3058 H HD12 . LEU A 1 200 ? 32.386 -6.144 58.875 1.00 43.41 ? 229 LEU A HD12 1 ATOM 3059 H HD13 . LEU A 1 200 ? 31.099 -6.568 58.046 1.00 43.41 ? 229 LEU A HD13 1 ATOM 3060 H HD21 . LEU A 1 200 ? 29.477 -4.154 58.642 1.00 43.48 ? 229 LEU A HD21 1 ATOM 3061 H HD22 . LEU A 1 200 ? 28.841 -5.607 58.733 1.00 43.48 ? 229 LEU A HD22 1 ATOM 3062 H HD23 . LEU A 1 200 ? 28.782 -4.634 59.988 1.00 43.48 ? 229 LEU A HD23 1 ATOM 3063 N N . LYS A 1 201 ? 30.306 -7.929 63.663 1.00 42.86 ? 230 LYS A N 1 ATOM 3064 C CA . LYS A 1 201 ? 30.252 -9.164 64.440 1.00 43.12 ? 230 LYS A CA 1 ATOM 3065 C C . LYS A 1 201 ? 30.965 -9.017 65.779 1.00 42.33 ? 230 LYS A C 1 ATOM 3066 O O . LYS A 1 201 ? 32.107 -8.560 65.841 1.00 41.75 ? 230 LYS A O 1 ATOM 3067 C CB . LYS A 1 201 ? 30.869 -10.318 63.644 1.00 43.70 ? 230 LYS A CB 1 ATOM 3068 C CG . LYS A 1 201 ? 30.791 -11.674 64.337 1.00 44.07 ? 230 LYS A CG 1 ATOM 3069 C CD . LYS A 1 201 ? 31.551 -12.740 63.560 1.00 45.00 ? 230 LYS A CD 1 ATOM 3070 C CE . LYS A 1 201 ? 31.660 -14.042 64.346 1.00 45.89 ? 230 LYS A CE 1 ATOM 3071 N NZ . LYS A 1 201 ? 30.332 -14.666 64.609 1.00 46.72 ? 230 LYS A NZ 1 ATOM 3072 H H . LYS A 1 201 ? 30.928 -7.386 63.904 1.00 51.43 ? 230 LYS A H 1 ATOM 3073 H HA . LYS A 1 201 ? 29.324 -9.384 64.617 1.00 51.74 ? 230 LYS A HA 1 ATOM 3074 H HB2 . LYS A 1 201 ? 30.405 -10.393 62.796 1.00 52.44 ? 230 LYS A HB2 1 ATOM 3075 H HB3 . LYS A 1 201 ? 31.806 -10.121 63.488 1.00 52.44 ? 230 LYS A HB3 1 ATOM 3076 H HG2 . LYS A 1 201 ? 31.183 -11.605 65.222 1.00 52.88 ? 230 LYS A HG2 1 ATOM 3077 H HG3 . LYS A 1 201 ? 29.863 -11.948 64.401 1.00 52.88 ? 230 LYS A HG3 1 ATOM 3078 H HD2 . LYS A 1 201 ? 31.084 -12.925 62.731 1.00 54.00 ? 230 LYS A HD2 1 ATOM 3079 H HD3 . LYS A 1 201 ? 32.448 -12.422 63.375 1.00 54.00 ? 230 LYS A HD3 1 ATOM 3080 H HE2 . LYS A 1 201 ? 32.194 -14.673 63.839 1.00 55.07 ? 230 LYS A HE2 1 ATOM 3081 H HE3 . LYS A 1 201 ? 32.082 -13.861 65.201 1.00 55.07 ? 230 LYS A HE3 1 ATOM 3082 H HZ1 . LYS A 1 201 ? 30.437 -15.421 65.068 1.00 56.07 ? 230 LYS A HZ1 1 ATOM 3083 H HZ2 . LYS A 1 201 ? 29.822 -14.109 65.080 1.00 56.07 ? 230 LYS A HZ2 1 ATOM 3084 H HZ3 . LYS A 1 201 ? 29.925 -14.850 63.839 1.00 56.07 ? 230 LYS A HZ3 1 ATOM 3085 N N . ARG A 1 202 ? 30.279 -9.412 66.847 1.00 32.91 ? 231 ARG A N 1 ATOM 3086 C CA . ARG A 1 202 ? 30.842 -9.370 68.190 1.00 32.38 ? 231 ARG A CA 1 ATOM 3087 C C . ARG A 1 202 ? 31.962 -10.392 68.344 1.00 32.33 ? 231 ARG A C 1 ATOM 3088 O O . ARG A 1 202 ? 32.298 -11.108 67.400 1.00 32.73 ? 231 ARG A O 1 ATOM 3089 C CB . ARG A 1 202 ? 29.753 -9.621 69.237 1.00 32.75 ? 231 ARG A CB 1 ATOM 3090 C CG . ARG A 1 202 ? 28.808 -8.449 69.426 1.00 33.59 ? 231 ARG A CG 1 ATOM 3091 C CD . ARG A 1 202 ? 27.886 -8.638 70.622 1.00 35.40 ? 231 ARG A CD 1 ATOM 3092 N NE . ARG A 1 202 ? 26.862 -9.655 70.383 1.00 36.88 ? 231 ARG A NE 1 ATOM 3093 C CZ . ARG A 1 202 ? 26.960 -10.934 70.738 1.00 37.54 ? 231 ARG A CZ 1 ATOM 3094 N NH1 . ARG A 1 202 ? 28.043 -11.388 71.358 1.00 36.99 ? 231 ARG A NH1 1 ATOM 3095 N NH2 . ARG A 1 202 ? 25.964 -11.768 70.469 1.00 38.77 ? 231 ARG A NH2 1 ATOM 3096 H H . ARG A 1 202 ? 29.474 -9.713 66.818 1.00 39.50 ? 231 ARG A H 1 ATOM 3097 H HA . ARG A 1 202 ? 31.215 -8.489 68.350 1.00 38.86 ? 231 ARG A HA 1 ATOM 3098 H HB2 . ARG A 1 202 ? 29.225 -10.387 68.963 1.00 39.30 ? 231 ARG A HB2 1 ATOM 3099 H HB3 . ARG A 1 202 ? 30.176 -9.802 70.092 1.00 39.30 ? 231 ARG A HB3 1 ATOM 3100 H HG2 . ARG A 1 202 ? 29.327 -7.642 69.570 1.00 40.31 ? 231 ARG A HG2 1 ATOM 3101 H HG3 . ARG A 1 202 ? 28.258 -8.354 68.633 1.00 40.31 ? 231 ARG A HG3 1 ATOM 3102 H HD2 . ARG A 1 202 ? 28.413 -8.916 71.388 1.00 42.48 ? 231 ARG A HD2 1 ATOM 3103 H HD3 . ARG A 1 202 ? 27.438 -7.799 70.812 1.00 42.48 ? 231 ARG A HD3 1 ATOM 3104 H HE . ARG A 1 202 ? 26.142 -9.408 69.984 1.00 44.26 ? 231 ARG A HE 1 ATOM 3105 H HH11 . ARG A 1 202 ? 28.693 -10.853 71.536 1.00 44.38 ? 231 ARG A HH11 1 ATOM 3106 H HH12 . ARG A 1 202 ? 28.095 -12.217 71.582 1.00 44.38 ? 231 ARG A HH12 1 ATOM 3107 H HH21 . ARG A 1 202 ? 25.260 -11.481 70.067 1.00 46.52 ? 231 ARG A HH21 1 ATOM 3108 H HH22 . ARG A 1 202 ? 26.023 -12.595 70.696 1.00 46.52 ? 231 ARG A HH22 1 ATOM 3109 N N . GLN A 1 203 ? 32.537 -10.453 69.540 1.00 36.50 ? 232 GLN A N 1 ATOM 3110 C CA . GLN A 1 203 ? 33.635 -11.369 69.815 1.00 36.55 ? 232 GLN A CA 1 ATOM 3111 C C . GLN A 1 203 ? 33.656 -11.715 71.295 1.00 37.95 ? 232 GLN A C 1 ATOM 3112 O O . GLN A 1 203 ? 33.735 -10.830 72.146 1.00 37.52 ? 232 GLN A O 1 ATOM 3113 C CB . GLN A 1 203 ? 34.965 -10.748 69.385 1.00 35.16 ? 232 GLN A CB 1 ATOM 3114 C CG . GLN A 1 203 ? 36.100 -11.742 69.221 1.00 35.47 ? 232 GLN A CG 1 ATOM 3115 C CD . GLN A 1 203 ? 37.099 -11.320 68.157 1.00 35.50 ? 232 GLN A CD 1 ATOM 3116 O OE1 . GLN A 1 203 ? 37.641 -12.157 67.435 1.00 36.06 ? 232 GLN A OE1 1 ATOM 3117 N NE2 . GLN A 1 203 ? 37.348 -10.019 68.054 1.00 35.00 ? 232 GLN A NE2 1 ATOM 3118 H H . GLN A 1 203 ? 32.307 -9.971 70.213 1.00 43.80 ? 232 GLN A H 1 ATOM 3119 H HA . GLN A 1 203 ? 33.504 -12.188 69.312 1.00 43.86 ? 232 GLN A HA 1 ATOM 3120 H HB2 . GLN A 1 203 ? 34.838 -10.303 68.532 1.00 42.19 ? 232 GLN A HB2 1 ATOM 3121 H HB3 . GLN A 1 203 ? 35.235 -10.100 70.054 1.00 42.19 ? 232 GLN A HB3 1 ATOM 3122 H HG2 . GLN A 1 203 ? 36.574 -11.822 70.063 1.00 42.56 ? 232 GLN A HG2 1 ATOM 3123 H HG3 . GLN A 1 203 ? 35.732 -12.602 68.964 1.00 42.56 ? 232 GLN A HG3 1 ATOM 3124 H HE21 . GLN A 1 203 ? 36.951 -9.462 68.576 1.00 42.00 ? 232 GLN A HE21 1 ATOM 3125 H HE22 . GLN A 1 203 ? 37.907 -9.733 67.466 1.00 42.00 ? 232 GLN A HE22 1 ATOM 3126 N N . SER A 1 204 ? 33.565 -13.006 71.596 1.00 44.72 ? 233 SER A N 1 ATOM 3127 C CA . SER A 1 204 ? 33.542 -13.472 72.976 1.00 45.78 ? 233 SER A CA 1 ATOM 3128 C C . SER A 1 204 ? 34.961 -13.680 73.492 1.00 45.30 ? 233 SER A C 1 ATOM 3129 O O . SER A 1 204 ? 35.843 -14.096 72.745 1.00 45.52 ? 233 SER A O 1 ATOM 3130 C CB . SER A 1 204 ? 32.741 -14.770 73.089 1.00 46.89 ? 233 SER A CB 1 ATOM 3131 O OG . SER A 1 204 ? 31.476 -14.643 72.462 1.00 47.40 ? 233 SER A OG 1 ATOM 3132 H H . SER A 1 204 ? 33.516 -13.636 71.013 1.00 53.67 ? 233 SER A H 1 ATOM 3133 H HA . SER A 1 204 ? 33.114 -12.802 73.532 1.00 54.94 ? 233 SER A HA 1 ATOM 3134 H HB2 . SER A 1 204 ? 33.236 -15.485 72.659 1.00 56.27 ? 233 SER A HB2 1 ATOM 3135 H HB3 . SER A 1 204 ? 32.608 -14.978 74.028 1.00 56.27 ? 233 SER A HB3 1 ATOM 3136 H HG . SER A 1 204 ? 31.036 -14.027 72.826 1.00 56.88 ? 233 SER A HG 1 ATOM 3137 N N . CYS A 1 205 ? 35.172 -13.390 74.772 1.00 44.73 ? 234 CYS A N 1 ATOM 3138 C CA . CYS A 1 205 ? 36.478 -13.576 75.396 1.00 44.70 ? 234 CYS A CA 1 ATOM 3139 C C . CYS A 1 205 ? 36.837 -15.062 75.416 1.00 47.76 ? 234 CYS A C 1 ATOM 3140 O O . CYS A 1 205 ? 36.182 -15.840 76.109 1.00 48.16 ? 234 CYS A O 1 ATOM 3141 C CB . CYS A 1 205 ? 36.477 -13.013 76.818 1.00 43.22 ? 234 CYS A CB 1 ATOM 3142 S SG . CYS A 1 205 ? 38.112 -12.571 77.437 1.00 52.38 ? 234 CYS A SG 1 ATOM 3143 H H . CYS A 1 205 ? 34.571 -13.082 75.304 1.00 53.67 ? 234 CYS A H 1 ATOM 3144 H HA . CYS A 1 205 ? 37.151 -13.106 74.880 1.00 53.64 ? 234 CYS A HA 1 ATOM 3145 H HB2 . CYS A 1 205 ? 35.928 -12.214 76.836 1.00 51.86 ? 234 CYS A HB2 1 ATOM 3146 H HB3 . CYS A 1 205 ? 36.105 -13.680 77.417 1.00 51.86 ? 234 CYS A HB3 1 ATOM 3147 N N . PRO A 1 206 ? 37.871 -15.470 74.657 1.00 38.18 ? 235 PRO A N 1 ATOM 3148 C CA . PRO A 1 206 ? 38.205 -16.901 74.614 1.00 43.63 ? 235 PRO A CA 1 ATOM 3149 C C . PRO A 1 206 ? 38.971 -17.418 75.839 1.00 52.81 ? 235 PRO A C 1 ATOM 3150 O O . PRO A 1 206 ? 39.649 -18.440 75.736 1.00 52.44 ? 235 PRO A O 1 ATOM 3151 C CB . PRO A 1 206 ? 39.080 -17.020 73.353 1.00 40.50 ? 235 PRO A CB 1 ATOM 3152 C CG . PRO A 1 206 ? 38.948 -15.708 72.635 1.00 37.87 ? 235 PRO A CG 1 ATOM 3153 C CD . PRO A 1 206 ? 38.683 -14.707 73.696 1.00 36.89 ? 235 PRO A CD 1 ATOM 3154 H HA . PRO A 1 206 ? 37.400 -17.429 74.495 1.00 52.36 ? 235 PRO A HA 1 ATOM 3155 H HB2 . PRO A 1 206 ? 40.002 -17.176 73.611 1.00 48.60 ? 235 PRO A HB2 1 ATOM 3156 H HB3 . PRO A 1 206 ? 38.753 -17.746 72.799 1.00 48.60 ? 235 PRO A HB3 1 ATOM 3157 H HG2 . PRO A 1 206 ? 39.775 -15.505 72.171 1.00 45.45 ? 235 PRO A HG2 1 ATOM 3158 H HG3 . PRO A 1 206 ? 38.206 -15.750 72.011 1.00 45.45 ? 235 PRO A HG3 1 ATOM 3159 H HD2 . PRO A 1 206 ? 39.513 -14.417 74.105 1.00 44.26 ? 235 PRO A HD2 1 ATOM 3160 H HD3 . PRO A 1 206 ? 38.178 -13.959 73.340 1.00 44.26 ? 235 PRO A HD3 1 ATOM 3161 N N . CYS A 1 207 ? 38.862 -16.736 76.976 1.00 66.59 ? 236 CYS A N 1 ATOM 3162 C CA . CYS A 1 207 ? 39.599 -17.130 78.174 1.00 77.35 ? 236 CYS A CA 1 ATOM 3163 C C . CYS A 1 207 ? 39.044 -18.415 78.793 1.00 86.50 ? 236 CYS A C 1 ATOM 3164 O O . CYS A 1 207 ? 37.901 -18.795 78.539 1.00 88.37 ? 236 CYS A O 1 ATOM 3165 C CB . CYS A 1 207 ? 39.574 -15.999 79.205 1.00 78.05 ? 236 CYS A CB 1 ATOM 3166 S SG . CYS A 1 207 ? 37.922 -15.495 79.725 1.00 33.07 ? 236 CYS A SG 1 ATOM 3167 H H . CYS A 1 207 ? 38.367 -16.040 77.080 1.00 79.91 ? 236 CYS A H 1 ATOM 3168 H HA . CYS A 1 207 ? 40.524 -17.292 77.933 1.00 92.81 ? 236 CYS A HA 1 ATOM 3169 H HB2 . CYS A 1 207 ? 40.056 -16.290 79.995 1.00 93.66 ? 236 CYS A HB2 1 ATOM 3170 H HB3 . CYS A 1 207 ? 40.012 -15.223 78.823 1.00 93.66 ? 236 CYS A HB3 1 ATOM 3171 N N . GLN A 1 208 ? 39.866 -19.076 79.605 1.00 41.28 ? 237 GLN A N 1 ATOM 3172 C CA . GLN A 1 208 ? 39.488 -20.333 80.246 1.00 41.71 ? 237 GLN A CA 1 ATOM 3173 C C . GLN A 1 208 ? 38.650 -20.096 81.499 1.00 41.76 ? 237 GLN A C 1 ATOM 3174 O O . GLN A 1 208 ? 39.075 -19.395 82.417 1.00 41.89 ? 237 GLN A O 1 ATOM 3175 C CB . GLN A 1 208 ? 40.736 -21.142 80.600 1.00 45.61 ? 237 GLN A CB 1 ATOM 3176 H H . GLN A 1 208 ? 40.660 -18.812 79.803 1.00 49.53 ? 237 GLN A H 1 ATOM 3177 H HA . GLN A 1 208 ? 38.957 -20.857 79.625 1.00 50.05 ? 237 GLN A HA 1 ATOM 3178 N N . ILE A 1 209 ? 37.466 -20.700 81.535 1.00 53.03 ? 238 ILE A N 1 ATOM 3179 C CA . ILE A 1 209 ? 36.518 -20.494 82.627 1.00 49.04 ? 238 ILE A CA 1 ATOM 3180 C C . ILE A 1 209 ? 36.714 -21.482 83.776 1.00 50.34 ? 238 ILE A C 1 ATOM 3181 O O . ILE A 1 209 ? 35.751 -21.865 84.441 1.00 50.27 ? 238 ILE A O 1 ATOM 3182 C CB . ILE A 1 209 ? 35.067 -20.614 82.126 1.00 45.94 ? 238 ILE A CB 1 ATOM 3183 H H . ILE A 1 209 ? 37.185 -21.243 80.930 1.00 63.64 ? 238 ILE A H 1 ATOM 3184 H HA . ILE A 1 209 ? 36.638 -19.599 82.981 1.00 58.85 ? 238 ILE A HA 1 ATOM 3185 N N . ASN A 1 210 ? 37.956 -21.891 84.009 1.00 65.49 ? 239 ASN A N 1 ATOM 3186 C CA . ASN A 1 210 ? 38.253 -22.878 85.043 1.00 68.34 ? 239 ASN A CA 1 ATOM 3187 C C . ASN A 1 210 ? 37.896 -22.393 86.448 1.00 70.78 ? 239 ASN A C 1 ATOM 3188 O O . ASN A 1 210 ? 37.259 -23.112 87.218 1.00 71.35 ? 239 ASN A O 1 ATOM 3189 C CB . ASN A 1 210 ? 39.733 -23.259 84.994 1.00 68.84 ? 239 ASN A CB 1 ATOM 3190 H H . ASN A 1 210 ? 38.648 -21.613 83.581 1.00 78.59 ? 239 ASN A H 1 ATOM 3191 H HA . ASN A 1 210 ? 37.735 -23.679 84.867 1.00 82.01 ? 239 ASN A HA 1 ATOM 3192 N N . ASP A 1 211 ? 38.306 -21.171 86.773 1.00 108.37 ? 240 ASP A N 1 ATOM 3193 C CA . ASP A 1 211 ? 38.122 -20.625 88.116 1.00 109.04 ? 240 ASP A CA 1 ATOM 3194 C C . ASP A 1 211 ? 36.725 -20.045 88.340 1.00 109.11 ? 240 ASP A C 1 ATOM 3195 O O . ASP A 1 211 ? 36.456 -19.461 89.390 1.00 109.95 ? 240 ASP A O 1 ATOM 3196 C CB . ASP A 1 211 ? 39.173 -19.546 88.388 1.00 108.88 ? 240 ASP A CB 1 ATOM 3197 H H . ASP A 1 211 ? 38.698 -20.632 86.229 1.00 130.04 ? 240 ASP A H 1 ATOM 3198 H HA . ASP A 1 211 ? 38.254 -21.337 88.762 1.00 130.85 ? 240 ASP A HA 1 ATOM 3199 N N . LEU A 1 212 ? 35.842 -20.202 87.358 1.00 81.32 ? 241 LEU A N 1 ATOM 3200 C CA . LEU A 1 212 ? 34.498 -19.637 87.443 1.00 79.67 ? 241 LEU A CA 1 ATOM 3201 C C . LEU A 1 212 ? 33.518 -20.568 88.153 1.00 81.33 ? 241 LEU A C 1 ATOM 3202 O O . LEU A 1 212 ? 33.349 -21.725 87.767 1.00 84.98 ? 241 LEU A O 1 ATOM 3203 C CB . LEU A 1 212 ? 33.974 -19.308 86.043 1.00 73.71 ? 241 LEU A CB 1 ATOM 3204 C CG . LEU A 1 212 ? 34.351 -17.925 85.502 1.00 70.41 ? 241 LEU A CG 1 ATOM 3205 C CD1 . LEU A 1 212 ? 35.858 -17.714 85.527 1.00 70.20 ? 241 LEU A CD1 1 ATOM 3206 C CD2 . LEU A 1 212 ? 33.809 -17.737 84.093 1.00 69.29 ? 241 LEU A CD2 1 ATOM 3207 H H . LEU A 1 212 ? 35.997 -20.632 86.630 1.00 97.58 ? 241 LEU A H 1 ATOM 3208 H HA . LEU A 1 212 ? 34.538 -18.810 87.947 1.00 95.60 ? 241 LEU A HA 1 ATOM 3209 H HB2 . LEU A 1 212 ? 34.323 -19.967 85.423 1.00 88.46 ? 241 LEU A HB2 1 ATOM 3210 H HB3 . LEU A 1 212 ? 33.006 -19.359 86.059 1.00 88.46 ? 241 LEU A HB3 1 ATOM 3211 H HG . LEU A 1 212 ? 33.947 -17.248 86.067 1.00 84.49 ? 241 LEU A HG 1 ATOM 3212 H HD11 . LEU A 1 212 ? 36.058 -16.831 85.178 1.00 84.24 ? 241 LEU A HD11 1 ATOM 3213 H HD12 . LEU A 1 212 ? 36.171 -17.787 86.442 1.00 84.24 ? 241 LEU A HD12 1 ATOM 3214 H HD13 . LEU A 1 212 ? 36.281 -18.391 84.977 1.00 84.24 ? 241 LEU A HD13 1 ATOM 3215 H HD21 . LEU A 1 212 ? 34.060 -16.857 83.773 1.00 83.14 ? 241 LEU A HD21 1 ATOM 3216 H HD22 . LEU A 1 212 ? 34.187 -18.420 83.516 1.00 83.14 ? 241 LEU A HD22 1 ATOM 3217 H HD23 . LEU A 1 212 ? 32.843 -17.819 84.113 1.00 83.14 ? 241 LEU A HD23 1 ATOM 3218 N N . ASN A 1 213 ? 32.875 -20.045 89.193 1.00 96.57 ? 242 ASN A N 1 ATOM 3219 C CA . ASN A 1 213 ? 31.834 -20.773 89.911 1.00 92.39 ? 242 ASN A CA 1 ATOM 3220 C C . ASN A 1 213 ? 30.531 -20.838 89.117 1.00 85.30 ? 242 ASN A C 1 ATOM 3221 O O . ASN A 1 213 ? 29.630 -21.607 89.453 1.00 86.52 ? 242 ASN A O 1 ATOM 3222 C CB . ASN A 1 213 ? 31.576 -20.123 91.273 1.00 92.66 ? 242 ASN A CB 1 ATOM 3223 C CG . ASN A 1 213 ? 32.560 -20.581 92.337 1.00 91.67 ? 242 ASN A CG 1 ATOM 3224 O OD1 . ASN A 1 213 ? 32.167 -21.137 93.363 1.00 91.43 ? 242 ASN A OD1 1 ATOM 3225 N ND2 . ASN A 1 213 ? 33.846 -20.359 92.091 1.00 90.35 ? 242 ASN A ND2 1 ATOM 3226 H H . ASN A 1 213 ? 33.026 -19.259 89.507 1.00 115.89 ? 242 ASN A H 1 ATOM 3227 H HA . ASN A 1 213 ? 32.135 -21.682 90.066 1.00 110.87 ? 242 ASN A HA 1 ATOM 3228 H HB2 . ASN A 1 213 ? 31.656 -19.161 91.184 1.00 111.19 ? 242 ASN A HB2 1 ATOM 3229 H HB3 . ASN A 1 213 ? 30.683 -20.356 91.570 1.00 111.19 ? 242 ASN A HB3 1 ATOM 3230 H HD21 . ASN A 1 213 ? 34.441 -20.600 92.663 1.00 108.41 ? 242 ASN A HD21 1 ATOM 3231 H HD22 . ASN A 1 213 ? 34.084 -19.974 91.360 1.00 108.41 ? 242 ASN A HD22 1 ATOM 3232 N N . ALA A 1 214 ? 30.440 -20.031 88.063 1.00 79.91 ? 243 ALA A N 1 ATOM 3233 C CA . ALA A 1 214 ? 29.239 -19.969 87.236 1.00 77.36 ? 243 ALA A CA 1 ATOM 3234 C C . ALA A 1 214 ? 29.596 -19.734 85.773 1.00 74.60 ? 243 ALA A C 1 ATOM 3235 O O . ALA A 1 214 ? 30.573 -19.055 85.462 1.00 74.84 ? 243 ALA A O 1 ATOM 3236 C CB . ALA A 1 214 ? 28.310 -18.873 87.735 1.00 77.10 ? 243 ALA A CB 1 ATOM 3237 H H . ALA A 1 214 ? 31.068 -19.503 87.804 1.00 95.89 ? 243 ALA A H 1 ATOM 3238 H HA . ALA A 1 214 ? 28.767 -20.815 87.299 1.00 92.83 ? 243 ALA A HA 1 ATOM 3239 H HB1 . ALA A 1 214 ? 27.520 -18.850 87.173 1.00 92.52 ? 243 ALA A HB1 1 ATOM 3240 H HB2 . ALA A 1 214 ? 28.059 -19.066 88.652 1.00 92.52 ? 243 ALA A HB2 1 ATOM 3241 H HB3 . ALA A 1 214 ? 28.774 -18.023 87.691 1.00 92.52 ? 243 ALA A HB3 1 ATOM 3242 N N . LYS A 1 215 ? 28.792 -20.300 84.878 1.00 68.26 ? 244 LYS A N 1 ATOM 3243 C CA . LYS A 1 215 ? 29.032 -20.186 83.444 1.00 66.47 ? 244 LYS A CA 1 ATOM 3244 C C . LYS A 1 215 ? 28.807 -18.750 82.970 1.00 65.90 ? 244 LYS A C 1 ATOM 3245 O O . LYS A 1 215 ? 27.972 -18.046 83.534 1.00 67.70 ? 244 LYS A O 1 ATOM 3246 C CB . LYS A 1 215 ? 28.115 -21.142 82.678 1.00 66.74 ? 244 LYS A CB 1 ATOM 3247 C CG . LYS A 1 215 ? 28.476 -21.302 81.215 1.00 66.79 ? 244 LYS A CG 1 ATOM 3248 C CD . LYS A 1 215 ? 27.525 -22.245 80.500 1.00 67.14 ? 244 LYS A CD 1 ATOM 3249 C CE . LYS A 1 215 ? 28.062 -22.634 79.132 1.00 65.63 ? 244 LYS A CE 1 ATOM 3250 N NZ . LYS A 1 215 ? 29.332 -23.408 79.230 1.00 64.06 ? 244 LYS A NZ 1 ATOM 3251 H H . LYS A 1 215 ? 28.094 -20.761 85.079 1.00 81.91 ? 244 LYS A H 1 ATOM 3252 H HA . LYS A 1 215 ? 29.951 -20.429 83.253 1.00 79.76 ? 244 LYS A HA 1 ATOM 3253 H HB2 . LYS A 1 215 ? 28.162 -22.017 83.092 1.00 80.09 ? 244 LYS A HB2 1 ATOM 3254 H HB3 . LYS A 1 215 ? 27.207 -20.806 82.724 1.00 80.09 ? 244 LYS A HB3 1 ATOM 3255 H HG2 . LYS A 1 215 ? 28.430 -20.437 80.778 1.00 80.15 ? 244 LYS A HG2 1 ATOM 3256 H HG3 . LYS A 1 215 ? 29.372 -21.666 81.145 1.00 80.15 ? 244 LYS A HG3 1 ATOM 3257 H HD2 . LYS A 1 215 ? 27.417 -23.052 81.026 1.00 80.56 ? 244 LYS A HD2 1 ATOM 3258 H HD3 . LYS A 1 215 ? 26.669 -21.805 80.378 1.00 80.56 ? 244 LYS A HD3 1 ATOM 3259 H HE2 . LYS A 1 215 ? 27.406 -23.185 78.678 1.00 78.76 ? 244 LYS A HE2 1 ATOM 3260 H HE3 . LYS A 1 215 ? 28.236 -21.830 78.618 1.00 78.76 ? 244 LYS A HE3 1 ATOM 3261 H HZ1 . LYS A 1 215 ? 29.622 -23.621 78.416 1.00 76.88 ? 244 LYS A HZ1 1 ATOM 3262 H HZ2 . LYS A 1 215 ? 29.954 -22.921 79.640 1.00 76.88 ? 244 LYS A HZ2 1 ATOM 3263 H HZ3 . LYS A 1 215 ? 29.198 -24.155 79.694 1.00 76.88 ? 244 LYS A HZ3 1 ATOM 3264 N N . PRO A 1 216 ? 29.554 -18.307 81.939 1.00 67.13 ? 245 PRO A N 1 ATOM 3265 C CA . PRO A 1 216 ? 29.348 -16.961 81.389 1.00 65.32 ? 245 PRO A CA 1 ATOM 3266 C C . PRO A 1 216 ? 27.895 -16.661 81.018 1.00 63.64 ? 245 PRO A C 1 ATOM 3267 O O . PRO A 1 216 ? 27.156 -17.569 80.637 1.00 64.55 ? 245 PRO A O 1 ATOM 3268 C CB . PRO A 1 216 ? 30.237 -16.961 80.146 1.00 65.13 ? 245 PRO A CB 1 ATOM 3269 C CG . PRO A 1 216 ? 31.356 -17.858 80.510 1.00 65.56 ? 245 PRO A CG 1 ATOM 3270 C CD . PRO A 1 216 ? 30.757 -18.942 81.368 1.00 66.52 ? 245 PRO A CD 1 ATOM 3271 H HA . PRO A 1 216 ? 29.666 -16.289 82.012 1.00 78.38 ? 245 PRO A HA 1 ATOM 3272 H HB2 . PRO A 1 216 ? 29.744 -17.311 79.388 1.00 78.16 ? 245 PRO A HB2 1 ATOM 3273 H HB3 . PRO A 1 216 ? 30.556 -16.063 79.968 1.00 78.16 ? 245 PRO A HB3 1 ATOM 3274 H HG2 . PRO A 1 216 ? 31.744 -18.236 79.706 1.00 78.68 ? 245 PRO A HG2 1 ATOM 3275 H HG3 . PRO A 1 216 ? 32.022 -17.359 81.008 1.00 78.68 ? 245 PRO A HG3 1 ATOM 3276 H HD2 . PRO A 1 216 ? 30.510 -19.705 80.823 1.00 79.83 ? 245 PRO A HD2 1 ATOM 3277 H HD3 . PRO A 1 216 ? 31.374 -19.193 82.073 1.00 79.83 ? 245 PRO A HD3 1 ATOM 3278 N N . HIS A 1 217 ? 27.503 -15.394 81.125 1.00 54.14 ? 246 HIS A N 1 ATOM 3279 C CA . HIS A 1 217 ? 26.116 -14.995 80.905 1.00 51.34 ? 246 HIS A CA 1 ATOM 3280 C C . HIS A 1 217 ? 25.981 -13.479 80.809 1.00 48.16 ? 246 HIS A C 1 ATOM 3281 O O . HIS A 1 217 ? 26.745 -12.743 81.433 1.00 47.46 ? 246 HIS A O 1 ATOM 3282 C CB . HIS A 1 217 ? 25.231 -15.515 82.037 1.00 51.61 ? 246 HIS A CB 1 ATOM 3283 C CG . HIS A 1 217 ? 25.580 -14.950 83.379 1.00 50.50 ? 246 HIS A CG 1 ATOM 3284 N ND1 . HIS A 1 217 ? 24.940 -13.852 83.912 1.00 50.57 ? 246 HIS A ND1 1 ATOM 3285 C CD2 . HIS A 1 217 ? 26.509 -15.323 84.291 1.00 49.42 ? 246 HIS A CD2 1 ATOM 3286 C CE1 . HIS A 1 217 ? 25.455 -13.578 85.097 1.00 50.25 ? 246 HIS A CE1 1 ATOM 3287 N NE2 . HIS A 1 217 ? 26.409 -14.455 85.350 1.00 49.55 ? 246 HIS A NE2 1 ATOM 3288 H H . HIS A 1 217 ? 28.026 -14.742 81.325 1.00 64.96 ? 246 HIS A H 1 ATOM 3289 H HA . HIS A 1 217 ? 25.801 -15.380 80.072 1.00 61.61 ? 246 HIS A HA 1 ATOM 3290 H HB2 . HIS A 1 217 ? 24.309 -15.282 81.847 1.00 61.93 ? 246 HIS A HB2 1 ATOM 3291 H HB3 . HIS A 1 217 ? 25.323 -16.480 82.088 1.00 61.93 ? 246 HIS A HB3 1 ATOM 3292 H HD2 . HIS A 1 217 ? 27.101 -16.036 84.215 1.00 59.30 ? 246 HIS A HD2 1 ATOM 3293 H HE1 . HIS A 1 217 ? 25.191 -12.884 85.658 1.00 60.31 ? 246 HIS A HE1 1 ATOM 3294 N N . HIS A 1 218 ? 25.002 -13.025 80.031 1.00 54.53 ? 247 HIS A N 1 ATOM 3295 C CA . HIS A 1 218 ? 24.717 -11.599 79.880 1.00 53.53 ? 247 HIS A CA 1 ATOM 3296 C C . HIS A 1 218 ? 25.965 -10.806 79.500 1.00 52.14 ? 247 HIS A C 1 ATOM 3297 O O . HIS A 1 218 ? 26.340 -9.861 80.194 1.00 54.17 ? 247 HIS A O 1 ATOM 3298 C CB . HIS A 1 218 ? 24.122 -11.030 81.172 1.00 54.10 ? 247 HIS A CB 1 ATOM 3299 C CG . HIS A 1 218 ? 22.805 -11.633 81.553 1.00 55.45 ? 247 HIS A CG 1 ATOM 3300 N ND1 . HIS A 1 218 ? 22.700 -12.791 82.293 1.00 55.95 ? 247 HIS A ND1 1 ATOM 3301 C CD2 . HIS A 1 218 ? 21.537 -11.232 81.299 1.00 56.59 ? 247 HIS A CD2 1 ATOM 3302 C CE1 . HIS A 1 218 ? 21.423 -13.078 82.477 1.00 57.23 ? 247 HIS A CE1 1 ATOM 3303 N NE2 . HIS A 1 218 ? 20.697 -12.149 81.884 1.00 57.64 ? 247 HIS A NE2 1 ATOM 3304 H H . HIS A 1 218 ? 24.480 -13.532 79.572 1.00 65.43 ? 247 HIS A H 1 ATOM 3305 H HA . HIS A 1 218 ? 24.063 -11.483 79.173 1.00 64.24 ? 247 HIS A HA 1 ATOM 3306 H HB2 . HIS A 1 218 ? 24.743 -11.191 81.899 1.00 64.92 ? 247 HIS A HB2 1 ATOM 3307 H HB3 . HIS A 1 218 ? 23.989 -10.076 81.059 1.00 64.92 ? 247 HIS A HB3 1 ATOM 3308 H HD2 . HIS A 1 218 ? 21.282 -10.478 80.817 1.00 67.91 ? 247 HIS A HD2 1 ATOM 3309 H HE1 . HIS A 1 218 ? 21.092 -13.811 82.945 1.00 68.68 ? 247 HIS A HE1 1 ATOM 3310 N N . PHE A 1 219 ? 26.604 -11.197 78.401 1.00 37.97 ? 248 PHE A N 1 ATOM 3311 C CA . PHE A 1 219 ? 27.828 -10.541 77.948 1.00 33.27 ? 248 PHE A CA 1 ATOM 3312 C C . PHE A 1 219 ? 27.799 -10.240 76.452 1.00 32.88 ? 248 PHE A C 1 ATOM 3313 O O . PHE A 1 219 ? 28.640 -9.497 75.946 1.00 32.19 ? 248 PHE A O 1 ATOM 3314 C CB . PHE A 1 219 ? 29.045 -11.407 78.280 1.00 32.86 ? 248 PHE A CB 1 ATOM 3315 C CG . PHE A 1 219 ? 29.008 -12.772 77.655 1.00 32.96 ? 248 PHE A CG 1 ATOM 3316 C CD1 . PHE A 1 219 ? 28.449 -13.844 78.330 1.00 47.09 ? 248 PHE A CD1 1 ATOM 3317 C CD2 . PHE A 1 219 ? 29.536 -12.984 76.393 1.00 32.54 ? 248 PHE A CD2 1 ATOM 3318 C CE1 . PHE A 1 219 ? 28.416 -15.100 77.758 1.00 33.78 ? 248 PHE A CE1 1 ATOM 3319 C CE2 . PHE A 1 219 ? 29.506 -14.239 75.815 1.00 32.79 ? 248 PHE A CE2 1 ATOM 3320 C CZ . PHE A 1 219 ? 28.945 -15.298 76.498 1.00 33.40 ? 248 PHE A CZ 1 ATOM 3321 H H . PHE A 1 219 ? 26.348 -11.844 77.897 1.00 45.56 ? 248 PHE A H 1 ATOM 3322 H HA . PHE A 1 219 ? 27.925 -9.698 78.419 1.00 39.93 ? 248 PHE A HA 1 ATOM 3323 H HB2 . PHE A 1 219 ? 29.844 -10.958 77.963 1.00 39.43 ? 248 PHE A HB2 1 ATOM 3324 H HB3 . PHE A 1 219 ? 29.092 -11.523 79.242 1.00 39.43 ? 248 PHE A HB3 1 ATOM 3325 H HD1 . PHE A 1 219 ? 28.091 -13.716 79.179 1.00 56.51 ? 248 PHE A HD1 1 ATOM 3326 H HD2 . PHE A 1 219 ? 29.915 -12.273 75.929 1.00 39.04 ? 248 PHE A HD2 1 ATOM 3327 H HE1 . PHE A 1 219 ? 28.038 -15.813 78.220 1.00 40.53 ? 248 PHE A HE1 1 ATOM 3328 H HE2 . PHE A 1 219 ? 29.863 -14.369 74.966 1.00 39.35 ? 248 PHE A HE2 1 ATOM 3329 H HZ . PHE A 1 219 ? 28.924 -16.143 76.111 1.00 40.08 ? 248 PHE A HZ 1 ATOM 3330 N N . MET A 1 220 ? 26.832 -10.818 75.746 1.00 44.04 ? 249 MET A N 1 ATOM 3331 C CA . MET A 1 220 ? 26.703 -10.600 74.310 1.00 43.89 ? 249 MET A CA 1 ATOM 3332 C C . MET A 1 220 ? 26.272 -9.165 74.015 1.00 43.84 ? 249 MET A C 1 ATOM 3333 O O . MET A 1 220 ? 25.089 -8.895 73.801 1.00 44.60 ? 249 MET A O 1 ATOM 3334 C CB . MET A 1 220 ? 25.699 -11.586 73.709 1.00 44.74 ? 249 MET A CB 1 ATOM 3335 H H . MET A 1 220 ? 26.236 -11.343 76.076 1.00 52.85 ? 249 MET A H 1 ATOM 3336 H HA . MET A 1 220 ? 27.563 -10.760 73.892 1.00 52.67 ? 249 MET A HA 1 ATOM 3337 N N . HIS A 1 221 ? 27.238 -8.251 74.003 1.00 36.08 ? 250 HIS A N 1 ATOM 3338 C CA . HIS A 1 221 ? 26.958 -6.843 73.741 1.00 35.97 ? 250 HIS A CA 1 ATOM 3339 C C . HIS A 1 221 ? 28.235 -6.066 73.449 1.00 35.04 ? 250 HIS A C 1 ATOM 3340 O O . HIS A 1 221 ? 29.315 -6.434 73.911 1.00 34.60 ? 250 HIS A O 1 ATOM 3341 C CB . HIS A 1 221 ? 26.234 -6.209 74.931 1.00 37.07 ? 250 HIS A CB 1 ATOM 3342 C CG . HIS A 1 221 ? 27.015 -6.258 76.207 1.00 38.61 ? 250 HIS A CG 1 ATOM 3343 N ND1 . HIS A 1 221 ? 26.716 -7.133 77.229 1.00 39.96 ? 250 HIS A ND1 1 ATOM 3344 C CD2 . HIS A 1 221 ? 28.085 -5.542 76.625 1.00 38.71 ? 250 HIS A CD2 1 ATOM 3345 C CE1 . HIS A 1 221 ? 27.567 -6.953 78.224 1.00 40.14 ? 250 HIS A CE1 1 ATOM 3346 N NE2 . HIS A 1 221 ? 28.409 -5.994 77.882 1.00 39.58 ? 250 HIS A NE2 1 ATOM 3347 H H . HIS A 1 221 ? 28.069 -8.421 74.144 1.00 43.29 ? 250 HIS A H 1 ATOM 3348 H HA . HIS A 1 221 ? 26.380 -6.774 72.965 1.00 43.16 ? 250 HIS A HA 1 ATOM 3349 H HB2 . HIS A 1 221 ? 26.055 -5.278 74.728 1.00 44.48 ? 250 HIS A HB2 1 ATOM 3350 H HB3 . HIS A 1 221 ? 25.399 -6.680 75.075 1.00 44.48 ? 250 HIS A HB3 1 ATOM 3351 H HD2 . HIS A 1 221 ? 28.520 -4.871 76.151 1.00 46.45 ? 250 HIS A HD2 1 ATOM 3352 H HE1 . HIS A 1 221 ? 27.573 -7.422 79.027 1.00 48.17 ? 250 HIS A HE1 1 ATOM 3353 N N . TYR A 1 222 ? 28.099 -4.992 72.676 1.00 34.76 ? 251 TYR A N 1 ATOM 3354 C CA . TYR A 1 222 ? 29.214 -4.096 72.387 1.00 33.98 ? 251 TYR A CA 1 ATOM 3355 C C . TYR A 1 222 ? 29.426 -3.108 73.526 1.00 33.95 ? 251 TYR A C 1 ATOM 3356 O O . TYR A 1 222 ? 28.514 -2.851 74.311 1.00 34.60 ? 251 TYR A O 1 ATOM 3357 C CB . TYR A 1 222 ? 28.971 -3.335 71.084 1.00 33.83 ? 251 TYR A CB 1 ATOM 3358 C CG . TYR A 1 222 ? 29.156 -4.170 69.839 1.00 33.83 ? 251 TYR A CG 1 ATOM 3359 C CD1 . TYR A 1 222 ? 30.423 -4.531 69.407 1.00 33.32 ? 251 TYR A CD1 1 ATOM 3360 C CD2 . TYR A 1 222 ? 28.065 -4.587 69.090 1.00 34.52 ? 251 TYR A CD2 1 ATOM 3361 C CE1 . TYR A 1 222 ? 30.601 -5.288 68.268 1.00 33.49 ? 251 TYR A CE1 1 ATOM 3362 C CE2 . TYR A 1 222 ? 28.232 -5.345 67.948 1.00 34.69 ? 251 TYR A CE2 1 ATOM 3363 C CZ . TYR A 1 222 ? 29.503 -5.692 67.542 1.00 34.18 ? 251 TYR A CZ 1 ATOM 3364 O OH . TYR A 1 222 ? 29.674 -6.447 66.406 1.00 34.52 ? 251 TYR A OH 1 ATOM 3365 H H . TYR A 1 222 ? 27.361 -4.758 72.302 1.00 41.72 ? 251 TYR A H 1 ATOM 3366 H HA . TYR A 1 222 ? 30.025 -4.619 72.285 1.00 40.78 ? 251 TYR A HA 1 ATOM 3367 H HB2 . TYR A 1 222 ? 28.060 -3.001 71.084 1.00 40.60 ? 251 TYR A HB2 1 ATOM 3368 H HB3 . TYR A 1 222 ? 29.593 -2.592 71.037 1.00 40.60 ? 251 TYR A HB3 1 ATOM 3369 H HD1 . TYR A 1 222 ? 31.167 -4.259 69.895 1.00 39.98 ? 251 TYR A HD1 1 ATOM 3370 H HD2 . TYR A 1 222 ? 27.207 -4.353 69.362 1.00 41.42 ? 251 TYR A HD2 1 ATOM 3371 H HE1 . TYR A 1 222 ? 31.457 -5.524 67.991 1.00 40.19 ? 251 TYR A HE1 1 ATOM 3372 H HE2 . TYR A 1 222 ? 27.492 -5.619 67.456 1.00 41.63 ? 251 TYR A HE2 1 ATOM 3373 H HH . TYR A 1 222 ? 28.928 -6.623 66.063 1.00 41.42 ? 251 TYR A HH 1 ATOM 3374 N N . ALA A 1 223 ? 30.629 -2.549 73.608 1.00 39.13 ? 252 ALA A N 1 ATOM 3375 C CA . ALA A 1 223 ? 30.933 -1.551 74.625 1.00 39.19 ? 252 ALA A CA 1 ATOM 3376 C C . ALA A 1 223 ? 32.168 -0.740 74.245 1.00 38.56 ? 252 ALA A C 1 ATOM 3377 O O . ALA A 1 223 ? 33.202 -1.305 73.885 1.00 38.19 ? 252 ALA A O 1 ATOM 3378 C CB . ALA A 1 223 ? 31.131 -2.219 75.977 1.00 39.60 ? 252 ALA A CB 1 ATOM 3379 H H . ALA A 1 223 ? 31.287 -2.731 73.085 1.00 46.95 ? 252 ALA A H 1 ATOM 3380 H HA . ALA A 1 223 ? 30.184 -0.939 74.700 1.00 47.03 ? 252 ALA A HA 1 ATOM 3381 H HB1 . ALA A 1 223 ? 31.332 -1.538 76.638 1.00 47.52 ? 252 ALA A HB1 1 ATOM 3382 H HB2 . ALA A 1 223 ? 30.316 -2.686 76.220 1.00 47.52 ? 252 ALA A HB2 1 ATOM 3383 H HB3 . ALA A 1 223 ? 31.867 -2.847 75.914 1.00 47.52 ? 252 ALA A HB3 1 ATOM 3384 N N . VAL A 1 224 ? 32.052 0.584 74.337 1.00 31.44 ? 253 VAL A N 1 ATOM 3385 C CA . VAL A 1 224 ? 33.134 1.491 73.956 1.00 30.93 ? 253 VAL A CA 1 ATOM 3386 C C . VAL A 1 224 ? 33.325 2.591 74.994 1.00 31.26 ? 253 VAL A C 1 ATOM 3387 O O . VAL A 1 224 ? 32.392 3.330 75.307 1.00 31.70 ? 253 VAL A O 1 ATOM 3388 C CB . VAL A 1 224 ? 32.864 2.144 72.585 1.00 30.55 ? 253 VAL A CB 1 ATOM 3389 C CG1 . VAL A 1 224 ? 34.011 3.071 72.189 1.00 45.79 ? 253 VAL A CG1 1 ATOM 3390 C CG2 . VAL A 1 224 ? 32.650 1.079 71.517 1.00 30.43 ? 253 VAL A CG2 1 ATOM 3391 H H . VAL A 1 224 ? 31.347 0.986 74.620 1.00 37.73 ? 253 VAL A H 1 ATOM 3392 H HA . VAL A 1 224 ? 33.962 0.989 73.893 1.00 37.12 ? 253 VAL A HA 1 ATOM 3393 H HB . VAL A 1 224 ? 32.055 2.677 72.643 1.00 36.67 ? 253 VAL A HB 1 ATOM 3394 H HG11 . VAL A 1 224 ? 33.813 3.466 71.325 1.00 54.95 ? 253 VAL A HG11 1 ATOM 3395 H HG12 . VAL A 1 224 ? 34.099 3.767 72.859 1.00 54.95 ? 253 VAL A HG12 1 ATOM 3396 H HG13 . VAL A 1 224 ? 34.830 2.554 72.137 1.00 54.95 ? 253 VAL A HG13 1 ATOM 3397 H HG21 . VAL A 1 224 ? 32.482 1.514 70.666 1.00 36.52 ? 253 VAL A HG21 1 ATOM 3398 H HG22 . VAL A 1 224 ? 33.446 0.528 71.456 1.00 36.52 ? 253 VAL A HG22 1 ATOM 3399 H HG23 . VAL A 1 224 ? 31.888 0.532 71.765 1.00 36.52 ? 253 VAL A HG23 1 ATOM 3400 N N . TYR A 1 225 ? 34.544 2.701 75.513 1.00 40.95 ? 254 TYR A N 1 ATOM 3401 C CA . TYR A 1 225 ? 34.873 3.728 76.494 1.00 30.11 ? 254 TYR A CA 1 ATOM 3402 C C . TYR A 1 225 ? 34.906 5.118 75.870 1.00 29.87 ? 254 TYR A C 1 ATOM 3403 O O . TYR A 1 225 ? 34.331 6.063 76.414 1.00 30.36 ? 254 TYR A O 1 ATOM 3404 C CB . TYR A 1 225 ? 36.225 3.436 77.147 1.00 30.24 ? 254 TYR A CB 1 ATOM 3405 C CG . TYR A 1 225 ? 36.174 2.425 78.268 1.00 30.81 ? 254 TYR A CG 1 ATOM 3406 C CD1 . TYR A 1 225 ? 35.486 2.697 79.442 1.00 31.63 ? 254 TYR A CD1 1 ATOM 3407 C CD2 . TYR A 1 225 ? 36.833 1.207 78.164 1.00 30.64 ? 254 TYR A CD2 1 ATOM 3408 C CE1 . TYR A 1 225 ? 35.443 1.783 80.470 1.00 32.22 ? 254 TYR A CE1 1 ATOM 3409 C CE2 . TYR A 1 225 ? 36.796 0.287 79.191 1.00 31.18 ? 254 TYR A CE2 1 ATOM 3410 C CZ . TYR A 1 225 ? 36.100 0.581 80.341 1.00 31.95 ? 254 TYR A CZ 1 ATOM 3411 O OH . TYR A 1 225 ? 36.053 -0.328 81.375 1.00 32.56 ? 254 TYR A OH 1 ATOM 3412 H H . TYR A 1 225 ? 35.204 2.188 75.311 1.00 49.14 ? 254 TYR A H 1 ATOM 3413 H HA . TYR A 1 225 ? 34.198 3.728 77.190 1.00 36.13 ? 254 TYR A HA 1 ATOM 3414 H HB2 . TYR A 1 225 ? 36.829 3.094 76.469 1.00 36.29 ? 254 TYR A HB2 1 ATOM 3415 H HB3 . TYR A 1 225 ? 36.579 4.263 77.512 1.00 36.29 ? 254 TYR A HB3 1 ATOM 3416 H HD1 . TYR A 1 225 ? 35.041 3.509 79.533 1.00 37.96 ? 254 TYR A HD1 1 ATOM 3417 H HD2 . TYR A 1 225 ? 37.304 1.007 77.387 1.00 36.76 ? 254 TYR A HD2 1 ATOM 3418 H HE1 . TYR A 1 225 ? 34.974 1.978 81.249 1.00 38.67 ? 254 TYR A HE1 1 ATOM 3419 H HE2 . TYR A 1 225 ? 37.239 -0.527 79.106 1.00 37.41 ? 254 TYR A HE2 1 ATOM 3420 H HH . TYR A 1 225 ? 35.596 -0.019 82.008 1.00 39.07 ? 254 TYR A HH 1 ATOM 3421 N N . ASP A 1 226 ? 35.584 5.239 74.731 1.00 28.97 ? 255 ASP A N 1 ATOM 3422 C CA . ASP A 1 226 ? 35.766 6.533 74.080 1.00 31.56 ? 255 ASP A CA 1 ATOM 3423 C C . ASP A 1 226 ? 35.688 6.424 72.563 1.00 28.08 ? 255 ASP A C 1 ATOM 3424 O O . ASP A 1 226 ? 36.026 5.392 71.982 1.00 27.83 ? 255 ASP A O 1 ATOM 3425 C CB . ASP A 1 226 ? 37.114 7.149 74.467 1.00 28.78 ? 255 ASP A CB 1 ATOM 3426 C CG . ASP A 1 226 ? 37.501 6.865 75.903 1.00 47.14 ? 255 ASP A CG 1 ATOM 3427 O OD1 . ASP A 1 226 ? 36.932 7.503 76.814 1.00 47.71 ? 255 ASP A OD1 1 ATOM 3428 O OD2 . ASP A 1 226 ? 38.385 6.010 76.119 1.00 29.53 ? 255 ASP A OD2 1 ATOM 3429 H H . ASP A 1 226 ? 35.949 4.582 74.313 1.00 34.77 ? 255 ASP A H 1 ATOM 3430 H HA . ASP A 1 226 ? 35.065 7.136 74.375 1.00 37.87 ? 255 ASP A HA 1 ATOM 3431 H HB2 . ASP A 1 226 ? 37.805 6.782 73.892 1.00 34.54 ? 255 ASP A HB2 1 ATOM 3432 H HB3 . ASP A 1 226 ? 37.066 8.111 74.354 1.00 34.54 ? 255 ASP A HB3 1 ATOM 3433 N N . PHE A 1 227 ? 35.243 7.506 71.933 1.00 27.47 ? 256 PHE A N 1 ATOM 3434 C CA . PHE A 1 227 ? 35.218 7.613 70.481 1.00 26.99 ? 256 PHE A CA 1 ATOM 3435 C C . PHE A 1 227 ? 35.936 8.899 70.089 1.00 26.75 ? 256 PHE A C 1 ATOM 3436 O O . PHE A 1 227 ? 35.321 9.858 69.625 1.00 26.72 ? 256 PHE A O 1 ATOM 3437 C CB . PHE A 1 227 ? 33.779 7.595 69.958 1.00 28.15 ? 256 PHE A CB 1 ATOM 3438 C CG . PHE A 1 227 ? 33.672 7.362 68.477 1.00 26.85 ? 256 PHE A CG 1 ATOM 3439 C CD1 . PHE A 1 227 ? 33.635 6.075 67.972 1.00 26.86 ? 256 PHE A CD1 1 ATOM 3440 C CD2 . PHE A 1 227 ? 33.601 8.426 67.593 1.00 26.66 ? 256 PHE A CD2 1 ATOM 3441 C CE1 . PHE A 1 227 ? 33.535 5.850 66.613 1.00 34.78 ? 256 PHE A CE1 1 ATOM 3442 C CE2 . PHE A 1 227 ? 33.500 8.207 66.231 1.00 26.51 ? 256 PHE A CE2 1 ATOM 3443 C CZ . PHE A 1 227 ? 33.467 6.917 65.742 1.00 26.61 ? 256 PHE A CZ 1 ATOM 3444 H H . PHE A 1 227 ? 34.945 8.206 72.335 1.00 32.97 ? 256 PHE A H 1 ATOM 3445 H HA . PHE A 1 227 ? 35.696 6.863 70.093 1.00 32.39 ? 256 PHE A HA 1 ATOM 3446 H HB2 . PHE A 1 227 ? 33.293 6.885 70.406 1.00 33.78 ? 256 PHE A HB2 1 ATOM 3447 H HB3 . PHE A 1 227 ? 33.365 8.450 70.154 1.00 33.78 ? 256 PHE A HB3 1 ATOM 3448 H HD1 . PHE A 1 227 ? 33.681 5.351 68.554 1.00 32.23 ? 256 PHE A HD1 1 ATOM 3449 H HD2 . PHE A 1 227 ? 33.623 9.297 67.918 1.00 31.99 ? 256 PHE A HD2 1 ATOM 3450 H HE1 . PHE A 1 227 ? 33.512 4.980 66.285 1.00 41.74 ? 256 PHE A HE1 1 ATOM 3451 H HE2 . PHE A 1 227 ? 33.454 8.928 65.646 1.00 31.81 ? 256 PHE A HE2 1 ATOM 3452 H HZ . PHE A 1 227 ? 33.399 6.768 64.826 1.00 31.93 ? 256 PHE A HZ 1 ATOM 3453 N N . ILE A 1 228 ? 37.248 8.912 70.300 1.00 30.98 ? 257 ILE A N 1 ATOM 3454 C CA . ILE A 1 228 ? 38.052 10.106 70.079 1.00 30.74 ? 257 ILE A CA 1 ATOM 3455 C C . ILE A 1 228 ? 38.264 10.350 68.589 1.00 30.20 ? 257 ILE A C 1 ATOM 3456 O O . ILE A 1 228 ? 38.896 9.544 67.906 1.00 29.58 ? 257 ILE A O 1 ATOM 3457 C CB . ILE A 1 228 ? 39.425 10.000 70.774 1.00 26.86 ? 257 ILE A CB 1 ATOM 3458 C CG1 . ILE A 1 228 ? 39.269 9.504 72.218 1.00 27.41 ? 257 ILE A CG1 1 ATOM 3459 C CG2 . ILE A 1 228 ? 40.148 11.339 70.739 1.00 40.10 ? 257 ILE A CG2 1 ATOM 3460 C CD1 . ILE A 1 228 ? 38.348 10.351 73.077 1.00 27.84 ? 257 ILE A CD1 1 ATOM 3461 H H . ILE A 1 228 ? 37.700 8.234 70.575 1.00 37.18 ? 257 ILE A H 1 ATOM 3462 H HA . ILE A 1 228 ? 37.587 10.874 70.447 1.00 36.88 ? 257 ILE A HA 1 ATOM 3463 H HB . ILE A 1 228 ? 39.961 9.353 70.288 1.00 32.23 ? 257 ILE A HB 1 ATOM 3464 H HG12 . ILE A 1 228 ? 38.908 8.603 72.199 1.00 32.89 ? 257 ILE A HG12 1 ATOM 3465 H HG13 . ILE A 1 228 ? 40.142 9.497 72.640 1.00 32.89 ? 257 ILE A HG13 1 ATOM 3466 H HG21 . ILE A 1 228 ? 41.006 11.246 71.181 1.00 48.12 ? 257 ILE A HG21 1 ATOM 3467 H HG22 . ILE A 1 228 ? 40.278 11.603 69.814 1.00 48.12 ? 257 ILE A HG22 1 ATOM 3468 H HG23 . ILE A 1 228 ? 39.608 12.001 71.199 1.00 48.12 ? 257 ILE A HG23 1 ATOM 3469 H HD11 . ILE A 1 228 ? 38.306 9.969 73.968 1.00 33.40 ? 257 ILE A HD11 1 ATOM 3470 H HD12 . ILE A 1 228 ? 38.699 11.254 73.120 1.00 33.40 ? 257 ILE A HD12 1 ATOM 3471 H HD13 . ILE A 1 228 ? 37.463 10.359 72.679 1.00 33.40 ? 257 ILE A HD13 1 ATOM 3472 N N . VAL A 1 229 ? 37.734 11.469 68.100 1.00 30.71 ? 258 VAL A N 1 ATOM 3473 C CA . VAL A 1 229 ? 37.853 11.851 66.696 1.00 25.67 ? 258 VAL A CA 1 ATOM 3474 C C . VAL A 1 229 ? 38.695 13.113 66.562 1.00 25.61 ? 258 VAL A C 1 ATOM 3475 O O . VAL A 1 229 ? 38.167 14.226 66.578 1.00 25.63 ? 258 VAL A O 1 ATOM 3476 C CB . VAL A 1 229 ? 36.469 12.092 66.058 1.00 25.66 ? 258 VAL A CB 1 ATOM 3477 C CG1 . VAL A 1 229 ? 36.607 12.477 64.588 1.00 25.41 ? 258 VAL A CG1 1 ATOM 3478 C CG2 . VAL A 1 229 ? 35.597 10.854 66.200 1.00 25.85 ? 258 VAL A CG2 1 ATOM 3479 H H . VAL A 1 229 ? 37.291 12.035 68.573 1.00 36.86 ? 258 VAL A H 1 ATOM 3480 H HA . VAL A 1 229 ? 38.293 11.138 66.207 1.00 30.81 ? 258 VAL A HA 1 ATOM 3481 H HB . VAL A 1 229 ? 36.031 12.824 66.520 1.00 30.79 ? 258 VAL A HB 1 ATOM 3482 H HG11 . VAL A 1 229 ? 35.723 12.622 64.215 1.00 30.49 ? 258 VAL A HG11 1 ATOM 3483 H HG12 . VAL A 1 229 ? 37.131 13.291 64.523 1.00 30.49 ? 258 VAL A HG12 1 ATOM 3484 H HG13 . VAL A 1 229 ? 37.052 11.758 64.114 1.00 30.49 ? 258 VAL A HG13 1 ATOM 3485 H HG21 . VAL A 1 229 ? 34.733 11.028 65.793 1.00 31.03 ? 258 VAL A HG21 1 ATOM 3486 H HG22 . VAL A 1 229 ? 36.030 10.110 65.754 1.00 31.03 ? 258 VAL A HG22 1 ATOM 3487 H HG23 . VAL A 1 229 ? 35.484 10.655 67.143 1.00 31.03 ? 258 VAL A HG23 1 ATOM 3488 N N . LYS A 1 230 ? 40.006 12.943 66.432 1.00 38.76 ? 259 LYS A N 1 ATOM 3489 C CA . LYS A 1 230 ? 40.897 14.085 66.286 1.00 38.41 ? 259 LYS A CA 1 ATOM 3490 C C . LYS A 1 230 ? 40.703 14.733 64.920 1.00 35.17 ? 259 LYS A C 1 ATOM 3491 O O . LYS A 1 230 ? 40.561 14.047 63.909 1.00 33.19 ? 259 LYS A O 1 ATOM 3492 C CB . LYS A 1 230 ? 42.353 13.664 66.477 1.00 40.49 ? 259 LYS A CB 1 ATOM 3493 C CG . LYS A 1 230 ? 42.621 12.990 67.813 1.00 41.71 ? 259 LYS A CG 1 ATOM 3494 C CD . LYS A 1 230 ? 44.076 13.127 68.229 1.00 43.44 ? 259 LYS A CD 1 ATOM 3495 C CE . LYS A 1 230 ? 44.388 12.269 69.448 1.00 46.10 ? 259 LYS A CE 1 ATOM 3496 N NZ . LYS A 1 230 ? 45.846 12.239 69.753 1.00 48.72 ? 259 LYS A NZ 1 ATOM 3497 H H . LYS A 1 230 ? 40.402 12.180 66.425 1.00 46.51 ? 259 LYS A H 1 ATOM 3498 H HA . LYS A 1 230 ? 40.682 14.743 66.965 1.00 46.09 ? 259 LYS A HA 1 ATOM 3499 H HB2 . LYS A 1 230 ? 42.593 13.038 65.776 1.00 48.59 ? 259 LYS A HB2 1 ATOM 3500 H HB3 . LYS A 1 230 ? 42.917 14.451 66.423 1.00 48.59 ? 259 LYS A HB3 1 ATOM 3501 H HG2 . LYS A 1 230 ? 42.070 13.405 68.496 1.00 50.05 ? 259 LYS A HG2 1 ATOM 3502 H HG3 . LYS A 1 230 ? 42.413 12.046 67.743 1.00 50.05 ? 259 LYS A HG3 1 ATOM 3503 H HD2 . LYS A 1 230 ? 44.646 12.838 67.500 1.00 52.13 ? 259 LYS A HD2 1 ATOM 3504 H HD3 . LYS A 1 230 ? 44.260 14.052 68.453 1.00 52.13 ? 259 LYS A HD3 1 ATOM 3505 H HE2 . LYS A 1 230 ? 43.926 12.632 70.219 1.00 55.32 ? 259 LYS A HE2 1 ATOM 3506 H HE3 . LYS A 1 230 ? 44.096 11.360 69.280 1.00 55.32 ? 259 LYS A HE3 1 ATOM 3507 H HZ1 . LYS A 1 230 ? 45.996 11.731 70.468 1.00 58.47 ? 259 LYS A HZ1 1 ATOM 3508 H HZ2 . LYS A 1 230 ? 46.294 11.904 69.061 1.00 58.47 ? 259 LYS A HZ2 1 ATOM 3509 H HZ3 . LYS A 1 230 ? 46.140 13.063 69.916 1.00 58.47 ? 259 LYS A HZ3 1 ATOM 3510 N N . GLY A 1 231 ? 40.698 16.061 64.901 1.00 33.45 ? 260 GLY A N 1 ATOM 3511 C CA . GLY A 1 231 ? 40.471 16.806 63.678 1.00 33.94 ? 260 GLY A CA 1 ATOM 3512 C C . GLY A 1 231 ? 40.586 18.297 63.922 1.00 35.62 ? 260 GLY A C 1 ATOM 3513 O O . GLY A 1 231 ? 41.116 18.722 64.948 1.00 38.06 ? 260 GLY A O 1 ATOM 3514 H H . GLY A 1 231 ? 40.824 16.555 65.593 1.00 40.14 ? 260 GLY A H 1 ATOM 3515 H HA2 . GLY A 1 231 ? 41.126 16.548 63.011 1.00 40.72 ? 260 GLY A HA2 1 ATOM 3516 H HA3 . GLY A 1 231 ? 39.584 16.614 63.336 1.00 40.72 ? 260 GLY A HA3 1 ATOM 3517 N N . SER A 1 232 ? 40.086 19.094 62.984 1.00 26.95 ? 261 SER A N 1 ATOM 3518 C CA . SER A 1 232 ? 40.173 20.543 63.100 1.00 25.06 ? 261 SER A CA 1 ATOM 3519 C C . SER A 1 232 ? 39.263 21.251 62.108 1.00 29.31 ? 261 SER A C 1 ATOM 3520 O O . SER A 1 232 ? 38.814 20.665 61.121 1.00 24.70 ? 261 SER A O 1 ATOM 3521 C CB . SER A 1 232 ? 41.613 21.008 62.887 1.00 25.20 ? 261 SER A CB 1 ATOM 3522 O OG . SER A 1 232 ? 42.092 20.603 61.616 1.00 25.04 ? 261 SER A OG 1 ATOM 3523 H H . SER A 1 232 ? 39.692 18.820 62.270 1.00 32.35 ? 261 SER A H 1 ATOM 3524 H HA . SER A 1 232 ? 39.903 20.804 63.994 1.00 30.08 ? 261 SER A HA 1 ATOM 3525 H HB2 . SER A 1 232 ? 41.644 21.976 62.942 1.00 30.24 ? 261 SER A HB2 1 ATOM 3526 H HB3 . SER A 1 232 ? 42.176 20.618 63.575 1.00 30.24 ? 261 SER A HB3 1 ATOM 3527 H HG . SER A 1 232 ? 42.883 20.864 61.510 1.00 30.05 ? 261 SER A HG 1 ATOM 3528 N N . CYS A 1 233 ? 38.998 22.523 62.386 1.00 35.95 ? 262 CYS A N 1 ATOM 3529 C CA . CYS A 1 233 ? 38.194 23.358 61.507 1.00 35.87 ? 262 CYS A CA 1 ATOM 3530 C C . CYS A 1 233 ? 38.904 23.557 60.173 1.00 34.90 ? 262 CYS A C 1 ATOM 3531 O O . CYS A 1 233 ? 40.067 23.955 60.134 1.00 36.31 ? 262 CYS A O 1 ATOM 3532 C CB . CYS A 1 233 ? 37.916 24.705 62.175 1.00 36.58 ? 262 CYS A CB 1 ATOM 3533 S SG . CYS A 1 233 ? 36.893 25.831 61.216 1.00 56.71 ? 262 CYS A SG 1 ATOM 3534 H H . CYS A 1 233 ? 39.278 22.930 63.090 1.00 43.15 ? 262 CYS A H 1 ATOM 3535 H HA . CYS A 1 233 ? 37.345 22.921 61.338 1.00 43.04 ? 262 CYS A HA 1 ATOM 3536 H HB2 . CYS A 1 233 ? 37.464 24.544 63.018 1.00 43.90 ? 262 CYS A HB2 1 ATOM 3537 H HB3 . CYS A 1 233 ? 38.763 25.148 62.339 1.00 43.90 ? 262 CYS A HB3 1 ATOM 3538 N N . PHE A 1 234 ? 38.200 23.268 59.083 1.00 33.42 ? 263 PHE A N 1 ATOM 3539 C CA . PHE A 1 234 ? 38.760 23.419 57.746 1.00 31.64 ? 263 PHE A CA 1 ATOM 3540 C C . PHE A 1 234 ? 38.549 24.835 57.228 1.00 31.11 ? 263 PHE A C 1 ATOM 3541 O O . PHE A 1 234 ? 37.419 25.316 57.167 1.00 30.31 ? 263 PHE A O 1 ATOM 3542 C CB . PHE A 1 234 ? 38.130 22.410 56.788 1.00 30.90 ? 263 PHE A CB 1 ATOM 3543 C CG . PHE A 1 234 ? 38.546 22.594 55.360 1.00 29.69 ? 263 PHE A CG 1 ATOM 3544 C CD1 . PHE A 1 234 ? 39.880 22.511 55.001 1.00 28.91 ? 263 PHE A CD1 1 ATOM 3545 C CD2 . PHE A 1 234 ? 37.605 22.847 54.377 1.00 29.06 ? 263 PHE A CD2 1 ATOM 3546 C CE1 . PHE A 1 234 ? 40.268 22.679 53.687 1.00 28.87 ? 263 PHE A CE1 1 ATOM 3547 C CE2 . PHE A 1 234 ? 37.987 23.016 53.060 1.00 28.67 ? 263 PHE A CE2 1 ATOM 3548 C CZ . PHE A 1 234 ? 39.320 22.932 52.715 1.00 28.72 ? 263 PHE A CZ 1 ATOM 3549 H H . PHE A 1 234 ? 37.390 22.980 59.093 1.00 40.10 ? 263 PHE A H 1 ATOM 3550 H HA . PHE A 1 234 ? 39.714 23.248 57.780 1.00 37.96 ? 263 PHE A HA 1 ATOM 3551 H HB2 . PHE A 1 234 ? 38.390 21.515 57.060 1.00 37.09 ? 263 PHE A HB2 1 ATOM 3552 H HB3 . PHE A 1 234 ? 37.165 22.499 56.829 1.00 37.09 ? 263 PHE A HB3 1 ATOM 3553 H HD1 . PHE A 1 234 ? 40.522 22.341 55.652 1.00 34.69 ? 263 PHE A HD1 1 ATOM 3554 H HD2 . PHE A 1 234 ? 36.705 22.905 54.605 1.00 34.87 ? 263 PHE A HD2 1 ATOM 3555 H HE1 . PHE A 1 234 ? 41.168 22.622 53.456 1.00 34.65 ? 263 PHE A HE1 1 ATOM 3556 H HE2 . PHE A 1 234 ? 37.347 23.187 52.408 1.00 34.40 ? 263 PHE A HE2 1 ATOM 3557 H HZ . PHE A 1 234 ? 39.579 23.046 51.829 1.00 34.46 ? 263 PHE A HZ 1 ATOM 3558 N N . CYS A 1 235 ? 39.640 25.488 56.837 1.00 38.66 ? 264 CYS A N 1 ATOM 3559 C CA . CYS A 1 235 ? 39.591 26.879 56.400 1.00 39.12 ? 264 CYS A CA 1 ATOM 3560 C C . CYS A 1 235 ? 40.501 27.136 55.204 1.00 40.24 ? 264 CYS A C 1 ATOM 3561 O O . CYS A 1 235 ? 40.883 28.277 54.946 1.00 43.35 ? 264 CYS A O 1 ATOM 3562 C CB . CYS A 1 235 ? 39.983 27.803 57.553 1.00 37.93 ? 264 CYS A CB 1 ATOM 3563 S SG . CYS A 1 235 ? 38.988 27.589 59.041 1.00 43.22 ? 264 CYS A SG 1 ATOM 3564 H H . CYS A 1 235 ? 40.427 25.143 56.816 1.00 46.39 ? 264 CYS A H 1 ATOM 3565 H HA . CYS A 1 235 ? 38.682 27.095 56.138 1.00 46.94 ? 264 CYS A HA 1 ATOM 3566 H HB2 . CYS A 1 235 ? 40.908 27.632 57.788 1.00 45.52 ? 264 CYS A HB2 1 ATOM 3567 H HB3 . CYS A 1 235 ? 39.884 28.723 57.261 1.00 45.52 ? 264 CYS A HB3 1 ATOM 3568 N N . ASN A 1 236 ? 40.850 26.075 54.484 1.00 24.60 ? 265 ASN A N 1 ATOM 3569 C CA . ASN A 1 236 ? 41.695 26.185 53.298 1.00 24.83 ? 265 ASN A CA 1 ATOM 3570 C C . ASN A 1 236 ? 43.009 26.912 53.577 1.00 24.98 ? 265 ASN A C 1 ATOM 3571 O O . ASN A 1 236 ? 43.620 27.486 52.677 1.00 25.21 ? 265 ASN A O 1 ATOM 3572 C CB . ASN A 1 236 ? 40.934 26.891 52.171 1.00 24.88 ? 265 ASN A CB 1 ATOM 3573 C CG . ASN A 1 236 ? 39.882 26.007 51.542 1.00 25.03 ? 265 ASN A CG 1 ATOM 3574 O OD1 . ASN A 1 236 ? 40.194 25.137 50.730 1.00 25.37 ? 265 ASN A OD1 1 ATOM 3575 N ND2 . ASN A 1 236 ? 38.625 26.227 51.909 1.00 24.94 ? 265 ASN A ND2 1 ATOM 3576 H H . ASN A 1 236 ? 40.608 25.269 54.664 1.00 29.52 ? 265 ASN A H 1 ATOM 3577 H HA . ASN A 1 236 ? 41.914 25.292 52.990 1.00 29.80 ? 265 ASN A HA 1 ATOM 3578 H HB2 . ASN A 1 236 ? 40.493 27.676 52.530 1.00 29.86 ? 265 ASN A HB2 1 ATOM 3579 H HB3 . ASN A 1 236 ? 41.562 27.150 51.478 1.00 29.86 ? 265 ASN A HB3 1 ATOM 3580 H HD21 . ASN A 1 236 ? 37.991 25.750 51.578 1.00 29.93 ? 265 ASN A HD21 1 ATOM 3581 H HD22 . ASN A 1 236 ? 38.445 26.847 52.477 1.00 29.93 ? 265 ASN A HD22 1 ATOM 3582 N N . GLY A 1 237 ? 43.439 26.883 54.833 1.00 36.55 ? 266 GLY A N 1 ATOM 3583 C CA . GLY A 1 237 ? 44.712 27.461 55.213 1.00 37.73 ? 266 GLY A CA 1 ATOM 3584 C C . GLY A 1 237 ? 44.708 28.975 55.336 1.00 37.71 ? 266 GLY A C 1 ATOM 3585 O O . GLY A 1 237 ? 45.771 29.594 55.391 1.00 39.04 ? 266 GLY A O 1 ATOM 3586 H H . GLY A 1 237 ? 43.005 26.531 55.486 1.00 43.86 ? 266 GLY A H 1 ATOM 3587 H HA2 . GLY A 1 237 ? 44.983 27.092 56.068 1.00 45.27 ? 266 GLY A HA2 1 ATOM 3588 H HA3 . GLY A 1 237 ? 45.380 27.216 54.554 1.00 45.27 ? 266 GLY A HA3 1 ATOM 3589 N N . HIS A 1 238 ? 43.516 29.569 55.379 1.00 24.98 ? 267 HIS A N 1 ATOM 3590 C CA . HIS A 1 238 ? 43.372 31.022 55.483 1.00 25.43 ? 267 HIS A CA 1 ATOM 3591 C C . HIS A 1 238 ? 42.842 31.459 56.849 1.00 30.16 ? 267 HIS A C 1 ATOM 3592 O O . HIS A 1 238 ? 42.282 32.547 56.982 1.00 25.14 ? 267 HIS A O 1 ATOM 3593 C CB . HIS A 1 238 ? 42.442 31.542 54.384 1.00 25.52 ? 267 HIS A CB 1 ATOM 3594 C CG . HIS A 1 238 ? 42.929 31.266 52.996 1.00 28.44 ? 267 HIS A CG 1 ATOM 3595 N ND1 . HIS A 1 238 ? 44.085 31.821 52.487 1.00 25.22 ? 267 HIS A ND1 1 ATOM 3596 C CD2 . HIS A 1 238 ? 42.413 30.502 52.004 1.00 24.92 ? 267 HIS A CD2 1 ATOM 3597 C CE1 . HIS A 1 238 ? 44.262 31.406 51.247 1.00 25.40 ? 267 HIS A CE1 1 ATOM 3598 N NE2 . HIS A 1 238 ? 43.260 30.605 50.929 1.00 25.23 ? 267 HIS A NE2 1 ATOM 3599 H H . HIS A 1 238 ? 42.767 29.148 55.350 1.00 29.98 ? 267 HIS A H 1 ATOM 3600 H HA . HIS A 1 238 ? 44.242 31.432 55.356 1.00 30.52 ? 267 HIS A HA 1 ATOM 3601 H HB2 . HIS A 1 238 ? 41.575 31.119 54.483 1.00 30.62 ? 267 HIS A HB2 1 ATOM 3602 H HB3 . HIS A 1 238 ? 42.352 32.503 54.480 1.00 30.62 ? 267 HIS A HB3 1 ATOM 3603 H HD2 . HIS A 1 238 ? 41.632 29.999 52.045 1.00 29.90 ? 267 HIS A HD2 1 ATOM 3604 H HE1 . HIS A 1 238 ? 44.970 31.639 50.691 1.00 30.48 ? 267 HIS A HE1 1 ATOM 3605 N N . ALA A 1 239 ? 43.017 30.616 57.863 1.00 28.09 ? 268 ALA A N 1 ATOM 3606 C CA . ALA A 1 239 ? 42.542 30.938 59.206 1.00 33.57 ? 268 ALA A CA 1 ATOM 3607 C C . ALA A 1 239 ? 43.174 30.035 60.262 1.00 28.60 ? 268 ALA A C 1 ATOM 3608 O O . ALA A 1 239 ? 43.615 28.925 59.963 1.00 28.48 ? 268 ALA A O 1 ATOM 3609 C CB . ALA A 1 239 ? 41.029 30.830 59.266 1.00 28.14 ? 268 ALA A CB 1 ATOM 3610 H H . ALA A 1 239 ? 43.407 29.852 57.800 1.00 33.71 ? 268 ALA A H 1 ATOM 3611 H HA . ALA A 1 239 ? 42.785 31.854 59.413 1.00 40.29 ? 268 ALA A HA 1 ATOM 3612 H HB1 . ALA A 1 239 ? 40.733 31.047 60.163 1.00 33.77 ? 268 ALA A HB1 1 ATOM 3613 H HB2 . ALA A 1 239 ? 40.643 31.453 58.630 1.00 33.77 ? 268 ALA A HB2 1 ATOM 3614 H HB3 . ALA A 1 239 ? 40.769 29.923 59.041 1.00 33.77 ? 268 ALA A HB3 1 ATOM 3615 N N . ASP A 1 240 ? 43.210 30.529 61.498 1.00 33.80 ? 269 ASP A N 1 ATOM 3616 C CA . ASP A 1 240 ? 43.766 29.787 62.626 1.00 37.40 ? 269 ASP A CA 1 ATOM 3617 C C . ASP A 1 240 ? 42.814 29.806 63.819 1.00 39.00 ? 269 ASP A C 1 ATOM 3618 O O . ASP A 1 240 ? 43.186 29.427 64.931 1.00 39.12 ? 269 ASP A O 1 ATOM 3619 C CB . ASP A 1 240 ? 45.120 30.372 63.029 1.00 40.93 ? 269 ASP A CB 1 ATOM 3620 C CG . ASP A 1 240 ? 45.052 31.860 63.318 1.00 43.36 ? 269 ASP A CG 1 ATOM 3621 O OD1 . ASP A 1 240 ? 44.021 32.336 63.840 1.00 44.21 ? 269 ASP A OD1 1 ATOM 3622 O OD2 . ASP A 1 240 ? 46.037 32.563 63.020 1.00 44.61 ? 269 ASP A OD2 1 ATOM 3623 H H . ASP A 1 240 ? 42.913 31.308 61.711 1.00 40.56 ? 269 ASP A H 1 ATOM 3624 H HA . ASP A 1 240 ? 43.902 28.864 62.363 1.00 44.88 ? 269 ASP A HA 1 ATOM 3625 H HB2 . ASP A 1 240 ? 45.431 29.924 63.831 1.00 49.11 ? 269 ASP A HB2 1 ATOM 3626 H HB3 . ASP A 1 240 ? 45.751 30.235 62.305 1.00 49.11 ? 269 ASP A HB3 1 ATOM 3627 N N . GLN A 1 241 ? 41.587 30.258 63.583 1.00 43.24 ? 270 GLN A N 1 ATOM 3628 C CA . GLN A 1 241 ? 40.597 30.378 64.642 1.00 45.09 ? 270 GLN A CA 1 ATOM 3629 C C . GLN A 1 241 ? 39.193 30.302 64.057 1.00 47.33 ? 270 GLN A C 1 ATOM 3630 O O . GLN A 1 241 ? 38.904 30.934 63.042 1.00 47.45 ? 270 GLN A O 1 ATOM 3631 C CB . GLN A 1 241 ? 40.788 31.691 65.402 1.00 44.97 ? 270 GLN A CB 1 ATOM 3632 C CG . GLN A 1 241 ? 39.874 31.854 66.605 1.00 45.25 ? 270 GLN A CG 1 ATOM 3633 C CD . GLN A 1 241 ? 39.991 33.223 67.242 1.00 45.83 ? 270 GLN A CD 1 ATOM 3634 O OE1 . GLN A 1 241 ? 40.788 34.058 66.809 1.00 45.83 ? 270 GLN A OE1 1 ATOM 3635 N NE2 . GLN A 1 241 ? 39.194 33.464 68.276 1.00 46.29 ? 270 GLN A NE2 1 ATOM 3636 H H . GLN A 1 241 ? 41.303 30.505 62.810 1.00 51.89 ? 270 GLN A H 1 ATOM 3637 H HA . GLN A 1 241 ? 40.707 29.645 65.268 1.00 54.11 ? 270 GLN A HA 1 ATOM 3638 H HB2 . GLN A 1 241 ? 41.703 31.737 65.719 1.00 53.97 ? 270 GLN A HB2 1 ATOM 3639 H HB3 . GLN A 1 241 ? 40.613 32.429 64.797 1.00 53.97 ? 270 GLN A HB3 1 ATOM 3640 H HG2 . GLN A 1 241 ? 38.954 31.732 66.322 1.00 54.30 ? 270 GLN A HG2 1 ATOM 3641 H HG3 . GLN A 1 241 ? 40.108 31.190 67.272 1.00 54.30 ? 270 GLN A HG3 1 ATOM 3642 H HE21 . GLN A 1 241 ? 38.649 32.857 68.549 1.00 55.55 ? 270 GLN A HE21 1 ATOM 3643 H HE22 . GLN A 1 241 ? 39.223 34.227 68.673 1.00 55.55 ? 270 GLN A HE22 1 ATOM 3644 N N . CYS A 1 242 ? 38.329 29.528 64.709 1.00 46.51 ? 271 CYS A N 1 ATOM 3645 C CA . CYS A 1 242 ? 36.961 29.321 64.245 1.00 48.88 ? 271 CYS A CA 1 ATOM 3646 C C . CYS A 1 242 ? 35.941 29.658 65.331 1.00 50.85 ? 271 CYS A C 1 ATOM 3647 O O . CYS A 1 242 ? 36.211 29.501 66.522 1.00 50.22 ? 271 CYS A O 1 ATOM 3648 C CB . CYS A 1 242 ? 36.765 27.871 63.788 1.00 49.35 ? 271 CYS A CB 1 ATOM 3649 S SG . CYS A 1 242 ? 37.609 27.433 62.245 1.00 41.96 ? 271 CYS A SG 1 ATOM 3650 H H . CYS A 1 242 ? 38.516 29.105 65.434 1.00 55.82 ? 271 CYS A H 1 ATOM 3651 H HA . CYS A 1 242 ? 36.793 29.900 63.486 1.00 58.66 ? 271 CYS A HA 1 ATOM 3652 H HB2 . CYS A 1 242 ? 37.099 27.281 64.482 1.00 59.22 ? 271 CYS A HB2 1 ATOM 3653 H HB3 . CYS A 1 242 ? 35.817 27.714 63.658 1.00 59.22 ? 271 CYS A HB3 1 ATOM 3654 N N . LEU A 1 243 ? 34.773 30.125 64.898 1.00 41.01 ? 272 LEU A N 1 ATOM 3655 C CA . LEU A 1 243 ? 33.643 30.387 65.784 1.00 43.22 ? 272 LEU A CA 1 ATOM 3656 C C . LEU A 1 243 ? 32.532 29.375 65.505 1.00 41.39 ? 272 LEU A C 1 ATOM 3657 O O . LEU A 1 243 ? 32.609 28.631 64.529 1.00 43.69 ? 272 LEU A O 1 ATOM 3658 C CB . LEU A 1 243 ? 33.132 31.818 65.590 1.00 46.56 ? 272 LEU A CB 1 ATOM 3659 C CG . LEU A 1 243 ? 34.087 32.945 65.993 1.00 47.90 ? 272 LEU A CG 1 ATOM 3660 C CD1 . LEU A 1 243 ? 33.469 34.295 65.667 1.00 48.22 ? 272 LEU A CD1 1 ATOM 3661 C CD2 . LEU A 1 243 ? 34.448 32.868 67.471 1.00 48.65 ? 272 LEU A CD2 1 ATOM 3662 H H . LEU A 1 243 ? 34.607 30.303 64.073 1.00 49.22 ? 272 LEU A H 1 ATOM 3663 H HA . LEU A 1 243 ? 33.926 30.285 66.706 1.00 51.86 ? 272 LEU A HA 1 ATOM 3664 H HB2 . LEU A 1 243 ? 32.923 31.940 64.651 1.00 55.87 ? 272 LEU A HB2 1 ATOM 3665 H HB3 . LEU A 1 243 ? 32.324 31.925 66.115 1.00 55.87 ? 272 LEU A HB3 1 ATOM 3666 H HG . LEU A 1 243 ? 34.906 32.860 65.481 1.00 57.48 ? 272 LEU A HG 1 ATOM 3667 H HD11 . LEU A 1 243 ? 34.086 34.996 65.928 1.00 57.87 ? 272 LEU A HD11 1 ATOM 3668 H HD12 . LEU A 1 243 ? 33.299 34.342 64.713 1.00 57.87 ? 272 LEU A HD12 1 ATOM 3669 H HD13 . LEU A 1 243 ? 32.636 34.388 66.156 1.00 57.87 ? 272 LEU A HD13 1 ATOM 3670 H HD21 . LEU A 1 243 ? 35.052 33.596 67.686 1.00 58.38 ? 272 LEU A HD21 1 ATOM 3671 H HD22 . LEU A 1 243 ? 33.637 32.944 67.998 1.00 58.38 ? 272 LEU A HD22 1 ATOM 3672 H HD23 . LEU A 1 243 ? 34.879 32.017 67.646 1.00 58.38 ? 272 LEU A HD23 1 ATOM 3673 N N . PRO A 1 244 ? 31.504 29.328 66.370 1.00 32.16 ? 273 PRO A N 1 ATOM 3674 C CA . PRO A 1 244 ? 30.384 28.406 66.148 1.00 32.47 ? 273 PRO A CA 1 ATOM 3675 C C . PRO A 1 244 ? 29.698 28.580 64.793 1.00 29.80 ? 273 PRO A C 1 ATOM 3676 O O . PRO A 1 244 ? 29.650 29.686 64.256 1.00 29.89 ? 273 PRO A O 1 ATOM 3677 C CB . PRO A 1 244 ? 29.423 28.753 67.285 1.00 31.37 ? 273 PRO A CB 1 ATOM 3678 C CG . PRO A 1 244 ? 30.302 29.239 68.372 1.00 47.20 ? 273 PRO A CG 1 ATOM 3679 C CD . PRO A 1 244 ? 31.420 29.978 67.690 1.00 36.71 ? 273 PRO A CD 1 ATOM 3680 H HA . PRO A 1 244 ? 30.679 27.487 66.245 1.00 38.96 ? 273 PRO A HA 1 ATOM 3681 H HB2 . PRO A 1 244 ? 28.811 29.450 66.998 1.00 37.65 ? 273 PRO A HB2 1 ATOM 3682 H HB3 . PRO A 1 244 ? 28.939 27.960 67.561 1.00 37.65 ? 273 PRO A HB3 1 ATOM 3683 H HG2 . PRO A 1 244 ? 29.803 29.836 68.953 1.00 56.64 ? 273 PRO A HG2 1 ATOM 3684 H HG3 . PRO A 1 244 ? 30.648 28.484 68.873 1.00 56.64 ? 273 PRO A HG3 1 ATOM 3685 H HD2 . PRO A 1 244 ? 31.195 30.916 67.592 1.00 44.05 ? 273 PRO A HD2 1 ATOM 3686 H HD3 . PRO A 1 244 ? 32.250 29.860 68.178 1.00 44.05 ? 273 PRO A HD3 1 ATOM 3687 N N . VAL A 1 245 ? 29.179 27.481 64.253 1.00 36.74 ? 274 VAL A N 1 ATOM 3688 C CA . VAL A 1 245 ? 28.454 27.504 62.989 1.00 32.86 ? 274 VAL A CA 1 ATOM 3689 C C . VAL A 1 245 ? 27.020 27.942 63.268 1.00 40.01 ? 274 VAL A C 1 ATOM 3690 O O . VAL A 1 245 ? 26.443 27.558 64.284 1.00 38.28 ? 274 VAL A O 1 ATOM 3691 C CB . VAL A 1 245 ? 28.465 26.124 62.298 1.00 31.50 ? 274 VAL A CB 1 ATOM 3692 C CG1 . VAL A 1 245 ? 28.102 26.260 60.829 1.00 31.38 ? 274 VAL A CG1 1 ATOM 3693 C CG2 . VAL A 1 245 ? 29.833 25.464 62.438 1.00 30.56 ? 274 VAL A CG2 1 ATOM 3694 H H . VAL A 1 245 ? 29.235 26.699 64.606 1.00 44.08 ? 274 VAL A H 1 ATOM 3695 H HA . VAL A 1 245 ? 28.863 28.151 62.393 1.00 39.44 ? 274 VAL A HA 1 ATOM 3696 H HB . VAL A 1 245 ? 27.807 25.550 62.721 1.00 37.80 ? 274 VAL A HB 1 ATOM 3697 H HG11 . VAL A 1 245 ? 28.116 25.381 60.419 1.00 37.66 ? 274 VAL A HG11 1 ATOM 3698 H HG12 . VAL A 1 245 ? 27.215 26.644 60.758 1.00 37.66 ? 274 VAL A HG12 1 ATOM 3699 H HG13 . VAL A 1 245 ? 28.750 26.838 60.396 1.00 37.66 ? 274 VAL A HG13 1 ATOM 3700 H HG21 . VAL A 1 245 ? 29.813 24.600 61.996 1.00 36.67 ? 274 VAL A HG21 1 ATOM 3701 H HG22 . VAL A 1 245 ? 30.502 26.032 62.024 1.00 36.67 ? 274 VAL A HG22 1 ATOM 3702 H HG23 . VAL A 1 245 ? 30.033 25.349 63.380 1.00 36.67 ? 274 VAL A HG23 1 ATOM 3703 N N . GLU A 1 246 ? 26.449 28.746 62.377 1.00 73.29 ? 275 GLU A N 1 ATOM 3704 C CA . GLU A 1 246 ? 25.115 29.299 62.597 1.00 76.37 ? 275 GLU A CA 1 ATOM 3705 C C . GLU A 1 246 ? 24.061 28.205 62.737 1.00 76.40 ? 275 GLU A C 1 ATOM 3706 O O . GLU A 1 246 ? 23.981 27.296 61.911 1.00 77.99 ? 275 GLU A O 1 ATOM 3707 C CB . GLU A 1 246 ? 24.734 30.243 61.453 1.00 77.29 ? 275 GLU A CB 1 ATOM 3708 C CG . GLU A 1 246 ? 25.463 31.579 61.479 1.00 77.77 ? 275 GLU A CG 1 ATOM 3709 C CD . GLU A 1 246 ? 25.087 32.432 62.678 1.00 79.84 ? 275 GLU A CD 1 ATOM 3710 O OE1 . GLU A 1 246 ? 24.047 32.150 63.310 1.00 81.21 ? 275 GLU A OE1 1 ATOM 3711 O OE2 . GLU A 1 246 ? 25.832 33.385 62.989 1.00 79.71 ? 275 GLU A OE2 1 ATOM 3712 H H . GLU A 1 246 ? 26.813 28.987 61.636 1.00 87.94 ? 275 GLU A H 1 ATOM 3713 H HA . GLU A 1 246 ? 25.121 29.814 63.419 1.00 91.64 ? 275 GLU A HA 1 ATOM 3714 H HB2 . GLU A 1 246 ? 24.941 29.810 60.610 1.00 92.75 ? 275 GLU A HB2 1 ATOM 3715 H HB3 . GLU A 1 246 ? 23.783 30.424 61.504 1.00 92.75 ? 275 GLU A HB3 1 ATOM 3716 H HG2 . GLU A 1 246 ? 26.419 31.417 61.515 1.00 93.33 ? 275 GLU A HG2 1 ATOM 3717 H HG3 . GLU A 1 246 ? 25.241 32.076 60.676 1.00 93.33 ? 275 GLU A HG3 1 ATOM 3718 N N . GLY A 1 247 ? 23.254 28.307 63.790 1.00 53.20 ? 276 GLY A N 1 ATOM 3719 C CA . GLY A 1 247 ? 22.177 27.364 64.033 1.00 51.53 ? 276 GLY A CA 1 ATOM 3720 C C . GLY A 1 247 ? 22.594 26.124 64.806 1.00 49.46 ? 276 GLY A C 1 ATOM 3721 O O . GLY A 1 247 ? 21.768 25.247 65.061 1.00 48.79 ? 276 GLY A O 1 ATOM 3722 H H . GLY A 1 247 ? 23.314 28.925 64.385 1.00 63.84 ? 276 GLY A H 1 ATOM 3723 H HA2 . GLY A 1 247 ? 21.474 27.808 64.533 1.00 61.84 ? 276 GLY A HA2 1 ATOM 3724 H HA3 . GLY A 1 247 ? 21.808 27.078 63.182 1.00 61.84 ? 276 GLY A HA3 1 ATOM 3725 N N . PHE A 1 248 ? 23.868 26.046 65.180 1.00 45.41 ? 277 PHE A N 1 ATOM 3726 C CA . PHE A 1 248 ? 24.380 24.894 65.919 1.00 46.49 ? 277 PHE A CA 1 ATOM 3727 C C . PHE A 1 248 ? 24.336 25.116 67.427 1.00 47.67 ? 277 PHE A C 1 ATOM 3728 O O . PHE A 1 248 ? 25.026 25.988 67.954 1.00 48.44 ? 277 PHE A O 1 ATOM 3729 C CB . PHE A 1 248 ? 25.813 24.579 65.494 1.00 46.67 ? 277 PHE A CB 1 ATOM 3730 C CG . PHE A 1 248 ? 26.452 23.485 66.299 1.00 49.78 ? 277 PHE A CG 1 ATOM 3731 C CD1 . PHE A 1 248 ? 26.208 22.154 66.002 1.00 50.98 ? 277 PHE A CD1 1 ATOM 3732 C CD2 . PHE A 1 248 ? 27.292 23.787 67.358 1.00 51.68 ? 277 PHE A CD2 1 ATOM 3733 C CE1 . PHE A 1 248 ? 26.793 21.146 66.745 1.00 51.82 ? 277 PHE A CE1 1 ATOM 3734 C CE2 . PHE A 1 248 ? 27.879 22.784 68.104 1.00 52.50 ? 277 PHE A CE2 1 ATOM 3735 C CZ . PHE A 1 248 ? 27.629 21.462 67.798 1.00 52.34 ? 277 PHE A CZ 1 ATOM 3736 H H . PHE A 1 248 ? 24.459 26.649 65.017 1.00 54.49 ? 277 PHE A H 1 ATOM 3737 H HA . PHE A 1 248 ? 23.831 24.121 65.715 1.00 55.79 ? 277 PHE A HA 1 ATOM 3738 H HB2 . PHE A 1 248 ? 25.811 24.301 64.565 1.00 56.01 ? 277 PHE A HB2 1 ATOM 3739 H HB3 . PHE A 1 248 ? 26.354 25.378 65.597 1.00 56.01 ? 277 PHE A HB3 1 ATOM 3740 H HD1 . PHE A 1 248 ? 25.645 21.936 65.295 1.00 61.17 ? 277 PHE A HD1 1 ATOM 3741 H HD2 . PHE A 1 248 ? 27.463 24.677 67.569 1.00 62.01 ? 277 PHE A HD2 1 ATOM 3742 H HE1 . PHE A 1 248 ? 26.623 20.256 66.537 1.00 62.18 ? 277 PHE A HE1 1 ATOM 3743 H HE2 . PHE A 1 248 ? 28.442 23.000 68.812 1.00 63.00 ? 277 PHE A HE2 1 ATOM 3744 H HZ . PHE A 1 248 ? 28.024 20.785 68.298 1.00 62.81 ? 277 PHE A HZ 1 ATOM 3745 N N . ARG A 1 249 ? 23.527 24.310 68.112 1.00 63.41 ? 278 ARG A N 1 ATOM 3746 C CA . ARG A 1 249 ? 23.450 24.331 69.570 1.00 63.75 ? 278 ARG A CA 1 ATOM 3747 C C . ARG A 1 249 ? 24.135 23.094 70.155 1.00 62.73 ? 278 ARG A C 1 ATOM 3748 O O . ARG A 1 249 ? 23.557 22.008 70.139 1.00 65.19 ? 278 ARG A O 1 ATOM 3749 C CB . ARG A 1 249 ? 21.993 24.389 70.028 1.00 64.57 ? 278 ARG A CB 1 ATOM 3750 H H . ARG A 1 249 ? 23.004 23.733 67.748 1.00 76.10 ? 278 ARG A H 1 ATOM 3751 H HA . ARG A 1 249 ? 23.907 25.119 69.904 1.00 76.50 ? 278 ARG A HA 1 ATOM 3752 N N . PRO A 1 250 ? 25.369 23.246 70.672 1.00 37.66 ? 279 PRO A N 1 ATOM 3753 C CA . PRO A 1 250 ? 26.053 22.078 71.246 1.00 34.13 ? 279 PRO A CA 1 ATOM 3754 C C . PRO A 1 250 ? 25.377 21.564 72.512 1.00 46.92 ? 279 PRO A C 1 ATOM 3755 O O . PRO A 1 250 ? 24.571 22.277 73.110 1.00 48.19 ? 279 PRO A O 1 ATOM 3756 C CB . PRO A 1 250 ? 27.458 22.605 71.556 1.00 33.43 ? 279 PRO A CB 1 ATOM 3757 C CG . PRO A 1 250 ? 27.295 24.074 71.693 1.00 45.21 ? 279 PRO A CG 1 ATOM 3758 C CD . PRO A 1 250 ? 26.198 24.462 70.751 1.00 34.47 ? 279 PRO A CD 1 ATOM 3759 H HA . PRO A 1 250 ? 26.111 21.362 70.594 1.00 40.95 ? 279 PRO A HA 1 ATOM 3760 H HB2 . PRO A 1 250 ? 27.778 22.216 72.385 1.00 40.11 ? 279 PRO A HB2 1 ATOM 3761 H HB3 . PRO A 1 250 ? 28.057 22.393 70.822 1.00 40.11 ? 279 PRO A HB3 1 ATOM 3762 H HG2 . PRO A 1 250 ? 27.050 24.289 72.607 1.00 54.25 ? 279 PRO A HG2 1 ATOM 3763 H HG3 . PRO A 1 250 ? 28.123 24.516 71.450 1.00 54.25 ? 279 PRO A HG3 1 ATOM 3764 H HD2 . PRO A 1 250 ? 25.683 25.199 71.117 1.00 41.36 ? 279 PRO A HD2 1 ATOM 3765 H HD3 . PRO A 1 250 ? 26.562 24.681 69.879 1.00 41.36 ? 279 PRO A HD3 1 ATOM 3766 N N . ILE A 1 251 ? 25.702 20.337 72.910 1.00 73.37 ? 280 ILE A N 1 ATOM 3767 C CA . ILE A 1 251 ? 25.107 19.732 74.098 1.00 75.77 ? 280 ILE A CA 1 ATOM 3768 C C . ILE A 1 251 ? 25.573 20.439 75.368 1.00 76.10 ? 280 ILE A C 1 ATOM 3769 O O . ILE A 1 251 ? 24.836 20.514 76.352 1.00 76.63 ? 280 ILE A O 1 ATOM 3770 C CB . ILE A 1 251 ? 25.446 18.229 74.198 1.00 76.47 ? 280 ILE A CB 1 ATOM 3771 C CG1 . ILE A 1 251 ? 26.964 18.022 74.251 1.00 76.53 ? 280 ILE A CG1 1 ATOM 3772 C CG2 . ILE A 1 251 ? 24.839 17.482 73.017 1.00 78.36 ? 280 ILE A CG2 1 ATOM 3773 C CD1 . ILE A 1 251 ? 27.390 16.586 74.477 1.00 74.83 ? 280 ILE A CD1 1 ATOM 3774 H H . ILE A 1 251 ? 26.269 19.832 72.506 1.00 88.05 ? 280 ILE A H 1 ATOM 3775 H HA . ILE A 1 251 ? 24.143 19.818 74.045 1.00 90.92 ? 280 ILE A HA 1 ATOM 3776 H HB . ILE A 1 251 ? 25.058 17.880 75.015 1.00 91.77 ? 280 ILE A HB 1 ATOM 3777 H HG12 . ILE A 1 251 ? 27.347 18.315 73.410 1.00 91.84 ? 280 ILE A HG12 1 ATOM 3778 H HG13 . ILE A 1 251 ? 27.324 18.554 74.978 1.00 91.84 ? 280 ILE A HG13 1 ATOM 3779 H HG21 . ILE A 1 251 ? 25.059 16.541 73.093 1.00 94.03 ? 280 ILE A HG21 1 ATOM 3780 H HG22 . ILE A 1 251 ? 23.876 17.599 73.031 1.00 94.03 ? 280 ILE A HG22 1 ATOM 3781 H HG23 . ILE A 1 251 ? 25.204 17.843 72.194 1.00 94.03 ? 280 ILE A HG23 1 ATOM 3782 H HD11 . ILE A 1 251 ? 28.359 16.545 74.497 1.00 89.80 ? 280 ILE A HD11 1 ATOM 3783 H HD12 . ILE A 1 251 ? 27.028 16.279 75.322 1.00 89.80 ? 280 ILE A HD12 1 ATOM 3784 H HD13 . ILE A 1 251 ? 27.051 16.039 73.752 1.00 89.80 ? 280 ILE A HD13 1 ATOM 3785 N N . ALA A 1 256 ? 31.163 21.115 80.335 1.00 79.67 ? 285 ALA A N 1 ATOM 3786 C CA . ALA A 1 256 ? 32.500 20.700 80.740 1.00 78.85 ? 285 ALA A CA 1 ATOM 3787 C C . ALA A 1 256 ? 33.248 20.072 79.568 1.00 76.44 ? 285 ALA A C 1 ATOM 3788 O O . ALA A 1 256 ? 33.778 18.965 79.683 1.00 76.09 ? 285 ALA A O 1 ATOM 3789 C CB . ALA A 1 256 ? 32.422 19.724 81.905 1.00 79.78 ? 285 ALA A CB 1 ATOM 3790 H HA . ALA A 1 256 ? 32.999 21.479 81.033 1.00 94.62 ? 285 ALA A HA 1 ATOM 3791 H HB1 . ALA A 1 256 ? 33.321 19.461 82.158 1.00 95.73 ? 285 ALA A HB1 1 ATOM 3792 H HB2 . ALA A 1 256 ? 31.981 20.159 82.652 1.00 95.73 ? 285 ALA A HB2 1 ATOM 3793 H HB3 . ALA A 1 256 ? 31.914 18.944 81.630 1.00 95.73 ? 285 ALA A HB3 1 ATOM 3794 N N . PHE A 1 257 ? 33.290 20.787 78.446 1.00 87.06 ? 286 PHE A N 1 ATOM 3795 C CA . PHE A 1 257 ? 33.929 20.285 77.233 1.00 83.28 ? 286 PHE A CA 1 ATOM 3796 C C . PHE A 1 257 ? 34.707 21.378 76.501 1.00 81.74 ? 286 PHE A C 1 ATOM 3797 O O . PHE A 1 257 ? 34.428 22.568 76.661 1.00 82.99 ? 286 PHE A O 1 ATOM 3798 C CB . PHE A 1 257 ? 32.881 19.682 76.294 1.00 81.08 ? 286 PHE A CB 1 ATOM 3799 H H . PHE A 1 257 ? 32.953 21.573 78.361 1.00 104.47 ? 286 PHE A H 1 ATOM 3800 H HA . PHE A 1 257 ? 34.554 19.583 77.473 1.00 99.93 ? 286 PHE A HA 1 ATOM 3801 N N . HIS A 1 258 ? 35.690 20.954 75.709 1.00 73.36 ? 287 HIS A N 1 ATOM 3802 C CA . HIS A 1 258 ? 36.467 21.855 74.860 1.00 72.03 ? 287 HIS A CA 1 ATOM 3803 C C . HIS A 1 258 ? 36.084 21.646 73.396 1.00 69.99 ? 287 HIS A C 1 ATOM 3804 O O . HIS A 1 258 ? 36.755 20.918 72.665 1.00 69.97 ? 287 HIS A O 1 ATOM 3805 C CB . HIS A 1 258 ? 37.966 21.622 75.055 1.00 71.23 ? 287 HIS A CB 1 ATOM 3806 H H . HIS A 1 258 ? 35.931 20.131 75.645 1.00 88.03 ? 287 HIS A H 1 ATOM 3807 H HA . HIS A 1 258 ? 36.267 22.774 75.099 1.00 86.44 ? 287 HIS A HA 1 ATOM 3808 N N . VAL A 1 259 ? 35.003 22.297 72.978 1.00 49.86 ? 288 VAL A N 1 ATOM 3809 C CA . VAL A 1 259 ? 34.398 22.047 71.673 1.00 49.82 ? 288 VAL A CA 1 ATOM 3810 C C . VAL A 1 259 ? 35.204 22.634 70.515 1.00 47.93 ? 288 VAL A C 1 ATOM 3811 O O . VAL A 1 259 ? 35.784 23.715 70.631 1.00 51.76 ? 288 VAL A O 1 ATOM 3812 C CB . VAL A 1 259 ? 32.967 22.622 71.618 1.00 53.76 ? 288 VAL A CB 1 ATOM 3813 C CG1 . VAL A 1 259 ? 32.285 22.260 70.306 1.00 54.39 ? 288 VAL A CG1 1 ATOM 3814 C CG2 . VAL A 1 259 ? 32.143 22.116 72.796 1.00 56.37 ? 288 VAL A CG2 1 ATOM 3815 H H . VAL A 1 259 ? 34.596 22.898 73.439 1.00 59.84 ? 288 VAL A H 1 ATOM 3816 H HA . VAL A 1 259 ? 34.338 21.088 71.536 1.00 59.79 ? 288 VAL A HA 1 ATOM 3817 H HB . VAL A 1 259 ? 33.012 23.589 71.677 1.00 64.51 ? 288 VAL A HB 1 ATOM 3818 H HG11 . VAL A 1 259 ? 31.390 22.635 70.302 1.00 65.26 ? 288 VAL A HG11 1 ATOM 3819 H HG12 . VAL A 1 259 ? 32.801 22.627 69.571 1.00 65.26 ? 288 VAL A HG12 1 ATOM 3820 H HG13 . VAL A 1 259 ? 32.240 21.294 70.230 1.00 65.26 ? 288 VAL A HG13 1 ATOM 3821 H HG21 . VAL A 1 259 ? 31.250 22.490 72.740 1.00 67.64 ? 288 VAL A HG21 1 ATOM 3822 H HG22 . VAL A 1 259 ? 32.099 21.147 72.757 1.00 67.64 ? 288 VAL A HG22 1 ATOM 3823 H HG23 . VAL A 1 259 ? 32.568 22.396 73.622 1.00 67.64 ? 288 VAL A HG23 1 ATOM 3824 N N . VAL A 1 260 ? 35.228 21.906 69.399 1.00 32.18 ? 289 VAL A N 1 ATOM 3825 C CA . VAL A 1 260 ? 35.817 22.390 68.153 1.00 29.44 ? 289 VAL A CA 1 ATOM 3826 C C . VAL A 1 260 ? 34.716 22.932 67.248 1.00 28.10 ? 289 VAL A C 1 ATOM 3827 O O . VAL A 1 260 ? 33.758 22.224 66.943 1.00 28.95 ? 289 VAL A O 1 ATOM 3828 C CB . VAL A 1 260 ? 36.584 21.275 67.416 1.00 30.13 ? 289 VAL A CB 1 ATOM 3829 C CG1 . VAL A 1 260 ? 37.209 21.806 66.130 1.00 30.53 ? 289 VAL A CG1 1 ATOM 3830 C CG2 . VAL A 1 260 ? 37.651 20.679 68.318 1.00 31.14 ? 289 VAL A CG2 1 ATOM 3831 H H . VAL A 1 260 ? 34.903 21.112 69.339 1.00 38.62 ? 289 VAL A H 1 ATOM 3832 H HA . VAL A 1 260 ? 36.437 23.111 68.348 1.00 35.33 ? 289 VAL A HA 1 ATOM 3833 H HB . VAL A 1 260 ? 35.963 20.569 67.178 1.00 36.16 ? 289 VAL A HB 1 ATOM 3834 H HG11 . VAL A 1 260 ? 37.683 21.084 65.689 1.00 36.64 ? 289 VAL A HG11 1 ATOM 3835 H HG12 . VAL A 1 260 ? 36.506 22.142 65.553 1.00 36.64 ? 289 VAL A HG12 1 ATOM 3836 H HG13 . VAL A 1 260 ? 37.826 22.521 66.352 1.00 36.64 ? 289 VAL A HG13 1 ATOM 3837 H HG21 . VAL A 1 260 ? 38.119 19.981 67.834 1.00 37.36 ? 289 VAL A HG21 1 ATOM 3838 H HG22 . VAL A 1 260 ? 38.273 21.377 68.576 1.00 37.36 ? 289 VAL A HG22 1 ATOM 3839 H HG23 . VAL A 1 260 ? 37.226 20.307 69.107 1.00 37.36 ? 289 VAL A HG23 1 ATOM 3840 N N . HIS A 1 261 ? 34.859 24.182 66.814 1.00 43.16 ? 290 HIS A N 1 ATOM 3841 C CA . HIS A 1 261 ? 33.845 24.836 65.989 1.00 43.32 ? 290 HIS A CA 1 ATOM 3842 C C . HIS A 1 261 ? 34.215 24.813 64.505 1.00 41.62 ? 290 HIS A C 1 ATOM 3843 O O . HIS A 1 261 ? 35.321 24.411 64.147 1.00 42.12 ? 290 HIS A O 1 ATOM 3844 C CB . HIS A 1 261 ? 33.634 26.271 66.460 1.00 44.82 ? 290 HIS A CB 1 ATOM 3845 C CG . HIS A 1 261 ? 33.035 26.371 67.829 1.00 46.35 ? 290 HIS A CG 1 ATOM 3846 N ND1 . HIS A 1 261 ? 33.609 27.103 68.845 1.00 47.45 ? 290 HIS A ND1 1 ATOM 3847 C CD2 . HIS A 1 261 ? 31.906 25.829 68.345 1.00 47.47 ? 290 HIS A CD2 1 ATOM 3848 C CE1 . HIS A 1 261 ? 32.861 27.004 69.932 1.00 48.81 ? 290 HIS A CE1 1 ATOM 3849 N NE2 . HIS A 1 261 ? 31.823 26.238 69.654 1.00 48.80 ? 290 HIS A NE2 1 ATOM 3850 H H . HIS A 1 261 ? 35.541 24.677 66.985 1.00 51.79 ? 290 HIS A H 1 ATOM 3851 H HA . HIS A 1 261 ? 33.004 24.362 66.092 1.00 51.98 ? 290 HIS A HA 1 ATOM 3852 H HB2 . HIS A 1 261 ? 34.491 26.724 66.478 1.00 53.79 ? 290 HIS A HB2 1 ATOM 3853 H HB3 . HIS A 1 261 ? 33.037 26.720 65.842 1.00 53.79 ? 290 HIS A HB3 1 ATOM 3854 H HD2 . HIS A 1 261 ? 31.302 25.281 67.898 1.00 56.97 ? 290 HIS A HD2 1 ATOM 3855 H HE1 . HIS A 1 261 ? 33.036 27.408 70.751 1.00 58.58 ? 290 HIS A HE1 1 ATOM 3856 N N . GLY A 1 262 ? 33.290 25.255 63.652 1.00 33.79 ? 291 GLY A N 1 ATOM 3857 C CA . GLY A 1 262 ? 33.434 25.114 62.210 1.00 30.88 ? 291 GLY A CA 1 ATOM 3858 C C . GLY A 1 262 ? 33.440 26.398 61.394 1.00 28.83 ? 291 GLY A C 1 ATOM 3859 O O . GLY A 1 262 ? 33.999 26.424 60.297 1.00 28.22 ? 291 GLY A O 1 ATOM 3860 H H . GLY A 1 262 ? 32.562 25.646 63.891 1.00 40.54 ? 291 GLY A H 1 ATOM 3861 H HA2 . GLY A 1 262 ? 34.265 24.648 62.028 1.00 37.05 ? 291 GLY A HA2 1 ATOM 3862 H HA3 . GLY A 1 262 ? 32.708 24.562 61.881 1.00 37.05 ? 291 GLY A HA3 1 ATOM 3863 N N . ARG A 1 263 ? 32.814 27.456 61.902 1.00 55.23 ? 292 ARG A N 1 ATOM 3864 C CA . ARG A 1 263 ? 32.757 28.724 61.172 1.00 53.57 ? 292 ARG A CA 1 ATOM 3865 C C . ARG A 1 263 ? 34.106 29.438 61.219 1.00 51.73 ? 292 ARG A C 1 ATOM 3866 O O . ARG A 1 263 ? 34.543 29.889 62.276 1.00 51.89 ? 292 ARG A O 1 ATOM 3867 C CB . ARG A 1 263 ? 31.660 29.629 61.745 1.00 53.89 ? 292 ARG A CB 1 ATOM 3868 C CG . ARG A 1 263 ? 31.473 30.945 61.014 1.00 54.21 ? 292 ARG A CG 1 ATOM 3869 C CD . ARG A 1 263 ? 30.863 30.751 59.641 1.00 54.78 ? 292 ARG A CD 1 ATOM 3870 N NE . ARG A 1 263 ? 30.677 32.027 58.955 1.00 55.33 ? 292 ARG A NE 1 ATOM 3871 C CZ . ARG A 1 263 ? 31.601 32.627 58.209 1.00 55.45 ? 292 ARG A CZ 1 ATOM 3872 N NH1 . ARG A 1 263 ? 32.795 32.073 58.035 1.00 54.64 ? 292 ARG A NH1 1 ATOM 3873 N NH2 . ARG A 1 263 ? 31.331 33.787 57.632 1.00 55.98 ? 292 ARG A NH2 1 ATOM 3874 H H . ARG A 1 263 ? 32.415 27.468 62.664 1.00 66.28 ? 292 ARG A H 1 ATOM 3875 H HA . ARG A 1 263 ? 32.543 28.545 60.243 1.00 64.28 ? 292 ARG A HA 1 ATOM 3876 H HB2 . ARG A 1 263 ? 30.817 29.152 61.710 1.00 64.67 ? 292 ARG A HB2 1 ATOM 3877 H HB3 . ARG A 1 263 ? 31.880 29.834 62.667 1.00 64.67 ? 292 ARG A HB3 1 ATOM 3878 H HG2 . ARG A 1 263 ? 30.881 31.514 61.530 1.00 65.05 ? 292 ARG A HG2 1 ATOM 3879 H HG3 . ARG A 1 263 ? 32.336 31.373 60.903 1.00 65.05 ? 292 ARG A HG3 1 ATOM 3880 H HD2 . ARG A 1 263 ? 31.453 30.200 59.103 1.00 65.74 ? 292 ARG A HD2 1 ATOM 3881 H HD3 . ARG A 1 263 ? 29.996 30.325 59.732 1.00 65.74 ? 292 ARG A HD3 1 ATOM 3882 H HE . ARG A 1 263 ? 29.916 32.419 59.039 1.00 66.40 ? 292 ARG A HE 1 ATOM 3883 H HH11 . ARG A 1 263 ? 32.979 31.320 58.407 1.00 65.57 ? 292 ARG A HH11 1 ATOM 3884 H HH12 . ARG A 1 263 ? 33.386 32.469 57.551 1.00 65.57 ? 292 ARG A HH12 1 ATOM 3885 H HH21 . ARG A 1 263 ? 30.559 34.151 57.740 1.00 67.18 ? 292 ARG A HH21 1 ATOM 3886 H HH22 . ARG A 1 263 ? 31.926 34.176 57.148 1.00 67.18 ? 292 ARG A HH22 1 ATOM 3887 N N . CYS A 1 264 ? 34.757 29.548 60.065 1.00 48.94 ? 293 CYS A N 1 ATOM 3888 C CA . CYS A 1 264 ? 36.094 30.128 59.990 1.00 48.16 ? 293 CYS A CA 1 ATOM 3889 C C . CYS A 1 264 ? 36.103 31.647 60.111 1.00 47.76 ? 293 CYS A C 1 ATOM 3890 O O . CYS A 1 264 ? 35.391 32.340 59.386 1.00 48.77 ? 293 CYS A O 1 ATOM 3891 C CB . CYS A 1 264 ? 36.764 29.737 58.672 1.00 48.09 ? 293 CYS A CB 1 ATOM 3892 S SG . CYS A 1 264 ? 37.073 27.978 58.489 1.00 38.87 ? 293 CYS A SG 1 ATOM 3893 H H . CYS A 1 264 ? 34.443 29.293 59.306 1.00 58.73 ? 293 CYS A H 1 ATOM 3894 H HA . CYS A 1 264 ? 36.631 29.770 60.714 1.00 57.79 ? 293 CYS A HA 1 ATOM 3895 H HB2 . CYS A 1 264 ? 36.192 30.014 57.939 1.00 57.71 ? 293 CYS A HB2 1 ATOM 3896 H HB3 . CYS A 1 264 ? 37.618 30.194 58.610 1.00 57.71 ? 293 CYS A HB3 1 ATOM 3897 N N . MET A 1 265 ? 36.918 32.155 61.031 1.00 39.58 ? 294 MET A N 1 ATOM 3898 C CA . MET A 1 265 ? 37.267 33.569 61.041 1.00 39.98 ? 294 MET A CA 1 ATOM 3899 C C . MET A 1 265 ? 38.345 33.774 59.985 1.00 39.91 ? 294 MET A C 1 ATOM 3900 O O . MET A 1 265 ? 39.539 33.720 60.280 1.00 40.58 ? 294 MET A O 1 ATOM 3901 C CB . MET A 1 265 ? 37.753 34.013 62.420 1.00 41.16 ? 294 MET A CB 1 ATOM 3902 C CG . MET A 1 265 ? 36.694 33.910 63.507 1.00 42.60 ? 294 MET A CG 1 ATOM 3903 S SD . MET A 1 265 ? 37.323 34.293 65.155 1.00 51.62 ? 294 MET A SD 1 ATOM 3904 C CE . MET A 1 265 ? 37.803 36.008 64.952 1.00 57.84 ? 294 MET A CE 1 ATOM 3905 H H . MET A 1 265 ? 37.282 31.699 61.662 1.00 47.49 ? 294 MET A H 1 ATOM 3906 H HA . MET A 1 265 ? 36.486 34.095 60.809 1.00 47.98 ? 294 MET A HA 1 ATOM 3907 H HB2 . MET A 1 265 ? 38.502 33.455 62.682 1.00 49.39 ? 294 MET A HB2 1 ATOM 3908 H HB3 . MET A 1 265 ? 38.036 34.939 62.368 1.00 49.39 ? 294 MET A HB3 1 ATOM 3909 H HG2 . MET A 1 265 ? 35.978 34.534 63.308 1.00 51.12 ? 294 MET A HG2 1 ATOM 3910 H HG3 . MET A 1 265 ? 36.347 33.005 63.523 1.00 51.12 ? 294 MET A HG3 1 ATOM 3911 H HE1 . MET A 1 265 ? 38.165 36.335 65.790 1.00 69.40 ? 294 MET A HE1 1 ATOM 3912 H HE2 . MET A 1 265 ? 38.475 36.067 64.255 1.00 69.40 ? 294 MET A HE2 1 ATOM 3913 H HE3 . MET A 1 265 ? 37.022 36.526 64.703 1.00 69.40 ? 294 MET A HE3 1 ATOM 3914 N N . CYS A 1 266 ? 37.910 33.998 58.751 1.00 38.67 ? 295 CYS A N 1 ATOM 3915 C CA . CYS A 1 266 ? 38.805 33.986 57.600 1.00 36.81 ? 295 CYS A CA 1 ATOM 3916 C C . CYS A 1 266 ? 39.752 35.183 57.553 1.00 36.17 ? 295 CYS A C 1 ATOM 3917 O O . CYS A 1 266 ? 39.374 36.307 57.886 1.00 39.19 ? 295 CYS A O 1 ATOM 3918 C CB . CYS A 1 266 ? 37.986 33.933 56.309 1.00 36.40 ? 295 CYS A CB 1 ATOM 3919 S SG . CYS A 1 266 ? 37.158 32.353 56.015 1.00 55.12 ? 295 CYS A SG 1 ATOM 3920 H H . CYS A 1 266 ? 37.090 34.161 58.551 1.00 46.40 ? 295 CYS A H 1 ATOM 3921 H HA . CYS A 1 266 ? 39.348 33.183 57.638 1.00 44.18 ? 295 CYS A HA 1 ATOM 3922 H HB2 . CYS A 1 266 ? 37.304 34.621 56.346 1.00 43.68 ? 295 CYS A HB2 1 ATOM 3923 H HB3 . CYS A 1 266 ? 38.578 34.100 55.559 1.00 43.68 ? 295 CYS A HB3 1 ATOM 3924 N N . LYS A 1 267 ? 40.985 34.913 57.132 1.00 36.07 ? 296 LYS A N 1 ATOM 3925 C CA . LYS A 1 267 ? 42.000 35.938 56.909 1.00 37.03 ? 296 LYS A CA 1 ATOM 3926 C C . LYS A 1 267 ? 42.396 35.923 55.435 1.00 37.56 ? 296 LYS A C 1 ATOM 3927 O O . LYS A 1 267 ? 41.732 35.279 54.625 1.00 38.07 ? 296 LYS A O 1 ATOM 3928 C CB . LYS A 1 267 ? 43.217 35.699 57.810 1.00 37.73 ? 296 LYS A CB 1 ATOM 3929 C CG . LYS A 1 267 ? 43.361 36.700 58.944 1.00 38.86 ? 296 LYS A CG 1 ATOM 3930 C CD . LYS A 1 267 ? 42.186 36.634 59.906 1.00 39.29 ? 296 LYS A CD 1 ATOM 3931 C CE . LYS A 1 267 ? 42.301 37.686 60.996 1.00 39.77 ? 296 LYS A CE 1 ATOM 3932 N NZ . LYS A 1 267 ? 43.553 37.541 61.791 1.00 39.85 ? 296 LYS A NZ 1 ATOM 3933 H H . LYS A 1 267 ? 41.266 34.118 56.964 1.00 43.28 ? 296 LYS A H 1 ATOM 3934 H HA . LYS A 1 267 ? 41.629 36.810 57.119 1.00 44.43 ? 296 LYS A HA 1 ATOM 3935 H HB2 . LYS A 1 267 ? 43.143 34.815 58.203 1.00 45.28 ? 296 LYS A HB2 1 ATOM 3936 H HB3 . LYS A 1 267 ? 44.019 35.749 57.268 1.00 45.28 ? 296 LYS A HB3 1 ATOM 3937 H HG2 . LYS A 1 267 ? 44.171 36.505 59.441 1.00 46.63 ? 296 LYS A HG2 1 ATOM 3938 H HG3 . LYS A 1 267 ? 43.401 37.596 58.575 1.00 46.63 ? 296 LYS A HG3 1 ATOM 3939 H HD2 . LYS A 1 267 ? 41.362 36.790 59.418 1.00 47.15 ? 296 LYS A HD2 1 ATOM 3940 H HD3 . LYS A 1 267 ? 42.166 35.760 60.328 1.00 47.15 ? 296 LYS A HD3 1 ATOM 3941 H HE2 . LYS A 1 267 ? 42.303 38.566 60.589 1.00 47.73 ? 296 LYS A HE2 1 ATOM 3942 H HE3 . LYS A 1 267 ? 41.548 37.600 61.602 1.00 47.73 ? 296 LYS A HE3 1 ATOM 3943 H HZ1 . LYS A 1 267 ? 43.589 38.171 62.419 1.00 47.82 ? 296 LYS A HZ1 1 ATOM 3944 H HZ2 . LYS A 1 267 ? 43.574 36.741 62.181 1.00 47.82 ? 296 LYS A HZ2 1 ATOM 3945 H HZ3 . LYS A 1 267 ? 44.262 37.621 61.259 1.00 47.82 ? 296 LYS A HZ3 1 ATOM 3946 N N . HIS A 1 268 ? 43.466 36.635 55.091 1.00 27.23 ? 297 HIS A N 1 ATOM 3947 C CA . HIS A 1 268 ? 43.985 36.648 53.725 1.00 27.06 ? 297 HIS A CA 1 ATOM 3948 C C . HIS A 1 268 ? 42.950 37.154 52.722 1.00 26.68 ? 297 HIS A C 1 ATOM 3949 O O . HIS A 1 268 ? 42.947 36.732 51.567 1.00 26.60 ? 297 HIS A O 1 ATOM 3950 C CB . HIS A 1 268 ? 44.457 35.249 53.315 1.00 27.28 ? 297 HIS A CB 1 ATOM 3951 C CG . HIS A 1 268 ? 45.554 34.704 54.175 1.00 27.68 ? 297 HIS A CG 1 ATOM 3952 N ND1 . HIS A 1 268 ? 45.987 33.398 54.089 1.00 27.54 ? 297 HIS A ND1 1 ATOM 3953 C CD2 . HIS A 1 268 ? 46.311 35.288 55.133 1.00 27.97 ? 297 HIS A CD2 1 ATOM 3954 C CE1 . HIS A 1 268 ? 46.960 33.201 54.960 1.00 27.86 ? 297 HIS A CE1 1 ATOM 3955 N NE2 . HIS A 1 268 ? 47.176 34.332 55.606 1.00 27.98 ? 297 HIS A NE2 1 ATOM 3956 H H . HIS A 1 268 ? 43.915 37.125 55.638 1.00 32.68 ? 297 HIS A H 1 ATOM 3957 H HA . HIS A 1 268 ? 44.750 37.243 53.687 1.00 32.48 ? 297 HIS A HA 1 ATOM 3958 H HB2 . HIS A 1 268 ? 43.706 34.637 53.370 1.00 32.73 ? 297 HIS A HB2 1 ATOM 3959 H HB3 . HIS A 1 268 ? 44.785 35.285 52.403 1.00 32.73 ? 297 HIS A HB3 1 ATOM 3960 H HD2 . HIS A 1 268 ? 46.254 36.171 55.419 1.00 33.57 ? 297 HIS A HD2 1 ATOM 3961 H HE1 . HIS A 1 268 ? 47.416 32.401 55.094 1.00 33.43 ? 297 HIS A HE1 1 ATOM 3962 N N . ASN A 1 269 ? 42.075 38.049 53.171 1.00 25.33 ? 298 ASN A N 1 ATOM 3963 C CA . ASN A 1 269 ? 41.060 38.647 52.307 1.00 25.25 ? 298 ASN A CA 1 ATOM 3964 C C . ASN A 1 269 ? 40.116 37.609 51.696 1.00 25.07 ? 298 ASN A C 1 ATOM 3965 O O . ASN A 1 269 ? 39.573 37.818 50.611 1.00 25.11 ? 298 ASN A O 1 ATOM 3966 C CB . ASN A 1 269 ? 41.722 39.458 51.186 1.00 25.34 ? 298 ASN A CB 1 ATOM 3967 C CG . ASN A 1 269 ? 42.687 40.504 51.709 1.00 25.63 ? 298 ASN A CG 1 ATOM 3968 O OD1 . ASN A 1 269 ? 42.388 41.219 52.665 1.00 25.83 ? 298 ASN A OD1 1 ATOM 3969 N ND2 . ASN A 1 269 ? 43.854 40.598 51.082 1.00 58.86 ? 298 ASN A ND2 1 ATOM 3970 H H . ASN A 1 269 ? 42.048 38.331 53.983 1.00 30.39 ? 298 ASN A H 1 ATOM 3971 H HA . ASN A 1 269 ? 40.523 39.258 52.836 1.00 30.30 ? 298 ASN A HA 1 ATOM 3972 H HB2 . ASN A 1 269 ? 42.217 38.854 50.610 1.00 30.41 ? 298 ASN A HB2 1 ATOM 3973 H HB3 . ASN A 1 269 ? 41.033 39.913 50.677 1.00 30.41 ? 298 ASN A HB3 1 ATOM 3974 H HD21 . ASN A 1 269 ? 44.436 41.176 51.340 1.00 70.63 ? 298 ASN A HD21 1 ATOM 3975 H HD22 . ASN A 1 269 ? 44.028 40.081 50.417 1.00 70.63 ? 298 ASN A HD22 1 ATOM 3976 N N . THR A 1 270 ? 39.931 36.490 52.392 1.00 33.72 ? 299 THR A N 1 ATOM 3977 C CA . THR A 1 270 ? 39.033 35.431 51.932 1.00 32.36 ? 299 THR A CA 1 ATOM 3978 C C . THR A 1 270 ? 37.674 35.536 52.617 1.00 33.22 ? 299 THR A C 1 ATOM 3979 O O . THR A 1 270 ? 37.447 36.429 53.433 1.00 34.20 ? 299 THR A O 1 ATOM 3980 C CB . THR A 1 270 ? 39.629 34.036 52.191 1.00 30.22 ? 299 THR A CB 1 ATOM 3981 O OG1 . THR A 1 270 ? 39.952 33.898 53.578 1.00 29.37 ? 299 THR A OG1 1 ATOM 3982 C CG2 . THR A 1 270 ? 40.884 33.836 51.364 1.00 29.81 ? 299 THR A CG2 1 ATOM 3983 H H . THR A 1 270 ? 40.317 36.317 53.141 1.00 40.46 ? 299 THR A H 1 ATOM 3984 H HA . THR A 1 270 ? 38.896 35.527 50.977 1.00 38.83 ? 299 THR A HA 1 ATOM 3985 H HB . THR A 1 270 ? 38.983 33.357 51.940 1.00 36.26 ? 299 THR A HB 1 ATOM 3986 H HG1 . THR A 1 270 ? 40.514 34.482 53.801 1.00 35.25 ? 299 THR A HG1 1 ATOM 3987 H HG21 . THR A 1 270 ? 41.254 32.955 51.532 1.00 35.77 ? 299 THR A HG21 1 ATOM 3988 H HG22 . THR A 1 270 ? 40.676 33.916 50.420 1.00 35.77 ? 299 THR A HG22 1 ATOM 3989 H HG23 . THR A 1 270 ? 41.546 34.505 51.599 1.00 35.77 ? 299 THR A HG23 1 ATOM 3990 N N . ALA A 1 271 ? 36.774 34.618 52.282 1.00 30.41 ? 300 ALA A N 1 ATOM 3991 C CA . ALA A 1 271 ? 35.427 34.627 52.837 1.00 30.27 ? 300 ALA A CA 1 ATOM 3992 C C . ALA A 1 271 ? 34.761 33.267 52.656 1.00 30.25 ? 300 ALA A C 1 ATOM 3993 O O . ALA A 1 271 ? 35.295 32.389 51.980 1.00 30.02 ? 300 ALA A O 1 ATOM 3994 C CB . ALA A 1 271 ? 34.592 35.719 52.185 1.00 30.74 ? 300 ALA A CB 1 ATOM 3995 H H . ALA A 1 271 ? 36.920 33.975 51.730 1.00 36.49 ? 300 ALA A H 1 ATOM 3996 H HA . ALA A 1 271 ? 35.477 34.813 53.788 1.00 36.32 ? 300 ALA A HA 1 ATOM 3997 H HB1 . ALA A 1 271 ? 33.702 35.706 52.569 1.00 36.89 ? 300 ALA A HB1 1 ATOM 3998 H HB2 . ALA A 1 271 ? 35.012 36.577 52.350 1.00 36.89 ? 300 ALA A HB2 1 ATOM 3999 H HB3 . ALA A 1 271 ? 34.544 35.551 51.231 1.00 36.89 ? 300 ALA A HB3 1 ATOM 4000 N N . GLY A 1 272 ? 33.588 33.107 53.259 1.00 47.06 ? 301 GLY A N 1 ATOM 4001 C CA . GLY A 1 272 ? 32.876 31.844 53.236 1.00 46.36 ? 301 GLY A CA 1 ATOM 4002 C C . GLY A 1 272 ? 33.134 31.044 54.496 1.00 45.52 ? 301 GLY A C 1 ATOM 4003 O O . GLY A 1 272 ? 34.056 31.343 55.255 1.00 45.64 ? 301 GLY A O 1 ATOM 4004 H H . GLY A 1 272 ? 33.181 33.727 53.694 1.00 56.47 ? 301 GLY A H 1 ATOM 4005 H HA2 . GLY A 1 272 ? 31.923 32.007 53.161 1.00 55.63 ? 301 GLY A HA2 1 ATOM 4006 H HA3 . GLY A 1 272 ? 33.163 31.321 52.471 1.00 55.63 ? 301 GLY A HA3 1 ATOM 4007 N N . SER A 1 273 ? 32.313 30.023 54.716 1.00 48.74 ? 302 SER A N 1 ATOM 4008 C CA . SER A 1 273 ? 32.389 29.214 55.927 1.00 48.28 ? 302 SER A CA 1 ATOM 4009 C C . SER A 1 273 ? 33.745 28.532 56.100 1.00 46.18 ? 302 SER A C 1 ATOM 4010 O O . SER A 1 273 ? 34.132 28.192 57.218 1.00 45.68 ? 302 SER A O 1 ATOM 4011 C CB . SER A 1 273 ? 31.278 28.162 55.916 1.00 49.91 ? 302 SER A CB 1 ATOM 4012 O OG . SER A 1 273 ? 31.133 27.592 54.626 1.00 50.23 ? 302 SER A OG 1 ATOM 4013 H H . SER A 1 273 ? 31.695 29.776 54.172 1.00 58.48 ? 302 SER A H 1 ATOM 4014 H HA . SER A 1 273 ? 32.246 29.788 56.696 1.00 57.94 ? 302 SER A HA 1 ATOM 4015 H HB2 . SER A 1 273 ? 31.501 27.461 56.548 1.00 59.90 ? 302 SER A HB2 1 ATOM 4016 H HB3 . SER A 1 273 ? 30.442 28.584 56.171 1.00 59.90 ? 302 SER A HB3 1 ATOM 4017 H HG . SER A 1 273 ? 30.521 27.017 54.633 1.00 60.27 ? 302 SER A HG 1 ATOM 4018 N N . HIS A 1 274 ? 34.463 28.341 54.996 1.00 28.18 ? 303 HIS A N 1 ATOM 4019 C CA . HIS A 1 274 ? 35.763 27.671 55.026 1.00 26.89 ? 303 HIS A CA 1 ATOM 4020 C C . HIS A 1 274 ? 36.807 28.447 54.227 1.00 25.79 ? 303 HIS A C 1 ATOM 4021 O O . HIS A 1 274 ? 37.810 27.883 53.787 1.00 25.68 ? 303 HIS A O 1 ATOM 4022 C CB . HIS A 1 274 ? 35.640 26.244 54.485 1.00 27.97 ? 303 HIS A CB 1 ATOM 4023 C CG . HIS A 1 274 ? 34.490 25.478 55.062 1.00 28.75 ? 303 HIS A CG 1 ATOM 4024 N ND1 . HIS A 1 274 ? 34.343 25.264 56.416 1.00 29.09 ? 303 HIS A ND1 1 ATOM 4025 C CD2 . HIS A 1 274 ? 33.433 24.876 54.469 1.00 29.54 ? 303 HIS A CD2 1 ATOM 4026 C CE1 . HIS A 1 274 ? 33.243 24.565 56.632 1.00 29.97 ? 303 HIS A CE1 1 ATOM 4027 N NE2 . HIS A 1 274 ? 32.672 24.316 55.468 1.00 30.40 ? 303 HIS A NE2 1 ATOM 4028 H H . HIS A 1 274 ? 34.219 28.592 54.210 1.00 33.82 ? 303 HIS A H 1 ATOM 4029 H HA . HIS A 1 274 ? 36.068 27.617 55.945 1.00 32.27 ? 303 HIS A HA 1 ATOM 4030 H HB2 . HIS A 1 274 ? 35.518 26.284 53.524 1.00 33.56 ? 303 HIS A HB2 1 ATOM 4031 H HB3 . HIS A 1 274 ? 36.454 25.759 54.694 1.00 33.56 ? 303 HIS A HB3 1 ATOM 4032 H HD2 . HIS A 1 274 ? 33.253 24.848 53.557 1.00 35.44 ? 303 HIS A HD2 1 ATOM 4033 H HE1 . HIS A 1 274 ? 32.926 24.293 57.463 1.00 35.96 ? 303 HIS A HE1 1 ATOM 4034 N N . CYS A 1 275 ? 36.561 29.741 54.047 1.00 32.46 ? 304 CYS A N 1 ATOM 4035 C CA . CYS A 1 275 ? 37.473 30.618 53.319 1.00 32.29 ? 304 CYS A CA 1 ATOM 4036 C C . CYS A 1 275 ? 37.648 30.173 51.870 1.00 32.47 ? 304 CYS A C 1 ATOM 4037 O O . CYS A 1 275 ? 38.635 30.519 51.221 1.00 32.84 ? 304 CYS A O 1 ATOM 4038 C CB . CYS A 1 275 ? 38.832 30.675 54.017 1.00 32.52 ? 304 CYS A CB 1 ATOM 4039 S SG . CYS A 1 275 ? 38.730 31.087 55.773 1.00 36.72 ? 304 CYS A SG 1 ATOM 4040 H H . CYS A 1 275 ? 35.860 30.142 54.342 1.00 38.95 ? 304 CYS A H 1 ATOM 4041 H HA . CYS A 1 275 ? 37.106 31.516 53.312 1.00 38.75 ? 304 CYS A HA 1 ATOM 4042 H HB2 . CYS A 1 275 ? 39.260 29.807 53.940 1.00 39.03 ? 304 CYS A HB2 1 ATOM 4043 H HB3 . CYS A 1 275 ? 39.378 31.350 53.585 1.00 39.03 ? 304 CYS A HB3 1 ATOM 4044 N N . GLN A 1 276 ? 36.686 29.405 51.366 1.00 30.97 ? 305 GLN A N 1 ATOM 4045 C CA . GLN A 1 276 ? 36.739 28.920 49.992 1.00 31.14 ? 305 GLN A CA 1 ATOM 4046 C C . GLN A 1 276 ? 36.558 30.065 48.997 1.00 32.73 ? 305 GLN A C 1 ATOM 4047 O O . GLN A 1 276 ? 36.929 29.946 47.828 1.00 32.87 ? 305 GLN A O 1 ATOM 4048 C CB . GLN A 1 276 ? 35.676 27.841 49.754 1.00 31.51 ? 305 GLN A CB 1 ATOM 4049 C CG . GLN A 1 276 ? 34.226 28.312 49.868 1.00 31.85 ? 305 GLN A CG 1 ATOM 4050 C CD . GLN A 1 276 ? 33.711 28.345 51.295 1.00 31.69 ? 305 GLN A CD 1 ATOM 4051 O OE1 . GLN A 1 276 ? 34.471 28.181 52.247 1.00 31.27 ? 305 GLN A OE1 1 ATOM 4052 N NE2 . GLN A 1 276 ? 32.409 28.557 51.447 1.00 32.18 ? 305 GLN A NE2 1 ATOM 4053 H H . GLN A 1 276 ? 35.990 29.150 51.802 1.00 37.17 ? 305 GLN A H 1 ATOM 4054 H HA . GLN A 1 276 ? 37.610 28.522 49.833 1.00 37.37 ? 305 GLN A HA 1 ATOM 4055 H HB2 . GLN A 1 276 ? 35.797 27.482 48.861 1.00 37.81 ? 305 GLN A HB2 1 ATOM 4056 H HB3 . GLN A 1 276 ? 35.804 27.134 50.407 1.00 37.81 ? 305 GLN A HB3 1 ATOM 4057 H HG2 . GLN A 1 276 ? 34.158 29.209 49.506 1.00 38.22 ? 305 GLN A HG2 1 ATOM 4058 H HG3 . GLN A 1 276 ? 33.659 27.709 49.361 1.00 38.22 ? 305 GLN A HG3 1 ATOM 4059 H HE21 . GLN A 1 276 ? 31.908 28.666 50.757 1.00 38.61 ? 305 GLN A HE21 1 ATOM 4060 H HE22 . GLN A 1 276 ? 32.068 28.585 52.236 1.00 38.61 ? 305 GLN A HE22 1 ATOM 4061 N N . HIS A 1 277 ? 35.985 31.170 49.469 1.00 45.66 ? 306 HIS A N 1 ATOM 4062 C CA . HIS A 1 277 ? 35.724 32.335 48.626 1.00 45.09 ? 306 HIS A CA 1 ATOM 4063 C C . HIS A 1 277 ? 36.752 33.439 48.830 1.00 43.33 ? 306 HIS A C 1 ATOM 4064 O O . HIS A 1 277 ? 37.530 33.415 49.783 1.00 43.31 ? 306 HIS A O 1 ATOM 4065 C CB . HIS A 1 277 ? 34.332 32.899 48.913 1.00 45.19 ? 306 HIS A CB 1 ATOM 4066 C CG . HIS A 1 277 ? 33.230 31.904 48.744 1.00 46.30 ? 306 HIS A CG 1 ATOM 4067 N ND1 . HIS A 1 277 ? 33.241 30.943 47.755 1.00 47.44 ? 306 HIS A ND1 1 ATOM 4068 C CD2 . HIS A 1 277 ? 32.084 31.718 49.438 1.00 47.30 ? 306 HIS A CD2 1 ATOM 4069 C CE1 . HIS A 1 277 ? 32.146 30.210 47.847 1.00 48.34 ? 306 HIS A CE1 1 ATOM 4070 N NE2 . HIS A 1 277 ? 31.427 30.659 48.860 1.00 48.30 ? 306 HIS A NE2 1 ATOM 4071 H H . HIS A 1 277 ? 35.735 31.271 50.285 1.00 54.79 ? 306 HIS A H 1 ATOM 4072 H HA . HIS A 1 277 ? 35.754 32.065 47.695 1.00 54.11 ? 306 HIS A HA 1 ATOM 4073 H HB2 . HIS A 1 277 ? 34.307 33.216 49.829 1.00 54.22 ? 306 HIS A HB2 1 ATOM 4074 H HB3 . HIS A 1 277 ? 34.163 33.635 48.305 1.00 54.22 ? 306 HIS A HB3 1 ATOM 4075 H HD2 . HIS A 1 277 ? 31.794 32.215 50.168 1.00 56.76 ? 306 HIS A HD2 1 ATOM 4076 H HE1 . HIS A 1 277 ? 31.921 29.497 47.293 1.00 58.01 ? 306 HIS A HE1 1 ATOM 4077 N N . CYS A 1 278 ? 36.745 34.403 47.917 1.00 31.18 ? 307 CYS A N 1 ATOM 4078 C CA . CYS A 1 278 ? 37.447 35.662 48.114 1.00 31.00 ? 307 CYS A CA 1 ATOM 4079 C C . CYS A 1 278 ? 36.499 36.663 48.760 1.00 31.10 ? 307 CYS A C 1 ATOM 4080 O O . CYS A 1 278 ? 35.280 36.539 48.633 1.00 31.44 ? 307 CYS A O 1 ATOM 4081 C CB . CYS A 1 278 ? 37.975 36.211 46.786 1.00 31.22 ? 307 CYS A CB 1 ATOM 4082 S SG . CYS A 1 278 ? 39.560 35.526 46.271 1.00 31.26 ? 307 CYS A SG 1 ATOM 4083 H H . CYS A 1 278 ? 36.334 34.350 47.163 1.00 37.41 ? 307 CYS A H 1 ATOM 4084 H HA . CYS A 1 278 ? 38.200 35.523 48.710 1.00 37.20 ? 307 CYS A HA 1 ATOM 4085 H HB2 . CYS A 1 278 ? 37.329 36.013 46.090 1.00 37.47 ? 307 CYS A HB2 1 ATOM 4086 H HB3 . CYS A 1 278 ? 38.083 37.171 46.869 1.00 37.47 ? 307 CYS A HB3 1 ATOM 4087 N N . ALA A 1 279 ? 37.056 37.649 49.455 1.00 26.17 ? 308 ALA A N 1 ATOM 4088 C CA . ALA A 1 279 ? 36.253 38.731 50.003 1.00 26.42 ? 308 ALA A CA 1 ATOM 4089 C C . ALA A 1 279 ? 35.534 39.431 48.855 1.00 28.47 ? 308 ALA A C 1 ATOM 4090 O O . ALA A 1 279 ? 36.041 39.448 47.734 1.00 28.11 ? 308 ALA A O 1 ATOM 4091 C CB . ALA A 1 279 ? 37.121 39.707 50.779 1.00 37.13 ? 308 ALA A CB 1 ATOM 4092 H H . ALA A 1 279 ? 37.897 37.713 49.622 1.00 31.40 ? 308 ALA A H 1 ATOM 4093 H HA . ALA A 1 279 ? 35.586 38.366 50.606 1.00 31.70 ? 308 ALA A HA 1 ATOM 4094 H HB1 . ALA A 1 279 ? 36.561 40.416 51.132 1.00 44.56 ? 308 ALA A HB1 1 ATOM 4095 H HB2 . ALA A 1 279 ? 37.555 39.234 51.506 1.00 44.56 ? 308 ALA A HB2 1 ATOM 4096 H HB3 . ALA A 1 279 ? 37.788 40.079 50.181 1.00 44.56 ? 308 ALA A HB3 1 ATOM 4097 N N . PRO A 1 280 ? 34.352 40.006 49.125 1.00 31.59 ? 309 PRO A N 1 ATOM 4098 C CA . PRO A 1 280 ? 33.509 40.561 48.058 1.00 29.14 ? 309 PRO A CA 1 ATOM 4099 C C . PRO A 1 280 ? 34.210 41.583 47.159 1.00 29.07 ? 309 PRO A C 1 ATOM 4100 O O . PRO A 1 280 ? 33.881 41.657 45.975 1.00 29.38 ? 309 PRO A O 1 ATOM 4101 C CB . PRO A 1 280 ? 32.356 41.224 48.828 1.00 29.71 ? 309 PRO A CB 1 ATOM 4102 C CG . PRO A 1 280 ? 32.819 41.328 50.243 1.00 29.50 ? 309 PRO A CG 1 ATOM 4103 C CD . PRO A 1 280 ? 33.735 40.176 50.450 1.00 28.90 ? 309 PRO A CD 1 ATOM 4104 H HA . PRO A 1 280 ? 33.153 39.846 47.508 1.00 34.97 ? 309 PRO A HA 1 ATOM 4105 H HB2 . PRO A 1 280 ? 32.184 42.105 48.460 1.00 35.65 ? 309 PRO A HB2 1 ATOM 4106 H HB3 . PRO A 1 280 ? 31.564 40.668 48.768 1.00 35.65 ? 309 PRO A HB3 1 ATOM 4107 H HG2 . PRO A 1 280 ? 33.290 42.167 50.370 1.00 35.40 ? 309 PRO A HG2 1 ATOM 4108 H HG3 . PRO A 1 280 ? 32.057 41.270 50.840 1.00 35.40 ? 309 PRO A HG3 1 ATOM 4109 H HD2 . PRO A 1 280 ? 34.409 40.393 51.114 1.00 34.68 ? 309 PRO A HD2 1 ATOM 4110 H HD3 . PRO A 1 280 ? 33.233 39.383 50.696 1.00 34.68 ? 309 PRO A HD3 1 ATOM 4111 N N . LEU A 1 281 ? 35.156 42.345 47.703 1.00 37.13 ? 310 LEU A N 1 ATOM 4112 C CA . LEU A 1 281 ? 35.867 43.364 46.929 1.00 37.83 ? 310 LEU A CA 1 ATOM 4113 C C . LEU A 1 281 ? 37.272 42.899 46.543 1.00 36.53 ? 310 LEU A C 1 ATOM 4114 O O . LEU A 1 281 ? 38.128 43.715 46.198 1.00 36.89 ? 310 LEU A O 1 ATOM 4115 C CB . LEU A 1 281 ? 35.942 44.674 47.727 1.00 39.14 ? 310 LEU A CB 1 ATOM 4116 C CG . LEU A 1 281 ? 36.384 45.958 47.008 1.00 40.12 ? 310 LEU A CG 1 ATOM 4117 C CD1 . LEU A 1 281 ? 35.570 46.209 45.747 1.00 40.09 ? 310 LEU A CD1 1 ATOM 4118 C CD2 . LEU A 1 281 ? 36.277 47.147 47.946 1.00 40.76 ? 310 LEU A CD2 1 ATOM 4119 H H . LEU A 1 281 ? 35.407 42.291 48.524 1.00 44.56 ? 310 LEU A H 1 ATOM 4120 H HA . LEU A 1 281 ? 35.375 43.539 46.112 1.00 45.40 ? 310 LEU A HA 1 ATOM 4121 H HB2 . LEU A 1 281 ? 35.060 44.848 48.091 1.00 46.97 ? 310 LEU A HB2 1 ATOM 4122 H HB3 . LEU A 1 281 ? 36.563 44.538 48.460 1.00 46.97 ? 310 LEU A HB3 1 ATOM 4123 H HG . LEU A 1 281 ? 37.314 45.867 46.748 1.00 48.15 ? 310 LEU A HG 1 ATOM 4124 H HD11 . LEU A 1 281 ? 35.882 47.027 45.328 1.00 48.11 ? 310 LEU A HD11 1 ATOM 4125 H HD12 . LEU A 1 281 ? 35.687 45.461 45.142 1.00 48.11 ? 310 LEU A HD12 1 ATOM 4126 H HD13 . LEU A 1 281 ? 34.634 46.297 45.988 1.00 48.11 ? 310 LEU A HD13 1 ATOM 4127 H HD21 . LEU A 1 281 ? 36.560 47.946 47.476 1.00 48.91 ? 310 LEU A HD21 1 ATOM 4128 H HD22 . LEU A 1 281 ? 35.356 47.240 48.234 1.00 48.91 ? 310 LEU A HD22 1 ATOM 4129 H HD23 . LEU A 1 281 ? 36.850 46.995 48.714 1.00 48.91 ? 310 LEU A HD23 1 ATOM 4130 N N . TYR A 1 282 ? 37.505 41.589 46.593 1.00 30.49 ? 311 TYR A N 1 ATOM 4131 C CA . TYR A 1 282 ? 38.839 41.034 46.354 1.00 30.30 ? 311 TYR A CA 1 ATOM 4132 C C . TYR A 1 282 ? 38.827 39.903 45.326 1.00 30.47 ? 311 TYR A C 1 ATOM 4133 O O . TYR A 1 282 ? 39.506 38.888 45.494 1.00 31.22 ? 311 TYR A O 1 ATOM 4134 C CB . TYR A 1 282 ? 39.444 40.545 47.676 1.00 30.03 ? 311 TYR A CB 1 ATOM 4135 C CG . TYR A 1 282 ? 39.869 41.665 48.599 1.00 30.05 ? 311 TYR A CG 1 ATOM 4136 C CD1 . TYR A 1 282 ? 38.930 42.442 49.264 1.00 30.21 ? 311 TYR A CD1 1 ATOM 4137 C CD2 . TYR A 1 282 ? 41.213 41.944 48.806 1.00 30.08 ? 311 TYR A CD2 1 ATOM 4138 C CE1 . TYR A 1 282 ? 39.317 43.466 50.106 1.00 30.38 ? 311 TYR A CE1 1 ATOM 4139 C CE2 . TYR A 1 282 ? 41.610 42.963 49.647 1.00 30.25 ? 311 TYR A CE2 1 ATOM 4140 C CZ . TYR A 1 282 ? 40.658 43.723 50.294 1.00 30.39 ? 311 TYR A CZ 1 ATOM 4141 O OH . TYR A 1 282 ? 41.049 44.741 51.132 1.00 30.71 ? 311 TYR A OH 1 ATOM 4142 H H . TYR A 1 282 ? 36.905 40.996 46.763 1.00 36.59 ? 311 TYR A H 1 ATOM 4143 H HA . TYR A 1 282 ? 39.411 41.738 46.011 1.00 36.36 ? 311 TYR A HA 1 ATOM 4144 H HB2 . TYR A 1 282 ? 38.784 40.009 48.143 1.00 36.04 ? 311 TYR A HB2 1 ATOM 4145 H HB3 . TYR A 1 282 ? 40.227 40.006 47.481 1.00 36.04 ? 311 TYR A HB3 1 ATOM 4146 H HD1 . TYR A 1 282 ? 38.024 42.272 49.138 1.00 36.25 ? 311 TYR A HD1 1 ATOM 4147 H HD2 . TYR A 1 282 ? 41.858 41.434 48.370 1.00 36.10 ? 311 TYR A HD2 1 ATOM 4148 H HE1 . TYR A 1 282 ? 38.677 43.978 50.544 1.00 36.46 ? 311 TYR A HE1 1 ATOM 4149 H HE2 . TYR A 1 282 ? 42.515 43.139 49.775 1.00 36.30 ? 311 TYR A HE2 1 ATOM 4150 H HH . TYR A 1 282 ? 41.887 44.788 51.155 1.00 36.85 ? 311 TYR A HH 1 ATOM 4151 N N . ASN A 1 283 ? 38.058 40.092 44.258 1.00 29.04 ? 312 ASN A N 1 ATOM 4152 C CA . ASN A 1 283 ? 37.996 39.124 43.169 1.00 29.43 ? 312 ASN A CA 1 ATOM 4153 C C . ASN A 1 283 ? 38.785 39.588 41.946 1.00 31.71 ? 312 ASN A C 1 ATOM 4154 O O . ASN A 1 283 ? 38.328 39.440 40.813 1.00 32.69 ? 312 ASN A O 1 ATOM 4155 C CB . ASN A 1 283 ? 36.539 38.856 42.781 1.00 29.86 ? 312 ASN A CB 1 ATOM 4156 C CG . ASN A 1 283 ? 35.736 38.252 43.917 1.00 29.66 ? 312 ASN A CG 1 ATOM 4157 O OD1 . ASN A 1 283 ? 35.821 37.053 44.184 1.00 29.58 ? 312 ASN A OD1 1 ATOM 4158 N ND2 . ASN A 1 283 ? 34.946 39.080 44.590 1.00 29.67 ? 312 ASN A ND2 1 ATOM 4159 H H . ASN A 1 283 ? 37.557 40.782 44.140 1.00 34.85 ? 312 ASN A H 1 ATOM 4160 H HA . ASN A 1 283 ? 38.382 38.287 43.471 1.00 35.31 ? 312 ASN A HA 1 ATOM 4161 H HB2 . ASN A 1 283 ? 36.120 39.694 42.528 1.00 35.83 ? 312 ASN A HB2 1 ATOM 4162 H HB3 . ASN A 1 283 ? 36.519 38.236 42.035 1.00 35.83 ? 312 ASN A HB3 1 ATOM 4163 H HD21 . ASN A 1 283 ? 34.471 38.785 45.243 1.00 35.60 ? 312 ASN A HD21 1 ATOM 4164 H HD22 . ASN A 1 283 ? 34.910 39.912 44.373 1.00 35.60 ? 312 ASN A HD22 1 ATOM 4165 N N . ASP A 1 284 ? 39.966 40.155 42.178 1.00 30.66 ? 313 ASP A N 1 ATOM 4166 C CA . ASP A 1 284 ? 40.813 40.626 41.083 1.00 31.63 ? 313 ASP A CA 1 ATOM 4167 C C . ASP A 1 284 ? 41.596 39.481 40.448 1.00 32.46 ? 313 ASP A C 1 ATOM 4168 O O . ASP A 1 284 ? 41.960 39.549 39.274 1.00 33.82 ? 313 ASP A O 1 ATOM 4169 C CB . ASP A 1 284 ? 41.781 41.703 41.571 1.00 31.06 ? 313 ASP A CB 1 ATOM 4170 C CG . ASP A 1 284 ? 42.659 42.241 40.455 1.00 31.07 ? 313 ASP A CG 1 ATOM 4171 O OD1 . ASP A 1 284 ? 42.181 43.093 39.676 1.00 29.52 ? 313 ASP A OD1 1 ATOM 4172 O OD2 . ASP A 1 284 ? 43.827 41.808 40.353 1.00 31.07 ? 313 ASP A OD2 1 ATOM 4173 H H . ASP A 1 284 ? 40.300 40.280 42.960 1.00 36.79 ? 313 ASP A H 1 ATOM 4174 H HA . ASP A 1 284 ? 40.250 41.019 40.398 1.00 37.96 ? 313 ASP A HA 1 ATOM 4175 H HB2 . ASP A 1 284 ? 41.273 42.443 41.938 1.00 37.27 ? 313 ASP A HB2 1 ATOM 4176 H HB3 . ASP A 1 284 ? 42.358 41.325 42.253 1.00 37.27 ? 313 ASP A HB3 1 ATOM 4177 N N . ARG A 1 285 ? 41.857 38.437 41.230 1.00 29.14 ? 314 ARG A N 1 ATOM 4178 C CA . ARG A 1 285 ? 42.534 37.246 40.730 1.00 29.63 ? 314 ARG A CA 1 ATOM 4179 C C . ARG A 1 285 ? 41.843 36.013 41.305 1.00 29.41 ? 314 ARG A C 1 ATOM 4180 O O . ARG A 1 285 ? 41.130 36.113 42.304 1.00 29.01 ? 314 ARG A O 1 ATOM 4181 C CB . ARG A 1 285 ? 44.025 37.275 41.093 1.00 29.72 ? 314 ARG A CB 1 ATOM 4182 C CG . ARG A 1 285 ? 44.373 36.718 42.466 1.00 29.21 ? 314 ARG A CG 1 ATOM 4183 C CD . ARG A 1 285 ? 45.868 36.809 42.722 1.00 29.55 ? 314 ARG A CD 1 ATOM 4184 N NE . ARG A 1 285 ? 46.242 36.258 44.021 1.00 32.98 ? 314 ARG A NE 1 ATOM 4185 C CZ . ARG A 1 285 ? 47.495 36.113 44.440 1.00 33.19 ? 314 ARG A CZ 1 ATOM 4186 N NH1 . ARG A 1 285 ? 48.506 36.475 43.663 1.00 33.87 ? 314 ARG A NH1 1 ATOM 4187 N NH2 . ARG A 1 285 ? 47.739 35.601 45.638 1.00 29.33 ? 314 ARG A NH2 1 ATOM 4188 H H . ARG A 1 285 ? 41.649 38.395 42.063 1.00 34.97 ? 314 ARG A H 1 ATOM 4189 H HA . ARG A 1 285 ? 42.457 37.215 39.763 1.00 35.55 ? 314 ARG A HA 1 ATOM 4190 H HB2 . ARG A 1 285 ? 44.511 36.753 40.435 1.00 35.66 ? 314 ARG A HB2 1 ATOM 4191 H HB3 . ARG A 1 285 ? 44.330 38.195 41.066 1.00 35.66 ? 314 ARG A HB3 1 ATOM 4192 H HG2 . ARG A 1 285 ? 43.914 37.232 43.149 1.00 35.05 ? 314 ARG A HG2 1 ATOM 4193 H HG3 . ARG A 1 285 ? 44.111 35.785 42.512 1.00 35.05 ? 314 ARG A HG3 1 ATOM 4194 H HD2 . ARG A 1 285 ? 46.339 36.309 42.036 1.00 35.45 ? 314 ARG A HD2 1 ATOM 4195 H HD3 . ARG A 1 285 ? 46.138 37.740 42.700 1.00 35.45 ? 314 ARG A HD3 1 ATOM 4196 H HE . ARG A 1 285 ? 45.610 36.012 44.550 1.00 39.58 ? 314 ARG A HE 1 ATOM 4197 H HH11 . ARG A 1 285 ? 48.353 36.807 42.884 1.00 40.64 ? 314 ARG A HH11 1 ATOM 4198 H HH12 . ARG A 1 285 ? 49.316 36.379 43.937 1.00 40.64 ? 314 ARG A HH12 1 ATOM 4199 H HH21 . ARG A 1 285 ? 47.086 35.365 46.146 1.00 35.19 ? 314 ARG A HH21 1 ATOM 4200 H HH22 . ARG A 1 285 ? 48.550 35.507 45.909 1.00 35.19 ? 314 ARG A HH22 1 ATOM 4201 N N . PRO A 1 286 ? 42.041 34.846 40.673 1.00 33.58 ? 315 PRO A N 1 ATOM 4202 C CA . PRO A 1 286 ? 41.303 33.656 41.110 1.00 32.12 ? 315 PRO A CA 1 ATOM 4203 C C . PRO A 1 286 ? 41.673 33.209 42.519 1.00 30.98 ? 315 PRO A C 1 ATOM 4204 O O . PRO A 1 286 ? 42.839 33.278 42.906 1.00 29.98 ? 315 PRO A O 1 ATOM 4205 C CB . PRO A 1 286 ? 41.701 32.598 40.077 1.00 32.70 ? 315 PRO A CB 1 ATOM 4206 C CG . PRO A 1 286 ? 43.001 33.059 39.538 1.00 32.01 ? 315 PRO A CG 1 ATOM 4207 C CD . PRO A 1 286 ? 42.966 34.549 39.566 1.00 31.64 ? 315 PRO A CD 1 ATOM 4208 H HA . PRO A 1 286 ? 40.347 33.813 41.060 1.00 38.54 ? 315 PRO A HA 1 ATOM 4209 H HB2 . PRO A 1 286 ? 41.795 31.736 40.511 1.00 39.24 ? 315 PRO A HB2 1 ATOM 4210 H HB3 . PRO A 1 286 ? 41.033 32.559 39.374 1.00 39.24 ? 315 PRO A HB3 1 ATOM 4211 H HG2 . PRO A 1 286 ? 43.720 32.726 40.099 1.00 38.42 ? 315 PRO A HG2 1 ATOM 4212 H HG3 . PRO A 1 286 ? 43.106 32.739 38.628 1.00 38.42 ? 315 PRO A HG3 1 ATOM 4213 H HD2 . PRO A 1 286 ? 43.848 34.905 39.756 1.00 37.97 ? 315 PRO A HD2 1 ATOM 4214 H HD3 . PRO A 1 286 ? 42.615 34.894 38.730 1.00 37.97 ? 315 PRO A HD3 1 ATOM 4215 N N . TRP A 1 287 ? 40.673 32.761 43.272 1.00 31.08 ? 316 TRP A N 1 ATOM 4216 C CA . TRP A 1 287 ? 40.883 32.271 44.628 1.00 30.53 ? 316 TRP A CA 1 ATOM 4217 C C . TRP A 1 287 ? 41.840 31.083 44.628 1.00 30.80 ? 316 TRP A C 1 ATOM 4218 O O . TRP A 1 287 ? 41.958 30.375 43.630 1.00 31.46 ? 316 TRP A O 1 ATOM 4219 C CB . TRP A 1 287 ? 39.543 31.877 45.262 1.00 30.33 ? 316 TRP A CB 1 ATOM 4220 C CG . TRP A 1 287 ? 39.666 31.216 46.606 1.00 31.39 ? 316 TRP A CG 1 ATOM 4221 C CD1 . TRP A 1 287 ? 39.559 31.814 47.828 1.00 30.84 ? 316 TRP A CD1 1 ATOM 4222 C CD2 . TRP A 1 287 ? 39.920 29.829 46.860 1.00 32.18 ? 316 TRP A CD2 1 ATOM 4223 N NE1 . TRP A 1 287 ? 39.732 30.885 48.827 1.00 30.58 ? 316 TRP A NE1 1 ATOM 4224 C CE2 . TRP A 1 287 ? 39.957 29.659 48.258 1.00 31.09 ? 316 TRP A CE2 1 ATOM 4225 C CE3 . TRP A 1 287 ? 40.124 28.715 46.040 1.00 33.39 ? 316 TRP A CE3 1 ATOM 4226 C CZ2 . TRP A 1 287 ? 40.186 28.421 48.852 1.00 31.19 ? 316 TRP A CZ2 1 ATOM 4227 C CZ3 . TRP A 1 287 ? 40.352 27.489 46.632 1.00 33.40 ? 316 TRP A CZ3 1 ATOM 4228 C CH2 . TRP A 1 287 ? 40.380 27.350 48.024 1.00 32.25 ? 316 TRP A CH2 1 ATOM 4229 H H . TRP A 1 287 ? 39.853 32.731 43.015 1.00 37.30 ? 316 TRP A H 1 ATOM 4230 H HA . TRP A 1 287 ? 41.277 32.976 45.165 1.00 36.63 ? 316 TRP A HA 1 ATOM 4231 H HB2 . TRP A 1 287 ? 39.005 32.677 45.374 1.00 36.39 ? 316 TRP A HB2 1 ATOM 4232 H HB3 . TRP A 1 287 ? 39.089 31.258 44.669 1.00 36.39 ? 316 TRP A HB3 1 ATOM 4233 H HD1 . TRP A 1 287 ? 39.393 32.719 47.966 1.00 37.00 ? 316 TRP A HD1 1 ATOM 4234 H HE1 . TRP A 1 287 ? 39.705 31.047 49.671 1.00 36.70 ? 316 TRP A HE1 1 ATOM 4235 H HE3 . TRP A 1 287 ? 40.107 28.799 45.114 1.00 40.07 ? 316 TRP A HE3 1 ATOM 4236 H HZ2 . TRP A 1 287 ? 40.205 28.326 49.777 1.00 37.43 ? 316 TRP A HZ2 1 ATOM 4237 H HZ3 . TRP A 1 287 ? 40.488 26.741 46.096 1.00 40.08 ? 316 TRP A HZ3 1 ATOM 4238 H HH2 . TRP A 1 287 ? 40.535 26.512 48.395 1.00 38.70 ? 316 TRP A HH2 1 ATOM 4239 N N . GLU A 1 288 ? 42.522 30.871 45.749 1.00 43.53 ? 317 GLU A N 1 ATOM 4240 C CA . GLU A 1 288 ? 43.392 29.712 45.911 1.00 45.30 ? 317 GLU A CA 1 ATOM 4241 C C . GLU A 1 288 ? 43.648 29.439 47.387 1.00 45.08 ? 317 GLU A C 1 ATOM 4242 O O . GLU A 1 288 ? 43.815 30.366 48.178 1.00 45.60 ? 317 GLU A O 1 ATOM 4243 C CB . GLU A 1 288 ? 44.720 29.922 45.181 1.00 47.91 ? 317 GLU A CB 1 ATOM 4244 C CG . GLU A 1 288 ? 45.662 28.730 45.261 1.00 50.93 ? 317 GLU A CG 1 ATOM 4245 C CD . GLU A 1 288 ? 46.971 28.967 44.537 1.00 53.74 ? 317 GLU A CD 1 ATOM 4246 O OE1 . GLU A 1 288 ? 47.824 28.052 44.534 1.00 55.76 ? 317 GLU A OE1 1 ATOM 4247 O OE2 . GLU A 1 288 ? 47.150 30.067 43.971 1.00 52.99 ? 317 GLU A OE2 1 ATOM 4248 H H . GLU A 1 288 ? 42.499 31.388 46.435 1.00 52.24 ? 317 GLU A H 1 ATOM 4249 H HA . GLU A 1 288 ? 42.958 28.932 45.530 1.00 54.36 ? 317 GLU A HA 1 ATOM 4250 H HB2 . GLU A 1 288 ? 44.538 30.093 44.244 1.00 57.50 ? 317 GLU A HB2 1 ATOM 4251 H HB3 . GLU A 1 288 ? 45.174 30.685 45.572 1.00 57.50 ? 317 GLU A HB3 1 ATOM 4252 H HG2 . GLU A 1 288 ? 45.863 28.548 46.193 1.00 61.12 ? 317 GLU A HG2 1 ATOM 4253 H HG3 . GLU A 1 288 ? 45.231 27.959 44.859 1.00 61.12 ? 317 GLU A HG3 1 ATOM 4254 N N . ALA A 1 289 ? 43.677 28.162 47.752 1.00 42.64 ? 318 ALA A N 1 ATOM 4255 C CA . ALA A 1 289 ? 43.949 27.768 49.128 1.00 41.50 ? 318 ALA A CA 1 ATOM 4256 C C . ALA A 1 289 ? 45.411 28.026 49.475 1.00 41.82 ? 318 ALA A C 1 ATOM 4257 O O . ALA A 1 289 ? 46.288 27.945 48.613 1.00 42.45 ? 318 ALA A O 1 ATOM 4258 C CB . ALA A 1 289 ? 43.603 26.302 49.342 1.00 41.56 ? 318 ALA A CB 1 ATOM 4259 H H . ALA A 1 289 ? 43.542 27.501 47.219 1.00 51.17 ? 318 ALA A H 1 ATOM 4260 H HA . ALA A 1 289 ? 43.399 28.298 49.726 1.00 49.80 ? 318 ALA A HA 1 ATOM 4261 H HB1 . ALA A 1 289 ? 43.792 26.064 50.263 1.00 49.87 ? 318 ALA A HB1 1 ATOM 4262 H HB2 . ALA A 1 289 ? 42.661 26.170 49.152 1.00 49.87 ? 318 ALA A HB2 1 ATOM 4263 H HB3 . ALA A 1 289 ? 44.140 25.761 48.742 1.00 49.87 ? 318 ALA A HB3 1 ATOM 4264 N N . ALA A 1 290 ? 45.670 28.340 50.739 1.00 30.13 ? 319 ALA A N 1 ATOM 4265 C CA . ALA A 1 290 ? 47.030 28.594 51.193 1.00 32.27 ? 319 ALA A CA 1 ATOM 4266 C C . ALA A 1 290 ? 47.865 27.327 51.080 1.00 36.64 ? 319 ALA A C 1 ATOM 4267 O O . ALA A 1 290 ? 47.371 26.225 51.313 1.00 38.32 ? 319 ALA A O 1 ATOM 4268 C CB . ALA A 1 290 ? 47.027 29.105 52.623 1.00 31.46 ? 319 ALA A CB 1 ATOM 4269 H H . ALA A 1 290 ? 45.074 28.412 51.355 1.00 36.15 ? 319 ALA A H 1 ATOM 4270 H HA . ALA A 1 290 ? 47.432 29.273 50.629 1.00 38.73 ? 319 ALA A HA 1 ATOM 4271 H HB1 . ALA A 1 290 ? 47.942 29.267 52.901 1.00 37.76 ? 319 ALA A HB1 1 ATOM 4272 H HB2 . ALA A 1 290 ? 46.519 29.930 52.662 1.00 37.76 ? 319 ALA A HB2 1 ATOM 4273 H HB3 . ALA A 1 290 ? 46.620 28.437 53.196 1.00 37.76 ? 319 ALA A HB3 1 ATOM 4274 N N . ASP A 1 291 ? 49.131 27.491 50.714 1.00 50.00 ? 320 ASP A N 1 ATOM 4275 C CA . ASP A 1 291 ? 50.038 26.362 50.560 1.00 51.98 ? 320 ASP A CA 1 ATOM 4276 C C . ASP A 1 291 ? 50.702 26.022 51.891 1.00 52.40 ? 320 ASP A C 1 ATOM 4277 O O . ASP A 1 291 ? 51.570 26.753 52.363 1.00 52.71 ? 320 ASP A O 1 ATOM 4278 C CB . ASP A 1 291 ? 51.095 26.679 49.500 1.00 53.32 ? 320 ASP A CB 1 ATOM 4279 C CG . ASP A 1 291 ? 51.746 25.436 48.933 1.00 54.80 ? 320 ASP A CG 1 ATOM 4280 O OD1 . ASP A 1 291 ? 51.830 24.423 49.657 1.00 55.00 ? 320 ASP A OD1 1 ATOM 4281 O OD2 . ASP A 1 291 ? 52.170 25.471 47.758 1.00 55.70 ? 320 ASP A OD2 1 ATOM 4282 H H . ASP A 1 291 ? 49.492 28.253 50.548 1.00 60.00 ? 320 ASP A H 1 ATOM 4283 H HA . ASP A 1 291 ? 49.536 25.586 50.264 1.00 62.38 ? 320 ASP A HA 1 ATOM 4284 H HB2 . ASP A 1 291 ? 50.674 27.158 48.768 1.00 63.98 ? 320 ASP A HB2 1 ATOM 4285 H HB3 . ASP A 1 291 ? 51.789 27.226 49.899 1.00 63.98 ? 320 ASP A HB3 1 ATOM 4286 N N . GLY A 1 292 ? 50.291 24.912 52.496 1.00 50.55 ? 321 GLY A N 1 ATOM 4287 C CA . GLY A 1 292 ? 50.862 24.484 53.761 1.00 51.51 ? 321 GLY A CA 1 ATOM 4288 C C . GLY A 1 292 ? 52.310 24.059 53.609 1.00 52.85 ? 321 GLY A C 1 ATOM 4289 O O . GLY A 1 292 ? 53.131 24.293 54.495 1.00 52.73 ? 321 GLY A O 1 ATOM 4290 H H . GLY A 1 292 ? 49.680 24.389 52.191 1.00 60.67 ? 321 GLY A H 1 ATOM 4291 H HA2 . GLY A 1 292 ? 50.819 25.212 54.400 1.00 61.81 ? 321 GLY A HA2 1 ATOM 4292 H HA3 . GLY A 1 292 ? 50.354 23.735 54.110 1.00 61.81 ? 321 GLY A HA3 1 ATOM 4293 N N . ARG A 1 293 ? 52.622 23.431 52.480 1.00 61.63 ? 322 ARG A N 1 ATOM 4294 C CA . ARG A 1 293 ? 53.992 23.037 52.172 1.00 63.86 ? 322 ARG A CA 1 ATOM 4295 C C . ARG A 1 293 ? 54.878 24.271 52.027 1.00 63.30 ? 322 ARG A C 1 ATOM 4296 O O . ARG A 1 293 ? 55.838 24.453 52.776 1.00 63.76 ? 322 ARG A O 1 ATOM 4297 C CB . ARG A 1 293 ? 54.026 22.196 50.891 1.00 66.01 ? 322 ARG A CB 1 ATOM 4298 C CG . ARG A 1 293 ? 55.413 21.963 50.302 1.00 70.29 ? 322 ARG A CG 1 ATOM 4299 C CD . ARG A 1 293 ? 55.332 21.138 49.025 1.00 71.87 ? 322 ARG A CD 1 ATOM 4300 N NE . ARG A 1 293 ? 56.628 21.019 48.357 1.00 74.93 ? 322 ARG A NE 1 ATOM 4301 C CZ . ARG A 1 293 ? 57.092 21.868 47.442 1.00 76.30 ? 322 ARG A CZ 1 ATOM 4302 N NH1 . ARG A 1 293 ? 56.375 22.921 47.065 1.00 75.61 ? 322 ARG A NH1 1 ATOM 4303 N NH2 . ARG A 1 293 ? 58.284 21.663 46.898 1.00 77.86 ? 322 ARG A NH2 1 ATOM 4304 H H . ARG A 1 293 ? 52.054 23.221 51.870 1.00 73.95 ? 322 ARG A H 1 ATOM 4305 H HA . ARG A 1 293 ? 54.340 22.498 52.898 1.00 76.63 ? 322 ARG A HA 1 ATOM 4306 H HB2 . ARG A 1 293 ? 53.641 21.327 51.083 1.00 79.21 ? 322 ARG A HB2 1 ATOM 4307 H HB3 . ARG A 1 293 ? 53.493 22.644 50.214 1.00 79.21 ? 322 ARG A HB3 1 ATOM 4308 H HG2 . ARG A 1 293 ? 55.820 22.818 50.088 1.00 84.35 ? 322 ARG A HG2 1 ATOM 4309 H HG3 . ARG A 1 293 ? 55.958 21.481 50.944 1.00 84.35 ? 322 ARG A HG3 1 ATOM 4310 H HD2 . ARG A 1 293 ? 55.023 20.245 49.244 1.00 86.24 ? 322 ARG A HD2 1 ATOM 4311 H HD3 . ARG A 1 293 ? 54.714 21.563 48.411 1.00 86.24 ? 322 ARG A HD3 1 ATOM 4312 H HE . ARG A 1 293 ? 57.126 20.352 48.571 1.00 89.92 ? 322 ARG A HE 1 ATOM 4313 H HH11 . ARG A 1 293 ? 55.601 23.061 47.412 1.00 90.73 ? 322 ARG A HH11 1 ATOM 4314 H HH12 . ARG A 1 293 ? 56.685 23.462 46.473 1.00 90.73 ? 322 ARG A HH12 1 ATOM 4315 H HH21 . ARG A 1 293 ? 58.755 20.984 47.137 1.00 93.43 ? 322 ARG A HH21 1 ATOM 4316 H HH22 . ARG A 1 293 ? 58.587 22.210 46.307 1.00 93.43 ? 322 ARG A HH22 1 ATOM 4317 N N . THR A 1 294 ? 54.543 25.117 51.059 1.00 54.79 ? 323 THR A N 1 ATOM 4318 C CA . THR A 1 294 ? 55.305 26.332 50.797 1.00 55.73 ? 323 THR A CA 1 ATOM 4319 C C . THR A 1 294 ? 55.175 27.320 51.949 1.00 54.90 ? 323 THR A C 1 ATOM 4320 O O . THR A 1 294 ? 56.077 28.121 52.197 1.00 55.14 ? 323 THR A O 1 ATOM 4321 C CB . THR A 1 294 ? 54.835 27.020 49.497 1.00 56.71 ? 323 THR A CB 1 ATOM 4322 O OG1 . THR A 1 294 ? 54.777 26.062 48.433 1.00 57.68 ? 323 THR A OG1 1 ATOM 4323 C CG2 . THR A 1 294 ? 55.776 28.154 49.107 1.00 57.94 ? 323 THR A CG2 1 ATOM 4324 H H . THR A 1 294 ? 53.870 25.008 50.534 1.00 65.75 ? 323 THR A H 1 ATOM 4325 H HA . THR A 1 294 ? 56.242 26.104 50.697 1.00 66.88 ? 323 THR A HA 1 ATOM 4326 H HB . THR A 1 294 ? 53.951 27.395 49.636 1.00 68.06 ? 323 THR A HB 1 ATOM 4327 H HG1 . THR A 1 294 ? 54.522 26.434 47.724 1.00 69.22 ? 323 THR A HG1 1 ATOM 4328 H HG21 . THR A 1 294 ? 55.467 28.575 48.290 1.00 69.53 ? 323 THR A HG21 1 ATOM 4329 H HG22 . THR A 1 294 ? 55.804 28.819 49.813 1.00 69.53 ? 323 THR A HG22 1 ATOM 4330 H HG23 . THR A 1 294 ? 56.671 27.808 48.964 1.00 69.53 ? 323 THR A HG23 1 ATOM 4331 N N . GLY A 1 295 ? 54.049 27.253 52.652 1.00 41.74 ? 324 GLY A N 1 ATOM 4332 C CA . GLY A 1 295 ? 53.728 28.230 53.674 1.00 41.72 ? 324 GLY A CA 1 ATOM 4333 C C . GLY A 1 295 ? 53.170 29.505 53.066 1.00 41.77 ? 324 GLY A C 1 ATOM 4334 O O . GLY A 1 295 ? 52.778 30.422 53.785 1.00 41.14 ? 324 GLY A O 1 ATOM 4335 H H . GLY A 1 295 ? 53.451 26.643 52.551 1.00 50.08 ? 324 GLY A H 1 ATOM 4336 H HA2 . GLY A 1 295 ? 53.069 27.861 54.283 1.00 50.07 ? 324 GLY A HA2 1 ATOM 4337 H HA3 . GLY A 1 295 ? 54.527 28.450 54.178 1.00 50.07 ? 324 GLY A HA3 1 ATOM 4338 N N . ALA A 1 296 ? 53.129 29.563 51.738 1.00 52.06 ? 325 ALA A N 1 ATOM 4339 C CA . ALA A 1 296 ? 52.641 30.744 51.034 1.00 50.08 ? 325 ALA A CA 1 ATOM 4340 C C . ALA A 1 296 ? 51.177 31.016 51.384 1.00 47.49 ? 325 ALA A C 1 ATOM 4341 O O . ALA A 1 296 ? 50.378 30.083 51.456 1.00 47.31 ? 325 ALA A O 1 ATOM 4342 C CB . ALA A 1 296 ? 52.805 30.567 49.533 1.00 50.25 ? 325 ALA A CB 1 ATOM 4343 H H . ALA A 1 296 ? 53.380 28.925 51.218 1.00 62.48 ? 325 ALA A H 1 ATOM 4344 H HA . ALA A 1 296 ? 53.164 31.514 51.306 1.00 60.10 ? 325 ALA A HA 1 ATOM 4345 H HB1 . ALA A 1 296 ? 52.476 31.362 49.084 1.00 60.30 ? 325 ALA A HB1 1 ATOM 4346 H HB2 . ALA A 1 296 ? 53.745 30.439 49.331 1.00 60.30 ? 325 ALA A HB2 1 ATOM 4347 H HB3 . ALA A 1 296 ? 52.296 29.792 49.249 1.00 60.30 ? 325 ALA A HB3 1 ATOM 4348 N N . PRO A 1 297 ? 50.814 32.292 51.604 1.00 35.16 ? 326 PRO A N 1 ATOM 4349 C CA . PRO A 1 297 ? 49.424 32.574 51.984 1.00 32.31 ? 326 PRO A CA 1 ATOM 4350 C C . PRO A 1 297 ? 48.436 32.451 50.825 1.00 31.72 ? 326 PRO A C 1 ATOM 4351 O O . PRO A 1 297 ? 47.307 32.005 51.038 1.00 30.51 ? 326 PRO A O 1 ATOM 4352 C CB . PRO A 1 297 ? 49.479 34.028 52.480 1.00 31.80 ? 326 PRO A CB 1 ATOM 4353 C CG . PRO A 1 297 ? 50.930 34.379 52.575 1.00 33.40 ? 326 PRO A CG 1 ATOM 4354 C CD . PRO A 1 297 ? 51.626 33.518 51.588 1.00 34.85 ? 326 PRO A CD 1 ATOM 4355 H HA . PRO A 1 297 ? 49.146 31.995 52.710 1.00 38.78 ? 326 PRO A HA 1 ATOM 4356 H HB2 . PRO A 1 297 ? 49.030 34.606 51.843 1.00 38.16 ? 326 PRO A HB2 1 ATOM 4357 H HB3 . PRO A 1 297 ? 49.057 34.089 53.351 1.00 38.16 ? 326 PRO A HB3 1 ATOM 4358 H HG2 . PRO A 1 297 ? 51.052 35.315 52.355 1.00 40.08 ? 326 PRO A HG2 1 ATOM 4359 H HG3 . PRO A 1 297 ? 51.250 34.195 53.472 1.00 40.08 ? 326 PRO A HG3 1 ATOM 4360 H HD2 . PRO A 1 297 ? 51.609 33.927 50.708 1.00 41.82 ? 326 PRO A HD2 1 ATOM 4361 H HD3 . PRO A 1 297 ? 52.532 33.330 51.879 1.00 41.82 ? 326 PRO A HD3 1 ATOM 4362 N N . ASN A 1 298 ? 48.860 32.839 49.625 1.00 31.99 ? 327 ASN A N 1 ATOM 4363 C CA . ASN A 1 298 ? 47.971 32.898 48.467 1.00 32.07 ? 327 ASN A CA 1 ATOM 4364 C C . ASN A 1 298 ? 46.707 33.692 48.788 1.00 30.65 ? 327 ASN A C 1 ATOM 4365 O O . ASN A 1 298 ? 45.594 33.174 48.696 1.00 29.23 ? 327 ASN A O 1 ATOM 4366 C CB . ASN A 1 298 ? 47.604 31.490 47.990 1.00 33.06 ? 327 ASN A CB 1 ATOM 4367 C CG . ASN A 1 298 ? 48.790 30.741 47.418 1.00 35.10 ? 327 ASN A CG 1 ATOM 4368 O OD1 . ASN A 1 298 ? 49.118 29.642 47.864 1.00 36.26 ? 327 ASN A OD1 1 ATOM 4369 N ND2 . ASN A 1 298 ? 49.441 31.334 46.424 1.00 35.64 ? 327 ASN A ND2 1 ATOM 4370 H H . ASN A 1 298 ? 49.669 33.077 49.453 1.00 38.39 ? 327 ASN A H 1 ATOM 4371 H HA . ASN A 1 298 ? 48.429 33.349 47.740 1.00 38.49 ? 327 ASN A HA 1 ATOM 4372 H HB2 . ASN A 1 298 ? 47.261 30.981 48.741 1.00 39.67 ? 327 ASN A HB2 1 ATOM 4373 H HB3 . ASN A 1 298 ? 46.928 31.557 47.297 1.00 39.67 ? 327 ASN A HB3 1 ATOM 4374 H HD21 . ASN A 1 298 ? 50.121 30.949 46.065 1.00 42.76 ? 327 ASN A HD21 1 ATOM 4375 H HD22 . ASN A 1 298 ? 49.182 32.102 46.138 1.00 42.76 ? 327 ASN A HD22 1 ATOM 4376 N N . GLU A 1 299 ? 46.897 34.950 49.172 1.00 41.67 ? 328 GLU A N 1 ATOM 4377 C CA . GLU A 1 299 ? 45.796 35.802 49.608 1.00 42.49 ? 328 GLU A CA 1 ATOM 4378 C C . GLU A 1 299 ? 45.119 36.504 48.435 1.00 42.03 ? 328 GLU A C 1 ATOM 4379 O O . GLU A 1 299 ? 45.753 36.803 47.424 1.00 42.61 ? 328 GLU A O 1 ATOM 4380 C CB . GLU A 1 299 ? 46.292 36.834 50.630 1.00 44.04 ? 328 GLU A CB 1 ATOM 4381 C CG . GLU A 1 299 ? 47.524 37.635 50.214 1.00 46.06 ? 328 GLU A CG 1 ATOM 4382 C CD . GLU A 1 299 ? 48.140 38.391 51.376 1.00 47.52 ? 328 GLU A CD 1 ATOM 4383 O OE1 . GLU A 1 299 ? 49.316 38.801 51.267 1.00 48.41 ? 328 GLU A OE1 1 ATOM 4384 O OE2 . GLU A 1 299 ? 47.450 38.572 52.402 1.00 47.33 ? 328 GLU A OE2 1 ATOM 4385 H H . GLU A 1 299 ? 47.664 35.338 49.188 1.00 50.00 ? 328 GLU A H 1 ATOM 4386 H HA . GLU A 1 299 ? 45.129 35.250 50.046 1.00 50.99 ? 328 GLU A HA 1 ATOM 4387 H HB2 . GLU A 1 299 ? 45.577 37.468 50.798 1.00 52.85 ? 328 GLU A HB2 1 ATOM 4388 H HB3 . GLU A 1 299 ? 46.512 36.369 51.453 1.00 52.85 ? 328 GLU A HB3 1 ATOM 4389 H HG2 . GLU A 1 299 ? 48.193 37.028 49.861 1.00 55.27 ? 328 GLU A HG2 1 ATOM 4390 H HG3 . GLU A 1 299 ? 47.269 38.280 49.536 1.00 55.27 ? 328 GLU A HG3 1 ATOM 4391 N N . CYS A 1 300 ? 43.821 36.756 48.579 1.00 41.70 ? 329 CYS A N 1 ATOM 4392 C CA . CYS A 1 300 ? 43.034 37.395 47.531 1.00 40.98 ? 329 CYS A CA 1 ATOM 4393 C C . CYS A 1 300 ? 43.460 38.844 47.308 1.00 39.41 ? 329 CYS A C 1 ATOM 4394 O O . CYS A 1 300 ? 43.727 39.575 48.263 1.00 38.87 ? 329 CYS A O 1 ATOM 4395 C CB . CYS A 1 300 ? 41.547 37.337 47.882 1.00 41.14 ? 329 CYS A CB 1 ATOM 4396 S SG . CYS A 1 300 ? 40.840 35.672 47.847 1.00 35.69 ? 329 CYS A SG 1 ATOM 4397 H H . CYS A 1 300 ? 43.369 36.564 49.285 1.00 50.05 ? 329 CYS A H 1 ATOM 4398 H HA . CYS A 1 300 ? 43.165 36.913 46.700 1.00 49.17 ? 329 CYS A HA 1 ATOM 4399 H HB2 . CYS A 1 300 ? 41.425 37.690 48.777 1.00 49.37 ? 329 CYS A HB2 1 ATOM 4400 H HB3 . CYS A 1 300 ? 41.056 37.880 47.246 1.00 49.37 ? 329 CYS A HB3 1 ATOM 4401 N N . ARG A 1 301 ? 43.521 39.251 46.042 1.00 34.64 ? 330 ARG A N 1 ATOM 4402 C CA . ARG A 1 301 ? 43.905 40.614 45.691 1.00 33.62 ? 330 ARG A CA 1 ATOM 4403 C C . ARG A 1 301 ? 42.678 41.488 45.452 1.00 32.79 ? 330 ARG A C 1 ATOM 4404 O O . ARG A 1 301 ? 41.662 41.020 44.936 1.00 32.78 ? 330 ARG A O 1 ATOM 4405 C CB . ARG A 1 301 ? 44.801 40.616 44.452 1.00 35.12 ? 330 ARG A CB 1 ATOM 4406 C CG . ARG A 1 301 ? 45.234 42.008 44.025 1.00 36.60 ? 330 ARG A CG 1 ATOM 4407 C CD . ARG A 1 301 ? 46.491 41.982 43.173 1.00 38.52 ? 330 ARG A CD 1 ATOM 4408 N NE . ARG A 1 301 ? 46.282 41.300 41.895 1.00 39.94 ? 330 ARG A NE 1 ATOM 4409 C CZ . ARG A 1 301 ? 46.930 40.209 41.489 1.00 41.06 ? 330 ARG A CZ 1 ATOM 4410 N NH1 . ARG A 1 301 ? 47.859 39.636 42.246 1.00 41.99 ? 330 ARG A NH1 1 ATOM 4411 N NH2 . ARG A 1 301 ? 46.650 39.686 40.303 1.00 41.17 ? 330 ARG A NH2 1 ATOM 4412 H H . ARG A 1 301 ? 43.343 38.753 45.364 1.00 41.57 ? 330 ARG A H 1 ATOM 4413 H HA . ARG A 1 301 ? 44.408 40.999 46.425 1.00 40.35 ? 330 ARG A HA 1 ATOM 4414 H HB2 . ARG A 1 301 ? 45.600 40.100 44.642 1.00 42.15 ? 330 ARG A HB2 1 ATOM 4415 H HB3 . ARG A 1 301 ? 44.316 40.215 43.714 1.00 42.15 ? 330 ARG A HB3 1 ATOM 4416 H HG2 . ARG A 1 301 ? 44.525 42.416 43.504 1.00 43.92 ? 330 ARG A HG2 1 ATOM 4417 H HG3 . ARG A 1 301 ? 45.417 42.540 44.815 1.00 43.92 ? 330 ARG A HG3 1 ATOM 4418 H HD2 . ARG A 1 301 ? 46.767 42.893 42.987 1.00 46.23 ? 330 ARG A HD2 1 ATOM 4419 H HD3 . ARG A 1 301 ? 47.190 41.513 43.654 1.00 46.23 ? 330 ARG A HD3 1 ATOM 4420 H HE . ARG A 1 301 ? 45.694 41.632 41.363 1.00 47.92 ? 330 ARG A HE 1 ATOM 4421 H HH11 . ARG A 1 301 ? 48.050 39.966 43.017 1.00 50.38 ? 330 ARG A HH11 1 ATOM 4422 H HH12 . ARG A 1 301 ? 48.267 38.932 41.967 1.00 50.38 ? 330 ARG A HH12 1 ATOM 4423 H HH21 . ARG A 1 301 ? 46.051 40.049 39.804 1.00 49.41 ? 330 ARG A HH21 1 ATOM 4424 H HH22 . ARG A 1 301 ? 47.064 38.982 40.035 1.00 49.41 ? 330 ARG A HH22 1 ATOM 4425 N N . THR A 1 302 ? 42.784 42.760 45.826 1.00 28.17 ? 331 THR A N 1 ATOM 4426 C CA . THR A 1 302 ? 41.661 43.689 45.723 1.00 28.14 ? 331 THR A CA 1 ATOM 4427 C C . THR A 1 302 ? 41.410 44.169 44.296 1.00 28.41 ? 331 THR A C 1 ATOM 4428 O O . THR A 1 302 ? 42.336 44.277 43.490 1.00 28.66 ? 331 THR A O 1 ATOM 4429 C CB . THR A 1 302 ? 41.870 44.929 46.610 1.00 28.19 ? 331 THR A CB 1 ATOM 4430 O OG1 . THR A 1 302 ? 40.729 45.787 46.502 1.00 28.27 ? 331 THR A OG1 1 ATOM 4431 C CG2 . THR A 1 302 ? 43.119 45.695 46.195 1.00 28.45 ? 331 THR A CG2 1 ATOM 4432 H H . THR A 1 302 ? 43.500 43.113 46.145 1.00 33.80 ? 331 THR A H 1 ATOM 4433 H HA . THR A 1 302 ? 40.857 43.239 46.028 1.00 33.77 ? 331 THR A HA 1 ATOM 4434 H HB . THR A 1 302 ? 41.976 44.649 47.533 1.00 33.83 ? 331 THR A HB 1 ATOM 4435 H HG1 . THR A 1 302 ? 40.834 46.467 46.983 1.00 33.93 ? 331 THR A HG1 1 ATOM 4436 H HG21 . THR A 1 302 ? 43.235 46.472 46.765 1.00 34.15 ? 331 THR A HG21 1 ATOM 4437 H HG22 . THR A 1 302 ? 43.900 45.125 46.277 1.00 34.15 ? 331 THR A HG22 1 ATOM 4438 H HG23 . THR A 1 302 ? 43.037 45.988 45.274 1.00 34.15 ? 331 THR A HG23 1 ATOM 4439 N N . CYS A 1 303 ? 40.147 44.460 44.001 1.00 29.49 ? 332 CYS A N 1 ATOM 4440 C CA . CYS A 1 303 ? 39.772 45.093 42.745 1.00 29.85 ? 332 CYS A CA 1 ATOM 4441 C C . CYS A 1 303 ? 40.005 46.596 42.845 1.00 29.94 ? 332 CYS A C 1 ATOM 4442 O O . CYS A 1 303 ? 39.778 47.195 43.897 1.00 29.79 ? 332 CYS A O 1 ATOM 4443 C CB . CYS A 1 303 ? 38.303 44.818 42.404 1.00 30.07 ? 332 CYS A CB 1 ATOM 4444 S SG . CYS A 1 303 ? 37.833 43.072 42.264 1.00 30.13 ? 332 CYS A SG 1 ATOM 4445 H H . CYS A 1 303 ? 39.481 44.298 44.521 1.00 35.39 ? 332 CYS A H 1 ATOM 4446 H HA . CYS A 1 303 ? 40.324 44.743 42.029 1.00 35.81 ? 332 CYS A HA 1 ATOM 4447 H HB2 . CYS A 1 303 ? 37.750 45.211 43.098 1.00 36.09 ? 332 CYS A HB2 1 ATOM 4448 H HB3 . CYS A 1 303 ? 38.102 45.241 41.555 1.00 36.09 ? 332 CYS A HB3 1 ATOM 4449 N N . LYS A 1 304 ? 40.464 47.201 41.756 1.00 46.70 ? 333 LYS A N 1 ATOM 4450 C CA . LYS A 1 304 ? 40.574 48.653 41.681 1.00 48.56 ? 333 LYS A CA 1 ATOM 4451 C C . LYS A 1 304 ? 39.220 49.226 41.280 1.00 48.44 ? 333 LYS A C 1 ATOM 4452 O O . LYS A 1 304 ? 38.719 48.941 40.192 1.00 49.76 ? 333 LYS A O 1 ATOM 4453 C CB . LYS A 1 304 ? 41.658 49.066 40.684 1.00 50.41 ? 333 LYS A CB 1 ATOM 4454 C CG . LYS A 1 304 ? 43.043 48.539 41.033 1.00 51.55 ? 333 LYS A CG 1 ATOM 4455 C CD . LYS A 1 304 ? 44.034 48.758 39.901 1.00 52.95 ? 333 LYS A CD 1 ATOM 4456 C CE . LYS A 1 304 ? 45.361 48.068 40.189 1.00 53.86 ? 333 LYS A CE 1 ATOM 4457 N NZ . LYS A 1 304 ? 46.322 48.187 39.055 1.00 54.52 ? 333 LYS A NZ 1 ATOM 4458 H H . LYS A 1 304 ? 40.719 46.793 41.043 1.00 56.04 ? 333 LYS A H 1 ATOM 4459 H HA . LYS A 1 304 ? 40.809 49.004 42.554 1.00 58.27 ? 333 LYS A HA 1 ATOM 4460 H HB2 . LYS A 1 304 ? 41.423 48.725 39.807 1.00 60.49 ? 333 LYS A HB2 1 ATOM 4461 H HB3 . LYS A 1 304 ? 41.707 50.035 40.659 1.00 60.49 ? 333 LYS A HB3 1 ATOM 4462 H HG2 . LYS A 1 304 ? 43.373 49.005 41.818 1.00 61.86 ? 333 LYS A HG2 1 ATOM 4463 H HG3 . LYS A 1 304 ? 42.987 47.587 41.208 1.00 61.86 ? 333 LYS A HG3 1 ATOM 4464 H HD2 . LYS A 1 304 ? 43.670 48.389 39.081 1.00 63.54 ? 333 LYS A HD2 1 ATOM 4465 H HD3 . LYS A 1 304 ? 44.200 49.708 39.798 1.00 63.54 ? 333 LYS A HD3 1 ATOM 4466 H HE2 . LYS A 1 304 ? 45.767 48.475 40.971 1.00 64.64 ? 333 LYS A HE2 1 ATOM 4467 H HE3 . LYS A 1 304 ? 45.201 47.125 40.349 1.00 64.64 ? 333 LYS A HE3 1 ATOM 4468 H HZ1 . LYS A 1 304 ? 47.084 47.774 39.258 1.00 65.42 ? 333 LYS A HZ1 1 ATOM 4469 H HZ2 . LYS A 1 304 ? 45.977 47.815 38.324 1.00 65.42 ? 333 LYS A HZ2 1 ATOM 4470 H HZ3 . LYS A 1 304 ? 46.493 49.045 38.890 1.00 65.42 ? 333 LYS A HZ3 1 ATOM 4471 N N . CYS A 1 305 ? 38.630 50.026 42.163 1.00 33.57 ? 334 CYS A N 1 ATOM 4472 C CA . CYS A 1 305 ? 37.297 50.578 41.937 1.00 33.51 ? 334 CYS A CA 1 ATOM 4473 C C . CYS A 1 305 ? 37.226 52.063 42.286 1.00 33.87 ? 334 CYS A C 1 ATOM 4474 O O . CYS A 1 305 ? 36.154 52.667 42.234 1.00 34.32 ? 334 CYS A O 1 ATOM 4475 C CB . CYS A 1 305 ? 36.257 49.804 42.753 1.00 33.17 ? 334 CYS A CB 1 ATOM 4476 S SG . CYS A 1 305 ? 36.029 48.081 42.238 1.00 29.66 ? 334 CYS A SG 1 ATOM 4477 H H . CYS A 1 305 ? 38.985 50.267 42.909 1.00 40.28 ? 334 CYS A H 1 ATOM 4478 H HA . CYS A 1 305 ? 37.072 50.481 40.999 1.00 40.21 ? 334 CYS A HA 1 ATOM 4479 H HB2 . CYS A 1 305 ? 36.533 49.799 43.683 1.00 39.80 ? 334 CYS A HB2 1 ATOM 4480 H HB3 . CYS A 1 305 ? 35.401 50.252 42.669 1.00 39.80 ? 334 CYS A HB3 1 ATOM 4481 N N . ASN A 1 306 ? 38.368 52.644 42.646 1.00 30.44 ? 335 ASN A N 1 ATOM 4482 C CA . ASN A 1 306 ? 38.451 54.066 42.970 1.00 31.15 ? 335 ASN A CA 1 ATOM 4483 C C . ASN A 1 306 ? 37.482 54.477 44.079 1.00 31.41 ? 335 ASN A C 1 ATOM 4484 O O . ASN A 1 306 ? 37.118 55.646 44.194 1.00 30.56 ? 335 ASN A O 1 ATOM 4485 C CB . ASN A 1 306 ? 38.194 54.910 41.716 1.00 33.36 ? 335 ASN A CB 1 ATOM 4486 C CG . ASN A 1 306 ? 39.241 54.692 40.642 1.00 35.33 ? 335 ASN A CG 1 ATOM 4487 O OD1 . ASN A 1 306 ? 39.061 53.880 39.736 1.00 35.87 ? 335 ASN A OD1 1 ATOM 4488 N ND2 . ASN A 1 306 ? 40.346 55.420 40.739 1.00 36.25 ? 335 ASN A ND2 1 ATOM 4489 H H . ASN A 1 306 ? 39.119 52.229 42.710 1.00 36.53 ? 335 ASN A H 1 ATOM 4490 H HA . ASN A 1 306 ? 39.350 54.262 43.277 1.00 37.38 ? 335 ASN A HA 1 ATOM 4491 H HB2 . ASN A 1 306 ? 37.330 54.671 41.346 1.00 40.03 ? 335 ASN A HB2 1 ATOM 4492 H HB3 . ASN A 1 306 ? 38.204 55.849 41.959 1.00 40.03 ? 335 ASN A HB3 1 ATOM 4493 H HD21 . ASN A 1 306 ? 40.971 55.334 40.155 1.00 43.50 ? 335 ASN A HD21 1 ATOM 4494 H HD22 . ASN A 1 306 ? 40.438 55.978 41.387 1.00 43.50 ? 335 ASN A HD22 1 ATOM 4495 N N . GLY A 1 307 ? 37.066 53.512 44.893 1.00 37.09 ? 336 GLY A N 1 ATOM 4496 C CA . GLY A 1 307 ? 36.190 53.789 46.017 1.00 40.04 ? 336 GLY A CA 1 ATOM 4497 C C . GLY A 1 307 ? 34.758 54.090 45.613 1.00 42.71 ? 336 GLY A C 1 ATOM 4498 O O . GLY A 1 307 ? 34.052 54.821 46.310 1.00 45.38 ? 336 GLY A O 1 ATOM 4499 H H . GLY A 1 307 ? 37.280 52.684 44.811 1.00 44.50 ? 336 GLY A H 1 ATOM 4500 H HA2 . GLY A 1 307 ? 36.183 53.023 46.612 1.00 48.05 ? 336 GLY A HA2 1 ATOM 4501 H HA3 . GLY A 1 307 ? 36.533 54.552 46.509 1.00 48.05 ? 336 GLY A HA3 1 ATOM 4502 N N . HIS A 1 308 ? 34.334 53.527 44.486 1.00 30.11 ? 337 HIS A N 1 ATOM 4503 C CA . HIS A 1 308 ? 32.968 53.696 43.998 1.00 31.39 ? 337 HIS A CA 1 ATOM 4504 C C . HIS A 1 308 ? 32.243 52.353 43.923 1.00 29.98 ? 337 HIS A C 1 ATOM 4505 O O . HIS A 1 308 ? 31.212 52.231 43.262 1.00 30.59 ? 337 HIS A O 1 ATOM 4506 C CB . HIS A 1 308 ? 32.971 54.372 42.626 1.00 39.45 ? 337 HIS A CB 1 ATOM 4507 C CG . HIS A 1 308 ? 33.650 55.706 42.613 1.00 30.17 ? 337 HIS A CG 1 ATOM 4508 N ND1 . HIS A 1 308 ? 33.099 56.828 43.193 1.00 30.77 ? 337 HIS A ND1 1 ATOM 4509 C CD2 . HIS A 1 308 ? 34.834 56.099 42.086 1.00 29.78 ? 337 HIS A CD2 1 ATOM 4510 C CE1 . HIS A 1 308 ? 33.913 57.854 43.025 1.00 30.68 ? 337 HIS A CE1 1 ATOM 4511 N NE2 . HIS A 1 308 ? 34.974 57.439 42.356 1.00 30.08 ? 337 HIS A NE2 1 ATOM 4512 H H . HIS A 1 308 ? 34.825 53.036 43.978 1.00 36.13 ? 337 HIS A H 1 ATOM 4513 H HA . HIS A 1 308 ? 32.481 54.266 44.613 1.00 37.67 ? 337 HIS A HA 1 ATOM 4514 H HB2 . HIS A 1 308 ? 33.432 53.797 41.995 1.00 47.34 ? 337 HIS A HB2 1 ATOM 4515 H HB3 . HIS A 1 308 ? 32.053 54.503 42.341 1.00 47.34 ? 337 HIS A HB3 1 ATOM 4516 H HD2 . HIS A 1 308 ? 35.439 55.562 41.627 1.00 35.73 ? 337 HIS A HD2 1 ATOM 4517 H HE1 . HIS A 1 308 ? 33.765 58.721 43.327 1.00 36.82 ? 337 HIS A HE1 1 ATOM 4518 N N . ALA A 1 309 ? 32.782 51.350 44.608 1.00 31.64 ? 338 ALA A N 1 ATOM 4519 C CA . ALA A 1 309 ? 32.174 50.025 44.631 1.00 33.07 ? 338 ALA A CA 1 ATOM 4520 C C . ALA A 1 309 ? 32.704 49.213 45.806 1.00 32.25 ? 338 ALA A C 1 ATOM 4521 O O . ALA A 1 309 ? 33.872 49.337 46.174 1.00 33.97 ? 338 ALA A O 1 ATOM 4522 C CB . ALA A 1 309 ? 32.438 49.297 43.323 1.00 35.38 ? 338 ALA A CB 1 ATOM 4523 H H . ALA A 1 309 ? 33.505 51.412 45.071 1.00 37.97 ? 338 ALA A H 1 ATOM 4524 H HA . ALA A 1 309 ? 31.214 50.118 44.736 1.00 39.69 ? 338 ALA A HA 1 ATOM 4525 H HB1 . ALA A 1 309 ? 32.025 48.421 43.361 1.00 42.45 ? 338 ALA A HB1 1 ATOM 4526 H HB2 . ALA A 1 309 ? 32.058 49.811 42.594 1.00 42.45 ? 338 ALA A HB2 1 ATOM 4527 H HB3 . ALA A 1 309 ? 33.396 49.207 43.200 1.00 42.45 ? 338 ALA A HB3 1 ATOM 4528 N N . ASP A 1 310 ? 31.837 48.388 46.387 1.00 55.07 ? 339 ASP A N 1 ATOM 4529 C CA . ASP A 1 310 ? 32.204 47.544 47.522 1.00 56.44 ? 339 ASP A CA 1 ATOM 4530 C C . ASP A 1 310 ? 32.191 46.059 47.156 1.00 55.82 ? 339 ASP A C 1 ATOM 4531 O O . ASP A 1 310 ? 32.485 45.205 47.993 1.00 55.53 ? 339 ASP A O 1 ATOM 4532 C CB . ASP A 1 310 ? 31.262 47.798 48.702 1.00 58.03 ? 339 ASP A CB 1 ATOM 4533 C CG . ASP A 1 310 ? 29.798 47.638 48.332 1.00 60.25 ? 339 ASP A CG 1 ATOM 4534 O OD1 . ASP A 1 310 ? 29.506 47.154 47.218 1.00 60.20 ? 339 ASP A OD1 1 ATOM 4535 O OD2 . ASP A 1 310 ? 28.935 47.992 49.164 1.00 62.27 ? 339 ASP A OD2 1 ATOM 4536 H H . ASP A 1 310 ? 31.018 48.297 46.139 1.00 66.08 ? 339 ASP A H 1 ATOM 4537 H HA . ASP A 1 310 ? 33.103 47.773 47.805 1.00 67.72 ? 339 ASP A HA 1 ATOM 4538 H HB2 . ASP A 1 310 ? 31.463 47.165 49.409 1.00 69.64 ? 339 ASP A HB2 1 ATOM 4539 H HB3 . ASP A 1 310 ? 31.393 48.705 49.021 1.00 69.64 ? 339 ASP A HB3 1 ATOM 4540 N N . THR A 1 311 ? 31.846 45.759 45.907 1.00 51.96 ? 340 THR A N 1 ATOM 4541 C CA . THR A 1 311 ? 31.812 44.383 45.424 1.00 50.86 ? 340 THR A CA 1 ATOM 4542 C C . THR A 1 311 ? 32.315 44.299 43.988 1.00 51.00 ? 340 THR A C 1 ATOM 4543 O O . THR A 1 311 ? 32.253 45.272 43.238 1.00 52.47 ? 340 THR A O 1 ATOM 4544 C CB . THR A 1 311 ? 30.391 43.794 45.484 1.00 50.37 ? 340 THR A CB 1 ATOM 4545 O OG1 . THR A 1 311 ? 29.502 44.600 44.699 1.00 51.79 ? 340 THR A OG1 1 ATOM 4546 C CG2 . THR A 1 311 ? 29.891 43.736 46.921 1.00 49.12 ? 340 THR A CG2 1 ATOM 4547 H H . THR A 1 311 ? 31.626 46.342 45.314 1.00 62.35 ? 340 THR A H 1 ATOM 4548 H HA . THR A 1 311 ? 32.389 43.836 45.979 1.00 61.03 ? 340 THR A HA 1 ATOM 4549 H HB . THR A 1 311 ? 30.402 42.891 45.129 1.00 60.44 ? 340 THR A HB 1 ATOM 4550 H HG1 . THR A 1 311 ? 28.725 44.283 44.728 1.00 62.14 ? 340 THR A HG1 1 ATOM 4551 H HG21 . THR A 1 311 ? 28.996 43.364 46.945 1.00 58.94 ? 340 THR A HG21 1 ATOM 4552 H HG22 . THR A 1 311 ? 30.479 43.178 47.454 1.00 58.94 ? 340 THR A HG22 1 ATOM 4553 H HG23 . THR A 1 311 ? 29.872 44.628 47.301 1.00 58.94 ? 340 THR A HG23 1 ATOM 4554 N N . CYS A 1 312 ? 32.812 43.125 43.613 1.00 43.38 ? 341 CYS A N 1 ATOM 4555 C CA . CYS A 1 312 ? 33.310 42.895 42.266 1.00 42.77 ? 341 CYS A CA 1 ATOM 4556 C C . CYS A 1 312 ? 33.339 41.400 41.985 1.00 42.21 ? 341 CYS A C 1 ATOM 4557 O O . CYS A 1 312 ? 33.215 40.588 42.903 1.00 42.46 ? 341 CYS A O 1 ATOM 4558 C CB . CYS A 1 312 ? 34.706 43.501 42.089 1.00 42.17 ? 341 CYS A CB 1 ATOM 4559 S SG . CYS A 1 312 ? 36.003 42.710 43.072 1.00 136.76 ? 341 CYS A SG 1 ATOM 4560 H H . CYS A 1 312 ? 32.871 42.439 44.128 1.00 52.06 ? 341 CYS A H 1 ATOM 4561 H HA . CYS A 1 312 ? 32.713 43.314 41.627 1.00 51.32 ? 341 CYS A HA 1 ATOM 4562 H HB2 . CYS A 1 312 ? 34.959 43.428 41.156 1.00 50.61 ? 341 CYS A HB2 1 ATOM 4563 H HB3 . CYS A 1 312 ? 34.672 44.436 42.346 1.00 50.61 ? 341 CYS A HB3 1 ATOM 4564 N N . HIS A 1 313 ? 33.502 41.044 40.715 1.00 40.16 ? 342 HIS A N 1 ATOM 4565 C CA . HIS A 1 313 ? 33.520 39.646 40.304 1.00 39.10 ? 342 HIS A CA 1 ATOM 4566 C C . HIS A 1 313 ? 34.680 39.386 39.353 1.00 38.18 ? 342 HIS A C 1 ATOM 4567 O O . HIS A 1 313 ? 35.100 40.273 38.611 1.00 37.50 ? 342 HIS A O 1 ATOM 4568 C CB . HIS A 1 313 ? 32.198 39.266 39.637 1.00 39.82 ? 342 HIS A CB 1 ATOM 4569 C CG . HIS A 1 313 ? 31.992 39.907 38.301 1.00 40.34 ? 342 HIS A CG 1 ATOM 4570 N ND1 . HIS A 1 313 ? 31.427 41.156 38.153 1.00 40.64 ? 342 HIS A ND1 1 ATOM 4571 C CD2 . HIS A 1 313 ? 32.278 39.474 37.051 1.00 40.94 ? 342 HIS A CD2 1 ATOM 4572 C CE1 . HIS A 1 313 ? 31.372 41.463 36.870 1.00 41.48 ? 342 HIS A CE1 1 ATOM 4573 N NE2 . HIS A 1 313 ? 31.883 40.459 36.179 1.00 41.72 ? 342 HIS A NE2 1 ATOM 4574 H H . HIS A 1 313 ? 33.604 41.599 40.067 1.00 48.19 ? 342 HIS A H 1 ATOM 4575 H HA . HIS A 1 313 ? 33.638 39.085 41.087 1.00 46.92 ? 342 HIS A HA 1 ATOM 4576 H HB2 . HIS A 1 313 ? 32.176 38.305 39.512 1.00 47.79 ? 342 HIS A HB2 1 ATOM 4577 H HB3 . HIS A 1 313 ? 31.467 39.539 40.214 1.00 47.79 ? 342 HIS A HB3 1 ATOM 4578 H HD2 . HIS A 1 313 ? 32.669 38.661 36.825 1.00 49.13 ? 342 HIS A HD2 1 ATOM 4579 H HE1 . HIS A 1 313 ? 31.033 42.251 36.513 1.00 49.78 ? 342 HIS A HE1 1 ATOM 4580 N N . PHE A 1 314 ? 35.196 38.163 39.386 1.00 29.87 ? 343 PHE A N 1 ATOM 4581 C CA . PHE A 1 314 ? 36.291 37.773 38.510 1.00 30.20 ? 343 PHE A CA 1 ATOM 4582 C C . PHE A 1 314 ? 35.800 37.639 37.072 1.00 33.29 ? 343 PHE A C 1 ATOM 4583 O O . PHE A 1 314 ? 34.619 37.388 36.832 1.00 33.68 ? 343 PHE A O 1 ATOM 4584 C CB . PHE A 1 314 ? 36.910 36.459 38.988 1.00 29.93 ? 343 PHE A CB 1 ATOM 4585 C CG . PHE A 1 314 ? 38.161 36.077 38.255 1.00 30.28 ? 343 PHE A CG 1 ATOM 4586 C CD1 . PHE A 1 314 ? 39.350 36.745 38.494 1.00 29.90 ? 343 PHE A CD1 1 ATOM 4587 C CD2 . PHE A 1 314 ? 38.153 35.045 37.332 1.00 31.17 ? 343 PHE A CD2 1 ATOM 4588 C CE1 . PHE A 1 314 ? 40.506 36.396 37.822 1.00 30.41 ? 343 PHE A CE1 1 ATOM 4589 C CE2 . PHE A 1 314 ? 39.307 34.689 36.656 1.00 31.69 ? 343 PHE A CE2 1 ATOM 4590 C CZ . PHE A 1 314 ? 40.485 35.366 36.903 1.00 31.32 ? 343 PHE A CZ 1 ATOM 4591 H H . PHE A 1 314 ? 34.928 37.537 39.911 1.00 35.84 ? 343 PHE A H 1 ATOM 4592 H HA . PHE A 1 314 ? 36.977 38.458 38.533 1.00 36.24 ? 343 PHE A HA 1 ATOM 4593 H HB2 . PHE A 1 314 ? 37.131 36.542 39.929 1.00 35.91 ? 343 PHE A HB2 1 ATOM 4594 H HB3 . PHE A 1 314 ? 36.264 35.746 38.864 1.00 35.91 ? 343 PHE A HB3 1 ATOM 4595 H HD1 . PHE A 1 314 ? 39.370 37.440 39.112 1.00 35.88 ? 343 PHE A HD1 1 ATOM 4596 H HD2 . PHE A 1 314 ? 37.361 34.586 37.162 1.00 37.41 ? 343 PHE A HD2 1 ATOM 4597 H HE1 . PHE A 1 314 ? 41.298 36.853 37.991 1.00 36.49 ? 343 PHE A HE1 1 ATOM 4598 H HE2 . PHE A 1 314 ? 39.289 33.995 36.037 1.00 38.03 ? 343 PHE A HE2 1 ATOM 4599 H HZ . PHE A 1 314 ? 41.263 35.129 36.450 1.00 37.58 ? 343 PHE A HZ 1 ATOM 4600 N N . ASP A 1 315 ? 36.713 37.808 36.121 1.00 38.50 ? 344 ASP A N 1 ATOM 4601 C CA . ASP A 1 315 ? 36.388 37.679 34.706 1.00 40.96 ? 344 ASP A CA 1 ATOM 4602 C C . ASP A 1 315 ? 37.581 37.076 33.973 1.00 41.68 ? 344 ASP A C 1 ATOM 4603 O O . ASP A 1 315 ? 38.624 37.715 33.831 1.00 42.34 ? 344 ASP A O 1 ATOM 4604 C CB . ASP A 1 315 ? 36.012 39.041 34.114 1.00 41.20 ? 344 ASP A CB 1 ATOM 4605 C CG . ASP A 1 315 ? 35.387 38.934 32.731 1.00 41.96 ? 344 ASP A CG 1 ATOM 4606 O OD1 . ASP A 1 315 ? 35.800 38.058 31.940 1.00 35.85 ? 344 ASP A OD1 1 ATOM 4607 O OD2 . ASP A 1 315 ? 34.477 39.739 32.433 1.00 35.36 ? 344 ASP A OD2 1 ATOM 4608 H H . ASP A 1 315 ? 37.537 38.000 36.272 1.00 46.20 ? 344 ASP A H 1 ATOM 4609 H HA . ASP A 1 315 ? 35.631 37.081 34.602 1.00 49.16 ? 344 ASP A HA 1 ATOM 4610 H HB2 . ASP A 1 315 ? 35.370 39.473 34.699 1.00 49.44 ? 344 ASP A HB2 1 ATOM 4611 H HB3 . ASP A 1 315 ? 36.812 39.584 34.039 1.00 49.44 ? 344 ASP A HB3 1 ATOM 4612 N N . VAL A 1 316 ? 37.420 35.840 33.514 1.00 33.64 ? 345 VAL A N 1 ATOM 4613 C CA . VAL A 1 316 ? 38.507 35.120 32.862 1.00 34.35 ? 345 VAL A CA 1 ATOM 4614 C C . VAL A 1 316 ? 38.900 35.794 31.549 1.00 35.39 ? 345 VAL A C 1 ATOM 4615 O O . VAL A 1 316 ? 40.065 35.770 31.152 1.00 35.77 ? 345 VAL A O 1 ATOM 4616 C CB . VAL A 1 316 ? 38.126 33.644 32.597 1.00 35.17 ? 345 VAL A CB 1 ATOM 4617 C CG1 . VAL A 1 316 ? 36.909 33.547 31.684 1.00 36.33 ? 345 VAL A CG1 1 ATOM 4618 C CG2 . VAL A 1 316 ? 39.308 32.878 32.014 1.00 35.99 ? 345 VAL A CG2 1 ATOM 4619 H H . VAL A 1 316 ? 36.687 35.393 33.567 1.00 40.37 ? 345 VAL A H 1 ATOM 4620 H HA . VAL A 1 316 ? 39.283 35.128 33.445 1.00 41.22 ? 345 VAL A HA 1 ATOM 4621 H HB . VAL A 1 316 ? 37.894 33.227 33.442 1.00 42.21 ? 345 VAL A HB 1 ATOM 4622 H HG11 . VAL A 1 316 ? 36.698 32.611 31.538 1.00 43.60 ? 345 VAL A HG11 1 ATOM 4623 H HG12 . VAL A 1 316 ? 36.160 33.993 32.108 1.00 43.60 ? 345 VAL A HG12 1 ATOM 4624 H HG13 . VAL A 1 316 ? 37.115 33.975 30.838 1.00 43.60 ? 345 VAL A HG13 1 ATOM 4625 H HG21 . VAL A 1 316 ? 39.042 31.958 31.858 1.00 43.18 ? 345 VAL A HG21 1 ATOM 4626 H HG22 . VAL A 1 316 ? 39.571 33.293 31.177 1.00 43.18 ? 345 VAL A HG22 1 ATOM 4627 H HG23 . VAL A 1 316 ? 40.045 32.907 32.644 1.00 43.18 ? 345 VAL A HG23 1 ATOM 4628 N N . ASN A 1 317 ? 37.923 36.392 30.876 1.00 43.93 ? 346 ASN A N 1 ATOM 4629 C CA . ASN A 1 317 ? 38.182 37.080 29.618 1.00 44.96 ? 346 ASN A CA 1 ATOM 4630 C C . ASN A 1 317 ? 39.024 38.331 29.848 1.00 44.48 ? 346 ASN A C 1 ATOM 4631 O O . ASN A 1 317 ? 39.989 38.583 29.125 1.00 43.64 ? 346 ASN A O 1 ATOM 4632 C CB . ASN A 1 317 ? 36.866 37.438 28.924 1.00 45.42 ? 346 ASN A CB 1 ATOM 4633 C CG . ASN A 1 317 ? 36.032 36.214 28.590 1.00 46.09 ? 346 ASN A CG 1 ATOM 4634 O OD1 . ASN A 1 317 ? 36.558 35.196 28.139 1.00 46.74 ? 346 ASN A OD1 1 ATOM 4635 N ND2 . ASN A 1 317 ? 34.725 36.306 28.814 1.00 45.92 ? 346 ASN A ND2 1 ATOM 4636 H H . ASN A 1 317 ? 37.101 36.414 31.127 1.00 52.72 ? 346 ASN A H 1 ATOM 4637 H HA . ASN A 1 317 ? 38.679 36.489 29.032 1.00 53.95 ? 346 ASN A HA 1 ATOM 4638 H HB2 . ASN A 1 317 ? 36.343 38.007 29.511 1.00 54.51 ? 346 ASN A HB2 1 ATOM 4639 H HB3 . ASN A 1 317 ? 37.061 37.904 28.097 1.00 54.51 ? 346 ASN A HB3 1 ATOM 4640 H HD21 . ASN A 1 317 ? 34.211 35.638 28.640 1.00 55.10 ? 346 ASN A HD21 1 ATOM 4641 H HD22 . ASN A 1 317 ? 34.394 37.032 29.132 1.00 55.10 ? 346 ASN A HD22 1 ATOM 4642 N N . VAL A 1 318 ? 38.654 39.109 30.861 1.00 43.69 ? 347 VAL A N 1 ATOM 4643 C CA . VAL A 1 318 ? 39.419 40.291 31.246 1.00 43.61 ? 347 VAL A CA 1 ATOM 4644 C C . VAL A 1 318 ? 40.753 39.870 31.856 1.00 41.62 ? 347 VAL A C 1 ATOM 4645 O O . VAL A 1 318 ? 41.763 40.561 31.712 1.00 41.26 ? 347 VAL A O 1 ATOM 4646 C CB . VAL A 1 318 ? 38.641 41.160 32.254 1.00 44.25 ? 347 VAL A CB 1 ATOM 4647 C CG1 . VAL A 1 318 ? 39.456 42.380 32.667 1.00 45.50 ? 347 VAL A CG1 1 ATOM 4648 C CG2 . VAL A 1 318 ? 37.306 41.591 31.664 1.00 44.14 ? 347 VAL A CG2 1 ATOM 4649 H H . VAL A 1 318 ? 37.956 38.973 31.345 1.00 52.43 ? 347 VAL A H 1 ATOM 4650 H HA . VAL A 1 318 ? 39.600 40.826 30.458 1.00 52.33 ? 347 VAL A HA 1 ATOM 4651 H HB . VAL A 1 318 ? 38.462 40.636 33.051 1.00 53.10 ? 347 VAL A HB 1 ATOM 4652 H HG11 . VAL A 1 318 ? 38.940 42.904 33.300 1.00 54.60 ? 347 VAL A HG11 1 ATOM 4653 H HG12 . VAL A 1 318 ? 40.282 42.083 33.079 1.00 54.60 ? 347 VAL A HG12 1 ATOM 4654 H HG13 . VAL A 1 318 ? 39.651 42.910 31.879 1.00 54.60 ? 347 VAL A HG13 1 ATOM 4655 H HG21 . VAL A 1 318 ? 36.835 42.136 32.314 1.00 52.97 ? 347 VAL A HG21 1 ATOM 4656 H HG22 . VAL A 1 318 ? 37.469 42.105 30.858 1.00 52.97 ? 347 VAL A HG22 1 ATOM 4657 H HG23 . VAL A 1 318 ? 36.785 40.801 31.454 1.00 52.97 ? 347 VAL A HG23 1 ATOM 4658 N N . TRP A 1 319 ? 40.741 38.730 32.541 1.00 40.32 ? 348 TRP A N 1 ATOM 4659 C CA . TRP A 1 319 ? 41.938 38.189 33.170 1.00 38.83 ? 348 TRP A CA 1 ATOM 4660 C C . TRP A 1 319 ? 43.021 37.930 32.128 1.00 39.78 ? 348 TRP A C 1 ATOM 4661 O O . TRP A 1 319 ? 44.136 38.443 32.239 1.00 38.22 ? 348 TRP A O 1 ATOM 4662 C CB . TRP A 1 319 ? 41.594 36.902 33.925 1.00 38.86 ? 348 TRP A CB 1 ATOM 4663 C CG . TRP A 1 319 ? 42.759 36.221 34.572 1.00 39.94 ? 348 TRP A CG 1 ATOM 4664 C CD1 . TRP A 1 319 ? 43.291 35.010 34.232 1.00 41.40 ? 348 TRP A CD1 1 ATOM 4665 C CD2 . TRP A 1 319 ? 43.533 36.702 35.678 1.00 39.91 ? 348 TRP A CD2 1 ATOM 4666 N NE1 . TRP A 1 319 ? 44.347 34.710 35.057 1.00 41.65 ? 348 TRP A NE1 1 ATOM 4667 C CE2 . TRP A 1 319 ? 44.517 35.732 35.952 1.00 40.38 ? 348 TRP A CE2 1 ATOM 4668 C CE3 . TRP A 1 319 ? 43.491 37.859 36.461 1.00 39.45 ? 348 TRP A CE3 1 ATOM 4669 C CZ2 . TRP A 1 319 ? 45.451 35.883 36.975 1.00 39.32 ? 348 TRP A CZ2 1 ATOM 4670 C CZ3 . TRP A 1 319 ? 44.420 38.007 37.476 1.00 38.74 ? 348 TRP A CZ3 1 ATOM 4671 C CH2 . TRP A 1 319 ? 45.386 37.024 37.724 1.00 38.54 ? 348 TRP A CH2 1 ATOM 4672 H H . TRP A 1 319 ? 40.040 38.246 32.656 1.00 48.38 ? 348 TRP A H 1 ATOM 4673 H HA . TRP A 1 319 ? 42.281 38.833 33.809 1.00 46.60 ? 348 TRP A HA 1 ATOM 4674 H HB2 . TRP A 1 319 ? 40.955 37.115 34.623 1.00 46.64 ? 348 TRP A HB2 1 ATOM 4675 H HB3 . TRP A 1 319 ? 41.197 36.275 33.301 1.00 46.64 ? 348 TRP A HB3 1 ATOM 4676 H HD1 . TRP A 1 319 ? 42.981 34.467 33.544 1.00 49.68 ? 348 TRP A HD1 1 ATOM 4677 H HE1 . TRP A 1 319 ? 44.825 33.996 35.017 1.00 49.98 ? 348 TRP A HE1 1 ATOM 4678 H HE3 . TRP A 1 319 ? 42.852 38.516 36.303 1.00 47.34 ? 348 TRP A HE3 1 ATOM 4679 H HZ2 . TRP A 1 319 ? 46.094 35.232 37.141 1.00 47.18 ? 348 TRP A HZ2 1 ATOM 4680 H HZ3 . TRP A 1 319 ? 44.401 38.773 38.004 1.00 46.49 ? 348 TRP A HZ3 1 ATOM 4681 H HH2 . TRP A 1 319 ? 45.997 37.151 38.413 1.00 46.25 ? 348 TRP A HH2 1 ATOM 4682 N N . GLU A 1 320 ? 42.680 37.148 31.108 1.00 39.58 ? 349 GLU A N 1 ATOM 4683 C CA . GLU A 1 320 ? 43.621 36.826 30.040 1.00 41.97 ? 349 GLU A CA 1 ATOM 4684 C C . GLU A 1 320 ? 44.007 38.071 29.248 1.00 42.68 ? 349 GLU A C 1 ATOM 4685 O O . GLU A 1 320 ? 45.111 38.157 28.714 1.00 39.03 ? 349 GLU A O 1 ATOM 4686 C CB . GLU A 1 320 ? 43.023 35.774 29.102 1.00 39.07 ? 349 GLU A CB 1 ATOM 4687 H H . GLU A 1 320 ? 41.905 36.788 31.011 1.00 47.50 ? 349 GLU A H 1 ATOM 4688 H HA . GLU A 1 320 ? 44.428 36.456 30.430 1.00 50.36 ? 349 GLU A HA 1 ATOM 4689 N N . ALA A 1 321 ? 43.094 39.034 29.177 1.00 58.93 ? 350 ALA A N 1 ATOM 4690 C CA . ALA A 1 321 ? 43.326 40.259 28.419 1.00 61.17 ? 350 ALA A CA 1 ATOM 4691 C C . ALA A 1 321 ? 44.397 41.127 29.077 1.00 59.71 ? 350 ALA A C 1 ATOM 4692 O O . ALA A 1 321 ? 45.116 41.860 28.398 1.00 61.00 ? 350 ALA A O 1 ATOM 4693 C CB . ALA A 1 321 ? 42.029 41.040 28.274 1.00 61.51 ? 350 ALA A CB 1 ATOM 4694 H H . ALA A 1 321 ? 42.326 39.002 29.563 1.00 70.72 ? 350 ALA A H 1 ATOM 4695 H HA . ALA A 1 321 ? 43.636 40.025 27.530 1.00 73.40 ? 350 ALA A HA 1 ATOM 4696 H HB1 . ALA A 1 321 ? 42.203 41.849 27.768 1.00 73.82 ? 350 ALA A HB1 1 ATOM 4697 H HB2 . ALA A 1 321 ? 41.381 40.491 27.806 1.00 73.82 ? 350 ALA A HB2 1 ATOM 4698 H HB3 . ALA A 1 321 ? 41.696 41.266 29.156 1.00 73.82 ? 350 ALA A HB3 1 ATOM 4699 N N . SER A 1 322 ? 44.492 41.042 30.400 1.00 39.82 ? 351 SER A N 1 ATOM 4700 C CA . SER A 1 322 ? 45.475 41.815 31.154 1.00 40.58 ? 351 SER A CA 1 ATOM 4701 C C . SER A 1 322 ? 46.844 41.143 31.154 1.00 40.45 ? 351 SER A C 1 ATOM 4702 O O . SER A 1 322 ? 47.814 41.703 31.664 1.00 39.62 ? 351 SER A O 1 ATOM 4703 C CB . SER A 1 322 ? 45.001 42.014 32.594 1.00 39.73 ? 351 SER A CB 1 ATOM 4704 O OG . SER A 1 322 ? 44.918 40.774 33.277 1.00 38.16 ? 351 SER A OG 1 ATOM 4705 H H . SER A 1 322 ? 43.995 40.539 30.889 1.00 47.78 ? 351 SER A H 1 ATOM 4706 H HA . SER A 1 322 ? 45.569 42.690 30.746 1.00 48.70 ? 351 SER A HA 1 ATOM 4707 H HB2 . SER A 1 322 ? 45.632 42.587 33.057 1.00 47.68 ? 351 SER A HB2 1 ATOM 4708 H HB3 . SER A 1 322 ? 44.124 42.427 32.583 1.00 47.68 ? 351 SER A HB3 1 ATOM 4709 H HG . SER A 1 322 ? 44.375 40.266 32.886 1.00 45.79 ? 351 SER A HG 1 ATOM 4710 N N . GLY A 1 323 ? 46.918 39.945 30.581 1.00 36.27 ? 352 GLY A N 1 ATOM 4711 C CA . GLY A 1 323 ? 48.137 39.159 30.608 1.00 37.06 ? 352 GLY A CA 1 ATOM 4712 C C . GLY A 1 323 ? 48.250 38.367 31.896 1.00 81.37 ? 352 GLY A C 1 ATOM 4713 O O . GLY A 1 323 ? 49.338 38.234 32.458 1.00 36.23 ? 352 GLY A O 1 ATOM 4714 H H . GLY A 1 323 ? 46.266 39.566 30.168 1.00 43.52 ? 352 GLY A H 1 ATOM 4715 H HA2 . GLY A 1 323 ? 48.144 38.541 29.861 1.00 44.47 ? 352 GLY A HA2 1 ATOM 4716 H HA3 . GLY A 1 323 ? 48.906 39.745 30.534 1.00 44.47 ? 352 GLY A HA3 1 ATOM 4717 N N . ASN A 1 324 ? 47.118 37.844 32.363 1.00 50.05 ? 353 ASN A N 1 ATOM 4718 C CA . ASN A 1 324 ? 47.070 37.040 33.583 1.00 48.46 ? 353 ASN A CA 1 ATOM 4719 C C . ASN A 1 324 ? 47.530 37.849 34.808 1.00 46.30 ? 353 ASN A C 1 ATOM 4720 O O . ASN A 1 324 ? 48.009 37.287 35.794 1.00 46.60 ? 353 ASN A O 1 ATOM 4721 C CB . ASN A 1 324 ? 47.921 35.766 33.411 1.00 50.43 ? 353 ASN A CB 1 ATOM 4722 C CG . ASN A 1 324 ? 47.080 34.494 33.292 1.00 52.19 ? 353 ASN A CG 1 ATOM 4723 O OD1 . ASN A 1 324 ? 45.992 34.499 32.717 1.00 51.70 ? 353 ASN A OD1 1 ATOM 4724 N ND2 . ASN A 1 324 ? 47.609 33.392 33.840 1.00 53.88 ? 353 ASN A ND2 1 ATOM 4725 H H . ASN A 1 324 ? 46.352 37.943 31.985 1.00 60.06 ? 353 ASN A H 1 ATOM 4726 H HA . ASN A 1 324 ? 46.153 36.765 33.738 1.00 58.15 ? 353 ASN A HA 1 ATOM 4727 H HB2 . ASN A 1 324 ? 48.453 35.849 32.605 1.00 60.52 ? 353 ASN A HB2 1 ATOM 4728 H HB3 . ASN A 1 324 ? 48.502 35.669 34.182 1.00 60.52 ? 353 ASN A HB3 1 ATOM 4729 H HD21 . ASN A 1 324 ? 48.375 33.489 34.220 1.00 64.65 ? 353 ASN A HD21 1 ATOM 4730 N N . ARG A 1 325 ? 47.368 39.170 34.739 1.00 98.31 ? 354 ARG A N 1 ATOM 4731 C CA . ARG A 1 325 ? 47.767 40.063 35.830 1.00 32.16 ? 354 ARG A CA 1 ATOM 4732 C C . ARG A 1 325 ? 46.585 40.542 36.677 1.00 30.98 ? 354 ARG A C 1 ATOM 4733 O O . ARG A 1 325 ? 46.699 40.672 37.896 1.00 30.24 ? 354 ARG A O 1 ATOM 4734 C CB . ARG A 1 325 ? 48.509 41.279 35.273 1.00 32.65 ? 354 ARG A CB 1 ATOM 4735 C CG . ARG A 1 325 ? 49.935 40.989 34.838 1.00 33.81 ? 354 ARG A CG 1 ATOM 4736 C CD . ARG A 1 325 ? 50.597 42.229 34.260 1.00 34.35 ? 354 ARG A CD 1 ATOM 4737 N NE . ARG A 1 325 ? 49.992 42.635 32.995 1.00 34.87 ? 354 ARG A NE 1 ATOM 4738 C CZ . ARG A 1 325 ? 50.419 43.651 32.251 1.00 35.47 ? 354 ARG A CZ 1 ATOM 4739 N NH1 . ARG A 1 325 ? 51.461 44.373 32.639 1.00 38.81 ? 354 ARG A NH1 1 ATOM 4740 N NH2 . ARG A 1 325 ? 49.804 43.946 31.114 1.00 35.99 ? 354 ARG A NH2 1 ATOM 4741 H H . ARG A 1 325 ? 47.026 39.579 34.064 1.00 117.97 ? 354 ARG A H 1 ATOM 4742 H HA . ARG A 1 325 ? 48.376 39.587 36.415 1.00 38.59 ? 354 ARG A HA 1 ATOM 4743 H HB2 . ARG A 1 325 ? 48.026 41.612 34.501 1.00 39.18 ? 354 ARG A HB2 1 ATOM 4744 H HB3 . ARG A 1 325 ? 48.543 41.964 35.959 1.00 39.18 ? 354 ARG A HB3 1 ATOM 4745 H HG2 . ARG A 1 325 ? 50.452 40.697 35.605 1.00 40.57 ? 354 ARG A HG2 1 ATOM 4746 H HG3 . ARG A 1 325 ? 49.929 40.301 34.155 1.00 40.57 ? 354 ARG A HG3 1 ATOM 4747 H HD2 . ARG A 1 325 ? 50.504 42.962 34.888 1.00 41.22 ? 354 ARG A HD2 1 ATOM 4748 H HD3 . ARG A 1 325 ? 51.536 42.044 34.100 1.00 41.22 ? 354 ARG A HD3 1 ATOM 4749 H HE . ARG A 1 325 ? 49.315 42.187 32.712 1.00 41.84 ? 354 ARG A HE 1 ATOM 4750 H HH11 . ARG A 1 325 ? 51.863 44.186 33.376 1.00 46.57 ? 354 ARG A HH11 1 ATOM 4751 H HH12 . ARG A 1 325 ? 51.734 45.029 32.155 1.00 46.57 ? 354 ARG A HH12 1 ATOM 4752 H HH21 . ARG A 1 325 ? 49.128 43.480 30.858 1.00 43.19 ? 354 ARG A HH21 1 ATOM 4753 H HH22 . ARG A 1 325 ? 50.081 44.603 30.633 1.00 43.19 ? 354 ARG A HH22 1 ATOM 4754 N N . SER A 1 326 ? 45.454 40.806 36.029 1.00 35.64 ? 355 SER A N 1 ATOM 4755 C CA . SER A 1 326 ? 44.270 41.311 36.719 1.00 34.77 ? 355 SER A CA 1 ATOM 4756 C C . SER A 1 326 ? 43.013 41.039 35.903 1.00 35.11 ? 355 SER A C 1 ATOM 4757 O O . SER A 1 326 ? 43.041 41.097 34.675 1.00 35.99 ? 355 SER A O 1 ATOM 4758 C CB . SER A 1 326 ? 44.408 42.810 36.988 1.00 34.41 ? 355 SER A CB 1 ATOM 4759 O OG . SER A 1 326 ? 43.178 43.367 37.419 1.00 33.85 ? 355 SER A OG 1 ATOM 4760 H H . SER A 1 326 ? 45.345 40.699 35.182 1.00 42.77 ? 355 SER A H 1 ATOM 4761 H HA . SER A 1 326 ? 44.181 40.857 37.572 1.00 41.72 ? 355 SER A HA 1 ATOM 4762 H HB2 . SER A 1 326 ? 45.074 42.945 37.680 1.00 41.30 ? 355 SER A HB2 1 ATOM 4763 H HB3 . SER A 1 326 ? 44.685 43.253 36.171 1.00 41.30 ? 355 SER A HB3 1 ATOM 4764 H HG . SER A 1 326 ? 42.926 42.993 38.128 1.00 40.62 ? 355 SER A HG 1 ATOM 4765 N N . GLY A 1 327 ? 41.912 40.747 36.591 1.00 32.17 ? 356 GLY A N 1 ATOM 4766 C CA . GLY A 1 327 ? 40.674 40.378 35.926 1.00 34.99 ? 356 GLY A CA 1 ATOM 4767 C C . GLY A 1 327 ? 39.422 40.766 36.691 1.00 37.02 ? 356 GLY A C 1 ATOM 4768 O O . GLY A 1 327 ? 38.322 40.328 36.353 1.00 36.90 ? 356 GLY A O 1 ATOM 4769 H H . GLY A 1 327 ? 41.860 40.757 37.449 1.00 38.61 ? 356 GLY A H 1 ATOM 4770 H HA2 . GLY A 1 327 ? 40.641 40.806 35.056 1.00 41.99 ? 356 GLY A HA2 1 ATOM 4771 H HA3 . GLY A 1 327 ? 40.660 39.418 35.792 1.00 41.99 ? 356 GLY A HA3 1 ATOM 4772 N N . GLY A 1 328 ? 39.582 41.586 37.724 1.00 29.95 ? 357 GLY A N 1 ATOM 4773 C CA . GLY A 1 328 ? 38.448 42.052 38.500 1.00 29.57 ? 357 GLY A CA 1 ATOM 4774 C C . GLY A 1 328 ? 37.565 42.999 37.710 1.00 30.06 ? 357 GLY A C 1 ATOM 4775 O O . GLY A 1 328 ? 38.032 43.674 36.792 1.00 32.36 ? 357 GLY A O 1 ATOM 4776 H H . GLY A 1 328 ? 40.341 41.887 37.995 1.00 35.94 ? 357 GLY A H 1 ATOM 4777 H HA2 . GLY A 1 328 ? 37.913 41.292 38.780 1.00 35.49 ? 357 GLY A HA2 1 ATOM 4778 H HA3 . GLY A 1 328 ? 38.765 42.514 39.292 1.00 35.49 ? 357 GLY A HA3 1 ATOM 4779 N N . VAL A 1 329 ? 36.285 43.043 38.068 1.00 29.21 ? 358 VAL A N 1 ATOM 4780 C CA . VAL A 1 329 ? 35.337 43.973 37.461 1.00 29.76 ? 358 VAL A CA 1 ATOM 4781 C C . VAL A 1 329 ? 34.349 44.451 38.520 1.00 29.54 ? 358 VAL A C 1 ATOM 4782 O O . VAL A 1 329 ? 33.618 43.652 39.107 1.00 29.58 ? 358 VAL A O 1 ATOM 4783 C CB . VAL A 1 329 ? 34.563 43.332 36.290 1.00 30.76 ? 358 VAL A CB 1 ATOM 4784 C CG1 . VAL A 1 329 ? 33.589 44.331 35.677 1.00 31.44 ? 358 VAL A CG1 1 ATOM 4785 C CG2 . VAL A 1 329 ? 35.525 42.818 35.229 1.00 32.14 ? 358 VAL A CG2 1 ATOM 4786 H H . VAL A 1 329 ? 35.936 42.537 38.669 1.00 35.06 ? 358 VAL A H 1 ATOM 4787 H HA . VAL A 1 329 ? 35.817 44.745 37.122 1.00 35.71 ? 358 VAL A HA 1 ATOM 4788 H HB . VAL A 1 329 ? 34.051 42.578 36.623 1.00 36.91 ? 358 VAL A HB 1 ATOM 4789 H HG11 . VAL A 1 329 ? 33.117 43.904 34.946 1.00 37.73 ? 358 VAL A HG11 1 ATOM 4790 H HG12 . VAL A 1 329 ? 32.958 44.615 36.358 1.00 37.73 ? 358 VAL A HG12 1 ATOM 4791 H HG13 . VAL A 1 329 ? 34.087 45.096 35.348 1.00 37.73 ? 358 VAL A HG13 1 ATOM 4792 H HG21 . VAL A 1 329 ? 35.014 42.420 34.506 1.00 38.56 ? 358 VAL A HG21 1 ATOM 4793 H HG22 . VAL A 1 329 ? 36.050 43.561 34.893 1.00 38.56 ? 358 VAL A HG22 1 ATOM 4794 H HG23 . VAL A 1 329 ? 36.108 42.153 35.627 1.00 38.56 ? 358 VAL A HG23 1 ATOM 4795 N N . CYS A 1 330 ? 34.330 45.759 38.753 1.00 30.47 ? 359 CYS A N 1 ATOM 4796 C CA . CYS A 1 330 ? 33.502 46.338 39.803 1.00 33.74 ? 359 CYS A CA 1 ATOM 4797 C C . CYS A 1 330 ? 32.016 46.185 39.503 1.00 34.33 ? 359 CYS A C 1 ATOM 4798 O O . CYS A 1 330 ? 31.581 46.350 38.362 1.00 34.82 ? 359 CYS A O 1 ATOM 4799 C CB . CYS A 1 330 ? 33.845 47.816 39.990 1.00 37.53 ? 359 CYS A CB 1 ATOM 4800 S SG . CYS A 1 330 ? 35.601 48.127 40.254 1.00 28.49 ? 359 CYS A SG 1 ATOM 4801 H H . CYS A 1 330 ? 34.791 46.336 38.313 1.00 36.57 ? 359 CYS A H 1 ATOM 4802 H HA . CYS A 1 330 ? 33.687 45.880 40.638 1.00 40.48 ? 359 CYS A HA 1 ATOM 4803 H HB2 . CYS A 1 330 ? 33.574 48.302 39.195 1.00 45.03 ? 359 CYS A HB2 1 ATOM 4804 H HB3 . CYS A 1 330 ? 33.364 48.153 40.762 1.00 45.03 ? 359 CYS A HB3 1 ATOM 4805 N N . ASN A 1 331 ? 31.246 45.868 40.540 1.00 40.62 ? 360 ASN A N 1 ATOM 4806 C CA . ASN A 1 331 ? 29.798 45.736 40.426 1.00 42.85 ? 360 ASN A CA 1 ATOM 4807 C C . ASN A 1 331 ? 29.080 46.952 41.000 1.00 42.08 ? 360 ASN A C 1 ATOM 4808 O O . ASN A 1 331 ? 29.453 47.460 42.060 1.00 38.69 ? 360 ASN A O 1 ATOM 4809 C CB . ASN A 1 331 ? 29.320 44.469 41.141 1.00 44.72 ? 360 ASN A CB 1 ATOM 4810 C CG . ASN A 1 331 ? 29.824 43.198 40.483 1.00 46.05 ? 360 ASN A CG 1 ATOM 4811 O OD1 . ASN A 1 331 ? 29.941 43.120 39.259 1.00 46.67 ? 360 ASN A OD1 1 ATOM 4812 N ND2 . ASN A 1 331 ? 30.126 42.193 41.296 1.00 46.36 ? 360 ASN A ND2 1 ATOM 4813 H H . ASN A 1 331 ? 31.544 45.722 41.333 1.00 48.75 ? 360 ASN A H 1 ATOM 4814 H HA . ASN A 1 331 ? 29.560 45.661 39.489 1.00 51.42 ? 360 ASN A HA 1 ATOM 4815 H HB2 . ASN A 1 331 ? 29.642 44.482 42.056 1.00 53.67 ? 360 ASN A HB2 1 ATOM 4816 H HB3 . ASN A 1 331 ? 28.350 44.448 41.131 1.00 53.67 ? 360 ASN A HB3 1 ATOM 4817 H HD21 . ASN A 1 331 ? 30.416 41.451 40.973 1.00 55.64 ? 360 ASN A HD21 1 ATOM 4818 H HD22 . ASN A 1 331 ? 30.031 42.284 42.146 1.00 55.64 ? 360 ASN A HD22 1 ATOM 4819 N N . ASN A 1 332 ? 28.051 47.409 40.291 1.00 68.74 ? 361 ASN A N 1 ATOM 4820 C CA . ASN A 1 332 ? 27.197 48.495 40.763 1.00 71.03 ? 361 ASN A CA 1 ATOM 4821 C C . ASN A 1 332 ? 27.985 49.747 41.130 1.00 69.57 ? 361 ASN A C 1 ATOM 4822 O O . ASN A 1 332 ? 28.081 50.107 42.303 1.00 71.17 ? 361 ASN A O 1 ATOM 4823 C CB . ASN A 1 332 ? 26.378 48.031 41.969 1.00 72.07 ? 361 ASN A CB 1 ATOM 4824 C CG . ASN A 1 332 ? 25.587 46.769 41.684 1.00 73.70 ? 361 ASN A CG 1 ATOM 4825 O OD1 . ASN A 1 332 ? 25.122 46.552 40.565 1.00 74.85 ? 361 ASN A OD1 1 ATOM 4826 N ND2 . ASN A 1 332 ? 25.434 45.927 42.699 1.00 74.07 ? 361 ASN A ND2 1 ATOM 4827 H H . ASN A 1 332 ? 27.824 47.101 39.521 1.00 82.48 ? 361 ASN A H 1 ATOM 4828 H HA . ASN A 1 332 ? 26.576 48.732 40.056 1.00 85.24 ? 361 ASN A HA 1 ATOM 4829 H HB2 . ASN A 1 332 ? 26.979 47.848 42.708 1.00 86.48 ? 361 ASN A HB2 1 ATOM 4830 H HB3 . ASN A 1 332 ? 25.752 48.729 42.214 1.00 86.48 ? 361 ASN A HB3 1 ATOM 4831 H HD21 . ASN A 1 332 ? 24.994 45.197 42.589 1.00 88.88 ? 361 ASN A HD21 1 ATOM 4832 H HD22 . ASN A 1 332 ? 25.776 46.111 43.467 1.00 88.88 ? 361 ASN A HD22 1 ATOM 4833 N N . CYS A 1 333 ? 28.544 50.408 40.122 1.00 46.95 ? 362 CYS A N 1 ATOM 4834 C CA . CYS A 1 333 ? 29.342 51.607 40.344 1.00 44.16 ? 362 CYS A CA 1 ATOM 4835 C C . CYS A 1 333 ? 28.518 52.713 40.995 1.00 44.92 ? 362 CYS A C 1 ATOM 4836 O O . CYS A 1 333 ? 27.447 53.075 40.507 1.00 45.66 ? 362 CYS A O 1 ATOM 4837 C CB . CYS A 1 333 ? 29.936 52.105 39.026 1.00 43.05 ? 362 CYS A CB 1 ATOM 4838 S SG . CYS A 1 333 ? 31.347 51.143 38.434 1.00 40.48 ? 362 CYS A SG 1 ATOM 4839 H H . CYS A 1 333 ? 28.476 50.181 39.295 1.00 56.34 ? 362 CYS A H 1 ATOM 4840 H HA . CYS A 1 333 ? 30.076 51.391 40.941 1.00 52.99 ? 362 CYS A HA 1 ATOM 4841 H HB2 . CYS A 1 333 ? 29.248 52.071 38.343 1.00 51.67 ? 362 CYS A HB2 1 ATOM 4842 H HB3 . CYS A 1 333 ? 30.233 53.021 39.145 1.00 51.67 ? 362 CYS A HB3 1 ATOM 4843 N N . GLN A 1 334 ? 29.032 53.240 42.102 1.00 47.52 ? 363 GLN A N 1 ATOM 4844 C CA . GLN A 1 334 ? 28.381 54.317 42.837 1.00 49.62 ? 363 GLN A CA 1 ATOM 4845 C C . GLN A 1 334 ? 28.885 55.680 42.381 1.00 48.20 ? 363 GLN A C 1 ATOM 4846 O O . GLN A 1 334 ? 29.815 55.771 41.581 1.00 46.99 ? 363 GLN A O 1 ATOM 4847 C CB . GLN A 1 334 ? 28.624 54.151 44.337 1.00 52.54 ? 363 GLN A CB 1 ATOM 4848 C CG . GLN A 1 334 ? 27.872 52.991 44.963 1.00 55.97 ? 363 GLN A CG 1 ATOM 4849 C CD . GLN A 1 334 ? 26.398 53.285 45.163 1.00 60.25 ? 363 GLN A CD 1 ATOM 4850 O OE1 . GLN A 1 334 ? 25.971 54.440 45.135 1.00 62.25 ? 363 GLN A OE1 1 ATOM 4851 N NE2 . GLN A 1 334 ? 25.610 52.236 45.370 1.00 61.67 ? 363 GLN A NE2 1 ATOM 4852 H H . GLN A 1 334 ? 29.773 52.984 42.454 1.00 57.02 ? 363 GLN A H 1 ATOM 4853 H HA . GLN A 1 334 ? 27.424 54.279 42.679 1.00 59.55 ? 363 GLN A HA 1 ATOM 4854 H HB2 . GLN A 1 334 ? 29.572 54.003 44.484 1.00 63.04 ? 363 GLN A HB2 1 ATOM 4855 H HB3 . GLN A 1 334 ? 28.346 54.963 44.790 1.00 63.04 ? 363 GLN A HB3 1 ATOM 4856 H HG2 . GLN A 1 334 ? 27.947 52.217 44.383 1.00 67.16 ? 363 GLN A HG2 1 ATOM 4857 H HG3 . GLN A 1 334 ? 28.259 52.795 45.830 1.00 67.16 ? 363 GLN A HG3 1 ATOM 4858 H HE21 . GLN A 1 334 ? 25.944 51.444 45.384 1.00 74.00 ? 363 GLN A HE21 1 ATOM 4859 H HE22 . GLN A 1 334 ? 24.766 52.349 45.489 1.00 74.00 ? 363 GLN A HE22 1 ATOM 4860 N N . HIS A 1 335 ? 28.257 56.733 42.896 1.00 47.44 ? 364 HIS A N 1 ATOM 4861 C CA . HIS A 1 335 ? 28.732 58.100 42.696 1.00 47.90 ? 364 HIS A CA 1 ATOM 4862 C C . HIS A 1 335 ? 28.779 58.488 41.221 1.00 49.36 ? 364 HIS A C 1 ATOM 4863 O O . HIS A 1 335 ? 29.655 59.243 40.799 1.00 51.54 ? 364 HIS A O 1 ATOM 4864 C CB . HIS A 1 335 ? 30.117 58.269 43.323 1.00 45.90 ? 364 HIS A CB 1 ATOM 4865 C CG . HIS A 1 335 ? 30.198 57.800 44.743 1.00 44.94 ? 364 HIS A CG 1 ATOM 4866 N ND1 . HIS A 1 335 ? 31.390 57.476 45.355 1.00 43.92 ? 364 HIS A ND1 1 ATOM 4867 C CD2 . HIS A 1 335 ? 29.233 57.605 45.674 1.00 45.42 ? 364 HIS A CD2 1 ATOM 4868 C CE1 . HIS A 1 335 ? 31.156 57.098 46.599 1.00 43.93 ? 364 HIS A CE1 1 ATOM 4869 N NE2 . HIS A 1 335 ? 29.855 57.167 46.818 1.00 44.79 ? 364 HIS A NE2 1 ATOM 4870 H H . HIS A 1 335 ? 27.543 56.682 43.372 1.00 56.93 ? 364 HIS A H 1 ATOM 4871 H HA . HIS A 1 335 ? 28.126 58.710 43.144 1.00 57.49 ? 364 HIS A HA 1 ATOM 4872 H HB2 . HIS A 1 335 ? 30.759 57.758 42.805 1.00 55.09 ? 364 HIS A HB2 1 ATOM 4873 H HB3 . HIS A 1 335 ? 30.355 59.209 43.307 1.00 55.09 ? 364 HIS A HB3 1 ATOM 4874 H HD2 . HIS A 1 335 ? 28.320 57.739 45.559 1.00 54.50 ? 364 HIS A HD2 1 ATOM 4875 H HE1 . HIS A 1 335 ? 31.798 56.830 47.216 1.00 52.72 ? 364 HIS A HE1 1 ATOM 4876 N N . ASN A 1 336 ? 27.837 57.958 40.447 1.00 36.74 ? 365 ASN A N 1 ATOM 4877 C CA . ASN A 1 336 ? 27.688 58.312 39.037 1.00 35.20 ? 365 ASN A CA 1 ATOM 4878 C C . ASN A 1 336 ? 28.920 57.992 38.190 1.00 34.26 ? 365 ASN A C 1 ATOM 4879 O O . ASN A 1 336 ? 29.164 58.643 37.174 1.00 34.45 ? 365 ASN A O 1 ATOM 4880 C CB . ASN A 1 336 ? 27.344 59.800 38.905 1.00 41.67 ? 365 ASN A CB 1 ATOM 4881 C CG . ASN A 1 336 ? 26.053 60.164 39.611 1.00 41.64 ? 365 ASN A CG 1 ATOM 4882 O OD1 . ASN A 1 336 ? 25.056 59.448 39.511 1.00 37.94 ? 365 ASN A OD1 1 ATOM 4883 N ND2 . ASN A 1 336 ? 26.065 61.278 40.335 1.00 37.48 ? 365 ASN A ND2 1 ATOM 4884 H H . ASN A 1 336 ? 27.262 57.380 40.719 1.00 44.08 ? 365 ASN A H 1 ATOM 4885 H HA . ASN A 1 336 ? 26.945 57.808 38.671 1.00 42.23 ? 365 ASN A HA 1 ATOM 4886 H HB2 . ASN A 1 336 ? 28.059 60.326 39.296 1.00 50.01 ? 365 ASN A HB2 1 ATOM 4887 H HB3 . ASN A 1 336 ? 27.245 60.020 37.965 1.00 50.01 ? 365 ASN A HB3 1 ATOM 4888 H HD21 . ASN A 1 336 ? 25.356 61.526 40.754 1.00 44.98 ? 365 ASN A HD21 1 ATOM 4889 H HD22 . ASN A 1 336 ? 26.782 61.751 40.384 1.00 44.98 ? 365 ASN A HD22 1 ATOM 4890 N N . THR A 1 337 ? 29.694 56.995 38.612 1.00 37.49 ? 366 THR A N 1 ATOM 4891 C CA . THR A 1 337 ? 30.819 56.504 37.817 1.00 36.78 ? 366 THR A CA 1 ATOM 4892 C C . THR A 1 337 ? 30.344 55.359 36.919 1.00 37.43 ? 366 THR A C 1 ATOM 4893 O O . THR A 1 337 ? 29.181 54.960 36.999 1.00 37.75 ? 366 THR A O 1 ATOM 4894 C CB . THR A 1 337 ? 31.984 56.044 38.707 1.00 35.30 ? 366 THR A CB 1 ATOM 4895 O OG1 . THR A 1 337 ? 31.501 55.150 39.717 1.00 35.17 ? 366 THR A OG1 1 ATOM 4896 C CG2 . THR A 1 337 ? 32.640 57.245 39.372 1.00 35.03 ? 366 THR A CG2 1 ATOM 4897 H H . THR A 1 337 ? 29.588 56.583 39.359 1.00 44.99 ? 366 THR A H 1 ATOM 4898 H HA . THR A 1 337 ? 31.141 57.220 37.247 1.00 44.14 ? 366 THR A HA 1 ATOM 4899 H HB . THR A 1 337 ? 32.648 55.591 38.164 1.00 42.36 ? 366 THR A HB 1 ATOM 4900 H HG1 . THR A 1 337 ? 30.928 55.537 40.193 1.00 42.20 ? 366 THR A HG1 1 ATOM 4901 H HG21 . THR A 1 337 ? 33.375 56.952 39.933 1.00 42.04 ? 366 THR A HG21 1 ATOM 4902 H HG22 . THR A 1 337 ? 32.982 57.852 38.696 1.00 42.04 ? 366 THR A HG22 1 ATOM 4903 H HG23 . THR A 1 337 ? 31.993 57.715 39.920 1.00 42.04 ? 366 THR A HG23 1 ATOM 4904 N N . GLU A 1 338 ? 31.229 54.826 36.075 1.00 43.96 ? 367 GLU A N 1 ATOM 4905 C CA . GLU A 1 338 ? 30.792 53.928 35.004 1.00 46.20 ? 367 GLU A CA 1 ATOM 4906 C C . GLU A 1 338 ? 31.779 52.827 34.608 1.00 46.56 ? 367 GLU A C 1 ATOM 4907 O O . GLU A 1 338 ? 31.365 51.731 34.228 1.00 46.61 ? 367 GLU A O 1 ATOM 4908 C CB . GLU A 1 338 ? 30.475 54.754 33.757 1.00 47.80 ? 367 GLU A CB 1 ATOM 4909 C CG . GLU A 1 338 ? 29.618 54.033 32.735 1.00 49.33 ? 367 GLU A CG 1 ATOM 4910 C CD . GLU A 1 338 ? 29.311 54.892 31.527 1.00 50.77 ? 367 GLU A CD 1 ATOM 4911 O OE1 . GLU A 1 338 ? 30.232 55.582 31.039 1.00 50.38 ? 367 GLU A OE1 1 ATOM 4912 O OE2 . GLU A 1 338 ? 28.150 54.881 31.068 1.00 52.46 ? 367 GLU A OE2 1 ATOM 4913 H H . GLU A 1 338 ? 32.077 54.967 36.100 1.00 52.75 ? 367 GLU A H 1 ATOM 4914 H HA . GLU A 1 338 ? 29.971 53.494 35.284 1.00 55.44 ? 367 GLU A HA 1 ATOM 4915 H HB2 . GLU A 1 338 ? 30.000 55.556 34.028 1.00 57.36 ? 367 GLU A HB2 1 ATOM 4916 H HB3 . GLU A 1 338 ? 31.308 54.998 33.325 1.00 57.36 ? 367 GLU A HB3 1 ATOM 4917 H HG2 . GLU A 1 338 ? 30.087 53.241 32.430 1.00 59.20 ? 367 GLU A HG2 1 ATOM 4918 H HG3 . GLU A 1 338 ? 28.776 53.783 33.147 1.00 59.20 ? 367 GLU A HG3 1 ATOM 4919 N N . GLY A 1 339 ? 33.072 53.119 34.680 1.00 48.90 ? 368 GLY A N 1 ATOM 4920 C CA . GLY A 1 339 ? 34.081 52.233 34.122 1.00 49.39 ? 368 GLY A CA 1 ATOM 4921 C C . GLY A 1 339 ? 34.149 50.836 34.717 1.00 49.10 ? 368 GLY A C 1 ATOM 4922 O O . GLY A 1 339 ? 33.483 50.530 35.708 1.00 48.10 ? 368 GLY A O 1 ATOM 4923 H H . GLY A 1 339 ? 33.391 53.827 35.049 1.00 58.68 ? 368 GLY A H 1 ATOM 4924 H HA2 . GLY A 1 339 ? 33.920 52.140 33.170 1.00 59.26 ? 368 GLY A HA2 1 ATOM 4925 H HA3 . GLY A 1 339 ? 34.952 52.644 34.237 1.00 59.26 ? 368 GLY A HA3 1 ATOM 4926 N N . GLN A 1 340 ? 34.959 49.985 34.093 1.00 46.45 ? 369 GLN A N 1 ATOM 4927 C CA . GLN A 1 340 ? 35.246 48.652 34.613 1.00 46.42 ? 369 GLN A CA 1 ATOM 4928 C C . GLN A 1 340 ? 35.815 48.759 36.023 1.00 45.63 ? 369 GLN A C 1 ATOM 4929 O O . GLN A 1 340 ? 35.520 47.940 36.893 1.00 45.41 ? 369 GLN A O 1 ATOM 4930 C CB . GLN A 1 340 ? 36.231 47.924 33.693 1.00 46.92 ? 369 GLN A CB 1 ATOM 4931 C CG . GLN A 1 340 ? 36.716 46.569 34.203 1.00 46.34 ? 369 GLN A CG 1 ATOM 4932 C CD . GLN A 1 340 ? 37.913 46.043 33.426 1.00 46.10 ? 369 GLN A CD 1 ATOM 4933 O OE1 . GLN A 1 340 ? 38.741 45.310 33.968 1.00 45.10 ? 369 GLN A OE1 1 ATOM 4934 N NE2 . GLN A 1 340 ? 38.011 46.414 32.153 1.00 46.93 ? 369 GLN A NE2 1 ATOM 4935 H H . GLN A 1 340 ? 35.361 50.160 33.353 1.00 55.74 ? 369 GLN A H 1 ATOM 4936 H HA . GLN A 1 340 ? 34.425 48.137 34.652 1.00 55.70 ? 369 GLN A HA 1 ATOM 4937 H HB2 . GLN A 1 340 ? 35.801 47.776 32.837 1.00 56.30 ? 369 GLN A HB2 1 ATOM 4938 H HB3 . GLN A 1 340 ? 37.012 48.486 33.571 1.00 56.30 ? 369 GLN A HB3 1 ATOM 4939 H HG2 . GLN A 1 340 ? 36.976 46.656 35.133 1.00 55.60 ? 369 GLN A HG2 1 ATOM 4940 H HG3 . GLN A 1 340 ? 35.996 45.924 34.118 1.00 55.60 ? 369 GLN A HG3 1 ATOM 4941 H HE21 . GLN A 1 340 ? 37.413 46.927 31.807 1.00 56.31 ? 369 GLN A HE21 1 ATOM 4942 H HE22 . GLN A 1 340 ? 38.672 46.141 31.675 1.00 56.31 ? 369 GLN A HE22 1 ATOM 4943 N N . HIS A 1 341 ? 36.644 49.778 36.225 1.00 44.03 ? 370 HIS A N 1 ATOM 4944 C CA . HIS A 1 341 ? 37.209 50.085 37.532 1.00 42.15 ? 370 HIS A CA 1 ATOM 4945 C C . HIS A 1 341 ? 36.534 51.325 38.105 1.00 40.68 ? 370 HIS A C 1 ATOM 4946 O O . HIS A 1 341 ? 37.079 51.988 38.987 1.00 41.20 ? 370 HIS A O 1 ATOM 4947 C CB . HIS A 1 341 ? 38.719 50.300 37.421 1.00 42.53 ? 370 HIS A CB 1 ATOM 4948 C CG . HIS A 1 341 ? 39.455 49.120 36.867 1.00 44.02 ? 370 HIS A CG 1 ATOM 4949 N ND1 . HIS A 1 341 ? 40.765 49.191 36.448 1.00 45.02 ? 370 HIS A ND1 1 ATOM 4950 C CD2 . HIS A 1 341 ? 39.062 47.842 36.660 1.00 45.03 ? 370 HIS A CD2 1 ATOM 4951 C CE1 . HIS A 1 341 ? 41.149 48.006 36.008 1.00 46.09 ? 370 HIS A CE1 1 ATOM 4952 N NE2 . HIS A 1 341 ? 40.134 47.169 36.125 1.00 45.91 ? 370 HIS A NE2 1 ATOM 4953 H H . HIS A 1 341 ? 36.899 50.317 35.606 1.00 52.83 ? 370 HIS A H 1 ATOM 4954 H HA . HIS A 1 341 ? 37.049 49.343 38.135 1.00 50.58 ? 370 HIS A HA 1 ATOM 4955 H HB2 . HIS A 1 341 ? 38.885 51.055 36.836 1.00 51.04 ? 370 HIS A HB2 1 ATOM 4956 H HB3 . HIS A 1 341 ? 39.075 50.484 38.304 1.00 51.04 ? 370 HIS A HB3 1 ATOM 4957 H HD2 . HIS A 1 341 ? 38.223 47.485 36.845 1.00 54.03 ? 370 HIS A HD2 1 ATOM 4958 H HE1 . HIS A 1 341 ? 41.991 47.796 35.672 1.00 55.31 ? 370 HIS A HE1 1 ATOM 4959 N N . CYS A 1 342 ? 35.344 51.628 37.593 1.00 36.12 ? 371 CYS A N 1 ATOM 4960 C CA . CYS A 1 342 ? 34.620 52.840 37.962 1.00 35.92 ? 371 CYS A CA 1 ATOM 4961 C C . CYS A 1 342 ? 35.508 54.069 37.790 1.00 36.90 ? 371 CYS A C 1 ATOM 4962 O O . CYS A 1 342 ? 35.513 54.963 38.636 1.00 37.15 ? 371 CYS A O 1 ATOM 4963 C CB . CYS A 1 342 ? 34.111 52.741 39.403 1.00 31.97 ? 371 CYS A CB 1 ATOM 4964 S SG . CYS A 1 342 ? 32.941 51.386 39.674 1.00 32.26 ? 371 CYS A SG 1 ATOM 4965 H H . CYS A 1 342 ? 34.929 51.139 37.020 1.00 43.35 ? 371 CYS A H 1 ATOM 4966 H HA . CYS A 1 342 ? 33.852 52.940 37.378 1.00 43.10 ? 371 CYS A HA 1 ATOM 4967 H HB2 . CYS A 1 342 ? 34.869 52.601 39.992 1.00 38.37 ? 371 CYS A HB2 1 ATOM 4968 H HB3 . CYS A 1 342 ? 33.663 53.570 39.633 1.00 38.37 ? 371 CYS A HB3 1 ATOM 4969 N N . GLN A 1 343 ? 36.257 54.104 36.690 1.00 30.02 ? 372 GLN A N 1 ATOM 4970 C CA . GLN A 1 343 ? 37.281 55.126 36.493 1.00 29.92 ? 372 GLN A CA 1 ATOM 4971 C C . GLN A 1 343 ? 36.802 56.341 35.698 1.00 30.47 ? 372 GLN A C 1 ATOM 4972 O O . GLN A 1 343 ? 37.579 57.266 35.464 1.00 30.46 ? 372 GLN A O 1 ATOM 4973 C CB . GLN A 1 343 ? 38.507 54.523 35.797 1.00 29.86 ? 372 GLN A CB 1 ATOM 4974 C CG . GLN A 1 343 ? 38.304 54.112 34.342 1.00 30.51 ? 372 GLN A CG 1 ATOM 4975 C CD . GLN A 1 343 ? 37.645 52.758 34.190 1.00 30.68 ? 372 GLN A CD 1 ATOM 4976 O OE1 . GLN A 1 343 ? 37.213 52.147 35.168 1.00 66.07 ? 372 GLN A OE1 1 ATOM 4977 N NE2 . GLN A 1 343 ? 37.567 52.278 32.955 1.00 31.38 ? 372 GLN A NE2 1 ATOM 4978 H H . GLN A 1 343 ? 36.190 53.545 36.040 1.00 36.03 ? 372 GLN A H 1 ATOM 4979 H HA . GLN A 1 343 ? 37.568 55.444 37.363 1.00 35.90 ? 372 GLN A HA 1 ATOM 4980 H HB2 . GLN A 1 343 ? 39.223 55.177 35.817 1.00 35.83 ? 372 GLN A HB2 1 ATOM 4981 H HB3 . GLN A 1 343 ? 38.779 53.732 36.287 1.00 35.83 ? 372 GLN A HB3 1 ATOM 4982 H HG2 . GLN A 1 343 ? 37.739 54.769 33.906 1.00 36.61 ? 372 GLN A HG2 1 ATOM 4983 H HG3 . GLN A 1 343 ? 39.167 54.075 33.902 1.00 36.61 ? 372 GLN A HG3 1 ATOM 4984 H HE21 . GLN A 1 343 ? 37.882 52.733 32.297 1.00 37.65 ? 372 GLN A HE21 1 ATOM 4985 H HE22 . GLN A 1 343 ? 37.202 51.513 32.814 1.00 37.65 ? 372 GLN A HE22 1 ATOM 4986 N N . ARG A 1 344 ? 35.538 56.344 35.282 1.00 31.04 ? 373 ARG A N 1 ATOM 4987 C CA . ARG A 1 344 ? 34.996 57.467 34.516 1.00 31.68 ? 373 ARG A CA 1 ATOM 4988 C C . ARG A 1 344 ? 33.588 57.821 34.977 1.00 32.18 ? 373 ARG A C 1 ATOM 4989 O O . ARG A 1 344 ? 32.880 56.990 35.544 1.00 32.22 ? 373 ARG A O 1 ATOM 4990 C CB . ARG A 1 344 ? 34.993 57.147 33.015 1.00 32.31 ? 373 ARG A CB 1 ATOM 4991 C CG . ARG A 1 344 ? 33.666 56.616 32.467 1.00 33.13 ? 373 ARG A CG 1 ATOM 4992 C CD . ARG A 1 344 ? 33.726 56.424 30.965 1.00 39.01 ? 373 ARG A CD 1 ATOM 4993 N NE . ARG A 1 344 ? 34.485 55.237 30.583 1.00 38.68 ? 373 ARG A NE 1 ATOM 4994 C CZ . ARG A 1 344 ? 33.961 54.025 30.422 1.00 38.39 ? 373 ARG A CZ 1 ATOM 4995 N NH1 . ARG A 1 344 ? 32.664 53.817 30.611 1.00 38.82 ? 373 ARG A NH1 1 ATOM 4996 N NH2 . ARG A 1 344 ? 34.740 53.012 30.071 1.00 38.08 ? 373 ARG A NH2 1 ATOM 4997 H H . ARG A 1 344 ? 34.974 55.712 35.429 1.00 37.25 ? 373 ARG A H 1 ATOM 4998 H HA . ARG A 1 344 ? 35.560 58.244 34.655 1.00 38.02 ? 373 ARG A HA 1 ATOM 4999 H HB2 . ARG A 1 344 ? 35.207 57.957 32.527 1.00 38.77 ? 373 ARG A HB2 1 ATOM 5000 H HB3 . ARG A 1 344 ? 35.670 56.475 32.841 1.00 38.77 ? 373 ARG A HB3 1 ATOM 5001 H HG2 . ARG A 1 344 ? 33.470 55.758 32.875 1.00 39.75 ? 373 ARG A HG2 1 ATOM 5002 H HG3 . ARG A 1 344 ? 32.960 57.251 32.664 1.00 39.75 ? 373 ARG A HG3 1 ATOM 5003 H HD2 . ARG A 1 344 ? 32.824 56.328 30.621 1.00 46.82 ? 373 ARG A HD2 1 ATOM 5004 H HD3 . ARG A 1 344 ? 34.155 57.197 30.564 1.00 46.82 ? 373 ARG A HD3 1 ATOM 5005 H HE . ARG A 1 344 ? 35.330 55.327 30.452 1.00 46.41 ? 373 ARG A HE 1 ATOM 5006 H HH11 . ARG A 1 344 ? 32.152 54.470 30.838 1.00 46.59 ? 373 ARG A HH11 1 ATOM 5007 H HH12 . ARG A 1 344 ? 32.334 53.030 30.505 1.00 46.59 ? 373 ARG A HH12 1 ATOM 5008 H HH21 . ARG A 1 344 ? 35.582 53.140 29.948 1.00 45.70 ? 373 ARG A HH21 1 ATOM 5009 H HH22 . ARG A 1 344 ? 34.404 52.227 29.967 1.00 45.70 ? 373 ARG A HH22 1 ATOM 5010 N N . CYS A 1 345 ? 33.192 59.064 34.722 1.00 36.03 ? 374 CYS A N 1 ATOM 5011 C CA . CYS A 1 345 ? 31.849 59.533 35.040 1.00 36.76 ? 374 CYS A CA 1 ATOM 5012 C C . CYS A 1 345 ? 30.865 59.108 33.954 1.00 40.97 ? 374 CYS A C 1 ATOM 5013 O O . CYS A 1 345 ? 31.208 59.102 32.772 1.00 37.97 ? 374 CYS A O 1 ATOM 5014 C CB . CYS A 1 345 ? 31.837 61.057 35.192 1.00 57.68 ? 374 CYS A CB 1 ATOM 5015 S SG . CYS A 1 345 ? 33.077 61.710 36.341 1.00 36.17 ? 374 CYS A SG 1 ATOM 5016 H H . CYS A 1 345 ? 33.690 59.663 34.358 1.00 43.23 ? 374 CYS A H 1 ATOM 5017 H HA . CYS A 1 345 ? 31.563 59.141 35.880 1.00 44.11 ? 374 CYS A HA 1 ATOM 5018 H HB2 . CYS A 1 345 ? 32.003 61.456 34.323 1.00 69.22 ? 374 CYS A HB2 1 ATOM 5019 H HB3 . CYS A 1 345 ? 30.965 61.329 35.515 1.00 69.22 ? 374 CYS A HB3 1 ATOM 5020 N N . LYS A 1 346 ? 29.644 58.760 34.350 1.00 47.53 ? 375 LYS A N 1 ATOM 5021 C CA . LYS A 1 346 ? 28.616 58.385 33.384 1.00 48.77 ? 375 LYS A CA 1 ATOM 5022 C C . LYS A 1 346 ? 28.317 59.544 32.442 1.00 48.85 ? 375 LYS A C 1 ATOM 5023 O O . LYS A 1 346 ? 28.608 60.697 32.764 1.00 49.38 ? 375 LYS A O 1 ATOM 5024 C CB . LYS A 1 346 ? 27.320 57.968 34.084 1.00 50.88 ? 375 LYS A CB 1 ATOM 5025 C CG . LYS A 1 346 ? 27.437 56.779 35.020 1.00 52.04 ? 375 LYS A CG 1 ATOM 5026 C CD . LYS A 1 346 ? 26.090 56.098 35.235 1.00 54.79 ? 375 LYS A CD 1 ATOM 5027 C CE . LYS A 1 346 ? 24.964 57.091 35.512 1.00 57.03 ? 375 LYS A CE 1 ATOM 5028 N NZ . LYS A 1 346 ? 25.274 58.022 36.632 1.00 56.96 ? 375 LYS A NZ 1 ATOM 5029 H H . LYS A 1 346 ? 29.386 58.733 35.170 1.00 57.03 ? 375 LYS A H 1 ATOM 5030 H HA . LYS A 1 346 ? 28.931 57.636 32.855 1.00 58.53 ? 375 LYS A HA 1 ATOM 5031 H HB2 . LYS A 1 346 ? 26.998 58.719 34.607 1.00 61.06 ? 375 LYS A HB2 1 ATOM 5032 H HB3 . LYS A 1 346 ? 26.664 57.741 33.406 1.00 61.06 ? 375 LYS A HB3 1 ATOM 5033 H HG2 . LYS A 1 346 ? 28.048 56.130 34.637 1.00 62.45 ? 375 LYS A HG2 1 ATOM 5034 H HG3 . LYS A 1 346 ? 27.766 57.081 35.881 1.00 62.45 ? 375 LYS A HG3 1 ATOM 5035 H HD2 . LYS A 1 346 ? 25.858 55.597 34.437 1.00 65.74 ? 375 LYS A HD2 1 ATOM 5036 H HD3 . LYS A 1 346 ? 26.156 55.499 35.995 1.00 65.74 ? 375 LYS A HD3 1 ATOM 5037 H HE2 . LYS A 1 346 ? 24.808 57.622 34.716 1.00 68.44 ? 375 LYS A HE2 1 ATOM 5038 H HE3 . LYS A 1 346 ? 24.160 56.599 35.746 1.00 68.44 ? 375 LYS A HE3 1 ATOM 5039 H HZ1 . LYS A 1 346 ? 24.593 58.581 36.759 1.00 68.35 ? 375 LYS A HZ1 1 ATOM 5040 H HZ2 . LYS A 1 346 ? 25.414 57.562 37.381 1.00 68.35 ? 375 LYS A HZ2 1 ATOM 5041 H HZ3 . LYS A 1 346 ? 26.004 58.494 36.442 1.00 68.35 ? 375 LYS A HZ3 1 ATOM 5042 N N . PRO A 1 347 ? 27.735 59.246 31.269 1.00 37.95 ? 376 PRO A N 1 ATOM 5043 C CA . PRO A 1 347 ? 27.210 60.337 30.442 1.00 38.98 ? 376 PRO A CA 1 ATOM 5044 C C . PRO A 1 347 ? 26.151 61.121 31.211 1.00 39.67 ? 376 PRO A C 1 ATOM 5045 O O . PRO A 1 347 ? 25.402 60.529 31.990 1.00 39.95 ? 376 PRO A O 1 ATOM 5046 C CB . PRO A 1 347 ? 26.611 59.612 29.233 1.00 40.14 ? 376 PRO A CB 1 ATOM 5047 C CG . PRO A 1 347 ? 27.346 58.315 29.167 1.00 39.44 ? 376 PRO A CG 1 ATOM 5048 C CD . PRO A 1 347 ? 27.634 57.942 30.593 1.00 38.29 ? 376 PRO A CD 1 ATOM 5049 H HA . PRO A 1 347 ? 27.921 60.930 30.155 1.00 46.77 ? 376 PRO A HA 1 ATOM 5050 H HB2 . PRO A 1 347 ? 25.663 59.463 29.376 1.00 48.17 ? 376 PRO A HB2 1 ATOM 5051 H HB3 . PRO A 1 347 ? 26.761 60.134 28.430 1.00 48.17 ? 376 PRO A HB3 1 ATOM 5052 H HG2 . PRO A 1 347 ? 26.786 57.645 28.745 1.00 47.32 ? 376 PRO A HG2 1 ATOM 5053 H HG3 . PRO A 1 347 ? 28.171 58.434 28.672 1.00 47.32 ? 376 PRO A HG3 1 ATOM 5054 H HD2 . PRO A 1 347 ? 26.901 57.425 30.962 1.00 45.95 ? 376 PRO A HD2 1 ATOM 5055 H HD3 . PRO A 1 347 ? 28.475 57.462 30.654 1.00 45.95 ? 376 PRO A HD3 1 ATOM 5056 N N . GLY A 1 348 ? 26.094 62.430 30.996 1.00 41.88 ? 377 GLY A N 1 ATOM 5057 C CA . GLY A 1 348 ? 25.248 63.298 31.795 1.00 42.54 ? 377 GLY A CA 1 ATOM 5058 C C . GLY A 1 348 ? 25.977 63.795 33.032 1.00 42.01 ? 377 GLY A C 1 ATOM 5059 O O . GLY A 1 348 ? 25.391 64.470 33.878 1.00 41.97 ? 377 GLY A O 1 ATOM 5060 H H . GLY A 1 348 ? 26.541 62.841 30.387 1.00 50.25 ? 377 GLY A H 1 ATOM 5061 H HA2 . GLY A 1 348 ? 24.974 64.065 31.266 1.00 51.05 ? 377 GLY A HA2 1 ATOM 5062 H HA3 . GLY A 1 348 ? 24.455 62.815 32.074 1.00 51.05 ? 377 GLY A HA3 1 ATOM 5063 N N . PHE A 1 349 ? 27.261 63.455 33.130 1.00 45.04 ? 378 PHE A N 1 ATOM 5064 C CA . PHE A 1 349 ? 28.120 63.922 34.215 1.00 45.11 ? 378 PHE A CA 1 ATOM 5065 C C . PHE A 1 349 ? 29.503 64.248 33.664 1.00 45.63 ? 378 PHE A C 1 ATOM 5066 O O . PHE A 1 349 ? 29.778 64.005 32.488 1.00 46.00 ? 378 PHE A O 1 ATOM 5067 C CB . PHE A 1 349 ? 28.228 62.870 35.320 1.00 44.01 ? 378 PHE A CB 1 ATOM 5068 C CG . PHE A 1 349 ? 26.934 62.600 36.030 1.00 44.86 ? 378 PHE A CG 1 ATOM 5069 C CD1 . PHE A 1 349 ? 26.033 61.674 35.531 1.00 45.49 ? 378 PHE A CD1 1 ATOM 5070 C CD2 . PHE A 1 349 ? 26.621 63.270 37.200 1.00 45.46 ? 378 PHE A CD2 1 ATOM 5071 C CE1 . PHE A 1 349 ? 24.842 61.425 36.185 1.00 46.79 ? 378 PHE A CE1 1 ATOM 5072 C CE2 . PHE A 1 349 ? 25.432 63.026 37.858 1.00 46.67 ? 378 PHE A CE2 1 ATOM 5073 C CZ . PHE A 1 349 ? 24.542 62.102 37.350 1.00 47.31 ? 378 PHE A CZ 1 ATOM 5074 H H . PHE A 1 349 ? 27.665 62.944 32.568 1.00 54.04 ? 378 PHE A H 1 ATOM 5075 H HA . PHE A 1 349 ? 27.745 64.730 34.598 1.00 54.14 ? 378 PHE A HA 1 ATOM 5076 H HB2 . PHE A 1 349 ? 28.531 62.036 34.929 1.00 52.81 ? 378 PHE A HB2 1 ATOM 5077 H HB3 . PHE A 1 349 ? 28.870 63.175 35.980 1.00 52.81 ? 378 PHE A HB3 1 ATOM 5078 H HD1 . PHE A 1 349 ? 26.231 61.216 34.747 1.00 54.59 ? 378 PHE A HD1 1 ATOM 5079 H HD2 . PHE A 1 349 ? 27.217 63.894 37.546 1.00 54.55 ? 378 PHE A HD2 1 ATOM 5080 H HE1 . PHE A 1 349 ? 24.244 60.802 35.841 1.00 56.15 ? 378 PHE A HE1 1 ATOM 5081 H HE2 . PHE A 1 349 ? 25.232 63.483 38.643 1.00 56.00 ? 378 PHE A HE2 1 ATOM 5082 H HZ . PHE A 1 349 ? 23.741 61.935 37.792 1.00 56.77 ? 378 PHE A HZ 1 ATOM 5083 N N . TYR A 1 350 ? 30.373 64.794 34.508 1.00 51.74 ? 379 TYR A N 1 ATOM 5084 C CA . TYR A 1 350 ? 31.731 65.113 34.083 1.00 51.58 ? 379 TYR A CA 1 ATOM 5085 C C . TYR A 1 350 ? 32.686 65.245 35.267 1.00 51.77 ? 379 TYR A C 1 ATOM 5086 O O . TYR A 1 350 ? 32.267 65.450 36.407 1.00 51.60 ? 379 TYR A O 1 ATOM 5087 C CB . TYR A 1 350 ? 31.742 66.402 33.255 1.00 51.59 ? 379 TYR A CB 1 ATOM 5088 C CG . TYR A 1 350 ? 31.586 67.673 34.059 1.00 51.43 ? 379 TYR A CG 1 ATOM 5089 C CD1 . TYR A 1 350 ? 30.332 68.125 34.448 1.00 52.06 ? 379 TYR A CD1 1 ATOM 5090 C CD2 . TYR A 1 350 ? 32.694 68.431 34.414 1.00 50.51 ? 379 TYR A CD2 1 ATOM 5091 C CE1 . TYR A 1 350 ? 30.188 69.291 35.178 1.00 51.83 ? 379 TYR A CE1 1 ATOM 5092 C CE2 . TYR A 1 350 ? 32.559 69.596 35.143 1.00 50.57 ? 379 TYR A CE2 1 ATOM 5093 C CZ . TYR A 1 350 ? 31.305 70.022 35.521 1.00 51.28 ? 379 TYR A CZ 1 ATOM 5094 O OH . TYR A 1 350 ? 31.168 71.183 36.244 1.00 51.99 ? 379 TYR A OH 1 ATOM 5095 H H . TYR A 1 350 ? 30.202 64.988 35.329 1.00 62.08 ? 379 TYR A H 1 ATOM 5096 H HA . TYR A 1 350 ? 32.058 64.395 33.519 1.00 61.89 ? 379 TYR A HA 1 ATOM 5097 H HB2 . TYR A 1 350 ? 32.586 66.457 32.780 1.00 61.91 ? 379 TYR A HB2 1 ATOM 5098 H HB3 . TYR A 1 350 ? 31.011 66.366 32.618 1.00 61.91 ? 379 TYR A HB3 1 ATOM 5099 H HD1 . TYR A 1 350 ? 29.577 67.634 34.218 1.00 62.47 ? 379 TYR A HD1 1 ATOM 5100 H HD2 . TYR A 1 350 ? 33.542 68.146 34.161 1.00 60.62 ? 379 TYR A HD2 1 ATOM 5101 H HE1 . TYR A 1 350 ? 29.342 69.580 35.434 1.00 62.20 ? 379 TYR A HE1 1 ATOM 5102 H HE2 . TYR A 1 350 ? 33.311 70.091 35.375 1.00 60.69 ? 379 TYR A HE2 1 ATOM 5103 H HH . TYR A 1 350 ? 31.923 71.525 36.383 1.00 62.38 ? 379 TYR A HH 1 ATOM 5104 N N . ARG A 1 351 ? 33.975 65.120 34.974 1.00 44.13 ? 380 ARG A N 1 ATOM 5105 C CA . ARG A 1 351 ? 35.020 65.142 35.990 1.00 44.45 ? 380 ARG A CA 1 ATOM 5106 C C . ARG A 1 351 ? 35.137 66.507 36.664 1.00 46.56 ? 380 ARG A C 1 ATOM 5107 O O . ARG A 1 351 ? 35.435 67.507 36.011 1.00 48.27 ? 380 ARG A O 1 ATOM 5108 C CB . ARG A 1 351 ? 36.362 64.755 35.357 1.00 42.98 ? 380 ARG A CB 1 ATOM 5109 C CG . ARG A 1 351 ? 37.532 64.668 36.325 1.00 41.55 ? 380 ARG A CG 1 ATOM 5110 C CD . ARG A 1 351 ? 37.500 63.388 37.139 1.00 40.53 ? 380 ARG A CD 1 ATOM 5111 N NE . ARG A 1 351 ? 38.525 63.397 38.178 1.00 39.83 ? 380 ARG A NE 1 ATOM 5112 C CZ . ARG A 1 351 ? 38.372 63.944 39.381 1.00 40.21 ? 380 ARG A CZ 1 ATOM 5113 N NH1 . ARG A 1 351 ? 37.229 64.530 39.716 1.00 40.28 ? 380 ARG A NH1 1 ATOM 5114 N NH2 . ARG A 1 351 ? 39.368 63.906 40.256 1.00 40.62 ? 380 ARG A NH2 1 ATOM 5115 H H . ARG A 1 351 ? 34.277 65.020 34.174 1.00 52.95 ? 380 ARG A H 1 ATOM 5116 H HA . ARG A 1 351 ? 34.810 64.486 36.674 1.00 53.34 ? 380 ARG A HA 1 ATOM 5117 H HB2 . ARG A 1 351 ? 36.266 63.887 34.937 1.00 51.58 ? 380 ARG A HB2 1 ATOM 5118 H HB3 . ARG A 1 351 ? 36.588 65.418 34.686 1.00 51.58 ? 380 ARG A HB3 1 ATOM 5119 H HG2 . ARG A 1 351 ? 38.362 64.687 35.824 1.00 49.86 ? 380 ARG A HG2 1 ATOM 5120 H HG3 . ARG A 1 351 ? 37.495 65.418 36.939 1.00 49.86 ? 380 ARG A HG3 1 ATOM 5121 H HD2 . ARG A 1 351 ? 36.633 63.301 37.566 1.00 48.64 ? 380 ARG A HD2 1 ATOM 5122 H HD3 . ARG A 1 351 ? 37.665 62.632 36.554 1.00 48.64 ? 380 ARG A HD3 1 ATOM 5123 H HE . ARG A 1 351 ? 39.279 63.024 38.000 1.00 47.79 ? 380 ARG A HE 1 ATOM 5124 H HH11 . ARG A 1 351 ? 36.580 64.560 39.153 1.00 48.34 ? 380 ARG A HH11 1 ATOM 5125 H HH12 . ARG A 1 351 ? 37.138 64.880 40.496 1.00 48.34 ? 380 ARG A HH12 1 ATOM 5126 H HH21 . ARG A 1 351 ? 40.111 63.527 40.046 1.00 48.74 ? 380 ARG A HH21 1 ATOM 5127 H HH22 . ARG A 1 351 ? 39.270 64.256 41.035 1.00 48.74 ? 380 ARG A HH22 1 ATOM 5128 N N . ASP A 1 352 ? 34.902 66.540 37.973 1.00 52.66 ? 381 ASP A N 1 ATOM 5129 C CA . ASP A 1 352 ? 35.126 67.744 38.768 1.00 53.25 ? 381 ASP A CA 1 ATOM 5130 C C . ASP A 1 352 ? 36.560 67.747 39.295 1.00 52.93 ? 381 ASP A C 1 ATOM 5131 O O . ASP A 1 352 ? 36.847 67.165 40.340 1.00 53.08 ? 381 ASP A O 1 ATOM 5132 C CB . ASP A 1 352 ? 34.127 67.822 39.925 1.00 53.54 ? 381 ASP A CB 1 ATOM 5133 C CG . ASP A 1 352 ? 34.139 69.171 40.620 1.00 53.63 ? 381 ASP A CG 1 ATOM 5134 O OD1 . ASP A 1 352 ? 35.011 70.005 40.297 1.00 52.77 ? 381 ASP A OD1 1 ATOM 5135 O OD2 . ASP A 1 352 ? 33.276 69.397 41.494 1.00 54.46 ? 381 ASP A OD2 1 ATOM 5136 H H . ASP A 1 352 ? 34.610 65.872 38.429 1.00 63.19 ? 381 ASP A H 1 ATOM 5137 H HA . ASP A 1 352 ? 35.005 68.526 38.207 1.00 63.90 ? 381 ASP A HA 1 ATOM 5138 H HB2 . ASP A 1 352 ? 33.233 67.670 39.581 1.00 64.25 ? 381 ASP A HB2 1 ATOM 5139 H HB3 . ASP A 1 352 ? 34.350 67.144 40.582 1.00 64.25 ? 381 ASP A HB3 1 ATOM 5140 N N . LEU A 1 353 ? 37.455 68.408 38.568 1.00 49.85 ? 382 LEU A N 1 ATOM 5141 C CA . LEU A 1 353 ? 38.878 68.390 38.897 1.00 49.88 ? 382 LEU A CA 1 ATOM 5142 C C . LEU A 1 353 ? 39.181 69.075 40.227 1.00 50.46 ? 382 LEU A C 1 ATOM 5143 O O . LEU A 1 353 ? 40.248 68.874 40.806 1.00 49.24 ? 382 LEU A O 1 ATOM 5144 C CB . LEU A 1 353 ? 39.684 69.052 37.779 1.00 50.62 ? 382 LEU A CB 1 ATOM 5145 C CG . LEU A 1 353 ? 39.573 68.391 36.404 1.00 51.00 ? 382 LEU A CG 1 ATOM 5146 C CD1 . LEU A 1 353 ? 40.293 69.224 35.358 1.00 51.85 ? 382 LEU A CD1 1 ATOM 5147 C CD2 . LEU A 1 353 ? 40.130 66.975 36.432 1.00 50.79 ? 382 LEU A CD2 1 ATOM 5148 H H . LEU A 1 353 ? 37.263 68.878 37.874 1.00 59.81 ? 382 LEU A H 1 ATOM 5149 H HA . LEU A 1 353 ? 39.170 67.467 38.967 1.00 59.86 ? 382 LEU A HA 1 ATOM 5150 H HB2 . LEU A 1 353 ? 39.383 69.969 37.686 1.00 60.74 ? 382 LEU A HB2 1 ATOM 5151 H HB3 . LEU A 1 353 ? 40.621 69.044 38.030 1.00 60.74 ? 382 LEU A HB3 1 ATOM 5152 H HG . LEU A 1 353 ? 38.637 68.339 36.153 1.00 61.20 ? 382 LEU A HG 1 ATOM 5153 H HD11 . LEU A 1 353 ? 40.210 68.788 34.495 1.00 62.22 ? 382 LEU A HD11 1 ATOM 5154 H HD12 . LEU A 1 353 ? 39.888 70.105 35.323 1.00 62.22 ? 382 LEU A HD12 1 ATOM 5155 H HD13 . LEU A 1 353 ? 41.228 69.298 35.603 1.00 62.22 ? 382 LEU A HD13 1 ATOM 5156 H HD21 . LEU A 1 353 ? 40.044 66.585 35.548 1.00 60.94 ? 382 LEU A HD21 1 ATOM 5157 H HD22 . LEU A 1 353 ? 41.064 67.009 36.691 1.00 60.94 ? 382 LEU A HD22 1 ATOM 5158 H HD23 . LEU A 1 353 ? 39.626 66.451 37.075 1.00 60.94 ? 382 LEU A HD23 1 ATOM 5159 N N . ARG A 1 354 ? 38.244 69.886 40.706 1.00 66.28 ? 383 ARG A N 1 ATOM 5160 C CA . ARG A 1 354 ? 38.390 70.542 42.000 1.00 66.07 ? 383 ARG A CA 1 ATOM 5161 C C . ARG A 1 354 ? 38.466 69.510 43.123 1.00 65.38 ? 383 ARG A C 1 ATOM 5162 O O . ARG A 1 354 ? 39.032 69.774 44.184 1.00 65.50 ? 383 ARG A O 1 ATOM 5163 C CB . ARG A 1 354 ? 37.225 71.508 42.237 1.00 65.73 ? 383 ARG A CB 1 ATOM 5164 C CG . ARG A 1 354 ? 37.194 72.144 43.620 1.00 64.68 ? 383 ARG A CG 1 ATOM 5165 C CD . ARG A 1 354 ? 36.099 73.197 43.730 1.00 65.54 ? 383 ARG A CD 1 ATOM 5166 N NE . ARG A 1 354 ? 34.798 72.697 43.281 1.00 65.35 ? 383 ARG A NE 1 ATOM 5167 C CZ . ARG A 1 354 ? 34.314 72.832 42.047 1.00 63.46 ? 383 ARG A CZ 1 ATOM 5168 N NH1 . ARG A 1 354 ? 35.014 73.456 41.107 1.00 62.78 ? 383 ARG A NH1 1 ATOM 5169 N NH2 . ARG A 1 354 ? 33.120 72.337 41.749 1.00 64.05 ? 383 ARG A NH2 1 ATOM 5170 H H . ARG A 1 354 ? 37.510 70.073 40.299 1.00 79.53 ? 383 ARG A H 1 ATOM 5171 H HA . ARG A 1 354 ? 39.213 71.055 42.005 1.00 79.28 ? 383 ARG A HA 1 ATOM 5172 H HB2 . ARG A 1 354 ? 37.280 72.224 41.586 1.00 78.88 ? 383 ARG A HB2 1 ATOM 5173 H HB3 . ARG A 1 354 ? 36.393 71.023 42.119 1.00 78.88 ? 383 ARG A HB3 1 ATOM 5174 H HG2 . ARG A 1 354 ? 37.024 71.457 44.284 1.00 77.62 ? 383 ARG A HG2 1 ATOM 5175 H HG3 . ARG A 1 354 ? 38.047 72.573 43.793 1.00 77.62 ? 383 ARG A HG3 1 ATOM 5176 H HD2 . ARG A 1 354 ? 36.013 73.469 44.657 1.00 78.65 ? 383 ARG A HD2 1 ATOM 5177 H HD3 . ARG A 1 354 ? 36.335 73.959 43.179 1.00 78.65 ? 383 ARG A HD3 1 ATOM 5178 H HE . ARG A 1 354 ? 34.310 72.286 43.857 1.00 78.42 ? 383 ARG A HE 1 ATOM 5179 H HH11 . ARG A 1 354 ? 35.789 73.779 41.291 1.00 75.34 ? 383 ARG A HH11 1 ATOM 5180 H HH12 . ARG A 1 354 ? 34.691 73.536 40.314 1.00 75.34 ? 383 ARG A HH12 1 ATOM 5181 H HH21 . ARG A 1 354 ? 32.660 71.932 42.352 1.00 76.86 ? 383 ARG A HH21 1 ATOM 5182 H HH22 . ARG A 1 354 ? 32.805 72.423 40.954 1.00 76.86 ? 383 ARG A HH22 1 ATOM 5183 N N . ARG A 1 355 ? 37.894 68.335 42.875 1.00 39.34 ? 384 ARG A N 1 ATOM 5184 C CA . ARG A 1 355 ? 37.866 67.253 43.853 1.00 34.06 ? 384 ARG A CA 1 ATOM 5185 C C . ARG A 1 355 ? 38.716 66.077 43.381 1.00 33.18 ? 384 ARG A C 1 ATOM 5186 O O . ARG A 1 355 ? 38.977 65.939 42.185 1.00 37.95 ? 384 ARG A O 1 ATOM 5187 C CB . ARG A 1 355 ? 36.429 66.790 44.091 1.00 34.34 ? 384 ARG A CB 1 ATOM 5188 C CG . ARG A 1 355 ? 35.458 67.908 44.443 1.00 35.40 ? 384 ARG A CG 1 ATOM 5189 C CD . ARG A 1 355 ? 35.639 68.394 45.870 1.00 36.11 ? 384 ARG A CD 1 ATOM 5190 N NE . ARG A 1 355 ? 35.261 67.368 46.842 1.00 36.09 ? 384 ARG A NE 1 ATOM 5191 C CZ . ARG A 1 355 ? 36.073 66.823 47.747 1.00 35.85 ? 384 ARG A CZ 1 ATOM 5192 N NH1 . ARG A 1 355 ? 37.345 67.193 47.845 1.00 35.68 ? 384 ARG A NH1 1 ATOM 5193 N NH2 . ARG A 1 355 ? 35.603 65.898 48.571 1.00 35.89 ? 384 ARG A NH2 1 ATOM 5194 H H . ARG A 1 355 ? 37.508 68.137 42.132 1.00 47.21 ? 384 ARG A H 1 ATOM 5195 H HA . ARG A 1 355 ? 38.227 67.572 44.695 1.00 40.87 ? 384 ARG A HA 1 ATOM 5196 H HB2 . ARG A 1 355 ? 36.103 66.361 43.284 1.00 41.21 ? 384 ARG A HB2 1 ATOM 5197 H HB3 . ARG A 1 355 ? 36.424 66.154 44.824 1.00 41.21 ? 384 ARG A HB3 1 ATOM 5198 H HG2 . ARG A 1 355 ? 35.607 68.659 43.847 1.00 42.48 ? 384 ARG A HG2 1 ATOM 5199 H HG3 . ARG A 1 355 ? 34.549 67.582 44.348 1.00 42.48 ? 384 ARG A HG3 1 ATOM 5200 H HD2 . ARG A 1 355 ? 36.571 68.620 46.014 1.00 43.33 ? 384 ARG A HD2 1 ATOM 5201 H HD3 . ARG A 1 355 ? 35.079 69.172 46.016 1.00 43.33 ? 384 ARG A HD3 1 ATOM 5202 H HE . ARG A 1 355 ? 34.446 67.094 46.829 1.00 43.31 ? 384 ARG A HE 1 ATOM 5203 H HH11 . ARG A 1 355 ? 37.660 67.792 47.315 1.00 42.82 ? 384 ARG A HH11 1 ATOM 5204 H HH12 . ARG A 1 355 ? 37.853 66.831 48.437 1.00 42.82 ? 384 ARG A HH12 1 ATOM 5205 H HH21 . ARG A 1 355 ? 34.780 65.652 48.518 1.00 43.07 ? 384 ARG A HH21 1 ATOM 5206 H HH22 . ARG A 1 355 ? 36.120 65.543 49.160 1.00 43.07 ? 384 ARG A HH22 1 ATOM 5207 N N . PRO A 1 356 ? 39.161 65.225 44.318 1.00 36.52 ? 385 PRO A N 1 ATOM 5208 C CA . PRO A 1 356 ? 39.829 63.987 43.905 1.00 35.77 ? 385 PRO A CA 1 ATOM 5209 C C . PRO A 1 356 ? 38.813 63.003 43.340 1.00 35.43 ? 385 PRO A C 1 ATOM 5210 O O . PRO A 1 356 ? 37.631 63.107 43.669 1.00 35.84 ? 385 PRO A O 1 ATOM 5211 C CB . PRO A 1 356 ? 40.455 63.475 45.202 1.00 35.78 ? 385 PRO A CB 1 ATOM 5212 C CG . PRO A 1 356 ? 39.578 64.010 46.273 1.00 50.98 ? 385 PRO A CG 1 ATOM 5213 C CD . PRO A 1 356 ? 39.079 65.343 45.784 1.00 51.66 ? 385 PRO A CD 1 ATOM 5214 H HA . PRO A 1 356 ? 40.521 64.167 43.250 1.00 42.92 ? 385 PRO A HA 1 ATOM 5215 H HB2 . PRO A 1 356 ? 40.453 62.505 45.207 1.00 42.94 ? 385 PRO A HB2 1 ATOM 5216 H HB3 . PRO A 1 356 ? 41.357 63.820 45.291 1.00 42.94 ? 385 PRO A HB3 1 ATOM 5217 H HG2 . PRO A 1 356 ? 38.836 63.402 46.418 1.00 61.17 ? 385 PRO A HG2 1 ATOM 5218 H HG3 . PRO A 1 356 ? 40.092 64.118 47.088 1.00 61.17 ? 385 PRO A HG3 1 ATOM 5219 H HD2 . PRO A 1 356 ? 38.160 65.482 46.061 1.00 61.99 ? 385 PRO A HD2 1 ATOM 5220 H HD3 . PRO A 1 356 ? 39.657 66.056 46.098 1.00 61.99 ? 385 PRO A HD3 1 ATOM 5221 N N . PHE A 1 357 ? 39.253 62.069 42.505 1.00 34.66 ? 386 PHE A N 1 ATOM 5222 C CA . PHE A 1 357 ? 38.319 61.175 41.834 1.00 34.48 ? 386 PHE A CA 1 ATOM 5223 C C . PHE A 1 357 ? 37.695 60.170 42.798 1.00 34.34 ? 386 PHE A C 1 ATOM 5224 O O . PHE A 1 357 ? 36.582 59.695 42.576 1.00 34.48 ? 386 PHE A O 1 ATOM 5225 C CB . PHE A 1 357 ? 39.007 60.431 40.693 1.00 34.10 ? 386 PHE A CB 1 ATOM 5226 C CG . PHE A 1 357 ? 38.073 59.581 39.887 1.00 34.09 ? 386 PHE A CG 1 ATOM 5227 C CD1 . PHE A 1 357 ? 37.278 60.145 38.903 1.00 34.54 ? 386 PHE A CD1 1 ATOM 5228 C CD2 . PHE A 1 357 ? 37.976 58.222 40.123 1.00 33.75 ? 386 PHE A CD2 1 ATOM 5229 C CE1 . PHE A 1 357 ? 36.410 59.367 38.164 1.00 34.72 ? 386 PHE A CE1 1 ATOM 5230 C CE2 . PHE A 1 357 ? 37.112 57.440 39.388 1.00 33.87 ? 386 PHE A CE2 1 ATOM 5231 C CZ . PHE A 1 357 ? 36.326 58.013 38.407 1.00 34.40 ? 386 PHE A CZ 1 ATOM 5232 H H . PHE A 1 357 ? 40.080 61.934 42.310 1.00 41.60 ? 386 PHE A H 1 ATOM 5233 H HA . PHE A 1 357 ? 37.601 61.703 41.453 1.00 41.37 ? 386 PHE A HA 1 ATOM 5234 H HB2 . PHE A 1 357 ? 39.411 61.079 40.094 1.00 40.92 ? 386 PHE A HB2 1 ATOM 5235 H HB3 . PHE A 1 357 ? 39.692 59.853 41.063 1.00 40.92 ? 386 PHE A HB3 1 ATOM 5236 H HD1 . PHE A 1 357 ? 37.331 61.059 38.737 1.00 41.45 ? 386 PHE A HD1 1 ATOM 5237 H HD2 . PHE A 1 357 ? 38.502 57.831 40.782 1.00 40.50 ? 386 PHE A HD2 1 ATOM 5238 H HE1 . PHE A 1 357 ? 35.883 59.756 37.504 1.00 41.66 ? 386 PHE A HE1 1 ATOM 5239 H HE2 . PHE A 1 357 ? 37.057 56.526 39.553 1.00 40.65 ? 386 PHE A HE2 1 ATOM 5240 H HZ . PHE A 1 357 ? 35.743 57.486 37.910 1.00 41.28 ? 386 PHE A HZ 1 ATOM 5241 N N . SER A 1 358 ? 38.414 59.844 43.867 1.00 36.49 ? 387 SER A N 1 ATOM 5242 C CA . SER A 1 358 ? 37.917 58.890 44.851 1.00 36.38 ? 387 SER A CA 1 ATOM 5243 C C . SER A 1 358 ? 36.769 59.481 45.664 1.00 37.05 ? 387 SER A C 1 ATOM 5244 O O . SER A 1 358 ? 36.026 58.753 46.322 1.00 37.14 ? 387 SER A O 1 ATOM 5245 C CB . SER A 1 358 ? 39.047 58.447 45.781 1.00 36.16 ? 387 SER A CB 1 ATOM 5246 O OG . SER A 1 358 ? 39.680 59.564 46.378 1.00 36.62 ? 387 SER A OG 1 ATOM 5247 H H . SER A 1 358 ? 39.194 60.161 44.045 1.00 43.79 ? 387 SER A H 1 ATOM 5248 H HA . SER A 1 358 ? 37.584 58.105 44.388 1.00 43.66 ? 387 SER A HA 1 ATOM 5249 H HB2 . SER A 1 358 ? 38.677 57.883 46.478 1.00 43.39 ? 387 SER A HB2 1 ATOM 5250 H HB3 . SER A 1 358 ? 39.702 57.951 45.266 1.00 43.39 ? 387 SER A HB3 1 ATOM 5251 H HG . SER A 1 358 ? 40.297 59.307 46.886 1.00 43.94 ? 387 SER A HG 1 ATOM 5252 N N . ALA A 1 359 ? 36.625 60.801 45.618 1.00 38.90 ? 388 ALA A N 1 ATOM 5253 C CA . ALA A 1 359 ? 35.571 61.474 46.365 1.00 39.76 ? 388 ALA A CA 1 ATOM 5254 C C . ALA A 1 359 ? 34.195 61.122 45.801 1.00 40.04 ? 388 ALA A C 1 ATOM 5255 O O . ALA A 1 359 ? 34.067 60.859 44.606 1.00 39.74 ? 388 ALA A O 1 ATOM 5256 C CB . ALA A 1 359 ? 35.782 62.977 46.339 1.00 40.37 ? 388 ALA A CB 1 ATOM 5257 H H . ALA A 1 359 ? 37.126 61.330 45.161 1.00 46.69 ? 388 ALA A H 1 ATOM 5258 H HA . ALA A 1 359 ? 35.601 61.182 47.290 1.00 47.71 ? 388 ALA A HA 1 ATOM 5259 H HB1 . ALA A 1 359 ? 35.070 63.404 46.842 1.00 48.44 ? 388 ALA A HB1 1 ATOM 5260 H HB2 . ALA A 1 359 ? 36.640 63.181 46.742 1.00 48.44 ? 388 ALA A HB2 1 ATOM 5261 H HB3 . ALA A 1 359 ? 35.766 63.281 45.419 1.00 48.44 ? 388 ALA A HB3 1 ATOM 5262 N N . PRO A 1 360 ? 33.159 61.111 46.659 1.00 32.91 ? 389 PRO A N 1 ATOM 5263 C CA . PRO A 1 360 ? 31.800 60.867 46.163 1.00 33.45 ? 389 PRO A CA 1 ATOM 5264 C C . PRO A 1 360 ? 31.349 61.918 45.154 1.00 33.96 ? 389 PRO A C 1 ATOM 5265 O O . PRO A 1 360 ? 30.644 61.591 44.200 1.00 34.10 ? 389 PRO A O 1 ATOM 5266 C CB . PRO A 1 360 ? 30.943 60.932 47.432 1.00 34.39 ? 389 PRO A CB 1 ATOM 5267 C CG . PRO A 1 360 ? 31.880 60.634 48.542 1.00 39.99 ? 389 PRO A CG 1 ATOM 5268 C CD . PRO A 1 360 ? 33.196 61.209 48.128 1.00 33.41 ? 389 PRO A CD 1 ATOM 5269 H HA . PRO A 1 360 ? 31.732 59.984 45.768 1.00 40.13 ? 389 PRO A HA 1 ATOM 5270 H HB2 . PRO A 1 360 ? 30.568 61.821 47.528 1.00 41.27 ? 389 PRO A HB2 1 ATOM 5271 H HB3 . PRO A 1 360 ? 30.241 60.264 47.387 1.00 41.27 ? 389 PRO A HB3 1 ATOM 5272 H HG2 . PRO A 1 360 ? 31.564 61.057 49.356 1.00 47.99 ? 389 PRO A HG2 1 ATOM 5273 H HG3 . PRO A 1 360 ? 31.950 59.674 48.660 1.00 47.99 ? 389 PRO A HG3 1 ATOM 5274 H HD2 . PRO A 1 360 ? 33.262 62.137 48.404 1.00 40.09 ? 389 PRO A HD2 1 ATOM 5275 H HD3 . PRO A 1 360 ? 33.925 60.678 48.485 1.00 40.09 ? 389 PRO A HD3 1 ATOM 5276 N N . ASP A 1 361 ? 31.754 63.166 45.371 1.00 49.78 ? 390 ASP A N 1 ATOM 5277 C CA . ASP A 1 361 ? 31.404 64.257 44.468 1.00 50.30 ? 390 ASP A CA 1 ATOM 5278 C C . ASP A 1 361 ? 32.494 64.467 43.420 1.00 49.49 ? 390 ASP A C 1 ATOM 5279 O O . ASP A 1 361 ? 32.776 65.596 43.019 1.00 49.76 ? 390 ASP A O 1 ATOM 5280 C CB . ASP A 1 361 ? 31.165 65.548 45.256 1.00 51.32 ? 390 ASP A CB 1 ATOM 5281 C CG . ASP A 1 361 ? 32.401 66.020 45.993 1.00 51.03 ? 390 ASP A CG 1 ATOM 5282 O OD1 . ASP A 1 361 ? 33.297 65.190 46.251 1.00 50.17 ? 390 ASP A OD1 1 ATOM 5283 O OD2 . ASP A 1 361 ? 32.478 67.224 46.320 1.00 51.77 ? 390 ASP A OD2 1 ATOM 5284 H H . ASP A 1 361 ? 32.236 63.408 46.041 1.00 59.74 ? 390 ASP A H 1 ATOM 5285 H HA . ASP A 1 361 ? 30.582 64.032 44.004 1.00 60.36 ? 390 ASP A HA 1 ATOM 5286 H HB2 . ASP A 1 361 ? 30.896 66.248 44.641 1.00 61.58 ? 390 ASP A HB2 1 ATOM 5287 H HB3 . ASP A 1 361 ? 30.466 65.393 45.910 1.00 61.58 ? 390 ASP A HB3 1 ATOM 5288 N N . ALA A 1 362 ? 33.113 63.374 42.986 1.00 41.83 ? 391 ALA A N 1 ATOM 5289 C CA . ALA A 1 362 ? 34.129 63.436 41.943 1.00 41.20 ? 391 ALA A CA 1 ATOM 5290 C C . ALA A 1 362 ? 33.501 63.818 40.608 1.00 41.57 ? 391 ALA A C 1 ATOM 5291 O O . ALA A 1 362 ? 34.099 64.546 39.816 1.00 41.51 ? 391 ALA A O 1 ATOM 5292 C CB . ALA A 1 362 ? 34.850 62.109 41.823 1.00 40.35 ? 391 ALA A CB 1 ATOM 5293 H H . ALA A 1 362 ? 32.961 62.580 43.282 1.00 50.19 ? 391 ALA A H 1 ATOM 5294 H HA . ALA A 1 362 ? 34.782 64.115 42.175 1.00 49.44 ? 391 ALA A HA 1 ATOM 5295 H HB1 . ALA A 1 362 ? 35.520 62.176 41.124 1.00 48.42 ? 391 ALA A HB1 1 ATOM 5296 H HB2 . ALA A 1 362 ? 35.276 61.904 42.671 1.00 48.42 ? 391 ALA A HB2 1 ATOM 5297 H HB3 . ALA A 1 362 ? 34.206 61.419 41.600 1.00 48.42 ? 391 ALA A HB3 1 ATOM 5298 N N . CYS A 1 363 ? 32.293 63.315 40.370 1.00 33.35 ? 392 CYS A N 1 ATOM 5299 C CA . CYS A 1 363 ? 31.553 63.604 39.148 1.00 33.92 ? 392 CYS A CA 1 ATOM 5300 C C . CYS A 1 363 ? 30.426 64.596 39.421 1.00 71.53 ? 392 CYS A C 1 ATOM 5301 O O . CYS A 1 363 ? 29.689 64.455 40.397 1.00 73.33 ? 392 CYS A O 1 ATOM 5302 C CB . CYS A 1 363 ? 30.990 62.315 38.550 1.00 33.90 ? 392 CYS A CB 1 ATOM 5303 S SG . CYS A 1 363 ? 32.255 61.105 38.100 1.00 32.80 ? 392 CYS A SG 1 ATOM 5304 H H . CYS A 1 363 ? 31.874 62.794 40.912 1.00 40.02 ? 392 CYS A H 1 ATOM 5305 H HA . CYS A 1 363 ? 32.154 64.001 38.498 1.00 40.71 ? 392 CYS A HA 1 ATOM 5306 H HB2 . CYS A 1 363 ? 30.401 61.900 39.201 1.00 40.68 ? 392 CYS A HB2 1 ATOM 5307 H HB3 . CYS A 1 363 ? 30.490 62.534 37.748 1.00 40.68 ? 392 CYS A HB3 1 ATOM 5308 N N . LYS A 1 364 ? 30.302 65.594 38.549 1.00 52.49 ? 393 LYS A N 1 ATOM 5309 C CA . LYS A 1 364 ? 29.289 66.636 38.693 1.00 49.97 ? 393 LYS A CA 1 ATOM 5310 C C . LYS A 1 364 ? 28.266 66.560 37.564 1.00 45.47 ? 393 LYS A C 1 ATOM 5311 O O . LYS A 1 364 ? 28.614 66.293 36.414 1.00 43.88 ? 393 LYS A O 1 ATOM 5312 C CB . LYS A 1 364 ? 29.949 68.015 38.720 1.00 51.23 ? 393 LYS A CB 1 ATOM 5313 C CG . LYS A 1 364 ? 28.976 69.171 38.867 1.00 52.86 ? 393 LYS A CG 1 ATOM 5314 C CD . LYS A 1 364 ? 29.707 70.472 39.154 1.00 52.69 ? 393 LYS A CD 1 ATOM 5315 C CE . LYS A 1 364 ? 28.788 71.675 39.014 1.00 53.63 ? 393 LYS A CE 1 ATOM 5316 N NZ . LYS A 1 364 ? 27.650 71.627 39.973 1.00 54.57 ? 393 LYS A NZ 1 ATOM 5317 H H . LYS A 1 364 ? 30.800 65.691 37.855 1.00 62.99 ? 393 LYS A H 1 ATOM 5318 H HA . LYS A 1 364 ? 28.821 66.509 39.533 1.00 59.96 ? 393 LYS A HA 1 ATOM 5319 H HB2 . LYS A 1 364 ? 30.565 68.051 39.469 1.00 61.48 ? 393 LYS A HB2 1 ATOM 5320 H HB3 . LYS A 1 364 ? 30.436 68.143 37.890 1.00 61.48 ? 393 LYS A HB3 1 ATOM 5321 H HG2 . LYS A 1 364 ? 28.476 69.277 38.042 1.00 63.43 ? 393 LYS A HG2 1 ATOM 5322 H HG3 . LYS A 1 364 ? 28.372 68.991 39.605 1.00 63.43 ? 393 LYS A HG3 1 ATOM 5323 H HD2 . LYS A 1 364 ? 30.047 70.454 40.063 1.00 63.23 ? 393 LYS A HD2 1 ATOM 5324 H HD3 . LYS A 1 364 ? 30.438 70.573 38.525 1.00 63.23 ? 393 LYS A HD3 1 ATOM 5325 H HE2 . LYS A 1 364 ? 29.294 72.484 39.186 1.00 64.36 ? 393 LYS A HE2 1 ATOM 5326 H HE3 . LYS A 1 364 ? 28.424 71.693 38.115 1.00 64.36 ? 393 LYS A HE3 1 ATOM 5327 H HZ1 . LYS A 1 364 ? 27.132 72.343 39.865 1.00 65.48 ? 393 LYS A HZ1 1 ATOM 5328 H HZ2 . LYS A 1 364 ? 27.164 70.895 39.832 1.00 65.48 ? 393 LYS A HZ2 1 ATOM 5329 H HZ3 . LYS A 1 364 ? 27.956 71.615 40.808 1.00 65.48 ? 393 LYS A HZ3 1 ATOM 5330 N N . ALA A 1 365 ? 27.003 66.798 37.903 1.00 48.41 ? 394 ALA A N 1 ATOM 5331 C CA . ALA A 1 365 ? 25.915 66.714 36.935 1.00 46.77 ? 394 ALA A CA 1 ATOM 5332 C C . ALA A 1 365 ? 26.048 67.779 35.853 1.00 48.92 ? 394 ALA A C 1 ATOM 5333 O O . ALA A 1 365 ? 26.476 68.902 36.121 1.00 48.84 ? 394 ALA A O 1 ATOM 5334 C CB . ALA A 1 365 ? 24.574 66.846 37.639 1.00 45.42 ? 394 ALA A CB 1 ATOM 5335 H H . ALA A 1 365 ? 26.747 67.013 38.696 1.00 58.09 ? 394 ALA A H 1 ATOM 5336 H HA . ALA A 1 365 ? 25.943 65.846 36.505 1.00 56.13 ? 394 ALA A HA 1 ATOM 5337 H HB1 . ALA A 1 365 ? 23.865 66.788 36.980 1.00 54.50 ? 394 ALA A HB1 1 ATOM 5338 H HB2 . ALA A 1 365 ? 24.485 66.128 38.285 1.00 54.50 ? 394 ALA A HB2 1 ATOM 5339 H HB3 . ALA A 1 365 ? 24.537 67.704 38.090 1.00 54.50 ? 394 ALA A HB3 1 ATOM 5340 N N . CYS A 1 366 ? 25.680 67.415 34.629 1.00 47.98 ? 395 CYS A N 1 ATOM 5341 C CA . CYS A 1 366 ? 25.720 68.343 33.504 1.00 51.36 ? 395 CYS A CA 1 ATOM 5342 C C . CYS A 1 366 ? 24.463 69.202 33.468 1.00 54.98 ? 395 CYS A C 1 ATOM 5343 O O . CYS A 1 366 ? 23.384 68.755 33.858 1.00 56.45 ? 395 CYS A O 1 ATOM 5344 C CB . CYS A 1 366 ? 25.874 67.580 32.189 1.00 51.66 ? 395 CYS A CB 1 ATOM 5345 S SG . CYS A 1 366 ? 27.354 66.549 32.117 1.00 65.72 ? 395 CYS A SG 1 ATOM 5346 H H . CYS A 1 366 ? 25.400 66.629 34.422 1.00 57.57 ? 395 CYS A H 1 ATOM 5347 H HA . CYS A 1 366 ? 26.485 68.930 33.604 1.00 61.63 ? 395 CYS A HA 1 ATOM 5348 H HB2 . CYS A 1 366 ? 25.104 67.003 32.071 1.00 61.99 ? 395 CYS A HB2 1 ATOM 5349 H HB3 . CYS A 1 366 ? 25.921 68.219 31.461 1.00 61.99 ? 395 CYS A HB3 1 ATOM 5350 N N . SER A 1 367 ? 24.614 70.435 32.993 1.00 88.03 ? 396 SER A N 1 ATOM 5351 C CA . SER A 1 367 ? 23.508 71.382 32.924 1.00 89.66 ? 396 SER A CA 1 ATOM 5352 C C . SER A 1 367 ? 23.254 71.829 31.489 1.00 86.46 ? 396 SER A C 1 ATOM 5353 O O . SER A 1 367 ? 22.970 73.000 31.235 1.00 87.58 ? 396 SER A O 1 ATOM 5354 C CB . SER A 1 367 ? 23.793 72.597 33.809 1.00 92.55 ? 396 SER A CB 1 ATOM 5355 O OG . SER A 1 367 ? 23.997 72.207 35.157 1.00 95.06 ? 396 SER A OG 1 ATOM 5356 H H . SER A 1 367 ? 25.359 70.750 32.700 1.00 105.63 ? 396 SER A H 1 ATOM 5357 H HA . SER A 1 367 ? 22.702 70.953 33.253 1.00 107.60 ? 396 SER A HA 1 ATOM 5358 H HB2 . SER A 1 367 ? 24.592 73.042 33.486 1.00 111.07 ? 396 SER A HB2 1 ATOM 5359 H HB3 . SER A 1 367 ? 23.037 73.202 33.767 1.00 111.07 ? 396 SER A HB3 1 ATOM 5360 H HG . SER A 1 367 ? 24.152 72.882 35.631 1.00 114.07 ? 396 SER A HG 1 ATOM 5361 N N . CYS A 1 368 ? 23.364 70.892 30.552 1.00 60.64 ? 397 CYS A N 1 ATOM 5362 C CA . CYS A 1 368 ? 23.092 71.180 29.149 1.00 56.47 ? 397 CYS A CA 1 ATOM 5363 C C . CYS A 1 368 ? 21.640 71.597 28.959 1.00 54.42 ? 397 CYS A C 1 ATOM 5364 O O . CYS A 1 368 ? 20.726 70.824 29.242 1.00 54.86 ? 397 CYS A O 1 ATOM 5365 C CB . CYS A 1 368 ? 23.398 69.960 28.278 1.00 55.05 ? 397 CYS A CB 1 ATOM 5366 S SG . CYS A 1 368 ? 25.118 69.428 28.308 1.00 51.01 ? 397 CYS A SG 1 ATOM 5367 H H . CYS A 1 368 ? 23.595 70.078 30.705 1.00 72.77 ? 397 CYS A H 1 ATOM 5368 H HA . CYS A 1 368 ? 23.658 71.912 28.857 1.00 67.76 ? 397 CYS A HA 1 ATOM 5369 H HB2 . CYS A 1 368 ? 22.855 69.217 28.584 1.00 66.06 ? 397 CYS A HB2 1 ATOM 5370 H HB3 . CYS A 1 368 ? 23.172 70.172 27.358 1.00 66.06 ? 397 CYS A HB3 1 ATOM 5371 N N . HIS A 1 369 ? 21.429 72.820 28.480 1.00 35.91 ? 398 HIS A N 1 ATOM 5372 C CA . HIS A 1 369 ? 20.078 73.308 28.238 1.00 34.51 ? 398 HIS A CA 1 ATOM 5373 C C . HIS A 1 369 ? 19.430 72.448 27.156 1.00 33.64 ? 398 HIS A C 1 ATOM 5374 O O . HIS A 1 369 ? 20.019 72.250 26.095 1.00 33.09 ? 398 HIS A O 1 ATOM 5375 C CB . HIS A 1 369 ? 20.093 74.779 27.822 1.00 33.28 ? 398 HIS A CB 1 ATOM 5376 C CG . HIS A 1 369 ? 18.742 75.424 27.840 1.00 33.49 ? 398 HIS A CG 1 ATOM 5377 N ND1 . HIS A 1 369 ? 17.872 75.360 26.773 1.00 33.05 ? 398 HIS A ND1 1 ATOM 5378 C CD2 . HIS A 1 369 ? 18.110 76.144 28.797 1.00 34.50 ? 398 HIS A CD2 1 ATOM 5379 C CE1 . HIS A 1 369 ? 16.764 76.014 27.071 1.00 33.66 ? 398 HIS A CE1 1 ATOM 5380 N NE2 . HIS A 1 369 ? 16.882 76.499 28.294 1.00 34.51 ? 398 HIS A NE2 1 ATOM 5381 H H . HIS A 1 369 ? 22.049 73.383 28.289 1.00 43.09 ? 398 HIS A H 1 ATOM 5382 H HA . HIS A 1 369 ? 19.554 73.225 29.050 1.00 41.41 ? 398 HIS A HA 1 ATOM 5383 H HB2 . HIS A 1 369 ? 20.665 75.271 28.433 1.00 39.93 ? 398 HIS A HB2 1 ATOM 5384 H HB3 . HIS A 1 369 ? 20.442 74.845 26.920 1.00 39.93 ? 398 HIS A HB3 1 ATOM 5385 H HD2 . HIS A 1 369 ? 18.445 76.358 29.637 1.00 41.39 ? 398 HIS A HD2 1 ATOM 5386 H HE1 . HIS A 1 369 ? 16.025 76.115 26.514 1.00 40.39 ? 398 HIS A HE1 1 ATOM 5387 N N . PRO A 1 370 ? 18.217 71.933 27.418 1.00 39.53 ? 399 PRO A N 1 ATOM 5388 C CA . PRO A 1 370 ? 17.619 70.957 26.497 1.00 38.57 ? 399 PRO A CA 1 ATOM 5389 C C . PRO A 1 370 ? 17.315 71.519 25.108 1.00 35.50 ? 399 PRO A C 1 ATOM 5390 O O . PRO A 1 370 ? 17.360 70.770 24.131 1.00 35.37 ? 399 PRO A O 1 ATOM 5391 C CB . PRO A 1 370 ? 16.324 70.552 27.211 1.00 40.72 ? 399 PRO A CB 1 ATOM 5392 C CG . PRO A 1 370 ? 16.003 71.692 28.103 1.00 41.51 ? 399 PRO A CG 1 ATOM 5393 C CD . PRO A 1 370 ? 17.320 72.250 28.543 1.00 40.89 ? 399 PRO A CD 1 ATOM 5394 H HA . PRO A 1 370 ? 18.193 70.180 26.411 1.00 46.28 ? 399 PRO A HA 1 ATOM 5395 H HB2 . PRO A 1 370 ? 15.619 70.418 26.559 1.00 48.86 ? 399 PRO A HB2 1 ATOM 5396 H HB3 . PRO A 1 370 ? 16.474 69.745 27.727 1.00 48.86 ? 399 PRO A HB3 1 ATOM 5397 H HG2 . PRO A 1 370 ? 15.498 72.358 27.611 1.00 49.82 ? 399 PRO A HG2 1 ATOM 5398 H HG3 . PRO A 1 370 ? 15.496 71.375 28.867 1.00 49.82 ? 399 PRO A HG3 1 ATOM 5399 H HD2 . PRO A 1 370 ? 17.257 73.210 28.665 1.00 49.07 ? 399 PRO A HD2 1 ATOM 5400 H HD3 . PRO A 1 370 ? 17.621 71.807 29.351 1.00 49.07 ? 399 PRO A HD3 1 ATOM 5401 N N . VAL A 1 371 ? 17.018 72.811 25.022 1.00 41.44 ? 400 VAL A N 1 ATOM 5402 C CA . VAL A 1 371 ? 16.642 73.422 23.751 1.00 38.29 ? 400 VAL A CA 1 ATOM 5403 C C . VAL A 1 371 ? 17.853 73.968 23.000 1.00 35.12 ? 400 VAL A C 1 ATOM 5404 O O . VAL A 1 371 ? 17.942 73.843 21.779 1.00 34.71 ? 400 VAL A O 1 ATOM 5405 C CB . VAL A 1 371 ? 15.630 74.562 23.959 1.00 28.66 ? 400 VAL A CB 1 ATOM 5406 C CG1 . VAL A 1 371 ? 15.145 75.095 22.621 1.00 28.79 ? 400 VAL A CG1 1 ATOM 5407 C CG2 . VAL A 1 371 ? 14.451 74.079 24.793 1.00 29.89 ? 400 VAL A CG2 1 ATOM 5408 H H . VAL A 1 371 ? 17.027 73.357 25.686 1.00 49.72 ? 400 VAL A H 1 ATOM 5409 H HA . VAL A 1 371 ? 16.222 72.750 23.192 1.00 45.95 ? 400 VAL A HA 1 ATOM 5410 H HB . VAL A 1 371 ? 16.062 75.288 24.437 1.00 34.40 ? 400 VAL A HB 1 ATOM 5411 H HG11 . VAL A 1 371 ? 14.510 75.811 22.779 1.00 34.55 ? 400 VAL A HG11 1 ATOM 5412 H HG12 . VAL A 1 371 ? 15.905 75.430 22.121 1.00 34.55 ? 400 VAL A HG12 1 ATOM 5413 H HG13 . VAL A 1 371 ? 14.718 74.375 22.131 1.00 34.55 ? 400 VAL A HG13 1 ATOM 5414 H HG21 . VAL A 1 371 ? 13.828 74.812 24.912 1.00 35.87 ? 400 VAL A HG21 1 ATOM 5415 H HG22 . VAL A 1 371 ? 14.017 73.346 24.329 1.00 35.87 ? 400 VAL A HG22 1 ATOM 5416 H HG23 . VAL A 1 371 ? 14.777 73.778 25.656 1.00 35.87 ? 400 VAL A HG23 1 ATOM 5417 N N . GLY A 1 372 ? 18.780 74.577 23.732 1.00 31.31 ? 401 GLY A N 1 ATOM 5418 C CA . GLY A 1 372 ? 19.943 75.197 23.123 1.00 29.05 ? 401 GLY A CA 1 ATOM 5419 C C . GLY A 1 372 ? 21.036 74.219 22.733 1.00 27.39 ? 401 GLY A C 1 ATOM 5420 O O . GLY A 1 372 ? 21.875 74.526 21.886 1.00 27.03 ? 401 GLY A O 1 ATOM 5421 H H . GLY A 1 372 ? 18.756 74.644 24.589 1.00 37.57 ? 401 GLY A H 1 ATOM 5422 H HA2 . GLY A 1 372 ? 19.667 75.674 22.325 1.00 34.86 ? 401 GLY A HA2 1 ATOM 5423 H HA3 . GLY A 1 372 ? 20.322 75.840 23.744 1.00 34.86 ? 401 GLY A HA3 1 ATOM 5424 N N . SER A 1 373 ? 21.031 73.042 23.351 1.00 34.08 ? 402 SER A N 1 ATOM 5425 C CA . SER A 1 373 ? 22.066 72.042 23.105 1.00 33.12 ? 402 SER A CA 1 ATOM 5426 C C . SER A 1 373 ? 21.784 71.217 21.852 1.00 33.61 ? 402 SER A C 1 ATOM 5427 O O . SER A 1 373 ? 20.692 70.674 21.688 1.00 33.65 ? 402 SER A O 1 ATOM 5428 C CB . SER A 1 373 ? 22.198 71.116 24.311 1.00 31.83 ? 402 SER A CB 1 ATOM 5429 O OG . SER A 1 373 ? 22.568 71.840 25.469 1.00 31.09 ? 402 SER A OG 1 ATOM 5430 H H . SER A 1 373 ? 20.436 72.796 23.921 1.00 40.90 ? 402 SER A H 1 ATOM 5431 H HA . SER A 1 373 ? 22.915 72.494 22.980 1.00 39.74 ? 402 SER A HA 1 ATOM 5432 H HB2 . SER A 1 373 ? 21.346 70.682 24.470 1.00 38.20 ? 402 SER A HB2 1 ATOM 5433 H HB3 . SER A 1 373 ? 22.879 70.451 24.124 1.00 38.20 ? 402 SER A HB3 1 ATOM 5434 H HG . SER A 1 373 ? 21.987 72.421 25.643 1.00 37.31 ? 402 SER A HG 1 ATOM 5435 N N . ALA A 1 374 ? 22.781 71.119 20.978 1.00 43.22 ? 403 ALA A N 1 ATOM 5436 C CA . ALA A 1 374 ? 22.675 70.300 19.774 1.00 43.44 ? 403 ALA A CA 1 ATOM 5437 C C . ALA A 1 374 ? 22.750 68.814 20.117 1.00 43.58 ? 403 ALA A C 1 ATOM 5438 O O . ALA A 1 374 ? 23.409 68.426 21.083 1.00 42.54 ? 403 ALA A O 1 ATOM 5439 C CB . ALA A 1 374 ? 23.773 70.670 18.787 1.00 43.65 ? 403 ALA A CB 1 ATOM 5440 H H . ALA A 1 374 ? 23.537 71.521 21.060 1.00 51.86 ? 403 ALA A H 1 ATOM 5441 H HA . ALA A 1 374 ? 21.819 70.469 19.350 1.00 52.13 ? 403 ALA A HA 1 ATOM 5442 H HB1 . ALA A 1 374 ? 23.685 70.115 17.996 1.00 52.38 ? 403 ALA A HB1 1 ATOM 5443 H HB2 . ALA A 1 374 ? 23.680 71.605 18.548 1.00 52.38 ? 403 ALA A HB2 1 ATOM 5444 H HB3 . ALA A 1 374 ? 24.635 70.518 19.203 1.00 52.38 ? 403 ALA A HB3 1 ATOM 5445 N N . ILE A 1 375 ? 22.075 67.991 19.316 1.00 44.11 ? 404 ILE A N 1 ATOM 5446 C CA . ILE A 1 375 ? 22.074 66.541 19.508 1.00 45.19 ? 404 ILE A CA 1 ATOM 5447 C C . ILE A 1 375 ? 22.634 65.837 18.274 1.00 48.44 ? 404 ILE A C 1 ATOM 5448 O O . ILE A 1 375 ? 22.311 66.198 17.141 1.00 48.97 ? 404 ILE A O 1 ATOM 5449 C CB . ILE A 1 375 ? 20.654 66.001 19.793 1.00 43.61 ? 404 ILE A CB 1 ATOM 5450 C CG1 . ILE A 1 375 ? 19.982 66.803 20.912 1.00 42.17 ? 404 ILE A CG1 1 ATOM 5451 C CG2 . ILE A 1 375 ? 20.719 64.523 20.168 1.00 44.15 ? 404 ILE A CG2 1 ATOM 5452 C CD1 . ILE A 1 375 ? 18.523 66.456 21.135 1.00 42.87 ? 404 ILE A CD1 1 ATOM 5453 H H . ILE A 1 375 ? 21.604 68.251 18.646 1.00 52.93 ? 404 ILE A H 1 ATOM 5454 H HA . ILE A 1 375 ? 22.638 66.320 20.265 1.00 54.23 ? 404 ILE A HA 1 ATOM 5455 H HB . ILE A 1 375 ? 20.123 66.091 18.986 1.00 52.33 ? 404 ILE A HB 1 ATOM 5456 H HG12 . ILE A 1 375 ? 20.455 66.636 21.742 1.00 50.60 ? 404 ILE A HG12 1 ATOM 5457 H HG13 . ILE A 1 375 ? 20.030 67.746 20.691 1.00 50.60 ? 404 ILE A HG13 1 ATOM 5458 H HG21 . ILE A 1 375 ? 19.820 64.202 20.342 1.00 52.98 ? 404 ILE A HG21 1 ATOM 5459 H HG22 . ILE A 1 375 ? 21.110 64.027 19.431 1.00 52.98 ? 404 ILE A HG22 1 ATOM 5460 H HG23 . ILE A 1 375 ? 21.267 64.423 20.962 1.00 52.98 ? 404 ILE A HG23 1 ATOM 5461 H HD11 . ILE A 1 375 ? 18.175 67.004 21.855 1.00 51.45 ? 404 ILE A HD11 1 ATOM 5462 H HD12 . ILE A 1 375 ? 18.029 66.629 20.318 1.00 51.45 ? 404 ILE A HD12 1 ATOM 5463 H HD13 . ILE A 1 375 ? 18.455 65.517 21.370 1.00 51.45 ? 404 ILE A HD13 1 ATOM 5464 N N . LEU A 1 376 ? 23.471 64.829 18.501 1.00 34.52 ? 405 LEU A N 1 ATOM 5465 C CA . LEU A 1 376 ? 24.048 64.047 17.413 1.00 38.66 ? 405 LEU A CA 1 ATOM 5466 C C . LEU A 1 376 ? 23.038 63.032 16.881 1.00 43.22 ? 405 LEU A C 1 ATOM 5467 O O . LEU A 1 376 ? 22.106 62.654 17.589 1.00 43.23 ? 405 LEU A O 1 ATOM 5468 C CB . LEU A 1 376 ? 25.315 63.328 17.883 1.00 39.00 ? 405 LEU A CB 1 ATOM 5469 C CG . LEU A 1 376 ? 26.446 64.214 18.410 1.00 38.42 ? 405 LEU A CG 1 ATOM 5470 C CD1 . LEU A 1 376 ? 27.637 63.359 18.817 1.00 39.42 ? 405 LEU A CD1 1 ATOM 5471 C CD2 . LEU A 1 376 ? 26.862 65.256 17.380 1.00 39.10 ? 405 LEU A CD2 1 ATOM 5472 H H . LEU A 1 376 ? 23.723 64.577 19.284 1.00 41.42 ? 405 LEU A H 1 ATOM 5473 H HA . LEU A 1 376 ? 24.290 64.642 16.686 1.00 46.39 ? 405 LEU A HA 1 ATOM 5474 H HB2 . LEU A 1 376 ? 25.070 62.719 18.598 1.00 46.80 ? 405 LEU A HB2 1 ATOM 5475 H HB3 . LEU A 1 376 ? 25.671 62.821 17.137 1.00 46.80 ? 405 LEU A HB3 1 ATOM 5476 H HG . LEU A 1 376 ? 26.134 64.683 19.199 1.00 46.11 ? 405 LEU A HG 1 ATOM 5477 H HD11 . LEU A 1 376 ? 28.342 63.937 19.148 1.00 47.30 ? 405 LEU A HD11 1 ATOM 5478 H HD12 . LEU A 1 376 ? 27.360 62.743 19.513 1.00 47.30 ? 405 LEU A HD12 1 ATOM 5479 H HD13 . LEU A 1 376 ? 27.949 62.865 18.043 1.00 47.30 ? 405 LEU A HD13 1 ATOM 5480 H HD21 . LEU A 1 376 ? 27.578 65.796 17.750 1.00 46.92 ? 405 LEU A HD21 1 ATOM 5481 H HD22 . LEU A 1 376 ? 27.168 64.803 16.579 1.00 46.92 ? 405 LEU A HD22 1 ATOM 5482 H HD23 . LEU A 1 376 ? 26.098 65.817 17.172 1.00 46.92 ? 405 LEU A HD23 1 ATOM 5483 N N . PRO A 1 377 ? 23.218 62.586 15.627 1.00 46.36 ? 406 PRO A N 1 ATOM 5484 C CA . PRO A 1 377 ? 22.328 61.547 15.098 1.00 49.65 ? 406 PRO A CA 1 ATOM 5485 C C . PRO A 1 377 ? 22.508 60.226 15.839 1.00 52.84 ? 406 PRO A C 1 ATOM 5486 O O . PRO A 1 377 ? 23.570 59.994 16.417 1.00 39.01 ? 406 PRO A O 1 ATOM 5487 C CB . PRO A 1 377 ? 22.754 61.428 13.631 1.00 51.09 ? 406 PRO A CB 1 ATOM 5488 C CG . PRO A 1 377 ? 24.153 61.928 13.597 1.00 50.48 ? 406 PRO A CG 1 ATOM 5489 C CD . PRO A 1 377 ? 24.233 62.998 14.641 1.00 47.72 ? 406 PRO A CD 1 ATOM 5490 H HA . PRO A 1 377 ? 21.401 61.830 15.148 1.00 59.58 ? 406 PRO A HA 1 ATOM 5491 H HB2 . PRO A 1 377 ? 22.714 60.499 13.353 1.00 61.30 ? 406 PRO A HB2 1 ATOM 5492 H HB3 . PRO A 1 377 ? 22.178 61.978 13.077 1.00 61.30 ? 406 PRO A HB3 1 ATOM 5493 H HG2 . PRO A 1 377 ? 24.763 61.203 13.804 1.00 60.58 ? 406 PRO A HG2 1 ATOM 5494 H HG3 . PRO A 1 377 ? 24.345 62.294 12.719 1.00 60.58 ? 406 PRO A HG3 1 ATOM 5495 H HD2 . PRO A 1 377 ? 25.114 63.009 15.047 1.00 57.27 ? 406 PRO A HD2 1 ATOM 5496 H HD3 . PRO A 1 377 ? 24.005 63.860 14.261 1.00 57.27 ? 406 PRO A HD3 1 ATOM 5497 N N . PHE A 1 378 ? 21.479 59.384 15.821 1.00 54.67 ? 407 PHE A N 1 ATOM 5498 C CA . PHE A 1 378 ? 21.487 58.118 16.551 1.00 56.75 ? 407 PHE A CA 1 ATOM 5499 C C . PHE A 1 378 ? 21.644 58.361 18.051 1.00 52.33 ? 407 PHE A C 1 ATOM 5500 O O . PHE A 1 378 ? 22.270 57.576 18.763 1.00 53.68 ? 407 PHE A O 1 ATOM 5501 C CB . PHE A 1 378 ? 22.593 57.195 16.031 1.00 61.84 ? 407 PHE A CB 1 ATOM 5502 C CG . PHE A 1 378 ? 22.467 56.876 14.571 1.00 65.66 ? 407 PHE A CG 1 ATOM 5503 C CD1 . PHE A 1 378 ? 21.580 55.906 14.140 1.00 46.99 ? 407 PHE A CD1 1 ATOM 5504 C CD2 . PHE A 1 378 ? 23.224 57.551 13.630 1.00 66.54 ? 407 PHE A CD2 1 ATOM 5505 C CE1 . PHE A 1 378 ? 21.452 55.610 12.799 1.00 49.05 ? 407 PHE A CE1 1 ATOM 5506 C CE2 . PHE A 1 378 ? 23.102 57.259 12.286 1.00 46.96 ? 407 PHE A CE2 1 ATOM 5507 C CZ . PHE A 1 378 ? 22.214 56.288 11.870 1.00 49.06 ? 407 PHE A CZ 1 ATOM 5508 H H . PHE A 1 378 ? 20.751 59.526 15.385 1.00 65.61 ? 407 PHE A H 1 ATOM 5509 H HA . PHE A 1 378 ? 20.638 57.671 16.411 1.00 68.10 ? 407 PHE A HA 1 ATOM 5510 H HB2 . PHE A 1 378 ? 23.451 57.625 16.168 1.00 74.20 ? 407 PHE A HB2 1 ATOM 5511 H HB3 . PHE A 1 378 ? 22.560 56.359 16.521 1.00 74.20 ? 407 PHE A HB3 1 ATOM 5512 H HD1 . PHE A 1 378 ? 21.063 55.447 14.762 1.00 56.39 ? 407 PHE A HD1 1 ATOM 5513 H HD2 . PHE A 1 378 ? 23.823 58.206 13.906 1.00 79.85 ? 407 PHE A HD2 1 ATOM 5514 H HE1 . PHE A 1 378 ? 20.853 54.955 12.521 1.00 58.86 ? 407 PHE A HE1 1 ATOM 5515 H HE2 . PHE A 1 378 ? 23.617 57.717 11.662 1.00 56.35 ? 407 PHE A HE2 1 ATOM 5516 H HZ . PHE A 1 378 ? 22.131 56.089 10.965 1.00 58.87 ? 407 PHE A HZ 1 ATOM 5517 N N . SER A 1 379 ? 21.064 59.465 18.513 1.00 47.36 ? 408 SER A N 1 ATOM 5518 C CA . SER A 1 379 ? 20.944 59.754 19.937 1.00 44.46 ? 408 SER A CA 1 ATOM 5519 C C . SER A 1 379 ? 19.809 60.754 20.124 1.00 43.10 ? 408 SER A C 1 ATOM 5520 O O . SER A 1 379 ? 19.538 61.559 19.232 1.00 38.71 ? 408 SER A O 1 ATOM 5521 C CB . SER A 1 379 ? 22.250 60.304 20.509 1.00 43.10 ? 408 SER A CB 1 ATOM 5522 O OG . SER A 1 379 ? 22.453 61.649 20.113 1.00 42.23 ? 408 SER A OG 1 ATOM 5523 H H . SER A 1 379 ? 20.725 60.074 18.010 1.00 56.84 ? 408 SER A H 1 ATOM 5524 H HA . SER A 1 379 ? 20.718 58.940 20.414 1.00 53.36 ? 408 SER A HA 1 ATOM 5525 H HB2 . SER A 1 379 ? 22.212 60.262 21.477 1.00 51.72 ? 408 SER A HB2 1 ATOM 5526 H HB3 . SER A 1 379 ? 22.988 59.765 20.183 1.00 51.72 ? 408 SER A HB3 1 ATOM 5527 H HG . SER A 1 379 ? 22.488 61.700 19.275 1.00 50.67 ? 408 SER A HG 1 ATOM 5528 N N . SER A 1 380 ? 19.147 60.695 21.276 1.00 67.93 ? 409 SER A N 1 ATOM 5529 C CA . SER A 1 380 ? 17.959 61.506 21.529 1.00 69.28 ? 409 SER A CA 1 ATOM 5530 C C . SER A 1 380 ? 18.161 62.488 22.681 1.00 66.96 ? 409 SER A C 1 ATOM 5531 O O . SER A 1 380 ? 17.211 63.134 23.126 1.00 68.86 ? 409 SER A O 1 ATOM 5532 C CB . SER A 1 380 ? 16.762 60.601 21.822 1.00 71.77 ? 409 SER A CB 1 ATOM 5533 O OG . SER A 1 380 ? 17.051 59.701 22.878 1.00 72.96 ? 409 SER A OG 1 ATOM 5534 H H . SER A 1 380 ? 19.368 60.187 21.934 1.00 81.52 ? 409 SER A H 1 ATOM 5535 H HA . SER A 1 380 ? 17.756 62.021 20.732 1.00 83.14 ? 409 SER A HA 1 ATOM 5536 H HB2 . SER A 1 380 ? 16.005 61.151 22.076 1.00 86.13 ? 409 SER A HB2 1 ATOM 5537 H HB3 . SER A 1 380 ? 16.549 60.092 21.024 1.00 86.13 ? 409 SER A HB3 1 ATOM 5538 H HG . SER A 1 380 ? 16.386 59.210 23.027 1.00 87.56 ? 409 SER A HG 1 ATOM 5539 N N . VAL A 1 381 ? 19.398 62.605 23.153 1.00 49.74 ? 410 VAL A N 1 ATOM 5540 C CA . VAL A 1 381 ? 19.708 63.492 24.268 1.00 44.23 ? 410 VAL A CA 1 ATOM 5541 C C . VAL A 1 381 ? 21.154 63.965 24.191 1.00 49.03 ? 410 VAL A C 1 ATOM 5542 O O . VAL A 1 381 ? 22.032 63.225 23.750 1.00 40.13 ? 410 VAL A O 1 ATOM 5543 C CB . VAL A 1 381 ? 19.465 62.793 25.626 1.00 33.75 ? 410 VAL A CB 1 ATOM 5544 C CG1 . VAL A 1 381 ? 20.372 61.575 25.781 1.00 35.13 ? 410 VAL A CG1 1 ATOM 5545 C CG2 . VAL A 1 381 ? 19.659 63.767 26.781 1.00 33.20 ? 410 VAL A CG2 1 ATOM 5546 H H . VAL A 1 381 ? 20.078 62.180 22.844 1.00 59.68 ? 410 VAL A H 1 ATOM 5547 H HA . VAL A 1 381 ? 19.133 64.272 24.223 1.00 53.08 ? 410 VAL A HA 1 ATOM 5548 H HB . VAL A 1 381 ? 18.546 62.482 25.654 1.00 40.50 ? 410 VAL A HB 1 ATOM 5549 H HG11 . VAL A 1 381 ? 20.197 61.159 26.640 1.00 42.16 ? 410 VAL A HG11 1 ATOM 5550 H HG12 . VAL A 1 381 ? 20.185 60.949 25.065 1.00 42.16 ? 410 VAL A HG12 1 ATOM 5551 H HG13 . VAL A 1 381 ? 21.297 61.864 25.735 1.00 42.16 ? 410 VAL A HG13 1 ATOM 5552 H HG21 . VAL A 1 381 ? 19.500 63.301 27.617 1.00 39.84 ? 410 VAL A HG21 1 ATOM 5553 H HG22 . VAL A 1 381 ? 20.567 64.106 26.759 1.00 39.84 ? 410 VAL A HG22 1 ATOM 5554 H HG23 . VAL A 1 381 ? 19.030 64.499 26.686 1.00 39.84 ? 410 VAL A HG23 1 ATOM 5555 N N . THR A 1 382 ? 21.392 65.204 24.612 1.00 72.70 ? 411 THR A N 1 ATOM 5556 C CA . THR A 1 382 ? 22.743 65.749 24.667 1.00 63.74 ? 411 THR A CA 1 ATOM 5557 C C . THR A 1 382 ? 23.415 65.410 25.991 1.00 61.10 ? 411 THR A C 1 ATOM 5558 O O . THR A 1 382 ? 22.789 65.465 27.050 1.00 61.19 ? 411 THR A O 1 ATOM 5559 C CB . THR A 1 382 ? 22.753 67.280 24.492 1.00 61.24 ? 411 THR A CB 1 ATOM 5560 O OG1 . THR A 1 382 ? 22.137 67.631 23.248 1.00 62.01 ? 411 THR A OG1 1 ATOM 5561 C CG2 . THR A 1 382 ? 24.185 67.815 24.513 1.00 61.26 ? 411 THR A CG2 1 ATOM 5562 H H . THR A 1 382 ? 20.783 65.751 24.874 1.00 87.24 ? 411 THR A H 1 ATOM 5563 H HA . THR A 1 382 ? 23.271 65.360 23.952 1.00 76.49 ? 411 THR A HA 1 ATOM 5564 H HB . THR A 1 382 ? 22.262 67.690 25.221 1.00 73.48 ? 411 THR A HB 1 ATOM 5565 H HG1 . THR A 1 382 ? 22.557 67.280 22.611 1.00 74.41 ? 411 THR A HG1 1 ATOM 5566 H HG21 . THR A 1 382 ? 24.180 68.778 24.403 1.00 73.52 ? 411 THR A HG21 1 ATOM 5567 H HG22 . THR A 1 382 ? 24.608 67.596 25.359 1.00 73.52 ? 411 THR A HG22 1 ATOM 5568 H HG23 . THR A 1 382 ? 24.697 67.417 23.792 1.00 73.52 ? 411 THR A HG23 1 ATOM 5569 N N . PHE A 1 383 ? 24.698 65.073 25.915 1.00 47.35 ? 412 PHE A N 1 ATOM 5570 C CA . PHE A 1 383 ? 25.526 64.865 27.096 1.00 46.67 ? 412 PHE A CA 1 ATOM 5571 C C . PHE A 1 383 ? 26.817 65.662 26.933 1.00 44.46 ? 412 PHE A C 1 ATOM 5572 O O . PHE A 1 383 ? 27.375 65.745 25.838 1.00 43.89 ? 412 PHE A O 1 ATOM 5573 C CB . PHE A 1 383 ? 25.825 63.375 27.302 1.00 49.73 ? 412 PHE A CB 1 ATOM 5574 C CG . PHE A 1 383 ? 24.620 62.555 27.692 1.00 53.61 ? 412 PHE A CG 1 ATOM 5575 C CD1 . PHE A 1 383 ? 23.690 63.041 28.599 1.00 54.66 ? 412 PHE A CD1 1 ATOM 5576 C CD2 . PHE A 1 383 ? 24.422 61.294 27.152 1.00 56.20 ? 412 PHE A CD2 1 ATOM 5577 C CE1 . PHE A 1 383 ? 22.586 62.286 28.956 1.00 55.77 ? 412 PHE A CE1 1 ATOM 5578 C CE2 . PHE A 1 383 ? 23.320 60.534 27.506 1.00 57.27 ? 412 PHE A CE2 1 ATOM 5579 C CZ . PHE A 1 383 ? 22.402 61.032 28.409 1.00 56.90 ? 412 PHE A CZ 1 ATOM 5580 H H . PHE A 1 383 ? 25.120 64.958 25.175 1.00 56.82 ? 412 PHE A H 1 ATOM 5581 H HA . PHE A 1 383 ? 25.059 65.195 27.879 1.00 56.01 ? 412 PHE A HA 1 ATOM 5582 H HB2 . PHE A 1 383 ? 26.176 63.010 26.474 1.00 59.68 ? 412 PHE A HB2 1 ATOM 5583 H HB3 . PHE A 1 383 ? 26.486 63.284 28.006 1.00 59.68 ? 412 PHE A HB3 1 ATOM 5584 H HD1 . PHE A 1 383 ? 23.809 63.885 28.971 1.00 65.59 ? 412 PHE A HD1 1 ATOM 5585 H HD2 . PHE A 1 383 ? 25.037 60.954 26.543 1.00 67.44 ? 412 PHE A HD2 1 ATOM 5586 H HE1 . PHE A 1 383 ? 21.969 62.623 29.565 1.00 66.92 ? 412 PHE A HE1 1 ATOM 5587 H HE2 . PHE A 1 383 ? 23.198 59.690 27.136 1.00 68.72 ? 412 PHE A HE2 1 ATOM 5588 H HZ . PHE A 1 383 ? 21.661 60.523 28.648 1.00 68.28 ? 412 PHE A HZ 1 ATOM 5589 N N . CYS A 1 384 ? 27.279 66.257 28.026 1.00 45.00 ? 413 CYS A N 1 ATOM 5590 C CA . CYS A 1 384 ? 28.433 67.146 27.978 1.00 45.64 ? 413 CYS A CA 1 ATOM 5591 C C . CYS A 1 384 ? 29.750 66.381 27.901 1.00 47.41 ? 413 CYS A C 1 ATOM 5592 O O . CYS A 1 384 ? 29.804 65.180 28.167 1.00 48.01 ? 413 CYS A O 1 ATOM 5593 C CB . CYS A 1 384 ? 28.445 68.064 29.201 1.00 46.32 ? 413 CYS A CB 1 ATOM 5594 S SG . CYS A 1 384 ? 28.715 67.207 30.764 1.00 42.22 ? 413 CYS A SG 1 ATOM 5595 H H . CYS A 1 384 ? 26.941 66.163 28.811 1.00 54.00 ? 413 CYS A H 1 ATOM 5596 H HA . CYS A 1 384 ? 28.367 67.704 27.187 1.00 54.77 ? 413 CYS A HA 1 ATOM 5597 H HB2 . CYS A 1 384 ? 29.157 68.715 29.094 1.00 55.58 ? 413 CYS A HB2 1 ATOM 5598 H HB3 . CYS A 1 384 ? 27.591 68.519 29.257 1.00 55.58 ? 413 CYS A HB3 1 ATOM 5599 N N . ASP A 1 385 ? 30.806 67.094 27.527 1.00 42.09 ? 414 ASP A N 1 ATOM 5600 C CA . ASP A 1 385 ? 32.155 66.541 27.509 1.00 45.47 ? 414 ASP A CA 1 ATOM 5601 C C . ASP A 1 385 ? 32.543 66.107 28.924 1.00 46.92 ? 414 ASP A C 1 ATOM 5602 O O . ASP A 1 385 ? 32.612 66.944 29.822 1.00 47.76 ? 414 ASP A O 1 ATOM 5603 C CB . ASP A 1 385 ? 33.142 67.581 26.973 1.00 47.19 ? 414 ASP A CB 1 ATOM 5604 C CG . ASP A 1 385 ? 34.512 66.999 26.673 1.00 50.42 ? 414 ASP A CG 1 ATOM 5605 O OD1 . ASP A 1 385 ? 34.842 65.921 27.209 1.00 52.21 ? 414 ASP A OD1 1 ATOM 5606 O OD2 . ASP A 1 385 ? 35.266 67.630 25.901 1.00 51.26 ? 414 ASP A OD2 1 ATOM 5607 H H . ASP A 1 385 ? 30.767 67.916 27.275 1.00 50.51 ? 414 ASP A H 1 ATOM 5608 H HA . ASP A 1 385 ? 32.179 65.764 26.929 1.00 54.56 ? 414 ASP A HA 1 ATOM 5609 H HB2 . ASP A 1 385 ? 32.789 67.956 26.151 1.00 56.63 ? 414 ASP A HB2 1 ATOM 5610 H HB3 . ASP A 1 385 ? 33.253 68.281 27.635 1.00 56.63 ? 414 ASP A HB3 1 ATOM 5611 N N . PRO A 1 386 ? 32.796 64.801 29.135 1.00 39.50 ? 415 PRO A N 1 ATOM 5612 C CA . PRO A 1 386 ? 33.109 64.340 30.495 1.00 41.58 ? 415 PRO A CA 1 ATOM 5613 C C . PRO A 1 386 ? 34.373 64.963 31.092 1.00 43.19 ? 415 PRO A C 1 ATOM 5614 O O . PRO A 1 386 ? 34.564 64.892 32.306 1.00 44.91 ? 415 PRO A O 1 ATOM 5615 C CB . PRO A 1 386 ? 33.294 62.827 30.319 1.00 43.33 ? 415 PRO A CB 1 ATOM 5616 C CG . PRO A 1 386 ? 32.558 62.488 29.081 1.00 41.74 ? 415 PRO A CG 1 ATOM 5617 C CD . PRO A 1 386 ? 32.707 63.676 28.187 1.00 39.85 ? 415 PRO A CD 1 ATOM 5618 H HA . PRO A 1 386 ? 32.359 64.505 31.087 1.00 49.90 ? 415 PRO A HA 1 ATOM 5619 H HB2 . PRO A 1 386 ? 34.238 62.622 30.224 1.00 52.00 ? 415 PRO A HB2 1 ATOM 5620 H HB3 . PRO A 1 386 ? 32.916 62.361 31.081 1.00 52.00 ? 415 PRO A HB3 1 ATOM 5621 H HG2 . PRO A 1 386 ? 32.953 61.702 28.672 1.00 50.09 ? 415 PRO A HG2 1 ATOM 5622 H HG3 . PRO A 1 386 ? 31.624 62.333 29.290 1.00 50.09 ? 415 PRO A HG3 1 ATOM 5623 H HD2 . PRO A 1 386 ? 33.522 63.607 27.665 1.00 47.82 ? 415 PRO A HD2 1 ATOM 5624 H HD3 . PRO A 1 386 ? 31.927 63.772 27.619 1.00 47.82 ? 415 PRO A HD3 1 ATOM 5625 N N . SER A 1 387 ? 35.215 65.562 30.255 1.00 43.12 ? 416 SER A N 1 ATOM 5626 C CA . SER A 1 387 ? 36.494 66.098 30.713 1.00 45.05 ? 416 SER A CA 1 ATOM 5627 C C . SER A 1 387 ? 36.400 67.540 31.216 1.00 44.73 ? 416 SER A C 1 ATOM 5628 O O . SER A 1 387 ? 37.206 67.953 32.051 1.00 46.22 ? 416 SER A O 1 ATOM 5629 C CB . SER A 1 387 ? 37.532 66.015 29.590 1.00 45.84 ? 416 SER A CB 1 ATOM 5630 O OG . SER A 1 387 ? 37.139 66.784 28.468 1.00 53.81 ? 416 SER A OG 1 ATOM 5631 H H . SER A 1 387 ? 35.069 65.672 29.414 1.00 51.74 ? 416 SER A H 1 ATOM 5632 H HA . SER A 1 387 ? 36.812 65.551 31.448 1.00 54.06 ? 416 SER A HA 1 ATOM 5633 H HB2 . SER A 1 387 ? 38.380 66.351 29.921 1.00 55.01 ? 416 SER A HB2 1 ATOM 5634 H HB3 . SER A 1 387 ? 37.627 65.089 29.318 1.00 55.01 ? 416 SER A HB3 1 ATOM 5635 H HG . SER A 1 387 ? 36.406 66.503 28.170 1.00 64.57 ? 416 SER A HG 1 ATOM 5636 N N . ASN A 1 388 ? 35.426 68.300 30.717 1.00 57.07 ? 417 ASN A N 1 ATOM 5637 C CA . ASN A 1 388 ? 35.299 69.712 31.087 1.00 57.87 ? 417 ASN A CA 1 ATOM 5638 C C . ASN A 1 388 ? 33.853 70.194 31.222 1.00 54.64 ? 417 ASN A C 1 ATOM 5639 O O . ASN A 1 388 ? 33.609 71.324 31.643 1.00 55.27 ? 417 ASN A O 1 ATOM 5640 C CB . ASN A 1 388 ? 36.041 70.589 30.068 1.00 59.67 ? 417 ASN A CB 1 ATOM 5641 C CG . ASN A 1 388 ? 35.523 70.417 28.648 1.00 59.40 ? 417 ASN A CG 1 ATOM 5642 O OD1 . ASN A 1 388 ? 34.320 70.313 28.418 1.00 57.98 ? 417 ASN A OD1 1 ATOM 5643 N ND2 . ASN A 1 388 ? 36.439 70.392 27.686 1.00 60.95 ? 417 ASN A ND2 1 ATOM 5644 H H . ASN A 1 388 ? 34.827 68.025 30.165 1.00 68.49 ? 417 ASN A H 1 ATOM 5645 H HA . ASN A 1 388 ? 35.728 69.842 31.947 1.00 69.45 ? 417 ASN A HA 1 ATOM 5646 H HB2 . ASN A 1 388 ? 35.932 71.520 30.315 1.00 71.60 ? 417 ASN A HB2 1 ATOM 5647 H HB3 . ASN A 1 388 ? 36.981 70.352 30.074 1.00 71.60 ? 417 ASN A HB3 1 ATOM 5648 H HD21 . ASN A 1 388 ? 36.198 70.297 26.866 1.00 73.15 ? 417 ASN A HD21 1 ATOM 5649 H HD22 . ASN A 1 388 ? 37.272 70.471 27.884 1.00 73.15 ? 417 ASN A HD22 1 ATOM 5650 N N . GLY A 1 389 ? 32.900 69.341 30.863 1.00 37.71 ? 418 GLY A N 1 ATOM 5651 C CA . GLY A 1 389 ? 31.494 69.651 31.049 1.00 36.17 ? 418 GLY A CA 1 ATOM 5652 C C . GLY A 1 389 ? 30.918 70.649 30.059 1.00 34.12 ? 418 GLY A C 1 ATOM 5653 O O . GLY A 1 389 ? 29.832 71.185 30.281 1.00 33.12 ? 418 GLY A O 1 ATOM 5654 H H . GLY A 1 389 ? 33.046 68.571 30.509 1.00 45.26 ? 418 GLY A H 1 ATOM 5655 H HA2 . GLY A 1 389 ? 30.980 68.831 30.979 1.00 43.40 ? 418 GLY A HA2 1 ATOM 5656 H HA3 . GLY A 1 389 ? 31.367 70.009 31.941 1.00 43.40 ? 418 GLY A HA3 1 ATOM 5657 N N . ASP A 1 390 ? 31.638 70.906 28.970 1.00 50.01 ? 419 ASP A N 1 ATOM 5658 C CA . ASP A 1 390 ? 31.148 71.804 27.926 1.00 48.45 ? 419 ASP A CA 1 ATOM 5659 C C . ASP A 1 390 ? 30.162 71.095 27.005 1.00 47.17 ? 419 ASP A C 1 ATOM 5660 O O . ASP A 1 390 ? 30.493 70.084 26.388 1.00 47.61 ? 419 ASP A O 1 ATOM 5661 C CB . ASP A 1 390 ? 32.313 72.363 27.105 1.00 50.00 ? 419 ASP A CB 1 ATOM 5662 C CG . ASP A 1 390 ? 33.217 73.272 27.915 1.00 52.99 ? 419 ASP A CG 1 ATOM 5663 O OD1 . ASP A 1 390 ? 32.733 73.881 28.894 1.00 53.58 ? 419 ASP A OD1 1 ATOM 5664 O OD2 . ASP A 1 390 ? 34.413 73.384 27.569 1.00 54.69 ? 419 ASP A OD2 1 ATOM 5665 H H . ASP A 1 390 ? 32.414 70.573 28.811 1.00 60.01 ? 419 ASP A H 1 ATOM 5666 H HA . ASP A 1 390 ? 30.689 72.550 28.342 1.00 58.14 ? 419 ASP A HA 1 ATOM 5667 H HB2 . ASP A 1 390 ? 32.849 71.625 26.773 1.00 60.01 ? 419 ASP A HB2 1 ATOM 5668 H HB3 . ASP A 1 390 ? 31.959 72.876 26.362 1.00 60.01 ? 419 ASP A HB3 1 ATOM 5669 N N . CYS A 1 391 ? 28.950 71.634 26.914 1.00 37.29 ? 420 CYS A N 1 ATOM 5670 C CA . CYS A 1 391 ? 27.924 71.071 26.042 1.00 36.31 ? 420 CYS A CA 1 ATOM 5671 C C . CYS A 1 391 ? 28.075 71.598 24.615 1.00 35.78 ? 420 CYS A C 1 ATOM 5672 O O . CYS A 1 391 ? 28.433 72.759 24.419 1.00 35.70 ? 420 CYS A O 1 ATOM 5673 C CB . CYS A 1 391 ? 26.532 71.403 26.574 1.00 35.61 ? 420 CYS A CB 1 ATOM 5674 S SG . CYS A 1 391 ? 26.322 71.060 28.331 1.00 36.73 ? 420 CYS A SG 1 ATOM 5675 H H . CYS A 1 391 ? 28.695 72.330 27.350 1.00 44.74 ? 420 CYS A H 1 ATOM 5676 H HA . CYS A 1 391 ? 28.019 70.106 26.020 1.00 43.57 ? 420 CYS A HA 1 ATOM 5677 H HB2 . CYS A 1 391 ? 26.361 72.348 26.434 1.00 42.73 ? 420 CYS A HB2 1 ATOM 5678 H HB3 . CYS A 1 391 ? 25.878 70.875 26.089 1.00 42.73 ? 420 CYS A HB3 1 ATOM 5679 N N . PRO A 1 392 ? 27.801 70.748 23.610 1.00 36.78 ? 421 PRO A N 1 ATOM 5680 C CA . PRO A 1 392 ? 27.868 71.200 22.216 1.00 36.66 ? 421 PRO A CA 1 ATOM 5681 C C . PRO A 1 392 ? 26.650 72.037 21.836 1.00 35.67 ? 421 PRO A C 1 ATOM 5682 O O . PRO A 1 392 ? 25.537 71.513 21.800 1.00 35.25 ? 421 PRO A O 1 ATOM 5683 C CB . PRO A 1 392 ? 27.908 69.891 21.430 1.00 37.33 ? 421 PRO A CB 1 ATOM 5684 C CG . PRO A 1 392 ? 27.141 68.937 22.275 1.00 37.20 ? 421 PRO A CG 1 ATOM 5685 C CD . PRO A 1 392 ? 27.403 69.332 23.706 1.00 37.18 ? 421 PRO A CD 1 ATOM 5686 H HA . PRO A 1 392 ? 28.680 71.706 22.056 1.00 43.99 ? 421 PRO A HA 1 ATOM 5687 H HB2 . PRO A 1 392 ? 27.480 70.011 20.567 1.00 44.80 ? 421 PRO A HB2 1 ATOM 5688 H HB3 . PRO A 1 392 ? 28.827 69.598 21.323 1.00 44.80 ? 421 PRO A HB3 1 ATOM 5689 H HG2 . PRO A 1 392 ? 26.196 69.011 22.070 1.00 44.64 ? 421 PRO A HG2 1 ATOM 5690 H HG3 . PRO A 1 392 ? 27.455 68.034 22.109 1.00 44.64 ? 421 PRO A HG3 1 ATOM 5691 H HD2 . PRO A 1 392 ? 26.594 69.244 24.234 1.00 44.62 ? 421 PRO A HD2 1 ATOM 5692 H HD3 . PRO A 1 392 ? 28.127 68.802 24.076 1.00 44.62 ? 421 PRO A HD3 1 ATOM 5693 N N . CYS A 1 393 ? 26.863 73.318 21.552 1.00 27.65 ? 422 CYS A N 1 ATOM 5694 C CA . CYS A 1 393 ? 25.760 74.246 21.320 1.00 27.01 ? 422 CYS A CA 1 ATOM 5695 C C . CYS A 1 393 ? 25.326 74.321 19.861 1.00 27.25 ? 422 CYS A C 1 ATOM 5696 O O . CYS A 1 393 ? 26.128 74.132 18.947 1.00 28.08 ? 422 CYS A O 1 ATOM 5697 C CB . CYS A 1 393 ? 26.150 75.645 21.800 1.00 27.16 ? 422 CYS A CB 1 ATOM 5698 S SG . CYS A 1 393 ? 26.564 75.735 23.552 1.00 39.38 ? 422 CYS A SG 1 ATOM 5699 H H . CYS A 1 393 ? 27.642 73.677 21.488 1.00 33.18 ? 422 CYS A H 1 ATOM 5700 H HA . CYS A 1 393 ? 24.995 73.956 21.841 1.00 32.41 ? 422 CYS A HA 1 ATOM 5701 H HB2 . CYS A 1 393 ? 26.925 75.942 21.298 1.00 32.59 ? 422 CYS A HB2 1 ATOM 5702 H HB3 . CYS A 1 393 ? 25.406 76.247 21.642 1.00 32.59 ? 422 CYS A HB3 1 ATOM 5703 N N . LYS A 1 394 ? 24.043 74.602 19.659 1.00 30.68 ? 423 LYS A N 1 ATOM 5704 C CA . LYS A 1 394 ? 23.522 74.902 18.333 1.00 31.20 ? 423 LYS A CA 1 ATOM 5705 C C . LYS A 1 394 ? 24.107 76.232 17.864 1.00 31.80 ? 423 LYS A C 1 ATOM 5706 O O . LYS A 1 394 ? 24.635 76.993 18.677 1.00 31.99 ? 423 LYS A O 1 ATOM 5707 C CB . LYS A 1 394 ? 21.993 74.956 18.353 1.00 30.93 ? 423 LYS A CB 1 ATOM 5708 C CG . LYS A 1 394 ? 21.336 73.628 18.684 1.00 30.77 ? 423 LYS A CG 1 ATOM 5709 C CD . LYS A 1 394 ? 19.828 73.764 18.823 1.00 31.13 ? 423 LYS A CD 1 ATOM 5710 C CE . LYS A 1 394 ? 19.186 72.434 19.184 1.00 31.02 ? 423 LYS A CE 1 ATOM 5711 N NZ . LYS A 1 394 ? 17.734 72.561 19.480 1.00 31.37 ? 423 LYS A NZ 1 ATOM 5712 H H . LYS A 1 394 ? 23.449 74.626 20.280 1.00 36.81 ? 423 LYS A H 1 ATOM 5713 H HA . LYS A 1 394 ? 23.797 74.209 17.713 1.00 37.44 ? 423 LYS A HA 1 ATOM 5714 H HB2 . LYS A 1 394 ? 21.712 75.600 19.022 1.00 37.12 ? 423 LYS A HB2 1 ATOM 5715 H HB3 . LYS A 1 394 ? 21.679 75.233 17.478 1.00 37.12 ? 423 LYS A HB3 1 ATOM 5716 H HG2 . LYS A 1 394 ? 21.519 72.995 17.972 1.00 36.92 ? 423 LYS A HG2 1 ATOM 5717 H HG3 . LYS A 1 394 ? 21.690 73.297 19.524 1.00 36.92 ? 423 LYS A HG3 1 ATOM 5718 H HD2 . LYS A 1 394 ? 19.626 74.401 19.527 1.00 37.36 ? 423 LYS A HD2 1 ATOM 5719 H HD3 . LYS A 1 394 ? 19.453 74.064 17.980 1.00 37.36 ? 423 LYS A HD3 1 ATOM 5720 H HE2 . LYS A 1 394 ? 19.288 71.822 18.439 1.00 37.22 ? 423 LYS A HE2 1 ATOM 5721 H HE3 . LYS A 1 394 ? 19.623 72.076 19.971 1.00 37.22 ? 423 LYS A HE3 1 ATOM 5722 H HZ1 . LYS A 1 394 ? 17.395 71.764 19.686 1.00 37.65 ? 423 LYS A HZ1 1 ATOM 5723 H HZ2 . LYS A 1 394 ? 17.611 73.114 20.167 1.00 37.65 ? 423 LYS A HZ2 1 ATOM 5724 H HZ3 . LYS A 1 394 ? 17.305 72.882 18.770 1.00 37.65 ? 423 LYS A HZ3 1 ATOM 5725 N N . PRO A 1 395 ? 24.021 76.517 16.554 1.00 28.29 ? 424 PRO A N 1 ATOM 5726 C CA . PRO A 1 395 ? 24.568 77.774 16.029 1.00 29.30 ? 424 PRO A CA 1 ATOM 5727 C C . PRO A 1 395 ? 23.973 79.011 16.700 1.00 28.97 ? 424 PRO A C 1 ATOM 5728 O O . PRO A 1 395 ? 22.762 79.082 16.898 1.00 28.51 ? 424 PRO A O 1 ATOM 5729 C CB . PRO A 1 395 ? 24.186 77.728 14.547 1.00 30.64 ? 424 PRO A CB 1 ATOM 5730 C CG . PRO A 1 395 ? 24.026 76.284 14.238 1.00 30.56 ? 424 PRO A CG 1 ATOM 5731 C CD . PRO A 1 395 ? 23.467 75.670 15.483 1.00 28.95 ? 424 PRO A CD 1 ATOM 5732 H HA . PRO A 1 395 ? 25.534 77.788 16.115 1.00 35.16 ? 424 PRO A HA 1 ATOM 5733 H HB2 . PRO A 1 395 ? 23.352 78.204 14.409 1.00 36.77 ? 424 PRO A HB2 1 ATOM 5734 H HB3 . PRO A 1 395 ? 24.896 78.117 14.013 1.00 36.77 ? 424 PRO A HB3 1 ATOM 5735 H HG2 . PRO A 1 395 ? 23.409 76.175 13.497 1.00 36.67 ? 424 PRO A HG2 1 ATOM 5736 H HG3 . PRO A 1 395 ? 24.890 75.899 14.025 1.00 36.67 ? 424 PRO A HG3 1 ATOM 5737 H HD2 . PRO A 1 395 ? 22.499 75.718 15.480 1.00 34.74 ? 424 PRO A HD2 1 ATOM 5738 H HD3 . PRO A 1 395 ? 23.779 74.756 15.579 1.00 34.74 ? 424 PRO A HD3 1 ATOM 5739 N N . GLY A 1 396 ? 24.824 79.973 17.040 1.00 43.17 ? 425 GLY A N 1 ATOM 5740 C CA . GLY A 1 396 ? 24.372 81.211 17.649 1.00 42.10 ? 425 GLY A CA 1 ATOM 5741 C C . GLY A 1 396 ? 24.150 81.110 19.147 1.00 39.42 ? 425 GLY A C 1 ATOM 5742 O O . GLY A 1 396 ? 23.819 82.105 19.792 1.00 39.98 ? 425 GLY A O 1 ATOM 5743 H H . GLY A 1 396 ? 25.675 79.930 16.926 1.00 51.80 ? 425 GLY A H 1 ATOM 5744 H HA2 . GLY A 1 396 ? 25.031 81.904 17.487 1.00 50.52 ? 425 GLY A HA2 1 ATOM 5745 H HA3 . GLY A 1 396 ? 23.538 81.482 17.237 1.00 50.52 ? 425 GLY A HA3 1 ATOM 5746 N N . VAL A 1 397 ? 24.320 79.910 19.698 1.00 36.24 ? 426 VAL A N 1 ATOM 5747 C CA . VAL A 1 397 ? 24.206 79.692 21.138 1.00 33.35 ? 426 VAL A CA 1 ATOM 5748 C C . VAL A 1 397 ? 25.596 79.476 21.733 1.00 34.22 ? 426 VAL A C 1 ATOM 5749 O O . VAL A 1 397 ? 26.436 78.806 21.130 1.00 35.17 ? 426 VAL A O 1 ATOM 5750 C CB . VAL A 1 397 ? 23.309 78.484 21.459 1.00 30.25 ? 426 VAL A CB 1 ATOM 5751 C CG1 . VAL A 1 397 ? 23.074 78.381 22.957 1.00 29.55 ? 426 VAL A CG1 1 ATOM 5752 C CG2 . VAL A 1 397 ? 21.982 78.597 20.727 1.00 29.87 ? 426 VAL A CG2 1 ATOM 5753 H H . VAL A 1 397 ? 24.505 79.198 19.253 1.00 43.49 ? 426 VAL A H 1 ATOM 5754 H HA . VAL A 1 397 ? 23.817 80.479 21.551 1.00 40.02 ? 426 VAL A HA 1 ATOM 5755 H HB . VAL A 1 397 ? 23.750 77.672 21.164 1.00 36.30 ? 426 VAL A HB 1 ATOM 5756 H HG11 . VAL A 1 397 ? 22.508 77.614 23.135 1.00 35.46 ? 426 VAL A HG11 1 ATOM 5757 H HG12 . VAL A 1 397 ? 23.929 78.272 23.403 1.00 35.46 ? 426 VAL A HG12 1 ATOM 5758 H HG13 . VAL A 1 397 ? 22.641 79.192 23.264 1.00 35.46 ? 426 VAL A HG13 1 ATOM 5759 H HG21 . VAL A 1 397 ? 21.435 77.827 20.945 1.00 35.84 ? 426 VAL A HG21 1 ATOM 5760 H HG22 . VAL A 1 397 ? 21.535 79.411 21.009 1.00 35.84 ? 426 VAL A HG22 1 ATOM 5761 H HG23 . VAL A 1 397 ? 22.150 78.625 19.772 1.00 35.84 ? 426 VAL A HG23 1 ATOM 5762 N N . ALA A 1 398 ? 25.827 80.031 22.921 1.00 41.32 ? 427 ALA A N 1 ATOM 5763 C CA . ALA A 1 398 ? 27.155 80.029 23.530 1.00 43.85 ? 427 ALA A CA 1 ATOM 5764 C C . ALA A 1 398 ? 27.120 79.552 24.978 1.00 46.19 ? 427 ALA A C 1 ATOM 5765 O O . ALA A 1 398 ? 26.079 79.128 25.481 1.00 46.39 ? 427 ALA A O 1 ATOM 5766 C CB . ALA A 1 398 ? 27.762 81.420 23.454 1.00 44.65 ? 427 ALA A CB 1 ATOM 5767 H H . ALA A 1 398 ? 25.226 80.418 23.398 1.00 49.58 ? 427 ALA A H 1 ATOM 5768 H HA . ALA A 1 398 ? 27.728 79.425 23.032 1.00 52.62 ? 427 ALA A HA 1 ATOM 5769 H HB1 . ALA A 1 398 ? 28.642 81.403 23.862 1.00 53.58 ? 427 ALA A HB1 1 ATOM 5770 H HB2 . ALA A 1 398 ? 27.834 81.682 22.523 1.00 53.58 ? 427 ALA A HB2 1 ATOM 5771 H HB3 . ALA A 1 398 ? 27.188 82.040 23.930 1.00 53.58 ? 427 ALA A HB3 1 ATOM 5772 N N . GLY A 1 399 ? 28.272 79.631 25.638 1.00 69.56 ? 428 GLY A N 1 ATOM 5773 C CA . GLY A 1 399 ? 28.404 79.208 27.020 1.00 70.31 ? 428 GLY A CA 1 ATOM 5774 C C . GLY A 1 399 ? 28.646 77.717 27.128 1.00 69.80 ? 428 GLY A C 1 ATOM 5775 O O . GLY A 1 399 ? 28.565 76.999 26.131 1.00 69.47 ? 428 GLY A O 1 ATOM 5776 H H . GLY A 1 399 ? 29.002 79.931 25.298 1.00 83.48 ? 428 GLY A H 1 ATOM 5777 H HA2 . GLY A 1 399 ? 29.148 79.674 27.433 1.00 84.38 ? 428 GLY A HA2 1 ATOM 5778 H HA3 . GLY A 1 399 ? 27.594 79.427 27.506 1.00 84.38 ? 428 GLY A HA3 1 ATOM 5779 N N . PRO A 1 400 ? 28.961 77.242 28.341 1.00 57.25 ? 429 PRO A N 1 ATOM 5780 C CA . PRO A 1 400 ? 29.163 75.812 28.585 1.00 57.90 ? 429 PRO A CA 1 ATOM 5781 C C . PRO A 1 400 ? 27.847 75.039 28.655 1.00 57.05 ? 429 PRO A C 1 ATOM 5782 O O . PRO A 1 400 ? 27.852 73.812 28.545 1.00 59.17 ? 429 PRO A O 1 ATOM 5783 C CB . PRO A 1 400 ? 29.883 75.793 29.934 1.00 60.17 ? 429 PRO A CB 1 ATOM 5784 C CG . PRO A 1 400 ? 29.377 77.002 30.632 1.00 60.91 ? 429 PRO A CG 1 ATOM 5785 C CD . PRO A 1 400 ? 29.155 78.041 29.564 1.00 59.57 ? 429 PRO A CD 1 ATOM 5786 H HA . PRO A 1 400 ? 29.735 75.425 27.904 1.00 69.48 ? 429 PRO A HA 1 ATOM 5787 H HB2 . PRO A 1 400 ? 29.648 74.988 30.422 1.00 72.21 ? 429 PRO A HB2 1 ATOM 5788 H HB3 . PRO A 1 400 ? 30.842 75.848 29.797 1.00 72.21 ? 429 PRO A HB3 1 ATOM 5789 H HG2 . PRO A 1 400 ? 28.543 76.792 31.081 1.00 73.09 ? 429 PRO A HG2 1 ATOM 5790 H HG3 . PRO A 1 400 ? 30.040 77.308 31.271 1.00 73.09 ? 429 PRO A HG3 1 ATOM 5791 H HD2 . PRO A 1 400 ? 28.360 78.561 29.758 1.00 71.48 ? 429 PRO A HD2 1 ATOM 5792 H HD3 . PRO A 1 400 ? 29.937 78.608 29.476 1.00 71.48 ? 429 PRO A HD3 1 ATOM 5793 N N . HIS A 1 401 ? 26.741 75.759 28.827 1.00 44.26 ? 430 HIS A N 1 ATOM 5794 C CA . HIS A 1 401 ? 25.431 75.143 29.023 1.00 40.01 ? 430 HIS A CA 1 ATOM 5795 C C . HIS A 1 401 ? 24.489 75.372 27.843 1.00 36.72 ? 430 HIS A C 1 ATOM 5796 O O . HIS A 1 401 ? 23.401 74.797 27.794 1.00 28.25 ? 430 HIS A O 1 ATOM 5797 C CB . HIS A 1 401 ? 24.792 75.680 30.304 1.00 39.91 ? 430 HIS A CB 1 ATOM 5798 C CG . HIS A 1 401 ? 25.571 75.367 31.543 1.00 41.69 ? 430 HIS A CG 1 ATOM 5799 N ND1 . HIS A 1 401 ? 25.224 75.855 32.785 1.00 43.75 ? 430 HIS A ND1 1 ATOM 5800 C CD2 . HIS A 1 401 ? 26.681 74.613 31.733 1.00 42.86 ? 430 HIS A CD2 1 ATOM 5801 C CE1 . HIS A 1 401 ? 26.086 75.416 33.685 1.00 46.30 ? 430 HIS A CE1 1 ATOM 5802 N NE2 . HIS A 1 401 ? 26.980 74.661 33.072 1.00 45.70 ? 430 HIS A NE2 1 ATOM 5803 H H . HIS A 1 401 ? 26.723 76.619 28.835 1.00 53.11 ? 430 HIS A H 1 ATOM 5804 H HA . HIS A 1 401 ? 25.549 74.186 29.128 1.00 48.02 ? 430 HIS A HA 1 ATOM 5805 H HB2 . HIS A 1 401 ? 24.718 76.645 30.236 1.00 47.89 ? 430 HIS A HB2 1 ATOM 5806 H HB3 . HIS A 1 401 ? 23.910 75.288 30.401 1.00 47.89 ? 430 HIS A HB3 1 ATOM 5807 H HD2 . HIS A 1 401 ? 27.152 74.151 31.078 1.00 51.43 ? 430 HIS A HD2 1 ATOM 5808 H HE1 . HIS A 1 401 ? 26.066 75.607 34.595 1.00 55.57 ? 430 HIS A HE1 1 ATOM 5809 N N . CYS A 1 402 ? 24.905 76.214 26.900 1.00 45.70 ? 431 CYS A N 1 ATOM 5810 C CA . CYS A 1 402 ? 24.098 76.515 25.721 1.00 42.12 ? 431 CYS A CA 1 ATOM 5811 C C . CYS A 1 402 ? 22.746 77.102 26.112 1.00 41.38 ? 431 CYS A C 1 ATOM 5812 O O . CYS A 1 402 ? 21.732 76.805 25.484 1.00 42.14 ? 431 CYS A O 1 ATOM 5813 C CB . CYS A 1 402 ? 23.889 75.256 24.873 1.00 40.51 ? 431 CYS A CB 1 ATOM 5814 S SG . CYS A 1 402 ? 25.407 74.356 24.494 1.00 33.66 ? 431 CYS A SG 1 ATOM 5815 H H . CYS A 1 402 ? 25.659 76.628 26.921 1.00 54.84 ? 431 CYS A H 1 ATOM 5816 H HA . CYS A 1 402 ? 24.563 77.169 25.177 1.00 50.55 ? 431 CYS A HA 1 ATOM 5817 H HB2 . CYS A 1 402 ? 23.301 74.652 25.353 1.00 48.62 ? 431 CYS A HB2 1 ATOM 5818 H HB3 . CYS A 1 402 ? 23.480 75.512 24.032 1.00 48.62 ? 431 CYS A HB3 1 ATOM 5819 N N . ASP A 1 403 ? 22.738 77.933 27.151 1.00 46.13 ? 432 ASP A N 1 ATOM 5820 C CA . ASP A 1 403 ? 21.496 78.452 27.720 1.00 44.39 ? 432 ASP A CA 1 ATOM 5821 C C . ASP A 1 403 ? 21.258 79.926 27.396 1.00 42.86 ? 432 ASP A C 1 ATOM 5822 O O . ASP A 1 403 ? 20.406 80.570 28.008 1.00 42.34 ? 432 ASP A O 1 ATOM 5823 C CB . ASP A 1 403 ? 21.503 78.258 29.236 1.00 45.87 ? 432 ASP A CB 1 ATOM 5824 C CG . ASP A 1 403 ? 22.634 79.004 29.911 1.00 46.97 ? 432 ASP A CG 1 ATOM 5825 O OD1 . ASP A 1 403 ? 23.626 79.326 29.225 1.00 45.75 ? 432 ASP A OD1 1 ATOM 5826 O OD2 . ASP A 1 403 ? 22.532 79.265 31.128 1.00 49.33 ? 432 ASP A OD2 1 ATOM 5827 H H . ASP A 1 403 ? 23.447 78.215 27.548 1.00 55.36 ? 432 ASP A H 1 ATOM 5828 H HA . ASP A 1 403 ? 20.751 77.945 27.360 1.00 53.27 ? 432 ASP A HA 1 ATOM 5829 H HB2 . ASP A 1 403 ? 20.666 78.585 29.601 1.00 55.05 ? 432 ASP A HB2 1 ATOM 5830 H HB3 . ASP A 1 403 ? 21.605 77.314 29.434 1.00 55.05 ? 432 ASP A HB3 1 ATOM 5831 N N . ARG A 1 404 ? 22.008 80.458 26.437 1.00 38.45 ? 433 ARG A N 1 ATOM 5832 C CA . ARG A 1 404 ? 21.876 81.861 26.059 1.00 38.71 ? 433 ARG A CA 1 ATOM 5833 C C . ARG A 1 404 ? 22.553 82.133 24.724 1.00 36.62 ? 433 ARG A C 1 ATOM 5834 O O . ARG A 1 404 ? 23.486 81.430 24.335 1.00 36.31 ? 433 ARG A O 1 ATOM 5835 C CB . ARG A 1 404 ? 22.468 82.764 27.141 1.00 41.06 ? 433 ARG A CB 1 ATOM 5836 C CG . ARG A 1 404 ? 23.966 82.595 27.333 1.00 42.31 ? 433 ARG A CG 1 ATOM 5837 C CD . ARG A 1 404 ? 24.432 83.218 28.637 1.00 44.87 ? 433 ARG A CD 1 ATOM 5838 N NE . ARG A 1 404 ? 23.853 82.548 29.799 1.00 45.88 ? 433 ARG A NE 1 ATOM 5839 C CZ . ARG A 1 404 ? 24.104 82.883 31.060 1.00 47.87 ? 433 ARG A CZ 1 ATOM 5840 N NH1 . ARG A 1 404 ? 24.927 83.886 31.336 1.00 49.76 ? 433 ARG A NH1 1 ATOM 5841 N NH2 . ARG A 1 404 ? 23.529 82.214 32.050 1.00 48.26 ? 433 ARG A NH2 1 ATOM 5842 H H . ARG A 1 404 ? 22.602 80.028 25.988 1.00 46.14 ? 433 ARG A H 1 ATOM 5843 H HA . ARG A 1 404 ? 20.934 82.078 25.969 1.00 46.45 ? 433 ARG A HA 1 ATOM 5844 H HB2 . ARG A 1 404 ? 22.304 83.689 26.900 1.00 49.27 ? 433 ARG A HB2 1 ATOM 5845 H HB3 . ARG A 1 404 ? 22.037 82.563 27.986 1.00 49.27 ? 433 ARG A HB3 1 ATOM 5846 H HG2 . ARG A 1 404 ? 24.181 81.649 27.353 1.00 50.78 ? 433 ARG A HG2 1 ATOM 5847 H HG3 . ARG A 1 404 ? 24.434 83.030 26.603 1.00 50.78 ? 433 ARG A HG3 1 ATOM 5848 H HD2 . ARG A 1 404 ? 25.397 83.148 28.696 1.00 53.84 ? 433 ARG A HD2 1 ATOM 5849 H HD3 . ARG A 1 404 ? 24.162 84.149 28.659 1.00 53.84 ? 433 ARG A HD3 1 ATOM 5850 H HE . ARG A 1 404 ? 23.314 81.893 29.657 1.00 55.06 ? 433 ARG A HE 1 ATOM 5851 H HH11 . ARG A 1 404 ? 25.302 84.323 30.697 1.00 59.72 ? 433 ARG A HH11 1 ATOM 5852 H HH12 . ARG A 1 404 ? 25.086 84.099 32.154 1.00 59.72 ? 433 ARG A HH12 1 ATOM 5853 H HH21 . ARG A 1 404 ? 22.995 81.563 31.876 1.00 57.92 ? 433 ARG A HH21 1 ATOM 5854 H HH22 . ARG A 1 404 ? 23.691 82.430 32.867 1.00 57.92 ? 433 ARG A HH22 1 ATOM 5855 N N . CYS A 1 405 ? 22.079 83.161 24.029 1.00 28.72 ? 434 CYS A N 1 ATOM 5856 C CA . CYS A 1 405 ? 22.563 83.465 22.689 1.00 28.94 ? 434 CYS A CA 1 ATOM 5857 C C . CYS A 1 405 ? 24.008 83.944 22.694 1.00 29.68 ? 434 CYS A C 1 ATOM 5858 O O . CYS A 1 405 ? 24.431 84.697 23.571 1.00 30.53 ? 434 CYS A O 1 ATOM 5859 C CB . CYS A 1 405 ? 21.671 84.517 22.026 1.00 29.88 ? 434 CYS A CB 1 ATOM 5860 S SG . CYS A 1 405 ? 20.075 83.882 21.456 1.00 72.21 ? 434 CYS A SG 1 ATOM 5861 H H . CYS A 1 405 ? 21.473 83.700 24.313 1.00 34.46 ? 434 CYS A H 1 ATOM 5862 H HA . CYS A 1 405 ? 22.520 82.659 22.152 1.00 34.73 ? 434 CYS A HA 1 ATOM 5863 H HB2 . CYS A 1 405 ? 21.495 85.225 22.666 1.00 35.85 ? 434 CYS A HB2 1 ATOM 5864 H HB3 . CYS A 1 405 ? 22.136 84.880 21.256 1.00 35.85 ? 434 CYS A HB3 1 ATOM 5865 N N . MET A 1 406 ? 24.756 83.486 21.697 1.00 39.80 ? 435 MET A N 1 ATOM 5866 C CA . MET A 1 406 ? 26.130 83.909 21.479 1.00 40.88 ? 435 MET A CA 1 ATOM 5867 C C . MET A 1 406 ? 26.165 85.414 21.247 1.00 42.46 ? 435 MET A C 1 ATOM 5868 O O . MET A 1 406 ? 25.157 86.008 20.865 1.00 42.71 ? 435 MET A O 1 ATOM 5869 C CB . MET A 1 406 ? 26.717 83.153 20.284 1.00 40.94 ? 435 MET A CB 1 ATOM 5870 C CG . MET A 1 406 ? 28.230 83.220 20.142 1.00 42.15 ? 435 MET A CG 1 ATOM 5871 S SD . MET A 1 406 ? 28.838 82.165 18.806 1.00 56.57 ? 435 MET A SD 1 ATOM 5872 C CE . MET A 1 406 ? 28.359 80.537 19.380 1.00 90.55 ? 435 MET A CE 1 ATOM 5873 H H . MET A 1 406 ? 24.480 82.913 21.118 1.00 47.76 ? 435 MET A H 1 ATOM 5874 H HA . MET A 1 406 ? 26.659 83.694 22.263 1.00 49.05 ? 435 MET A HA 1 ATOM 5875 H HB2 . MET A 1 406 ? 26.474 82.218 20.364 1.00 49.13 ? 435 MET A HB2 1 ATOM 5876 H HB3 . MET A 1 406 ? 26.333 83.519 19.472 1.00 49.13 ? 435 MET A HB3 1 ATOM 5877 H HG2 . MET A 1 406 ? 28.491 84.134 19.948 1.00 50.59 ? 435 MET A HG2 1 ATOM 5878 H HG3 . MET A 1 406 ? 28.640 82.925 20.970 1.00 50.59 ? 435 MET A HG3 1 ATOM 5879 H HE1 . MET A 1 406 ? 28.641 79.877 18.727 1.00 108.66 ? 435 MET A HE1 1 ATOM 5880 H HE2 . MET A 1 406 ? 28.789 80.364 20.233 1.00 108.66 ? 435 MET A HE2 1 ATOM 5881 H HE3 . MET A 1 406 ? 27.395 80.510 19.483 1.00 108.66 ? 435 MET A HE3 1 ATOM 5882 N N . VAL A 1 407 ? 27.316 86.035 21.487 1.00 44.73 ? 436 VAL A N 1 ATOM 5883 C CA . VAL A 1 407 ? 27.451 87.477 21.298 1.00 46.62 ? 436 VAL A CA 1 ATOM 5884 C C . VAL A 1 407 ? 27.211 87.829 19.833 1.00 47.48 ? 436 VAL A C 1 ATOM 5885 O O . VAL A 1 407 ? 27.887 87.312 18.943 1.00 48.70 ? 436 VAL A O 1 ATOM 5886 C CB . VAL A 1 407 ? 28.844 87.990 21.731 1.00 48.29 ? 436 VAL A CB 1 ATOM 5887 C CG1 . VAL A 1 407 ? 28.925 89.506 21.594 1.00 50.53 ? 436 VAL A CG1 1 ATOM 5888 C CG2 . VAL A 1 407 ? 29.149 87.574 23.166 1.00 47.80 ? 436 VAL A CG2 1 ATOM 5889 H H . VAL A 1 407 ? 28.033 85.645 21.760 1.00 53.67 ? 436 VAL A H 1 ATOM 5890 H HA . VAL A 1 407 ? 26.781 87.932 21.832 1.00 55.94 ? 436 VAL A HA 1 ATOM 5891 H HB . VAL A 1 407 ? 29.519 87.599 21.155 1.00 57.95 ? 436 VAL A HB 1 ATOM 5892 H HG11 . VAL A 1 407 ? 29.807 89.801 21.871 1.00 60.64 ? 436 VAL A HG11 1 ATOM 5893 H HG12 . VAL A 1 407 ? 28.772 89.747 20.667 1.00 60.64 ? 436 VAL A HG12 1 ATOM 5894 H HG13 . VAL A 1 407 ? 28.248 89.911 22.158 1.00 60.64 ? 436 VAL A HG13 1 ATOM 5895 H HG21 . VAL A 1 407 ? 30.026 87.908 23.411 1.00 57.35 ? 436 VAL A HG21 1 ATOM 5896 H HG22 . VAL A 1 407 ? 28.475 87.951 23.754 1.00 57.35 ? 436 VAL A HG22 1 ATOM 5897 H HG23 . VAL A 1 407 ? 29.135 86.606 23.224 1.00 57.35 ? 436 VAL A HG23 1 ATOM 5898 N N . GLY A 1 408 ? 26.244 88.708 19.592 1.00 49.87 ? 437 GLY A N 1 ATOM 5899 C CA . GLY A 1 408 ? 25.893 89.114 18.242 1.00 52.74 ? 437 GLY A CA 1 ATOM 5900 C C . GLY A 1 408 ? 24.792 88.263 17.633 1.00 53.59 ? 437 GLY A C 1 ATOM 5901 O O . GLY A 1 408 ? 24.661 88.191 16.410 1.00 55.74 ? 437 GLY A O 1 ATOM 5902 H H . GLY A 1 408 ? 25.772 89.087 20.203 1.00 59.85 ? 437 GLY A H 1 ATOM 5903 H HA2 . GLY A 1 408 ? 25.595 90.037 18.252 1.00 63.29 ? 437 GLY A HA2 1 ATOM 5904 H HA3 . GLY A 1 408 ? 26.677 89.052 17.674 1.00 63.29 ? 437 GLY A HA3 1 ATOM 5905 N N . TYR A 1 409 ? 24.002 87.617 18.487 1.00 42.89 ? 438 TYR A N 1 ATOM 5906 C CA . TYR A 1 409 ? 22.861 86.817 18.046 1.00 42.48 ? 438 TYR A CA 1 ATOM 5907 C C . TYR A 1 409 ? 21.664 87.070 18.956 1.00 41.94 ? 438 TYR A C 1 ATOM 5908 O O . TYR A 1 409 ? 21.815 87.587 20.064 1.00 42.17 ? 438 TYR A O 1 ATOM 5909 C CB . TYR A 1 409 ? 23.210 85.326 18.033 1.00 41.83 ? 438 TYR A CB 1 ATOM 5910 C CG . TYR A 1 409 ? 24.195 84.923 16.954 1.00 43.81 ? 438 TYR A CG 1 ATOM 5911 C CD1 . TYR A 1 409 ? 25.562 85.104 17.127 1.00 44.77 ? 438 TYR A CD1 1 ATOM 5912 C CD2 . TYR A 1 409 ? 23.757 84.352 15.766 1.00 44.47 ? 438 TYR A CD2 1 ATOM 5913 C CE1 . TYR A 1 409 ? 26.464 84.735 16.145 1.00 45.88 ? 438 TYR A CE1 1 ATOM 5914 C CE2 . TYR A 1 409 ? 24.651 83.979 14.779 1.00 45.71 ? 438 TYR A CE2 1 ATOM 5915 C CZ . TYR A 1 409 ? 26.003 84.172 14.973 1.00 46.47 ? 438 TYR A CZ 1 ATOM 5916 O OH . TYR A 1 409 ? 26.896 83.802 13.992 1.00 47.86 ? 438 TYR A OH 1 ATOM 5917 H H . TYR A 1 409 ? 24.108 87.627 19.341 1.00 51.47 ? 438 TYR A H 1 ATOM 5918 H HA . TYR A 1 409 ? 22.618 87.079 17.144 1.00 50.97 ? 438 TYR A HA 1 ATOM 5919 H HB2 . TYR A 1 409 ? 23.600 85.090 18.890 1.00 50.19 ? 438 TYR A HB2 1 ATOM 5920 H HB3 . TYR A 1 409 ? 22.396 84.817 17.893 1.00 50.19 ? 438 TYR A HB3 1 ATOM 5921 H HD1 . TYR A 1 409 ? 25.876 85.484 17.916 1.00 53.72 ? 438 TYR A HD1 1 ATOM 5922 H HD2 . TYR A 1 409 ? 22.846 84.220 15.631 1.00 53.36 ? 438 TYR A HD2 1 ATOM 5923 H HE1 . TYR A 1 409 ? 27.375 84.865 16.274 1.00 55.06 ? 438 TYR A HE1 1 ATOM 5924 H HE2 . TYR A 1 409 ? 24.342 83.600 13.988 1.00 54.85 ? 438 TYR A HE2 1 ATOM 5925 H HH . TYR A 1 409 ? 26.484 83.475 13.337 1.00 57.43 ? 438 TYR A HH 1 ATOM 5926 N N . TRP A 1 410 ? 20.475 86.702 18.487 1.00 43.69 ? 439 TRP A N 1 ATOM 5927 C CA . TRP A 1 410 ? 19.248 86.961 19.231 1.00 43.28 ? 439 TRP A CA 1 ATOM 5928 C C . TRP A 1 410 ? 18.191 85.900 18.949 1.00 42.74 ? 439 TRP A C 1 ATOM 5929 O O . TRP A 1 410 ? 18.361 85.059 18.068 1.00 43.60 ? 439 TRP A O 1 ATOM 5930 C CB . TRP A 1 410 ? 18.697 88.344 18.882 1.00 44.10 ? 439 TRP A CB 1 ATOM 5931 C CG . TRP A 1 410 ? 18.002 88.397 17.555 1.00 44.13 ? 439 TRP A CG 1 ATOM 5932 C CD1 . TRP A 1 410 ? 18.587 88.469 16.324 1.00 45.09 ? 439 TRP A CD1 1 ATOM 5933 C CD2 . TRP A 1 410 ? 16.587 88.388 17.326 1.00 44.31 ? 439 TRP A CD2 1 ATOM 5934 N NE1 . TRP A 1 410 ? 17.625 88.504 15.343 1.00 46.26 ? 439 TRP A NE1 1 ATOM 5935 C CE2 . TRP A 1 410 ? 16.389 88.455 15.932 1.00 45.96 ? 439 TRP A CE2 1 ATOM 5936 C CE3 . TRP A 1 410 ? 15.469 88.329 18.164 1.00 43.41 ? 439 TRP A CE3 1 ATOM 5937 C CZ2 . TRP A 1 410 ? 15.119 88.466 15.358 1.00 47.16 ? 439 TRP A CZ2 1 ATOM 5938 C CZ3 . TRP A 1 410 ? 14.209 88.339 17.592 1.00 44.62 ? 439 TRP A CZ3 1 ATOM 5939 C CH2 . TRP A 1 410 ? 14.045 88.406 16.203 1.00 46.43 ? 439 TRP A CH2 1 ATOM 5940 H H . TRP A 1 410 ? 20.353 86.299 17.737 1.00 52.43 ? 439 TRP A H 1 ATOM 5941 H HA . TRP A 1 410 ? 19.444 86.946 20.181 1.00 51.94 ? 439 TRP A HA 1 ATOM 5942 H HB2 . TRP A 1 410 ? 18.057 88.607 19.562 1.00 52.92 ? 439 TRP A HB2 1 ATOM 5943 H HB3 . TRP A 1 410 ? 19.431 88.976 18.858 1.00 52.92 ? 439 TRP A HB3 1 ATOM 5944 H HD1 . TRP A 1 410 ? 19.504 88.491 16.172 1.00 54.11 ? 439 TRP A HD1 1 ATOM 5945 H HE1 . TRP A 1 410 ? 17.774 88.549 14.497 1.00 55.51 ? 439 TRP A HE1 1 ATOM 5946 H HE3 . TRP A 1 410 ? 15.570 88.284 19.088 1.00 52.09 ? 439 TRP A HE3 1 ATOM 5947 H HZ2 . TRP A 1 410 ? 15.006 88.510 14.436 1.00 56.60 ? 439 TRP A HZ2 1 ATOM 5948 H HZ3 . TRP A 1 410 ? 13.459 88.300 18.140 1.00 53.54 ? 439 TRP A HZ3 1 ATOM 5949 H HH2 . TRP A 1 410 ? 13.186 88.411 15.847 1.00 55.72 ? 439 TRP A HH2 1 ATOM 5950 N N . GLY A 1 411 ? 17.101 85.948 19.707 1.00 44.35 ? 440 GLY A N 1 ATOM 5951 C CA . GLY A 1 411 ? 16.010 85.008 19.538 1.00 43.40 ? 440 GLY A CA 1 ATOM 5952 C C . GLY A 1 411 ? 16.421 83.581 19.844 1.00 41.86 ? 440 GLY A C 1 ATOM 5953 O O . GLY A 1 411 ? 16.443 82.731 18.954 1.00 41.98 ? 440 GLY A O 1 ATOM 5954 H H . GLY A 1 411 ? 16.971 86.525 20.332 1.00 53.23 ? 440 GLY A H 1 ATOM 5955 H HA2 . GLY A 1 411 ? 15.280 85.251 20.129 1.00 52.08 ? 440 GLY A HA2 1 ATOM 5956 H HA3 . GLY A 1 411 ? 15.690 85.046 18.623 1.00 52.08 ? 440 GLY A HA3 1 ATOM 5957 N N . PHE A 1 412 ? 16.755 83.322 21.106 1.00 37.08 ? 441 PHE A N 1 ATOM 5958 C CA . PHE A 1 412 ? 17.107 81.978 21.549 1.00 36.32 ? 441 PHE A CA 1 ATOM 5959 C C . PHE A 1 412 ? 15.938 81.038 21.292 1.00 36.05 ? 441 PHE A C 1 ATOM 5960 O O . PHE A 1 412 ? 14.804 81.334 21.665 1.00 33.47 ? 441 PHE A O 1 ATOM 5961 C CB . PHE A 1 412 ? 17.483 81.982 23.035 1.00 36.92 ? 441 PHE A CB 1 ATOM 5962 C CG . PHE A 1 412 ? 17.963 80.652 23.548 1.00 36.74 ? 441 PHE A CG 1 ATOM 5963 C CD1 . PHE A 1 412 ? 19.252 80.216 23.285 1.00 35.97 ? 441 PHE A CD1 1 ATOM 5964 C CD2 . PHE A 1 412 ? 17.130 79.844 24.304 1.00 37.34 ? 441 PHE A CD2 1 ATOM 5965 C CE1 . PHE A 1 412 ? 19.697 78.996 23.759 1.00 34.99 ? 441 PHE A CE1 1 ATOM 5966 C CE2 . PHE A 1 412 ? 17.571 78.622 24.781 1.00 36.44 ? 441 PHE A CE2 1 ATOM 5967 C CZ . PHE A 1 412 ? 18.856 78.199 24.507 1.00 35.21 ? 441 PHE A CZ 1 ATOM 5968 H H . PHE A 1 412 ? 16.785 83.914 21.729 1.00 44.50 ? 441 PHE A H 1 ATOM 5969 H HA . PHE A 1 412 ? 17.871 81.662 21.042 1.00 43.58 ? 441 PHE A HA 1 ATOM 5970 H HB2 . PHE A 1 412 ? 18.193 82.627 23.175 1.00 44.31 ? 441 PHE A HB2 1 ATOM 5971 H HB3 . PHE A 1 412 ? 16.703 82.235 23.554 1.00 44.31 ? 441 PHE A HB3 1 ATOM 5972 H HD1 . PHE A 1 412 ? 19.823 80.749 22.780 1.00 43.17 ? 441 PHE A HD1 1 ATOM 5973 H HD2 . PHE A 1 412 ? 16.263 80.124 24.491 1.00 44.81 ? 441 PHE A HD2 1 ATOM 5974 H HE1 . PHE A 1 412 ? 20.563 78.713 23.574 1.00 41.98 ? 441 PHE A HE1 1 ATOM 5975 H HE2 . PHE A 1 412 ? 17.002 78.086 25.285 1.00 43.73 ? 441 PHE A HE2 1 ATOM 5976 H HZ . PHE A 1 412 ? 19.154 77.378 24.827 1.00 42.25 ? 441 PHE A HZ 1 ATOM 5977 N N . GLY A 1 413 ? 16.213 79.907 20.650 1.00 39.20 ? 442 GLY A N 1 ATOM 5978 C CA . GLY A 1 413 ? 15.160 78.989 20.263 1.00 40.38 ? 442 GLY A CA 1 ATOM 5979 C C . GLY A 1 413 ? 15.652 77.602 19.902 1.00 40.66 ? 442 GLY A C 1 ATOM 5980 O O . GLY A 1 413 ? 16.838 77.293 20.015 1.00 39.41 ? 442 GLY A O 1 ATOM 5981 H H . GLY A 1 413 ? 17.004 79.652 20.428 1.00 47.05 ? 442 GLY A H 1 ATOM 5982 H HA2 . GLY A 1 413 ? 14.528 78.904 20.994 1.00 48.46 ? 442 GLY A HA2 1 ATOM 5983 H HA3 . GLY A 1 413 ? 14.688 79.351 19.496 1.00 48.46 ? 442 GLY A HA3 1 ATOM 5984 N N . ASP A 1 414 ? 14.720 76.768 19.453 1.00 39.04 ? 443 ASP A N 1 ATOM 5985 C CA . ASP A 1 414 ? 14.990 75.360 19.183 1.00 39.23 ? 443 ASP A CA 1 ATOM 5986 C C . ASP A 1 414 ? 15.907 75.147 17.977 1.00 40.91 ? 443 ASP A C 1 ATOM 5987 O O . ASP A 1 414 ? 16.293 74.015 17.683 1.00 43.03 ? 443 ASP A O 1 ATOM 5988 C CB . ASP A 1 414 ? 13.662 74.623 18.973 1.00 38.45 ? 443 ASP A CB 1 ATOM 5989 C CG . ASP A 1 414 ? 13.797 73.116 19.086 1.00 36.55 ? 443 ASP A CG 1 ATOM 5990 O OD1 . ASP A 1 414 ? 14.773 72.638 19.701 1.00 36.57 ? 443 ASP A OD1 1 ATOM 5991 O OD2 . ASP A 1 414 ? 12.915 72.405 18.560 1.00 35.53 ? 443 ASP A OD2 1 ATOM 5992 H H . ASP A 1 414 ? 13.907 76.998 19.294 1.00 46.85 ? 443 ASP A H 1 ATOM 5993 H HA . ASP A 1 414 ? 15.425 74.972 19.958 1.00 47.08 ? 443 ASP A HA 1 ATOM 5994 H HB2 . ASP A 1 414 ? 13.028 74.918 19.645 1.00 46.14 ? 443 ASP A HB2 1 ATOM 5995 H HB3 . ASP A 1 414 ? 13.325 74.828 18.086 1.00 46.14 ? 443 ASP A HB3 1 ATOM 5996 N N . TYR A 1 415 ? 16.256 76.230 17.288 1.00 31.56 ? 444 TYR A N 1 ATOM 5997 C CA . TYR A 1 415 ? 17.135 76.156 16.123 1.00 31.48 ? 444 TYR A CA 1 ATOM 5998 C C . TYR A 1 415 ? 18.371 77.036 16.300 1.00 30.85 ? 444 TYR A C 1 ATOM 5999 O O . TYR A 1 415 ? 19.099 77.300 15.342 1.00 31.58 ? 444 TYR A O 1 ATOM 6000 C CB . TYR A 1 415 ? 16.375 76.563 14.858 1.00 34.91 ? 444 TYR A CB 1 ATOM 6001 C CG . TYR A 1 415 ? 15.154 75.714 14.584 1.00 38.08 ? 444 TYR A CG 1 ATOM 6002 C CD1 . TYR A 1 415 ? 15.262 74.501 13.917 1.00 39.81 ? 444 TYR A CD1 1 ATOM 6003 C CD2 . TYR A 1 415 ? 13.892 76.126 14.992 1.00 39.62 ? 444 TYR A CD2 1 ATOM 6004 C CE1 . TYR A 1 415 ? 14.148 73.721 13.664 1.00 41.47 ? 444 TYR A CE1 1 ATOM 6005 C CE2 . TYR A 1 415 ? 12.772 75.354 14.744 1.00 41.30 ? 444 TYR A CE2 1 ATOM 6006 C CZ . TYR A 1 415 ? 12.906 74.153 14.080 1.00 41.81 ? 444 TYR A CZ 1 ATOM 6007 O OH . TYR A 1 415 ? 11.793 73.383 13.831 1.00 42.75 ? 444 TYR A OH 1 ATOM 6008 H H . TYR A 1 415 ? 15.995 77.027 17.476 1.00 37.87 ? 444 TYR A H 1 ATOM 6009 H HA . TYR A 1 415 ? 17.434 75.240 16.011 1.00 37.77 ? 444 TYR A HA 1 ATOM 6010 H HB2 . TYR A 1 415 ? 16.083 77.483 14.952 1.00 41.90 ? 444 TYR A HB2 1 ATOM 6011 H HB3 . TYR A 1 415 ? 16.970 76.482 14.096 1.00 41.90 ? 444 TYR A HB3 1 ATOM 6012 H HD1 . TYR A 1 415 ? 16.099 74.207 13.636 1.00 47.77 ? 444 TYR A HD1 1 ATOM 6013 H HD2 . TYR A 1 415 ? 13.799 76.935 15.440 1.00 47.54 ? 444 TYR A HD2 1 ATOM 6014 H HE1 . TYR A 1 415 ? 14.236 72.911 13.216 1.00 49.77 ? 444 TYR A HE1 1 ATOM 6015 H HE2 . TYR A 1 415 ? 11.934 75.643 15.023 1.00 49.57 ? 444 TYR A HE2 1 ATOM 6016 H HH . TYR A 1 415 ? 11.107 73.761 14.136 1.00 51.30 ? 444 TYR A HH 1 ATOM 6017 N N . GLY A 1 416 ? 18.602 77.481 17.532 1.00 43.50 ? 445 GLY A N 1 ATOM 6018 C CA . GLY A 1 416 ? 19.736 78.333 17.844 1.00 43.98 ? 445 GLY A CA 1 ATOM 6019 C C . GLY A 1 416 ? 19.319 79.779 18.021 1.00 45.18 ? 445 GLY A C 1 ATOM 6020 O O . GLY A 1 416 ? 18.291 80.062 18.638 1.00 43.90 ? 445 GLY A O 1 ATOM 6021 H H . GLY A 1 416 ? 18.108 77.298 18.211 1.00 52.20 ? 445 GLY A H 1 ATOM 6022 H HA2 . GLY A 1 416 ? 20.155 78.029 18.664 1.00 52.78 ? 445 GLY A HA2 1 ATOM 6023 H HA3 . GLY A 1 416 ? 20.387 78.284 17.127 1.00 52.78 ? 445 GLY A HA3 1 ATOM 6024 N N . CYS A 1 417 ? 20.121 80.692 17.480 1.00 42.29 ? 446 CYS A N 1 ATOM 6025 C CA . CYS A 1 417 ? 19.836 82.121 17.556 1.00 46.01 ? 446 CYS A CA 1 ATOM 6026 C C . CYS A 1 417 ? 20.044 82.791 16.202 1.00 51.15 ? 446 CYS A C 1 ATOM 6027 O O . CYS A 1 417 ? 21.043 82.550 15.526 1.00 51.21 ? 446 CYS A O 1 ATOM 6028 C CB . CYS A 1 417 ? 20.723 82.792 18.608 1.00 45.10 ? 446 CYS A CB 1 ATOM 6029 S SG . CYS A 1 417 ? 20.440 82.245 20.307 1.00 31.86 ? 446 CYS A SG 1 ATOM 6030 H H . CYS A 1 417 ? 20.846 80.505 17.056 1.00 50.75 ? 446 CYS A H 1 ATOM 6031 H HA . CYS A 1 417 ? 18.910 82.247 17.816 1.00 55.21 ? 446 CYS A HA 1 ATOM 6032 H HB2 . CYS A 1 417 ? 21.650 82.608 18.392 1.00 54.12 ? 446 CYS A HB2 1 ATOM 6033 H HB3 . CYS A 1 417 ? 20.566 83.749 18.578 1.00 54.12 ? 446 CYS A HB3 1 ATOM 6034 N N . ARG A 1 418 ? 19.094 83.636 15.815 1.00 72.28 ? 447 ARG A N 1 ATOM 6035 C CA . ARG A 1 418 ? 19.194 84.372 14.562 1.00 74.95 ? 447 ARG A CA 1 ATOM 6036 C C . ARG A 1 418 ? 20.358 85.358 14.617 1.00 74.94 ? 447 ARG A C 1 ATOM 6037 O O . ARG A 1 418 ? 20.559 86.016 15.638 1.00 74.25 ? 447 ARG A O 1 ATOM 6038 C CB . ARG A 1 418 ? 17.895 85.127 14.268 1.00 76.49 ? 447 ARG A CB 1 ATOM 6039 C CG . ARG A 1 418 ? 16.646 84.261 14.221 1.00 76.41 ? 447 ARG A CG 1 ATOM 6040 C CD . ARG A 1 418 ? 15.433 85.084 13.812 1.00 78.71 ? 447 ARG A CD 1 ATOM 6041 N NE . ARG A 1 418 ? 14.184 84.331 13.908 1.00 79.35 ? 447 ARG A NE 1 ATOM 6042 C CZ . ARG A 1 418 ? 13.424 84.257 14.998 1.00 79.22 ? 447 ARG A CZ 1 ATOM 6043 N NH1 . ARG A 1 418 ? 13.774 84.889 16.112 1.00 78.37 ? 447 ARG A NH1 1 ATOM 6044 N NH2 . ARG A 1 418 ? 12.305 83.545 14.976 1.00 79.83 ? 447 ARG A NH2 1 ATOM 6045 H H . ARG A 1 418 ? 18.379 83.801 16.263 1.00 86.74 ? 447 ARG A H 1 ATOM 6046 H HA . ARG A 1 418 ? 19.355 83.749 13.836 1.00 89.94 ? 447 ARG A HA 1 ATOM 6047 H HB2 . ARG A 1 418 ? 17.762 85.794 14.960 1.00 91.79 ? 447 ARG A HB2 1 ATOM 6048 H HB3 . ARG A 1 418 ? 17.980 85.564 13.406 1.00 91.79 ? 447 ARG A HB3 1 ATOM 6049 H HG2 . ARG A 1 418 ? 16.770 83.553 13.569 1.00 91.69 ? 447 ARG A HG2 1 ATOM 6050 H HG3 . ARG A 1 418 ? 16.480 83.886 15.100 1.00 91.69 ? 447 ARG A HG3 1 ATOM 6051 H HD2 . ARG A 1 418 ? 15.364 85.856 14.395 1.00 94.46 ? 447 ARG A HD2 1 ATOM 6052 H HD3 . ARG A 1 418 ? 15.541 85.371 12.892 1.00 94.46 ? 447 ARG A HD3 1 ATOM 6053 H HE . ARG A 1 418 ? 13.921 83.904 13.209 1.00 95.22 ? 447 ARG A HE 1 ATOM 6054 H HH11 . ARG A 1 418 ? 14.497 85.353 16.135 1.00 94.04 ? 447 ARG A HH11 1 ATOM 6055 H HH12 . ARG A 1 418 ? 13.276 84.835 16.812 1.00 94.04 ? 447 ARG A HH12 1 ATOM 6056 H HH21 . ARG A 1 418 ? 12.072 83.132 14.259 1.00 95.80 ? 447 ARG A HH21 1 ATOM 6057 H HH22 . ARG A 1 418 ? 11.813 83.495 15.680 1.00 95.80 ? 447 ARG A HH22 1 ATOM 6058 N N . PRO A 1 419 ? 21.138 85.464 13.528 1.00 60.71 ? 448 PRO A N 1 ATOM 6059 C CA . PRO A 1 419 ? 22.138 86.538 13.487 1.00 62.33 ? 448 PRO A CA 1 ATOM 6060 C C . PRO A 1 419 ? 21.486 87.914 13.401 1.00 66.58 ? 448 PRO A C 1 ATOM 6061 O O . PRO A 1 419 ? 20.611 88.118 12.558 1.00 65.71 ? 448 PRO A O 1 ATOM 6062 C CB . PRO A 1 419 ? 22.939 86.237 12.213 1.00 62.32 ? 448 PRO A CB 1 ATOM 6063 C CG . PRO A 1 419 ? 22.651 84.813 11.888 1.00 60.67 ? 448 PRO A CG 1 ATOM 6064 C CD . PRO A 1 419 ? 21.268 84.547 12.383 1.00 60.28 ? 448 PRO A CD 1 ATOM 6065 H HA . PRO A 1 419 ? 22.722 86.496 14.261 1.00 74.80 ? 448 PRO A HA 1 ATOM 6066 H HB2 . PRO A 1 419 ? 22.641 86.818 11.496 1.00 74.79 ? 448 PRO A HB2 1 ATOM 6067 H HB3 . PRO A 1 419 ? 23.885 86.363 12.386 1.00 74.79 ? 448 PRO A HB3 1 ATOM 6068 H HG2 . PRO A 1 419 ? 22.699 84.684 10.928 1.00 72.81 ? 448 PRO A HG2 1 ATOM 6069 H HG3 . PRO A 1 419 ? 23.290 84.241 12.341 1.00 72.81 ? 448 PRO A HG3 1 ATOM 6070 H HD2 . PRO A 1 419 ? 20.615 84.765 11.699 1.00 72.33 ? 448 PRO A HD2 1 ATOM 6071 H HD3 . PRO A 1 419 ? 21.184 83.626 12.675 1.00 72.33 ? 448 PRO A HD3 1 ATOM 6072 N N . CYS A 1 420 ? 21.899 88.837 14.264 1.00 56.86 ? 449 CYS A N 1 ATOM 6073 C CA . CYS A 1 420 ? 21.401 90.208 14.218 1.00 64.32 ? 449 CYS A CA 1 ATOM 6074 C C . CYS A 1 420 ? 22.317 91.078 13.363 1.00 69.11 ? 449 CYS A C 1 ATOM 6075 O O . CYS A 1 420 ? 23.503 91.228 13.659 1.00 69.32 ? 449 CYS A O 1 ATOM 6076 C CB . CYS A 1 420 ? 21.280 90.789 15.628 1.00 64.36 ? 449 CYS A CB 1 ATOM 6077 S SG . CYS A 1 420 ? 22.778 90.668 16.631 1.00 79.94 ? 449 CYS A SG 1 ATOM 6078 H H . CYS A 1 420 ? 22.472 88.694 14.890 1.00 68.23 ? 449 CYS A H 1 ATOM 6079 H HA . CYS A 1 420 ? 20.519 90.212 13.814 1.00 77.18 ? 449 CYS A HA 1 ATOM 6080 H HB2 . CYS A 1 420 ? 21.050 91.728 15.557 1.00 77.24 ? 449 CYS A HB2 1 ATOM 6081 H HB3 . CYS A 1 420 ? 20.574 90.316 16.097 1.00 77.24 ? 449 CYS A HB3 1 ATOM 6082 N N . ASP A 1 421 ? 21.760 91.647 12.298 1.00 77.88 ? 450 ASP A N 1 ATOM 6083 C CA . ASP A 1 421 ? 22.527 92.482 11.381 1.00 82.12 ? 450 ASP A CA 1 ATOM 6084 C C . ASP A 1 421 ? 22.638 93.917 11.889 1.00 83.26 ? 450 ASP A C 1 ATOM 6085 O O . ASP A 1 421 ? 22.010 94.824 11.341 1.00 86.42 ? 450 ASP A O 1 ATOM 6086 C CB . ASP A 1 421 ? 21.887 92.470 9.991 1.00 85.55 ? 450 ASP A CB 1 ATOM 6087 H H . ASP A 1 421 ? 20.931 91.563 12.083 1.00 93.46 ? 450 ASP A H 1 ATOM 6088 H HA . ASP A 1 421 ? 23.424 92.122 11.301 1.00 98.54 ? 450 ASP A HA 1 ATOM 6089 N N . CYS A 1 422 ? 23.435 94.117 12.937 1.00 82.82 ? 451 CYS A N 1 ATOM 6090 C CA . CYS A 1 422 ? 23.653 95.450 13.489 1.00 81.58 ? 451 CYS A CA 1 ATOM 6091 C C . CYS A 1 422 ? 24.850 96.198 12.874 1.00 82.27 ? 451 CYS A C 1 ATOM 6092 O O . CYS A 1 422 ? 24.676 97.342 12.458 1.00 85.39 ? 451 CYS A O 1 ATOM 6093 C CB . CYS A 1 422 ? 23.808 95.374 15.012 1.00 79.03 ? 451 CYS A CB 1 ATOM 6094 S SG . CYS A 1 422 ? 22.237 95.219 15.897 1.00 84.77 ? 451 CYS A SG 1 ATOM 6095 H H . CYS A 1 422 ? 23.863 93.493 13.347 1.00 99.38 ? 451 CYS A H 1 ATOM 6096 H HA . CYS A 1 422 ? 22.862 95.982 13.308 1.00 97.89 ? 451 CYS A HA 1 ATOM 6097 H HB2 . CYS A 1 422 ? 24.351 94.601 15.233 1.00 94.84 ? 451 CYS A HB2 1 ATOM 6098 H HB3 . CYS A 1 422 ? 24.245 96.183 15.323 1.00 94.84 ? 451 CYS A HB3 1 ATOM 6099 N N . ALA A 1 423 ? 26.051 95.613 12.790 1.00 89.60 ? 452 ALA A N 1 ATOM 6100 C CA . ALA A 1 423 ? 26.377 94.246 13.200 1.00 84.81 ? 452 ALA A CA 1 ATOM 6101 C C . ALA A 1 423 ? 27.817 94.171 13.709 1.00 84.92 ? 452 ALA A C 1 ATOM 6102 O O . ALA A 1 423 ? 28.667 93.586 13.036 1.00 85.31 ? 452 ALA A O 1 ATOM 6103 C CB . ALA A 1 423 ? 26.199 93.279 12.031 1.00 83.59 ? 452 ALA A CB 1 ATOM 6104 H H . ALA A 1 423 ? 26.739 96.023 12.476 1.00 107.51 ? 452 ALA A H 1 ATOM 6105 H HA . ALA A 1 423 ? 25.783 93.974 13.917 1.00 101.77 ? 452 ALA A HA 1 ATOM 6106 H HB1 . ALA A 1 423 ? 26.420 92.383 12.326 1.00 100.31 ? 452 ALA A HB1 1 ATOM 6107 H HB2 . ALA A 1 423 ? 25.276 93.312 11.732 1.00 100.31 ? 452 ALA A HB2 1 ATOM 6108 H HB3 . ALA A 1 423 ? 26.790 93.546 11.309 1.00 100.31 ? 452 ALA A HB3 1 ATOM 6109 N N . GLY A 1 424 ? 28.121 94.743 14.876 1.00 94.21 ? 453 GLY A N 1 ATOM 6110 C CA . GLY A 1 424 ? 27.165 95.404 15.747 1.00 94.47 ? 453 GLY A CA 1 ATOM 6111 C C . GLY A 1 424 ? 26.714 94.500 16.880 1.00 90.79 ? 453 GLY A C 1 ATOM 6112 O O . GLY A 1 424 ? 26.444 93.317 16.674 1.00 89.64 ? 453 GLY A O 1 ATOM 6113 H H . GLY A 1 424 ? 28.920 94.758 15.193 1.00 113.05 ? 453 GLY A H 1 ATOM 6114 H HA2 . GLY A 1 424 ? 27.569 96.199 16.129 1.00 113.37 ? 453 GLY A HA2 1 ATOM 6115 H HA3 . GLY A 1 424 ? 26.386 95.668 15.234 1.00 113.37 ? 453 GLY A HA3 1 ATOM 6116 N N . SER A 1 425 ? 26.648 95.063 18.084 1.00 86.47 ? 454 SER A N 1 ATOM 6117 C CA . SER A 1 425 ? 26.264 94.309 19.273 1.00 78.93 ? 454 SER A CA 1 ATOM 6118 C C . SER A 1 425 ? 24.749 94.159 19.366 1.00 78.42 ? 454 SER A C 1 ATOM 6119 O O . SER A 1 425 ? 24.003 95.099 19.092 1.00 81.18 ? 454 SER A O 1 ATOM 6120 C CB . SER A 1 425 ? 26.802 94.989 20.534 1.00 76.72 ? 454 SER A CB 1 ATOM 6121 H H . SER A 1 425 ? 26.823 95.891 18.239 1.00 103.77 ? 454 SER A H 1 ATOM 6122 H HA . SER A 1 425 ? 26.651 93.421 19.222 1.00 94.72 ? 454 SER A HA 1 ATOM 6123 N N . CYS A 1 426 ? 24.308 92.970 19.765 1.00 63.35 ? 455 CYS A N 1 ATOM 6124 C CA . CYS A 1 426 ? 22.890 92.632 19.800 1.00 64.20 ? 455 CYS A CA 1 ATOM 6125 C C . CYS A 1 426 ? 22.294 92.755 21.197 1.00 65.79 ? 455 CYS A C 1 ATOM 6126 O O . CYS A 1 426 ? 23.002 92.637 22.196 1.00 66.90 ? 455 CYS A O 1 ATOM 6127 C CB . CYS A 1 426 ? 22.681 91.203 19.294 1.00 61.95 ? 455 CYS A CB 1 ATOM 6128 S SG . CYS A 1 426 ? 21.378 91.015 18.061 1.00 60.74 ? 455 CYS A SG 1 ATOM 6129 H H . CYS A 1 426 ? 24.821 92.330 20.025 1.00 76.02 ? 455 CYS A H 1 ATOM 6130 H HA . CYS A 1 426 ? 22.406 93.234 19.213 1.00 77.04 ? 455 CYS A HA 1 ATOM 6131 H HB2 . CYS A 1 426 ? 23.508 90.892 18.895 1.00 74.34 ? 455 CYS A HB2 1 ATOM 6132 H HB3 . CYS A 1 426 ? 22.452 90.638 20.049 1.00 74.34 ? 455 CYS A HB3 1 ATOM 6133 N N . ASP A 1 427 ? 20.989 93.002 21.251 1.00 80.77 ? 456 ASP A N 1 ATOM 6134 C CA . ASP A 1 427 ? 20.206 92.752 22.455 1.00 78.10 ? 456 ASP A CA 1 ATOM 6135 C C . ASP A 1 427 ? 19.532 91.394 22.266 1.00 74.99 ? 456 ASP A C 1 ATOM 6136 O O . ASP A 1 427 ? 18.658 91.258 21.411 1.00 73.89 ? 456 ASP A O 1 ATOM 6137 C CB . ASP A 1 427 ? 19.171 93.851 22.693 1.00 80.34 ? 456 ASP A CB 1 ATOM 6138 C CG . ASP A 1 427 ? 18.259 93.546 23.865 1.00 81.94 ? 456 ASP A CG 1 ATOM 6139 O OD1 . ASP A 1 427 ? 17.200 92.921 23.650 1.00 82.99 ? 456 ASP A OD1 1 ATOM 6140 O OD2 . ASP A 1 427 ? 18.604 93.927 25.004 1.00 82.78 ? 456 ASP A OD2 1 ATOM 6141 H H . ASP A 1 427 ? 20.530 93.318 20.597 1.00 96.93 ? 456 ASP A H 1 ATOM 6142 H HA . ASP A 1 427 ? 20.793 92.704 23.225 1.00 93.72 ? 456 ASP A HA 1 ATOM 6143 H HB2 . ASP A 1 427 ? 19.631 94.685 22.878 1.00 96.40 ? 456 ASP A HB2 1 ATOM 6144 H HB3 . ASP A 1 427 ? 18.620 93.945 21.900 1.00 96.40 ? 456 ASP A HB3 1 ATOM 6145 N N . PRO A 1 428 ? 19.931 90.384 23.059 1.00 48.29 ? 457 PRO A N 1 ATOM 6146 C CA . PRO A 1 428 ? 19.545 88.998 22.757 1.00 48.27 ? 457 PRO A CA 1 ATOM 6147 C C . PRO A 1 428 ? 18.038 88.740 22.751 1.00 52.35 ? 457 PRO A C 1 ATOM 6148 O O . PRO A 1 428 ? 17.599 87.729 22.203 1.00 49.09 ? 457 PRO A O 1 ATOM 6149 C CB . PRO A 1 428 ? 20.221 88.197 23.876 1.00 46.32 ? 457 PRO A CB 1 ATOM 6150 C CG . PRO A 1 428 ? 20.391 89.161 24.988 1.00 47.47 ? 457 PRO A CG 1 ATOM 6151 C CD . PRO A 1 428 ? 20.653 90.484 24.340 1.00 48.57 ? 457 PRO A CD 1 ATOM 6152 H HA . PRO A 1 428 ? 19.918 88.727 21.903 1.00 57.92 ? 457 PRO A HA 1 ATOM 6153 H HB2 . PRO A 1 428 ? 19.648 87.461 24.144 1.00 55.58 ? 457 PRO A HB2 1 ATOM 6154 H HB3 . PRO A 1 428 ? 21.081 87.869 23.571 1.00 55.58 ? 457 PRO A HB3 1 ATOM 6155 H HG2 . PRO A 1 428 ? 19.578 89.195 25.517 1.00 56.97 ? 457 PRO A HG2 1 ATOM 6156 H HG3 . PRO A 1 428 ? 21.144 88.895 25.537 1.00 56.97 ? 457 PRO A HG3 1 ATOM 6157 H HD2 . PRO A 1 428 ? 20.288 91.203 24.879 1.00 58.28 ? 457 PRO A HD2 1 ATOM 6158 H HD3 . PRO A 1 428 ? 21.603 90.602 24.185 1.00 58.28 ? 457 PRO A HD3 1 ATOM 6159 N N . LEU A 1 429 ? 17.263 89.637 23.349 1.00 50.00 ? 458 LEU A N 1 ATOM 6160 C CA . LEU A 1 429 ? 15.817 89.460 23.424 1.00 57.71 ? 458 LEU A CA 1 ATOM 6161 C C . LEU A 1 429 ? 15.112 89.867 22.134 1.00 57.28 ? 458 LEU A C 1 ATOM 6162 O O . LEU A 1 429 ? 14.283 89.121 21.610 1.00 56.11 ? 458 LEU A O 1 ATOM 6163 C CB . LEU A 1 429 ? 15.247 90.260 24.597 1.00 67.28 ? 458 LEU A CB 1 ATOM 6164 C CG . LEU A 1 429 ? 15.217 89.535 25.944 1.00 73.13 ? 458 LEU A CG 1 ATOM 6165 C CD1 . LEU A 1 429 ? 16.585 88.972 26.299 1.00 74.01 ? 458 LEU A CD1 1 ATOM 6166 C CD2 . LEU A 1 429 ? 14.729 90.473 27.033 1.00 77.43 ? 458 LEU A CD2 1 ATOM 6167 H H . LEU A 1 429 ? 17.549 90.358 23.720 1.00 60.01 ? 458 LEU A H 1 ATOM 6168 H HA . LEU A 1 429 ? 15.625 88.522 23.583 1.00 69.26 ? 458 LEU A HA 1 ATOM 6169 H HB2 . LEU A 1 429 ? 15.783 91.061 24.710 1.00 80.74 ? 458 LEU A HB2 1 ATOM 6170 H HB3 . LEU A 1 429 ? 14.335 90.510 24.382 1.00 80.74 ? 458 LEU A HB3 1 ATOM 6171 H HG . LEU A 1 429 ? 14.595 88.794 25.888 1.00 87.76 ? 458 LEU A HG 1 ATOM 6172 H HD11 . LEU A 1 429 ? 16.527 88.521 27.156 1.00 88.81 ? 458 LEU A HD11 1 ATOM 6173 H HD12 . LEU A 1 429 ? 16.855 88.343 25.611 1.00 88.81 ? 458 LEU A HD12 1 ATOM 6174 H HD13 . LEU A 1 429 ? 17.223 89.701 26.350 1.00 88.81 ? 458 LEU A HD13 1 ATOM 6175 H HD21 . LEU A 1 429 ? 14.717 89.996 27.877 1.00 92.92 ? 458 LEU A HD21 1 ATOM 6176 H HD22 . LEU A 1 429 ? 15.331 91.231 27.089 1.00 92.92 ? 458 LEU A HD22 1 ATOM 6177 H HD23 . LEU A 1 429 ? 13.834 90.775 26.811 1.00 92.92 ? 458 LEU A HD23 1 ATOM 6178 N N . THR A 1 430 ? 15.450 91.050 21.627 1.00 51.45 ? 459 THR A N 1 ATOM 6179 C CA . THR A 1 430 ? 14.745 91.636 20.489 1.00 55.63 ? 459 THR A CA 1 ATOM 6180 C C . THR A 1 430 ? 15.599 91.680 19.224 1.00 57.93 ? 459 THR A C 1 ATOM 6181 O O . THR A 1 430 ? 15.077 91.579 18.113 1.00 59.99 ? 459 THR A O 1 ATOM 6182 C CB . THR A 1 430 ? 14.280 93.065 20.813 1.00 59.01 ? 459 THR A CB 1 ATOM 6183 O OG1 . THR A 1 430 ? 15.415 93.883 21.120 1.00 60.07 ? 459 THR A OG1 1 ATOM 6184 C CG2 . THR A 1 430 ? 13.326 93.060 21.998 1.00 60.09 ? 459 THR A CG2 1 ATOM 6185 H H . THR A 1 430 ? 16.092 91.537 21.927 1.00 61.74 ? 459 THR A H 1 ATOM 6186 H HA . THR A 1 430 ? 13.958 91.102 20.299 1.00 66.76 ? 459 THR A HA 1 ATOM 6187 H HB . THR A 1 430 ? 13.814 93.434 20.046 1.00 70.81 ? 459 THR A HB 1 ATOM 6188 H HG1 . THR A 1 430 ? 15.167 94.665 21.298 1.00 72.08 ? 459 THR A HG1 1 ATOM 6189 H HG21 . THR A 1 430 ? 13.037 93.964 22.195 1.00 72.11 ? 459 THR A HG21 1 ATOM 6190 H HG22 . THR A 1 430 ? 12.548 92.517 21.794 1.00 72.11 ? 459 THR A HG22 1 ATOM 6191 H HG23 . THR A 1 430 ? 13.770 92.693 22.778 1.00 72.11 ? 459 THR A HG23 1 ATOM 6192 N N . GLY A 1 431 ? 16.908 91.831 19.399 1.00 72.53 ? 460 GLY A N 1 ATOM 6193 C CA . GLY A 1 431 ? 17.822 91.952 18.278 1.00 70.98 ? 460 GLY A CA 1 ATOM 6194 C C . GLY A 1 431 ? 18.090 93.397 17.893 1.00 69.89 ? 460 GLY A C 1 ATOM 6195 O O . GLY A 1 431 ? 18.762 93.666 16.896 1.00 69.96 ? 460 GLY A O 1 ATOM 6196 H H . GLY A 1 431 ? 17.293 91.866 20.167 1.00 87.04 ? 460 GLY A H 1 ATOM 6197 H HA2 . GLY A 1 431 ? 18.667 91.534 18.504 1.00 85.18 ? 460 GLY A HA2 1 ATOM 6198 H HA3 . GLY A 1 431 ? 17.450 91.495 17.508 1.00 85.18 ? 460 GLY A HA3 1 ATOM 6199 N N . ASP A 1 432 ? 17.561 94.329 18.680 1.00 87.72 ? 461 ASP A N 1 ATOM 6200 C CA . ASP A 1 432 ? 17.810 95.748 18.455 1.00 92.14 ? 461 ASP A CA 1 ATOM 6201 C C . ASP A 1 432 ? 19.260 96.090 18.782 1.00 92.88 ? 461 ASP A C 1 ATOM 6202 O O . ASP A 1 432 ? 19.876 95.458 19.641 1.00 91.11 ? 461 ASP A O 1 ATOM 6203 C CB . ASP A 1 432 ? 16.862 96.604 19.298 1.00 94.19 ? 461 ASP A CB 1 ATOM 6204 C CG . ASP A 1 432 ? 15.405 96.400 18.929 1.00 95.29 ? 461 ASP A CG 1 ATOM 6205 O OD1 . ASP A 1 432 ? 15.126 96.058 17.760 1.00 95.45 ? 461 ASP A OD1 1 ATOM 6206 O OD2 . ASP A 1 432 ? 14.536 96.583 19.808 1.00 95.67 ? 461 ASP A OD2 1 ATOM 6207 H H . ASP A 1 432 ? 17.051 94.165 19.353 1.00 105.27 ? 461 ASP A H 1 ATOM 6208 H HA . ASP A 1 432 ? 17.654 95.955 17.520 1.00 110.57 ? 461 ASP A HA 1 ATOM 6209 H HB2 . ASP A 1 432 ? 16.971 96.369 20.233 1.00 113.03 ? 461 ASP A HB2 1 ATOM 6210 H HB3 . ASP A 1 432 ? 17.078 97.540 19.164 1.00 113.03 ? 461 ASP A HB3 1 ATOM 6211 N N . CYS A 1 433 ? 19.798 97.090 18.092 1.00 72.24 ? 462 CYS A N 1 ATOM 6212 C CA . CYS A 1 433 ? 21.185 97.497 18.283 1.00 66.32 ? 462 CYS A CA 1 ATOM 6213 C C . CYS A 1 433 ? 21.319 98.458 19.460 1.00 64.93 ? 462 CYS A C 1 ATOM 6214 O O . CYS A 1 433 ? 22.374 98.538 20.091 1.00 63.31 ? 462 CYS A O 1 ATOM 6215 C CB . CYS A 1 433 ? 21.728 98.147 17.009 1.00 66.00 ? 462 CYS A CB 1 ATOM 6216 S SG . CYS A 1 433 ? 21.584 97.108 15.536 1.00 120.38 ? 462 CYS A SG 1 ATOM 6217 H H . CYS A 1 433 ? 19.377 97.552 17.501 1.00 86.69 ? 462 CYS A H 1 ATOM 6218 H HA . CYS A 1 433 ? 21.722 96.712 18.473 1.00 79.58 ? 462 CYS A HA 1 ATOM 6219 H HB2 . CYS A 1 433 ? 21.236 98.966 16.843 1.00 79.20 ? 462 CYS A HB2 1 ATOM 6220 H HB3 . CYS A 1 433 ? 22.668 98.348 17.138 1.00 79.20 ? 462 CYS A HB3 1 HETATM 6221 C C1 . NAG B 2 . ? 47.056 32.041 33.896 1.00 79.86 ? 501 NAG A C1 1 HETATM 6222 C C2 . NAG B 2 . ? 45.538 31.766 33.887 1.00 76.85 ? 501 NAG A C2 1 HETATM 6223 C C3 . NAG B 2 . ? 45.180 30.757 32.798 1.00 76.35 ? 501 NAG A C3 1 HETATM 6224 C C4 . NAG B 2 . ? 45.929 31.054 31.504 1.00 75.86 ? 501 NAG A C4 1 HETATM 6225 C C5 . NAG B 2 . ? 47.438 30.973 31.714 1.00 76.27 ? 501 NAG A C5 1 HETATM 6226 C C6 . NAG B 2 . ? 48.200 32.095 31.045 1.00 74.50 ? 501 NAG A C6 1 HETATM 6227 C C7 . NAG B 2 . ? 43.860 30.924 35.484 1.00 71.58 ? 501 NAG A C7 1 HETATM 6228 C C8 . NAG B 2 . ? 43.631 30.415 36.874 1.00 70.11 ? 501 NAG A C8 1 HETATM 6229 N N2 . NAG B 2 . ? 45.117 31.270 35.189 1.00 74.55 ? 501 NAG A N2 1 HETATM 6230 O O3 . NAG B 2 . ? 43.781 30.822 32.543 1.00 74.86 ? 501 NAG A O3 1 HETATM 6231 O O4 . NAG B 2 . ? 45.532 30.129 30.495 1.00 78.24 ? 501 NAG A O4 1 HETATM 6232 O O5 . NAG B 2 . ? 47.751 31.017 33.115 1.00 78.06 ? 501 NAG A O5 1 HETATM 6233 O O6 . NAG B 2 . ? 49.598 31.976 31.268 1.00 74.75 ? 501 NAG A O6 1 HETATM 6234 O O7 . NAG B 2 . ? 42.948 31.019 34.669 1.00 71.07 ? 501 NAG A O7 1 HETATM 6235 H H2 . NAG B 2 . ? 45.070 32.602 33.699 1.00 92.22 ? 501 NAG A H2 1 HETATM 6236 H H3 . NAG B 2 . ? 45.410 29.859 33.104 1.00 91.62 ? 501 NAG A H3 1 HETATM 6237 H H4 . NAG B 2 . ? 45.701 31.957 31.210 1.00 91.03 ? 501 NAG A H4 1 HETATM 6238 H H5 . NAG B 2 . ? 47.755 30.124 31.352 1.00 91.53 ? 501 NAG A H5 1 HETATM 6239 H H61 . NAG B 2 . ? 47.891 32.948 31.403 1.00 89.40 ? 501 NAG A H61 1 HETATM 6240 H H62 . NAG B 2 . ? 48.026 32.070 30.085 1.00 89.40 ? 501 NAG A H62 1 HETATM 6241 H H81 . NAG B 2 . ? 42.681 30.229 37.000 1.00 84.13 ? 501 NAG A H81 1 HETATM 6242 H H82 . NAG B 2 . ? 43.920 31.089 37.518 1.00 84.13 ? 501 NAG A H82 1 HETATM 6243 H H83 . NAG B 2 . ? 44.143 29.595 37.008 1.00 84.13 ? 501 NAG A H83 1 HETATM 6244 H HN2 . NAG B 2 . ? 45.753 31.169 35.836 1.00 89.46 ? 501 NAG A HN2 1 HETATM 6245 H HO3 . NAG B 2 . ? 43.346 30.353 33.159 1.00 89.84 ? 501 NAG A HO3 1 HETATM 6246 H HO6 . NAG B 2 . ? 49.741 31.519 32.016 1.00 89.70 ? 501 NAG A HO6 1 HETATM 6247 C C1 . NAG C 2 . ? 45.676 28.763 30.946 1.00 120.40 ? 502 NAG A C1 1 HETATM 6248 C C2 . NAG C 2 . ? 44.403 27.942 30.732 1.00 122.33 ? 502 NAG A C2 1 HETATM 6249 C C3 . NAG C 2 . ? 44.581 26.543 31.310 1.00 123.47 ? 502 NAG A C3 1 HETATM 6250 C C4 . NAG C 2 . ? 45.836 25.892 30.739 1.00 125.05 ? 502 NAG A C4 1 HETATM 6251 C C5 . NAG C 2 . ? 47.042 26.808 30.932 1.00 124.26 ? 502 NAG A C5 1 HETATM 6252 C C6 . NAG C 2 . ? 48.298 26.277 30.281 1.00 125.35 ? 502 NAG A C6 1 HETATM 6253 C C7 . NAG C 2 . ? 42.103 28.819 30.694 1.00 120.30 ? 502 NAG A C7 1 HETATM 6254 C C8 . NAG C 2 . ? 41.026 29.499 31.486 1.00 118.84 ? 502 NAG A C8 1 HETATM 6255 N N2 . NAG C 2 . ? 43.251 28.597 31.342 1.00 120.82 ? 502 NAG A N2 1 HETATM 6256 O O3 . NAG C 2 . ? 43.439 25.751 31.007 1.00 124.09 ? 502 NAG A O3 1 HETATM 6257 O O4 . NAG C 2 . ? 46.079 24.654 31.398 1.00 125.70 ? 502 NAG A O4 1 HETATM 6258 O O5 . NAG C 2 . ? 46.779 28.088 30.343 1.00 123.49 ? 502 NAG A O5 1 HETATM 6259 O O6 . NAG C 2 . ? 49.427 27.079 30.596 1.00 124.77 ? 502 NAG A O6 1 HETATM 6260 O O7 . NAG C 2 . ? 41.939 28.492 29.522 1.00 121.13 ? 502 NAG A O7 1 HETATM 6261 H H2 . NAG C 2 . ? 44.246 27.859 29.773 1.00 146.80 ? 502 NAG A H2 1 HETATM 6262 H H3 . NAG C 2 . ? 44.672 26.610 32.279 1.00 148.17 ? 502 NAG A H3 1 HETATM 6263 H H4 . NAG C 2 . ? 45.707 25.728 29.786 1.00 150.06 ? 502 NAG A H4 1 HETATM 6264 H H5 . NAG C 2 . ? 47.204 26.924 31.888 1.00 149.12 ? 502 NAG A H5 1 HETATM 6265 H H61 . NAG C 2 . ? 48.174 26.266 29.313 1.00 150.42 ? 502 NAG A H61 1 HETATM 6266 H H62 . NAG C 2 . ? 48.457 25.365 30.592 1.00 150.42 ? 502 NAG A H62 1 HETATM 6267 H H81 . NAG C 2 . ? 40.249 29.651 30.915 1.00 142.61 ? 502 NAG A H81 1 HETATM 6268 H H82 . NAG C 2 . ? 41.357 30.355 31.818 1.00 142.61 ? 502 NAG A H82 1 HETATM 6269 H H83 . NAG C 2 . ? 40.770 28.934 32.239 1.00 142.61 ? 502 NAG A H83 1 HETATM 6270 H HN2 . NAG C 2 . ? 43.314 28.861 32.213 1.00 144.98 ? 502 NAG A HN2 1 HETATM 6271 H HO3 . NAG C 2 . ? 43.523 24.954 31.388 1.00 148.90 ? 502 NAG A HO3 1 HETATM 6272 H HO4 . NAG C 2 . ? 46.494 24.099 30.842 1.00 150.84 ? 502 NAG A HO4 1 HETATM 6273 H HO6 . NAG C 2 . ? 50.155 26.721 30.235 1.00 149.72 ? 502 NAG A HO6 1 HETATM 6274 C C1 . NAG D 2 . ? 10.835 -3.242 74.316 1.00 125.66 ? 503 NAG A C1 1 HETATM 6275 C C2 . NAG D 2 . ? 11.916 -3.960 73.517 1.00 124.68 ? 503 NAG A C2 1 HETATM 6276 C C3 . NAG D 2 . ? 11.275 -4.810 72.424 1.00 125.42 ? 503 NAG A C3 1 HETATM 6277 C C4 . NAG D 2 . ? 10.105 -4.062 71.800 1.00 127.02 ? 503 NAG A C4 1 HETATM 6278 C C5 . NAG D 2 . ? 9.030 -3.798 72.853 1.00 128.61 ? 503 NAG A C5 1 HETATM 6279 C C6 . NAG D 2 . ? 7.872 -4.767 72.784 1.00 129.70 ? 503 NAG A C6 1 HETATM 6280 C C7 . NAG D 2 . ? 14.107 -3.337 72.600 1.00 122.43 ? 503 NAG A C7 1 HETATM 6281 C C8 . NAG D 2 . ? 14.936 -2.232 72.020 1.00 121.68 ? 503 NAG A C8 1 HETATM 6282 N N2 . NAG D 2 . ? 12.855 -3.015 72.943 1.00 123.81 ? 503 NAG A N2 1 HETATM 6283 O O3 . NAG D 2 . ? 10.825 -6.040 72.980 1.00 125.80 ? 503 NAG A O3 1 HETATM 6284 O O4 . NAG D 2 . ? 10.561 -2.821 71.273 1.00 126.10 ? 503 NAG A O4 1 HETATM 6285 O O5 . NAG D 2 . ? 9.594 -3.923 74.167 1.00 127.50 ? 503 NAG A O5 1 HETATM 6286 O O6 . NAG D 2 . ? 6.645 -4.135 73.122 1.00 130.65 ? 503 NAG A O6 1 HETATM 6287 O O7 . NAG D 2 . ? 14.549 -4.472 72.752 1.00 122.13 ? 503 NAG A O7 1 HETATM 6288 H H2 . NAG D 2 . ? 12.401 -4.555 74.120 1.00 149.62 ? 503 NAG A H2 1 HETATM 6289 H H3 . NAG D 2 . ? 11.939 -4.996 71.734 1.00 150.51 ? 503 NAG A H3 1 HETATM 6290 H H4 . NAG D 2 . ? 9.726 -4.599 71.079 1.00 152.42 ? 503 NAG A H4 1 HETATM 6291 H H5 . NAG D 2 . ? 8.691 -2.890 72.738 1.00 154.33 ? 503 NAG A H5 1 HETATM 6292 H H61 . NAG D 2 . ? 8.034 -5.502 73.405 1.00 155.64 ? 503 NAG A H61 1 HETATM 6293 H H62 . NAG D 2 . ? 7.808 -5.123 71.878 1.00 155.64 ? 503 NAG A H62 1 HETATM 6294 H H81 . NAG D 2 . ? 15.838 -2.560 71.843 1.00 146.01 ? 503 NAG A H81 1 HETATM 6295 H H82 . NAG D 2 . ? 14.978 -1.490 72.653 1.00 146.01 ? 503 NAG A H82 1 HETATM 6296 H H83 . NAG D 2 . ? 14.532 -1.926 71.186 1.00 146.01 ? 503 NAG A H83 1 HETATM 6297 H HN2 . NAG D 2 . ? 12.576 -2.157 72.808 1.00 148.57 ? 503 NAG A HN2 1 HETATM 6298 H HO3 . NAG D 2 . ? 10.519 -5.899 73.801 1.00 150.96 ? 503 NAG A HO3 1 HETATM 6299 H HO4 . NAG D 2 . ? 10.660 -2.892 70.393 1.00 151.31 ? 503 NAG A HO4 1 HETATM 6300 H HO6 . NAG D 2 . ? 5.984 -4.725 73.073 1.00 156.78 ? 503 NAG A HO6 1 HETATM 6301 C C1 . NAG E 2 . ? 7.871 -2.239 70.274 1.00 141.18 ? 504 NAG A C1 1 HETATM 6302 C C2 . NAG E 2 . ? 7.826 -0.751 70.586 1.00 140.63 ? 504 NAG A C2 1 HETATM 6303 C C3 . NAG E 2 . ? 7.005 -0.024 69.527 1.00 141.30 ? 504 NAG A C3 1 HETATM 6304 C C4 . NAG E 2 . ? 7.538 -0.340 68.137 1.00 140.76 ? 504 NAG A C4 1 HETATM 6305 C C5 . NAG E 2 . ? 7.636 -1.851 67.931 1.00 141.47 ? 504 NAG A C5 1 HETATM 6306 C C6 . NAG E 2 . ? 8.303 -2.227 66.629 1.00 141.14 ? 504 NAG A C6 1 HETATM 6307 C C7 . NAG E 2 . ? 8.003 -0.012 72.925 1.00 140.26 ? 504 NAG A C7 1 HETATM 6308 C C8 . NAG E 2 . ? 7.274 0.169 74.222 1.00 141.38 ? 504 NAG A C8 1 HETATM 6309 N N2 . NAG E 2 . ? 7.283 -0.509 71.912 1.00 141.26 ? 504 NAG A N2 1 HETATM 6310 O O3 . NAG E 2 . ? 7.061 1.378 69.765 1.00 140.76 ? 504 NAG A O3 1 HETATM 6311 O O4 . NAG E 2 . ? 6.674 0.211 67.149 1.00 141.50 ? 504 NAG A O4 1 HETATM 6312 O O5 . NAG E 2 . ? 8.420 -2.441 68.979 1.00 140.64 ? 504 NAG A O5 1 HETATM 6313 O O6 . NAG E 2 . ? 8.935 -3.497 66.717 1.00 140.88 ? 504 NAG A O6 1 HETATM 6314 O O7 . NAG E 2 . ? 9.189 0.278 72.801 1.00 138.71 ? 504 NAG A O7 1 HETATM 6315 H H2 . NAG E 2 . ? 8.737 -0.402 70.554 1.00 168.76 ? 504 NAG A H2 1 HETATM 6316 H H3 . NAG E 2 . ? 6.077 -0.320 69.587 1.00 169.56 ? 504 NAG A H3 1 HETATM 6317 H H4 . NAG E 2 . ? 8.426 0.054 68.039 1.00 168.91 ? 504 NAG A H4 1 HETATM 6318 H H5 . NAG E 2 . ? 6.738 -2.233 67.951 1.00 169.77 ? 504 NAG A H5 1 HETATM 6319 H H61 . NAG E 2 . ? 8.972 -1.552 66.406 1.00 169.37 ? 504 NAG A H61 1 HETATM 6320 H H62 . NAG E 2 . ? 7.630 -2.255 65.922 1.00 169.37 ? 504 NAG A H62 1 HETATM 6321 H H81 . NAG E 2 . ? 7.894 0.496 74.901 1.00 169.66 ? 504 NAG A H81 1 HETATM 6322 H H82 . NAG E 2 . ? 6.900 -0.687 74.507 1.00 169.66 ? 504 NAG A H82 1 HETATM 6323 H H83 . NAG E 2 . ? 6.552 0.815 74.102 1.00 169.66 ? 504 NAG A H83 1 HETATM 6324 H HN2 . NAG E 2 . ? 6.405 -0.707 72.062 1.00 169.52 ? 504 NAG A HN2 1 HETATM 6325 H HO3 . NAG E 2 . ? 6.578 1.802 69.153 1.00 168.91 ? 504 NAG A HO3 1 HETATM 6326 H HO4 . NAG E 2 . ? 7.106 0.265 66.375 1.00 169.80 ? 504 NAG A HO4 1 HETATM 6327 H HO6 . NAG E 2 . ? 9.060 -3.707 67.570 1.00 169.05 ? 504 NAG A HO6 1 HETATM 6328 C C1 . NAG F 2 . ? 43.921 -15.517 57.052 1.00 123.16 ? 505 NAG A C1 1 HETATM 6329 C C2 . NAG F 2 . ? 45.080 -16.238 57.800 1.00 127.06 ? 505 NAG A C2 1 HETATM 6330 C C3 . NAG F 2 . ? 44.821 -17.735 58.083 1.00 128.68 ? 505 NAG A C3 1 HETATM 6331 C C4 . NAG F 2 . ? 44.055 -18.470 56.985 1.00 129.33 ? 505 NAG A C4 1 HETATM 6332 C C5 . NAG F 2 . ? 42.934 -17.640 56.374 1.00 127.97 ? 505 NAG A C5 1 HETATM 6333 C C6 . NAG F 2 . ? 41.730 -17.457 57.274 1.00 127.06 ? 505 NAG A C6 1 HETATM 6334 C C7 . NAG F 2 . ? 46.868 -15.881 56.025 1.00 127.78 ? 505 NAG A C7 1 HETATM 6335 C C8 . NAG F 2 . ? 45.866 -16.011 54.921 1.00 127.71 ? 505 NAG A C8 1 HETATM 6336 N N2 . NAG F 2 . ? 46.443 -16.000 57.291 1.00 127.67 ? 505 NAG A N2 1 HETATM 6337 O O3 . NAG F 2 . ? 44.123 -17.861 59.318 1.00 127.65 ? 505 NAG A O3 1 HETATM 6338 O O4 . NAG F 2 . ? 44.935 -18.950 55.975 1.00 137.83 ? 505 NAG A O4 1 HETATM 6339 O O5 . NAG F 2 . ? 43.412 -16.344 56.003 1.00 126.31 ? 505 NAG A O5 1 HETATM 6340 O O6 . NAG F 2 . ? 42.080 -17.307 58.642 1.00 126.24 ? 505 NAG A O6 1 HETATM 6341 O O7 . NAG F 2 . ? 48.054 -15.673 55.776 1.00 127.98 ? 505 NAG A O7 1 HETATM 6342 H H2 . NAG F 2 . ? 45.078 -15.829 58.686 1.00 152.48 ? 505 NAG A H2 1 HETATM 6343 H H3 . NAG F 2 . ? 45.687 -18.173 58.184 1.00 154.42 ? 505 NAG A H3 1 HETATM 6344 H H4 . NAG F 2 . ? 43.640 -19.251 57.399 1.00 155.20 ? 505 NAG A H4 1 HETATM 6345 H H5 . NAG F 2 . ? 42.635 -18.094 55.563 1.00 153.57 ? 505 NAG A H5 1 HETATM 6346 H H61 . NAG F 2 . ? 41.148 -18.235 57.182 1.00 152.47 ? 505 NAG A H61 1 HETATM 6347 H H62 . NAG F 2 . ? 41.242 -16.662 56.986 1.00 152.47 ? 505 NAG A H62 1 HETATM 6348 H H81 . NAG F 2 . ? 46.307 -15.863 54.063 1.00 153.25 ? 505 NAG A H81 1 HETATM 6349 H H82 . NAG F 2 . ? 45.160 -15.348 55.043 1.00 153.25 ? 505 NAG A H82 1 HETATM 6350 H H83 . NAG F 2 . ? 45.478 -16.906 54.937 1.00 153.25 ? 505 NAG A H83 1 HETATM 6351 H HN2 . NAG F 2 . ? 47.088 -15.911 57.929 1.00 153.20 ? 505 NAG A HN2 1 HETATM 6352 H HO3 . NAG F 2 . ? 43.648 -17.125 59.466 1.00 153.18 ? 505 NAG A HO3 1 HETATM 6353 H HO6 . NAG F 2 . ? 41.802 -18.016 59.098 1.00 151.49 ? 505 NAG A HO6 1 HETATM 6354 C C1 . NAG G 2 . ? 44.619 -20.348 55.812 1.00 112.53 ? 506 NAG A C1 1 HETATM 6355 C C2 . NAG G 2 . ? 43.937 -20.605 54.466 1.00 115.68 ? 506 NAG A C2 1 HETATM 6356 C C3 . NAG G 2 . ? 44.941 -21.169 53.468 1.00 117.22 ? 506 NAG A C3 1 HETATM 6357 C C4 . NAG G 2 . ? 46.316 -20.568 53.718 1.00 117.15 ? 506 NAG A C4 1 HETATM 6358 C C5 . NAG G 2 . ? 46.837 -21.019 55.080 1.00 115.51 ? 506 NAG A C5 1 HETATM 6359 C C6 . NAG G 2 . ? 47.747 -20.012 55.749 1.00 114.50 ? 506 NAG A C6 1 HETATM 6360 C C7 . NAG G 2 . ? 41.534 -21.088 54.658 1.00 118.61 ? 506 NAG A C7 1 HETATM 6361 C C8 . NAG G 2 . ? 40.497 -22.157 54.820 1.00 119.46 ? 506 NAG A C8 1 HETATM 6362 N N2 . NAG G 2 . ? 42.804 -21.505 54.617 1.00 117.85 ? 506 NAG A N2 1 HETATM 6363 O O3 . NAG G 2 . ? 44.512 -20.873 52.143 1.00 118.37 ? 506 NAG A O3 1 HETATM 6364 O O4 . NAG G 2 . ? 47.222 -20.989 52.704 1.00 118.94 ? 506 NAG A O4 1 HETATM 6365 O O5 . NAG G 2 . ? 45.738 -21.253 55.974 1.00 113.83 ? 506 NAG A O5 1 HETATM 6366 O O6 . NAG G 2 . ? 48.283 -19.078 54.821 1.00 114.30 ? 506 NAG A O6 1 HETATM 6367 O O7 . NAG G 2 . ? 41.235 -19.901 54.570 1.00 117.94 ? 506 NAG A O7 1 HETATM 6368 H H2 . NAG G 2 . ? 43.613 -19.752 54.119 1.00 138.81 ? 506 NAG A H2 1 HETATM 6369 H H3 . NAG G 2 . ? 44.991 -22.137 53.578 1.00 140.67 ? 506 NAG A H3 1 HETATM 6370 H H4 . NAG G 2 . ? 46.249 -19.594 53.705 1.00 140.58 ? 506 NAG A H4 1 HETATM 6371 H H5 . NAG G 2 . ? 47.329 -21.854 54.964 1.00 138.61 ? 506 NAG A H5 1 HETATM 6372 H H61 . NAG G 2 . ? 48.482 -20.486 56.182 1.00 137.40 ? 506 NAG A H61 1 HETATM 6373 H H62 . NAG G 2 . ? 47.239 -19.528 56.428 1.00 137.40 ? 506 NAG A H62 1 HETATM 6374 H H81 . NAG G 2 . ? 39.613 -21.747 54.879 1.00 143.35 ? 506 NAG A H81 1 HETATM 6375 H H82 . NAG G 2 . ? 40.676 -22.663 55.635 1.00 143.35 ? 506 NAG A H82 1 HETATM 6376 H H83 . NAG G 2 . ? 40.526 -22.757 54.051 1.00 143.35 ? 506 NAG A H83 1 HETATM 6377 H HN2 . NAG G 2 . ? 42.969 -22.399 54.688 1.00 141.42 ? 506 NAG A HN2 1 HETATM 6378 H HO3 . NAG G 2 . ? 45.218 -20.835 51.605 1.00 142.05 ? 506 NAG A HO3 1 HETATM 6379 H HO4 . NAG G 2 . ? 48.023 -20.637 52.858 1.00 142.73 ? 506 NAG A HO4 1 HETATM 6380 H HO6 . NAG G 2 . ? 48.749 -18.461 55.258 1.00 137.16 ? 506 NAG A HO6 1 HETATM 6381 CA CA . CA H 3 . ? 33.776 7.711 78.304 1.00 32.05 ? 507 CA A CA 1 HETATM 6382 C C . TAM I 4 . ? 48.790 34.677 64.882 0.93 57.27 ? 508 TAM A C 1 HETATM 6383 C C1 . TAM I 4 . ? 49.075 36.035 64.207 0.93 57.32 ? 508 TAM A C1 1 HETATM 6384 C C2 . TAM I 4 . ? 48.702 33.496 63.900 0.93 57.55 ? 508 TAM A C2 1 HETATM 6385 C C3 . TAM I 4 . ? 47.445 34.884 65.617 0.93 55.50 ? 508 TAM A C3 1 HETATM 6386 C C4 . TAM I 4 . ? 49.931 36.038 62.937 0.93 57.12 ? 508 TAM A C4 1 HETATM 6387 C C5 . TAM I 4 . ? 50.058 32.909 63.503 0.93 57.86 ? 508 TAM A C5 1 HETATM 6388 C C6 . TAM I 4 . ? 46.916 33.647 66.343 0.93 54.14 ? 508 TAM A C6 1 HETATM 6389 N N . TAM I 4 . ? 49.811 34.400 65.833 0.93 58.54 ? 508 TAM A N 1 HETATM 6390 O O4 . TAM I 4 . ? 51.325 36.090 63.236 0.93 58.12 ? 508 TAM A O4 1 HETATM 6391 O O5 . TAM I 4 . ? 49.897 32.162 62.294 0.93 56.77 ? 508 TAM A O5 1 HETATM 6392 O O6 . TAM I 4 . ? 45.771 34.007 67.119 0.93 53.44 ? 508 TAM A O6 1 HETATM 6393 H H11 . TAM I 4 . ? 48.221 36.456 63.991 0.93 68.79 ? 508 TAM A H11 1 HETATM 6394 H H12 . TAM I 4 . ? 49.526 36.592 64.869 0.93 68.79 ? 508 TAM A H12 1 HETATM 6395 H H21 . TAM I 4 . ? 48.176 32.785 64.314 0.93 69.06 ? 508 TAM A H21 1 HETATM 6396 H H22 . TAM I 4 . ? 48.238 33.798 63.096 0.93 69.06 ? 508 TAM A H22 1 HETATM 6397 H H31 . TAM I 4 . ? 47.551 35.603 66.269 0.93 66.60 ? 508 TAM A H31 1 HETATM 6398 H H32 . TAM I 4 . ? 46.774 35.165 64.967 0.93 66.60 ? 508 TAM A H32 1 HETATM 6399 H H41 . TAM I 4 . ? 49.741 35.232 62.421 0.93 68.55 ? 508 TAM A H41 1 HETATM 6400 H H42 . TAM I 4 . ? 49.698 36.820 62.402 0.93 68.55 ? 508 TAM A H42 1 HETATM 6401 H H51 . TAM I 4 . ? 50.694 33.634 63.353 0.93 69.43 ? 508 TAM A H51 1 HETATM 6402 H H52 . TAM I 4 . ? 50.387 32.326 64.214 0.93 69.43 ? 508 TAM A H52 1 HETATM 6403 H H61 . TAM I 4 . ? 46.666 32.968 65.688 0.93 64.97 ? 508 TAM A H61 1 HETATM 6404 H H62 . TAM I 4 . ? 47.610 33.293 66.931 0.93 64.97 ? 508 TAM A H62 1 HETATM 6405 H HN1 . TAM I 4 . ? 49.885 33.498 65.946 0.93 70.25 ? 508 TAM A HN1 1 HETATM 6406 H HN2 . TAM I 4 . ? 49.599 34.790 66.630 0.93 70.25 ? 508 TAM A HN2 1 HETATM 6407 H HO4 . TAM I 4 . ? 51.775 36.330 62.510 0.93 69.74 ? 508 TAM A HO4 1 HETATM 6408 H HO5 . TAM I 4 . ? 50.547 31.561 62.229 0.93 68.12 ? 508 TAM A HO5 1 HETATM 6409 H HO6 . TAM I 4 . ? 45.187 33.338 67.111 0.93 64.12 ? 508 TAM A HO6 1 HETATM 6410 O O . HOH J 5 . ? 40.054 44.311 35.704 1.00 35.60 ? 601 HOH A O 1 HETATM 6411 O O . HOH J 5 . ? 46.499 -0.731 60.257 1.00 29.45 ? 602 HOH A O 1 HETATM 6412 O O . HOH J 5 . ? 53.781 12.772 47.934 1.00 48.08 ? 603 HOH A O 1 HETATM 6413 O O . HOH J 5 . ? 31.664 11.381 50.536 1.00 37.26 ? 604 HOH A O 1 HETATM 6414 O O . HOH J 5 . ? 34.926 8.965 76.149 1.00 30.75 ? 605 HOH A O 1 HETATM 6415 O O . HOH J 5 . ? 28.951 -13.827 71.426 1.00 36.42 ? 606 HOH A O 1 HETATM 6416 O O . HOH J 5 . ? 23.524 -1.010 61.818 1.00 29.24 ? 607 HOH A O 1 HETATM 6417 O O . HOH J 5 . ? 31.172 61.298 41.655 1.00 24.73 ? 608 HOH A O 1 HETATM 6418 O O . HOH J 5 . ? 27.853 71.014 32.079 1.00 32.85 ? 609 HOH A O 1 HETATM 6419 O O . HOH J 5 . ? 38.423 36.049 42.053 1.00 19.98 ? 610 HOH A O 1 HETATM 6420 O O . HOH J 5 . ? 43.019 33.292 46.916 1.00 26.94 ? 611 HOH A O 1 HETATM 6421 O O . HOH J 5 . ? 29.863 -8.395 90.003 1.00 34.55 ? 612 HOH A O 1 HETATM 6422 O O . HOH J 5 . ? 35.666 45.068 31.608 1.00 25.49 ? 613 HOH A O 1 HETATM 6423 O O . HOH J 5 . ? 40.452 7.106 51.244 1.00 38.11 ? 614 HOH A O 1 HETATM 6424 O O . HOH J 5 . ? 38.690 19.347 71.060 1.00 27.28 ? 615 HOH A O 1 HETATM 6425 O O . HOH J 5 . ? 34.865 -15.165 70.142 1.00 37.53 ? 616 HOH A O 1 HETATM 6426 O O . HOH J 5 . ? 44.551 1.195 60.681 1.00 27.41 ? 617 HOH A O 1 HETATM 6427 O O . HOH J 5 . ? 23.294 9.831 73.812 1.00 27.53 ? 618 HOH A O 1 HETATM 6428 O O . HOH J 5 . ? 17.329 95.455 14.904 1.00 43.70 ? 619 HOH A O 1 HETATM 6429 O O . HOH J 5 . ? 45.517 43.172 47.339 1.00 24.64 ? 620 HOH A O 1 HETATM 6430 O O . HOH J 5 . ? 28.995 4.274 81.835 1.00 32.20 ? 621 HOH A O 1 HETATM 6431 O O . HOH J 5 . ? 30.066 73.804 33.384 1.00 28.60 ? 622 HOH A O 1 HETATM 6432 O O . HOH J 5 . ? 43.953 -15.132 62.251 1.00 36.99 ? 623 HOH A O 1 HETATM 6433 O O . HOH J 5 . ? 41.540 6.472 49.215 1.00 28.53 ? 624 HOH A O 1 HETATM 6434 O O . HOH J 5 . ? 21.216 98.729 10.518 1.00 38.89 ? 625 HOH A O 1 HETATM 6435 O O . HOH J 5 . ? 31.729 75.528 34.321 1.00 33.91 ? 626 HOH A O 1 HETATM 6436 O O . HOH J 5 . ? 22.940 97.569 7.465 1.00 44.66 ? 627 HOH A 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 . CYS A 1 ? 0.7950 0.6083 0.6018 -0.0120 -0.1427 0.0349 30 CYS A N 2 C CA . CYS A 1 ? 0.7823 0.6115 0.6053 -0.0053 -0.1430 0.0361 30 CYS A CA 3 C C . CYS A 1 ? 0.7682 0.6139 0.6056 -0.0008 -0.1429 0.0406 30 CYS A C 4 O O . CYS A 1 ? 0.7643 0.6176 0.6013 0.0072 -0.1373 0.0354 30 CYS A O 5 C CB . CYS A 1 ? 0.7739 0.6028 0.5902 0.0023 -0.1363 0.0270 30 CYS A CB 6 S SG . CYS A 1 ? 0.8051 0.6451 0.6357 0.0096 -0.1378 0.0272 30 CYS A SG 10 N N . GLU A 2 ? 0.6330 0.4833 0.4832 -0.0062 -0.1494 0.0508 31 GLU A N 11 C CA . GLU A 2 ? 0.5909 0.4558 0.4553 -0.0025 -0.1494 0.0572 31 GLU A CA 12 C C . GLU A 2 ? 0.5741 0.4521 0.4510 0.0087 -0.1460 0.0580 31 GLU A C 13 O O . GLU A 2 ? 0.5586 0.4401 0.4295 0.0163 -0.1403 0.0517 31 GLU A O 14 C CB . GLU A 2 ? 0.5820 0.4499 0.4616 -0.0109 -0.1574 0.0697 31 GLU A CB 17 N N . LYS A 3 ? 0.6558 0.5392 0.5499 0.0098 -0.1495 0.0659 32 LYS A N 18 C CA . LYS A 3 ? 0.6736 0.5658 0.5801 0.0215 -0.1461 0.0678 32 LYS A CA 19 C C . LYS A 3 ? 0.6607 0.5448 0.5533 0.0269 -0.1430 0.0562 32 LYS A C 20 O O . LYS A 3 ? 0.6695 0.5440 0.5441 0.0224 -0.1419 0.0468 32 LYS A O 21 C CB . LYS A 3 ? 0.7103 0.6113 0.6439 0.0212 -0.1497 0.0818 32 LYS A CB 22 C CG . LYS A 3 ? 0.7280 0.6396 0.6805 0.0171 -0.1520 0.0949 32 LYS A CG 23 C CD . LYS A 3 ? 0.7391 0.6611 0.7015 0.0281 -0.1455 0.0991 32 LYS A CD 24 C CE . LYS A 3 ? 0.7656 0.6854 0.7107 0.0258 -0.1445 0.0931 32 LYS A CE 25 N NZ . LYS A 3 ? 0.7877 0.7165 0.7420 0.0360 -0.1386 0.0982 32 LYS A NZ 39 N N . ALA A 4 ? 0.3946 0.2815 0.2962 0.0371 -0.1410 0.0572 33 ALA A N 40 C CA . ALA A 4 ? 0.3939 0.2748 0.2866 0.0411 -0.1367 0.0463 33 ALA A CA 41 C C . ALA A 4 ? 0.4071 0.2799 0.2962 0.0321 -0.1440 0.0476 33 ALA A C 42 O O . ALA A 4 ? 0.4180 0.2937 0.3209 0.0253 -0.1489 0.0577 33 ALA A O 43 C CB . ALA A 4 ? 0.4876 0.3755 0.3963 0.0508 -0.1268 0.0462 33 ALA A CB 49 N N . CYS A 5 ? 0.4903 0.3541 0.3629 0.0314 -0.1423 0.0369 34 CYS A N 50 C CA . CYS A 5 ? 0.4800 0.3348 0.3461 0.0222 -0.1455 0.0361 34 CYS A CA 51 C C . CYS A 5 ? 0.4714 0.3198 0.3296 0.0256 -0.1439 0.0280 34 CYS A C 52 O O . CYS A 5 ? 0.4591 0.3096 0.3155 0.0345 -0.1405 0.0219 34 CYS A O 53 C CB . CYS A 5 ? 0.4777 0.3251 0.3286 0.0147 -0.1438 0.0327 34 CYS A CB 54 S SG . CYS A 5 ? 1.5405 1.3874 1.3769 0.0209 -0.1353 0.0211 34 CYS A SG 59 N N . ASN A 6 ? 0.5660 0.4054 0.4186 0.0185 -0.1466 0.0279 35 ASN A N 60 C CA . ASN A 6 ? 0.5784 0.4118 0.4245 0.0207 -0.1455 0.0213 35 ASN A CA 61 C C . ASN A 6 ? 0.5482 0.3687 0.3821 0.0120 -0.1465 0.0208 35 ASN A C 62 O O . ASN A 6 ? 0.5495 0.3651 0.3849 0.0040 -0.1512 0.0276 35 ASN A O 63 C CB . ASN A 6 ? 0.6402 0.4774 0.5007 0.0257 -0.1491 0.0251 35 ASN A CB 64 C CG . ASN A 6 ? 0.6943 0.5278 0.5506 0.0289 -0.1458 0.0169 35 ASN A CG 65 O OD1 . ASN A 6 ? 0.7226 0.5485 0.5755 0.0242 -0.1499 0.0178 35 ASN A OD1 66 N ND2 . ASN A 6 ? 0.7048 0.5431 0.5612 0.0362 -0.1385 0.0090 35 ASN A ND2 73 N N . PRO A 7 ? 0.5039 0.3178 0.3257 0.0134 -0.1422 0.0135 36 PRO A N 74 C CA . PRO A 7 ? 0.5200 0.3191 0.3281 0.0065 -0.1423 0.0137 36 PRO A CA 75 C C . PRO A 7 ? 0.5438 0.3381 0.3569 0.0019 -0.1487 0.0184 36 PRO A C 76 O O . PRO A 7 ? 0.5215 0.3250 0.3502 0.0052 -0.1525 0.0211 36 PRO A O 77 C CB . PRO A 7 ? 0.5027 0.2993 0.3018 0.0111 -0.1363 0.0062 36 PRO A CB 78 C CG . PRO A 7 ? 0.4841 0.2929 0.2894 0.0183 -0.1327 0.0019 36 PRO A CG 79 C CD . PRO A 7 ? 0.4846 0.3032 0.3041 0.0210 -0.1371 0.0055 36 PRO A CD 87 N N . ARG A 8 ? 0.7579 0.5366 0.5573 -0.0053 -0.1495 0.0197 37 ARG A N 88 C CA . ARG A 8 ? 0.7765 0.5490 0.5792 -0.0110 -0.1559 0.0243 37 ARG A CA 89 C C . ARG A 8 ? 0.7589 0.5350 0.5668 -0.0059 -0.1559 0.0208 37 ARG A C 90 O O . ARG A 8 ? 0.7598 0.5358 0.5609 -0.0008 -0.1507 0.0144 37 ARG A O 91 C CB . ARG A 8 ? 0.8260 0.5773 0.6084 -0.0200 -0.1564 0.0257 37 ARG A CB 92 C CG . ARG A 8 ? 0.8609 0.6001 0.6233 -0.0175 -0.1488 0.0199 37 ARG A CG 93 C CD . ARG A 8 ? 0.9019 0.6166 0.6419 -0.0259 -0.1489 0.0218 37 ARG A CD 94 N NE . ARG A 8 ? 0.9334 0.6355 0.6536 -0.0227 -0.1404 0.0175 37 ARG A NE 95 C CZ . ARG A 8 ? 0.9502 0.6511 0.6680 -0.0198 -0.1385 0.0155 37 ARG A CZ 96 N NH1 . ARG A 8 ? 0.9418 0.6530 0.6757 -0.0196 -0.1447 0.0167 37 ARG A NH1 97 N NH2 . ARG A 8 ? 0.9645 0.6535 0.6636 -0.0168 -0.1303 0.0129 37 ARG A NH2 111 N N . MET A 9 ? 0.5528 0.3322 0.3742 -0.0074 -0.1622 0.0256 38 MET A N 112 C CA . MET A 9 ? 0.5301 0.3106 0.3563 -0.0035 -0.1633 0.0229 38 MET A CA 113 C C . MET A 9 ? 0.5474 0.3119 0.3573 -0.0097 -0.1633 0.0221 38 MET A C 114 O O . MET A 9 ? 0.5846 0.3363 0.3829 -0.0180 -0.1648 0.0257 38 MET A O 115 C CB . MET A 9 ? 0.5095 0.2982 0.3566 -0.0022 -0.1693 0.0292 38 MET A CB 116 C CG . MET A 9 ? 0.4939 0.2966 0.3572 0.0054 -0.1684 0.0314 38 MET A CG 117 S SD . MET A 9 ? 1.1579 0.9690 1.0241 0.0173 -0.1594 0.0209 38 MET A SD 118 C CE . MET A 9 ? 1.1074 0.9316 0.9893 0.0242 -0.1559 0.0249 38 MET A CE 128 N N . GLY A 10 ? 0.6106 0.3745 0.4187 -0.0059 -0.1619 0.0176 39 GLY A N 129 C CA . GLY A 10 ? 0.6153 0.3642 0.4079 -0.0109 -0.1614 0.0174 39 GLY A CA 130 C C . GLY A 10 ? 0.6159 0.3697 0.4153 -0.0066 -0.1588 0.0128 39 GLY A C 131 O O . GLY A 10 ? 0.6137 0.3816 0.4285 0.0002 -0.1559 0.0083 39 GLY A O 135 N N . ASN A 11 ? 0.6003 0.3420 0.3894 -0.0111 -0.1583 0.0137 40 ASN A N 136 C CA . ASN A 11 ? 0.5920 0.3388 0.3902 -0.0084 -0.1544 0.0099 40 ASN A CA 137 C C . ASN A 11 ? 0.5811 0.3324 0.3777 -0.0039 -0.1447 0.0050 40 ASN A C 138 O O . ASN A 11 ? 0.6074 0.3479 0.3881 -0.0059 -0.1386 0.0060 40 ASN A O 139 C CB . ASN A 11 ? 0.6059 0.3383 0.3942 -0.0150 -0.1569 0.0135 40 ASN A CB 140 C CG . ASN A 11 ? 0.6015 0.3397 0.4017 -0.0129 -0.1548 0.0107 40 ASN A CG 141 O OD1 . ASN A 11 ? 0.5917 0.3436 0.4074 -0.0070 -0.1531 0.0064 40 ASN A OD1 142 N ND2 . ASN A 11 ? 0.6141 0.3401 0.4056 -0.0182 -0.1555 0.0136 40 ASN A ND2 149 N N . LEU A 12 ? 0.4928 0.2586 0.3053 0.0021 -0.1433 0.0005 41 LEU A N 150 C CA . LEU A 12 ? 0.4725 0.2444 0.2876 0.0059 -0.1361 -0.0028 41 LEU A CA 151 C C . LEU A 12 ? 0.4689 0.2367 0.2844 0.0039 -0.1320 -0.0015 41 LEU A C 152 O O . LEU A 12 ? 0.4827 0.2541 0.3011 0.0061 -0.1253 -0.0018 41 LEU A O 153 C CB . LEU A 12 ? 0.4655 0.2507 0.2952 0.0115 -0.1378 -0.0074 41 LEU A CB 154 C CG . LEU A 12 ? 0.4782 0.2688 0.3089 0.0149 -0.1396 -0.0086 41 LEU A CG 155 C CD1 . LEU A 12 ? 0.4807 0.2802 0.3220 0.0204 -0.1404 -0.0132 41 LEU A CD1 156 C CD2 . LEU A 12 ? 0.4895 0.2788 0.3098 0.0150 -0.1351 -0.0081 41 LEU A CD2 168 N N . ALA A 13 ? 0.4146 0.1754 0.2292 -0.0003 -0.1360 0.0009 42 ALA A N 169 C CA . ALA A 13 ? 0.4205 0.1772 0.2361 -0.0025 -0.1322 0.0030 42 ALA A CA 170 C C . ALA A 13 ? 0.4351 0.1786 0.2333 -0.0045 -0.1228 0.0065 42 ALA A C 171 O O . ALA A 13 ? 0.4377 0.1818 0.2397 -0.0035 -0.1150 0.0084 42 ALA A O 172 C CB . ALA A 13 ? 0.4248 0.1761 0.2423 -0.0067 -0.1392 0.0048 42 ALA A CB 178 N N . LEU A 14 ? 0.5781 0.3084 0.3569 -0.0074 -0.1235 0.0080 43 LEU A N 179 C CA . LEU A 14 ? 0.5993 0.3108 0.3550 -0.0097 -0.1145 0.0111 43 LEU A CA 180 C C . LEU A 14 ? 0.5959 0.3123 0.3536 -0.0040 -0.1028 0.0105 43 LEU A C 181 O O . LEU A 14 ? 0.5818 0.3100 0.3477 0.0000 -0.1036 0.0075 43 LEU A O 182 C CB . LEU A 14 ? 0.6172 0.3120 0.3501 -0.0145 -0.1199 0.0129 43 LEU A CB 183 C CG . LEU A 14 ? 0.6235 0.3120 0.3543 -0.0210 -0.1327 0.0156 43 LEU A CG 184 C CD1 . LEU A 14 ? 0.6464 0.3149 0.3520 -0.0271 -0.1380 0.0192 43 LEU A CD1 185 C CD2 . LEU A 14 ? 0.6330 0.3135 0.3623 -0.0248 -0.1327 0.0179 43 LEU A CD2 197 N N . GLY A 15 ? 0.6242 0.3308 0.3749 -0.0035 -0.0912 0.0140 44 GLY A N 198 C CA . GLY A 15 ? 0.6295 0.3378 0.3812 0.0020 -0.0782 0.0153 44 GLY A CA 199 C C . GLY A 15 ? 0.6126 0.3441 0.3949 0.0067 -0.0765 0.0156 44 GLY A C 200 O O . GLY A 15 ? 0.6274 0.3622 0.4156 0.0113 -0.0655 0.0185 44 GLY A O 204 N N . ARG A 16 ? 0.5563 0.3023 0.3576 0.0055 -0.0875 0.0133 45 ARG A N 205 C CA . ARG A 16 ? 0.5494 0.3147 0.3774 0.0085 -0.0891 0.0137 45 ARG A CA 206 C C . ARG A 16 ? 0.5586 0.3269 0.4002 0.0058 -0.0907 0.0173 45 ARG A C 207 O O . ARG A 16 ? 0.5797 0.3382 0.4121 0.0016 -0.0942 0.0175 45 ARG A O 208 C CB . ARG A 16 ? 0.5275 0.3052 0.3647 0.0097 -0.1006 0.0078 45 ARG A CB 209 C CG . ARG A 16 ? 0.5225 0.2974 0.3465 0.0117 -0.1006 0.0044 45 ARG A CG 210 C CD . ARG A 16 ? 0.5086 0.2968 0.3437 0.0143 -0.1087 -0.0005 45 ARG A CD 211 N NE . ARG A 16 ? 0.5094 0.2942 0.3321 0.0149 -0.1112 -0.0034 45 ARG A NE 212 C CZ . ARG A 16 ? 0.5110 0.2930 0.3241 0.0169 -0.1057 -0.0033 45 ARG A CZ 213 N NH1 . ARG A 16 ? 0.5216 0.3035 0.3362 0.0192 -0.0963 -0.0004 45 ARG A NH1 214 N NH2 . ARG A 16 ? 0.5056 0.2849 0.3088 0.0166 -0.1095 -0.0051 45 ARG A NH2 228 N N . LYS A 17 ? 0.5352 0.3168 0.3992 0.0076 -0.0891 0.0210 46 LYS A N 229 C CA . LYS A 17 ? 0.5401 0.3260 0.4199 0.0047 -0.0915 0.0255 46 LYS A CA 230 C C . LYS A 17 ? 0.5297 0.3215 0.4175 0.0020 -0.1068 0.0207 46 LYS A C 231 O O . LYS A 17 ? 0.5343 0.3362 0.4329 0.0034 -0.1143 0.0178 46 LYS A O 232 C CB . LYS A 17 ? 0.5485 0.3469 0.4520 0.0070 -0.0853 0.0332 46 LYS A CB 233 C CG . LYS A 17 ? 0.5732 0.3642 0.4729 0.0099 -0.0672 0.0409 46 LYS A CG 234 C CD . LYS A 17 ? 0.5684 0.3744 0.4976 0.0123 -0.0614 0.0506 46 LYS A CD 235 C CE . LYS A 17 ? 0.5505 0.3664 0.5030 0.0078 -0.0702 0.0558 46 LYS A CE 236 N NZ . LYS A 17 ? 0.5452 0.3493 0.4872 0.0043 -0.0672 0.0573 46 LYS A NZ 250 N N . LEU A 18 ? 0.6132 0.3967 0.4940 -0.0019 -0.1111 0.0200 47 LEU A N 251 C CA . LEU A 18 ? 0.5905 0.3777 0.4803 -0.0043 -0.1238 0.0170 47 LEU A CA 252 C C . LEU A 18 ? 0.5993 0.3930 0.5083 -0.0067 -0.1247 0.0234 47 LEU A C 253 O O . LEU A 18 ? 0.6121 0.4026 0.5229 -0.0080 -0.1158 0.0302 47 LEU A O 254 C CB . LEU A 18 ? 0.5734 0.3495 0.4498 -0.0074 -0.1286 0.0146 47 LEU A CB 255 C CG . LEU A 18 ? 0.5561 0.3315 0.4257 -0.0057 -0.1366 0.0080 47 LEU A CG 256 C CD1 . LEU A 18 ? 0.5632 0.3279 0.4222 -0.0093 -0.1407 0.0081 47 LEU A CD1 257 C CD2 . LEU A 18 ? 0.5485 0.3316 0.4301 -0.0039 -0.1455 0.0040 47 LEU A CD2 269 N N . ARG A 19 ? 0.5732 0.3743 0.4954 -0.0074 -0.1354 0.0218 48 ARG A N 270 C CA . ARG A 19 ? 0.5770 0.3845 0.5191 -0.0107 -0.1390 0.0287 48 ARG A CA 271 C C . ARG A 19 ? 0.5601 0.3623 0.5025 -0.0147 -0.1509 0.0262 48 ARG A C 272 O O . ARG A 19 ? 0.5551 0.3518 0.4868 -0.0137 -0.1584 0.0185 48 ARG A O 273 C CB . ARG A 19 ? 0.5886 0.4067 0.5457 -0.0096 -0.1433 0.0307 48 ARG A CB 274 C CG . ARG A 19 ? 0.6022 0.4258 0.5604 -0.0051 -0.1315 0.0334 48 ARG A CG 275 C CD . ARG A 19 ? 0.6104 0.4454 0.5877 -0.0050 -0.1359 0.0382 48 ARG A CD 276 N NE . ARG A 19 ? 0.6221 0.4559 0.5929 -0.0049 -0.1485 0.0303 48 ARG A NE 277 C CZ . ARG A 19 ? 0.6394 0.4699 0.6127 -0.0090 -0.1627 0.0285 48 ARG A CZ 278 N NH1 . ARG A 19 ? 0.6514 0.4812 0.6357 -0.0139 -0.1677 0.0342 48 ARG A NH1 279 N NH2 . ARG A 19 ? 0.6407 0.4665 0.6036 -0.0081 -0.1718 0.0211 48 ARG A NH2 293 N N . ALA A 20 ? 0.5072 0.3108 0.4624 -0.0189 -0.1517 0.0336 49 ALA A N 294 C CA . ALA A 20 ? 0.5088 0.3069 0.4656 -0.0232 -0.1631 0.0324 49 ALA A CA 295 C C . ALA A 20 ? 0.5189 0.3241 0.4978 -0.0278 -0.1681 0.0416 49 ALA A C 296 O O . ALA A 20 ? 0.5172 0.3306 0.5105 -0.0279 -0.1589 0.0510 49 ALA A O 297 C CB . ALA A 20 ? 0.5149 0.3036 0.4600 -0.0249 -0.1592 0.0320 49 ALA A CB 303 N N . ASP A 21 ? 0.5311 0.3320 0.5127 -0.0316 -0.1825 0.0398 50 ASP A N 304 C CA . ASP A 21 ? 0.5472 0.3535 0.5496 -0.0373 -0.1908 0.0490 50 ASP A CA 305 C C . ASP A 21 ? 0.5658 0.3759 0.5815 -0.0406 -0.1836 0.0592 50 ASP A C 306 O O . ASP A 21 ? 0.5652 0.3855 0.6040 -0.0435 -0.1825 0.0708 50 ASP A O 307 C CB . ASP A 21 ? 0.5609 0.3564 0.5574 -0.0412 -0.2082 0.0442 50 ASP A CB 308 C CG . ASP A 21 ? 0.5673 0.3563 0.5490 -0.0377 -0.2146 0.0346 50 ASP A CG 309 O OD1 . ASP A 21 ? 0.5524 0.3492 0.5381 -0.0351 -0.2110 0.0356 50 ASP A OD1 310 O OD2 . ASP A 21 ? 0.5837 0.3589 0.5493 -0.0373 -0.2226 0.0265 50 ASP A OD2 315 N N . THR A 22 ? 0.4520 0.2535 0.4536 -0.0403 -0.1787 0.0557 51 THR A N 316 C CA . THR A 22 ? 0.4936 0.2951 0.5034 -0.0439 -0.1726 0.0644 51 THR A CA 317 C C . THR A 22 ? 0.5358 0.3280 0.5259 -0.0417 -0.1609 0.0610 51 THR A C 318 O O . THR A 22 ? 0.5517 0.3365 0.5224 -0.0387 -0.1617 0.0515 51 THR A O 319 C CB . THR A 22 ? 0.4993 0.2954 0.5144 -0.0504 -0.1872 0.0656 51 THR A CB 320 O OG1 . THR A 22 ? 0.4939 0.2774 0.4885 -0.0493 -0.1951 0.0541 51 THR A OG1 321 C CG2 . THR A 22 ? 0.5059 0.3081 0.5395 -0.0545 -0.2006 0.0708 51 THR A CG2 329 N N . MET A 23 ? 0.5209 0.3125 0.5159 -0.0435 -0.1503 0.0698 52 MET A N 330 C CA . MET A 23 ? 0.5562 0.3349 0.5301 -0.0433 -0.1411 0.0679 52 MET A CA 331 C C . MET A 23 ? 0.5653 0.3412 0.5470 -0.0480 -0.1374 0.0772 52 MET A C 332 O O . MET A 23 ? 0.5756 0.3619 0.5806 -0.0495 -0.1345 0.0877 52 MET A O 333 C CB . MET A 23 ? 0.5870 0.3627 0.5483 -0.0381 -0.1246 0.0682 52 MET A CB 334 C CG . MET A 23 ? 0.6099 0.3950 0.5894 -0.0356 -0.1105 0.0796 52 MET A CG 335 S SD . MET A 23 ? 0.4729 0.2475 0.4307 -0.0294 -0.0891 0.0798 52 MET A SD 336 C CE . MET A 23 ? 0.4730 0.2624 0.4611 -0.0256 -0.0741 0.0946 52 MET A CE 346 N N . CYS A 24 ? 0.6589 0.4209 0.6221 -0.0507 -0.1379 0.0742 53 CYS A N 347 C CA . CYS A 24 ? 0.6904 0.4477 0.6580 -0.0557 -0.1356 0.0822 53 CYS A CA 348 C C . CYS A 24 ? 0.7250 0.4830 0.6977 -0.0538 -0.1160 0.0933 53 CYS A C 349 O O . CYS A 24 ? 0.7349 0.4899 0.6967 -0.0488 -0.1027 0.0928 53 CYS A O 350 C CB . CYS A 24 ? 0.7004 0.4406 0.6440 -0.0588 -0.1394 0.0767 53 CYS A CB 351 S SG . CYS A 24 ? 0.6593 0.3821 0.5703 -0.0562 -0.1251 0.0739 53 CYS A SG 356 N N . GLY A 25 ? 0.5451 0.3062 0.5340 -0.0577 -0.1137 0.1037 54 GLY A N 357 C CA . GLY A 25 ? 0.5582 0.3190 0.5534 -0.0556 -0.0934 0.1158 54 GLY A CA 358 C C . GLY A 25 ? 0.6084 0.3845 0.6250 -0.0500 -0.0838 0.1225 54 GLY A C 359 O O . GLY A 25 ? 0.6121 0.3834 0.6224 -0.0447 -0.0636 0.1278 54 GLY A O 363 N N . GLN A 26 ? 0.7427 0.5354 0.7832 -0.0512 -0.0984 0.1224 55 GLN A N 364 C CA . GLN A 26 ? 0.7708 0.5795 0.8349 -0.0469 -0.0924 0.1296 55 GLN A CA 365 C C . GLN A 26 ? 0.8314 0.6487 0.9215 -0.0459 -0.0761 0.1475 55 GLN A C 366 O O . GLN A 26 ? 0.8515 0.6712 0.9461 -0.0393 -0.0573 0.1540 55 GLN A O 367 C CB . GLN A 26 ? 0.7314 0.5535 0.8152 -0.0503 -0.1138 0.1274 55 GLN A CB 368 C CG . GLN A 26 ? 0.7198 0.5552 0.8198 -0.0459 -0.1113 0.1305 55 GLN A CG 369 C CD . GLN A 26 ? 0.7391 0.5669 0.8124 -0.0400 -0.1077 0.1172 55 GLN A CD 370 O OE1 . GLN A 26 ? 0.7576 0.5836 0.8243 -0.0338 -0.0899 0.1191 55 GLN A OE1 371 N NE2 . GLN A 26 ? 0.7428 0.5653 0.8004 -0.0418 -0.1240 0.1041 55 GLN A NE2 380 N N . ASN A 27 ? 1.1098 0.9309 1.2174 -0.0522 -0.0828 0.1560 56 ASN A N 381 C CA . ASN A 27 ? 1.1646 0.9944 1.2996 -0.0518 -0.0677 0.1746 56 ASN A CA 382 C C . ASN A 27 ? 1.0974 0.9086 1.2082 -0.0497 -0.0474 0.1766 56 ASN A C 383 O O . ASN A 27 ? 1.1087 0.9096 1.2021 -0.0425 -0.0264 0.1767 56 ASN A O 384 C CB . ASN A 27 ? 1.2985 1.1413 1.4651 -0.0604 -0.0852 0.1843 56 ASN A CB 385 C CG . ASN A 27 ? 1.4186 1.2771 1.6089 -0.0634 -0.1051 0.1850 56 ASN A CG 386 O OD1 . ASN A 27 ? 1.4456 1.3052 1.6271 -0.0591 -0.1071 0.1764 56 ASN A OD1 387 N ND2 . ASN A 27 ? 1.5042 1.3731 1.7233 -0.0713 -0.1206 0.1955 56 ASN A ND2 393 N N . ALA A 28 ? 0.8295 0.6340 0.9371 -0.0563 -0.0542 0.1781 57 ALA A N 394 C CA . ALA A 28 ? 0.7874 0.5720 0.8702 -0.0559 -0.0376 0.1801 57 ALA A CA 395 C C . ALA A 28 ? 0.7363 0.4992 0.7768 -0.0586 -0.0472 0.1631 57 ALA A C 396 O O . ALA A 28 ? 0.7211 0.4852 0.7524 -0.0590 -0.0629 0.1503 57 ALA A O 397 C CB . ALA A 28 ? 0.7900 0.5807 0.8966 -0.0617 -0.0382 0.1940 57 ALA A CB 403 N N . THR A 29 ? 0.6580 0.4005 0.6734 -0.0605 -0.0375 0.1640 58 THR A N 404 C CA . THR A 29 ? 0.6458 0.3669 0.6227 -0.0640 -0.0467 0.1502 58 THR A CA 405 C C . THR A 29 ? 0.6065 0.3337 0.5924 -0.0715 -0.0723 0.1444 58 THR A C 406 O O . THR A 29 ? 0.5942 0.3354 0.6094 -0.0755 -0.0797 0.1529 58 THR A O 407 C CB . THR A 29 ? 0.6921 0.3871 0.6384 -0.0651 -0.0301 0.1540 58 THR A CB 408 O OG1 . THR A 29 ? 0.7155 0.4045 0.6579 -0.0576 -0.0035 0.1627 58 THR A OG1 409 C CG2 . THR A 29 ? 0.7084 0.3793 0.6120 -0.0679 -0.0379 0.1406 58 THR A CG2 417 N N . GLU A 30 ? 0.7003 0.4162 0.6612 -0.0733 -0.0855 0.1308 59 GLU A N 418 C CA . GLU A 30 ? 0.6785 0.3974 0.6446 -0.0790 -0.1085 0.1243 59 GLU A CA 419 C C . GLU A 30 ? 0.6569 0.3547 0.5903 -0.0824 -0.1147 0.1155 59 GLU A C 420 O O . GLU A 30 ? 0.6575 0.3435 0.5658 -0.0797 -0.1107 0.1084 59 GLU A O 421 C CB . GLU A 30 ? 0.6791 0.4128 0.6590 -0.0767 -0.1230 0.1165 59 GLU A CB 422 C CG . GLU A 30 ? 0.6928 0.4474 0.7067 -0.0750 -0.1218 0.1254 59 GLU A CG 423 C CD . GLU A 30 ? 0.7035 0.4683 0.7251 -0.0731 -0.1364 0.1171 59 GLU A CD 424 O OE1 . GLU A 30 ? 0.7097 0.4660 0.7111 -0.0722 -0.1456 0.1045 59 GLU A OE1 425 O OE2 . GLU A 30 ? 0.7036 0.4843 0.7519 -0.0727 -0.1387 0.1239 59 GLU A OE2 432 N N . LEU A 31 ? 0.6624 0.3554 0.5972 -0.0888 -0.1253 0.1168 60 LEU A N 433 C CA . LEU A 31 ? 0.6518 0.3270 0.5609 -0.0927 -0.1349 0.1093 60 LEU A CA 434 C C . LEU A 31 ? 0.6405 0.3219 0.5526 -0.0914 -0.1528 0.0982 60 LEU A C 435 O O . LEU A 31 ? 0.6368 0.3326 0.5716 -0.0912 -0.1636 0.0974 60 LEU A O 436 C CB . LEU A 31 ? 0.6436 0.3118 0.5547 -0.0999 -0.1399 0.1152 60 LEU A CB 437 C CG . LEU A 31 ? 0.6332 0.2838 0.5217 -0.1049 -0.1520 0.1091 60 LEU A CG 438 C CD1 . LEU A 31 ? 0.6451 0.2743 0.4988 -0.1048 -0.1425 0.1068 60 LEU A CD1 439 C CD2 . LEU A 31 ? 0.6361 0.2817 0.5299 -0.1118 -0.1568 0.1157 60 LEU A CD2 451 N N . PHE A 32 ? 0.5655 0.2347 0.4542 -0.0907 -0.1559 0.0905 61 PHE A N 452 C CA . PHE A 32 ? 0.5518 0.2253 0.4425 -0.0888 -0.1709 0.0808 61 PHE A CA 453 C C . PHE A 32 ? 0.5615 0.2183 0.4310 -0.0924 -0.1787 0.0771 61 PHE A C 454 O O . PHE A 32 ? 0.5784 0.2189 0.4249 -0.0951 -0.1712 0.0797 61 PHE A O 455 C CB . PHE A 32 ? 0.5403 0.2227 0.4317 -0.0820 -0.1665 0.0756 61 PHE A CB 456 C CG . PHE A 32 ? 0.5510 0.2204 0.4169 -0.0805 -0.1563 0.0742 61 PHE A CG 457 C CD1 . PHE A 32 ? 0.5606 0.2270 0.4197 -0.0784 -0.1387 0.0797 61 PHE A CD1 458 C CD2 . PHE A 32 ? 0.5530 0.2124 0.4019 -0.0813 -0.1643 0.0683 61 PHE A CD2 459 C CE1 . PHE A 32 ? 0.5743 0.2248 0.4060 -0.0773 -0.1298 0.0782 61 PHE A CE1 460 C CE2 . PHE A 32 ? 0.5653 0.2107 0.3893 -0.0811 -0.1569 0.0677 61 PHE A CE2 461 C CZ . PHE A 32 ? 0.5769 0.2166 0.3904 -0.0793 -0.1398 0.0721 61 PHE A CZ 471 N N . CYS A 33 ? 0.6738 0.3332 0.5506 -0.0924 -0.1938 0.0717 62 CYS A N 472 C CA . CYS A 33 ? 0.6781 0.3282 0.5416 -0.0946 -0.2019 0.0687 62 CYS A CA 473 C C . CYS A 33 ? 0.6614 0.3192 0.5291 -0.0889 -0.2094 0.0611 62 CYS A C 474 O O . CYS A 33 ? 0.6471 0.3134 0.5289 -0.0847 -0.2128 0.0574 62 CYS A O 475 C CB . CYS A 33 ? 0.6859 0.3381 0.5568 -0.0984 -0.2098 0.0705 62 CYS A CB 476 S SG . CYS A 33 ? 0.7613 0.4028 0.6239 -0.1056 -0.2007 0.0799 62 CYS A SG 481 N N . PHE A 34 ? 0.7601 0.4143 0.6152 -0.0890 -0.2120 0.0595 63 PHE A N 482 C CA . PHE A 34 ? 0.7532 0.4146 0.6138 -0.0836 -0.2187 0.0543 63 PHE A CA 483 C C . PHE A 34 ? 0.7706 0.4336 0.6344 -0.0844 -0.2280 0.0552 63 PHE A C 484 O O . PHE A 34 ? 0.7811 0.4373 0.6345 -0.0900 -0.2289 0.0593 63 PHE A O 485 C CB . PHE A 34 ? 0.7427 0.3995 0.5888 -0.0826 -0.2139 0.0534 63 PHE A CB 486 C CG . PHE A 34 ? 0.7194 0.3782 0.5677 -0.0786 -0.2070 0.0509 63 PHE A CG 487 C CD1 . PHE A 34 ? 0.6961 0.3639 0.5556 -0.0723 -0.2106 0.0454 63 PHE A CD1 488 C CD2 . PHE A 34 ? 0.7227 0.3758 0.5622 -0.0803 -0.1956 0.0543 63 PHE A CD2 489 C CE1 . PHE A 34 ? 0.6812 0.3586 0.5439 -0.0672 -0.2028 0.0425 63 PHE A CE1 490 C CE2 . PHE A 34 ? 0.7080 0.3725 0.5532 -0.0745 -0.1870 0.0519 63 PHE A CE2 491 C CZ . PHE A 34 ? 0.6861 0.3628 0.5427 -0.0684 -0.1914 0.0458 63 PHE A CZ 501 N N . TYR A 35 ? 0.7072 0.3780 0.5850 -0.0785 -0.2345 0.0516 64 TYR A N 502 C CA . TYR A 35 ? 0.7205 0.3928 0.6049 -0.0779 -0.2429 0.0530 64 TYR A CA 503 C C . TYR A 35 ? 0.6833 0.3597 0.5741 -0.0723 -0.2462 0.0511 64 TYR A C 504 O O . TYR A 35 ? 0.6829 0.3633 0.5808 -0.0660 -0.2445 0.0463 64 TYR A O 505 C CB . TYR A 35 ? 0.7625 0.4375 0.6592 -0.0761 -0.2472 0.0516 64 TYR A CB 506 C CG . TYR A 35 ? 0.8005 0.4721 0.6942 -0.0825 -0.2455 0.0552 64 TYR A CG 507 C CD1 . TYR A 35 ? 0.8098 0.4809 0.7021 -0.0847 -0.2388 0.0556 64 TYR A CD1 508 C CD2 . TYR A 35 ? 0.8174 0.4864 0.7115 -0.0863 -0.2506 0.0589 64 TYR A CD2 509 C CE1 . TYR A 35 ? 0.8214 0.4894 0.7138 -0.0906 -0.2367 0.0602 64 TYR A CE1 510 C CE2 . TYR A 35 ? 0.8285 0.4943 0.7207 -0.0922 -0.2488 0.0626 64 TYR A CE2 511 C CZ . TYR A 35 ? 0.8291 0.4945 0.7210 -0.0944 -0.2416 0.0635 64 TYR A CZ 512 O OH . TYR A 35 ? 0.8330 0.4952 0.7255 -0.1004 -0.2390 0.0687 64 TYR A OH 522 N N . SER A 36 ? 0.5390 0.2141 0.4278 -0.0750 -0.2512 0.0553 65 SER A N 523 C CA . SER A 36 ? 0.5284 0.2080 0.4273 -0.0709 -0.2553 0.0554 65 SER A CA 524 C C . SER A 36 ? 0.5703 0.2507 0.4796 -0.0724 -0.2637 0.0594 65 SER A C 525 O O . SER A 36 ? 0.5953 0.2726 0.5020 -0.0762 -0.2664 0.0616 65 SER A O 526 C CB . SER A 36 ? 0.5241 0.2023 0.4119 -0.0738 -0.2537 0.0576 65 SER A CB 527 O OG . SER A 36 ? 0.5376 0.2085 0.4089 -0.0822 -0.2552 0.0625 65 SER A OG 533 N N . GLU A 37 ? 0.6100 0.2949 0.5327 -0.0695 -0.2675 0.0607 66 GLU A N 534 C CA . GLU A 37 ? 0.6300 0.3167 0.5673 -0.0702 -0.2748 0.0646 66 GLU A CA 535 C C . GLU A 37 ? 0.6399 0.3299 0.5816 -0.0753 -0.2804 0.0710 66 GLU A C 536 O O . GLU A 37 ? 0.6325 0.3244 0.5703 -0.0758 -0.2783 0.0713 66 GLU A O 537 C CB . GLU A 37 ? 0.6319 0.3207 0.5872 -0.0608 -0.2728 0.0607 66 GLU A CB 538 C CG . GLU A 37 ? 0.6411 0.3351 0.6092 -0.0546 -0.2695 0.0610 66 GLU A CG 539 C CD . GLU A 37 ? 0.6517 0.3468 0.6089 -0.0534 -0.2640 0.0578 66 GLU A CD 540 O OE1 . GLU A 37 ? 0.6586 0.3499 0.6006 -0.0550 -0.2610 0.0538 66 GLU A OE1 541 O OE2 . GLU A 37 ? 0.6533 0.3535 0.6183 -0.0508 -0.2621 0.0600 66 GLU A OE2 548 N N . ASN A 38 ? 0.9109 0.6014 0.8612 -0.0795 -0.2881 0.0763 67 ASN A N 549 C CA . ASN A 38 ? 0.8915 0.5864 0.8515 -0.0849 -0.2951 0.0831 67 ASN A CA 550 C C . ASN A 38 ? 0.8977 0.5999 0.8874 -0.0785 -0.2952 0.0857 67 ASN A C 551 O O . ASN A 38 ? 0.8905 0.5926 0.8889 -0.0690 -0.2888 0.0811 67 ASN A O 552 C CB . ASN A 38 ? 0.9079 0.5978 0.8558 -0.0949 -0.3041 0.0886 67 ASN A CB 553 C CG . ASN A 38 ? 0.9178 0.6054 0.8702 -0.0942 -0.3068 0.0887 67 ASN A CG 554 O OD1 . ASN A 38 ? 0.9185 0.6101 0.8921 -0.0883 -0.3064 0.0880 67 ASN A OD1 555 N ND2 . ASN A 38 ? 0.9285 0.6082 0.8598 -0.0998 -0.3084 0.0898 67 ASN A ND2 562 N N . ALA A 39 ? 0.6940 0.4016 0.6985 -0.0834 -0.3019 0.0936 68 ALA A N 563 C CA . ALA A 39 ? 0.6972 0.4131 0.7322 -0.0766 -0.3000 0.0985 68 ALA A CA 564 C C . ALA A 39 ? 0.7098 0.4231 0.7554 -0.0701 -0.2983 0.0970 68 ALA A C 565 O O . ALA A 39 ? 0.7078 0.4235 0.7700 -0.0588 -0.2904 0.0965 68 ALA A O 566 C CB . ALA A 39 ? 0.6996 0.4219 0.7491 -0.0852 -0.3092 0.1087 68 ALA A CB 572 N N . ASP A 40 ? 0.8553 0.5625 0.8895 -0.0767 -0.3050 0.0963 69 ASP A N 573 C CA . ASP A 40 ? 0.8537 0.5572 0.8961 -0.0721 -0.3048 0.0950 69 ASP A CA 574 C C . ASP A 40 ? 0.8451 0.5414 0.8749 -0.0644 -0.2972 0.0854 69 ASP A C 575 O O . ASP A 40 ? 0.8620 0.5529 0.8934 -0.0613 -0.2973 0.0830 69 ASP A O 576 C CB . ASP A 40 ? 0.8622 0.5624 0.8970 -0.0822 -0.3155 0.0987 69 ASP A CB 579 N N . LEU A 41 ? 0.5751 0.2711 0.5924 -0.0620 -0.2913 0.0802 70 LEU A N 580 C CA . LEU A 41 ? 0.5546 0.2444 0.5593 -0.0562 -0.2851 0.0713 70 LEU A CA 581 C C . LEU A 41 ? 0.5737 0.2578 0.5625 -0.0624 -0.2893 0.0694 70 LEU A C 582 O O . LEU A 41 ? 0.5904 0.2694 0.5727 -0.0586 -0.2862 0.0635 70 LEU A O 583 C CB . LEU A 41 ? 0.5369 0.2231 0.5540 -0.0443 -0.2787 0.0680 70 LEU A CB 584 C CG . LEU A 41 ? 0.5328 0.2245 0.5663 -0.0352 -0.2715 0.0707 70 LEU A CG 585 C CD1 . LEU A 41 ? 0.5386 0.2225 0.5750 -0.0221 -0.2627 0.0654 70 LEU A CD1 586 C CD2 . LEU A 41 ? 0.5236 0.2207 0.5499 -0.0364 -0.2686 0.0697 70 LEU A CD2 598 N N . THR A 42 ? 0.7103 0.3951 0.6925 -0.0718 -0.2962 0.0750 71 THR A N 599 C CA . THR A 42 ? 0.7131 0.3929 0.6785 -0.0774 -0.2983 0.0749 71 THR A CA 600 C C . THR A 42 ? 0.6874 0.3656 0.6335 -0.0794 -0.2923 0.0725 71 THR A C 601 O O . THR A 42 ? 0.6955 0.3757 0.6367 -0.0811 -0.2908 0.0738 71 THR A O 602 C CB . THR A 42 ? 0.7288 0.4077 0.6914 -0.0861 -0.3070 0.0822 71 THR A CB 603 O OG1 . THR A 42 ? 0.7364 0.4187 0.7208 -0.0847 -0.3125 0.0858 71 THR A OG1 604 C CG2 . THR A 42 ? 0.7375 0.4105 0.6865 -0.0899 -0.3080 0.0825 71 THR A CG2 612 N N . CYS A 43 ? 0.5511 0.2256 0.4873 -0.0795 -0.2885 0.0695 72 CYS A N 613 C CA . CYS A 43 ? 0.5500 0.2227 0.4702 -0.0817 -0.2814 0.0679 72 CYS A CA 614 C C . CYS A 43 ? 0.5599 0.2281 0.4634 -0.0901 -0.2822 0.0733 72 CYS A C 615 O O . CYS A 43 ? 0.5698 0.2344 0.4695 -0.0954 -0.2874 0.0777 72 CYS A O 616 C CB . CYS A 43 ? 0.5506 0.2211 0.4679 -0.0813 -0.2778 0.0649 72 CYS A CB 617 S SG . CYS A 43 ? 1.0670 0.7393 0.9959 -0.0721 -0.2760 0.0574 72 CYS A SG 622 N N . ARG A 44 ? 0.6520 0.3190 0.5439 -0.0913 -0.2770 0.0726 73 ARG A N 623 C CA . ARG A 44 ? 0.6804 0.3394 0.5512 -0.0992 -0.2763 0.0765 73 ARG A CA 624 C C . ARG A 44 ? 0.6978 0.3495 0.5541 -0.1029 -0.2685 0.0756 73 ARG A C 625 O O . ARG A 44 ? 0.6922 0.3472 0.5568 -0.0993 -0.2641 0.0722 73 ARG A O 626 C CB . ARG A 44 ? 0.6906 0.3494 0.5535 -0.0991 -0.2736 0.0759 73 ARG A CB 627 C CG . ARG A 44 ? 0.6923 0.3605 0.5749 -0.0940 -0.2787 0.0758 73 ARG A CG 628 C CD . ARG A 44 ? 0.7123 0.3802 0.5867 -0.0953 -0.2774 0.0761 73 ARG A CD 629 N NE . ARG A 44 ? 0.7414 0.4103 0.6186 -0.1010 -0.2875 0.0819 73 ARG A NE 630 C CZ . ARG A 44 ? 0.7555 0.4315 0.6465 -0.1001 -0.2912 0.0833 73 ARG A CZ 631 N NH1 . ARG A 44 ? 0.7469 0.4291 0.6486 -0.0929 -0.2850 0.0791 73 ARG A NH1 632 N NH2 . ARG A 44 ? 0.7747 0.4520 0.6706 -0.1062 -0.2986 0.0892 73 ARG A NH2 646 N N . GLN A 45 ? 0.7807 0.4216 0.6157 -0.1104 -0.2669 0.0787 74 GLN A N 647 C CA . GLN A 45 ? 0.7983 0.4305 0.6193 -0.1142 -0.2575 0.0783 74 GLN A CA 648 C C . GLN A 45 ? 0.7914 0.4236 0.6089 -0.1109 -0.2469 0.0746 74 GLN A C 649 O O . GLN A 45 ? 0.7940 0.4230 0.6008 -0.1108 -0.2449 0.0738 74 GLN A O 650 C CB . GLN A 45 ? 0.8247 0.4419 0.6203 -0.1228 -0.2570 0.0821 74 GLN A CB 651 C CG . GLN A 45 ? 0.8388 0.4550 0.6370 -0.1268 -0.2671 0.0861 74 GLN A CG 652 C CD . GLN A 45 ? 0.8409 0.4611 0.6523 -0.1259 -0.2663 0.0862 74 GLN A CD 653 O OE1 . GLN A 45 ? 0.8437 0.4591 0.6497 -0.1275 -0.2568 0.0857 74 GLN A OE1 654 N NE2 . GLN A 45 ? 0.8359 0.4645 0.6655 -0.1233 -0.2762 0.0874 74 GLN A NE2 663 N N . PRO A 46 ? 0.8617 0.4974 0.6889 -0.1086 -0.2409 0.0727 75 PRO A N 664 C CA . PRO A 46 ? 0.8461 0.4838 0.6745 -0.1047 -0.2323 0.0695 75 PRO A CA 665 C C . PRO A 46 ? 0.8639 0.4880 0.6700 -0.1086 -0.2204 0.0714 75 PRO A C 666 O O . PRO A 46 ? 0.8784 0.4939 0.6765 -0.1131 -0.2143 0.0750 75 PRO A O 667 C CB . PRO A 46 ? 0.8554 0.5009 0.7026 -0.1021 -0.2321 0.0683 75 PRO A CB 668 C CG . PRO A 46 ? 0.8563 0.4976 0.7024 -0.1075 -0.2346 0.0724 75 PRO A CG 669 C CD . PRO A 46 ? 0.8599 0.4977 0.6977 -0.1100 -0.2424 0.0742 75 PRO A CD 677 N N . LYS A 47 ? 0.8495 0.4708 0.6452 -0.1067 -0.2163 0.0694 76 LYS A N 678 C CA . LYS A 47 ? 0.8519 0.4592 0.6260 -0.1086 -0.2031 0.0708 76 LYS A CA 679 C C . LYS A 47 ? 0.8251 0.4358 0.6113 -0.1055 -0.1935 0.0717 76 LYS A C 680 O O . LYS A 47 ? 0.8003 0.4230 0.6045 -0.1002 -0.1958 0.0685 76 LYS A O 681 C CB . LYS A 47 ? 0.8643 0.4682 0.6250 -0.1069 -0.2022 0.0684 76 LYS A CB 682 C CG . LYS A 47 ? 0.8923 0.4908 0.6388 -0.1115 -0.2116 0.0694 76 LYS A CG 683 C CD . LYS A 47 ? 0.9317 0.5090 0.6465 -0.1183 -0.2053 0.0720 76 LYS A CD 684 C CE . LYS A 47 ? 0.9458 0.5162 0.6433 -0.1231 -0.2148 0.0724 76 LYS A CE 685 N NZ . LYS A 47 ? 0.9749 0.5213 0.6368 -0.1296 -0.2084 0.0735 76 LYS A NZ 699 N N . CYS A 48 ? 0.6388 0.2388 0.4157 -0.1087 -0.1827 0.0769 77 CYS A N 700 C CA . CYS A 48 ? 0.6261 0.2295 0.4168 -0.1064 -0.1732 0.0808 77 CYS A CA 701 C C . CYS A 48 ? 0.6415 0.2302 0.4118 -0.1054 -0.1555 0.0847 77 CYS A C 702 O O . CYS A 48 ? 0.6640 0.2364 0.4061 -0.1079 -0.1496 0.0848 77 CYS A O 703 C CB . CYS A 48 ? 0.6255 0.2313 0.4288 -0.1102 -0.1746 0.0860 77 CYS A CB 704 S SG . CYS A 48 ? 1.4441 1.0661 1.2711 -0.1103 -0.1939 0.0816 77 CYS A SG 709 N N . ASP A 49 ? 0.7877 0.3825 0.5723 -0.1013 -0.1468 0.0883 78 ASP A N 710 C CA . ASP A 49 ? 0.7949 0.3820 0.5647 -0.0975 -0.1272 0.0915 78 ASP A CA 711 C C . ASP A 49 ? 0.7724 0.3821 0.5721 -0.0915 -0.1167 0.0954 78 ASP A C 712 O O . ASP A 49 ? 0.7513 0.3818 0.5807 -0.0907 -0.1268 0.0944 78 ASP A O 713 C CB . ASP A 49 ? 0.8100 0.3907 0.5619 -0.0947 -0.1275 0.0854 78 ASP A CB 714 C CG . ASP A 49 ? 0.8602 0.4145 0.5742 -0.0962 -0.1140 0.0874 78 ASP A CG 715 O OD1 . ASP A 49 ? 0.8803 0.4232 0.5854 -0.0953 -0.0966 0.0944 78 ASP A OD1 716 O OD2 . ASP A 49 ? 0.8759 0.4239 0.5706 -0.0976 -0.1200 0.0815 78 ASP A OD2 721 N N . LYS A 50 ? 0.6407 0.2445 0.4316 -0.0874 -0.0967 0.1004 79 LYS A N 722 C CA . LYS A 50 ? 0.6279 0.2529 0.4485 -0.0815 -0.0856 0.1062 79 LYS A CA 723 C C . LYS A 50 ? 0.6135 0.2500 0.4396 -0.0745 -0.0825 0.1011 79 LYS A C 724 O O . LYS A 50 ? 0.6241 0.2453 0.4230 -0.0730 -0.0785 0.0964 79 LYS A O 725 C CB . LYS A 50 ? 0.6517 0.2647 0.4644 -0.0804 -0.0630 0.1172 79 LYS A CB 726 C CG . LYS A 50 ? 0.6667 0.2692 0.4759 -0.0872 -0.0642 0.1236 79 LYS A CG 727 C CD . LYS A 50 ? 0.6808 0.2837 0.5006 -0.0844 -0.0422 0.1367 79 LYS A CD 728 C CE . LYS A 50 ? 0.7083 0.2885 0.4975 -0.0790 -0.0180 0.1396 79 LYS A CE 729 N NZ . LYS A 50 ? 0.7218 0.3041 0.5252 -0.0747 0.0058 0.1536 79 LYS A NZ 743 N N . CYS A 51 ? 0.7457 0.4080 0.6062 -0.0709 -0.0855 0.1026 80 CYS A N 744 C CA . CYS A 51 ? 0.7193 0.3946 0.5887 -0.0643 -0.0831 0.0987 80 CYS A CA 745 C C . CYS A 51 ? 0.7212 0.4102 0.6143 -0.0593 -0.0670 0.1089 80 CYS A C 746 O O . CYS A 51 ? 0.7060 0.4085 0.6266 -0.0612 -0.0681 0.1173 80 CYS A O 747 C CB . CYS A 51 ? 0.6790 0.3716 0.5668 -0.0645 -0.1032 0.0908 80 CYS A CB 748 S SG . CYS A 51 ? 1.1370 0.8474 1.0394 -0.0571 -0.1016 0.0869 80 CYS A SG 753 N N . ASN A 52 ? 0.6772 0.3631 0.5610 -0.0530 -0.0526 0.1089 81 ASN A N 754 C CA . ASN A 52 ? 0.6079 0.3069 0.5153 -0.0470 -0.0361 0.1193 81 ASN A CA 755 C C . ASN A 52 ? 0.6163 0.3187 0.5192 -0.0402 -0.0301 0.1147 81 ASN A C 756 O O . ASN A 52 ? 0.6432 0.3251 0.5125 -0.0383 -0.0226 0.1093 81 ASN A O 757 C CB . ASN A 52 ? 0.6351 0.3175 0.5307 -0.0458 -0.0135 0.1301 81 ASN A CB 758 C CG . ASN A 52 ? 0.6327 0.3323 0.5620 -0.0401 0.0032 0.1442 81 ASN A CG 759 O OD1 . ASN A 52 ? 0.6198 0.3343 0.5665 -0.0345 0.0063 0.1450 81 ASN A OD1 760 N ND2 . ASN A 52 ? 0.6455 0.3435 0.5859 -0.0416 0.0141 0.1564 81 ASN A ND2 767 N N . ALA A 53 ? 0.5971 0.3241 0.5331 -0.0372 -0.0346 0.1172 82 ALA A N 768 C CA . ALA A 53 ? 0.5860 0.3189 0.5213 -0.0312 -0.0316 0.1127 82 ALA A CA 769 C C . ALA A 53 ? 0.6036 0.3274 0.5311 -0.0239 -0.0058 0.1203 82 ALA A C 770 O O . ALA A 53 ? 0.6074 0.3229 0.5159 -0.0193 0.0003 0.1147 82 ALA A O 771 C CB . ALA A 53 ? 0.5614 0.3213 0.5336 -0.0309 -0.0446 0.1142 82 ALA A CB 777 N N . ALA A 54 ? 0.6319 0.3565 0.5742 -0.0227 0.0098 0.1337 83 ALA A N 778 C CA . ALA A 54 ? 0.6608 0.3771 0.5997 -0.0145 0.0370 0.1432 83 ALA A CA 779 C C . ALA A 54 ? 0.7032 0.3838 0.5906 -0.0129 0.0508 0.1373 83 ALA A C 780 O O . ALA A 54 ? 0.7305 0.3987 0.6049 -0.0054 0.0721 0.1411 83 ALA A O 781 C CB . ALA A 54 ? 0.6643 0.3893 0.6322 -0.0137 0.0508 0.1601 83 ALA A CB 787 N N . HIS A 55 ? 0.6287 0.2915 0.4864 -0.0202 0.0381 0.1285 84 HIS A N 788 C CA . HIS A 55 ? 0.6610 0.2868 0.4672 -0.0210 0.0474 0.1235 84 HIS A CA 789 C C . HIS A 55 ? 0.6539 0.2718 0.4355 -0.0255 0.0276 0.1093 84 HIS A C 790 O O . HIS A 55 ? 0.6330 0.2644 0.4270 -0.0313 0.0055 0.1033 84 HIS A O 791 C CB . HIS A 55 ? 0.6845 0.2908 0.4741 -0.0264 0.0523 0.1287 84 HIS A CB 792 C CG . HIS A 55 ? 0.7087 0.3222 0.5229 -0.0220 0.0728 0.1439 84 HIS A CG 793 N ND1 . HIS A 55 ? 0.6823 0.3281 0.5458 -0.0231 0.0656 0.1520 84 HIS A ND1 794 C CD2 . HIS A 55 ? 0.7260 0.3177 0.5229 -0.0165 0.1007 0.1535 84 HIS A CD2 795 C CE1 . HIS A 55 ? 0.6952 0.3414 0.5739 -0.0186 0.0877 0.1667 84 HIS A CE1 796 N NE2 . HIS A 55 ? 0.7181 0.3316 0.5570 -0.0139 0.1104 0.1678 84 HIS A NE2 803 N N . SER A 56 ? 0.7452 0.3402 0.4919 -0.0227 0.0362 0.1048 85 SER A N 804 C CA . SER A 56 ? 0.7303 0.3186 0.4557 -0.0262 0.0191 0.0931 85 SER A CA 805 C C . SER A 56 ? 0.7313 0.3045 0.4352 -0.0360 0.0017 0.0881 85 SER A C 806 O O . SER A 56 ? 0.7195 0.3043 0.4305 -0.0398 -0.0190 0.0806 85 SER A O 807 C CB . SER A 56 ? 0.7467 0.3083 0.4350 -0.0220 0.0332 0.0911 85 SER A CB 808 O OG . SER A 56 ? 0.7398 0.2904 0.4035 -0.0270 0.0164 0.0814 85 SER A OG 814 N N . HIS A 57 ? 0.7130 0.2599 0.3911 -0.0398 0.0106 0.0930 86 HIS A N 815 C CA . HIS A 57 ? 0.7207 0.2493 0.3750 -0.0496 -0.0052 0.0895 86 HIS A CA 816 C C . HIS A 57 ? 0.6965 0.2487 0.3840 -0.0540 -0.0205 0.0904 86 HIS A C 817 O O . HIS A 57 ? 0.7796 0.3198 0.4534 -0.0619 -0.0337 0.0887 86 HIS A O 818 C CB . HIS A 57 ? 0.7665 0.2544 0.3765 -0.0527 0.0098 0.0945 86 HIS A CB 819 C CG . HIS A 57 ? 0.7761 0.2656 0.3996 -0.0505 0.0265 0.1045 86 HIS A CG 820 N ND1 . HIS A 57 ? 0.8608 0.3606 0.5037 -0.0410 0.0492 0.1123 86 HIS A ND1 821 C CD2 . HIS A 57 ? 0.7861 0.2687 0.4081 -0.0565 0.0238 0.1090 86 HIS A CD2 822 C CE1 . HIS A 57 ? 0.8690 0.3688 0.5228 -0.0413 0.0602 0.1217 86 HIS A CE1 823 N NE2 . HIS A 57 ? 0.8736 0.3627 0.5140 -0.0507 0.0451 0.1194 86 HIS A NE2 830 N N . LEU A 58 ? 0.6657 0.2498 0.3961 -0.0492 -0.0193 0.0936 87 LEU A N 831 C CA . LEU A 58 ? 0.6434 0.2496 0.4060 -0.0531 -0.0341 0.0946 87 LEU A CA 832 C C . LEU A 58 ? 0.6081 0.2459 0.4056 -0.0500 -0.0474 0.0898 87 LEU A C 833 O O . LEU A 58 ? 0.5899 0.2436 0.4100 -0.0534 -0.0630 0.0884 87 LEU A O 834 C CB . LEU A 58 ? 0.6508 0.2616 0.4315 -0.0522 -0.0203 0.1060 87 LEU A CB 835 C CG . LEU A 58 ? 0.6879 0.2670 0.4352 -0.0552 -0.0057 0.1119 87 LEU A CG 836 C CD1 . LEU A 58 ? 0.6924 0.2806 0.4641 -0.0526 0.0104 0.1247 87 LEU A CD1 837 C CD2 . LEU A 58 ? 0.6966 0.2595 0.4225 -0.0647 -0.0229 0.1073 87 LEU A CD2 849 N N . ALA A 59 ? 0.6010 0.2453 0.4006 -0.0438 -0.0411 0.0875 88 ALA A N 850 C CA . ALA A 59 ? 0.5710 0.2428 0.4010 -0.0406 -0.0519 0.0836 88 ALA A CA 851 C C . ALA A 59 ? 0.5582 0.2313 0.3805 -0.0432 -0.0712 0.0728 88 ALA A C 852 O O . ALA A 59 ? 0.5723 0.2254 0.3651 -0.0465 -0.0746 0.0687 88 ALA A O 853 C CB . ALA A 59 ? 0.5689 0.2473 0.4049 -0.0328 -0.0376 0.0858 88 ALA A CB 859 N N . HIS A 60 ? 0.5684 0.2639 0.4173 -0.0419 -0.0837 0.0692 89 HIS A N 860 C CA . HIS A 60 ? 0.5553 0.2543 0.4011 -0.0425 -0.0998 0.0597 89 HIS A CA 861 C C . HIS A 60 ? 0.5345 0.2541 0.4021 -0.0375 -0.1036 0.0566 89 HIS A C 862 O O . HIS A 60 ? 0.5202 0.2520 0.4049 -0.0383 -0.1169 0.0534 89 HIS A O 863 C CB . HIS A 60 ? 0.5516 0.2507 0.4028 -0.0479 -0.1152 0.0578 89 HIS A CB 864 C CG . HIS A 60 ? 0.5720 0.2500 0.4006 -0.0537 -0.1143 0.0603 89 HIS A CG 865 N ND1 . HIS A 60 ? 0.5864 0.2570 0.4141 -0.0565 -0.1052 0.0681 89 HIS A ND1 866 C CD2 . HIS A 60 ? 0.5819 0.2438 0.3879 -0.0577 -0.1218 0.0569 89 HIS A CD2 867 C CE1 . HIS A 60 ? 0.6052 0.2547 0.4082 -0.0621 -0.1072 0.0686 89 HIS A CE1 868 N NE2 . HIS A 60 ? 0.6029 0.2468 0.3928 -0.0632 -0.1180 0.0622 89 HIS A NE2 875 N N . PRO A 61 ? 0.6196 0.3409 0.4844 -0.0324 -0.0919 0.0577 90 PRO A N 876 C CA . PRO A 61 ? 0.6020 0.3416 0.4861 -0.0277 -0.0944 0.0556 90 PRO A CA 877 C C . PRO A 61 ? 0.5911 0.3326 0.4679 -0.0267 -0.1065 0.0458 90 PRO A C 878 O O . PRO A 61 ? 0.5985 0.3267 0.4544 -0.0290 -0.1101 0.0418 90 PRO A O 879 C CB . PRO A 61 ? 0.6106 0.3469 0.4892 -0.0227 -0.0763 0.0603 90 PRO A CB 880 C CG . PRO A 61 ? 0.6325 0.3440 0.4770 -0.0244 -0.0686 0.0593 90 PRO A CG 881 C CD . PRO A 61 ? 0.6402 0.3429 0.4795 -0.0308 -0.0758 0.0605 90 PRO A CD 889 N N . PRO A 62 ? 0.4645 0.2215 0.3582 -0.0237 -0.1127 0.0428 91 PRO A N 890 C CA . PRO A 62 ? 0.4550 0.2141 0.3429 -0.0219 -0.1228 0.0340 91 PRO A CA 891 C C . PRO A 62 ? 0.4607 0.2098 0.3264 -0.0199 -0.1170 0.0308 91 PRO A C 892 O O . PRO A 62 ? 0.4576 0.2037 0.3144 -0.0201 -0.1250 0.0252 91 PRO A O 893 C CB . PRO A 62 ? 0.4422 0.2170 0.3497 -0.0188 -0.1263 0.0334 91 PRO A CB 894 C CG . PRO A 62 ? 0.4450 0.2260 0.3665 -0.0179 -0.1153 0.0425 91 PRO A CG 895 C CD . PRO A 62 ? 0.4568 0.2292 0.3757 -0.0218 -0.1104 0.0485 91 PRO A CD 903 N N . SER A 63 ? 0.4626 0.2055 0.3196 -0.0181 -0.1030 0.0352 92 SER A N 904 C CA . SER A 63 ? 0.4717 0.2021 0.3049 -0.0167 -0.0972 0.0328 92 SER A CA 905 C C . SER A 63 ? 0.4860 0.1975 0.2954 -0.0220 -0.1019 0.0317 92 SER A C 906 O O . SER A 63 ? 0.4938 0.1939 0.2829 -0.0226 -0.1021 0.0294 92 SER A O 907 C CB . SER A 63 ? 0.6567 0.3809 0.4836 -0.0133 -0.0796 0.0385 92 SER A CB 908 O OG . SER A 63 ? 0.4988 0.2137 0.3234 -0.0156 -0.0708 0.0454 92 SER A OG 914 N N . ALA A 64 ? 0.4963 0.2040 0.3085 -0.0265 -0.1068 0.0339 93 ALA A N 915 C CA . ALA A 64 ? 0.5104 0.2003 0.3022 -0.0325 -0.1131 0.0339 93 ALA A CA 916 C C . ALA A 64 ? 0.7456 0.4410 0.5413 -0.0332 -0.1278 0.0288 93 ALA A C 917 O O . ALA A 64 ? 0.5086 0.1913 0.2905 -0.0382 -0.1351 0.0295 93 ALA A O 918 C CB . ALA A 64 ? 0.5183 0.2032 0.3135 -0.0369 -0.1137 0.0383 93 ALA A CB 924 N N . MET A 65 ? 0.6799 0.3935 0.4946 -0.0284 -0.1319 0.0246 94 MET A N 925 C CA . MET A 65 ? 0.6743 0.3936 0.4939 -0.0273 -0.1430 0.0202 94 MET A CA 926 C C . MET A 65 ? 0.6999 0.4182 0.5091 -0.0248 -0.1411 0.0181 94 MET A C 927 O O . MET A 65 ? 0.6483 0.3658 0.4554 -0.0254 -0.1488 0.0169 94 MET A O 928 C CB . MET A 65 ? 0.6312 0.3668 0.4732 -0.0234 -0.1484 0.0165 94 MET A CB 929 C CG . MET A 65 ? 0.6250 0.3617 0.4782 -0.0261 -0.1516 0.0187 94 MET A CG 930 S SD . MET A 65 ? 0.4536 0.2036 0.3272 -0.0224 -0.1597 0.0144 94 MET A SD 931 C CE . MET A 65 ? 0.4354 0.1963 0.3182 -0.0194 -0.1519 0.0158 94 MET A CE 941 N N . ALA A 66 ? 0.8433 0.5620 0.6476 -0.0219 -0.1305 0.0186 95 ALA A N 942 C CA . ALA A 66 ? 0.9094 0.6276 0.7044 -0.0192 -0.1280 0.0165 95 ALA A CA 943 C C . ALA A 66 ? 0.9371 0.6333 0.7036 -0.0235 -0.1243 0.0196 95 ALA A C 944 O O . ALA A 66 ? 0.9327 0.6250 0.6880 -0.0225 -0.1232 0.0185 95 ALA A O 945 C CB . ALA A 66 ? 0.8477 0.5775 0.6528 -0.0135 -0.1192 0.0155 95 ALA A CB 951 N N . ASP A 67 ? 0.8445 0.5243 0.5973 -0.0288 -0.1227 0.0236 96 ASP A N 952 C CA . ASP A 67 ? 0.8962 0.5497 0.6167 -0.0339 -0.1199 0.0267 96 ASP A CA 953 C C . ASP A 67 ? 0.9264 0.5724 0.6386 -0.0397 -0.1345 0.0276 96 ASP A C 954 O O . ASP A 67 ? 0.9082 0.5703 0.6415 -0.0387 -0.1447 0.0260 96 ASP A O 955 C CB . ASP A 67 ? 0.9267 0.5628 0.6331 -0.0377 -0.1127 0.0312 96 ASP A CB 956 C CG . ASP A 67 ? 0.9301 0.5681 0.6463 -0.0426 -0.1233 0.0326 96 ASP A CG 957 O OD1 . ASP A 67 ? 0.9229 0.5789 0.6615 -0.0413 -0.1341 0.0299 96 ASP A OD1 958 O OD2 . ASP A 67 ? 0.9408 0.5607 0.6409 -0.0475 -0.1202 0.0366 96 ASP A OD2 963 N N . SER A 68 ? 0.9721 0.5923 0.6532 -0.0457 -0.1353 0.0308 97 SER A N 964 C CA . SER A 68 ? 0.9948 0.6061 0.6676 -0.0525 -0.1503 0.0337 97 SER A CA 965 C C . SER A 68 ? 1.0001 0.6158 0.6872 -0.0569 -0.1619 0.0363 97 SER A C 966 O O . SER A 68 ? 0.9889 0.5963 0.6707 -0.0598 -0.1592 0.0378 97 SER A O 967 C CB . SER A 68 ? 1.0225 0.6103 0.6623 -0.0596 -0.1474 0.0340 97 SER A CB 968 O OG . SER A 68 ? 1.0390 0.6106 0.6616 -0.0633 -0.1411 0.0354 97 SER A OG 974 N N . SER A 69 ? 1.0418 0.6729 0.7492 -0.0568 -0.1735 0.0367 98 SER A N 975 C CA . SER A 69 ? 1.0399 0.6789 0.7654 -0.0598 -0.1836 0.0387 98 SER A CA 976 C C . SER A 69 ? 1.0368 0.6654 0.7505 -0.0706 -0.1907 0.0410 98 SER A C 977 O O . SER A 69 ? 1.0391 0.6758 0.7700 -0.0740 -0.2009 0.0436 98 SER A O 978 C CB . SER A 69 ? 1.0234 0.6837 0.7775 -0.0541 -0.1905 0.0384 98 SER A CB 979 O OG . SER A 69 ? 1.0218 0.6857 0.7775 -0.0562 -0.1928 0.0389 98 SER A OG 985 N N . PHE A 70 ? 1.3336 0.9433 1.0177 -0.0756 -0.1853 0.0402 99 PHE A N 986 C CA . PHE A 70 ? 1.3695 0.9659 1.0378 -0.0863 -0.1928 0.0417 99 PHE A CA 987 C C . PHE A 70 ? 1.4147 0.9867 1.0462 -0.0892 -0.1827 0.0398 99 PHE A C 988 O O . PHE A 70 ? 1.4372 0.9950 1.0480 -0.0929 -0.1810 0.0377 99 PHE A O 989 C CB . PHE A 70 ? 1.3634 0.9649 1.0412 -0.0904 -0.2003 0.0430 99 PHE A CB 992 N N . ARG A 71 ? 1.0864 0.6524 0.7109 -0.0875 -0.1751 0.0407 100 ARG A N 993 C CA . ARG A 71 ? 1.1182 0.6599 0.7093 -0.0894 -0.1629 0.0396 100 ARG A CA 994 C C . ARG A 71 ? 1.1140 0.6466 0.6965 -0.0960 -0.1673 0.0418 100 ARG A C 995 O O . ARG A 71 ? 1.0921 0.6389 0.6964 -0.0983 -0.1793 0.0443 100 ARG A O 996 C CB . ARG A 71 ? 1.1273 0.6683 0.7183 -0.0801 -0.1452 0.0394 100 ARG A CB 997 C CG . ARG A 71 ? 1.1195 0.6793 0.7414 -0.0747 -0.1456 0.0414 100 ARG A CG 998 C CD . ARG A 71 ? 1.1384 0.6940 0.7592 -0.0676 -0.1281 0.0423 100 ARG A CD 999 N NE . ARG A 71 ? 1.1771 0.7125 0.7741 -0.0702 -0.1164 0.0443 100 ARG A NE 1000 C CZ . ARG A 71 ? 1.1944 0.7189 0.7806 -0.0650 -0.0976 0.0461 100 ARG A CZ 1001 N NH1 . ARG A 71 ? 1.1835 0.7157 0.7809 -0.0572 -0.0893 0.0464 100 ARG A NH1 1002 N NH2 . ARG A 71 ? 1.2202 0.7260 0.7851 -0.0672 -0.0866 0.0481 100 ARG A NH2 1016 N N . PHE A 72 ? 1.5215 1.0297 1.0719 -0.0986 -0.1570 0.0408 101 PHE A N 1017 C CA . PHE A 72 ? 1.5274 1.0222 1.0629 -0.1061 -0.1616 0.0423 101 PHE A CA 1018 C C . PHE A 72 ? 1.5035 1.0144 1.0649 -0.1044 -0.1646 0.0459 101 PHE A C 1019 O O . PHE A 72 ? 1.4948 1.0167 1.0719 -0.1092 -0.1802 0.0480 101 PHE A O 1020 C CB . PHE A 72 ? 1.5573 1.0225 1.0548 -0.1066 -0.1457 0.0404 101 PHE A CB 1023 N N . PRO A 73 ? 1.3776 0.8899 0.9451 -0.0979 -0.1500 0.0471 102 PRO A N 1024 C CA . PRO A 73 ? 1.3389 0.8698 0.9370 -0.0959 -0.1551 0.0497 102 PRO A CA 1025 C C . PRO A 73 ? 1.2851 0.8382 0.9142 -0.0884 -0.1567 0.0488 102 PRO A C 1026 O O . PRO A 73 ? 1.3038 0.8559 0.9301 -0.0826 -0.1463 0.0474 102 PRO A O 1027 C CB . PRO A 73 ? 1.3519 0.8709 0.9406 -0.0941 -0.1393 0.0519 102 PRO A CB 1028 C CG . PRO A 73 ? 1.3695 0.8747 0.9381 -0.0891 -0.1222 0.0507 102 PRO A CG 1029 C CD . PRO A 73 ? 1.3872 0.8827 0.9347 -0.0930 -0.1291 0.0470 102 PRO A CD 1037 N N . ARG A 74 ? 0.9185 0.4904 0.5761 -0.0881 -0.1691 0.0495 103 ARG A N 1038 C CA . ARG A 74 ? 0.9159 0.5070 0.6021 -0.0807 -0.1708 0.0479 103 ARG A CA 1039 C C . ARG A 74 ? 0.9517 0.5437 0.6464 -0.0754 -0.1589 0.0481 103 ARG A C 1040 O O . ARG A 74 ? 0.9890 0.5759 0.6828 -0.0776 -0.1550 0.0505 103 ARG A O 1041 C CB . ARG A 74 ? 0.8988 0.5070 0.6118 -0.0811 -0.1853 0.0485 103 ARG A CB 1042 C CG . ARG A 74 ? 0.8866 0.5040 0.6080 -0.0814 -0.1959 0.0485 103 ARG A CG 1043 C CD . ARG A 74 ? 0.8724 0.5049 0.6206 -0.0810 -0.2079 0.0502 103 ARG A CD 1044 N NE . ARG A 74 ? 0.8416 0.4893 0.6128 -0.0741 -0.2109 0.0484 103 ARG A NE 1045 C CZ . ARG A 74 ? 0.8105 0.4711 0.6068 -0.0714 -0.2187 0.0493 103 ARG A CZ 1046 N NH1 . ARG A 74 ? 0.8085 0.4700 0.6114 -0.0751 -0.2251 0.0522 103 ARG A NH1 1047 N NH2 . ARG A 74 ? 0.7857 0.4577 0.5999 -0.0643 -0.2191 0.0475 103 ARG A NH2 1061 N N . THR A 75 ? 0.5990 0.2000 0.3040 -0.0684 -0.1533 0.0456 104 THR A N 1062 C CA . THR A 75 ? 0.5866 0.2032 0.3093 -0.0619 -0.1412 0.0442 104 THR A CA 1063 C C . THR A 75 ? 0.5568 0.2013 0.3137 -0.0565 -0.1482 0.0399 104 THR A C 1064 O O . THR A 75 ? 0.5807 0.2335 0.3459 -0.0551 -0.1577 0.0370 104 THR A O 1065 C CB . THR A 75 ? 0.5916 0.2056 0.3038 -0.0567 -0.1262 0.0435 104 THR A CB 1066 O OG1 . THR A 75 ? 0.5770 0.2020 0.2952 -0.0530 -0.1308 0.0392 104 THR A OG1 1067 C CG2 . THR A 75 ? 0.6263 0.2078 0.2995 -0.0615 -0.1178 0.0474 104 THR A CG2 1074 N N . TRP A 76 ? 0.9492 0.6065 0.7251 -0.0537 -0.1433 0.0402 105 TRP A N 1075 C CA . TRP A 76 ? 0.5093 0.1882 0.3132 -0.0494 -0.1503 0.0364 105 TRP A CA 1076 C C . TRP A 76 ? 0.5014 0.1933 0.3229 -0.0459 -0.1424 0.0377 105 TRP A C 1077 O O . TRP A 76 ? 0.5126 0.1984 0.3311 -0.0481 -0.1339 0.0431 105 TRP A O 1078 C CB . TRP A 76 ? 0.7408 0.4190 0.5527 -0.0532 -0.1630 0.0366 105 TRP A CB 1079 C CG . TRP A 76 ? 0.7553 0.4288 0.5698 -0.0573 -0.1615 0.0409 105 TRP A CG 1080 C CD1 . TRP A 76 ? 0.7525 0.4382 0.5873 -0.0559 -0.1619 0.0413 105 TRP A CD1 1081 C CD2 . TRP A 76 ? 0.5374 0.1914 0.3326 -0.0642 -0.1598 0.0461 105 TRP A CD2 1082 N NE1 . TRP A 76 ? 0.5191 0.1962 0.3508 -0.0610 -0.1602 0.0466 105 TRP A NE1 1083 C CE2 . TRP A 76 ? 0.5382 0.1954 0.3450 -0.0659 -0.1584 0.0494 105 TRP A CE2 1084 C CE3 . TRP A 76 ? 0.6858 0.3182 0.4535 -0.0696 -0.1603 0.0487 105 TRP A CE3 1085 C CZ2 . TRP A 76 ? 0.5578 0.1984 0.3502 -0.0723 -0.1560 0.0549 105 TRP A CZ2 1086 C CZ3 . TRP A 76 ? 0.5794 0.1931 0.3305 -0.0762 -0.1586 0.0539 105 TRP A CZ3 1087 C CH2 . TRP A 76 ? 0.5787 0.1971 0.3423 -0.0772 -0.1558 0.0568 105 TRP A CH2 1098 N N . TRP A 77 ? 0.4898 0.1988 0.3297 -0.0408 -0.1453 0.0337 106 TRP A N 1099 C CA . TRP A 77 ? 0.4815 0.2039 0.3420 -0.0388 -0.1426 0.0357 106 TRP A CA 1100 C C . TRP A 77 ? 0.4796 0.2042 0.3527 -0.0422 -0.1528 0.0363 106 TRP A C 1101 O O . TRP A 77 ? 0.4779 0.1993 0.3492 -0.0432 -0.1630 0.0326 106 TRP A O 1102 C CB . TRP A 77 ? 0.4666 0.2033 0.3389 -0.0332 -0.1439 0.0313 106 TRP A CB 1103 C CG . TRP A 77 ? 0.4797 0.2290 0.3741 -0.0326 -0.1484 0.0325 106 TRP A CG 1104 C CD1 . TRP A 77 ? 0.4915 0.2490 0.4002 -0.0323 -0.1416 0.0388 106 TRP A CD1 1105 C CD2 . TRP A 77 ? 0.4908 0.2442 0.3950 -0.0327 -0.1611 0.0283 106 TRP A CD2 1106 N NE1 . TRP A 77 ? 0.4988 0.2654 0.4258 -0.0333 -0.1513 0.0390 106 TRP A NE1 1107 C CE2 . TRP A 77 ? 0.5040 0.2666 0.4261 -0.0335 -0.1632 0.0320 106 TRP A CE2 1108 C CE3 . TRP A 77 ? 0.5048 0.2538 0.4042 -0.0319 -0.1706 0.0224 106 TRP A CE3 1109 C CZ2 . TRP A 77 ? 0.5155 0.2800 0.4467 -0.0343 -0.1754 0.0292 106 TRP A CZ2 1110 C CZ3 . TRP A 77 ? 0.5148 0.2658 0.4235 -0.0314 -0.1805 0.0194 106 TRP A CZ3 1111 C CH2 . TRP A 77 ? 0.5206 0.2779 0.4429 -0.0329 -0.1833 0.0223 106 TRP A CH2 1122 N N . GLN A 78 ? 0.4744 0.2042 0.3614 -0.0438 -0.1499 0.0418 107 GLN A N 1123 C CA . GLN A 78 ? 0.5037 0.2344 0.4021 -0.0477 -0.1597 0.0432 107 GLN A CA 1124 C C . GLN A 78 ? 0.5384 0.2820 0.4593 -0.0476 -0.1609 0.0472 107 GLN A C 1125 O O . GLN A 78 ? 0.5474 0.2954 0.4763 -0.0478 -0.1507 0.0547 107 GLN A O 1126 C CB . GLN A 78 ? 0.5194 0.2373 0.4078 -0.0532 -0.1567 0.0486 107 GLN A CB 1127 C CG . GLN A 78 ? 0.4902 0.2084 0.3902 -0.0576 -0.1664 0.0507 107 GLN A CG 1128 C CD . GLN A 78 ? 0.5055 0.2100 0.3937 -0.0633 -0.1635 0.0560 107 GLN A CD 1129 O OE1 . GLN A 78 ? 0.5149 0.2061 0.3830 -0.0650 -0.1628 0.0546 107 GLN A OE1 1130 N NE2 . GLN A 78 ? 0.5095 0.2165 0.4100 -0.0667 -0.1622 0.0627 107 GLN A NE2 1139 N N . SER A 79 ? 0.6577 0.4057 0.5882 -0.0473 -0.1734 0.0430 108 SER A N 1140 C CA . SER A 79 ? 0.6563 0.4143 0.6065 -0.0484 -0.1783 0.0468 108 SER A CA 1141 C C . SER A 79 ? 0.6615 0.4202 0.6245 -0.0541 -0.1788 0.0559 108 SER A C 1142 O O . SER A 79 ? 0.6646 0.4145 0.6194 -0.0572 -0.1768 0.0578 108 SER A O 1143 C CB . SER A 79 ? 0.6679 0.4243 0.6187 -0.0474 -0.1924 0.0395 108 SER A CB 1144 O OG . SER A 79 ? 0.6876 0.4345 0.6346 -0.0505 -0.2012 0.0377 108 SER A OG 1150 N N . ALA A 80 ? 0.5190 0.2877 0.5024 -0.0560 -0.1820 0.0624 109 ALA A N 1151 C CA . ALA A 80 ? 0.5254 0.2965 0.5250 -0.0620 -0.1845 0.0723 109 ALA A CA 1152 C C . ALA A 80 ? 0.5337 0.2947 0.5279 -0.0662 -0.1988 0.0681 109 ALA A C 1153 O O . ALA A 80 ? 0.5235 0.2773 0.5054 -0.0639 -0.2074 0.0583 109 ALA A O 1154 C CB . ALA A 80 ? 0.5148 0.2991 0.5395 -0.0638 -0.1882 0.0808 109 ALA A CB 1160 N N . GLU A 81 ? 0.6284 0.3881 0.6319 -0.0719 -0.2005 0.0760 110 GLU A N 1161 C CA . GLU A 81 ? 0.6424 0.3914 0.6406 -0.0761 -0.2134 0.0728 110 GLU A CA 1162 C C . GLU A 81 ? 0.6530 0.4009 0.6587 -0.0784 -0.2301 0.0707 110 GLU A C 1163 O O . GLU A 81 ? 0.6478 0.4047 0.6698 -0.0802 -0.2333 0.0768 110 GLU A O 1164 C CB . GLU A 81 ? 0.6557 0.4034 0.6615 -0.0819 -0.2102 0.0825 110 GLU A CB 1165 C CG . GLU A 81 ? 0.6794 0.4196 0.6688 -0.0808 -0.1969 0.0827 110 GLU A CG 1166 C CD . GLU A 81 ? 0.7046 0.4318 0.6727 -0.0795 -0.2028 0.0724 110 GLU A CD 1167 O OE1 . GLU A 81 ? 0.7109 0.4325 0.6791 -0.0815 -0.2165 0.0684 110 GLU A OE1 1168 O OE2 . GLU A 81 ? 0.7163 0.4382 0.6677 -0.0765 -0.1940 0.0691 110 GLU A OE2 1175 N N . ASP A 82 ? 0.8731 0.6078 0.8657 -0.0785 -0.2409 0.0625 111 ASP A N 1176 C CA . ASP A 82 ? 0.8858 0.6125 0.8781 -0.0805 -0.2569 0.0592 111 ASP A CA 1177 C C . ASP A 82 ? 0.8838 0.6146 0.8761 -0.0771 -0.2587 0.0559 111 ASP A C 1178 O O . ASP A 82 ? 0.9084 0.6451 0.9152 -0.0814 -0.2650 0.0629 111 ASP A O 1179 C CB . ASP A 82 ? 0.8911 0.6186 0.9000 -0.0892 -0.2666 0.0695 111 ASP A CB 1180 C CG . ASP A 82 ? 0.8990 0.6183 0.9047 -0.0930 -0.2687 0.0711 111 ASP A CG 1181 O OD1 . ASP A 82 ? 0.8973 0.6057 0.8859 -0.0893 -0.2700 0.0622 111 ASP A OD1 1182 O OD2 . ASP A 82 ? 0.9056 0.6308 0.9271 -0.0992 -0.2683 0.0821 111 ASP A OD2 1187 N N . VAL A 83 ? 0.6271 0.3546 0.6039 -0.0698 -0.2536 0.0460 112 VAL A N 1188 C CA . VAL A 83 ? 0.6150 0.3433 0.5875 -0.0660 -0.2558 0.0412 112 VAL A CA 1189 C C . VAL A 83 ? 0.6541 0.3701 0.6060 -0.0591 -0.2561 0.0292 112 VAL A C 1190 O O . VAL A 83 ? 0.6700 0.3853 0.6149 -0.0554 -0.2486 0.0258 112 VAL A O 1191 C CB . VAL A 83 ? 0.5807 0.3254 0.5623 -0.0631 -0.2431 0.0451 112 VAL A CB 1192 C CG1 . VAL A 83 ? 0.5674 0.3144 0.5394 -0.0581 -0.2292 0.0417 112 VAL A CG1 1193 C CG2 . VAL A 83 ? 0.5729 0.3182 0.5508 -0.0599 -0.2467 0.0407 112 VAL A CG2 1203 N N . HIS A 84 ? 0.7012 0.4067 0.6433 -0.0574 -0.2646 0.0238 113 HIS A N 1204 C CA . HIS A 84 ? 0.7208 0.4173 0.6445 -0.0482 -0.2607 0.0144 113 HIS A CA 1205 C C . HIS A 84 ? 0.7208 0.4200 0.6391 -0.0439 -0.2573 0.0098 113 HIS A C 1206 O O . HIS A 84 ? 0.7239 0.4235 0.6344 -0.0376 -0.2498 0.0037 113 HIS A O 1207 C CB . HIS A 84 ? 0.7503 0.4320 0.6622 -0.0463 -0.2676 0.0128 113 HIS A CB 1208 C CG . HIS A 84 ? 0.7603 0.4379 0.6737 -0.0482 -0.2697 0.0151 113 HIS A CG 1209 N ND1 . HIS A 84 ? 0.7751 0.4380 0.6761 -0.0455 -0.2745 0.0126 113 HIS A ND1 1210 C CD2 . HIS A 84 ? 0.7485 0.4335 0.6730 -0.0526 -0.2676 0.0199 113 HIS A CD2 1211 C CE1 . HIS A 84 ? 0.7665 0.4297 0.6727 -0.0480 -0.2757 0.0157 113 HIS A CE1 1212 N NE2 . HIS A 84 ? 0.7511 0.4277 0.6713 -0.0525 -0.2715 0.0202 113 HIS A NE2 1219 N N . ARG A 85 ? 0.8483 0.5497 0.7718 -0.0477 -0.2635 0.0136 114 ARG A N 1220 C CA . ARG A 85 ? 0.8191 0.5237 0.7383 -0.0443 -0.2612 0.0103 114 ARG A CA 1221 C C . ARG A 85 ? 0.7645 0.4892 0.6982 -0.0440 -0.2508 0.0146 114 ARG A C 1222 O O . ARG A 85 ? 0.7304 0.4672 0.6824 -0.0492 -0.2507 0.0240 114 ARG A O 1223 C CB . ARG A 85 ? 0.8301 0.5296 0.7495 -0.0481 -0.2709 0.0146 114 ARG A CB 1224 C CG . ARG A 85 ? 0.8520 0.5344 0.7600 -0.0491 -0.2786 0.0153 114 ARG A CG 1225 C CD . ARG A 85 ? 0.8742 0.5451 0.7729 -0.0510 -0.2873 0.0174 114 ARG A CD 1226 N NE . ARG A 85 ? 0.8907 0.5524 0.7692 -0.0434 -0.2822 0.0087 114 ARG A NE 1227 C CZ . ARG A 85 ? 0.9150 0.5605 0.7712 -0.0361 -0.2787 0.0007 114 ARG A CZ 1228 N NH1 . ARG A 85 ? 0.9227 0.5597 0.7741 -0.0354 -0.2801 -0.0001 114 ARG A NH1 1229 N NH2 . ARG A 85 ? 0.9274 0.5654 0.7668 -0.0295 -0.2736 -0.0061 114 ARG A NH2 1243 N N . GLU A 86 ? 0.6783 0.4069 0.6041 -0.0369 -0.2399 0.0089 115 GLU A N 1244 C CA . GLU A 86 ? 0.6526 0.3977 0.5873 -0.0350 -0.2276 0.0125 115 GLU A CA 1245 C C . GLU A 86 ? 0.6167 0.3634 0.5411 -0.0282 -0.2218 0.0059 115 GLU A C 1246 O O . GLU A 86 ? 0.6096 0.3453 0.5198 -0.0236 -0.2238 -0.0017 115 GLU A O 1247 C CB . GLU A 86 ? 0.6569 0.4043 0.5921 -0.0350 -0.2197 0.0144 115 GLU A CB 1248 C CG . GLU A 86 ? 0.6551 0.4150 0.5965 -0.0344 -0.2070 0.0194 115 GLU A CG 1249 C CD . GLU A 86 ? 0.6674 0.4373 0.6270 -0.0390 -0.2055 0.0295 115 GLU A CD 1250 O OE1 . GLU A 86 ? 0.6793 0.4473 0.6486 -0.0441 -0.2157 0.0337 115 GLU A OE1 1251 O OE2 . GLU A 86 ? 0.6672 0.4460 0.6317 -0.0374 -0.1940 0.0340 115 GLU A OE2 1258 N N . LYS A 87 ? 0.5508 0.3107 0.4828 -0.0271 -0.2138 0.0094 116 LYS A N 1259 C CA . LYS A 87 ? 0.5466 0.3093 0.4705 -0.0213 -0.2087 0.0041 116 LYS A CA 1260 C C . LYS A 87 ? 0.5202 0.2939 0.4468 -0.0189 -0.1957 0.0067 116 LYS A C 1261 O O . LYS A 87 ? 0.5265 0.3093 0.4653 -0.0214 -0.1906 0.0141 116 LYS A O 1262 C CB . LYS A 87 ? 0.5700 0.3338 0.4975 -0.0228 -0.2154 0.0053 116 LYS A CB 1263 C CG . LYS A 87 ? 0.5784 0.3452 0.4978 -0.0172 -0.2105 0.0003 116 LYS A CG 1264 C CD . LYS A 87 ? 0.5941 0.3613 0.5173 -0.0198 -0.2185 0.0026 116 LYS A CD 1265 C CE . LYS A 87 ? 0.5970 0.3793 0.5432 -0.0243 -0.2169 0.0136 116 LYS A CE 1266 N NZ . LYS A 87 ? 0.6033 0.3870 0.5556 -0.0273 -0.2257 0.0173 116 LYS A NZ 1280 N N . ILE A 88 ? 0.4268 0.1984 0.3417 -0.0140 -0.1904 0.0011 117 ILE A N 1281 C CA . ILE A 88 ? 0.4187 0.1971 0.3313 -0.0117 -0.1795 0.0025 117 ILE A CA 1282 C C . ILE A 88 ? 0.4143 0.1961 0.3219 -0.0069 -0.1777 -0.0020 117 ILE A C 1283 O O . ILE A 88 ? 0.4173 0.1933 0.3168 -0.0035 -0.1817 -0.0081 117 ILE A O 1284 C CB . ILE A 88 ? 0.4192 0.1921 0.3226 -0.0111 -0.1761 0.0012 117 ILE A CB 1285 C CG1 . ILE A 88 ? 0.4252 0.1929 0.3322 -0.0161 -0.1792 0.0052 117 ILE A CG1 1286 C CG2 . ILE A 88 ? 0.4152 0.1913 0.3129 -0.0101 -0.1661 0.0032 117 ILE A CG2 1287 C CD1 . ILE A 88 ? 0.4279 0.1884 0.3265 -0.0165 -0.1791 0.0044 117 ILE A CD1 1299 N N . GLN A 89 ? 0.4503 0.2407 0.3623 -0.0062 -0.1707 0.0013 118 GLN A N 1300 C CA . GLN A 89 ? 0.4612 0.2556 0.3699 -0.0022 -0.1694 -0.0021 118 GLN A CA 1301 C C . GLN A 89 ? 0.4620 0.2621 0.3682 0.0001 -0.1585 -0.0001 118 GLN A C 1302 O O . GLN A 89 ? 0.4580 0.2610 0.3697 -0.0017 -0.1514 0.0060 118 GLN A O 1303 C CB . GLN A 89 ? 0.4657 0.2637 0.3849 -0.0044 -0.1761 0.0006 118 GLN A CB 1304 C CG . GLN A 89 ? 0.4695 0.2698 0.3841 -0.0009 -0.1768 -0.0030 118 GLN A CG 1305 C CD . GLN A 89 ? 0.4930 0.2941 0.4166 -0.0045 -0.1863 0.0003 118 GLN A CD 1306 O OE1 . GLN A 89 ? 0.5039 0.3014 0.4348 -0.0095 -0.1946 0.0040 118 GLN A OE1 1307 N NE2 . GLN A 89 ? 0.4993 0.3045 0.4224 -0.0025 -0.1861 -0.0004 118 GLN A NE2 1316 N N . LEU A 90 ? 0.5150 0.3151 0.4115 0.0043 -0.1566 -0.0051 119 LEU A N 1317 C CA . LEU A 90 ? 0.5101 0.3131 0.4010 0.0065 -0.1474 -0.0041 119 LEU A CA 1318 C C . LEU A 90 ? 0.5078 0.3170 0.3999 0.0097 -0.1470 -0.0061 119 LEU A C 1319 O O . LEU A 90 ? 0.4979 0.3056 0.3835 0.0126 -0.1507 -0.0116 119 LEU A O 1320 C CB . LEU A 90 ? 0.5023 0.2992 0.3803 0.0076 -0.1461 -0.0070 119 LEU A CB 1321 C CG . LEU A 90 ? 0.4959 0.2927 0.3643 0.0093 -0.1387 -0.0065 119 LEU A CG 1322 C CD1 . LEU A 90 ? 0.5018 0.2964 0.3686 0.0073 -0.1300 -0.0009 119 LEU A CD1 1323 C CD2 . LEU A 90 ? 0.4920 0.2828 0.3502 0.0091 -0.1406 -0.0078 119 LEU A CD2 1335 N N . ASP A 91 ? 0.5945 0.4101 0.4953 0.0096 -0.1418 -0.0010 120 ASP A N 1336 C CA . ASP A 91 ? 0.6000 0.4219 0.5036 0.0122 -0.1415 -0.0017 120 ASP A CA 1337 C C . ASP A 91 ? 0.5923 0.4142 0.4855 0.0156 -0.1324 -0.0028 120 ASP A C 1338 O O . ASP A 91 ? 0.6077 0.4267 0.4975 0.0153 -0.1235 0.0010 120 ASP A O 1339 C CB . ASP A 91 ? 0.6030 0.4328 0.5250 0.0103 -0.1414 0.0059 120 ASP A CB 1340 C CG . ASP A 91 ? 0.5953 0.4242 0.5278 0.0058 -0.1521 0.0081 120 ASP A CG 1341 O OD1 . ASP A 91 ? 0.5858 0.4072 0.5091 0.0052 -0.1608 0.0020 120 ASP A OD1 1342 O OD2 . ASP A 91 ? 0.6033 0.4380 0.5532 0.0029 -0.1514 0.0166 120 ASP A OD2 1347 N N . LEU A 92 ? 0.4566 0.2796 0.3430 0.0186 -0.1345 -0.0078 121 LEU A N 1348 C CA . LEU A 92 ? 0.4257 0.2483 0.3019 0.0214 -0.1275 -0.0088 121 LEU A CA 1349 C C . LEU A 92 ? 0.4348 0.2647 0.3176 0.0236 -0.1245 -0.0068 121 LEU A C 1350 O O . LEU A 92 ? 0.4360 0.2705 0.3270 0.0235 -0.1311 -0.0073 121 LEU A O 1351 C CB . LEU A 92 ? 0.3854 0.2050 0.2506 0.0234 -0.1312 -0.0147 121 LEU A CB 1352 C CG . LEU A 92 ? 0.3859 0.1994 0.2476 0.0217 -0.1350 -0.0159 121 LEU A CG 1353 C CD1 . LEU A 92 ? 0.3846 0.1968 0.2398 0.0246 -0.1375 -0.0199 121 LEU A CD1 1354 C CD2 . LEU A 92 ? 0.3905 0.1979 0.2466 0.0187 -0.1303 -0.0119 121 LEU A CD2 1366 N N . GLU A 93 ? 0.5748 0.4036 0.4528 0.0253 -0.1149 -0.0041 122 GLU A N 1367 C CA . GLU A 93 ? 0.5863 0.4215 0.4713 0.0279 -0.1106 -0.0011 122 GLU A CA 1368 C C . GLU A 93 ? 0.5808 0.4184 0.4589 0.0303 -0.1146 -0.0065 122 GLU A C 1369 O O . GLU A 93 ? 0.5714 0.4145 0.4549 0.0323 -0.1127 -0.0047 122 GLU A O 1370 C CB . GLU A 93 ? 0.5903 0.4203 0.4694 0.0297 -0.0974 0.0035 122 GLU A CB 1371 C CG . GLU A 93 ? 0.6197 0.4392 0.4763 0.0306 -0.0937 -0.0003 122 GLU A CG 1372 C CD . GLU A 93 ? 0.6298 0.4394 0.4739 0.0271 -0.0967 -0.0022 122 GLU A CD 1373 O OE1 . GLU A 93 ? 0.6441 0.4536 0.4955 0.0246 -0.0989 -0.0005 122 GLU A OE1 1374 O OE2 . GLU A 93 ? 0.6231 0.4251 0.4510 0.0265 -0.0976 -0.0048 122 GLU A OE2 1381 N N . ALA A 94 ? 0.5845 0.4182 0.4519 0.0302 -0.1198 -0.0122 123 ALA A N 1382 C CA . ALA A 94 ? 0.6059 0.4411 0.4662 0.0328 -0.1227 -0.0169 123 ALA A CA 1383 C C . ALA A 94 ? 0.6160 0.4474 0.4705 0.0329 -0.1286 -0.0217 123 ALA A C 1384 O O . ALA A 94 ? 0.6333 0.4610 0.4895 0.0309 -0.1310 -0.0214 123 ALA A O 1385 C CB . ALA A 94 ? 0.6183 0.4514 0.4680 0.0346 -0.1160 -0.0167 123 ALA A CB 1391 N N . GLU A 95 ? 0.6481 0.4800 0.4962 0.0357 -0.1303 -0.0255 124 GLU A N 1392 C CA . GLU A 95 ? 0.6348 0.4626 0.4779 0.0373 -0.1335 -0.0291 124 GLU A CA 1393 C C . GLU A 95 ? 0.6062 0.4322 0.4449 0.0371 -0.1307 -0.0276 124 GLU A C 1394 O O . GLU A 95 ? 0.6101 0.4374 0.4439 0.0373 -0.1273 -0.0260 124 GLU A O 1395 C CB . GLU A 95 ? 0.6443 0.4720 0.4819 0.0408 -0.1350 -0.0329 124 GLU A CB 1396 C CG . GLU A 95 ? 0.6592 0.4856 0.4986 0.0398 -0.1403 -0.0341 124 GLU A CG 1397 C CD . GLU A 95 ? 0.6740 0.4972 0.5040 0.0429 -0.1417 -0.0379 124 GLU A CD 1398 O OE1 . GLU A 95 ? 0.6716 0.4972 0.4965 0.0460 -0.1370 -0.0388 124 GLU A OE1 1399 O OE2 . GLU A 95 ? 0.6882 0.5053 0.5149 0.0417 -0.1479 -0.0396 124 GLU A OE2 1406 N N . PHE A 96 ? 0.4161 0.2382 0.2566 0.0363 -0.1331 -0.0274 125 PHE A N 1407 C CA . PHE A 96 ? 0.3885 0.2085 0.2269 0.0352 -0.1325 -0.0245 125 PHE A CA 1408 C C . PHE A 96 ? 0.3867 0.2054 0.2281 0.0383 -0.1345 -0.0256 125 PHE A C 1409 O O . PHE A 96 ? 0.3886 0.2047 0.2310 0.0409 -0.1360 -0.0291 125 PHE A O 1410 C CB . PHE A 96 ? 0.3781 0.1935 0.2168 0.0304 -0.1328 -0.0211 125 PHE A CB 1411 C CG . PHE A 96 ? 0.3797 0.1933 0.2130 0.0281 -0.1281 -0.0187 125 PHE A CG 1412 C CD1 . PHE A 96 ? 0.3787 0.1954 0.2169 0.0284 -0.1256 -0.0188 125 PHE A CD1 1413 C CD2 . PHE A 96 ? 0.3846 0.1917 0.2076 0.0254 -0.1263 -0.0154 125 PHE A CD2 1414 C CE1 . PHE A 96 ? 0.3819 0.1962 0.2161 0.0275 -0.1192 -0.0156 125 PHE A CE1 1415 C CE2 . PHE A 96 ? 0.3902 0.1919 0.2047 0.0240 -0.1205 -0.0133 125 PHE A CE2 1416 C CZ . PHE A 96 ? 0.3885 0.1942 0.2093 0.0257 -0.1159 -0.0134 125 PHE A CZ 1426 N N . TYR A 97 ? 0.4672 0.2864 0.3097 0.0381 -0.1344 -0.0217 126 TYR A N 1427 C CA . TYR A 97 ? 0.4664 0.2849 0.3152 0.0413 -0.1351 -0.0204 126 TYR A CA 1428 C C . TYR A 97 ? 0.4665 0.2806 0.3200 0.0379 -0.1385 -0.0177 126 TYR A C 1429 O O . TYR A 97 ? 0.4599 0.2720 0.3117 0.0325 -0.1408 -0.0135 126 TYR A O 1430 C CB . TYR A 97 ? 0.4701 0.2931 0.3221 0.0426 -0.1339 -0.0155 126 TYR A CB 1431 C CG . TYR A 97 ? 0.4838 0.3099 0.3368 0.0494 -0.1295 -0.0175 126 TYR A CG 1432 C CD1 . TYR A 97 ? 0.4946 0.3184 0.3402 0.0528 -0.1274 -0.0241 126 TYR A CD1 1433 C CD2 . TYR A 97 ? 0.4848 0.3153 0.3461 0.0522 -0.1276 -0.0118 126 TYR A CD2 1434 C CE1 . TYR A 97 ? 0.5009 0.3246 0.3440 0.0589 -0.1229 -0.0260 126 TYR A CE1 1435 C CE2 . TYR A 97 ? 0.4918 0.3242 0.3535 0.0590 -0.1219 -0.0130 126 TYR A CE2 1436 C CZ . TYR A 97 ? 0.5026 0.3306 0.3534 0.0624 -0.1192 -0.0206 126 TYR A CZ 1437 O OH . TYR A 97 ? 0.5092 0.3363 0.3570 0.0690 -0.1131 -0.0219 126 TYR A OH 1447 N N . PHE A 98 ? 0.4281 0.2385 0.2851 0.0409 -0.1391 -0.0202 127 PHE A N 1448 C CA . PHE A 98 ? 0.4296 0.2355 0.2918 0.0384 -0.1426 -0.0178 127 PHE A CA 1449 C C . PHE A 98 ? 0.4174 0.2233 0.2887 0.0427 -0.1416 -0.0142 127 PHE A C 1450 O O . PHE A 98 ? 0.4218 0.2259 0.2934 0.0495 -0.1376 -0.0169 127 PHE A O 1451 C CB . PHE A 98 ? 0.4572 0.2576 0.3171 0.0380 -0.1445 -0.0226 127 PHE A CB 1452 C CG . PHE A 98 ? 0.4782 0.2729 0.3433 0.0370 -0.1476 -0.0210 127 PHE A CG 1453 C CD1 . PHE A 98 ? 0.4847 0.2783 0.3517 0.0308 -0.1510 -0.0173 127 PHE A CD1 1454 C CD2 . PHE A 98 ? 0.4966 0.2852 0.3629 0.0426 -0.1467 -0.0232 127 PHE A CD2 1455 C CE1 . PHE A 98 ? 0.5000 0.2884 0.3720 0.0296 -0.1543 -0.0157 127 PHE A CE1 1456 C CE2 . PHE A 98 ? 0.5143 0.2971 0.3855 0.0419 -0.1495 -0.0217 127 PHE A CE2 1457 C CZ . PHE A 98 ? 0.5157 0.2993 0.3907 0.0352 -0.1538 -0.0178 127 PHE A CZ 1467 N N . THR A 99 ? 0.4393 0.2459 0.3176 0.0388 -0.1451 -0.0073 128 THR A N 1468 C CA . THR A 99 ? 0.4410 0.2497 0.3325 0.0424 -0.1445 -0.0011 128 THR A CA 1469 C C . THR A 99 ? 0.4463 0.2496 0.3450 0.0422 -0.1473 0.0007 128 THR A C 1470 O O . THR A 99 ? 0.5028 0.3051 0.4107 0.0488 -0.1438 0.0023 128 THR A O 1471 C CB . THR A 99 ? 0.4423 0.2560 0.3394 0.0376 -0.1483 0.0079 128 THR A CB 1472 O OG1 . THR A 99 ? 0.4400 0.2482 0.3307 0.0287 -0.1550 0.0104 128 THR A OG1 1473 C CG2 . THR A 99 ? 0.4334 0.2521 0.3243 0.0385 -0.1454 0.0067 128 THR A CG2 1481 N N . HIS A 100 ? 0.5166 0.3156 0.4110 0.0350 -0.1528 0.0009 129 HIS A N 1482 C CA . HIS A 100 ? 0.5480 0.3420 0.4495 0.0338 -0.1565 0.0035 129 HIS A CA 1483 C C . HIS A 100 ? 0.5258 0.3143 0.4195 0.0256 -0.1616 0.0027 129 HIS A C 1484 O O . HIS A 100 ? 0.5222 0.3101 0.4073 0.0196 -0.1633 0.0042 129 HIS A O 1485 C CB . HIS A 100 ? 0.5926 0.3903 0.5096 0.0337 -0.1591 0.0138 129 HIS A CB 1486 C CG . HIS A 100 ? 0.6039 0.3976 0.5224 0.0248 -0.1676 0.0204 129 HIS A CG 1487 N ND1 . HIS A 100 ? 0.6023 0.3963 0.5184 0.0174 -0.1733 0.0274 129 HIS A ND1 1488 C CD2 . HIS A 100 ? 0.6219 0.4095 0.5428 0.0216 -0.1721 0.0216 129 HIS A CD2 1489 C CE1 . HIS A 100 ? 0.6213 0.4082 0.5366 0.0099 -0.1810 0.0325 129 HIS A CE1 1490 N NE2 . HIS A 100 ? 0.6321 0.4160 0.5512 0.0124 -0.1801 0.0291 129 HIS A NE2 1497 N N . LEU A 101 ? 0.4710 0.2538 0.3665 0.0259 -0.1634 0.0006 130 LEU A N 1498 C CA . LEU A 101 ? 0.4735 0.2510 0.3625 0.0192 -0.1670 -0.0006 130 LEU A CA 1499 C C . LEU A 101 ? 0.4820 0.2544 0.3772 0.0149 -0.1728 0.0051 130 LEU A C 1500 O O . LEU A 101 ? 0.4809 0.2530 0.3872 0.0190 -0.1736 0.0078 130 LEU A O 1501 C CB . LEU A 101 ? 0.4758 0.2503 0.3609 0.0218 -0.1656 -0.0078 130 LEU A CB 1502 C CG . LEU A 101 ? 0.4798 0.2489 0.3633 0.0164 -0.1695 -0.0082 130 LEU A CG 1503 C CD1 . LEU A 101 ? 0.4775 0.2479 0.3543 0.0102 -0.1686 -0.0067 130 LEU A CD1 1504 C CD2 . LEU A 101 ? 0.4848 0.2495 0.3666 0.0196 -0.1701 -0.0140 130 LEU A CD2 1516 N N . ILE A 102 ? 0.4683 0.2359 0.3560 0.0070 -0.1761 0.0073 131 ILE A N 1517 C CA . ILE A 102 ? 0.4748 0.2358 0.3656 0.0017 -0.1823 0.0125 131 ILE A CA 1518 C C . ILE A 102 ? 0.4913 0.2462 0.3736 -0.0035 -0.1828 0.0103 131 ILE A C 1519 O O . ILE A 102 ? 0.5254 0.2774 0.3960 -0.0081 -0.1805 0.0106 131 ILE A O 1520 C CB . ILE A 102 ? 0.4634 0.2210 0.3520 -0.0048 -0.1877 0.0210 131 ILE A CB 1521 C CG1 . ILE A 102 ? 0.4590 0.2242 0.3595 -0.0002 -0.1877 0.0253 131 ILE A CG1 1522 C CG2 . ILE A 102 ? 0.4717 0.2212 0.3628 -0.0109 -0.1952 0.0267 131 ILE A CG2 1523 C CD1 . ILE A 102 ? 0.4644 0.2260 0.3622 -0.0076 -0.1946 0.0346 131 ILE A CD1 1535 N N . MET A 103 ? 0.4493 0.2014 0.3375 -0.0025 -0.1851 0.0086 132 MET A N 1536 C CA . MET A 103 ? 0.4651 0.2116 0.3484 -0.0081 -0.1866 0.0084 132 MET A CA 1537 C C . MET A 103 ? 0.4808 0.2198 0.3658 -0.0137 -0.1931 0.0145 132 MET A C 1538 O O . MET A 103 ? 0.4954 0.2346 0.3900 -0.0115 -0.1969 0.0179 132 MET A O 1539 C CB . MET A 103 ? 0.4549 0.2019 0.3425 -0.0046 -0.1864 0.0030 132 MET A CB 1540 C CG . MET A 103 ? 0.4442 0.1967 0.3286 -0.0017 -0.1816 -0.0019 132 MET A CG 1541 S SD . MET A 103 ? 0.4483 0.1979 0.3356 -0.0004 -0.1846 -0.0065 132 MET A SD 1542 C CE . MET A 103 ? 0.4518 0.1989 0.3398 -0.0087 -0.1865 -0.0019 132 MET A CE 1552 N N . VAL A 104 ? 0.5330 0.2649 0.4090 -0.0207 -0.1938 0.0167 133 VAL A N 1553 C CA . VAL A 104 ? 0.5351 0.2578 0.4096 -0.0273 -0.2005 0.0227 133 VAL A CA 1554 C C . VAL A 104 ? 0.5540 0.2716 0.4255 -0.0312 -0.2003 0.0221 133 VAL A C 1555 O O . VAL A 104 ? 0.5647 0.2778 0.4245 -0.0354 -0.1956 0.0229 133 VAL A O 1556 C CB . VAL A 104 ? 0.5361 0.2502 0.3966 -0.0341 -0.2024 0.0285 133 VAL A CB 1557 C CG1 . VAL A 104 ? 0.5527 0.2552 0.4100 -0.0418 -0.2107 0.0352 133 VAL A CG1 1558 C CG2 . VAL A 104 ? 0.5326 0.2525 0.3975 -0.0309 -0.2034 0.0303 133 VAL A CG2 1568 N N . PHE A 105 ? 0.5837 0.3011 0.4657 -0.0296 -0.2046 0.0211 134 PHE A N 1569 C CA . PHE A 105 ? 0.5877 0.3013 0.4695 -0.0332 -0.2054 0.0208 134 PHE A CA 1570 C C . PHE A 105 ? 0.5962 0.2989 0.4711 -0.0414 -0.2099 0.0270 134 PHE A C 1571 O O . PHE A 105 ? 0.6005 0.2988 0.4780 -0.0432 -0.2165 0.0310 134 PHE A O 1572 C CB . PHE A 105 ? 0.5816 0.2968 0.4748 -0.0285 -0.2090 0.0170 134 PHE A CB 1573 C CG . PHE A 105 ? 0.5813 0.3030 0.4768 -0.0223 -0.2052 0.0108 134 PHE A CG 1574 C CD1 . PHE A 105 ? 0.5848 0.3109 0.4823 -0.0153 -0.2027 0.0078 134 PHE A CD1 1575 C CD2 . PHE A 105 ? 0.5843 0.3071 0.4803 -0.0239 -0.2046 0.0090 134 PHE A CD2 1576 C CE1 . PHE A 105 ? 0.5865 0.3162 0.4834 -0.0102 -0.1997 0.0022 134 PHE A CE1 1577 C CE2 . PHE A 105 ? 0.5877 0.3148 0.4849 -0.0193 -0.2030 0.0041 134 PHE A CE2 1578 C CZ . PHE A 105 ? 0.5858 0.3154 0.4820 -0.0125 -0.2005 0.0003 134 PHE A CZ 1588 N N . LYS A 106 ? 0.6063 0.3045 0.4733 -0.0463 -0.2062 0.0285 135 LYS A N 1589 C CA . LYS A 106 ? 0.6147 0.3008 0.4738 -0.0541 -0.2099 0.0339 135 LYS A CA 1590 C C . LYS A 106 ? 0.6065 0.2929 0.4778 -0.0543 -0.2160 0.0335 135 LYS A C 1591 O O . LYS A 106 ? 0.6296 0.3122 0.5022 -0.0575 -0.2221 0.0371 135 LYS A O 1592 C CB . LYS A 106 ? 0.6323 0.3117 0.4768 -0.0587 -0.2014 0.0364 135 LYS A CB 1593 C CG . LYS A 106 ? 0.6593 0.3233 0.4919 -0.0669 -0.2042 0.0422 135 LYS A CG 1594 C CD . LYS A 106 ? 0.6786 0.3322 0.4926 -0.0706 -0.1934 0.0453 135 LYS A CD 1595 C CE . LYS A 106 ? 0.6964 0.3375 0.4979 -0.0780 -0.1945 0.0504 135 LYS A CE 1596 N NZ . LYS A 106 ? 0.6993 0.3406 0.4967 -0.0811 -0.2039 0.0518 135 LYS A NZ 1610 N N . SER A 107 ? 0.4831 0.1773 0.3634 -0.0505 -0.2137 0.0294 136 SER A N 1611 C CA . SER A 107 ? 0.4841 0.1775 0.3748 -0.0501 -0.2200 0.0282 136 SER A CA 1612 C C . SER A 107 ? 0.4805 0.1750 0.3791 -0.0434 -0.2246 0.0247 136 SER A C 1613 O O . SER A 107 ? 0.4757 0.1738 0.3738 -0.0394 -0.2224 0.0239 136 SER A O 1614 C CB . SER A 107 ? 0.4810 0.1802 0.3773 -0.0492 -0.2174 0.0261 136 SER A CB 1615 O OG . SER A 107 ? 0.4728 0.1795 0.3724 -0.0426 -0.2151 0.0207 136 SER A OG 1621 N N . PRO A 108 ? 0.6646 0.3561 0.5704 -0.0417 -0.2300 0.0233 137 PRO A N 1622 C CA . PRO A 108 ? 0.6134 0.3037 0.5254 -0.0338 -0.2318 0.0197 137 PRO A CA 1623 C C . PRO A 108 ? 0.5776 0.2731 0.4880 -0.0273 -0.2267 0.0136 137 PRO A C 1624 O O . PRO A 108 ? 0.6031 0.3016 0.5109 -0.0291 -0.2251 0.0116 137 PRO A O 1625 C CB . PRO A 108 ? 0.5437 0.2302 0.4601 -0.0334 -0.2365 0.0191 137 PRO A CB 1626 C CG . PRO A 108 ? 0.5466 0.2338 0.4614 -0.0417 -0.2386 0.0246 137 PRO A CG 1627 C CD . PRO A 108 ? 0.5929 0.2828 0.5009 -0.0462 -0.2335 0.0259 137 PRO A CD 1635 N N . ARG A 109 ? 0.4755 0.1726 0.3886 -0.0198 -0.2241 0.0117 138 ARG A N 1636 C CA . ARG A 109 ? 0.4719 0.1728 0.3820 -0.0133 -0.2190 0.0060 138 ARG A CA 1637 C C . ARG A 109 ? 0.4808 0.1735 0.3873 -0.0114 -0.2220 0.0008 138 ARG A C 1638 O O . ARG A 109 ? 0.4904 0.1734 0.3981 -0.0124 -0.2273 0.0013 138 ARG A O 1639 C CB . ARG A 109 ? 0.5486 0.2513 0.4631 -0.0053 -0.2152 0.0060 138 ARG A CB 1640 C CG . ARG A 109 ? 0.5704 0.2814 0.4871 -0.0077 -0.2132 0.0112 138 ARG A CG 1641 C CD . ARG A 109 ? 0.6166 0.3299 0.5428 -0.0007 -0.2110 0.0141 138 ARG A CD 1642 N NE . ARG A 109 ? 0.4680 0.1753 0.4044 -0.0001 -0.2155 0.0190 138 ARG A NE 1643 C CZ . ARG A 109 ? 0.4688 0.1779 0.4183 0.0057 -0.2142 0.0242 138 ARG A CZ 1644 N NH1 . ARG A 109 ? 0.4629 0.1798 0.4165 0.0110 -0.2085 0.0251 138 ARG A NH1 1645 N NH2 . ARG A 109 ? 0.4756 0.1792 0.4358 0.0061 -0.2183 0.0293 138 ARG A NH2 1659 N N . PRO A 110 ? 0.5340 0.2289 0.4351 -0.0093 -0.2196 -0.0037 139 PRO A N 1660 C CA . PRO A 110 ? 0.5455 0.2302 0.4409 -0.0093 -0.2246 -0.0078 139 PRO A CA 1661 C C . PRO A 110 ? 0.5603 0.2297 0.4498 -0.0017 -0.2251 -0.0118 139 PRO A C 1662 O O . PRO A 110 ? 0.5594 0.2292 0.4496 0.0059 -0.2189 -0.0128 139 PRO A O 1663 C CB . PRO A 110 ? 0.5407 0.2317 0.4318 -0.0085 -0.2218 -0.0107 139 PRO A CB 1664 C CG . PRO A 110 ? 0.5295 0.2304 0.4221 -0.0039 -0.2139 -0.0105 139 PRO A CG 1665 C CD . PRO A 110 ? 0.5236 0.2291 0.4229 -0.0073 -0.2133 -0.0048 139 PRO A CD 1673 N N . ALA A 111 ? 0.5665 0.2253 0.4509 -0.0034 -0.2309 -0.0131 140 ALA A N 1674 C CA . ALA A 111 ? 0.5841 0.2278 0.4594 0.0040 -0.2295 -0.0170 140 ALA A CA 1675 C C . ALA A 111 ? 0.5922 0.2285 0.4543 0.0105 -0.2251 -0.0230 140 ALA A C 1676 O O . ALA A 111 ? 0.6071 0.2304 0.4600 0.0190 -0.2199 -0.0265 140 ALA A O 1677 C CB . ALA A 111 ? 0.5979 0.2332 0.4684 -0.0002 -0.2366 -0.0165 140 ALA A CB 1683 N N . ALA A 112 ? 0.5875 0.2321 0.4485 0.0067 -0.2263 -0.0236 141 ALA A N 1684 C CA . ALA A 112 ? 0.6122 0.2513 0.4606 0.0118 -0.2227 -0.0287 141 ALA A CA 1685 C C . ALA A 112 ? 0.6096 0.2632 0.4634 0.0076 -0.2226 -0.0279 141 ALA A C 1686 O O . ALA A 112 ? 0.6040 0.2681 0.4665 -0.0005 -0.2273 -0.0237 141 ALA A O 1687 C CB . ALA A 112 ? 0.6356 0.2598 0.4676 0.0110 -0.2277 -0.0313 141 ALA A CB 1693 N N . MET A 113 ? 0.6151 0.2721 0.4648 0.0139 -0.2152 -0.0308 142 MET A N 1694 C CA . MET A 113 ? 0.5992 0.2727 0.4536 0.0113 -0.2129 -0.0297 142 MET A CA 1695 C C . MET A 113 ? 0.5940 0.2649 0.4387 0.0193 -0.2057 -0.0342 142 MET A C 1696 O O . MET A 113 ? 0.6039 0.2658 0.4436 0.0274 -0.1997 -0.0363 142 MET A O 1697 C CB . MET A 113 ? 0.5859 0.2788 0.4556 0.0082 -0.2089 -0.0241 142 MET A CB 1698 C CG . MET A 113 ? 0.5873 0.2832 0.4621 0.0140 -0.2024 -0.0225 142 MET A CG 1699 S SD . MET A 113 ? 0.6200 0.3340 0.5066 0.0091 -0.1992 -0.0159 142 MET A SD 1700 C CE . MET A 113 ? 0.5622 0.2869 0.4453 0.0117 -0.1930 -0.0181 142 MET A CE 1710 N N . VAL A 114 ? 0.5531 0.2321 0.3963 0.0173 -0.2058 -0.0349 143 VAL A N 1711 C CA . VAL A 114 ? 0.5533 0.2305 0.3870 0.0241 -0.1993 -0.0389 143 VAL A CA 1712 C C . VAL A 114 ? 0.5329 0.2307 0.3761 0.0225 -0.1950 -0.0364 143 VAL A C 1713 O O . VAL A 114 ? 0.5197 0.2291 0.3724 0.0156 -0.1983 -0.0326 143 VAL A O 1714 C CB . VAL A 114 ? 0.5791 0.2364 0.3929 0.0239 -0.2051 -0.0439 143 VAL A CB 1715 C CG1 . VAL A 114 ? 0.6052 0.2434 0.4086 0.0242 -0.2093 -0.0447 143 VAL A CG1 1716 C CG2 . VAL A 114 ? 0.5753 0.2418 0.3939 0.0155 -0.2127 -0.0410 143 VAL A CG2 1726 N N . LEU A 115 ? 0.5327 0.2338 0.3730 0.0294 -0.1869 -0.0383 144 LEU A N 1727 C CA . LEU A 115 ? 0.5266 0.2448 0.3734 0.0289 -0.1822 -0.0364 144 LEU A CA 1728 C C . LEU A 115 ? 0.5660 0.2793 0.4005 0.0328 -0.1802 -0.0409 144 LEU A C 1729 O O . LEU A 115 ? 0.5874 0.2864 0.4096 0.0394 -0.1769 -0.0448 144 LEU A O 1730 C CB . LEU A 115 ? 0.5028 0.2312 0.3593 0.0324 -0.1753 -0.0329 144 LEU A CB 1731 C CG . LEU A 115 ? 0.4810 0.2241 0.3416 0.0327 -0.1702 -0.0310 144 LEU A CG 1732 C CD1 . LEU A 115 ? 0.4730 0.2265 0.3391 0.0252 -0.1725 -0.0278 144 LEU A CD1 1733 C CD2 . LEU A 115 ? 0.4723 0.2210 0.3410 0.0363 -0.1653 -0.0269 144 LEU A CD2 1745 N N . ASP A 116 ? 0.5762 0.3001 0.4134 0.0290 -0.1814 -0.0399 145 ASP A N 1746 C CA . ASP A 116 ? 0.6113 0.3314 0.4373 0.0319 -0.1803 -0.0435 145 ASP A CA 1747 C C . ASP A 116 ? 0.5955 0.3334 0.4301 0.0296 -0.1777 -0.0409 145 ASP A C 1748 O O . ASP A 116 ? 0.5852 0.3361 0.4325 0.0257 -0.1767 -0.0363 145 ASP A O 1749 C CB . ASP A 116 ? 0.6490 0.3519 0.4618 0.0284 -0.1899 -0.0462 145 ASP A CB 1750 C CG . ASP A 116 ? 0.6564 0.3645 0.4802 0.0193 -0.1991 -0.0416 145 ASP A CG 1751 O OD1 . ASP A 116 ? 0.6452 0.3718 0.4853 0.0161 -0.1966 -0.0367 145 ASP A OD1 1752 O OD2 . ASP A 116 ? 0.6735 0.3673 0.4902 0.0156 -0.2075 -0.0416 145 ASP A OD2 1757 N N . ARG A 117 ? 0.5910 0.3271 0.4167 0.0323 -0.1762 -0.0437 146 ARG A N 1758 C CA . ARG A 117 ? 0.5637 0.3151 0.3957 0.0316 -0.1727 -0.0418 146 ARG A CA 1759 C C . ARG A 117 ? 0.5735 0.3212 0.3994 0.0289 -0.1786 -0.0428 146 ARG A C 1760 O O . ARG A 117 ? 0.5773 0.3079 0.3887 0.0291 -0.1842 -0.0464 146 ARG A O 1761 C CB . ARG A 117 ? 0.5554 0.3110 0.3846 0.0384 -0.1638 -0.0431 146 ARG A CB 1762 C CG . ARG A 117 ? 0.5802 0.3215 0.3928 0.0442 -0.1619 -0.0482 146 ARG A CG 1763 C CD . ARG A 117 ? 0.5814 0.3276 0.3944 0.0513 -0.1522 -0.0481 146 ARG A CD 1764 N NE . ARG A 117 ? 0.5989 0.3289 0.3955 0.0581 -0.1480 -0.0524 146 ARG A NE 1765 C CZ . ARG A 117 ? 0.6110 0.3245 0.3993 0.0627 -0.1458 -0.0543 146 ARG A CZ 1766 N NH1 . ARG A 117 ? 0.6083 0.3209 0.4049 0.0606 -0.1488 -0.0523 146 ARG A NH1 1767 N NH2 . ARG A 117 ? 0.6308 0.3271 0.4013 0.0696 -0.1401 -0.0580 146 ARG A NH2 1781 N N . SER A 118 ? 0.7343 0.4964 0.5703 0.0262 -0.1776 -0.0393 147 SER A N 1782 C CA . SER A 118 ? 0.7250 0.4865 0.5577 0.0242 -0.1823 -0.0392 147 SER A CA 1783 C C . SER A 118 ? 0.7103 0.4821 0.5427 0.0283 -0.1745 -0.0399 147 SER A C 1784 O O . SER A 118 ? 0.6953 0.4806 0.5380 0.0285 -0.1682 -0.0368 147 SER A O 1785 C CB . SER A 118 ? 0.7022 0.4716 0.5503 0.0171 -0.1888 -0.0327 147 SER A CB 1786 O OG . SER A 118 ? 0.6912 0.4629 0.5399 0.0151 -0.1932 -0.0310 147 SER A OG 1792 N N . GLN A 119 ? 0.7451 0.5081 0.5633 0.0312 -0.1752 -0.0440 148 GLN A N 1793 C CA . GLN A 119 ? 0.7565 0.5274 0.5724 0.0354 -0.1683 -0.0451 148 GLN A CA 1794 C C . GLN A 119 ? 0.7516 0.5304 0.5735 0.0319 -0.1715 -0.0420 148 GLN A C 1795 O O . GLN A 119 ? 0.7303 0.5158 0.5510 0.0346 -0.1665 -0.0424 148 GLN A O 1796 C CB . GLN A 119 ? 0.7752 0.5324 0.5731 0.0414 -0.1646 -0.0504 148 GLN A CB 1797 C CG . GLN A 119 ? 0.7698 0.5355 0.5676 0.0471 -0.1551 -0.0510 148 GLN A CG 1798 C CD . GLN A 119 ? 0.7972 0.5492 0.5801 0.0542 -0.1494 -0.0549 148 GLN A CD 1799 O OE1 . GLN A 119 ? 0.7867 0.5444 0.5747 0.0591 -0.1413 -0.0535 148 GLN A OE1 1800 N NE2 . GLN A 119 ? 0.8327 0.5654 0.5971 0.0546 -0.1533 -0.0588 148 GLN A NE2 1809 N N . ASP A 120 ? 0.6519 0.4300 0.4819 0.0258 -0.1800 -0.0380 149 ASP A N 1810 C CA . ASP A 120 ? 0.6419 0.4264 0.4800 0.0220 -0.1849 -0.0336 149 ASP A CA 1811 C C . ASP A 120 ? 0.6596 0.4550 0.5188 0.0167 -0.1887 -0.0257 149 ASP A C 1812 O O . ASP A 120 ? 0.6891 0.4836 0.5562 0.0112 -0.1985 -0.0206 149 ASP A O 1813 C CB . ASP A 120 ? 0.6367 0.4068 0.4640 0.0195 -0.1905 -0.0342 149 ASP A CB 1814 C CG . ASP A 120 ? 0.6404 0.3959 0.4630 0.0157 -0.1977 -0.0338 149 ASP A CG 1815 O OD1 . ASP A 120 ? 0.6359 0.3920 0.4618 0.0164 -0.1967 -0.0346 149 ASP A OD1 1816 O OD2 . ASP A 120 ? 0.6568 0.3989 0.4712 0.0118 -0.2048 -0.0324 149 ASP A OD2 1821 N N . PHE A 121 ? 0.5108 0.3161 0.3801 0.0182 -0.1800 -0.0236 150 PHE A N 1822 C CA . PHE A 121 ? 0.5098 0.3267 0.3998 0.0148 -0.1782 -0.0152 150 PHE A CA 1823 C C . PHE A 121 ? 0.5186 0.3309 0.4175 0.0086 -0.1889 -0.0106 150 PHE A C 1824 O O . PHE A 121 ? 0.5103 0.3317 0.4288 0.0048 -0.1910 -0.0017 150 PHE A O 1825 C CB . PHE A 121 ? 0.5240 0.3522 0.4254 0.0152 -0.1752 -0.0100 150 PHE A CB 1826 C CG . PHE A 121 ? 0.5358 0.3679 0.4283 0.0208 -0.1653 -0.0139 150 PHE A CG 1827 C CD1 . PHE A 121 ? 0.5320 0.3703 0.4274 0.0232 -0.1539 -0.0121 150 PHE A CD1 1828 C CD2 . PHE A 121 ? 0.5397 0.3672 0.4189 0.0231 -0.1677 -0.0191 150 PHE A CD2 1829 C CE1 . PHE A 121 ? 0.5232 0.3632 0.4092 0.0274 -0.1464 -0.0152 150 PHE A CE1 1830 C CE2 . PHE A 121 ? 0.5267 0.3580 0.3986 0.0277 -0.1593 -0.0220 150 PHE A CE2 1831 C CZ . PHE A 121 ? 0.5197 0.3574 0.3954 0.0296 -0.1492 -0.0199 150 PHE A CZ 1841 N N . GLY A 122 ? 0.6971 0.4950 0.5824 0.0077 -0.1953 -0.0157 151 GLY A N 1842 C CA . GLY A 122 ? 0.7162 0.5077 0.6076 0.0016 -0.2053 -0.0119 151 GLY A CA 1843 C C . GLY A 122 ? 0.7402 0.5177 0.6239 -0.0038 -0.2207 -0.0113 151 GLY A C 1844 O O . GLY A 122 ? 0.7558 0.5265 0.6440 -0.0100 -0.2311 -0.0073 151 GLY A O 1848 N N . LYS A 123 ? 0.6721 0.4444 0.5439 -0.0020 -0.2208 -0.0146 152 LYS A N 1849 C CA . LYS A 123 ? 0.6854 0.4429 0.5490 -0.0069 -0.2292 -0.0129 152 LYS A CA 1850 C C . LYS A 123 ? 0.6977 0.4331 0.5392 -0.0054 -0.2293 -0.0188 152 LYS A C 1851 O O . LYS A 123 ? 0.7127 0.4337 0.5495 -0.0111 -0.2388 -0.0154 152 LYS A O 1852 C CB . LYS A 123 ? 0.6855 0.4429 0.5416 -0.0048 -0.2267 -0.0146 152 LYS A CB 1855 N N . THR A 124 ? 0.8357 0.5680 0.6639 0.0024 -0.2190 -0.0265 153 THR A N 1856 C CA . THR A 124 ? 0.8681 0.5801 0.6756 0.0056 -0.2176 -0.0317 153 THR A CA 1857 C C . THR A 124 ? 0.8675 0.5842 0.6759 0.0113 -0.2095 -0.0360 153 THR A C 1858 O O . THR A 124 ? 0.8551 0.5882 0.6740 0.0141 -0.2030 -0.0365 153 THR A O 1859 C CB . THR A 124 ? 0.8928 0.5895 0.6768 0.0104 -0.2134 -0.0366 153 THR A CB 1860 O OG1 . THR A 124 ? 0.8847 0.5934 0.6692 0.0172 -0.2026 -0.0405 153 THR A OG1 1861 C CG2 . THR A 124 ? 0.9044 0.5940 0.6854 0.0042 -0.2223 -0.0321 153 THR A CG2 1869 N N . TRP A 125 ? 0.6409 0.3420 0.4376 0.0127 -0.2104 -0.0386 154 TRP A N 1870 C CA . TRP A 125 ? 0.6189 0.3218 0.4164 0.0176 -0.2041 -0.0422 154 TRP A CA 1871 C C . TRP A 125 ? 0.6234 0.3061 0.3984 0.0245 -0.1992 -0.0480 154 TRP A C 1872 O O . TRP A 125 ? 0.6445 0.3083 0.4021 0.0238 -0.2030 -0.0484 154 TRP A O 1873 C CB . TRP A 125 ? 0.6237 0.3298 0.4346 0.0120 -0.2103 -0.0381 154 TRP A CB 1874 C CG . TRP A 125 ? 0.6121 0.3369 0.4451 0.0057 -0.2143 -0.0317 154 TRP A CG 1875 C CD1 . TRP A 125 ? 0.6123 0.3398 0.4550 -0.0013 -0.2231 -0.0253 154 TRP A CD1 1876 C CD2 . TRP A 125 ? 0.6005 0.3429 0.4485 0.0061 -0.2094 -0.0299 154 TRP A CD2 1877 N NE1 . TRP A 125 ? 0.5946 0.3412 0.4586 -0.0047 -0.2241 -0.0196 154 TRP A NE1 1878 C CE2 . TRP A 125 ? 0.5884 0.3445 0.4556 0.0004 -0.2128 -0.0218 154 TRP A CE2 1879 C CE3 . TRP A 125 ? 0.6011 0.3505 0.4511 0.0113 -0.1986 -0.0317 154 TRP A CE3 1880 C CZ2 . TRP A 125 ? 0.5751 0.3493 0.4600 0.0005 -0.2039 -0.0165 154 TRP A CZ2 1881 C CZ3 . TRP A 125 ? 0.5839 0.3503 0.4499 0.0102 -0.1920 -0.0266 154 TRP A CZ3 1882 C CH2 . TRP A 125 ? 0.5719 0.3495 0.4535 0.0052 -0.1938 -0.0195 154 TRP A CH2 1893 N N . LYS A 126 ? 0.8152 0.5002 0.5899 0.0312 -0.1910 -0.0519 155 LYS A N 1894 C CA . LYS A 126 ? 0.8144 0.4802 0.5701 0.0390 -0.1847 -0.0570 155 LYS A CA 1895 C C . LYS A 126 ? 0.7792 0.4464 0.5429 0.0431 -0.1804 -0.0585 155 LYS A C 1896 O O . LYS A 126 ? 0.7494 0.4384 0.5323 0.0431 -0.1759 -0.0551 155 LYS A O 1897 C CB . LYS A 126 ? 0.8238 0.4870 0.5673 0.0457 -0.1763 -0.0603 155 LYS A CB 1898 C CG . LYS A 126 ? 0.7971 0.4814 0.5550 0.0472 -0.1717 -0.0600 155 LYS A CG 1899 C CD . LYS A 126 ? 0.7992 0.4840 0.5476 0.0496 -0.1677 -0.0610 155 LYS A CD 1900 C CE . LYS A 126 ? 0.8287 0.4923 0.5543 0.0578 -0.1596 -0.0652 155 LYS A CE 1901 N NZ . LYS A 126 ? 0.8413 0.5047 0.5569 0.0596 -0.1557 -0.0657 155 LYS A NZ 1915 N N . PRO A 127 ? 0.7046 0.3536 0.4577 0.0465 -0.1791 -0.0603 156 PRO A N 1916 C CA . PRO A 127 ? 0.6894 0.3417 0.4546 0.0497 -0.1749 -0.0589 156 PRO A CA 1917 C C . PRO A 127 ? 0.6869 0.3565 0.4665 0.0566 -0.1628 -0.0561 156 PRO A C 1918 O O . PRO A 127 ? 0.6862 0.3572 0.4604 0.0619 -0.1555 -0.0574 156 PRO A O 1919 C CB . PRO A 127 ? 0.7046 0.3298 0.4501 0.0544 -0.1734 -0.0621 156 PRO A CB 1920 C CG . PRO A 127 ? 0.7157 0.3307 0.4452 0.0487 -0.1808 -0.0618 156 PRO A CG 1921 C CD . PRO A 127 ? 0.7130 0.3393 0.4436 0.0468 -0.1810 -0.0615 156 PRO A CD 1929 N N . TYR A 128 ? 0.6275 0.3092 0.4254 0.0558 -0.1617 -0.0516 157 TYR A N 1930 C CA . TYR A 128 ? 0.6227 0.3190 0.4359 0.0610 -0.1526 -0.0472 157 TYR A CA 1931 C C . TYR A 128 ? 0.6115 0.2993 0.4295 0.0660 -0.1490 -0.0450 157 TYR A C 1932 O O . TYR A 128 ? 0.6231 0.3079 0.4431 0.0748 -0.1392 -0.0434 157 TYR A O 1933 C CB . TYR A 128 ? 0.6155 0.3346 0.4468 0.0541 -0.1555 -0.0420 157 TYR A CB 1934 C CG . TYR A 128 ? 0.6139 0.3477 0.4493 0.0549 -0.1510 -0.0406 157 TYR A CG 1935 C CD1 . TYR A 128 ? 0.6214 0.3546 0.4544 0.0628 -0.1423 -0.0407 157 TYR A CD1 1936 C CD2 . TYR A 128 ? 0.5992 0.3467 0.4409 0.0480 -0.1546 -0.0386 157 TYR A CD2 1937 C CE1 . TYR A 128 ? 0.6083 0.3547 0.4449 0.0630 -0.1390 -0.0390 157 TYR A CE1 1938 C CE2 . TYR A 128 ? 0.5875 0.3467 0.4314 0.0487 -0.1506 -0.0373 157 TYR A CE2 1939 C CZ . TYR A 128 ? 0.5927 0.3516 0.4342 0.0558 -0.1436 -0.0377 157 TYR A CZ 1940 O OH . TYR A 128 ? 0.5846 0.3547 0.4281 0.0560 -0.1403 -0.0362 157 TYR A OH 1950 N N . LYS A 129 ? 0.5037 0.1878 0.3250 0.0604 -0.1567 -0.0443 158 LYS A N 1951 C CA . LYS A 129 ? 0.5103 0.1880 0.3386 0.0639 -0.1547 -0.0415 158 LYS A CA 1952 C C . LYS A 129 ? 0.9769 0.6451 0.8019 0.0570 -0.1648 -0.0426 158 LYS A C 1953 O O . LYS A 129 ? 0.5053 0.1839 0.3361 0.0480 -0.1727 -0.0413 158 LYS A O 1954 C CB . LYS A 129 ? 0.4896 0.1875 0.3411 0.0635 -0.1519 -0.0337 158 LYS A CB 1955 C CG . LYS A 129 ? 0.4965 0.1895 0.3586 0.0696 -0.1473 -0.0290 158 LYS A CG 1956 C CD . LYS A 129 ? 0.5072 0.1945 0.3681 0.0815 -0.1347 -0.0282 158 LYS A CD 1957 C CE . LYS A 129 ? 0.5139 0.1978 0.3894 0.0884 -0.1290 -0.0217 158 LYS A CE 1958 N NZ . LYS A 129 ? 0.6921 0.3704 0.5684 0.1011 -0.1146 -0.0195 158 LYS A NZ 1972 N N . TYR A 130 ? 0.5393 0.1870 0.3549 0.0617 -0.1638 -0.0445 159 TYR A N 1973 C CA . TYR A 130 ? 0.5480 0.1854 0.3610 0.0557 -0.1733 -0.0450 159 TYR A CA 1974 C C . TYR A 130 ? 0.5390 0.1843 0.3709 0.0561 -0.1724 -0.0390 159 TYR A C 1975 O O . TYR A 130 ? 0.5367 0.1861 0.3788 0.0637 -0.1635 -0.0353 159 TYR A O 1976 C CB . TYR A 130 ? 0.5815 0.1873 0.3687 0.0596 -0.1743 -0.0510 159 TYR A CB 1977 C CG . TYR A 130 ? 0.5920 0.1915 0.3600 0.0559 -0.1781 -0.0552 159 TYR A CG 1978 C CD1 . TYR A 130 ? 0.5968 0.1934 0.3541 0.0622 -0.1700 -0.0581 159 TYR A CD1 1979 C CD2 . TYR A 130 ? 0.5973 0.1948 0.3596 0.0461 -0.1900 -0.0547 159 TYR A CD2 1980 C CE1 . TYR A 130 ? 0.6069 0.1983 0.3472 0.0581 -0.1742 -0.0606 159 TYR A CE1 1981 C CE2 . TYR A 130 ? 0.6070 0.2000 0.3547 0.0423 -0.1944 -0.0560 159 TYR A CE2 1982 C CZ . TYR A 130 ? 0.6119 0.2016 0.3482 0.0481 -0.1868 -0.0592 159 TYR A CZ 1983 O OH . TYR A 130 ? 0.6224 0.2072 0.3446 0.0439 -0.1919 -0.0594 159 TYR A OH 1993 N N . PHE A 131 ? 0.6129 0.2605 0.4506 0.0475 -0.1819 -0.0371 160 PHE A N 1994 C CA . PHE A 131 ? 0.5957 0.2493 0.4497 0.0462 -0.1830 -0.0313 160 PHE A CA 1995 C C . PHE A 131 ? 0.6168 0.2543 0.4640 0.0421 -0.1914 -0.0327 160 PHE A C 1996 O O . PHE A 131 ? 0.6167 0.2522 0.4578 0.0340 -0.2002 -0.0345 160 PHE A O 1997 C CB . PHE A 131 ? 0.5582 0.2346 0.4285 0.0384 -0.1859 -0.0257 160 PHE A CB 1998 C CG . PHE A 131 ? 0.5375 0.2290 0.4127 0.0408 -0.1795 -0.0243 160 PHE A CG 1999 C CD1 . PHE A 131 ? 0.5287 0.2251 0.3959 0.0384 -0.1798 -0.0278 160 PHE A CD1 2000 C CD2 . PHE A 131 ? 0.5286 0.2292 0.4175 0.0450 -0.1741 -0.0184 160 PHE A CD2 2001 C CE1 . PHE A 131 ? 0.5156 0.2249 0.3865 0.0405 -0.1741 -0.0265 160 PHE A CE1 2002 C CE2 . PHE A 131 ? 0.5156 0.2293 0.4087 0.0465 -0.1692 -0.0166 160 PHE A CE2 2003 C CZ . PHE A 131 ? 0.5106 0.2281 0.3937 0.0444 -0.1690 -0.0211 160 PHE A CZ 2013 N N . ALA A 132 ? 0.6022 0.2287 0.4522 0.0476 -0.1887 -0.0311 161 ALA A N 2014 C CA . ALA A 132 ? 0.6199 0.2332 0.4639 0.0439 -0.1954 -0.0320 161 ALA A CA 2015 C C . ALA A 132 ? 0.6249 0.2351 0.4802 0.0494 -0.1909 -0.0276 161 ALA A C 2016 O O . ALA A 132 ? 0.6339 0.2459 0.4978 0.0586 -0.1814 -0.0246 161 ALA A O 2017 C CB . ALA A 132 ? 0.6491 0.2436 0.4685 0.0456 -0.1953 -0.0384 161 ALA A CB 2023 N N . THR A 133 ? 0.5790 0.1856 0.4360 0.0438 -0.1979 -0.0262 162 THR A N 2024 C CA . THR A 133 ? 0.5854 0.1882 0.4529 0.0484 -0.1945 -0.0219 162 THR A CA 2025 C C . THR A 133 ? 0.6114 0.1943 0.4651 0.0601 -0.1835 -0.0255 162 THR A C 2026 O O . THR A 133 ? 0.6171 0.1974 0.4820 0.0679 -0.1757 -0.0212 162 THR A O 2027 C CB . THR A 133 ? 0.5868 0.1889 0.4567 0.0394 -0.2047 -0.0202 162 THR A CB 2028 O OG1 . THR A 133 ? 0.7161 0.3049 0.5658 0.0355 -0.2102 -0.0258 162 THR A OG1 2029 C CG2 . THR A 133 ? 0.5634 0.1842 0.4476 0.0289 -0.2128 -0.0152 162 THR A CG2 2037 N N . ASN A 134 ? 0.7062 0.2746 0.5355 0.0610 -0.1826 -0.0327 163 ASN A N 2038 C CA . ASN A 134 ? 0.7454 0.2925 0.5564 0.0720 -0.1706 -0.0366 163 ASN A CA 2039 C C . ASN A 134 ? 0.7438 0.2831 0.5322 0.0721 -0.1693 -0.0428 163 ASN A C 2040 O O . ASN A 134 ? 0.7544 0.2853 0.5247 0.0644 -0.1789 -0.0467 163 ASN A O 2041 C CB . ASN A 134 ? 0.8545 0.3815 0.6517 0.0718 -0.1725 -0.0385 163 ASN A CB 2042 C CG . ASN A 134 ? 0.9264 0.4313 0.7092 0.0849 -0.1567 -0.0405 163 ASN A CG 2043 O OD1 . ASN A 134 ? 0.9673 0.4564 0.7254 0.0885 -0.1512 -0.0459 163 ASN A OD1 2044 N ND2 . ASN A 134 ? 0.9229 0.4262 0.7214 0.0921 -0.1490 -0.0354 163 ASN A ND2 2050 N N . CYS A 135 ? 1.1132 0.6561 0.9038 0.0806 -0.1580 -0.0427 164 CYS A N 2051 C CA . CYS A 135 ? 1.0806 0.6183 0.8517 0.0808 -0.1564 -0.0479 164 CYS A CA 2052 C C . CYS A 135 ? 1.0759 0.5858 0.8141 0.0829 -0.1537 -0.0537 164 CYS A C 2053 O O . CYS A 135 ? 1.0705 0.5742 0.7892 0.0772 -0.1603 -0.0576 164 CYS A O 2054 C CB . CYS A 135 ? 1.0687 0.6150 0.8496 0.0907 -0.1433 -0.0458 164 CYS A CB 2055 S SG . CYS A 135 ? 0.8870 0.4649 0.7018 0.0867 -0.1484 -0.0385 164 CYS A SG 2060 N N . SER A 136 ? 0.9523 0.4450 0.6845 0.0909 -0.1442 -0.0534 165 SER A N 2061 C CA . SER A 136 ? 0.9619 0.4249 0.6603 0.0938 -0.1400 -0.0584 165 SER A CA 2062 C C . SER A 136 ? 0.9494 0.4021 0.6318 0.0820 -0.1570 -0.0604 165 SER A C 2063 O O . SER A 136 ? 0.9849 0.4192 0.6383 0.0786 -0.1615 -0.0640 165 SER A O 2064 C CB . SER A 136 ? 0.9750 0.4226 0.6736 0.1065 -0.1234 -0.0567 165 SER A CB 2065 O OG . SER A 136 ? 0.9594 0.4168 0.6745 0.1180 -0.1070 -0.0531 165 SER A OG 2071 N N . ALA A 137 ? 1.1506 0.6152 0.8524 0.0756 -0.1668 -0.0569 166 ALA A N 2072 C CA . ALA A 137 ? 0.7751 0.2320 0.4660 0.0647 -0.1828 -0.0571 166 ALA A CA 2073 C C . ALA A 137 ? 0.7555 0.2286 0.4508 0.0526 -0.1977 -0.0558 166 ALA A C 2074 O O . ALA A 137 ? 0.7712 0.2340 0.4502 0.0446 -0.2098 -0.0557 166 ALA A O 2075 C CB . ALA A 137 ? 0.8895 0.3529 0.5998 0.0627 -0.1866 -0.0533 166 ALA A CB 2081 N N . THR A 138 ? 0.8658 0.3637 0.5841 0.0517 -0.1968 -0.0537 167 THR A N 2082 C CA . THR A 138 ? 0.8257 0.3417 0.5534 0.0410 -0.2090 -0.0513 167 THR A CA 2083 C C . THR A 138 ? 0.8011 0.3134 0.5130 0.0412 -0.2081 -0.0540 167 THR A C 2084 O O . THR A 138 ? 0.7968 0.3094 0.5025 0.0325 -0.2197 -0.0522 167 THR A O 2085 C CB . THR A 138 ? 0.7996 0.3431 0.5583 0.0390 -0.2087 -0.0474 167 THR A CB 2086 O OG1 . THR A 138 ? 0.7970 0.3440 0.5704 0.0380 -0.2104 -0.0441 167 THR A OG1 2087 C CG2 . THR A 138 ? 0.7830 0.3444 0.5520 0.0284 -0.2195 -0.0444 167 THR A CG2 2095 N N . PHE A 139 ? 0.7191 0.2285 0.4261 0.0511 -0.1945 -0.0571 168 PHE A N 2096 C CA . PHE A 139 ? 0.7222 0.2304 0.4163 0.0517 -0.1926 -0.0594 168 PHE A CA 2097 C C . PHE A 139 ? 0.7566 0.2387 0.4214 0.0608 -0.1811 -0.0638 168 PHE A C 2098 O O . PHE A 139 ? 0.7656 0.2422 0.4146 0.0610 -0.1799 -0.0656 168 PHE A O 2099 C CB . PHE A 139 ? 0.6936 0.2256 0.4097 0.0544 -0.1869 -0.0584 168 PHE A CB 2100 C CG . PHE A 139 ? 0.6752 0.2315 0.4160 0.0449 -0.1974 -0.0542 168 PHE A CG 2101 C CD1 . PHE A 139 ? 0.6747 0.2389 0.4157 0.0356 -0.2081 -0.0524 168 PHE A CD1 2102 C CD2 . PHE A 139 ? 0.6606 0.2315 0.4251 0.0454 -0.1959 -0.0509 168 PHE A CD2 2103 C CE1 . PHE A 139 ? 0.6531 0.2391 0.4171 0.0276 -0.2152 -0.0478 168 PHE A CE1 2104 C CE2 . PHE A 139 ? 0.6426 0.2336 0.4270 0.0366 -0.2041 -0.0468 168 PHE A CE2 2105 C CZ . PHE A 139 ? 0.6390 0.2376 0.4230 0.0280 -0.2129 -0.0455 168 PHE A CZ 2115 N N . GLY A 140 ? 0.8052 0.2707 0.4626 0.0684 -0.1719 -0.0649 169 GLY A N 2116 C CA . GLY A 140 ? 0.8442 0.2843 0.4747 0.0783 -0.1579 -0.0684 169 GLY A CA 2117 C C . GLY A 140 ? 0.8404 0.2902 0.4796 0.0882 -0.1423 -0.0687 169 GLY A C 2118 O O . GLY A 140 ? 0.8685 0.3020 0.4851 0.0944 -0.1321 -0.0713 169 GLY A O 2122 N N . LEU A 141 ? 0.7545 0.2307 0.4264 0.0893 -0.1411 -0.0652 170 LEU A N 2123 C CA . LEU A 141 ? 0.7394 0.2283 0.4248 0.0983 -0.1278 -0.0638 170 LEU A CA 2124 C C . LEU A 141 ? 0.7362 0.2285 0.4426 0.1093 -0.1141 -0.0590 170 LEU A C 2125 O O . LEU A 141 ? 0.7356 0.2274 0.4526 0.1078 -0.1178 -0.0565 170 LEU A O 2126 C CB . LEU A 141 ? 0.7023 0.2185 0.4092 0.0912 -0.1372 -0.0619 170 LEU A CB 2127 C CG . LEU A 141 ? 0.7018 0.2188 0.3941 0.0808 -0.1500 -0.0647 170 LEU A CG 2128 C CD1 . LEU A 141 ? 0.6652 0.2094 0.3821 0.0731 -0.1596 -0.0621 170 LEU A CD1 2129 C CD2 . LEU A 141 ? 0.7206 0.2252 0.3899 0.0859 -0.1414 -0.0680 170 LEU A CD2 2141 N N . GLU A 142 ? 0.9290 0.4258 0.6432 0.1201 -0.0984 -0.0565 171 GLU A N 2142 C CA . GLU A 142 ? 0.9258 0.4296 0.6658 0.1311 -0.0849 -0.0492 171 GLU A CA 2143 C C . GLU A 142 ? 0.8687 0.4020 0.6447 0.1275 -0.0927 -0.0422 171 GLU A C 2144 O O . GLU A 142 ? 0.8323 0.3808 0.6124 0.1203 -0.1023 -0.0432 171 GLU A O 2145 C CB . GLU A 142 ? 0.9313 0.4285 0.6668 0.1443 -0.0643 -0.0475 171 GLU A CB 2146 C CG . GLU A 142 ? 0.9748 0.4403 0.6749 0.1491 -0.0543 -0.0530 171 GLU A CG 2147 C CD . GLU A 142 ? 0.9950 0.4543 0.6899 0.1617 -0.0332 -0.0511 171 GLU A CD 2148 O OE1 . GLU A 142 ? 1.0379 0.4784 0.7231 0.1712 -0.0179 -0.0500 171 GLU A OE1 2149 O OE2 . GLU A 142 ? 0.9838 0.4570 0.6841 0.1621 -0.0315 -0.0504 171 GLU A OE2 2156 N N . ASP A 143 ? 0.7451 0.2858 0.5467 0.1321 -0.0889 -0.0344 172 ASP A N 2157 C CA . ASP A 143 ? 0.7200 0.2873 0.5554 0.1280 -0.0971 -0.0260 172 ASP A CA 2158 C C . ASP A 143 ? 0.7370 0.3194 0.5951 0.1377 -0.0851 -0.0174 172 ASP A C 2159 O O . ASP A 143 ? 0.7594 0.3346 0.6228 0.1499 -0.0683 -0.0129 172 ASP A O 2160 C CB . ASP A 143 ? 0.7100 0.2783 0.5621 0.1263 -0.1013 -0.0207 172 ASP A CB 2161 C CG . ASP A 143 ? 0.6729 0.2653 0.5510 0.1163 -0.1157 -0.0142 172 ASP A CG 2162 O OD1 . ASP A 143 ? 0.6569 0.2688 0.5502 0.1148 -0.1171 -0.0097 172 ASP A OD1 2163 O OD2 . ASP A 143 ? 0.6593 0.2515 0.5419 0.1092 -0.1253 -0.0134 172 ASP A OD2 2168 N N . ASP A 144 ? 0.6818 0.2880 0.5553 0.1311 -0.0929 -0.0141 173 ASP A N 2169 C CA . ASP A 144 ? 0.6922 0.3180 0.5877 0.1373 -0.0826 -0.0055 173 ASP A CA 2170 C C . ASP A 144 ? 0.6978 0.3391 0.6301 0.1413 -0.0792 0.0086 173 ASP A C 2171 O O . ASP A 144 ? 0.6822 0.3387 0.6368 0.1474 -0.0701 0.0182 173 ASP A O 2172 C CB . ASP A 144 ? 0.6711 0.3206 0.5712 0.1267 -0.0917 -0.0061 173 ASP A CB 2173 C CG . ASP A 144 ? 0.6487 0.3170 0.5648 0.1130 -0.1077 -0.0025 173 ASP A CG 2174 O OD1 . ASP A 144 ? 0.6517 0.3165 0.5769 0.1111 -0.1127 0.0008 173 ASP A OD1 2175 O OD2 . ASP A 144 ? 0.6297 0.3148 0.5479 0.1043 -0.1148 -0.0029 173 ASP A OD2 2180 N N . VAL A 145 ? 0.8103 0.4480 0.7501 0.1373 -0.0872 0.0107 174 VAL A N 2181 C CA . VAL A 145 ? 0.8070 0.4567 0.7814 0.1410 -0.0848 0.0247 174 VAL A CA 2182 C C . VAL A 145 ? 0.8284 0.4604 0.8054 0.1588 -0.0650 0.0288 174 VAL A C 2183 O O . VAL A 145 ? 0.8093 0.4522 0.8189 0.1652 -0.0586 0.0426 174 VAL A O 2184 C CB . VAL A 145 ? 0.6265 0.2759 0.6071 0.1316 -0.0992 0.0258 174 VAL A CB 2185 C CG1 . VAL A 145 ? 0.6044 0.2676 0.5792 0.1150 -0.1165 0.0215 174 VAL A CG1 2186 C CG2 . VAL A 145 ? 0.6538 0.2757 0.6104 0.1355 -0.0956 0.0172 174 VAL A CG2 2196 N N . VAL A 146 ? 0.8648 0.4724 0.8085 0.1648 -0.0544 0.0176 175 VAL A N 2197 C CA . VAL A 146 ? 0.8890 0.4812 0.8309 0.1792 -0.0326 0.0198 175 VAL A CA 2198 C C . VAL A 146 ? 0.8842 0.4712 0.8092 0.1861 -0.0187 0.0155 175 VAL A C 2199 O O . VAL A 146 ? 0.8844 0.4771 0.8275 0.1972 -0.0017 0.0240 175 VAL A O 2200 C CB . VAL A 146 ? 0.9250 0.4900 0.8396 0.1791 -0.0309 0.0103 175 VAL A CB 2201 C CG1 . VAL A 146 ? 0.9587 0.5101 0.8766 0.1933 -0.0092 0.0140 175 VAL A CG1 2202 C CG2 . VAL A 146 ? 0.9115 0.4808 0.8372 0.1700 -0.0467 0.0123 175 VAL A CG2 2212 N N . LYS A 147 ? 1.0018 0.5792 0.8933 0.1788 -0.0265 0.0028 176 LYS A N 2213 C CA . LYS A 147 ? 1.0280 0.5956 0.8963 0.1841 -0.0144 -0.0030 176 LYS A CA 2214 C C . LYS A 147 ? 1.0201 0.6109 0.9100 0.1868 -0.0112 0.0048 176 LYS A C 2215 O O . LYS A 147 ? 1.0353 0.6229 0.9186 0.1947 0.0041 0.0051 176 LYS A O 2216 C CB . LYS A 147 ? 1.0336 0.5839 0.8607 0.1742 -0.0258 -0.0178 176 LYS A CB 2217 C CG . LYS A 147 ? 1.0540 0.5893 0.8511 0.1785 -0.0145 -0.0246 176 LYS A CG 2218 C CD . LYS A 147 ? 1.0846 0.5997 0.8709 0.1905 0.0064 -0.0235 176 LYS A CD 2219 C CE . LYS A 147 ? 1.1062 0.6043 0.8589 0.1936 0.0167 -0.0301 176 LYS A CE 2220 N NZ . LYS A 147 ? 1.1257 0.6025 0.8367 0.1829 0.0030 -0.0423 176 LYS A NZ 2234 N N . LYS A 148 ? 1.0089 0.6225 0.9232 0.1795 -0.0263 0.0113 177 LYS A N 2235 C CA . LYS A 148 ? 1.0145 0.6565 0.9533 0.1780 -0.0255 0.0199 177 LYS A CA 2236 C C . LYS A 148 ? 1.0170 0.6544 0.9283 0.1760 -0.0244 0.0101 177 LYS A C 2237 O O . LYS A 148 ? 1.0652 0.7041 0.9787 0.1850 -0.0102 0.0138 177 LYS A O 2238 C CB . LYS A 148 ? 1.0054 0.6547 0.9746 0.1922 -0.0070 0.0348 177 LYS A CB 2241 N N . GLY A 149 ? 0.8510 0.4831 0.7381 0.1642 -0.0395 -0.0015 178 GLY A N 2242 C CA . GLY A 149 ? 0.8244 0.4518 0.6855 0.1608 -0.0411 -0.0108 178 GLY A CA 2243 C C . GLY A 149 ? 0.8007 0.4093 0.6293 0.1517 -0.0543 -0.0238 178 GLY A C 2244 O O . GLY A 149 ? 0.7792 0.3855 0.5879 0.1465 -0.0593 -0.0311 178 GLY A O 2248 N N . ALA A 150 ? 0.6834 0.2789 0.5078 0.1495 -0.0606 -0.0257 179 ALA A N 2249 C CA . ALA A 150 ? 0.6860 0.2639 0.4821 0.1402 -0.0734 -0.0363 179 ALA A CA 2250 C C . ALA A 150 ? 0.6139 0.2125 0.4156 0.1259 -0.0904 -0.0384 179 ALA A C 2251 O O . ALA A 150 ? 0.5847 0.2121 0.4116 0.1221 -0.0922 -0.0319 179 ALA A O 2252 C CB . ALA A 150 ? 0.6532 0.2213 0.4512 0.1387 -0.0764 -0.0357 179 ALA A CB 2258 N N . ILE A 151 ? 0.6241 0.2080 0.4025 0.1175 -0.1024 -0.0466 180 ILE A N 2259 C CA . ILE A 151 ? 0.6004 0.2026 0.3832 0.1043 -0.1168 -0.0483 180 ILE A CA 2260 C C . ILE A 151 ? 0.5883 0.1980 0.3836 0.0948 -0.1295 -0.0462 180 ILE A C 2261 O O . ILE A 151 ? 0.5662 0.1943 0.3712 0.0844 -0.1396 -0.0453 180 ILE A O 2262 C CB . ILE A 151 ? 0.6183 0.2019 0.3701 0.1002 -0.1227 -0.0569 180 ILE A CB 2263 C CG1 . ILE A 151 ? 0.5914 0.1984 0.3526 0.0893 -0.1333 -0.0566 180 ILE A CG1 2264 C CG2 . ILE A 151 ? 0.6415 0.2063 0.3742 0.0950 -0.1292 -0.0605 180 ILE A CG2 2265 C CD1 . ILE A 151 ? 0.6058 0.1991 0.3418 0.0859 -0.1382 -0.0630 180 ILE A CD1 2277 N N . CYS A 152 ? 0.6723 0.2666 0.4667 0.0987 -0.1280 -0.0453 181 CYS A N 2278 C CA . CYS A 152 ? 0.6795 0.2793 0.4858 0.0904 -0.1392 -0.0428 181 CYS A CA 2279 C C . CYS A 152 ? 0.6637 0.2782 0.4982 0.0943 -0.1342 -0.0337 181 CYS A C 2280 O O . CYS A 152 ? 0.6769 0.2907 0.5194 0.1051 -0.1214 -0.0295 181 CYS A O 2281 C CB . CYS A 152 ? 0.7132 0.2890 0.4976 0.0883 -0.1433 -0.0480 181 CYS A CB 2282 S SG . CYS A 152 ? 0.8565 0.4380 0.6527 0.0769 -0.1582 -0.0455 181 CYS A SG 2287 N N . THR A 153 ? 0.7080 0.2546 0.5134 0.0254 -0.1022 0.0350 182 THR A N 2288 C CA . THR A 153 ? 0.6434 0.2029 0.4757 0.0283 -0.0964 0.0419 182 THR A CA 2289 C C . THR A 153 ? 0.7703 0.3368 0.6059 0.0215 -0.1067 0.0411 182 THR A C 2290 O O . THR A 153 ? 0.7669 0.3409 0.5971 0.0130 -0.1197 0.0366 182 THR A O 2291 C CB . THR A 153 ? 0.6188 0.1993 0.4758 0.0282 -0.0957 0.0462 182 THR A CB 2292 O OG1 . THR A 153 ? 0.7053 0.2969 0.5866 0.0299 -0.0923 0.0541 182 THR A OG1 2293 C CG2 . THR A 153 ? 0.6002 0.1949 0.4560 0.0188 -0.1098 0.0409 182 THR A CG2 2301 N N . SER A 154 ? 0.6132 0.1771 0.4593 0.0256 -0.1001 0.0465 183 SER A N 2302 C CA . SER A 154 ? 0.6059 0.1768 0.4574 0.0197 -0.1087 0.0468 183 SER A CA 2303 C C . SER A 154 ? 0.5848 0.1757 0.4636 0.0183 -0.1099 0.0534 183 SER A C 2304 O O . SER A 154 ? 0.5796 0.1765 0.4655 0.0141 -0.1158 0.0553 183 SER A O 2305 C CB . SER A 154 ? 0.6285 0.1814 0.4709 0.0244 -0.1023 0.0484 183 SER A CB 2306 O OG . SER A 154 ? 0.6437 0.1924 0.5025 0.0349 -0.0863 0.0569 183 SER A OG 2312 N N . ARG A 155 ? 0.6086 0.2086 0.5010 0.0212 -0.1052 0.0571 184 ARG A N 2313 C CA . ARG A 155 ? 0.6065 0.2235 0.5225 0.0192 -0.1076 0.0641 184 ARG A CA 2314 C C . ARG A 155 ? 0.5830 0.2132 0.4982 0.0078 -0.1233 0.0598 184 ARG A C 2315 O O . ARG A 155 ? 0.5780 0.2188 0.5074 0.0036 -0.1289 0.0646 184 ARG A O 2316 C CB . ARG A 155 ? 0.6192 0.2417 0.5467 0.0240 -0.1004 0.0686 184 ARG A CB 2317 C CG . ARG A 155 ? 0.6251 0.2642 0.5754 0.0211 -0.1048 0.0764 184 ARG A CG 2318 C CD . ARG A 155 ? 0.6303 0.2733 0.5920 0.0267 -0.0967 0.0820 184 ARG A CD 2319 N NE . ARG A 155 ? 0.6473 0.2798 0.6176 0.0394 -0.0789 0.0913 184 ARG A NE 2320 C CZ . ARG A 155 ? 0.6662 0.2832 0.6260 0.0480 -0.0652 0.0898 184 ARG A CZ 2321 N NH1 . ARG A 155 ? 0.6794 0.2902 0.6181 0.0444 -0.0699 0.0788 184 ARG A NH1 2322 N NH2 . ARG A 155 ? 0.5979 0.2045 0.5678 0.0603 -0.0468 0.1001 184 ARG A NH2 2336 N N . TYR A 156 ? 0.5774 0.2058 0.4761 0.0029 -0.1300 0.0517 185 TYR A N 2337 C CA . TYR A 156 ? 0.5622 0.2011 0.4597 -0.0064 -0.1417 0.0484 185 TYR A CA 2338 C C . TYR A 156 ? 0.5615 0.1945 0.4442 -0.0109 -0.1480 0.0433 185 TYR A C 2339 O O . TYR A 156 ? 0.5476 0.1840 0.4240 -0.0156 -0.1537 0.0395 185 TYR A O 2340 C CB . TYR A 156 ? 0.5331 0.1789 0.4303 -0.0081 -0.1432 0.0458 185 TYR A CB 2341 C CG . TYR A 156 ? 0.5282 0.1797 0.4393 -0.0041 -0.1377 0.0510 185 TYR A CG 2342 C CD1 . TYR A 156 ? 0.5207 0.1822 0.4453 -0.0083 -0.1425 0.0561 185 TYR A CD1 2343 C CD2 . TYR A 156 ? 0.5332 0.1792 0.4432 0.0031 -0.1286 0.0514 185 TYR A CD2 2344 C CE1 . TYR A 156 ? 0.5172 0.1846 0.4559 -0.0056 -0.1391 0.0619 185 TYR A CE1 2345 C CE2 . TYR A 156 ? 0.5290 0.1809 0.4534 0.0068 -0.1232 0.0573 185 TYR A CE2 2346 C CZ . TYR A 156 ? 0.5205 0.1837 0.4602 0.0023 -0.1290 0.0628 185 TYR A CZ 2347 O OH . TYR A 156 ? 0.5174 0.1870 0.4726 0.0051 -0.1253 0.0697 185 TYR A OH 2357 N N . SER A 157 ? 0.6783 0.3024 0.5569 -0.0094 -0.1468 0.0443 186 SER A N 2358 C CA . SER A 157 ? 0.6843 0.3013 0.5487 -0.0136 -0.1532 0.0403 186 SER A CA 2359 C C . SER A 157 ? 0.7014 0.3175 0.5685 -0.0161 -0.1564 0.0427 186 SER A C 2360 O O . SER A 157 ? 0.6982 0.3097 0.5553 -0.0204 -0.1625 0.0404 186 SER A O 2361 C CB . SER A 157 ? 0.6866 0.2865 0.5336 -0.0090 -0.1491 0.0373 186 SER A CB 2362 O OG . SER A 157 ? 0.6721 0.2720 0.5151 -0.0071 -0.1471 0.0352 186 SER A OG 2368 N N . ASN A 158 ? 0.7235 0.3441 0.6050 -0.0139 -0.1529 0.0482 187 ASN A N 2369 C CA . ASN A 158 ? 0.7387 0.3589 0.6242 -0.0164 -0.1563 0.0512 187 ASN A CA 2370 C C . ASN A 158 ? 0.7104 0.3383 0.5930 -0.0258 -0.1670 0.0493 187 ASN A C 2371 O O . ASN A 158 ? 0.6994 0.3365 0.5851 -0.0298 -0.1703 0.0489 187 ASN A O 2372 C CB . ASN A 158 ? 0.7642 0.3900 0.6689 -0.0132 -0.1523 0.0591 187 ASN A CB 2373 C CG . ASN A 158 ? 0.7940 0.4103 0.7039 -0.0023 -0.1386 0.0635 187 ASN A CG 2374 O OD1 . ASN A 158 ? 0.8134 0.4187 0.7107 0.0027 -0.1320 0.0597 187 ASN A OD1 2375 N ND2 . ASN A 158 ? 0.7986 0.4180 0.7271 0.0016 -0.1340 0.0725 187 ASN A ND2 2382 N N . PRO A 159 ? 0.6772 0.3001 0.5529 -0.0290 -0.1714 0.0485 188 PRO A N 2383 C CA . PRO A 159 ? 0.6635 0.2924 0.5367 -0.0372 -0.1796 0.0479 188 PRO A CA 2384 C C . PRO A 159 ? 0.6567 0.2940 0.5393 -0.0410 -0.1827 0.0519 188 PRO A C 2385 O O . PRO A 159 ? 0.6513 0.2931 0.5305 -0.0465 -0.1863 0.0513 188 PRO A O 2386 C CB . PRO A 159 ? 0.6660 0.2869 0.5322 -0.0387 -0.1827 0.0478 188 PRO A CB 2387 C CG . PRO A 159 ? 0.6785 0.2867 0.5370 -0.0321 -0.1771 0.0460 188 PRO A CG 2388 C CD . PRO A 159 ? 0.6820 0.2913 0.5496 -0.0251 -0.1684 0.0482 188 PRO A CD 2396 N N . PHE A 160 ? 0.7158 0.3536 0.6094 -0.0382 -0.1811 0.0568 189 PHE A N 2397 C CA . PHE A 160 ? 0.7131 0.3579 0.6159 -0.0427 -0.1862 0.0617 189 PHE A CA 2398 C C . PHE A 160 ? 0.6958 0.3465 0.6072 -0.0403 -0.1834 0.0635 189 PHE A C 2399 O O . PHE A 160 ? 0.6912 0.3407 0.6104 -0.0328 -0.1756 0.0650 189 PHE A O 2400 C CB . PHE A 160 ? 0.7278 0.3715 0.6419 -0.0416 -0.1874 0.0680 189 PHE A CB 2401 C CG . PHE A 160 ? 0.7395 0.3773 0.6453 -0.0444 -0.1909 0.0666 189 PHE A CG 2402 C CD1 . PHE A 160 ? 0.7423 0.3795 0.6345 -0.0511 -0.1964 0.0628 189 PHE A CD1 2403 C CD2 . PHE A 160 ? 0.7490 0.3812 0.6612 -0.0398 -0.1874 0.0701 189 PHE A CD2 2404 C CE1 . PHE A 160 ? 0.7481 0.3803 0.6336 -0.0538 -0.1997 0.0623 189 PHE A CE1 2405 C CE2 . PHE A 160 ? 0.7539 0.3802 0.6581 -0.0425 -0.1910 0.0688 189 PHE A CE2 2406 C CZ . PHE A 160 ? 0.7525 0.3794 0.6435 -0.0499 -0.1978 0.0648 189 PHE A CZ 2416 N N . PRO A 161 ? 0.6182 0.2733 0.5267 -0.0464 -0.1891 0.0638 190 PRO A N 2417 C CA . PRO A 161 ? 0.6211 0.2741 0.5171 -0.0545 -0.1961 0.0628 190 PRO A CA 2418 C C . PRO A 161 ? 0.6285 0.2782 0.5106 -0.0554 -0.1932 0.0570 190 PRO A C 2419 O O . PRO A 161 ? 0.6361 0.2871 0.5173 -0.0520 -0.1883 0.0537 190 PRO A O 2420 C CB . PRO A 161 ? 0.6179 0.2735 0.5141 -0.0588 -0.2006 0.0655 190 PRO A CB 2421 C CG . PRO A 161 ? 0.6106 0.2706 0.5149 -0.0529 -0.1944 0.0645 190 PRO A CG 2422 C CD . PRO A 161 ? 0.6116 0.2718 0.5268 -0.0449 -0.1873 0.0652 190 PRO A CD 2430 N N . CYS A 162 ? 0.6806 0.3261 0.5537 -0.0601 -0.1962 0.0567 191 CYS A N 2431 C CA . CYS A 162 ? 0.6784 0.3212 0.5424 -0.0615 -0.1932 0.0533 191 CYS A CA 2432 C C . CYS A 162 ? 0.6762 0.3173 0.5322 -0.0642 -0.1902 0.0523 191 CYS A C 2433 O O . CYS A 162 ? 0.6816 0.3207 0.5337 -0.0650 -0.1861 0.0506 191 CYS A O 2434 C CB . CYS A 162 ? 0.6889 0.3273 0.5470 -0.0658 -0.1964 0.0545 191 CYS A CB 2435 S SG . CYS A 162 ? 0.6657 0.3028 0.5298 -0.0624 -0.1985 0.0549 191 CYS A SG 2440 N N . THR A 163 ? 0.6076 0.2485 0.4619 -0.0657 -0.1923 0.0540 192 THR A N 2441 C CA . THR A 163 ? 0.6140 0.2501 0.4578 -0.0680 -0.1888 0.0529 192 THR A CA 2442 C C . THR A 163 ? 0.6088 0.2479 0.4563 -0.0672 -0.1914 0.0543 192 THR A C 2443 O O . THR A 163 ? 0.6070 0.2494 0.4626 -0.0680 -0.1979 0.0580 192 THR A O 2444 C CB . THR A 163 ? 0.6413 0.2657 0.4675 -0.0747 -0.1894 0.0542 192 THR A CB 2445 O OG1 . THR A 163 ? 0.6558 0.2718 0.4690 -0.0762 -0.1837 0.0528 192 THR A OG1 2446 C CG2 . THR A 163 ? 0.6563 0.2780 0.4788 -0.0793 -0.1991 0.0582 192 THR A CG2 2454 N N . GLY A 164 ? 0.5480 0.1859 0.3914 -0.0658 -0.1864 0.0520 193 GLY A N 2455 C CA . GLY A 164 ? 0.5462 0.1866 0.3926 -0.0654 -0.1888 0.0533 193 GLY A CA 2456 C C . GLY A 164 ? 0.5317 0.1829 0.3971 -0.0591 -0.1879 0.0537 193 GLY A C 2457 O O . GLY A 164 ? 0.5289 0.1835 0.4005 -0.0583 -0.1894 0.0555 193 GLY A O 2461 N N . GLY A 165 ? 0.5415 0.1961 0.4144 -0.0549 -0.1851 0.0522 194 GLY A N 2462 C CA . GLY A 165 ? 0.5821 0.2423 0.4683 -0.0482 -0.1817 0.0522 194 GLY A CA 2463 C C . GLY A 165 ? 0.5696 0.2319 0.4554 -0.0446 -0.1765 0.0490 194 GLY A C 2464 O O . GLY A 165 ? 0.5262 0.1863 0.4041 -0.0454 -0.1738 0.0457 194 GLY A O 2468 N N . GLU A 166 ? 0.6325 0.2989 0.5283 -0.0407 -0.1747 0.0509 195 GLU A N 2469 C CA . GLU A 166 ? 0.6323 0.3007 0.5280 -0.0375 -0.1703 0.0484 195 GLU A CA 2470 C C . GLU A 166 ? 0.6307 0.2993 0.5314 -0.0302 -0.1642 0.0468 195 GLU A C 2471 O O . GLU A 166 ? 0.6597 0.3270 0.5675 -0.0263 -0.1618 0.0495 195 GLU A O 2472 C CB . GLU A 166 ? 0.6428 0.3142 0.5437 -0.0393 -0.1729 0.0521 195 GLU A CB 2473 C CG . GLU A 166 ? 0.6650 0.3411 0.5831 -0.0365 -0.1732 0.0584 195 GLU A CG 2474 C CD . GLU A 166 ? 0.6934 0.3734 0.6189 -0.0391 -0.1771 0.0631 195 GLU A CD 2475 O OE1 . GLU A 166 ? 0.7050 0.3905 0.6485 -0.0361 -0.1758 0.0697 195 GLU A OE1 2476 O OE2 . GLU A 166 ? 0.7023 0.3792 0.6157 -0.0440 -0.1808 0.0609 195 GLU A OE2 2483 N N . VAL A 167 ? 0.4934 0.1617 0.3891 -0.0282 -0.1611 0.0427 196 VAL A N 2484 C CA . VAL A 167 ? 0.4938 0.1597 0.3898 -0.0218 -0.1558 0.0410 196 VAL A CA 2485 C C . VAL A 167 ? 0.4885 0.1580 0.3883 -0.0194 -0.1528 0.0412 196 VAL A C 2486 O O . VAL A 167 ? 0.4846 0.1571 0.3821 -0.0228 -0.1548 0.0401 196 VAL A O 2487 C CB . VAL A 167 ? 0.4971 0.1585 0.3835 -0.0222 -0.1568 0.0368 196 VAL A CB 2488 C CG1 . VAL A 167 ? 0.5027 0.1579 0.3845 -0.0165 -0.1526 0.0349 196 VAL A CG1 2489 C CG2 . VAL A 167 ? 0.5029 0.1607 0.3856 -0.0252 -0.1606 0.0370 196 VAL A CG2 2499 N N . ILE A 168 ? 0.4903 0.1582 0.3953 -0.0132 -0.1468 0.0430 197 ILE A N 2500 C CA . ILE A 168 ? 0.4856 0.1574 0.3963 -0.0107 -0.1435 0.0444 197 ILE A CA 2501 C C . ILE A 168 ? 0.4907 0.1563 0.3977 -0.0036 -0.1358 0.0431 197 ILE A C 2502 O O . ILE A 168 ? 0.5006 0.1576 0.4040 0.0010 -0.1309 0.0436 197 ILE A O 2503 C CB . ILE A 168 ? 0.4842 0.1614 0.4099 -0.0110 -0.1439 0.0518 197 ILE A CB 2504 C CG1 . ILE A 168 ? 0.4833 0.1638 0.4082 -0.0194 -0.1531 0.0530 197 ILE A CG1 2505 C CG2 . ILE A 168 ? 0.4802 0.1614 0.4130 -0.0083 -0.1405 0.0542 197 ILE A CG2 2506 C CD1 . ILE A 168 ? 0.4845 0.1700 0.4239 -0.0218 -0.1571 0.0611 197 ILE A CD1 2518 N N . PHE A 169 ? 0.4864 0.1543 0.3922 -0.0026 -0.1346 0.0413 198 PHE A N 2519 C CA . PHE A 169 ? 0.4925 0.1540 0.3945 0.0039 -0.1271 0.0409 198 PHE A CA 2520 C C . PHE A 169 ? 0.7695 0.4377 0.6802 0.0051 -0.1248 0.0433 198 PHE A C 2521 O O . PHE A 169 ? 0.4769 0.1520 0.3886 0.0002 -0.1305 0.0418 198 PHE A O 2522 C CB . PHE A 169 ? 0.4982 0.1527 0.3845 0.0032 -0.1296 0.0348 198 PHE A CB 2523 C CG . PHE A 169 ? 0.5059 0.1529 0.3850 0.0085 -0.1237 0.0338 198 PHE A CG 2524 C CD1 . PHE A 169 ? 0.5222 0.1556 0.3935 0.0148 -0.1156 0.0350 198 PHE A CD1 2525 C CD2 . PHE A 169 ? 0.4993 0.1510 0.3782 0.0074 -0.1256 0.0319 198 PHE A CD2 2526 C CE1 . PHE A 169 ? 0.5328 0.1567 0.3946 0.0196 -0.1096 0.0342 198 PHE A CE1 2527 C CE2 . PHE A 169 ? 0.5076 0.1517 0.3788 0.0119 -0.1206 0.0311 198 PHE A CE2 2528 C CZ . PHE A 169 ? 0.5250 0.1547 0.3867 0.0178 -0.1127 0.0321 198 PHE A CZ 2538 N N . ARG A 170 ? 0.8526 0.5173 0.7691 0.0121 -0.1157 0.0478 199 ARG A N 2539 C CA . ARG A 170 ? 0.8687 0.5394 0.7946 0.0137 -0.1130 0.0512 199 ARG A CA 2540 C C . ARG A 170 ? 0.8921 0.5543 0.8090 0.0199 -0.1052 0.0492 199 ARG A C 2541 O O . ARG A 170 ? 0.8874 0.5391 0.8018 0.0269 -0.0953 0.0519 199 ARG A O 2542 C CB . ARG A 170 ? 0.8770 0.5530 0.8225 0.0163 -0.1089 0.0613 199 ARG A CB 2543 C CG . ARG A 170 ? 0.8618 0.5446 0.8152 0.0095 -0.1180 0.0641 199 ARG A CG 2544 C CD . ARG A 170 ? 0.8375 0.5255 0.8120 0.0121 -0.1147 0.0756 199 ARG A CD 2545 N NE . ARG A 170 ? 0.8185 0.5117 0.7997 0.0050 -0.1245 0.0785 199 ARG A NE 2546 C CZ . ARG A 170 ? 0.8310 0.5306 0.8320 0.0047 -0.1257 0.0889 199 ARG A CZ 2547 N NH1 . ARG A 170 ? 0.8445 0.5465 0.8617 0.0120 -0.1164 0.0981 199 ARG A NH1 2548 N NH2 . ARG A 170 ? 0.8349 0.5383 0.8398 -0.0029 -0.1362 0.0909 199 ARG A NH2 2562 N N . ALA A 171 ? 0.6925 0.3578 0.6037 0.0172 -0.1092 0.0448 200 ALA A N 2563 C CA . ALA A 171 ? 0.7260 0.3834 0.6277 0.0219 -0.1036 0.0428 200 ALA A CA 2564 C C . ALA A 171 ? 0.7740 0.4318 0.6883 0.0285 -0.0932 0.0504 200 ALA A C 2565 O O . ALA A 171 ? 0.7864 0.4327 0.6942 0.0352 -0.0836 0.0516 200 ALA A O 2566 C CB . ALA A 171 ? 0.6975 0.3597 0.5933 0.0174 -0.1108 0.0376 200 ALA A CB 2572 N N . LEU A 172 ? 0.7810 0.4507 0.7128 0.0263 -0.0955 0.0562 201 LEU A N 2573 C CA . LEU A 172 ? 0.8339 0.5059 0.7818 0.0321 -0.0865 0.0658 201 LEU A CA 2574 C C . LEU A 172 ? 0.8361 0.5019 0.7930 0.0394 -0.0755 0.0739 201 LEU A C 2575 O O . LEU A 172 ? 0.8250 0.4983 0.7994 0.0393 -0.0756 0.0827 201 LEU A O 2576 C CB . LEU A 172 ? 0.8767 0.5627 0.8396 0.0258 -0.0950 0.0702 201 LEU A CB 2577 C CG . LEU A 172 ? 0.9101 0.6007 0.8689 0.0219 -0.1004 0.0662 201 LEU A CG 2578 C CD1 . LEU A 172 ? 0.9263 0.6131 0.8876 0.0293 -0.0899 0.0700 201 LEU A CD1 2579 C CD2 . LEU A 172 ? 0.9217 0.6091 0.8621 0.0177 -0.1069 0.0553 201 LEU A CD2 2591 N N . SER A 173 ? 1.2806 0.9315 1.2244 0.0452 -0.0669 0.0712 202 SER A N 2592 C CA . SER A 173 ? 1.2948 0.9366 1.2464 0.0535 -0.0538 0.0791 202 SER A CA 2593 C C . SER A 173 ? 1.3019 0.9431 1.2713 0.0630 -0.0387 0.0914 202 SER A C 2594 O O . SER A 173 ? 1.2538 0.8991 1.2243 0.0627 -0.0390 0.0915 202 SER A O 2595 C CB . SER A 173 ? 1.3129 0.9364 1.2422 0.0557 -0.0508 0.0717 202 SER A CB 2596 O OG . SER A 173 ? 1.3127 0.9362 1.2270 0.0481 -0.0631 0.0630 202 SER A OG 2602 N N . PRO A 174 ? 1.4784 1.1134 1.4610 0.0721 -0.0244 0.1025 203 PRO A N 2603 C CA . PRO A 174 ? 1.5013 1.1328 1.4834 0.0823 -0.0094 0.1109 203 PRO A CA 2604 C C . PRO A 174 ? 1.4908 1.1358 1.5089 0.0771 -0.0181 0.1111 203 PRO A C 2605 O O . PRO A 174 ? 1.5255 1.1402 1.4915 0.0798 -0.0394 0.1043 203 PRO A O 2606 C CB . PRO A 174 ? 1.5364 1.1400 1.4976 0.0814 -0.0397 0.1046 203 PRO A CB 2607 C CG . PRO A 174 ? 1.5027 1.1362 1.5082 0.0809 -0.0087 0.1128 203 PRO A CG 2608 C CD . PRO A 174 ? 1.4870 1.1184 1.4701 0.0727 -0.0242 0.1042 203 PRO A CD 2616 N N . PRO A 175 ? 1.1481 0.7674 1.1342 0.0783 -0.0201 0.1005 204 PRO A N 2617 C CA . PRO A 175 ? 1.0923 0.6996 1.0575 0.0810 -0.0172 0.0951 204 PRO A CA 2618 C C . PRO A 175 ? 1.0546 0.6749 1.0202 0.0759 -0.0211 0.0926 204 PRO A C 2619 O O . PRO A 175 ? 1.0079 0.6254 0.9725 0.0782 -0.0190 0.0936 204 PRO A O 2620 C CB . PRO A 175 ? 1.0801 0.6631 1.0002 0.0819 -0.0136 0.0821 204 PRO A CB 2621 C CG . PRO A 175 ? 1.0888 0.6682 1.0105 0.0822 -0.0137 0.0828 204 PRO A CG 2622 C CD . PRO A 175 ? 1.1010 0.7054 1.0578 0.0773 -0.0204 0.0905 204 PRO A CD 2630 N N . TYR A 176 ? 0.9947 0.6252 0.9531 0.0689 -0.0294 0.0873 205 TYR A N 2631 C CA . TYR A 176 ? 1.0680 0.7057 1.0149 0.0623 -0.0396 0.0799 205 TYR A CA 2632 C C . TYR A 176 ? 1.0058 0.6603 0.9704 0.0594 -0.0439 0.0863 205 TYR A C 2633 O O . TYR A 176 ? 0.9924 0.6533 0.9530 0.0545 -0.0517 0.0819 205 TYR A O 2634 C CB . TYR A 176 ? 1.1871 0.8234 1.1112 0.0539 -0.0537 0.0670 205 TYR A CB 2635 C CG . TYR A 176 ? 1.3335 0.9503 1.2301 0.0553 -0.0527 0.0591 205 TYR A CG 2636 C CD1 . TYR A 176 ? 1.4052 1.0094 1.2808 0.0565 -0.0515 0.0541 205 TYR A CD1 2637 C CD2 . TYR A 176 ? 1.4035 1.0125 1.2915 0.0547 -0.0538 0.0568 205 TYR A CD2 2638 C CE1 . TYR A 176 ? 1.4759 1.0588 1.3200 0.0567 -0.0520 0.0472 205 TYR A CE1 2639 C CE2 . TYR A 176 ? 1.4731 1.0615 1.3311 0.0551 -0.0540 0.0498 205 TYR A CE2 2640 C CZ . TYR A 176 ? 1.5168 1.0915 1.3518 0.0559 -0.0534 0.0451 205 TYR A CZ 2641 O OH . TYR A 176 ? 1.5791 1.1304 1.3797 0.0553 -0.0551 0.0387 205 TYR A OH 2651 N N . ASP A 177 ? 1.2643 0.9239 1.2439 0.0615 -0.0412 0.0958 206 ASP A N 2652 C CA . ASP A 177 ? 1.2484 0.9235 1.2421 0.0553 -0.0519 0.1005 206 ASP A CA 2653 C C . ASP A 177 ? 1.2470 0.9210 1.2472 0.0612 -0.0444 0.1086 206 ASP A C 2654 O O . ASP A 177 ? 1.2250 0.9124 1.2354 0.0542 -0.0545 0.1094 206 ASP A O 2655 C CB . ASP A 177 ? 1.2688 0.9519 1.2777 0.0525 -0.0576 0.1072 206 ASP A CB 2656 C CG . ASP A 177 ? 1.3104 0.9799 1.3195 0.0641 -0.0433 0.1155 206 ASP A CG 2657 O OD1 . ASP A 177 ? 1.3344 0.9885 1.3335 0.0741 -0.0320 0.1188 206 ASP A OD1 2658 O OD2 . ASP A 177 ? 1.3148 0.9860 1.3300 0.0630 -0.0459 0.1177 206 ASP A OD2 2663 N N . ILE A 178 ? 1.3352 0.9892 1.3241 0.0739 -0.0285 0.1136 207 ILE A N 2664 C CA . ILE A 178 ? 1.3253 0.9720 1.3114 0.0790 -0.0264 0.1179 207 ILE A CA 2665 C C . ILE A 178 ? 1.2995 0.9446 1.2728 0.0800 -0.0164 0.1102 207 ILE A C 2666 O O . ILE A 178 ? 1.3057 0.9589 1.2909 0.0735 -0.0203 0.1048 207 ILE A O 2667 C CB . ILE A 178 ? 1.1268 0.7649 1.1232 0.0856 -0.0244 0.1248 207 ILE A CB 2668 C CG1 . ILE A 178 ? 1.1140 0.7745 1.1472 0.0862 -0.0188 0.1382 207 ILE A CG1 2669 C CG2 . ILE A 178 ? 1.1414 0.7617 1.1285 0.0888 -0.0238 0.1185 207 ILE A CG2 2670 C CD1 . ILE A 178 ? 1.1211 0.7905 1.1847 0.0933 -0.0049 0.1511 207 ILE A CD1 2682 N N . GLU A 179 ? 1.1522 0.7858 1.1119 0.0822 -0.0219 0.1092 208 GLU A N 2683 C CA . GLU A 179 ? 1.0679 0.7326 1.0784 0.0762 -0.0136 0.1122 208 GLU A CA 2684 C C . GLU A 179 ? 1.0441 0.7030 1.0273 0.0720 -0.0224 0.1047 208 GLU A C 2685 O O . GLU A 179 ? 1.0733 0.7422 1.0572 0.0645 -0.0359 0.1019 208 GLU A O 2686 C CB . GLU A 179 ? 1.0705 0.7092 1.0554 0.0765 -0.0207 0.1015 208 GLU A CB 2687 C CG . GLU A 179 ? 1.0972 0.7163 1.0692 0.0837 -0.0154 0.1021 208 GLU A CG 2688 C CD . GLU A 179 ? 1.1233 0.7203 1.0543 0.0866 -0.0060 0.0905 208 GLU A CD 2689 O OE1 . GLU A 179 ? 1.1149 0.7108 1.0260 0.0806 -0.0131 0.0804 208 GLU A OE1 2690 O OE2 . GLU A 179 ? 1.1484 0.7261 1.0613 0.0947 0.0077 0.0911 208 GLU A OE2 2697 N N . ASN A 180 ? 0.7643 0.4227 0.7421 0.0695 -0.0260 0.0989 209 ASN A N 2698 C CA . ASN A 180 ? 0.7314 0.3973 0.6970 0.0607 -0.0409 0.0892 209 ASN A CA 2699 C C . ASN A 180 ? 0.6953 0.3610 0.6443 0.0536 -0.0533 0.0768 209 ASN A C 2700 O O . ASN A 180 ? 0.7142 0.3678 0.6451 0.0548 -0.0522 0.0700 209 ASN A O 2701 C CB . ASN A 180 ? 0.7551 0.4154 0.7117 0.0620 -0.0390 0.0861 209 ASN A CB 2702 C CG . ASN A 180 ? 0.7611 0.4279 0.7061 0.0539 -0.0530 0.0764 209 ASN A CG 2703 O OD1 . ASN A 180 ? 0.7560 0.4338 0.7060 0.0470 -0.0638 0.0743 209 ASN A OD1 2704 N ND2 . ASN A 180 ? 0.7716 0.4306 0.7012 0.0544 -0.0533 0.0708 209 ASN A ND2 2711 N N . PRO A 181 ? 0.6201 0.2979 0.5736 0.0455 -0.0659 0.0741 210 PRO A N 2712 C CA . PRO A 181 ? 0.5948 0.2724 0.5352 0.0396 -0.0759 0.0642 210 PRO A CA 2713 C C . PRO A 181 ? 0.5848 0.2572 0.5059 0.0371 -0.0814 0.0542 210 PRO A C 2714 O O . PRO A 181 ? 0.5830 0.2529 0.4927 0.0338 -0.0876 0.0474 210 PRO A O 2715 C CB . PRO A 181 ? 0.5748 0.2651 0.5257 0.0317 -0.0870 0.0651 210 PRO A CB 2716 C CG . PRO A 181 ? 0.5710 0.2676 0.5341 0.0313 -0.0868 0.0717 210 PRO A CG 2717 C CD . PRO A 181 ? 0.5924 0.2830 0.5627 0.0409 -0.0723 0.0804 210 PRO A CD 2725 N N . TYR A 182 ? 0.6800 0.3512 0.5987 0.0387 -0.0794 0.0543 211 TYR A N 2726 C CA . TYR A 182 ? 0.6588 0.3263 0.5616 0.0361 -0.0855 0.0463 211 TYR A CA 2727 C C . TYR A 182 ? 0.6342 0.2857 0.5192 0.0407 -0.0798 0.0443 211 TYR A C 2728 O O . TYR A 182 ? 0.6357 0.2823 0.5064 0.0385 -0.0854 0.0388 211 TYR A O 2729 C CB . TYR A 182 ? 0.6605 0.3362 0.5698 0.0335 -0.0893 0.0468 211 TYR A CB 2730 C CG . TYR A 182 ? 0.6602 0.3474 0.5814 0.0278 -0.0961 0.0482 211 TYR A CG 2731 C CD1 . TYR A 182 ? 0.6565 0.3464 0.5728 0.0226 -0.1041 0.0425 211 TYR A CD1 2732 C CD2 . TYR A 182 ? 0.6661 0.3595 0.6023 0.0274 -0.0948 0.0559 211 TYR A CD2 2733 C CE1 . TYR A 182 ? 0.6560 0.3520 0.5785 0.0172 -0.1099 0.0436 211 TYR A CE1 2734 C CE2 . TYR A 182 ? 0.6651 0.3655 0.6079 0.0208 -0.1031 0.0570 211 TYR A CE2 2735 C CZ . TYR A 182 ? 0.6631 0.3634 0.5972 0.0158 -0.1103 0.0504 211 TYR A CZ 2736 O OH . TYR A 182 ? 0.6708 0.3740 0.6071 0.0092 -0.1179 0.0514 211 TYR A OH 2746 N N . SER A 183 ? 0.7960 0.4381 0.6814 0.0470 -0.0687 0.0494 212 SER A N 2747 C CA . SER A 183 ? 0.8258 0.4480 0.6890 0.0512 -0.0627 0.0473 212 SER A CA 2748 C C . SER A 183 ? 0.8426 0.4540 0.6821 0.0471 -0.0715 0.0391 212 SER A C 2749 O O . SER A 183 ? 0.8464 0.4665 0.6910 0.0424 -0.0796 0.0365 212 SER A O 2750 C CB . SER A 183 ? 0.8440 0.4574 0.7134 0.0591 -0.0483 0.0549 212 SER A CB 2751 O OG . SER A 183 ? 0.8403 0.4558 0.7166 0.0590 -0.0479 0.0562 212 SER A OG 2757 N N . ALA A 184 ? 0.7251 0.3162 0.5377 0.0485 -0.0704 0.0358 213 ALA A N 2758 C CA . ALA A 184 ? 0.7394 0.3174 0.5275 0.0437 -0.0805 0.0296 213 ALA A CA 2759 C C . ALA A 184 ? 0.7491 0.3219 0.5344 0.0443 -0.0787 0.0294 213 ALA A C 2760 O O . ALA A 184 ? 0.7266 0.3000 0.5061 0.0387 -0.0896 0.0257 213 ALA A O 2761 C CB . ALA A 184 ? 0.7768 0.3295 0.5324 0.0450 -0.0795 0.0272 213 ALA A CB 2767 N N . LYS A 185 ? 0.8427 0.4109 0.6344 0.0514 -0.0647 0.0344 214 LYS A N 2768 C CA . LYS A 185 ? 0.8850 0.4466 0.6740 0.0530 -0.0612 0.0350 214 LYS A CA 2769 C C . LYS A 185 ? 0.8712 0.4544 0.6844 0.0485 -0.0685 0.0356 214 LYS A C 2770 O O . LYS A 185 ? 0.8511 0.4305 0.6571 0.0457 -0.0735 0.0329 214 LYS A O 2771 C CB . LYS A 185 ? 0.9171 0.4706 0.7127 0.0624 -0.0435 0.0420 214 LYS A CB 2772 C CG . LYS A 185 ? 0.9579 0.4990 0.7451 0.0653 -0.0381 0.0424 214 LYS A CG 2773 C CD . LYS A 185 ? 1.0097 0.5418 0.8039 0.0755 -0.0197 0.0502 214 LYS A CD 2774 C CE . LYS A 185 ? 1.0651 0.5800 0.8444 0.0791 -0.0131 0.0498 214 LYS A CE 2775 N NZ . LYS A 185 ? 1.0625 0.5950 0.8649 0.0750 -0.0210 0.0509 214 LYS A NZ 2789 N N . VAL A 186 ? 0.7143 0.3183 0.5536 0.0474 -0.0695 0.0393 215 VAL A N 2790 C CA . VAL A 186 ? 0.7294 0.3515 0.5883 0.0430 -0.0759 0.0402 215 VAL A CA 2791 C C . VAL A 186 ? 0.7448 0.3739 0.5981 0.0351 -0.0901 0.0336 215 VAL A C 2792 O O . VAL A 186 ? 0.7758 0.4109 0.6330 0.0311 -0.0963 0.0320 215 VAL A O 2793 C CB . VAL A 186 ? 0.7156 0.3540 0.6009 0.0442 -0.0723 0.0474 215 VAL A CB 2794 C CG1 . VAL A 186 ? 0.7017 0.3549 0.6011 0.0386 -0.0803 0.0477 215 VAL A CG1 2795 C CG2 . VAL A 186 ? 0.7257 0.3593 0.6236 0.0524 -0.0577 0.0569 215 VAL A CG2 2805 N N . GLN A 187 ? 0.7968 0.4252 0.6428 0.0332 -0.0948 0.0308 216 GLN A N 2806 C CA . GLN A 187 ? 0.7463 0.3813 0.5910 0.0267 -0.1071 0.0265 216 GLN A CA 2807 C C . GLN A 187 ? 0.7178 0.3427 0.5477 0.0235 -0.1141 0.0235 216 GLN A C 2808 O O . GLN A 187 ? 0.6927 0.3259 0.5293 0.0186 -0.1222 0.0223 216 GLN A O 2809 C CB . GLN A 187 ? 0.7353 0.3687 0.5742 0.0259 -0.1104 0.0251 216 GLN A CB 2810 C CG . GLN A 187 ? 0.7116 0.3583 0.5669 0.0268 -0.1075 0.0274 216 GLN A CG 2811 C CD . GLN A 187 ? 0.7022 0.3497 0.5541 0.0249 -0.1129 0.0256 216 GLN A CD 2812 O OE1 . GLN A 187 ? 0.7017 0.3439 0.5444 0.0216 -0.1210 0.0232 216 GLN A OE1 2813 N NE2 . GLN A 187 ? 0.6937 0.3477 0.5544 0.0266 -0.1090 0.0276 216 GLN A NE2 2822 N N . GLU A 188 ? 0.9528 0.5580 0.7617 0.0263 -0.1105 0.0228 217 GLU A N 2823 C CA . GLU A 188 ? 0.9919 0.5834 0.7827 0.0231 -0.1173 0.0204 217 GLU A CA 2824 C C . GLU A 188 ? 0.9763 0.5769 0.7795 0.0218 -0.1177 0.0211 217 GLU A C 2825 O O . GLU A 188 ? 0.9747 0.5749 0.7745 0.0165 -0.1275 0.0196 217 GLU A O 2826 C CB . GLU A 188 ? 1.0402 0.6056 0.8033 0.0277 -0.1101 0.0199 217 GLU A CB 2827 C CG . GLU A 188 ? 1.0716 0.6204 0.8155 0.0262 -0.1128 0.0183 217 GLU A CG 2828 C CD . GLU A 188 ? 1.0910 0.6363 0.8246 0.0176 -0.1304 0.0162 217 GLU A CD 2829 O OE1 . GLU A 188 ? 1.1057 0.6400 0.8263 0.0150 -0.1351 0.0153 217 GLU A OE1 2830 O OE2 . GLU A 188 ? 1.0925 0.6458 0.8323 0.0133 -0.1398 0.0163 217 GLU A OE2 2837 N N . GLN A 189 ? 0.6836 0.2924 0.5026 0.0262 -0.1078 0.0243 218 GLN A N 2838 C CA . GLN A 189 ? 0.6802 0.2961 0.5103 0.0253 -0.1075 0.0257 218 GLN A CA 2839 C C . GLN A 189 ? 0.6065 0.2421 0.4555 0.0202 -0.1144 0.0257 218 GLN A C 2840 O O . GLN A 189 ? 0.6185 0.2579 0.4697 0.0161 -0.1204 0.0247 218 GLN A O 2841 C CB . GLN A 189 ? 0.7401 0.3545 0.5799 0.0321 -0.0944 0.0309 218 GLN A CB 2842 C CG . GLN A 189 ? 0.7931 0.4077 0.6382 0.0322 -0.0932 0.0326 218 GLN A CG 2843 C CD . GLN A 189 ? 0.8633 0.4587 0.6845 0.0319 -0.0950 0.0290 218 GLN A CD 2844 O OE1 . GLN A 189 ? 0.9000 0.4780 0.6983 0.0330 -0.0946 0.0264 218 GLN A OE1 2845 N NE2 . GLN A 189 ? 0.8796 0.4764 0.7036 0.0299 -0.0977 0.0291 218 GLN A NE2 2854 N N . LEU A 190 ? 0.5022 0.1485 0.3630 0.0204 -0.1131 0.0271 219 LEU A N 2855 C CA . LEU A 190 ? 0.4842 0.1456 0.3598 0.0162 -0.1176 0.0276 219 LEU A CA 2856 C C . LEU A 190 ? 0.4791 0.1446 0.3538 0.0116 -0.1256 0.0247 219 LEU A C 2857 O O . LEU A 190 ? 0.4721 0.1436 0.3526 0.0078 -0.1298 0.0244 219 LEU A O 2858 C CB . LEU A 190 ? 0.4756 0.1447 0.3635 0.0181 -0.1128 0.0313 219 LEU A CB 2859 C CG . LEU A 190 ? 0.4790 0.1469 0.3756 0.0227 -0.1045 0.0372 219 LEU A CG 2860 C CD1 . LEU A 190 ? 0.4698 0.1472 0.3811 0.0224 -0.1034 0.0421 219 LEU A CD1 2861 C CD2 . LEU A 190 ? 0.4795 0.1476 0.3799 0.0216 -0.1053 0.0388 219 LEU A CD2 2873 N N . LYS A 191 ? 0.6497 0.3113 0.5182 0.0123 -0.1270 0.0235 220 LYS A N 2874 C CA . LYS A 191 ? 0.6442 0.3107 0.5167 0.0088 -0.1336 0.0227 220 LYS A CA 2875 C C . LYS A 191 ? 0.6065 0.2699 0.4765 0.0048 -0.1413 0.0224 220 LYS A C 2876 O O . LYS A 191 ? 0.6212 0.2733 0.4781 0.0043 -0.1447 0.0217 220 LYS A O 2877 C CB . LYS A 191 ? 0.6732 0.3353 0.5399 0.0102 -0.1343 0.0223 220 LYS A CB 2878 C CG . LYS A 191 ? 0.6711 0.3398 0.5468 0.0076 -0.1393 0.0228 220 LYS A CG 2879 C CD . LYS A 191 ? 0.6818 0.3481 0.5541 0.0093 -0.1392 0.0228 220 LYS A CD 2880 C CE . LYS A 191 ? 0.7227 0.3751 0.5786 0.0086 -0.1448 0.0223 220 LYS A CE 2881 N NZ . LYS A 191 ? 0.7501 0.3997 0.6025 0.0094 -0.1460 0.0226 220 LYS A NZ 2895 N N . ILE A 192 ? 0.5282 0.1998 0.4101 0.0017 -0.1437 0.0235 221 ILE A N 2896 C CA . ILE A 192 ? 0.4837 0.1543 0.3684 -0.0024 -0.1507 0.0250 221 ILE A CA 2897 C C . ILE A 192 ? 0.4770 0.1548 0.3770 -0.0043 -0.1520 0.0280 221 ILE A C 2898 O O . ILE A 192 ? 0.4692 0.1520 0.3753 -0.0024 -0.1460 0.0280 221 ILE A O 2899 C CB . ILE A 192 ? 0.8474 0.5187 0.7324 -0.0036 -0.1496 0.0248 221 ILE A CB 2900 C CG1 . ILE A 192 ? 0.4710 0.1500 0.3645 -0.0033 -0.1436 0.0251 221 ILE A CG1 2901 C CG2 . ILE A 192 ? 0.8514 0.5143 0.7233 -0.0011 -0.1472 0.0231 221 ILE A CG2 2902 C CD1 . ILE A 192 ? 0.4704 0.1500 0.3655 -0.0058 -0.1440 0.0257 221 ILE A CD1 2914 N N . THR A 193 ? 0.5206 0.1974 0.4268 -0.0081 -0.1596 0.0313 222 THR A N 2915 C CA . THR A 193 ? 0.5161 0.1993 0.4411 -0.0095 -0.1594 0.0363 222 THR A CA 2916 C C . THR A 193 ? 0.5161 0.2008 0.4487 -0.0124 -0.1598 0.0391 222 THR A C 2917 O O . THR A 193 ? 0.5129 0.2014 0.4599 -0.0123 -0.1547 0.0433 222 THR A O 2918 C CB . THR A 193 ? 0.5226 0.2055 0.4558 -0.0121 -0.1685 0.0410 222 THR A CB 2919 O OG1 . THR A 193 ? 0.5354 0.2106 0.4587 -0.0166 -0.1800 0.0415 222 THR A OG1 2920 C CG2 . THR A 193 ? 0.5222 0.2040 0.4498 -0.0091 -0.1668 0.0389 222 THR A CG2 2928 N N . ASN A 194 ? 0.5670 0.2470 0.4889 -0.0146 -0.1649 0.0372 223 ASN A N 2929 C CA . ASN A 194 ? 0.5676 0.2484 0.4947 -0.0176 -0.1658 0.0394 223 ASN A CA 2930 C C . ASN A 194 ? 0.5692 0.2456 0.4808 -0.0168 -0.1643 0.0346 223 ASN A C 2931 O O . ASN A 194 ? 0.5730 0.2442 0.4706 -0.0143 -0.1639 0.0308 223 ASN A O 2932 C CB . ASN A 194 ? 0.5764 0.2562 0.5121 -0.0231 -0.1775 0.0451 223 ASN A CB 2933 C CG . ASN A 194 ? 0.5764 0.2612 0.5301 -0.0242 -0.1810 0.0516 223 ASN A CG 2934 O OD1 . ASN A 194 ? 0.5732 0.2650 0.5491 -0.0253 -0.1786 0.0589 223 ASN A OD1 2935 N ND2 . ASN A 194 ? 0.5812 0.2623 0.5265 -0.0238 -0.1859 0.0498 223 ASN A ND2 2942 N N . LEU A 195 ? 0.4797 0.1575 0.3949 -0.0187 -0.1627 0.0357 224 LEU A N 2943 C CA . LEU A 195 ? 0.4818 0.1559 0.3855 -0.0184 -0.1621 0.0325 224 LEU A CA 2944 C C . LEU A 195 ? 0.4858 0.1594 0.3944 -0.0228 -0.1666 0.0356 224 LEU A C 2945 O O . LEU A 195 ? 0.4821 0.1597 0.4025 -0.0244 -0.1631 0.0389 224 LEU A O 2946 C CB . LEU A 195 ? 0.4741 0.1511 0.3757 -0.0157 -0.1535 0.0301 224 LEU A CB 2947 C CG . LEU A 195 ? 0.4758 0.1500 0.3685 -0.0147 -0.1525 0.0280 224 LEU A CG 2948 C CD1 . LEU A 195 ? 0.4815 0.1502 0.3644 -0.0111 -0.1523 0.0259 224 LEU A CD1 2949 C CD2 . LEU A 195 ? 0.4698 0.1473 0.3639 -0.0142 -0.1471 0.0278 224 LEU A CD2 2961 N N . ARG A 196 ? 0.5485 0.2153 0.4469 -0.0247 -0.1736 0.0347 225 ARG A N 2962 C CA . ARG A 196 ? 0.5543 0.2199 0.4571 -0.0297 -0.1802 0.0383 225 ARG A CA 2963 C C . ARG A 196 ? 0.5594 0.2192 0.4493 -0.0294 -0.1801 0.0353 225 ARG A C 2964 O O . ARG A 196 ? 0.5676 0.2188 0.4415 -0.0267 -0.1801 0.0317 225 ARG A O 2965 C CB . ARG A 196 ? 0.5661 0.2273 0.4700 -0.0343 -0.1926 0.0421 225 ARG A CB 2966 C CG . ARG A 196 ? 0.5752 0.2339 0.4821 -0.0404 -0.2021 0.0463 225 ARG A CG 2967 C CD . ARG A 196 ? 0.5899 0.2431 0.4968 -0.0462 -0.2169 0.0510 225 ARG A CD 2968 N NE . ARG A 196 ? 0.6065 0.2439 0.4857 -0.0448 -0.2215 0.0458 225 ARG A NE 2969 C CZ . ARG A 196 ? 0.6253 0.2522 0.4949 -0.0498 -0.2352 0.0484 225 ARG A CZ 2970 N NH1 . ARG A 196 ? 0.6274 0.2610 0.5174 -0.0571 -0.2471 0.0569 225 ARG A NH1 2971 N NH2 . ARG A 196 ? 0.6443 0.2530 0.4840 -0.0478 -0.2368 0.0433 225 ARG A NH2 2985 N N . VAL A 197 ? 0.6075 0.2707 0.5044 -0.0319 -0.1790 0.0373 226 VAL A N 2986 C CA . VAL A 197 ? 0.6127 0.2711 0.5002 -0.0325 -0.1801 0.0357 226 VAL A CA 2987 C C . VAL A 197 ? 0.6222 0.2777 0.5127 -0.0384 -0.1898 0.0398 226 VAL A C 2988 O O . VAL A 197 ? 0.6186 0.2805 0.5258 -0.0421 -0.1912 0.0451 226 VAL A O 2989 C CB . VAL A 197 ? 0.6038 0.2672 0.4952 -0.0316 -0.1724 0.0352 226 VAL A CB 2990 C CG1 . VAL A 197 ? 0.6094 0.2685 0.4939 -0.0330 -0.1745 0.0347 226 VAL A CG1 2991 C CG2 . VAL A 197 ? 0.5967 0.2624 0.4850 -0.0269 -0.1651 0.0322 226 VAL A CG2 3001 N N . ARG A 198 ? 0.6705 0.3151 0.5453 -0.0393 -0.1961 0.0381 227 ARG A N 3002 C CA . ARG A 198 ? 0.6824 0.3225 0.5574 -0.0457 -0.2072 0.0422 227 ARG A CA 3003 C C . ARG A 198 ? 0.6873 0.3223 0.5531 -0.0457 -0.2064 0.0405 227 ARG A C 3004 O O . ARG A 198 ? 0.6997 0.3223 0.5460 -0.0430 -0.2061 0.0366 227 ARG A O 3005 C CB . ARG A 198 ? 0.7016 0.3290 0.5621 -0.0482 -0.2185 0.0426 227 ARG A CB 3006 C CG . ARG A 198 ? 0.6988 0.3326 0.5738 -0.0511 -0.2242 0.0472 227 ARG A CG 3007 C CD . ARG A 198 ? 0.7219 0.3417 0.5822 -0.0562 -0.2393 0.0493 227 ARG A CD 3008 N NE . ARG A 198 ? 0.7343 0.3394 0.5685 -0.0513 -0.2363 0.0431 227 ARG A NE 3009 C CZ . ARG A 198 ? 0.7561 0.3412 0.5605 -0.0496 -0.2369 0.0388 227 ARG A CZ 3010 N NH1 . ARG A 198 ? 0.7680 0.3451 0.5632 -0.0525 -0.2416 0.0394 227 ARG A NH1 3011 N NH2 . ARG A 198 ? 0.7681 0.3397 0.5509 -0.0446 -0.2317 0.0342 227 ARG A NH2 3025 N N . LEU A 199 ? 0.5409 0.1842 0.4206 -0.0487 -0.2049 0.0437 228 LEU A N 3026 C CA . LEU A 199 ? 0.5449 0.1845 0.4182 -0.0495 -0.2048 0.0429 228 LEU A CA 3027 C C . LEU A 199 ? 0.5624 0.1928 0.4285 -0.0552 -0.2174 0.0458 228 LEU A C 3028 O O . LEU A 199 ? 0.5650 0.1993 0.4439 -0.0610 -0.2260 0.0518 228 LEU A O 3029 C CB . LEU A 199 ? 0.5332 0.1827 0.4214 -0.0512 -0.1987 0.0456 228 LEU A CB 3030 C CG . LEU A 199 ? 0.5200 0.1767 0.4152 -0.0475 -0.1882 0.0443 228 LEU A CG 3031 C CD1 . LEU A 199 ? 0.5158 0.1764 0.4196 -0.0498 -0.1822 0.0473 228 LEU A CD1 3032 C CD2 . LEU A 199 ? 0.5169 0.1713 0.4006 -0.0418 -0.1827 0.0389 228 LEU A CD2 3044 N N . LEU A 200 ? 0.6157 0.2335 0.4624 -0.0536 -0.2187 0.0424 229 LEU A N 3045 C CA . LEU A 200 ? 0.6334 0.2374 0.4659 -0.0586 -0.2313 0.0443 229 LEU A CA 3046 C C . LEU A 200 ? 0.6338 0.2365 0.4665 -0.0620 -0.2344 0.0462 229 LEU A C 3047 O O . LEU A 200 ? 0.6484 0.2451 0.4784 -0.0686 -0.2469 0.0505 229 LEU A O 3048 C CB . LEU A 200 ? 0.6564 0.2404 0.4603 -0.0542 -0.2305 0.0391 229 LEU A CB 3049 C CG . LEU A 200 ? 0.6571 0.2392 0.4567 -0.0508 -0.2278 0.0371 229 LEU A CG 3050 C CD1 . LEU A 200 ? 0.6820 0.2413 0.4512 -0.0459 -0.2244 0.0323 229 LEU A CD1 3051 C CD2 . LEU A 200 ? 0.6608 0.2463 0.4697 -0.0578 -0.2409 0.0426 229 LEU A CD2 3063 N N . LYS A 201 ? 0.7280 0.3362 0.5643 -0.0582 -0.2243 0.0437 230 LYS A N 3064 C CA . LYS A 201 ? 0.7320 0.3386 0.5676 -0.0610 -0.2266 0.0452 230 LYS A CA 3065 C C . LYS A 201 ? 0.7149 0.3323 0.5613 -0.0583 -0.2162 0.0442 230 LYS A C 3066 O O . LYS A 201 ? 0.7083 0.3263 0.5516 -0.0524 -0.2074 0.0405 230 LYS A O 3067 C CB . LYS A 201 ? 0.7542 0.3413 0.5648 -0.0591 -0.2292 0.0419 230 LYS A CB 3068 C CG . LYS A 201 ? 0.7609 0.3446 0.5690 -0.0622 -0.2327 0.0434 230 LYS A CG 3069 C CD . LYS A 201 ? 0.7886 0.3507 0.5705 -0.0588 -0.2323 0.0396 230 LYS A CD 3070 C CE . LYS A 201 ? 0.8011 0.3606 0.5818 -0.0608 -0.2338 0.0407 230 LYS A CE 3071 N NZ . LYS A 201 ? 0.8093 0.3708 0.5951 -0.0698 -0.2473 0.0463 230 LYS A NZ 3085 N N . ARG A 202 ? 0.5891 0.2137 0.4478 -0.0632 -0.2178 0.0485 231 ARG A N 3086 C CA . ARG A 202 ? 0.5779 0.2095 0.4430 -0.0622 -0.2097 0.0482 231 ARG A CA 3087 C C . ARG A 202 ? 0.5837 0.2081 0.4368 -0.0592 -0.2082 0.0451 231 ARG A C 3088 O O . ARG A 202 ? 0.5971 0.2099 0.4364 -0.0573 -0.2115 0.0429 231 ARG A O 3089 C CB . ARG A 202 ? 0.5759 0.2137 0.4548 -0.0684 -0.2110 0.0540 231 ARG A CB 3090 C CG . ARG A 202 ? 0.5783 0.2242 0.4738 -0.0701 -0.2076 0.0581 231 ARG A CG 3091 C CD . ARG A 202 ? 0.5952 0.2453 0.5046 -0.0751 -0.2043 0.0645 231 ARG A CD 3092 N NE . ARG A 202 ? 0.6115 0.2613 0.5285 -0.0812 -0.2143 0.0705 231 ARG A NE 3093 C CZ . ARG A 202 ? 0.6236 0.2691 0.5338 -0.0840 -0.2190 0.0708 231 ARG A CZ 3094 N NH1 . ARG A 202 ? 0.6224 0.2638 0.5191 -0.0810 -0.2145 0.0656 231 ARG A NH1 3095 N NH2 . ARG A 202 ? 0.6365 0.2820 0.5545 -0.0901 -0.2291 0.0770 231 ARG A NH2 3109 N N . GLN A 203 ? 0.6333 0.2626 0.4908 -0.0590 -0.2030 0.0454 232 GLN A N 3110 C CA . GLN A 203 ? 0.6380 0.2621 0.4885 -0.0565 -0.2016 0.0438 232 GLN A CA 3111 C C . GLN A 203 ? 0.6525 0.2814 0.5082 -0.0602 -0.2007 0.0463 232 GLN A C 3112 O O . GLN A 203 ? 0.6431 0.2782 0.5042 -0.0610 -0.1963 0.0472 232 GLN A O 3113 C CB . GLN A 203 ? 0.6211 0.2447 0.4702 -0.0499 -0.1949 0.0410 232 GLN A CB 3114 C CG . GLN A 203 ? 0.6296 0.2449 0.4731 -0.0459 -0.1927 0.0403 232 GLN A CG 3115 C CD . GLN A 203 ? 0.6330 0.2424 0.4733 -0.0386 -0.1859 0.0383 232 GLN A CD 3116 O OE1 . GLN A 203 ? 0.6474 0.2440 0.4785 -0.0344 -0.1831 0.0375 232 GLN A OE1 3117 N NE2 . GLN A 203 ? 0.6219 0.2391 0.4690 -0.0366 -0.1821 0.0380 232 GLN A NE2 3126 N N . SER A 204 ? 0.7413 0.3652 0.5928 -0.0627 -0.2050 0.0475 233 SER A N 3127 C CA . SER A 204 ? 0.7529 0.3794 0.6071 -0.0667 -0.2049 0.0501 233 SER A CA 3128 C C . SER A 204 ? 0.7476 0.3734 0.6001 -0.0637 -0.2024 0.0493 233 SER A C 3129 O O . SER A 204 ? 0.7530 0.3738 0.6026 -0.0590 -0.2017 0.0477 233 SER A O 3130 C CB . SER A 204 ? 0.7693 0.3912 0.6210 -0.0713 -0.2113 0.0525 233 SER A CB 3131 O OG . SER A 204 ? 0.7742 0.3967 0.6300 -0.0745 -0.2157 0.0547 233 SER A OG 3137 N N . CYS A 205 ? 0.7387 0.3678 0.5928 -0.0668 -0.2010 0.0513 234 CYS A N 3138 C CA . CYS A 205 ? 0.7383 0.3673 0.5928 -0.0657 -0.2012 0.0522 234 CYS A CA 3139 C C . CYS A 205 ? 0.7795 0.4032 0.6321 -0.0657 -0.2050 0.0532 234 CYS A C 3140 O O . CYS A 205 ? 0.7863 0.4079 0.6355 -0.0704 -0.2083 0.0548 234 CYS A O 3141 C CB . CYS A 205 ? 0.7200 0.3502 0.5718 -0.0706 -0.2007 0.0544 234 CYS A CB 3142 S SG . CYS A 205 ? 0.8349 0.4665 0.6889 -0.0700 -0.2027 0.0565 234 CYS A SG 3147 N N . PRO A 206 ? 0.6586 0.2787 0.5134 -0.0602 -0.2035 0.0526 235 PRO A N 3148 C CA . PRO A 206 ? 0.7310 0.3435 0.5832 -0.0595 -0.2057 0.0535 235 PRO A CA 3149 C C . PRO A 206 ? 0.8451 0.4595 0.7020 -0.0624 -0.2088 0.0574 235 PRO A C 3150 O O . PRO A 206 ? 0.8416 0.4504 0.7005 -0.0600 -0.2089 0.0590 235 PRO A O 3151 C CB . PRO A 206 ? 0.6935 0.2990 0.5465 -0.0514 -0.1997 0.0523 235 PRO A CB 3152 C CG . PRO A 206 ? 0.6584 0.2680 0.5126 -0.0488 -0.1958 0.0501 235 PRO A CG 3153 C CD . PRO A 206 ? 0.6406 0.2611 0.4999 -0.0538 -0.1981 0.0513 235 PRO A CD 3161 N N . CYS A 207 ? 1.0176 0.6377 0.8747 -0.0675 -0.2111 0.0592 236 CYS A N 3162 C CA . CYS A 207 ? 1.1531 0.7735 1.0121 -0.0714 -0.2159 0.0632 236 CYS A CA 3163 C C . CYS A 207 ? 1.2727 0.8883 1.1255 -0.0756 -0.2201 0.0642 236 CYS A C 3164 O O . CYS A 207 ? 1.2992 0.9124 1.1459 -0.0771 -0.2198 0.0623 236 CYS A O 3165 C CB . CYS A 207 ? 1.1625 0.7858 1.0173 -0.0763 -0.2173 0.0645 236 CYS A CB 3166 S SG . CYS A 207 ? 0.5977 0.2186 0.4402 -0.0810 -0.2140 0.0624 236 CYS A SG 3171 N N . GLN A 208 ? 0.6994 0.3138 0.5551 -0.0778 -0.2248 0.0679 237 GLN A N 3172 C CA . GLN A 208 ? 0.7084 0.3179 0.5585 -0.0817 -0.2292 0.0693 237 GLN A CA 3173 C C . GLN A 208 ? 0.7133 0.3214 0.5521 -0.0892 -0.2315 0.0703 237 GLN A C 3174 O O . GLN A 208 ? 0.7162 0.3243 0.5511 -0.0929 -0.2337 0.0724 237 GLN A O 3175 C CB . GLN A 208 ? 0.7552 0.3635 0.6142 -0.0810 -0.2332 0.0736 237 GLN A CB 3178 N N . ILE A 209 ? 0.8590 0.4643 0.6917 -0.0917 -0.2307 0.0694 238 ILE A N 3179 C CA . ILE A 209 ? 0.8130 0.4148 0.6356 -0.0981 -0.2295 0.0707 238 ILE A CA 3180 C C . ILE A 209 ? 0.8335 0.4298 0.6493 -0.1033 -0.2348 0.0739 238 ILE A C 3181 O O . ILE A 209 ? 0.8366 0.4282 0.6451 -0.1081 -0.2333 0.0751 238 ILE A O 3182 C CB . ILE A 209 ? 0.7733 0.3754 0.5968 -0.0989 -0.2256 0.0698 238 ILE A CB 3185 N N . ASN A 210 ? 1.0240 0.6205 0.8437 -0.1027 -0.2409 0.0759 239 ASN A N 3186 C CA . ASN A 210 ? 1.0637 0.6550 0.8779 -0.1076 -0.2474 0.0793 239 ASN A CA 3187 C C . ASN A 210 ? 1.1028 0.6864 0.9001 -0.1149 -0.2478 0.0811 239 ASN A C 3188 O O . ASN A 210 ? 1.1154 0.6924 0.9032 -0.1197 -0.2483 0.0825 239 ASN A O 3189 C CB . ASN A 210 ? 1.0654 0.6592 0.8910 -0.1056 -0.2538 0.0823 239 ASN A CB 3192 N N . ASP A 211 ? 1.5811 1.1634 1.3729 -0.1159 -0.2471 0.0811 240 ASP A N 3193 C CA . ASP A 211 ? 1.6008 1.1710 1.3714 -0.1230 -0.2474 0.0826 240 ASP A CA 3194 C C . ASP A 211 ? 1.6078 1.1708 1.3669 -0.1246 -0.2356 0.0803 240 ASP A C 3195 O O . ASP A 211 ? 1.6300 1.1791 1.3685 -0.1298 -0.2324 0.0808 240 ASP A O 3196 C CB . ASP A 211 ? 1.6001 1.1693 1.3674 -0.1242 -0.2526 0.0838 240 ASP A CB 3199 N N . LEU A 212 ? 1.2490 0.8196 1.0211 -0.1204 -0.2292 0.0783 241 LEU A N 3200 C CA . LEU A 212 ? 1.2310 0.7968 0.9991 -0.1216 -0.2177 0.0776 241 LEU A CA 3201 C C . LEU A 212 ? 1.2563 0.8146 1.0192 -0.1265 -0.2146 0.0802 241 LEU A C 3202 O O . LEU A 212 ? 1.2973 0.8615 1.0701 -0.1261 -0.2195 0.0812 241 LEU A O 3203 C CB . LEU A 212 ? 1.1458 0.7233 0.9318 -0.1158 -0.2139 0.0754 241 LEU A CB 3204 C CG . LEU A 212 ? 1.1021 0.6831 0.8900 -0.1119 -0.2105 0.0729 241 LEU A CG 3205 C CD1 . LEU A 212 ? 1.0989 0.6825 0.8859 -0.1104 -0.2188 0.0727 241 LEU A CD1 3206 C CD2 . LEU A 212 ? 1.0788 0.6704 0.8833 -0.1066 -0.2080 0.0710 241 LEU A CD2 3218 N N . ASN A 213 ? 1.4598 1.0034 1.2061 -0.1311 -0.2056 0.0815 242 ASN A N 3219 C CA . ASN A 213 ? 1.4112 0.9460 1.1532 -0.1357 -0.1995 0.0850 242 ASN A CA 3220 C C . ASN A 213 ? 1.3120 0.8549 1.0742 -0.1339 -0.1916 0.0872 242 ASN A C 3221 O O . ASN A 213 ? 1.3269 0.8670 1.0934 -0.1373 -0.1880 0.0914 242 ASN A O 3222 C CB . ASN A 213 ? 1.4309 0.9436 1.1462 -0.1406 -0.1900 0.0861 242 ASN A CB 3223 C CG . ASN A 213 ? 1.4295 0.9308 1.1226 -0.1457 -0.2000 0.0862 242 ASN A CG 3224 O OD1 . ASN A 213 ? 1.4368 0.9234 1.1138 -0.1510 -0.1969 0.0886 242 ASN A OD1 3225 N ND2 . ASN A 213 ? 1.4106 0.9184 1.1038 -0.1443 -0.2123 0.0844 242 ASN A ND2 3232 N N . ALA A 214 ? 1.2359 0.7888 1.0115 -0.1289 -0.1899 0.0852 243 ALA A N 3233 C CA . ALA A 214 ? 1.1940 0.7551 0.9901 -0.1276 -0.1844 0.0882 243 ALA A CA 3234 C C . ALA A 214 ? 1.1493 0.7251 0.9602 -0.1221 -0.1916 0.0846 243 ALA A C 3235 O O . ALA A 214 ? 1.1532 0.7314 0.9591 -0.1183 -0.1944 0.0803 243 ALA A O 3236 C CB . ALA A 214 ? 1.1948 0.7459 0.9887 -0.1283 -0.1682 0.0918 243 ALA A CB 3242 N N . LYS A 215 ? 1.0602 0.6450 0.8885 -0.1220 -0.1951 0.0871 244 LYS A N 3243 C CA . LYS A 215 ? 1.0304 0.6258 0.8692 -0.1172 -0.2022 0.0839 244 LYS A CA 3244 C C . LYS A 215 ? 1.0204 0.6186 0.8647 -0.1140 -0.1949 0.0829 244 LYS A C 3245 O O . LYS A 215 ? 1.0439 0.6374 0.8910 -0.1159 -0.1840 0.0870 244 LYS A O 3246 C CB . LYS A 215 ? 1.0275 0.6285 0.8801 -0.1195 -0.2090 0.0875 244 LYS A CB 3247 C CG . LYS A 215 ? 1.0249 0.6317 0.8811 -0.1151 -0.2182 0.0838 244 LYS A CG 3248 C CD . LYS A 215 ? 1.0253 0.6345 0.8911 -0.1186 -0.2268 0.0879 244 LYS A CD 3249 C CE . LYS A 215 ? 1.0083 0.6167 0.8688 -0.1144 -0.2363 0.0834 244 LYS A CE 3250 N NZ . LYS A 215 ? 0.9950 0.5975 0.8416 -0.1108 -0.2394 0.0788 244 LYS A NZ 3264 N N . PRO A 216 ? 1.0335 0.6379 0.8791 -0.1086 -0.1996 0.0780 245 PRO A N 3265 C CA . PRO A 216 ? 1.0076 0.6153 0.8588 -0.1054 -0.1937 0.0769 245 PRO A CA 3266 C C . PRO A 216 ? 0.9796 0.5907 0.8477 -0.1076 -0.1893 0.0828 245 PRO A C 3267 O O . PRO A 216 ? 0.9865 0.6013 0.8650 -0.1106 -0.1955 0.0868 245 PRO A O 3268 C CB . PRO A 216 ? 1.0030 0.6169 0.8549 -0.0999 -0.2014 0.0719 245 PRO A CB 3269 C CG . PRO A 216 ? 1.0126 0.6237 0.8548 -0.0993 -0.2072 0.0699 245 PRO A CG 3270 C CD . PRO A 216 ? 1.0268 0.6335 0.8672 -0.1049 -0.2087 0.0737 245 PRO A CD 3278 N N . HIS A 217 ? 0.8584 0.4682 0.7302 -0.1061 -0.1793 0.0841 246 HIS A N 3279 C CA . HIS A 217 ? 0.8154 0.4285 0.7068 -0.1078 -0.1731 0.0920 246 HIS A CA 3280 C C . HIS A 217 ? 0.7750 0.3865 0.6686 -0.1041 -0.1626 0.0920 246 HIS A C 3281 O O . HIS A 217 ? 0.7748 0.3776 0.6510 -0.1019 -0.1562 0.0875 246 HIS A O 3282 C CB . HIS A 217 ? 0.8200 0.4260 0.7148 -0.1128 -0.1645 0.1001 246 HIS A CB 3283 C CG . HIS A 217 ? 0.8179 0.4081 0.6927 -0.1127 -0.1512 0.0993 246 HIS A CG 3284 N ND1 . HIS A 217 ? 0.8217 0.4025 0.6971 -0.1113 -0.1345 0.1044 246 HIS A ND1 3285 C CD2 . HIS A 217 ? 0.8154 0.3955 0.6668 -0.1140 -0.1526 0.0944 246 HIS A CD2 3286 C CE1 . HIS A 217 ? 0.8320 0.3955 0.6819 -0.1119 -0.1261 0.1019 246 HIS A CE1 3287 N NE2 . HIS A 217 ? 0.8278 0.3915 0.6635 -0.1141 -0.1380 0.0960 246 HIS A NE2 3294 N N . HIS A 218 ? 0.8457 0.4653 0.7608 -0.1038 -0.1618 0.0979 247 HIS A N 3295 C CA . HIS A 218 ? 0.8316 0.4501 0.7522 -0.1000 -0.1513 0.0995 247 HIS A CA 3296 C C . HIS A 218 ? 0.8199 0.4374 0.7237 -0.0952 -0.1538 0.0892 247 HIS A C 3297 O O . HIS A 218 ? 0.8534 0.4609 0.7437 -0.0931 -0.1435 0.0870 247 HIS A O 3298 C CB . HIS A 218 ? 0.8446 0.4493 0.7616 -0.1004 -0.1322 0.1062 247 HIS A CB 3299 C CG . HIS A 218 ? 0.8540 0.4606 0.7922 -0.1042 -0.1260 0.1191 247 HIS A CG 3300 N ND1 . HIS A 218 ? 0.8634 0.4658 0.7967 -0.1088 -0.1274 0.1215 247 HIS A ND1 3301 C CD2 . HIS A 218 ? 0.8565 0.4702 0.8235 -0.1040 -0.1183 0.1316 247 HIS A CD2 3302 C CE1 . HIS A 218 ? 0.8700 0.4767 0.8279 -0.1113 -0.1204 0.1348 247 HIS A CE1 3303 N NE2 . HIS A 218 ? 0.8652 0.4797 0.8453 -0.1085 -0.1148 0.1418 247 HIS A NE2 3310 N N . PHE A 219 ? 0.6377 0.2638 0.5412 -0.0935 -0.1671 0.0835 248 PHE A N 3311 C CA . PHE A 219 ? 0.5822 0.2090 0.4731 -0.0887 -0.1695 0.0752 248 PHE A CA 3312 C C . PHE A 219 ? 0.5711 0.2069 0.4712 -0.0857 -0.1771 0.0732 248 PHE A C 3313 O O . PHE A 219 ? 0.5642 0.2012 0.4577 -0.0812 -0.1772 0.0678 248 PHE A O 3314 C CB . PHE A 219 ? 0.5829 0.2074 0.4582 -0.0886 -0.1761 0.0700 248 PHE A CB 3315 C CG . PHE A 219 ? 0.5819 0.2102 0.4605 -0.0900 -0.1872 0.0702 248 PHE A CG 3316 C CD1 . PHE A 219 ? 0.7613 0.3867 0.6412 -0.0949 -0.1887 0.0744 248 PHE A CD1 3317 C CD2 . PHE A 219 ? 0.5753 0.2075 0.4534 -0.0864 -0.1952 0.0663 248 PHE A CD2 3318 C CE1 . PHE A 219 ? 0.5918 0.2189 0.4726 -0.0964 -0.1992 0.0745 248 PHE A CE1 3319 C CE2 . PHE A 219 ? 0.5794 0.2106 0.4559 -0.0876 -0.2045 0.0664 248 PHE A CE2 3320 C CZ . PHE A 219 ? 0.5873 0.2163 0.4653 -0.0927 -0.2071 0.0704 248 PHE A CZ 3330 N N . MET A 220 ? 0.7059 0.3469 0.6206 -0.0886 -0.1842 0.0782 249 MET A N 3331 C CA . MET A 220 ? 0.7003 0.3468 0.6207 -0.0869 -0.1929 0.0770 249 MET A CA 3332 C C . MET A 220 ? 0.6949 0.3450 0.6259 -0.0844 -0.1859 0.0790 249 MET A C 3333 O O . MET A 220 ? 0.6961 0.3512 0.6471 -0.0870 -0.1857 0.0872 249 MET A O 3334 C CB . MET A 220 ? 0.7061 0.3557 0.6382 -0.0923 -0.2041 0.0832 249 MET A CB 3337 N N . HIS A 221 ? 0.6011 0.2491 0.5205 -0.0794 -0.1806 0.0725 250 HIS A N 3338 C CA . HIS A 221 ? 0.5966 0.2466 0.5233 -0.0763 -0.1736 0.0734 250 HIS A CA 3339 C C . HIS A 221 ? 0.5900 0.2389 0.5023 -0.0711 -0.1720 0.0653 250 HIS A C 3340 O O . HIS A 221 ? 0.5904 0.2360 0.4884 -0.0700 -0.1724 0.0605 250 HIS A O 3341 C CB . HIS A 221 ? 0.6102 0.2550 0.5432 -0.0772 -0.1595 0.0797 250 HIS A CB 3342 C CG . HIS A 221 ? 0.6399 0.2741 0.5532 -0.0772 -0.1520 0.0760 250 HIS A CG 3343 N ND1 . HIS A 221 ? 0.6602 0.2881 0.5701 -0.0812 -0.1491 0.0795 250 HIS A ND1 3344 C CD2 . HIS A 221 ? 0.6490 0.2772 0.5444 -0.0744 -0.1482 0.0696 250 HIS A CD2 3345 C CE1 . HIS A 221 ? 0.6728 0.2904 0.5619 -0.0810 -0.1441 0.0752 250 HIS A CE1 3346 N NE2 . HIS A 221 ? 0.6685 0.2865 0.5491 -0.0772 -0.1441 0.0695 250 HIS A NE2 3353 N N . TYR A 222 ? 0.5835 0.2358 0.5015 -0.0680 -0.1707 0.0647 251 TYR A N 3354 C CA . TYR A 222 ? 0.5774 0.2294 0.4845 -0.0631 -0.1682 0.0582 251 TYR A CA 3355 C C . TYR A 222 ? 0.5812 0.2271 0.4818 -0.0622 -0.1568 0.0581 251 TYR A C 3356 O O . TYR A 222 ? 0.5893 0.2300 0.4953 -0.0641 -0.1485 0.0635 251 TYR A O 3357 C CB . TYR A 222 ? 0.5714 0.2284 0.4857 -0.0604 -0.1716 0.0577 251 TYR A CB 3358 C CG . TYR A 222 ? 0.5723 0.2301 0.4830 -0.0605 -0.1829 0.0556 251 TYR A CG 3359 C CD1 . TYR A 222 ? 0.5715 0.2264 0.4679 -0.0569 -0.1848 0.0497 251 TYR A CD1 3360 C CD2 . TYR A 222 ? 0.5770 0.2365 0.4979 -0.0642 -0.1914 0.0605 251 TYR A CD2 3361 C CE1 . TYR A 222 ? 0.5777 0.2283 0.4665 -0.0563 -0.1928 0.0479 251 TYR A CE1 3362 C CE2 . TYR A 222 ? 0.5838 0.2389 0.4953 -0.0648 -0.2020 0.0584 251 TYR A CE2 3363 C CZ . TYR A 222 ? 0.5853 0.2345 0.4788 -0.0604 -0.2016 0.0517 251 TYR A CZ 3364 O OH . TYR A 222 ? 0.5971 0.2373 0.4773 -0.0603 -0.2099 0.0497 251 TYR A OH 3374 N N . ALA A 223 ? 0.6511 0.2959 0.5396 -0.0594 -0.1561 0.0528 252 ALA A N 3375 C CA . ALA A 223 ? 0.6583 0.2947 0.5361 -0.0592 -0.1473 0.0522 252 ALA A CA 3376 C C . ALA A 223 ? 0.6520 0.2909 0.5223 -0.0560 -0.1493 0.0476 252 ALA A C 3377 O O . ALA A 223 ? 0.6464 0.2900 0.5145 -0.0550 -0.1562 0.0452 252 ALA A O 3378 C CB . ALA A 223 ? 0.6708 0.2979 0.5360 -0.0632 -0.1453 0.0533 252 ALA A CB 3384 N N . VAL A 224 ? 0.5639 0.1990 0.4317 -0.0541 -0.1425 0.0472 253 VAL A N 3385 C CA . VAL A 224 ? 0.5583 0.1961 0.4209 -0.0514 -0.1443 0.0437 253 VAL A CA 3386 C C . VAL A 224 ? 0.5715 0.1971 0.4190 -0.0526 -0.1374 0.0435 253 VAL A C 3387 O O . VAL A 224 ? 0.5802 0.1975 0.4267 -0.0519 -0.1279 0.0452 253 VAL A O 3388 C CB . VAL A 224 ? 0.5467 0.1930 0.4212 -0.0471 -0.1450 0.0427 253 VAL A CB 3389 C CG1 . VAL A 224 ? 0.7402 0.3892 0.6103 -0.0444 -0.1462 0.0398 253 VAL A CG1 3390 C CG2 . VAL A 224 ? 0.5394 0.1934 0.4234 -0.0465 -0.1524 0.0428 253 VAL A CG2 3400 N N . TYR A 225 ? 0.6991 0.3221 0.5347 -0.0546 -0.1424 0.0421 254 TYR A N 3401 C CA . TYR A 225 ? 0.5727 0.1819 0.3895 -0.0569 -0.1386 0.0418 254 TYR A CA 3402 C C . TYR A 225 ? 0.5687 0.1790 0.3871 -0.0534 -0.1349 0.0402 254 TYR A C 3403 O O . TYR A 225 ? 0.5832 0.1802 0.3902 -0.0532 -0.1258 0.0402 254 TYR A O 3404 C CB . TYR A 225 ? 0.5786 0.1859 0.3846 -0.0611 -0.1483 0.0423 254 TYR A CB 3405 C CG . TYR A 225 ? 0.5927 0.1909 0.3871 -0.0661 -0.1503 0.0440 254 TYR A CG 3406 C CD1 . TYR A 225 ? 0.6165 0.1952 0.3902 -0.0694 -0.1423 0.0444 254 TYR A CD1 3407 C CD2 . TYR A 225 ? 0.5846 0.1919 0.3876 -0.0673 -0.1593 0.0454 254 TYR A CD2 3408 C CE1 . TYR A 225 ? 0.6313 0.2003 0.3926 -0.0742 -0.1439 0.0459 254 TYR A CE1 3409 C CE2 . TYR A 225 ? 0.5977 0.1968 0.3901 -0.0720 -0.1617 0.0471 254 TYR A CE2 3410 C CZ . TYR A 225 ? 0.6208 0.2010 0.3920 -0.0757 -0.1544 0.0472 254 TYR A CZ 3411 O OH . TYR A 225 ? 0.6359 0.2064 0.3947 -0.0806 -0.1564 0.0489 254 TYR A OH 3421 N N . ASP A 226 ? 0.5482 0.1728 0.3799 -0.0502 -0.1409 0.0390 255 ASP A N 3422 C CA . ASP A 226 ? 0.5796 0.2064 0.4133 -0.0470 -0.1387 0.0376 255 ASP A CA 3423 C C . ASP A 226 ? 0.5245 0.1659 0.3765 -0.0421 -0.1408 0.0367 255 ASP A C 3424 O O . ASP A 226 ? 0.5158 0.1654 0.3762 -0.0413 -0.1463 0.0368 255 ASP A O 3425 C CB . ASP A 226 ? 0.5485 0.1728 0.3724 -0.0495 -0.1450 0.0379 255 ASP A CB 3426 C CG . ASP A 226 ? 0.7921 0.4026 0.5964 -0.0558 -0.1481 0.0394 255 ASP A CG 3427 O OD1 . ASP A 226 ? 0.8115 0.4048 0.5966 -0.0580 -0.1413 0.0388 255 ASP A OD1 3428 O OD2 . ASP A 226 ? 0.5665 0.1817 0.3738 -0.0586 -0.1571 0.0414 255 ASP A OD2 3433 N N . PHE A 227 ? 0.5151 0.1576 0.3711 -0.0388 -0.1362 0.0358 256 PHE A N 3434 C CA . PHE A 227 ? 0.5007 0.1545 0.3702 -0.0345 -0.1385 0.0347 256 PHE A CA 3435 C C . PHE A 227 ? 0.4980 0.1530 0.3654 -0.0324 -0.1379 0.0335 256 PHE A C 3436 O O . PHE A 227 ? 0.4966 0.1514 0.3672 -0.0298 -0.1334 0.0330 256 PHE A O 3437 C CB . PHE A 227 ? 0.5117 0.1666 0.3914 -0.0329 -0.1348 0.0361 256 PHE A CB 3438 C CG . PHE A 227 ? 0.4886 0.1528 0.3788 -0.0301 -0.1398 0.0353 256 PHE A CG 3439 C CD1 . PHE A 227 ? 0.4866 0.1541 0.3798 -0.0309 -0.1459 0.0355 256 PHE A CD1 3440 C CD2 . PHE A 227 ? 0.4837 0.1511 0.3780 -0.0268 -0.1386 0.0345 256 PHE A CD2 3441 C CE1 . PHE A 227 ? 0.5844 0.2556 0.4815 -0.0288 -0.1505 0.0346 256 PHE A CE1 3442 C CE2 . PHE A 227 ? 0.4782 0.1509 0.3780 -0.0248 -0.1435 0.0337 256 PHE A CE2 3443 C CZ . PHE A 227 ? 0.4793 0.1526 0.3790 -0.0259 -0.1494 0.0337 256 PHE A CZ 3453 N N . ILE A 228 ? 0.5523 0.2086 0.4162 -0.0338 -0.1430 0.0339 257 ILE A N 3454 C CA . ILE A 228 ? 0.5496 0.2065 0.4118 -0.0331 -0.1437 0.0338 257 ILE A CA 3455 C C . ILE A 228 ? 0.5355 0.2022 0.4098 -0.0280 -0.1436 0.0329 257 ILE A C 3456 O O . ILE A 228 ? 0.5232 0.1957 0.4049 -0.0261 -0.1465 0.0336 257 ILE A O 3457 C CB . ILE A 228 ? 0.5023 0.1578 0.3604 -0.0371 -0.1507 0.0366 257 ILE A CB 3458 C CG1 . ILE A 228 ? 0.5178 0.1622 0.3614 -0.0428 -0.1524 0.0376 257 ILE A CG1 3459 C CG2 . ILE A 228 ? 0.6716 0.3255 0.5265 -0.0379 -0.1523 0.0374 257 ILE A CG2 3460 C CD1 . ILE A 228 ? 0.5340 0.1635 0.3601 -0.0445 -0.1453 0.0360 257 ILE A CD1 3472 N N . VAL A 229 ? 0.5420 0.2083 0.4167 -0.0255 -0.1395 0.0315 258 VAL A N 3473 C CA . VAL A 229 ? 0.4729 0.1464 0.3561 -0.0210 -0.1392 0.0305 258 VAL A CA 3474 C C . VAL A 229 ? 0.4724 0.1463 0.3545 -0.0204 -0.1391 0.0310 258 VAL A C 3475 O O . VAL A 229 ? 0.4748 0.1455 0.3535 -0.0197 -0.1355 0.0300 258 VAL A O 3476 C CB . VAL A 229 ? 0.4712 0.1451 0.3586 -0.0188 -0.1360 0.0295 258 VAL A CB 3477 C CG1 . VAL A 229 ? 0.4645 0.1437 0.3573 -0.0148 -0.1368 0.0284 258 VAL A CG1 3478 C CG2 . VAL A 229 ? 0.4729 0.1463 0.3631 -0.0203 -0.1375 0.0302 258 VAL A CG2 3488 N N . LYS A 230 ? 0.6363 0.3137 0.5226 -0.0207 -0.1427 0.0333 259 LYS A N 3489 C CA . LYS A 230 ? 0.6311 0.3095 0.5187 -0.0209 -0.1437 0.0351 259 LYS A CA 3490 C C . LYS A 230 ? 0.5866 0.2695 0.4800 -0.0156 -0.1398 0.0335 259 LYS A C 3491 O O . LYS A 230 ? 0.5590 0.2449 0.4571 -0.0117 -0.1380 0.0326 259 LYS A O 3492 C CB . LYS A 230 ? 0.6536 0.3355 0.5493 -0.0227 -0.1486 0.0401 259 LYS A CB 3493 C CG . LYS A 230 ? 0.6726 0.3498 0.5624 -0.0287 -0.1544 0.0422 259 LYS A CG 3494 C CD . LYS A 230 ? 0.6911 0.3707 0.5889 -0.0326 -0.1615 0.0487 259 LYS A CD 3495 C CE . LYS A 230 ? 0.7276 0.4031 0.6208 -0.0387 -0.1685 0.0514 259 LYS A CE 3496 N NZ . LYS A 230 ? 0.7549 0.4350 0.6613 -0.0427 -0.1768 0.0594 259 LYS A NZ 3510 N N . GLY A 231 ? 0.5664 0.2477 0.4568 -0.0157 -0.1388 0.0331 260 GLY A N 3511 C CA . GLY A 231 ? 0.5701 0.2548 0.4645 -0.0112 -0.1354 0.0317 260 GLY A CA 3512 C C . GLY A 231 ? 0.5939 0.2757 0.4839 -0.0123 -0.1349 0.0317 260 GLY A C 3513 O O . GLY A 231 ? 0.6287 0.3053 0.5122 -0.0168 -0.1382 0.0335 260 GLY A O 3517 N N . SER A 232 ? 0.4829 0.1665 0.3748 -0.0086 -0.1317 0.0300 261 SER A N 3518 C CA . SER A 232 ? 0.4613 0.1418 0.3491 -0.0091 -0.1307 0.0299 261 SER A CA 3519 C C . SER A 232 ? 0.5137 0.1959 0.4040 -0.0049 -0.1268 0.0278 261 SER A C 3520 O O . SER A 232 ? 0.4521 0.1385 0.3478 -0.0019 -0.1264 0.0269 261 SER A O 3521 C CB . SER A 232 ? 0.4604 0.1440 0.3531 -0.0102 -0.1342 0.0336 261 SER A CB 3522 O OG . SER A 232 ? 0.4527 0.1431 0.3557 -0.0056 -0.1320 0.0348 261 SER A OG 3528 N N . CYS A 233 ? 0.6012 0.2785 0.4864 -0.0051 -0.1246 0.0272 262 CYS A N 3529 C CA . CYS A 233 ? 0.5984 0.2772 0.4872 -0.0014 -0.1212 0.0260 262 CYS A CA 3530 C C . CYS A 233 ? 0.5818 0.2675 0.4767 0.0013 -0.1229 0.0266 262 CYS A C 3531 O O . CYS A 233 ? 0.5991 0.2860 0.4945 0.0003 -0.1245 0.0285 262 CYS A O 3532 C CB . CYS A 233 ? 0.6130 0.2831 0.4937 -0.0020 -0.1175 0.0257 262 CYS A CB 3533 S SG . CYS A 233 ? 0.8655 0.5368 0.7524 0.0028 -0.1130 0.0252 262 CYS A SG 3538 N N . PHE A 234 ? 0.5606 0.2494 0.4598 0.0043 -0.1226 0.0256 263 PHE A N 3539 C CA . PHE A 234 ? 0.5366 0.2280 0.4374 0.0071 -0.1229 0.0259 263 PHE A CA 3540 C C . PHE A 234 ? 0.5299 0.2212 0.4309 0.0087 -0.1215 0.0257 263 PHE A C 3541 O O . PHE A 234 ? 0.5195 0.2099 0.4222 0.0093 -0.1209 0.0251 263 PHE A O 3542 C CB . PHE A 234 ? 0.5278 0.2185 0.4279 0.0085 -0.1247 0.0250 263 PHE A CB 3543 C CG . PHE A 234 ? 0.5143 0.2028 0.4109 0.0116 -0.1240 0.0250 263 PHE A CG 3544 C CD1 . PHE A 234 ? 0.5047 0.1925 0.4011 0.0138 -0.1204 0.0268 263 PHE A CD1 3545 C CD2 . PHE A 234 ? 0.5082 0.1939 0.4020 0.0122 -0.1269 0.0242 263 PHE A CD2 3546 C CE1 . PHE A 234 ? 0.5076 0.1905 0.3989 0.0173 -0.1176 0.0273 263 PHE A CE1 3547 C CE2 . PHE A 234 ? 0.5075 0.1878 0.3940 0.0146 -0.1263 0.0241 263 PHE A CE2 3548 C CZ . PHE A 234 ? 0.5096 0.1877 0.3937 0.0176 -0.1207 0.0254 263 PHE A CZ 3558 N N . CYS A 235 ? 0.6250 0.3174 0.5264 0.0095 -0.1207 0.0272 264 CYS A N 3559 C CA . CYS A 235 ? 0.6310 0.3231 0.5322 0.0106 -0.1196 0.0272 264 CYS A CA 3560 C C . CYS A 235 ? 0.6444 0.3377 0.5470 0.0133 -0.1182 0.0290 264 CYS A C 3561 O O . CYS A 235 ? 0.6834 0.3770 0.5867 0.0137 -0.1175 0.0300 264 CYS A O 3562 C CB . CYS A 235 ? 0.6181 0.3070 0.5161 0.0076 -0.1199 0.0280 264 CYS A CB 3563 S SG . CYS A 235 ? 0.6894 0.3715 0.5812 0.0050 -0.1185 0.0264 264 CYS A SG 3568 N N . ASN A 236 ? 0.4468 0.1391 0.3488 0.0154 -0.1169 0.0296 265 ASN A N 3569 C CA . ASN A 236 ? 0.4507 0.1406 0.3521 0.0192 -0.1128 0.0319 265 ASN A CA 3570 C C . ASN A 236 ? 0.4488 0.1420 0.3585 0.0191 -0.1107 0.0369 265 ASN A C 3571 O O . ASN A 236 ? 0.4517 0.1435 0.3628 0.0222 -0.1067 0.0396 265 ASN A O 3572 C CB . ASN A 236 ? 0.4547 0.1409 0.3497 0.0209 -0.1135 0.0298 265 ASN A CB 3573 C CG . ASN A 236 ? 0.4612 0.1418 0.3480 0.0208 -0.1168 0.0271 265 ASN A CG 3574 O OD1 . ASN A 236 ? 0.4709 0.1436 0.3493 0.0229 -0.1147 0.0273 265 ASN A OD1 3575 N ND2 . ASN A 236 ? 0.4586 0.1415 0.3476 0.0184 -0.1217 0.0255 265 ASN A ND2 3582 N N . GLY A 237 ? 0.5925 0.2890 0.5072 0.0151 -0.1139 0.0387 266 GLY A N 3583 C CA . GLY A 237 ? 0.6034 0.3029 0.5272 0.0133 -0.1145 0.0448 266 GLY A CA 3584 C C . GLY A 237 ? 0.6038 0.3030 0.5259 0.0110 -0.1173 0.0448 266 GLY A C 3585 O O . GLY A 237 ? 0.6172 0.3188 0.5474 0.0095 -0.1183 0.0506 266 GLY A O 3589 N N . HIS A 238 ? 0.4466 0.1430 0.3597 0.0107 -0.1183 0.0391 267 HIS A N 3590 C CA . HIS A 238 ? 0.4542 0.1484 0.3637 0.0092 -0.1199 0.0386 267 HIS A CA 3591 C C . HIS A 238 ? 0.5190 0.2073 0.4197 0.0047 -0.1233 0.0362 267 HIS A C 3592 O O . HIS A 238 ? 0.4592 0.1427 0.3534 0.0046 -0.1228 0.0342 267 HIS A O 3593 C CB . HIS A 238 ? 0.4566 0.1501 0.3628 0.0133 -0.1169 0.0352 267 HIS A CB 3594 C CG . HIS A 238 ? 0.4923 0.1868 0.4014 0.0176 -0.1130 0.0373 267 HIS A CG 3595 N ND1 . HIS A 238 ? 0.4492 0.1448 0.3643 0.0188 -0.1106 0.0425 267 HIS A ND1 3596 C CD2 . HIS A 238 ? 0.4500 0.1419 0.3548 0.0210 -0.1108 0.0354 267 HIS A CD2 3597 C CE1 . HIS A 238 ? 0.4529 0.1457 0.3665 0.0236 -0.1052 0.0436 267 HIS A CE1 3598 N NE2 . HIS A 238 ? 0.4546 0.1440 0.3601 0.0246 -0.1059 0.0389 267 HIS A NE2 3605 N N . ALA A 239 ? 0.4940 0.1806 0.3929 0.0014 -0.1260 0.0367 268 ALA A N 3606 C CA . ALA A 239 ? 0.5707 0.2479 0.4571 -0.0028 -0.1280 0.0347 268 ALA A CA 3607 C C . ALA A 239 ? 0.5089 0.1842 0.3937 -0.0078 -0.1330 0.0370 268 ALA A C 3608 O O . ALA A 239 ? 0.5015 0.1841 0.3964 -0.0067 -0.1332 0.0391 268 ALA A O 3609 C CB . ALA A 239 ? 0.5046 0.1785 0.3862 0.0005 -0.1225 0.0301 268 ALA A CB 3615 N N . ASP A 240 ? 0.5834 0.2471 0.4537 -0.0132 -0.1367 0.0369 269 ASP A N 3616 C CA . ASP A 240 ? 0.6322 0.2915 0.4973 -0.0191 -0.1430 0.0392 269 ASP A CA 3617 C C . ASP A 240 ? 0.6645 0.3085 0.5089 -0.0210 -0.1402 0.0352 269 ASP A C 3618 O O . ASP A 240 ? 0.6727 0.3080 0.5058 -0.0269 -0.1458 0.0366 269 ASP A O 3619 C CB . ASP A 240 ? 0.6771 0.3347 0.5433 -0.0261 -0.1530 0.0452 269 ASP A CB 3620 C CG . ASP A 240 ? 0.7171 0.3627 0.5678 -0.0288 -0.1550 0.0442 269 ASP A CG 3621 O OD1 . ASP A 240 ? 0.7386 0.3708 0.5704 -0.0275 -0.1494 0.0391 269 ASP A OD1 3622 O OD2 . ASP A 240 ? 0.7293 0.3782 0.5875 -0.0321 -0.1613 0.0492 269 ASP A OD2 3627 N N . GLN A 241 ? 0.7211 0.3610 0.5609 -0.0159 -0.1312 0.0310 270 GLN A N 3628 C CA . GLN A 241 ? 0.7560 0.3797 0.5777 -0.0161 -0.1249 0.0280 270 GLN A CA 3629 C C . GLN A 241 ? 0.7801 0.4075 0.6107 -0.0089 -0.1144 0.0254 270 GLN A C 3630 O O . GLN A 241 ? 0.7759 0.4103 0.6166 -0.0046 -0.1119 0.0251 270 GLN A O 3631 C CB . GLN A 241 ? 0.7680 0.3732 0.5676 -0.0198 -0.1257 0.0277 270 GLN A CB 3632 C CG . GLN A 241 ? 0.7866 0.3701 0.5627 -0.0200 -0.1175 0.0251 270 GLN A CG 3633 C CD . GLN A 241 ? 0.8095 0.3716 0.5601 -0.0228 -0.1168 0.0243 270 GLN A CD 3634 O OE1 . GLN A 241 ? 0.8084 0.3730 0.5599 -0.0253 -0.1242 0.0260 270 GLN A OE1 3635 N NE2 . GLN A 241 ? 0.8309 0.3704 0.5575 -0.0221 -0.1074 0.0221 270 GLN A NE2 3644 N N . CYS A 242 ? 0.7726 0.3946 0.6001 -0.0079 -0.1088 0.0244 271 CYS A N 3645 C CA . CYS A 242 ? 0.7974 0.4230 0.6369 -0.0018 -0.0999 0.0239 271 CYS A CA 3646 C C . CYS A 242 ? 0.8329 0.4398 0.6593 -0.0002 -0.0888 0.0235 271 CYS A C 3647 O O . CYS A 242 ? 0.8365 0.4285 0.6431 -0.0044 -0.0884 0.0229 271 CYS A O 3648 C CB . CYS A 242 ? 0.7939 0.4328 0.6482 -0.0011 -0.1029 0.0244 271 CYS A CB 3649 S SG . CYS A 242 ? 0.6885 0.3467 0.5590 -0.0000 -0.1111 0.0250 271 CYS A SG 3654 N N . LEU A 243 ? 0.7046 0.3114 0.5423 0.0060 -0.0796 0.0247 272 LEU A N 3655 C CA . LEU A 243 ? 0.7403 0.3302 0.5716 0.0096 -0.0660 0.0260 272 LEU A CA 3656 C C . LEU A 243 ? 0.7070 0.3056 0.5601 0.0133 -0.0619 0.0297 272 LEU A C 3657 O O . LEU A 243 ? 0.7243 0.3409 0.5947 0.0130 -0.0703 0.0303 272 LEU A O 3658 C CB . LEU A 243 ? 0.7860 0.3672 0.6159 0.0144 -0.0574 0.0267 272 LEU A CB 3659 C CG . LEU A 243 ? 0.8155 0.3838 0.6207 0.0105 -0.0606 0.0237 272 LEU A CG 3660 C CD1 . LEU A 243 ? 0.8214 0.3827 0.6282 0.0162 -0.0517 0.0246 272 LEU A CD1 3661 C CD2 . LEU A 243 ? 0.8433 0.3886 0.6167 0.0056 -0.0586 0.0219 272 LEU A CD2 3673 N N . PRO A 244 ? 0.5956 0.1797 0.4466 0.0168 -0.0489 0.0326 273 PRO A N 3674 C CA . PRO A 244 ? 0.5892 0.1808 0.4637 0.0203 -0.0450 0.0382 273 PRO A CA 3675 C C . PRO A 244 ? 0.5402 0.1486 0.4435 0.0246 -0.0483 0.0428 273 PRO A C 3676 O O . PRO A 244 ? 0.5401 0.1489 0.4465 0.0276 -0.0464 0.0431 273 PRO A O 3677 C CB . PRO A 244 ? 0.5848 0.1554 0.4519 0.0249 -0.0275 0.0418 273 PRO A CB 3678 C CG . PRO A 244 ? 0.8041 0.3551 0.6344 0.0204 -0.0259 0.0357 273 PRO A CG 3679 C CD . PRO A 244 ? 0.6708 0.2294 0.4945 0.0168 -0.0377 0.0312 273 PRO A CD 3687 N N . VAL A 245 ? 0.6172 0.2388 0.5397 0.0240 -0.0543 0.0466 274 VAL A N 3688 C CA . VAL A 245 ? 0.5546 0.1917 0.5024 0.0264 -0.0601 0.0518 274 VAL A CA 3689 C C . VAL A 245 ? 0.6407 0.2713 0.6083 0.0334 -0.0469 0.0620 274 VAL A C 3690 O O . VAL A 245 ? 0.6226 0.2414 0.5905 0.0355 -0.0357 0.0663 274 VAL A O 3691 C CB . VAL A 245 ? 0.5287 0.1813 0.4869 0.0218 -0.0737 0.0521 274 VAL A CB 3692 C CG1 . VAL A 245 ? 0.5164 0.1841 0.4919 0.0216 -0.0843 0.0549 274 VAL A CG1 3693 C CG2 . VAL A 245 ? 0.5228 0.1771 0.4612 0.0163 -0.0818 0.0439 274 VAL A CG2 3703 N N . GLU A 246 ? 1.0540 0.6920 1.0386 0.0373 -0.0475 0.0669 275 GLU A N 3704 C CA . GLU A 246 ? 1.0879 0.7208 1.0929 0.0451 -0.0343 0.0780 275 GLU A CA 3705 C C . GLU A 246 ? 1.0763 0.7198 1.1068 0.0444 -0.0354 0.0875 275 GLU A C 3706 O O . GLU A 246 ? 1.0848 0.7478 1.1305 0.0384 -0.0515 0.0886 275 GLU A O 3707 C CB . GLU A 246 ? 1.0899 0.7350 1.1117 0.0476 -0.0393 0.0816 275 GLU A CB 3708 C CG . GLU A 246 ? 1.1069 0.7395 1.1086 0.0504 -0.0331 0.0754 275 GLU A CG 3709 C CD . GLU A 246 ? 1.1440 0.7523 1.1371 0.0580 -0.0108 0.0783 275 GLU A CD 3710 O OE1 . GLU A 246 ? 1.1609 0.7632 1.1613 0.0612 -0.0083 0.0843 275 GLU A OE1 3711 O OE2 . GLU A 246 ? 1.1485 0.7510 1.1293 0.0559 -0.0117 0.0710 275 GLU A OE2 3718 N N . GLY A 247 ? 0.7850 0.4162 0.8201 0.0502 -0.0183 0.0942 276 GLY A N 3719 C CA . GLY A 247 ? 0.7485 0.3946 0.8148 0.0499 -0.0155 0.1052 276 GLY A CA 3720 C C . GLY A 247 ? 0.7304 0.3680 0.7810 0.0449 -0.0172 0.1014 276 GLY A C 3721 O O . GLY A 247 ? 0.7099 0.3591 0.7847 0.0440 -0.0152 0.1102 276 GLY A O 3725 N N . PHE A 248 ? 0.6975 0.3173 0.7105 0.0414 -0.0207 0.0891 277 PHE A N 3726 C CA . PHE A 248 ? 0.7186 0.3319 0.7159 0.0359 -0.0232 0.0847 277 PHE A CA 3727 C C . PHE A 248 ? 0.7481 0.3363 0.7268 0.0386 -0.0062 0.0844 277 PHE A C 3728 O O . PHE A 248 ? 0.7715 0.3473 0.7218 0.0387 -0.0001 0.0758 277 PHE A O 3729 C CB . PHE A 248 ? 0.7257 0.3464 0.7013 0.0284 -0.0390 0.0717 277 PHE A CB 3730 C CG . PHE A 248 ? 0.7728 0.3884 0.7302 0.0227 -0.0422 0.0663 277 PHE A CG 3731 C CD1 . PHE A 248 ? 0.7792 0.4079 0.7498 0.0184 -0.0525 0.0687 277 PHE A CD1 3732 C CD2 . PHE A 248 ? 0.8126 0.4115 0.7394 0.0209 -0.0362 0.0590 277 PHE A CD2 3733 C CE1 . PHE A 248 ? 0.7968 0.4209 0.7511 0.0135 -0.0551 0.0641 277 PHE A CE1 3734 C CE2 . PHE A 248 ? 0.8297 0.4248 0.7402 0.0153 -0.0400 0.0547 277 PHE A CE2 3735 C CZ . PHE A 248 ? 0.8188 0.4263 0.7436 0.0121 -0.0487 0.0573 277 PHE A CZ 3745 N N . ARG A 249 ? 0.9455 0.5319 0.9321 0.0396 0.0029 0.0914 278 ARG A N 3746 C CA . ARG A 249 ? 0.9639 0.5317 0.9265 0.0414 0.0220 0.0893 278 ARG A CA 3747 C C . ARG A 249 ? 0.9591 0.5213 0.9031 0.0336 0.0135 0.0837 278 ARG A C 3748 O O . ARG A 249 ? 0.9811 0.5512 0.9446 0.0321 0.0113 0.0910 278 ARG A O 3749 C CB . ARG A 249 ? 0.9634 0.5368 0.9533 0.0494 0.0440 0.1024 278 ARG A CB 3752 N N . PRO A 250 ? 0.6574 0.2087 0.5649 0.0281 0.0082 0.0715 279 PRO A N 3753 C CA . PRO A 250 ? 0.6189 0.1683 0.5096 0.0206 -0.0003 0.0663 279 PRO A CA 3754 C C . PRO A 250 ? 0.7899 0.3227 0.6702 0.0221 0.0163 0.0707 279 PRO A C 3755 O O . PRO A 250 ? 0.8113 0.3313 0.6885 0.0291 0.0370 0.0754 279 PRO A O 3756 C CB . PRO A 250 ? 0.6239 0.1660 0.4802 0.0151 -0.0082 0.0546 279 PRO A CB 3757 C CG . PRO A 250 ? 0.7812 0.3105 0.6261 0.0204 0.0034 0.0539 279 PRO A CG 3758 C CD . PRO A 250 ? 0.6286 0.1706 0.5103 0.0279 0.0084 0.0629 279 PRO A CD 3766 N N . ILE A 251 ? 1.1264 0.6605 1.0009 0.0159 0.0085 0.0691 280 ILE A N 3767 C CA . ILE A 251 ? 1.1655 0.6842 1.0292 0.0165 0.0235 0.0732 280 ILE A CA 3768 C C . ILE A 251 ? 1.1942 0.6850 1.0125 0.0162 0.0359 0.0662 280 ILE A C 3769 O O . ILE A 251 ? 1.2110 0.6838 1.0170 0.0206 0.0568 0.0703 280 ILE A O 3770 C CB . ILE A 251 ? 1.1707 0.6975 1.0374 0.0091 0.0100 0.0724 280 ILE A CB 3771 C CG1 . ILE A 251 ? 1.1795 0.7080 1.0203 0.0011 -0.0076 0.0606 280 ILE A CG1 3772 C CG2 . ILE A 251 ? 1.1731 0.7231 1.0811 0.0091 -0.0013 0.0805 280 ILE A CG2 3773 C CD1 . ILE A 251 ? 1.1559 0.6916 0.9958 -0.0058 -0.0193 0.0589 280 ILE A CD1 3785 N N . ALA A 256 ? 1.3519 0.7355 0.9397 -0.0246 -0.0025 0.0284 285 ALA A N 3786 C CA . ALA A 256 ? 1.3482 0.7311 0.9167 -0.0355 -0.0243 0.0254 285 ALA A CA 3787 C C . ALA A 256 ? 1.2916 0.7125 0.9002 -0.0379 -0.0441 0.0261 285 ALA A C 3788 O O . ALA A 256 ? 1.2810 0.7133 0.8968 -0.0432 -0.0563 0.0267 285 ALA A O 3789 C CB . ALA A 256 ? 1.3742 0.7389 0.9181 -0.0403 -0.0224 0.0258 285 ALA A CB 3794 N N . PHE A 257 ? 1.4120 0.8510 1.0449 -0.0336 -0.0461 0.0259 286 PHE A N 3795 C CA . PHE A 257 ? 1.3408 0.8137 1.0096 -0.0343 -0.0617 0.0265 286 PHE A CA 3796 C C . PHE A 257 ? 1.3178 0.7984 0.9894 -0.0347 -0.0702 0.0249 286 PHE A C 3797 O O . PHE A 257 ? 1.3446 0.8089 0.9997 -0.0320 -0.0614 0.0238 286 PHE A O 3798 C CB . PHE A 257 ? 1.2932 0.7868 1.0005 -0.0272 -0.0543 0.0294 286 PHE A CB 3801 N N . HIS A 258 ? 1.1969 0.7015 0.8890 -0.0376 -0.0864 0.0254 287 HIS A N 3802 C CA . HIS A 258 ? 1.1734 0.6894 0.8741 -0.0376 -0.0948 0.0250 287 HIS A CA 3803 C C . HIS A 258 ? 1.1260 0.6690 0.8641 -0.0311 -0.0939 0.0255 287 HIS A C 3804 O O . HIS A 258 ? 1.1123 0.6761 0.8703 -0.0322 -0.1045 0.0265 287 HIS A O 3805 C CB . HIS A 258 ? 1.1634 0.6843 0.8586 -0.0457 -0.1135 0.0266 287 HIS A CB 3808 N N . VAL A 259 ? 0.8692 0.4099 0.6155 -0.0242 -0.0809 0.0254 288 VAL A N 3809 C CA . VAL A 259 ? 0.8504 0.4130 0.6297 -0.0183 -0.0796 0.0267 288 VAL A CA 3810 C C . VAL A 259 ? 0.8165 0.3959 0.6087 -0.0177 -0.0889 0.0258 288 VAL A C 3811 O O . VAL A 259 ? 0.8722 0.4437 0.6508 -0.0192 -0.0907 0.0248 288 VAL A O 3812 C CB . VAL A 259 ? 0.9007 0.4550 0.6870 -0.0111 -0.0633 0.0289 288 VAL A CB 3813 C CG1 . VAL A 259 ? 0.8901 0.4660 0.7104 -0.0062 -0.0645 0.0316 288 VAL A CG1 3814 C CG2 . VAL A 259 ? 0.9444 0.4799 0.7175 -0.0108 -0.0513 0.0308 288 VAL A CG2 3824 N N . VAL A 260 ? 0.6018 0.2026 0.4184 -0.0157 -0.0947 0.0265 289 VAL A N 3825 C CA . VAL A 260 ? 0.5574 0.1736 0.3876 -0.0138 -0.1011 0.0261 289 VAL A CA 3826 C C . VAL A 260 ? 0.5335 0.1548 0.3794 -0.0076 -0.0940 0.0269 289 VAL A C 3827 O O . VAL A 260 ? 0.5378 0.1643 0.3979 -0.0051 -0.0912 0.0289 289 VAL A O 3828 C CB . VAL A 260 ? 0.5558 0.1893 0.3998 -0.0151 -0.1111 0.0265 289 VAL A CB 3829 C CG1 . VAL A 260 ? 0.5528 0.1991 0.4082 -0.0127 -0.1156 0.0264 289 VAL A CG1 3830 C CG2 . VAL A 260 ? 0.5736 0.2031 0.4063 -0.0211 -0.1185 0.0273 289 VAL A CG2 3840 N N . HIS A 261 ? 0.7253 0.3451 0.5695 -0.0055 -0.0924 0.0263 290 HIS A N 3841 C CA . HIS A 261 ? 0.7210 0.3447 0.5800 0.0003 -0.0862 0.0279 290 HIS A CA 3842 C C . HIS A 261 ? 0.6884 0.3301 0.5629 0.0017 -0.0944 0.0275 290 HIS A C 3843 O O . HIS A 261 ? 0.6925 0.3421 0.5656 -0.0010 -0.1028 0.0261 290 HIS A O 3844 C CB . HIS A 261 ? 0.7495 0.3578 0.5957 0.0024 -0.0776 0.0275 290 HIS A CB 3845 C CG . HIS A 261 ? 0.7818 0.3685 0.6108 0.0025 -0.0663 0.0282 290 HIS A CG 3846 N ND1 . HIS A 261 ? 0.8118 0.3790 0.6122 -0.0009 -0.0643 0.0258 290 HIS A ND1 3847 C CD2 . HIS A 261 ? 0.7963 0.3761 0.6313 0.0055 -0.0560 0.0316 290 HIS A CD2 3848 C CE1 . HIS A 261 ? 0.8402 0.3881 0.6264 0.0003 -0.0524 0.0268 290 HIS A CE1 3849 N NE2 . HIS A 261 ? 0.8299 0.3857 0.6384 0.0046 -0.0465 0.0307 290 HIS A NE2 3856 N N . GLY A 262 ? 0.5826 0.2294 0.4717 0.0061 -0.0915 0.0297 291 GLY A N 3857 C CA . GLY A 262 ? 0.5368 0.1980 0.4383 0.0072 -0.0992 0.0296 291 GLY A CA 3858 C C . GLY A 262 ? 0.5093 0.1724 0.4137 0.0100 -0.0984 0.0296 291 GLY A C 3859 O O . GLY A 262 ? 0.4976 0.1696 0.4050 0.0100 -0.1049 0.0285 291 GLY A O 3863 N N . ARG A 263 ? 0.8475 0.5008 0.7503 0.0129 -0.0895 0.0311 292 ARG A N 3864 C CA . ARG A 263 ? 0.8250 0.4794 0.7309 0.0158 -0.0883 0.0315 292 ARG A CA 3865 C C . ARG A 263 ? 0.8074 0.4597 0.6984 0.0131 -0.0919 0.0278 292 ARG A C 3866 O O . ARG A 263 ? 0.8189 0.4587 0.6939 0.0110 -0.0885 0.0265 292 ARG A O 3867 C CB . ARG A 263 ? 0.8318 0.4745 0.7412 0.0206 -0.0761 0.0351 292 ARG A CB 3868 C CG . ARG A 263 ? 0.8339 0.4774 0.7483 0.0241 -0.0741 0.0361 292 ARG A CG 3869 C CD . ARG A 263 ? 0.8296 0.4878 0.7641 0.0256 -0.0811 0.0396 292 ARG A CD 3870 N NE . ARG A 263 ? 0.8349 0.4935 0.7740 0.0289 -0.0794 0.0410 292 ARG A NE 3871 C CZ . ARG A 263 ? 0.8374 0.5004 0.7689 0.0272 -0.0855 0.0372 292 ARG A CZ 3872 N NH1 . ARG A 263 ? 0.8294 0.4967 0.7500 0.0229 -0.0929 0.0327 292 ARG A NH1 3873 N NH2 . ARG A 263 ? 0.8427 0.5055 0.7788 0.0302 -0.0835 0.0389 292 ARG A NH2 3887 N N . CYS A 264 ? 0.7669 0.4300 0.6626 0.0129 -0.0990 0.0270 293 CYS A N 3888 C CA . CYS A 264 ? 0.7602 0.4232 0.6464 0.0103 -0.1031 0.0254 293 CYS A CA 3889 C C . CYS A 264 ? 0.7600 0.4151 0.6396 0.0115 -0.0993 0.0252 293 CYS A C 3890 O O . CYS A 264 ? 0.7693 0.4266 0.6571 0.0153 -0.0965 0.0262 293 CYS A O 3891 C CB . CYS A 264 ? 0.7528 0.4278 0.6465 0.0106 -0.1096 0.0254 293 CYS A CB 3892 S SG . CYS A 264 ? 0.6327 0.3142 0.5300 0.0091 -0.1141 0.0253 293 CYS A SG 3897 N N . MET A 265 ? 0.6649 0.3098 0.5290 0.0077 -0.1002 0.0244 294 MET A N 3898 C CA . MET A 265 ? 0.6755 0.3129 0.5307 0.0074 -0.0994 0.0242 294 MET A CA 3899 C C . MET A 265 ? 0.6683 0.3174 0.5307 0.0062 -0.1071 0.0251 294 MET A C 3900 O O . MET A 265 ? 0.6785 0.3274 0.5360 0.0015 -0.1136 0.0264 294 MET A O 3901 C CB . MET A 265 ? 0.7039 0.3233 0.5366 0.0026 -0.0993 0.0235 294 MET A CB 3902 C CG . MET A 265 ? 0.7311 0.3346 0.5530 0.0044 -0.0890 0.0227 294 MET A CG 3903 S SD . MET A 265 ? 0.8650 0.4432 0.6530 -0.0024 -0.0902 0.0215 294 MET A SD 3904 C CE . MET A 265 ? 0.9514 0.5196 0.7266 -0.0034 -0.0917 0.0212 294 MET A CE 3914 N N . CYS A 266 ? 0.6454 0.3038 0.5200 0.0103 -0.1062 0.0254 295 CYS A N 3915 C CA . CYS A 266 ? 0.6160 0.2849 0.4979 0.0103 -0.1114 0.0265 295 CYS A CA 3916 C C . CYS A 266 ? 0.6109 0.2763 0.4873 0.0081 -0.1140 0.0277 295 CYS A C 3917 O O . CYS A 266 ? 0.6544 0.3111 0.5234 0.0085 -0.1112 0.0270 295 CYS A O 3918 C CB . CYS A 266 ? 0.6049 0.2811 0.4971 0.0147 -0.1103 0.0264 295 CYS A CB 3919 S SG . CYS A 266 ? 0.8375 0.5194 0.7373 0.0158 -0.1113 0.0262 295 CYS A SG 3924 N N . LYS A 267 ? 0.6058 0.2775 0.4871 0.0060 -0.1189 0.0304 296 LYS A N 3925 C CA . LYS A 267 ? 0.6185 0.2892 0.4992 0.0037 -0.1224 0.0332 296 LYS A CA 3926 C C . LYS A 267 ? 0.6183 0.2985 0.5103 0.0074 -0.1212 0.0351 296 LYS A C 3927 O O . LYS A 267 ? 0.6219 0.3065 0.5179 0.0114 -0.1182 0.0333 296 LYS A O 3928 C CB . LYS A 267 ? 0.6288 0.2971 0.5076 -0.0026 -0.1291 0.0370 296 LYS A CB 3929 C CG . LYS A 267 ? 0.6534 0.3075 0.5157 -0.0081 -0.1331 0.0369 296 LYS A CG 3930 C CD . LYS A 267 ? 0.6680 0.3098 0.5150 -0.0073 -0.1278 0.0324 296 LYS A CD 3931 C CE . LYS A 267 ? 0.6879 0.3106 0.5127 -0.0121 -0.1302 0.0319 296 LYS A CE 3932 N NZ . LYS A 267 ? 0.6925 0.3107 0.5109 -0.0207 -0.1416 0.0360 296 LYS A NZ 3946 N N . HIS A 268 ? 0.4858 0.1674 0.3815 0.0057 -0.1236 0.0392 297 HIS A N 3947 C CA . HIS A 268 ? 0.4784 0.1665 0.3834 0.0095 -0.1208 0.0420 297 HIS A CA 3948 C C . HIS A 268 ? 0.4747 0.1623 0.3766 0.0140 -0.1173 0.0383 297 HIS A C 3949 O O . HIS A 268 ? 0.4720 0.1621 0.3766 0.0178 -0.1144 0.0388 297 HIS A O 3950 C CB . HIS A 268 ? 0.4769 0.1701 0.3895 0.0118 -0.1181 0.0443 297 HIS A CB 3951 C CG . HIS A 268 ? 0.4789 0.1742 0.3985 0.0078 -0.1215 0.0496 297 HIS A CG 3952 N ND1 . HIS A 268 ? 0.4735 0.1725 0.4003 0.0096 -0.1189 0.0522 297 HIS A ND1 3953 C CD2 . HIS A 268 ? 0.4829 0.1765 0.4035 0.0015 -0.1282 0.0535 297 HIS A CD2 3954 C CE1 . HIS A 268 ? 0.4743 0.1755 0.4087 0.0048 -0.1237 0.0579 297 HIS A CE1 3955 N NE2 . HIS A 268 ? 0.4783 0.1761 0.4086 -0.0007 -0.1303 0.0588 297 HIS A NE2 3962 N N . ASN A 269 ? 0.4615 0.1440 0.3568 0.0135 -0.1176 0.0353 298 ASN A N 3963 C CA . ASN A 269 ? 0.4607 0.1431 0.3557 0.0173 -0.1153 0.0331 298 ASN A CA 3964 C C . ASN A 269 ? 0.4565 0.1420 0.3542 0.0201 -0.1143 0.0312 298 ASN A C 3965 O O . ASN A 269 ? 0.4565 0.1426 0.3549 0.0225 -0.1145 0.0309 298 ASN A O 3966 C CB . ASN A 269 ? 0.4606 0.1446 0.3577 0.0185 -0.1152 0.0356 298 ASN A CB 3967 C CG . ASN A 269 ? 0.4657 0.1467 0.3615 0.0149 -0.1176 0.0385 298 ASN A CG 3968 O OD1 . ASN A 269 ? 0.4728 0.1471 0.3614 0.0125 -0.1191 0.0370 298 ASN A OD1 3969 N ND2 . ASN A 269 ? 0.8832 0.5677 0.7854 0.0147 -0.1177 0.0434 298 ASN A ND2 3976 N N . THR A 270 ? 0.5656 0.2518 0.4636 0.0191 -0.1145 0.0303 299 THR A N 3977 C CA . THR A 270 ? 0.5471 0.2351 0.4471 0.0207 -0.1150 0.0290 299 THR A CA 3978 C C . THR A 270 ? 0.5577 0.2439 0.4605 0.0212 -0.1138 0.0280 299 THR A C 3979 O O . THR A 270 ? 0.5723 0.2540 0.4733 0.0211 -0.1108 0.0279 299 THR A O 3980 C CB . THR A 270 ? 0.5194 0.2092 0.4195 0.0197 -0.1154 0.0292 299 THR A CB 3981 O OG1 . THR A 270 ? 0.5094 0.1980 0.4086 0.0168 -0.1154 0.0293 299 THR A OG1 3982 C CG2 . THR A 270 ? 0.5140 0.2043 0.4141 0.0209 -0.1140 0.0318 299 THR A CG2 3990 N N . ALA A 271 ? 0.5201 0.2081 0.4270 0.0219 -0.1156 0.0280 300 ALA A N 3991 C CA . ALA A 271 ? 0.5163 0.2033 0.4305 0.0229 -0.1138 0.0292 300 ALA A CA 3992 C C . ALA A 271 ? 0.5138 0.2031 0.4324 0.0220 -0.1176 0.0298 300 ALA A C 3993 O O . ALA A 271 ? 0.5124 0.2025 0.4258 0.0208 -0.1216 0.0287 300 ALA A O 3994 C CB . ALA A 271 ? 0.5202 0.2069 0.4409 0.0253 -0.1136 0.0313 300 ALA A CB 4000 N N . GLY A 272 ? 0.7236 0.4125 0.6518 0.0229 -0.1155 0.0324 301 GLY A N 4001 C CA . GLY A 272 ? 0.7120 0.4030 0.6463 0.0213 -0.1197 0.0340 301 GLY A CA 4002 C C . GLY A 272 ? 0.7031 0.3922 0.6342 0.0203 -0.1156 0.0326 301 GLY A C 4003 O O . GLY A 272 ? 0.7087 0.3947 0.6305 0.0198 -0.1116 0.0300 301 GLY A O 4007 N N . SER A 273 ? 0.7408 0.4313 0.6796 0.0192 -0.1177 0.0349 302 SER A N 4008 C CA . SER A 273 ? 0.7368 0.4247 0.6731 0.0182 -0.1138 0.0342 302 SER A CA 4009 C C . SER A 273 ? 0.7143 0.4024 0.6377 0.0158 -0.1158 0.0299 302 SER A C 4010 O O . SER A 273 ? 0.7110 0.3957 0.6290 0.0145 -0.1124 0.0287 302 SER A O 4011 C CB . SER A 273 ? 0.7525 0.4430 0.7010 0.0170 -0.1174 0.0383 302 SER A CB 4012 O OG . SER A 273 ? 0.7550 0.4490 0.7044 0.0146 -0.1279 0.0388 302 SER A OG 4018 N N . HIS A 274 ? 0.4872 0.1779 0.4056 0.0154 -0.1209 0.0283 303 HIS A N 4019 C CA . HIS A 274 ? 0.4737 0.1646 0.3836 0.0142 -0.1215 0.0262 303 HIS A CA 4020 C C . HIS A 274 ? 0.4612 0.1523 0.3664 0.0155 -0.1210 0.0257 303 HIS A C 4021 O O . HIS A 274 ? 0.4612 0.1521 0.3623 0.0158 -0.1211 0.0255 303 HIS A O 4022 C CB . HIS A 274 ? 0.4880 0.1786 0.3960 0.0131 -0.1260 0.0259 303 HIS A CB 4023 C CG . HIS A 274 ? 0.4955 0.1864 0.4103 0.0115 -0.1279 0.0275 303 HIS A CG 4024 N ND1 . HIS A 274 ? 0.4993 0.1897 0.4164 0.0107 -0.1238 0.0278 303 HIS A ND1 4025 C CD2 . HIS A 274 ? 0.5040 0.1945 0.4238 0.0101 -0.1340 0.0296 303 HIS A CD2 4026 C CE1 . HIS A 274 ? 0.5077 0.1983 0.4327 0.0096 -0.1257 0.0303 303 HIS A CE1 4027 N NE2 . HIS A 274 ? 0.5118 0.2033 0.4399 0.0089 -0.1327 0.0318 303 HIS A NE2 4034 N N . CYS A 275 ? 0.5452 0.2359 0.4521 0.0168 -0.1195 0.0262 304 CYS A N 4035 C CA . CYS A 275 ? 0.5442 0.2350 0.4478 0.0179 -0.1188 0.0263 304 CYS A CA 4036 C C . CYS A 275 ? 0.5485 0.2375 0.4478 0.0192 -0.1212 0.0263 304 CYS A C 4037 O O . CYS A 275 ? 0.5548 0.2425 0.4504 0.0206 -0.1192 0.0270 304 CYS A O 4038 C CB . CYS A 275 ? 0.5478 0.2388 0.4491 0.0164 -0.1171 0.0269 304 CYS A CB 4039 S SG . CYS A 275 ? 0.6031 0.2902 0.5017 0.0134 -0.1157 0.0267 304 CYS A SG 4044 N N . GLN A 276 ? 0.5304 0.2174 0.4291 0.0186 -0.1256 0.0262 305 GLN A N 4045 C CA . GLN A 276 ? 0.5381 0.2181 0.4269 0.0190 -0.1289 0.0260 305 GLN A CA 4046 C C . GLN A 276 ? 0.5600 0.2374 0.4463 0.0200 -0.1304 0.0267 305 GLN A C 4047 O O . GLN A 276 ? 0.5686 0.2375 0.4428 0.0208 -0.1312 0.0265 305 GLN A O 4048 C CB . GLN A 276 ? 0.5445 0.2209 0.4318 0.0165 -0.1359 0.0263 305 GLN A CB 4049 C CG . GLN A 276 ? 0.5437 0.2236 0.4430 0.0146 -0.1414 0.0290 305 GLN A CG 4050 C CD . GLN A 276 ? 0.5346 0.2217 0.4478 0.0147 -0.1375 0.0302 305 GLN A CD 4051 O OE1 . GLN A 276 ? 0.5292 0.2181 0.4408 0.0154 -0.1316 0.0284 305 GLN A OE1 4052 N NE2 . GLN A 276 ? 0.5354 0.2250 0.4622 0.0139 -0.1404 0.0343 305 GLN A NE2 4061 N N . HIS A 277 ? 0.7186 0.4013 0.6148 0.0201 -0.1300 0.0277 306 HIS A N 4062 C CA . HIS A 277 ? 0.7121 0.3933 0.6080 0.0209 -0.1316 0.0288 306 HIS A CA 4063 C C . HIS A 277 ? 0.6891 0.3724 0.5847 0.0228 -0.1257 0.0284 306 HIS A C 4064 O O . HIS A 277 ? 0.6873 0.3736 0.5848 0.0227 -0.1214 0.0280 306 HIS A O 4065 C CB . HIS A 277 ? 0.7076 0.3924 0.6168 0.0204 -0.1346 0.0315 306 HIS A CB 4066 C CG . HIS A 277 ? 0.7203 0.4043 0.6345 0.0178 -0.1419 0.0338 306 HIS A CG 4067 N ND1 . HIS A 277 ? 0.7416 0.4176 0.6433 0.0151 -0.1493 0.0332 306 HIS A ND1 4068 C CD2 . HIS A 277 ? 0.7263 0.4148 0.6562 0.0172 -0.1430 0.0375 306 HIS A CD2 4069 C CE1 . HIS A 277 ? 0.7500 0.4267 0.6600 0.0120 -0.1566 0.0363 306 HIS A CE1 4070 N NE2 . HIS A 277 ? 0.7401 0.4256 0.6694 0.0133 -0.1525 0.0395 306 HIS A NE2 4077 N N . CYS A 278 ? 0.5370 0.2177 0.4298 0.0237 -0.1267 0.0292 307 CYS A N 4078 C CA . CYS A 278 ? 0.5335 0.2164 0.4281 0.0249 -0.1226 0.0296 307 CYS A CA 4079 C C . CYS A 278 ? 0.5309 0.2165 0.4345 0.0252 -0.1222 0.0303 307 CYS A C 4080 O O . CYS A 278 ? 0.5327 0.2188 0.4430 0.0251 -0.1255 0.0318 307 CYS A O 4081 C CB . CYS A 278 ? 0.5409 0.2184 0.4272 0.0261 -0.1228 0.0304 307 CYS A CB 4082 S SG . CYS A 278 ? 0.5456 0.2184 0.4236 0.0280 -0.1169 0.0315 307 CYS A SG 4087 N N . ALA A 279 ? 0.4681 0.1541 0.3721 0.0255 -0.1181 0.0302 308 ALA A N 4088 C CA . ALA A 279 ? 0.4698 0.1546 0.3793 0.0268 -0.1156 0.0311 308 ALA A CA 4089 C C . ALA A 279 ? 0.4947 0.1795 0.4078 0.0282 -0.1188 0.0330 308 ALA A C 4090 O O . ALA A 279 ? 0.4924 0.1761 0.3994 0.0277 -0.1222 0.0328 308 ALA A O 4091 C CB . ALA A 279 ? 0.6084 0.2899 0.5126 0.0260 -0.1121 0.0305 308 ALA A CB 4097 N N . PRO A 280 ? 0.5307 0.2154 0.4540 0.0301 -0.1172 0.0355 309 PRO A N 4098 C CA . PRO A 280 ? 0.4973 0.1827 0.4274 0.0309 -0.1220 0.0387 309 PRO A CA 4099 C C . PRO A 280 ? 0.4996 0.1829 0.4220 0.0309 -0.1234 0.0380 309 PRO A C 4100 O O . PRO A 280 ? 0.5042 0.1864 0.4256 0.0299 -0.1299 0.0396 309 PRO A O 4101 C CB . PRO A 280 ? 0.4998 0.1849 0.4442 0.0344 -0.1161 0.0427 309 PRO A CB 4102 C CG . PRO A 280 ? 0.5006 0.1809 0.4392 0.0355 -0.1071 0.0402 309 PRO A CG 4103 C CD . PRO A 280 ? 0.4957 0.1777 0.4248 0.0321 -0.1101 0.0365 309 PRO A CD 4111 N N . LEU A 281 ? 0.6044 0.2859 0.5206 0.0313 -0.1183 0.0360 310 LEU A N 4112 C CA . LEU A 281 ? 0.6159 0.2955 0.5261 0.0312 -0.1191 0.0359 310 LEU A CA 4113 C C . LEU A 281 ? 0.6027 0.2819 0.5032 0.0295 -0.1195 0.0346 310 LEU A C 4114 O O . LEU A 281 ? 0.6091 0.2868 0.5056 0.0293 -0.1184 0.0352 310 LEU A O 4115 C CB . LEU A 281 ? 0.6335 0.3097 0.5440 0.0325 -0.1139 0.0361 310 LEU A CB 4116 C CG . LEU A 281 ? 0.6479 0.3219 0.5549 0.0327 -0.1147 0.0368 310 LEU A CG 4117 C CD1 . LEU A 281 ? 0.6454 0.3206 0.5573 0.0338 -0.1195 0.0392 310 LEU A CD1 4118 C CD2 . LEU A 281 ? 0.6583 0.3262 0.5641 0.0340 -0.1094 0.0368 310 LEU A CD2 4130 N N . TYR A 282 ? 0.5268 0.2069 0.4250 0.0286 -0.1202 0.0337 311 TYR A N 4131 C CA . TYR A 282 ? 0.5266 0.2060 0.4188 0.0281 -0.1182 0.0339 311 TYR A CA 4132 C C . TYR A 282 ? 0.5327 0.2076 0.4173 0.0286 -0.1200 0.0337 311 TYR A C 4133 O O . TYR A 282 ? 0.5433 0.2176 0.4255 0.0288 -0.1175 0.0337 311 TYR A O 4134 C CB . TYR A 282 ? 0.5213 0.2035 0.4162 0.0267 -0.1158 0.0334 311 TYR A CB 4135 C CG . TYR A 282 ? 0.5216 0.2030 0.4173 0.0252 -0.1146 0.0339 311 TYR A CG 4136 C CD1 . TYR A 282 ? 0.5242 0.2028 0.4208 0.0257 -0.1136 0.0328 311 TYR A CD1 4137 C CD2 . TYR A 282 ? 0.5220 0.2035 0.4174 0.0233 -0.1142 0.0365 311 TYR A CD2 4138 C CE1 . TYR A 282 ? 0.5294 0.2030 0.4219 0.0241 -0.1124 0.0329 311 TYR A CE1 4139 C CE2 . TYR A 282 ? 0.5259 0.2042 0.4193 0.0206 -0.1153 0.0372 311 TYR A CE2 4140 C CZ . TYR A 282 ? 0.5308 0.2037 0.4203 0.0209 -0.1145 0.0348 311 TYR A CZ 4141 O OH . TYR A 282 ? 0.5395 0.2050 0.4222 0.0180 -0.1155 0.0352 311 TYR A OH 4151 N N . ASN A 283 ? 0.5180 0.1878 0.3976 0.0285 -0.1247 0.0340 312 ASN A N 4152 C CA . ASN A 283 ? 0.5306 0.1906 0.3969 0.0282 -0.1277 0.0337 312 ASN A CA 4153 C C . ASN A 283 ? 0.5671 0.2174 0.4204 0.0297 -0.1250 0.0350 312 ASN A C 4154 O O . ASN A 283 ? 0.5881 0.2267 0.4273 0.0288 -0.1300 0.0350 312 ASN A O 4155 C CB . ASN A 283 ? 0.5366 0.1941 0.4036 0.0257 -0.1371 0.0341 312 ASN A CB 4156 C CG . ASN A 283 ? 0.5268 0.1927 0.4074 0.0247 -0.1385 0.0340 312 ASN A CG 4157 O OD1 . ASN A 283 ? 0.5275 0.1919 0.4046 0.0239 -0.1387 0.0329 312 ASN A OD1 4158 N ND2 . ASN A 283 ? 0.5195 0.1927 0.4152 0.0253 -0.1383 0.0357 312 ASN A ND2 4165 N N . ASP A 284 ? 0.5514 0.2049 0.4087 0.0317 -0.1177 0.0368 313 ASP A N 4166 C CA . ASP A 284 ? 0.5700 0.2145 0.4174 0.0339 -0.1131 0.0393 313 ASP A CA 4167 C C . ASP A 284 ? 0.5884 0.2216 0.4234 0.0366 -0.1064 0.0406 313 ASP A C 4168 O O . ASP A 284 ? 0.6155 0.2346 0.4349 0.0386 -0.1028 0.0421 313 ASP A O 4169 C CB . ASP A 284 ? 0.5562 0.2086 0.4154 0.0347 -0.1082 0.0424 313 ASP A CB 4170 C CG . ASP A 284 ? 0.5616 0.2054 0.4135 0.0373 -0.1025 0.0463 313 ASP A CG 4171 O OD1 . ASP A 284 ? 0.5462 0.1847 0.3908 0.0368 -0.1060 0.0458 313 ASP A OD1 4172 O OD2 . ASP A 284 ? 0.5614 0.2032 0.4158 0.0402 -0.0939 0.0509 313 ASP A OD2 4177 N N . ARG A 285 ? 0.5429 0.1806 0.3837 0.0370 -0.1039 0.0402 314 ARG A N 4178 C CA . ARG A 285 ? 0.5565 0.1829 0.3863 0.0400 -0.0967 0.0416 314 ARG A CA 4179 C C . ARG A 285 ? 0.5541 0.1813 0.3822 0.0380 -0.1014 0.0382 314 ARG A C 4180 O O . ARG A 285 ? 0.5407 0.1802 0.3811 0.0349 -0.1077 0.0361 314 ARG A O 4181 C CB . ARG A 285 ? 0.5511 0.1830 0.3951 0.0437 -0.0857 0.0479 314 ARG A CB 4182 C CG . ARG A 285 ? 0.5343 0.1796 0.3960 0.0425 -0.0856 0.0490 314 ARG A CG 4183 C CD . ARG A 285 ? 0.5314 0.1817 0.4094 0.0456 -0.0763 0.0576 314 ARG A CD 4184 N NE . ARG A 285 ? 0.5661 0.2276 0.4594 0.0437 -0.0776 0.0593 314 ARG A NE 4185 C CZ . ARG A 285 ? 0.5613 0.2282 0.4715 0.0455 -0.0714 0.0680 314 ARG A CZ 4186 N NH1 . ARG A 285 ? 0.5690 0.2321 0.4857 0.0501 -0.0619 0.0767 314 ARG A NH1 4187 N NH2 . ARG A 285 ? 0.5058 0.1815 0.4270 0.0426 -0.0747 0.0691 314 ARG A NH2 4201 N N . PRO A 286 ? 0.6172 0.2298 0.4287 0.0399 -0.0976 0.0378 315 PRO A N 4202 C CA . PRO A 286 ? 0.6005 0.2120 0.4080 0.0374 -0.1034 0.0345 315 PRO A CA 4203 C C . PRO A 286 ? 0.5736 0.2015 0.4020 0.0373 -0.1010 0.0352 315 PRO A C 4204 O O . PRO A 286 ? 0.5552 0.1886 0.3953 0.0404 -0.0923 0.0394 315 PRO A O 4205 C CB . PRO A 286 ? 0.6236 0.2128 0.4060 0.0402 -0.0975 0.0344 315 PRO A CB 4206 C CG . PRO A 286 ? 0.6164 0.2007 0.3993 0.0459 -0.0842 0.0392 315 PRO A CG 4207 C CD . PRO A 286 ? 0.6042 0.1990 0.3990 0.0447 -0.0870 0.0407 315 PRO A CD 4215 N N . TRP A 287 ? 0.5710 0.2057 0.4043 0.0336 -0.1092 0.0322 316 TRP A N 4216 C CA . TRP A 287 ? 0.5544 0.2020 0.4035 0.0328 -0.1081 0.0323 316 TRP A CA 4217 C C . TRP A 287 ? 0.5607 0.2029 0.4069 0.0358 -0.1002 0.0343 316 TRP A C 4218 O O . TRP A 287 ? 0.5801 0.2065 0.4086 0.0381 -0.0972 0.0340 316 TRP A O 4219 C CB . TRP A 287 ? 0.5491 0.2016 0.4016 0.0287 -0.1173 0.0294 316 TRP A CB 4220 C CG . TRP A 287 ? 0.5553 0.2176 0.4196 0.0277 -0.1162 0.0291 316 TRP A CG 4221 C CD1 . TRP A 287 ? 0.5400 0.2137 0.4180 0.0261 -0.1167 0.0291 316 TRP A CD1 4222 C CD2 . TRP A 287 ? 0.5676 0.2267 0.4284 0.0279 -0.1146 0.0287 316 TRP A CD2 4223 N NE1 . TRP A 287 ? 0.5339 0.2115 0.4166 0.0250 -0.1159 0.0288 316 TRP A NE1 4224 C CE2 . TRP A 287 ? 0.5457 0.2159 0.4197 0.0262 -0.1147 0.0287 316 TRP A CE2 4225 C CE3 . TRP A 287 ? 0.5924 0.2383 0.4381 0.0295 -0.1127 0.0283 316 TRP A CE3 4226 C CZ2 . TRP A 287 ? 0.5466 0.2170 0.4214 0.0258 -0.1136 0.0285 316 TRP A CZ2 4227 C CZ3 . TRP A 287 ? 0.5920 0.2381 0.4388 0.0296 -0.1110 0.0281 316 TRP A CZ3 4228 C CH2 . TRP A 287 ? 0.5678 0.2272 0.4304 0.0277 -0.1117 0.0283 316 TRP A CH2 4239 N N . GLU A 288 ? 0.7128 0.3662 0.5751 0.0359 -0.0971 0.0365 317 GLU A N 4240 C CA . GLU A 288 ? 0.7355 0.3859 0.5998 0.0388 -0.0900 0.0395 317 GLU A CA 4241 C C . GLU A 288 ? 0.7227 0.3865 0.6035 0.0362 -0.0920 0.0406 317 GLU A C 4242 O O . GLU A 288 ? 0.7223 0.3960 0.6143 0.0336 -0.0949 0.0417 317 GLU A O 4243 C CB . GLU A 288 ? 0.7695 0.4143 0.6367 0.0444 -0.0785 0.0462 317 GLU A CB 4244 C CG . GLU A 288 ? 0.8074 0.4483 0.6796 0.0487 -0.0692 0.0510 317 GLU A CG 4245 C CD . GLU A 288 ? 0.8421 0.4779 0.7220 0.0551 -0.0563 0.0599 317 GLU A CD 4246 O OE1 . GLU A 288 ? 0.8661 0.4988 0.7539 0.0597 -0.0472 0.0658 317 GLU A OE1 4247 O OE2 . GLU A 288 ? 0.8328 0.4680 0.7127 0.0558 -0.0551 0.0618 317 GLU A OE2 4254 N N . ALA A 289 ? 0.6929 0.3548 0.5726 0.0364 -0.0911 0.0401 318 ALA A N 4255 C CA . ALA A 289 ? 0.6705 0.3428 0.5634 0.0337 -0.0934 0.0414 318 ALA A CA 4256 C C . ALA A 289 ? 0.6674 0.3451 0.5763 0.0356 -0.0873 0.0495 318 ALA A C 4257 O O . ALA A 289 ? 0.6766 0.3486 0.5876 0.0410 -0.0781 0.0552 318 ALA A O 4258 C CB . ALA A 289 ? 0.6745 0.3426 0.5618 0.0335 -0.0939 0.0391 318 ALA A CB 4264 N N . ALA A 290 ? 0.5125 0.1998 0.4324 0.0310 -0.0927 0.0510 319 ALA A N 4265 C CA . ALA A 290 ? 0.5323 0.2254 0.4685 0.0311 -0.0902 0.0600 319 ALA A CA 4266 C C . ALA A 290 ? 0.5858 0.2768 0.5296 0.0356 -0.0824 0.0662 319 ALA A C 4267 O O . ALA A 290 ? 0.6100 0.2982 0.5478 0.0355 -0.0831 0.0623 319 ALA A O 4268 C CB . ALA A 290 ? 0.5179 0.2183 0.4593 0.0235 -0.1001 0.0595 319 ALA A CB 4274 N N . ASP A 291 ? 0.7500 0.4421 0.7076 0.0400 -0.0742 0.0767 320 ASP A N 4275 C CA . ASP A 291 ? 0.7731 0.4621 0.7400 0.0461 -0.0641 0.0848 320 ASP A CA 4276 C C . ASP A 291 ? 0.7698 0.4693 0.7518 0.0409 -0.0713 0.0900 320 ASP A C 4277 O O . ASP A 291 ? 0.7660 0.4740 0.7627 0.0374 -0.0756 0.0974 320 ASP A O 4278 C CB . ASP A 291 ? 0.7894 0.4726 0.7638 0.0547 -0.0498 0.0953 320 ASP A CB 4279 C CG . ASP A 291 ? 0.8106 0.4837 0.7880 0.0642 -0.0344 0.1025 320 ASP A CG 4280 O OD1 . ASP A 291 ? 0.8118 0.4864 0.7917 0.0634 -0.0362 0.1026 320 ASP A OD1 4281 O OD2 . ASP A 291 ? 0.8230 0.4884 0.8049 0.0715 -0.0211 0.1084 320 ASP A OD2 4286 N N . GLY A 292 ? 0.7478 0.4468 0.7263 0.0392 -0.0742 0.0861 321 GLY A N 4287 C CA . GLY A 292 ? 0.7525 0.4604 0.7442 0.0335 -0.0820 0.0907 321 GLY A CA 4288 C C . GLY A 292 ? 0.7621 0.4728 0.7730 0.0386 -0.0741 0.1041 321 GLY A C 4289 O O . GLY A 292 ? 0.7508 0.4729 0.7799 0.0323 -0.0827 0.1115 321 GLY A O 4293 N N . ARG A 293 ? 0.8791 0.5777 0.8847 0.0499 -0.0581 0.1075 322 ARG A N 4294 C CA . ARG A 293 ? 0.9034 0.6004 0.9226 0.0567 -0.0494 0.1198 322 ARG A CA 4295 C C . ARG A 293 ? 0.8870 0.5944 0.9238 0.0544 -0.0522 0.1282 322 ARG A C 4296 O O . ARG A 293 ? 0.8779 0.6024 0.9425 0.0482 -0.0598 0.1380 322 ARG A O 4297 C CB . ARG A 293 ? 0.9462 0.6185 0.9434 0.0700 -0.0326 0.1191 322 ARG A CB 4298 C CG . ARG A 293 ? 0.9965 0.6663 1.0079 0.0758 -0.0281 0.1297 322 ARG A CG 4299 C CD . ARG A 293 ? 1.0303 0.6765 1.0238 0.0835 -0.0225 0.1258 322 ARG A CD 4300 N NE . ARG A 293 ? 1.0559 0.7126 1.0785 0.0898 -0.0074 0.1386 322 ARG A NE 4301 C CZ . ARG A 293 ? 1.0702 0.7288 1.0999 0.0933 0.0020 0.1434 322 ARG A CZ 4302 N NH1 . ARG A 293 ? 1.0698 0.7212 1.0818 0.0899 -0.0058 0.1362 322 ARG A NH1 4303 N NH2 . ARG A 293 ? 1.0784 0.7463 1.1335 0.1008 0.0207 0.1562 322 ARG A NH2 4317 N N . THR A 294 ? 0.7871 0.4850 0.8096 0.0584 -0.0465 0.1250 323 THR A N 4318 C CA . THR A 294 ? 0.7911 0.4977 0.8288 0.0565 -0.0483 0.1324 323 THR A CA 4319 C C . THR A 294 ? 0.7704 0.4943 0.8212 0.0432 -0.0656 0.1317 323 THR A C 4320 O O . THR A 294 ? 0.7618 0.4985 0.8347 0.0382 -0.0712 0.1411 323 THR A O 4321 C CB . THR A 294 ? 0.8167 0.5065 0.8316 0.0635 -0.0392 0.1277 323 THR A CB 4322 O OG1 . THR A 294 ? 0.8451 0.5100 0.8365 0.0741 -0.0281 0.1250 323 THR A OG1 4323 C CG2 . THR A 294 ? 0.8234 0.5219 0.8562 0.0625 -0.0394 0.1369 323 THR A CG2 4331 N N . GLY A 295 ? 0.6088 0.3317 0.6452 0.0370 -0.0748 0.1206 324 GLY A N 4332 C CA . GLY A 295 ? 0.6056 0.3366 0.6431 0.0250 -0.0913 0.1169 324 GLY A CA 4333 C C . GLY A 295 ? 0.6116 0.3385 0.6371 0.0249 -0.0915 0.1115 324 GLY A C 4334 O O . GLY A 295 ? 0.6045 0.3336 0.6251 0.0163 -0.1037 0.1071 324 GLY A O 4338 N N . ALA A 296 ? 0.7472 0.4655 0.7655 0.0347 -0.0779 0.1119 325 ALA A N 4339 C CA . ALA A 296 ? 0.7269 0.4411 0.7349 0.0353 -0.0772 0.1077 325 ALA A CA 4340 C C . ALA A 296 ? 0.7014 0.4125 0.6904 0.0303 -0.0857 0.0938 325 ALA A C 4341 O O . ALA A 296 ? 0.7041 0.4109 0.6825 0.0316 -0.0849 0.0868 325 ALA A O 4342 C CB . ALA A 296 ? 0.7357 0.4377 0.7360 0.0469 -0.0604 0.1104 325 ALA A CB 4348 N N . PRO A 297 ? 0.5462 0.2589 0.5306 0.0248 -0.0938 0.0902 326 PRO A N 4349 C CA . PRO A 297 ? 0.5175 0.2264 0.4840 0.0210 -0.1007 0.0779 326 PRO A CA 4350 C C . PRO A 297 ? 0.5172 0.2187 0.4692 0.0270 -0.0942 0.0708 326 PRO A C 4351 O O . PRO A 297 ? 0.5068 0.2056 0.4469 0.0258 -0.0974 0.0622 326 PRO A O 4352 C CB . PRO A 297 ? 0.5108 0.2211 0.4764 0.0146 -0.1094 0.0778 326 PRO A CB 4353 C CG . PRO A 297 ? 0.5224 0.2394 0.5073 0.0126 -0.1103 0.0900 326 PRO A CG 4354 C CD . PRO A 297 ? 0.5372 0.2546 0.5323 0.0216 -0.0972 0.0973 326 PRO A CD 4362 N N . ASN A 298 ? 0.5216 0.2194 0.4747 0.0327 -0.0857 0.0750 327 ASN A N 4363 C CA . ASN A 298 ? 0.5307 0.2198 0.4682 0.0367 -0.0818 0.0686 327 ASN A CA 4364 C C . ASN A 298 ? 0.5161 0.2059 0.4425 0.0319 -0.0911 0.0594 327 ASN A C 4365 O O . ASN A 298 ? 0.5031 0.1895 0.4181 0.0316 -0.0938 0.0522 327 ASN A O 4366 C CB . ASN A 298 ? 0.5486 0.2301 0.4775 0.0408 -0.0766 0.0658 327 ASN A CB 4367 C CG . ASN A 298 ? 0.5728 0.2498 0.5111 0.0477 -0.0638 0.0756 327 ASN A CG 4368 O OD1 . ASN A 298 ? 0.5854 0.2630 0.5293 0.0491 -0.0610 0.0781 327 ASN A OD1 4369 N ND2 . ASN A 298 ? 0.5802 0.2523 0.5215 0.0527 -0.0550 0.0820 327 ASN A ND2 4376 N N . GLU A 299 ? 0.6531 0.3467 0.5834 0.0283 -0.0958 0.0607 328 GLU A N 4377 C CA . GLU A 299 ? 0.6665 0.3599 0.5881 0.0246 -0.1029 0.0535 328 GLU A CA 4378 C C . GLU A 299 ? 0.6651 0.3538 0.5779 0.0275 -0.1012 0.0504 328 GLU A C 4379 O O . GLU A 299 ? 0.6732 0.3589 0.5870 0.0310 -0.0957 0.0547 328 GLU A O 4380 C CB . GLU A 299 ? 0.6836 0.3798 0.6100 0.0189 -0.1091 0.0560 328 GLU A CB 4381 C CG . GLU A 299 ? 0.7048 0.4034 0.6417 0.0188 -0.1075 0.0645 328 GLU A CG 4382 C CD . GLU A 299 ? 0.7213 0.4215 0.6626 0.0113 -0.1162 0.0679 328 GLU A CD 4383 O OE1 . GLU A 299 ? 0.7269 0.4312 0.6811 0.0098 -0.1167 0.0769 328 GLU A OE1 4384 O OE2 . GLU A 299 ? 0.7235 0.4198 0.6548 0.0068 -0.1225 0.0622 328 GLU A OE2 4391 N N . CYS A 300 ? 0.6640 0.3516 0.5690 0.0262 -0.1056 0.0439 329 CYS A N 4392 C CA . CYS A 300 ? 0.6587 0.3421 0.5561 0.0281 -0.1060 0.0413 329 CYS A CA 4393 C C . CYS A 300 ? 0.6380 0.3218 0.5377 0.0276 -0.1062 0.0437 329 CYS A C 4394 O O . CYS A 300 ? 0.6289 0.3154 0.5327 0.0243 -0.1090 0.0445 329 CYS A O 4395 C CB . CYS A 300 ? 0.6619 0.3455 0.5557 0.0267 -0.1107 0.0361 329 CYS A CB 4396 S SG . CYS A 300 ? 0.5949 0.2765 0.4847 0.0271 -0.1120 0.0335 329 CYS A SG 4401 N N . ARG A 301 ? 0.5809 0.2599 0.4755 0.0304 -0.1036 0.0448 330 ARG A N 4402 C CA . ARG A 301 ? 0.5674 0.2463 0.4638 0.0301 -0.1035 0.0473 330 ARG A CA 4403 C C . ARG A 301 ? 0.5593 0.2366 0.4500 0.0294 -0.1081 0.0429 330 ARG A C 4404 O O . ARG A 301 ? 0.5623 0.2364 0.4469 0.0303 -0.1104 0.0397 330 ARG A O 4405 C CB . ARG A 301 ? 0.5888 0.2622 0.4835 0.0340 -0.0967 0.0526 330 ARG A CB 4406 C CG . ARG A 301 ? 0.6068 0.2800 0.5038 0.0338 -0.0964 0.0559 330 ARG A CG 4407 C CD . ARG A 301 ? 0.6309 0.3005 0.5322 0.0377 -0.0875 0.0642 330 ARG A CD 4408 N NE . ARG A 301 ? 0.6574 0.3151 0.5450 0.0422 -0.0818 0.0634 330 ARG A NE 4409 C CZ . ARG A 301 ? 0.6738 0.3255 0.5607 0.0465 -0.0731 0.0674 330 ARG A CZ 4410 N NH1 . ARG A 301 ? 0.6777 0.3366 0.5810 0.0473 -0.0688 0.0737 330 ARG A NH1 4411 N NH2 . ARG A 301 ? 0.6866 0.3231 0.5548 0.0497 -0.0689 0.0655 330 ARG A NH2 4425 N N . THR A 302 ? 0.4993 0.1780 0.3929 0.0277 -0.1099 0.0436 331 THR A N 4426 C CA . THR A 302 ? 0.5003 0.1776 0.3912 0.0277 -0.1131 0.0406 331 THR A CA 4427 C C . THR A 302 ? 0.5070 0.1799 0.3924 0.0297 -0.1133 0.0412 331 THR A C 4428 O O . THR A 302 ? 0.5121 0.1819 0.3951 0.0310 -0.1100 0.0446 331 THR A O 4429 C CB . THR A 302 ? 0.5004 0.1775 0.3932 0.0253 -0.1143 0.0410 331 THR A CB 4430 O OG1 . THR A 302 ? 0.5027 0.1775 0.3941 0.0265 -0.1154 0.0388 331 THR A OG1 4431 C CG2 . THR A 302 ? 0.5032 0.1800 0.3979 0.0243 -0.1136 0.0457 331 THR A CG2 4439 N N . CYS A 303 ? 0.5216 0.1932 0.4057 0.0300 -0.1171 0.0390 332 CYS A N 4440 C CA . CYS A 303 ? 0.5297 0.1962 0.4081 0.0309 -0.1195 0.0398 332 CYS A CA 4441 C C . CYS A 303 ? 0.5297 0.1969 0.4111 0.0307 -0.1190 0.0411 332 CYS A C 4442 O O . CYS A 303 ? 0.5248 0.1950 0.4120 0.0300 -0.1186 0.0403 332 CYS A O 4443 C CB . CYS A 303 ? 0.5329 0.1980 0.4118 0.0305 -0.1255 0.0386 332 CYS A CB 4444 S SG . CYS A 303 ? 0.5362 0.1985 0.4102 0.0296 -0.1286 0.0372 332 CYS A SG 4449 N N . LYS A 304 ? 0.7454 0.4079 0.6210 0.0314 -0.1186 0.0431 333 LYS A N 4450 C CA . LYS A 304 ? 0.7684 0.4307 0.6459 0.0311 -0.1191 0.0444 333 LYS A CA 4451 C C . LYS A 304 ? 0.7670 0.4279 0.6456 0.0315 -0.1238 0.0434 333 LYS A C 4452 O O . LYS A 304 ? 0.7875 0.4433 0.6597 0.0315 -0.1277 0.0438 333 LYS A O 4453 C CB . LYS A 304 ? 0.7952 0.4528 0.6673 0.0318 -0.1160 0.0481 333 LYS A CB 4454 C CG . LYS A 304 ? 0.8075 0.4673 0.6838 0.0319 -0.1104 0.0518 333 LYS A CG 4455 C CD . LYS A 304 ? 0.8286 0.4823 0.7009 0.0341 -0.1050 0.0571 333 LYS A CD 4456 C CE . LYS A 304 ? 0.8366 0.4928 0.7172 0.0353 -0.0980 0.0631 333 LYS A CE 4457 N NZ . LYS A 304 ? 0.8479 0.4971 0.7263 0.0388 -0.0898 0.0701 333 LYS A NZ 4471 N N . CYS A 305 ? 0.5752 0.2388 0.4613 0.0318 -0.1235 0.0428 334 CYS A N 4472 C CA . CYS A 305 ? 0.5725 0.2359 0.4649 0.0331 -0.1264 0.0436 334 CYS A CA 4473 C C . CYS A 305 ? 0.5766 0.2382 0.4719 0.0342 -0.1242 0.0445 334 CYS A C 4474 O O . CYS A 305 ? 0.5800 0.2412 0.4829 0.0362 -0.1247 0.0463 334 CYS A O 4475 C CB . CYS A 305 ? 0.5640 0.2308 0.4655 0.0341 -0.1260 0.0433 334 CYS A CB 4476 S SG . CYS A 305 ? 0.5204 0.1879 0.4186 0.0324 -0.1307 0.0426 334 CYS A SG 4481 N N . ASN A 306 ? 0.5357 0.1955 0.4255 0.0328 -0.1218 0.0442 335 ASN A N 4482 C CA . ASN A 306 ? 0.5463 0.2018 0.4353 0.0330 -0.1204 0.0448 335 ASN A CA 4483 C C . ASN A 306 ? 0.5493 0.2013 0.4428 0.0355 -0.1161 0.0441 335 ASN A C 4484 O O . ASN A 306 ? 0.5402 0.1870 0.4341 0.0371 -0.1141 0.0451 335 ASN A O 4485 C CB . ASN A 306 ? 0.5750 0.2290 0.4636 0.0337 -0.1235 0.0469 335 ASN A CB 4486 C CG . ASN A 306 ? 0.6026 0.2560 0.4840 0.0320 -0.1252 0.0482 335 ASN A CG 4487 O OD1 . ASN A 306 ? 0.6108 0.2634 0.4886 0.0321 -0.1275 0.0485 335 ASN A OD1 4488 N ND2 . ASN A 306 ? 0.6158 0.2674 0.4942 0.0303 -0.1238 0.0498 335 ASN A ND2 4495 N N . GLY A 307 ? 0.6196 0.2732 0.5162 0.0362 -0.1136 0.0429 336 GLY A N 4496 C CA . GLY A 307 ? 0.6579 0.3057 0.5578 0.0392 -0.1070 0.0429 336 GLY A CA 4497 C C . GLY A 307 ? 0.6866 0.3357 0.6003 0.0440 -0.1047 0.0466 336 GLY A C 4498 O O . GLY A 307 ? 0.7216 0.3633 0.6392 0.0481 -0.0971 0.0483 336 GLY A O 4502 N N . HIS A 308 ? 0.5221 0.1789 0.4431 0.0435 -0.1113 0.0486 337 HIS A N 4503 C CA . HIS A 308 ? 0.5322 0.1916 0.4689 0.0468 -0.1122 0.0538 337 HIS A CA 4504 C C . HIS A 308 ? 0.5090 0.1749 0.4553 0.0462 -0.1159 0.0557 337 HIS A C 4505 O O . HIS A 308 ? 0.5110 0.1808 0.4706 0.0468 -0.1210 0.0609 337 HIS A O 4506 C CB . HIS A 308 ? 0.6341 0.2946 0.5702 0.0452 -0.1199 0.0559 337 HIS A CB 4507 C CG . HIS A 308 ? 0.5213 0.1759 0.4492 0.0455 -0.1171 0.0547 337 HIS A CG 4508 N ND1 . HIS A 308 ? 0.5290 0.1777 0.4624 0.0499 -0.1098 0.0570 337 HIS A ND1 4509 C CD2 . HIS A 308 ? 0.5213 0.1741 0.4360 0.0422 -0.1204 0.0521 337 HIS A CD2 4510 C CE1 . HIS A 308 ? 0.5333 0.1767 0.4559 0.0484 -0.1101 0.0552 337 HIS A CE1 4511 N NE2 . HIS A 308 ? 0.5281 0.1746 0.4404 0.0436 -0.1166 0.0525 337 HIS A NE2 4518 N N . ALA A 309 ? 0.5320 0.1986 0.4717 0.0445 -0.1142 0.0519 338 ALA A N 4519 C CA . ALA A 309 ? 0.5458 0.2176 0.4931 0.0436 -0.1176 0.0533 338 ALA A CA 4520 C C . ALA A 309 ? 0.5379 0.2085 0.4790 0.0432 -0.1121 0.0494 338 ALA A C 4521 O O . ALA A 309 ? 0.5651 0.2327 0.4927 0.0411 -0.1105 0.0451 338 ALA A O 4522 C CB . ALA A 309 ? 0.5764 0.2505 0.5172 0.0390 -0.1289 0.0526 338 ALA A CB 4528 N N . ASP A 310 ? 0.8225 0.4954 0.7745 0.0448 -0.1098 0.0518 339 ASP A N 4529 C CA . ASP A 310 ? 0.8422 0.5133 0.7888 0.0444 -0.1047 0.0486 339 ASP A CA 4530 C C . ASP A 310 ? 0.8321 0.5094 0.7795 0.0410 -0.1120 0.0479 339 ASP A C 4531 O O . ASP A 310 ? 0.8298 0.5068 0.7734 0.0402 -0.1092 0.0454 339 ASP A O 4532 C CB . ASP A 310 ? 0.8612 0.5265 0.8174 0.0497 -0.0933 0.0520 339 ASP A CB 4533 C CG . ASP A 310 ? 0.8801 0.5505 0.8585 0.0533 -0.0936 0.0600 339 ASP A CG 4534 O OD1 . ASP A 310 ? 0.8743 0.5532 0.8596 0.0499 -0.1053 0.0623 339 ASP A OD1 4535 O OD2 . ASP A 310 ? 0.9042 0.5689 0.8930 0.0594 -0.0821 0.0648 339 ASP A OD2 4540 N N . THR A 311 ? 0.7808 0.4619 0.7314 0.0387 -0.1218 0.0501 340 THR A N 4541 C CA . THR A 311 ? 0.7670 0.4505 0.7150 0.0349 -0.1296 0.0494 340 THR A CA 4542 C C . THR A 311 ? 0.7742 0.4543 0.7094 0.0314 -0.1387 0.0481 340 THR A C 4543 O O . THR A 311 ? 0.7937 0.4718 0.7282 0.0315 -0.1412 0.0497 340 THR A O 4544 C CB . THR A 311 ? 0.7529 0.4409 0.7199 0.0350 -0.1335 0.0557 340 THR A CB 4545 O OG1 . THR A 311 ? 0.7662 0.4558 0.7457 0.0354 -0.1386 0.0618 340 THR A OG1 4546 C CG2 . THR A 311 ? 0.7332 0.4218 0.7112 0.0394 -0.1223 0.0575 340 THR A CG2 4554 N N . CYS A 312 ? 0.6824 0.3598 0.6060 0.0285 -0.1428 0.0454 341 CYS A N 4555 C CA . CYS A 312 ? 0.6831 0.3522 0.5897 0.0257 -0.1496 0.0443 341 CYS A CA 4556 C C . CYS A 312 ? 0.6811 0.3451 0.5777 0.0228 -0.1544 0.0429 341 CYS A C 4557 O O . CYS A 312 ? 0.6804 0.3493 0.5835 0.0232 -0.1517 0.0421 341 CYS A O 4558 C CB . CYS A 312 ? 0.6808 0.3468 0.5747 0.0273 -0.1430 0.0411 341 CYS A CB 4559 S SG . CYS A 312 ? 1.8795 1.5482 1.7687 0.0284 -0.1344 0.0377 341 CYS A SG 4564 N N . HIS A 313 ? 0.6652 0.3169 0.5436 0.0200 -0.1614 0.0425 342 HIS A N 4565 C CA . HIS A 313 ? 0.6599 0.3021 0.5237 0.0172 -0.1664 0.0411 342 HIS A CA 4566 C C . HIS A 313 ? 0.6623 0.2892 0.4993 0.0181 -0.1627 0.0382 342 HIS A C 4567 O O . HIS A 313 ? 0.6584 0.2795 0.4870 0.0190 -0.1612 0.0385 342 HIS A O 4568 C CB . HIS A 313 ? 0.6701 0.3070 0.5361 0.0115 -0.1813 0.0452 342 HIS A CB 4569 C CG . HIS A 313 ? 0.6853 0.3097 0.5376 0.0083 -0.1901 0.0470 342 HIS A CG 4570 N ND1 . HIS A 313 ? 0.6818 0.3129 0.5494 0.0085 -0.1926 0.0508 342 HIS A ND1 4571 C CD2 . HIS A 313 ? 0.7099 0.3131 0.5324 0.0048 -0.1966 0.0454 342 HIS A CD2 4572 C CE1 . HIS A 313 ? 0.7035 0.3198 0.5528 0.0047 -0.2014 0.0516 342 HIS A CE1 4573 N NE2 . HIS A 313 ? 0.7224 0.3203 0.5425 0.0024 -0.2038 0.0482 342 HIS A NE2 4580 N N . PHE A 314 ? 0.5636 0.1834 0.3878 0.0183 -0.1599 0.0360 343 PHE A N 4581 C CA . PHE A 314 ? 0.5818 0.1851 0.3807 0.0204 -0.1536 0.0342 343 PHE A CA 4582 C C . PHE A 314 ? 0.6370 0.2180 0.4097 0.0165 -0.1635 0.0347 343 PHE A C 4583 O O . PHE A 314 ? 0.6427 0.2207 0.4164 0.0108 -0.1774 0.0363 343 PHE A O 4584 C CB . PHE A 314 ? 0.5808 0.1820 0.3743 0.0222 -0.1471 0.0324 343 PHE A CB 4585 C CG . PHE A 314 ? 0.5976 0.1832 0.3699 0.0262 -0.1364 0.0319 343 PHE A CG 4586 C CD1 . PHE A 314 ? 0.5873 0.1800 0.3687 0.0310 -0.1242 0.0336 343 PHE A CD1 4587 C CD2 . PHE A 314 ? 0.6262 0.1886 0.3696 0.0253 -0.1380 0.0307 343 PHE A CD2 4588 C CE1 . PHE A 314 ? 0.6033 0.1824 0.3696 0.0355 -0.1126 0.0351 343 PHE A CE1 4589 C CE2 . PHE A 314 ? 0.6448 0.1909 0.3684 0.0302 -0.1253 0.0310 343 PHE A CE2 4590 C CZ . PHE A 314 ? 0.6324 0.1878 0.3697 0.0357 -0.1119 0.0337 343 PHE A CZ 4600 N N . ASP A 315 ? 0.7164 0.2807 0.4658 0.0190 -0.1566 0.0340 344 ASP A N 4601 C CA . ASP A 315 ? 0.7671 0.3049 0.4844 0.0153 -0.1648 0.0339 344 ASP A CA 4602 C C . ASP A 315 ? 0.7936 0.3094 0.4808 0.0199 -0.1517 0.0324 344 ASP A C 4603 O O . ASP A 315 ? 0.8010 0.3181 0.4896 0.0254 -0.1386 0.0336 344 ASP A O 4604 C CB . ASP A 315 ? 0.7687 0.3073 0.4893 0.0135 -0.1707 0.0360 344 ASP A CB 4605 C CG . ASP A 315 ? 0.7978 0.3094 0.4869 0.0073 -0.1839 0.0363 344 ASP A CG 4606 O OD1 . ASP A 315 ? 0.7411 0.2263 0.3949 0.0070 -0.1818 0.0342 344 ASP A OD1 4607 O OD2 . ASP A 315 ? 0.7099 0.2252 0.4086 0.0024 -0.1965 0.0390 344 ASP A OD2 4612 N N . VAL A 316 ? 0.7076 0.2025 0.3682 0.0178 -0.1549 0.0305 345 VAL A N 4613 C CA . VAL A 316 ? 0.7342 0.2059 0.3650 0.0230 -0.1404 0.0294 345 VAL A CA 4614 C C . VAL A 316 ? 0.7655 0.2128 0.3663 0.0241 -0.1366 0.0299 345 VAL A C 4615 O O . VAL A 316 ? 0.7781 0.2143 0.3665 0.0310 -0.1190 0.0308 345 VAL A O 4616 C CB . VAL A 316 ? 0.7607 0.2112 0.3644 0.0199 -0.1458 0.0269 345 VAL A CB 4617 C CG1 . VAL A 316 ? 0.7913 0.2204 0.3688 0.0104 -0.1667 0.0263 345 VAL A CG1 4618 C CG2 . VAL A 316 ? 0.7889 0.2153 0.3631 0.0269 -0.1274 0.0261 345 VAL A CG2 4628 N N . ASN A 317 ? 0.8801 0.3187 0.4704 0.0170 -0.1531 0.0299 346 ASN A N 4629 C CA . ASN A 317 ? 0.9112 0.3256 0.4714 0.0169 -0.1516 0.0302 346 ASN A CA 4630 C C . ASN A 317 ? 0.8912 0.3239 0.4751 0.0230 -0.1388 0.0329 346 ASN A C 4631 O O . ASN A 317 ? 0.8926 0.3088 0.4570 0.0283 -0.1245 0.0339 346 ASN A O 4632 C CB . ASN A 317 ? 0.9250 0.3280 0.4728 0.0067 -0.1750 0.0304 346 ASN A CB 4633 C CG . ASN A 317 ? 0.9492 0.3309 0.4710 -0.0010 -0.1901 0.0286 346 ASN A CG 4634 O OD1 . ASN A 317 ? 0.9781 0.3334 0.4646 0.0012 -0.1821 0.0259 346 ASN A OD1 4635 N ND2 . ASN A 317 ? 0.9372 0.3300 0.4775 -0.0100 -0.2118 0.0307 346 ASN A ND2 4642 N N . VAL A 318 ? 0.8565 0.3219 0.4818 0.0223 -0.1436 0.0345 347 VAL A N 4643 C CA . VAL A 318 ? 0.8408 0.3253 0.4908 0.0272 -0.1332 0.0372 347 VAL A CA 4644 C C . VAL A 318 ? 0.8088 0.3017 0.4708 0.0349 -0.1141 0.0389 347 VAL A C 4645 O O . VAL A 318 ? 0.8012 0.2969 0.4696 0.0399 -0.1016 0.0422 347 VAL A O 4646 C CB . VAL A 318 ? 0.8262 0.3408 0.5141 0.0245 -0.1427 0.0381 347 VAL A CB 4647 C CG1 . VAL A 318 ? 0.8290 0.3608 0.5390 0.0289 -0.1327 0.0407 347 VAL A CG1 4648 C CG2 . VAL A 318 ? 0.8288 0.3373 0.5111 0.0171 -0.1614 0.0384 347 VAL A CG2 4658 N N . TRP A 319 ? 0.7892 0.2865 0.4561 0.0354 -0.1127 0.0374 348 TRP A N 4659 C CA . TRP A 319 ? 0.7631 0.2686 0.4437 0.0420 -0.0963 0.0397 348 TRP A CA 4660 C C . TRP A 319 ? 0.7920 0.2730 0.4466 0.0481 -0.0800 0.0422 348 TRP A C 4661 O O . TRP A 319 ? 0.7642 0.2532 0.4349 0.0537 -0.0664 0.0475 348 TRP A O 4662 C CB . TRP A 319 ? 0.7607 0.2706 0.4454 0.0408 -0.0993 0.0373 348 TRP A CB 4663 C CG . TRP A 319 ? 0.7669 0.2845 0.4660 0.0469 -0.0840 0.0402 348 TRP A CG 4664 C CD1 . TRP A 319 ? 0.7977 0.2977 0.4778 0.0507 -0.0741 0.0401 348 TRP A CD1 4665 C CD2 . TRP A 319 ? 0.7456 0.2895 0.4812 0.0496 -0.0776 0.0443 348 TRP A CD2 4666 N NE1 . TRP A 319 ? 0.7868 0.3025 0.4933 0.0559 -0.0619 0.0446 348 TRP A NE1 4667 C CE2 . TRP A 319 ? 0.7505 0.2929 0.4908 0.0548 -0.0647 0.0475 348 TRP A CE2 4668 C CE3 . TRP A 319 ? 0.7230 0.2897 0.4862 0.0478 -0.0819 0.0459 348 TRP A CE3 4669 C CZ2 . TRP A 319 ? 0.7189 0.2825 0.4924 0.0574 -0.0579 0.0531 348 TRP A CZ2 4670 C CZ3 . TRP A 319 ? 0.6983 0.2838 0.4900 0.0501 -0.0749 0.0505 348 TRP A CZ3 4671 C CH2 . TRP A 319 ? 0.6942 0.2784 0.4918 0.0545 -0.0639 0.0545 348 TRP A CH2 4682 N N . GLU A 320 ? 0.8137 0.2631 0.4272 0.0468 -0.0816 0.0391 349 GLU A N 4683 C CA . GLU A 320 ? 0.8643 0.2846 0.4457 0.0529 -0.0645 0.0408 349 GLU A CA 4684 C C . GLU A 320 ? 0.8773 0.2914 0.4529 0.0545 -0.0598 0.0438 349 GLU A C 4685 O O . GLU A 320 ? 0.8376 0.2403 0.4052 0.0617 -0.0410 0.0480 349 GLU A O 4686 C CB . GLU A 320 ? 0.8564 0.2399 0.3883 0.0498 -0.0695 0.0359 349 GLU A CB 4689 N N . ALA A 321 ? 1.0788 0.5007 0.6598 0.0479 -0.0764 0.0421 350 ALA A N 4690 C CA . ALA A 321 ? 1.1111 0.5271 0.6859 0.0484 -0.0745 0.0445 350 ALA A CA 4691 C C . ALA A 321 ? 1.0711 0.5132 0.6844 0.0540 -0.0620 0.0509 350 ALA A C 4692 O O . ALA A 321 ? 1.0922 0.5261 0.6995 0.0576 -0.0516 0.0549 350 ALA A O 4693 C CB . ALA A 321 ? 1.1138 0.5341 0.6892 0.0397 -0.0963 0.0418 350 ALA A CB 4699 N N . SER A 322 ? 0.7962 0.2686 0.4482 0.0541 -0.0638 0.0522 351 SER A N 4700 C CA . SER A 322 ? 0.7851 0.2823 0.4745 0.0577 -0.0552 0.0588 351 SER A CA 4701 C C . SER A 322 ? 0.7825 0.2764 0.4781 0.0655 -0.0355 0.0654 351 SER A C 4702 O O . SER A 322 ? 0.7558 0.2675 0.4821 0.0684 -0.0279 0.0732 351 SER A O 4703 C CB . SER A 322 ? 0.7526 0.2802 0.4769 0.0539 -0.0658 0.0574 351 SER A CB 4704 O OG . SER A 322 ? 0.7302 0.2614 0.4584 0.0543 -0.0653 0.0554 351 SER A OG 4710 N N . GLY A 323 ? 0.7471 0.2175 0.4136 0.0684 -0.0277 0.0631 352 GLY A N 4711 C CA . GLY A 323 ? 0.7562 0.2231 0.4287 0.0764 -0.0083 0.0694 352 GLY A CA 4712 C C . GLY A 323 ? 1.3001 0.7892 1.0026 0.0760 -0.0108 0.0702 352 GLY A C 4713 O O . GLY A 323 ? 0.7136 0.2174 0.4456 0.0807 -0.0001 0.0785 352 GLY A O 4717 N N . ASN A 324 ? 0.9048 0.3963 0.6007 0.0701 -0.0258 0.0623 353 ASN A N 4718 C CA . ASN A 324 ? 0.8702 0.3807 0.5903 0.0691 -0.0294 0.0619 353 ASN A CA 4719 C C . ASN A 324 ? 0.8171 0.3599 0.5820 0.0677 -0.0326 0.0674 353 ASN A C 4720 O O . ASN A 324 ? 0.8076 0.3659 0.5972 0.0686 -0.0305 0.0708 353 ASN A O 4721 C CB . ASN A 324 ? 0.9021 0.3998 0.6143 0.0758 -0.0134 0.0650 353 ASN A CB 4722 C CG . ASN A 324 ? 0.9395 0.4203 0.6232 0.0734 -0.0191 0.0572 353 ASN A CG 4723 O OD1 . ASN A 324 ? 0.9483 0.4133 0.6028 0.0680 -0.0314 0.0503 353 ASN A OD1 4724 N ND2 . ASN A 324 ? 0.9565 0.4405 0.6500 0.0771 -0.0111 0.0593 353 ASN A ND2 4730 N N . ARG A 325 ? 1.4703 1.0215 1.2435 0.0650 -0.0384 0.0683 354 ARG A N 4731 C CA . ARG A 325 ? 0.6117 0.1892 0.4211 0.0630 -0.0423 0.0732 354 ARG A CA 4732 C C . ARG A 325 ? 0.5902 0.1818 0.4054 0.0562 -0.0583 0.0659 354 ARG A C 4733 O O . ARG A 325 ? 0.5666 0.1771 0.4052 0.0540 -0.0621 0.0670 354 ARG A O 4734 C CB . ARG A 325 ? 0.6152 0.1931 0.4322 0.0648 -0.0368 0.0804 354 ARG A CB 4735 C CG . ARG A 325 ? 0.6282 0.2013 0.4549 0.0715 -0.0203 0.0914 354 ARG A CG 4736 C CD . ARG A 325 ? 0.6325 0.2060 0.4666 0.0726 -0.0160 0.0988 354 ARG A CD 4737 N NE . ARG A 325 ? 0.6582 0.2097 0.4569 0.0730 -0.0153 0.0929 354 ARG A NE 4738 C CZ . ARG A 325 ? 0.6684 0.2147 0.4645 0.0742 -0.0108 0.0978 354 ARG A CZ 4739 N NH1 . ARG A 325 ? 0.6947 0.2569 0.5230 0.0751 -0.0070 0.1090 354 ARG A NH1 4740 N NH2 . ARG A 325 ? 0.6941 0.2183 0.4550 0.0740 -0.0112 0.0920 354 ARG A NH2 4754 N N . SER A 326 ? 0.6600 0.2411 0.4532 0.0530 -0.0676 0.0591 355 SER A N 4755 C CA . SER A 326 ? 0.6424 0.2361 0.4426 0.0473 -0.0818 0.0535 355 SER A CA 4756 C C . SER A 326 ? 0.6601 0.2386 0.4353 0.0439 -0.0919 0.0478 355 SER A C 4757 O O . SER A 326 ? 0.6863 0.2443 0.4368 0.0448 -0.0901 0.0479 355 SER A O 4758 C CB . SER A 326 ? 0.6287 0.2345 0.4443 0.0458 -0.0844 0.0558 355 SER A CB 4759 O OG . SER A 326 ? 0.6180 0.2316 0.4367 0.0413 -0.0966 0.0507 355 SER A OG 4765 N N . GLY A 327 ? 0.6178 0.2052 0.3994 0.0398 -0.1030 0.0436 356 GLY A N 4766 C CA . GLY A 327 ? 0.6640 0.2387 0.4268 0.0356 -0.1149 0.0400 356 GLY A CA 4767 C C . GLY A 327 ? 0.6786 0.2688 0.4591 0.0311 -0.1272 0.0383 356 GLY A C 4768 O O . GLY A 327 ? 0.6822 0.2655 0.4543 0.0270 -0.1384 0.0369 356 GLY A O 4772 N N . GLY A 328 ? 0.5746 0.1842 0.3793 0.0319 -0.1249 0.0392 357 GLY A N 4773 C CA . GLY A 328 ? 0.5595 0.1824 0.3816 0.0291 -0.1332 0.0383 357 GLY A CA 4774 C C . GLY A 328 ? 0.5681 0.1866 0.3874 0.0267 -0.1419 0.0394 357 GLY A C 4775 O O . GLY A 328 ? 0.6044 0.2135 0.4119 0.0275 -0.1402 0.0406 357 GLY A O 4779 N N . VAL A 329 ? 0.5510 0.1761 0.3828 0.0240 -0.1509 0.0401 358 VAL A N 4780 C CA . VAL A 329 ? 0.5570 0.1809 0.3928 0.0216 -0.1598 0.0426 358 VAL A CA 4781 C C . VAL A 329 ? 0.5400 0.1799 0.4026 0.0219 -0.1612 0.0447 358 VAL A C 4782 O O . VAL A 329 ? 0.5355 0.1804 0.4082 0.0207 -0.1644 0.0455 358 VAL A O 4783 C CB . VAL A 329 ? 0.5810 0.1885 0.3993 0.0164 -0.1725 0.0438 358 VAL A CB 4784 C CG1 . VAL A 329 ? 0.5873 0.1946 0.4128 0.0133 -0.1829 0.0476 358 VAL A CG1 4785 C CG2 . VAL A 329 ? 0.6161 0.2026 0.4024 0.0169 -0.1689 0.0416 358 VAL A CG2 4795 N N . CYS A 330 ? 0.5460 0.1924 0.4195 0.0240 -0.1579 0.0461 359 CYS A N 4796 C CA . CYS A 330 ? 0.5757 0.2340 0.4722 0.0261 -0.1556 0.0484 359 CYS A CA 4797 C C . CYS A 330 ? 0.5779 0.2381 0.4885 0.0236 -0.1655 0.0538 359 CYS A C 4798 O O . CYS A 330 ? 0.5885 0.2415 0.4931 0.0199 -0.1757 0.0563 359 CYS A O 4799 C CB . CYS A 330 ? 0.6213 0.2822 0.5223 0.0289 -0.1498 0.0488 359 CYS A CB 4800 S SG . CYS A 330 ? 0.5117 0.1710 0.3998 0.0303 -0.1406 0.0449 359 CYS A SG 4805 N N . ASN A 331 ? 0.6481 0.3174 0.5780 0.0253 -0.1626 0.0562 360 ASN A N 4806 C CA . ASN A 331 ? 0.6679 0.3420 0.6182 0.0235 -0.1707 0.0635 360 ASN A CA 4807 C C . ASN A 331 ? 0.6482 0.3298 0.6207 0.0285 -0.1640 0.0688 360 ASN A C 4808 O O . ASN A 331 ? 0.6039 0.2875 0.5787 0.0338 -0.1511 0.0665 360 ASN A O 4809 C CB . ASN A 331 ? 0.6873 0.3658 0.6462 0.0225 -0.1713 0.0645 360 ASN A CB 4810 C CG . ASN A 331 ? 0.7144 0.3836 0.6518 0.0174 -0.1791 0.0605 360 ASN A CG 4811 O OD1 . ASN A 331 ? 0.7316 0.3896 0.6519 0.0129 -0.1889 0.0601 360 ASN A OD1 4812 N ND2 . ASN A 331 ? 0.7182 0.3896 0.6539 0.0182 -0.1743 0.0575 360 ASN A ND2 4819 N N . ASN A 332 ? 0.9802 0.6640 0.9675 0.0264 -0.1729 0.0762 361 ASN A N 4820 C CA . ASN A 332 ? 0.9990 0.6896 1.0104 0.0318 -0.1664 0.0832 361 ASN A CA 4821 C C . ASN A 332 ? 0.9849 0.6716 0.9869 0.0372 -0.1545 0.0788 361 ASN A C 4822 O O . ASN A 332 ? 1.0038 0.6905 1.0097 0.0433 -0.1407 0.0778 361 ASN A O 4823 C CB . ASN A 332 ? 1.0021 0.7005 1.0357 0.0362 -0.1578 0.0880 361 ASN A CB 4824 C CG . ASN A 332 ? 1.0171 0.7207 1.0626 0.0302 -0.1699 0.0931 361 ASN A CG 4825 O OD1 . ASN A 332 ? 1.0312 0.7341 1.0786 0.0229 -0.1860 0.0972 361 ASN A OD1 4826 N ND2 . ASN A 332 ? 1.0184 0.7255 1.0704 0.0324 -0.1629 0.0929 361 ASN A ND2 4833 N N . CYS A 333 ? 0.7050 0.3861 0.6928 0.0345 -0.1603 0.0766 362 CYS A N 4834 C CA . CYS A 333 ? 0.6741 0.3512 0.6524 0.0384 -0.1512 0.0728 362 CYS A CA 4835 C C . CYS A 333 ? 0.6765 0.3560 0.6743 0.0450 -0.1420 0.0787 362 CYS A C 4836 O O . CYS A 333 ? 0.6782 0.3619 0.6947 0.0453 -0.1474 0.0868 362 CYS A O 4837 C CB . CYS A 333 ? 0.6678 0.3385 0.6296 0.0342 -0.1599 0.0710 362 CYS A CB 4838 S SG . CYS A 333 ? 0.6479 0.3103 0.5799 0.0297 -0.1628 0.0630 362 CYS A SG 4843 N N . GLN A 334 ? 0.7126 0.3879 0.7050 0.0501 -0.1282 0.0751 363 GLN A N 4844 C CA . GLN A 334 ? 0.7364 0.4082 0.7408 0.0576 -0.1162 0.0797 363 GLN A CA 4845 C C . GLN A 334 ? 0.7232 0.3893 0.7188 0.0583 -0.1152 0.0783 363 GLN A C 4846 O O . GLN A 334 ? 0.7134 0.3786 0.6933 0.0530 -0.1231 0.0736 363 GLN A O 4847 C CB . GLN A 334 ? 0.7774 0.4423 0.7765 0.0622 -0.1015 0.0766 363 GLN A CB 4848 C CG . GLN A 334 ? 0.8151 0.4846 0.8269 0.0636 -0.0992 0.0798 363 GLN A CG 4849 C CD . GLN A 334 ? 0.8602 0.5318 0.8972 0.0704 -0.0935 0.0904 363 GLN A CD 4850 O OE1 . GLN A 334 ? 0.8855 0.5519 0.9280 0.0759 -0.0871 0.0946 363 GLN A OE1 4851 N NE2 . GLN A 334 ? 0.8701 0.5496 0.9234 0.0700 -0.0961 0.0952 363 GLN A NE2 4860 N N . HIS A 335 ? 0.7123 0.3729 0.7173 0.0653 -0.1045 0.0830 364 HIS A N 4861 C CA . HIS A 335 ? 0.7237 0.3768 0.7197 0.0667 -0.1013 0.0816 364 HIS A CA 4862 C C . HIS A 335 ? 0.7403 0.3984 0.7368 0.0619 -0.1152 0.0833 364 HIS A C 4863 O O . HIS A 335 ? 0.7743 0.4279 0.7561 0.0594 -0.1172 0.0792 364 HIS A O 4864 C CB . HIS A 335 ? 0.7086 0.3541 0.6815 0.0639 -0.0974 0.0726 364 HIS A CB 4865 C CG . HIS A 335 ? 0.6998 0.3387 0.6688 0.0665 -0.0861 0.0701 364 HIS A CG 4866 N ND1 . HIS A 335 ? 0.6945 0.3295 0.6446 0.0619 -0.0865 0.0625 364 HIS A ND1 4867 C CD2 . HIS A 335 ? 0.7036 0.3378 0.6844 0.0732 -0.0741 0.0747 364 HIS A CD2 4868 C CE1 . HIS A 335 ? 0.6973 0.3253 0.6466 0.0646 -0.0766 0.0618 364 HIS A CE1 4869 N NE2 . HIS A 335 ? 0.7023 0.3292 0.6702 0.0719 -0.0679 0.0690 364 HIS A NE2 4876 N N . ASN A 336 ? 0.5721 0.2387 0.5850 0.0596 -0.1255 0.0897 365 ASN A N 4877 C CA . ASN A 336 ? 0.5515 0.2205 0.5653 0.0544 -0.1397 0.0925 365 ASN A CA 4878 C C . ASN A 336 ? 0.5494 0.2144 0.5379 0.0472 -0.1486 0.0848 365 ASN A C 4879 O O . ASN A 336 ? 0.5555 0.2170 0.5364 0.0441 -0.1559 0.0851 365 ASN A O 4880 C CB . ASN A 336 ? 0.6325 0.2977 0.6533 0.0592 -0.1348 0.0969 365 ASN A CB 4881 C CG . ASN A 336 ? 0.6228 0.2902 0.6690 0.0676 -0.1250 0.1060 365 ASN A CG 4882 O OD1 . ASN A 336 ? 0.5657 0.2424 0.6332 0.0667 -0.1305 0.1131 365 ASN A OD1 4883 N ND2 . ASN A 336 ? 0.5744 0.2319 0.6179 0.0756 -0.1103 0.1063 365 ASN A ND2 4890 N N . THR A 337 ? 0.5949 0.2593 0.5702 0.0451 -0.1469 0.0785 366 THR A N 4891 C CA . THR A 337 ? 0.5951 0.2550 0.5474 0.0394 -0.1535 0.0725 366 THR A CA 4892 C C . THR A 337 ? 0.6040 0.2636 0.5546 0.0337 -0.1665 0.0743 366 THR A C 4893 O O . THR A 337 ? 0.5999 0.2651 0.5694 0.0334 -0.1712 0.0804 366 THR A O 4894 C CB . THR A 337 ? 0.5812 0.2399 0.5203 0.0401 -0.1450 0.0656 366 THR A CB 4895 O OG1 . THR A 337 ? 0.5747 0.2379 0.5236 0.0421 -0.1404 0.0658 366 THR A OG1 4896 C CG2 . THR A 337 ? 0.5803 0.2355 0.5152 0.0431 -0.1359 0.0635 366 THR A CG2 4904 N N . GLU A 338 ? 0.6970 0.3486 0.6246 0.0292 -0.1718 0.0699 367 GLU A N 4905 C CA . GLU A 338 ? 0.7305 0.3754 0.6495 0.0229 -0.1855 0.0716 367 GLU A CA 4906 C C . GLU A 338 ? 0.7470 0.3820 0.6401 0.0202 -0.1858 0.0658 367 GLU A C 4907 O O . GLU A 338 ? 0.7514 0.3812 0.6385 0.0160 -0.1943 0.0663 367 GLU A O 4908 C CB . GLU A 338 ? 0.7551 0.3923 0.6688 0.0193 -0.1956 0.0751 367 GLU A CB 4909 C CG . GLU A 338 ? 0.7782 0.4079 0.6882 0.0116 -0.2126 0.0793 367 GLU A CG 4910 C CD . GLU A 338 ? 0.8016 0.4222 0.7051 0.0073 -0.2234 0.0829 367 GLU A CD 4911 O OE1 . GLU A 338 ? 0.8058 0.4180 0.6905 0.0086 -0.2188 0.0792 367 GLU A OE1 4912 O OE2 . GLU A 338 ? 0.8175 0.4397 0.7361 0.0022 -0.2368 0.0902 367 GLU A OE2 4919 N N . GLY A 339 ? 0.7827 0.4142 0.6611 0.0226 -0.1766 0.0611 368 GLY A N 4920 C CA . GLY A 339 ? 0.8009 0.4211 0.6546 0.0212 -0.1751 0.0572 368 GLY A CA 4921 C C . GLY A 339 ? 0.7971 0.4190 0.6496 0.0210 -0.1733 0.0549 368 GLY A C 4922 O O . GLY A 339 ? 0.7743 0.4076 0.6458 0.0222 -0.1724 0.0558 368 GLY A O 4926 N N . GLN A 340 ? 0.7756 0.3847 0.6047 0.0201 -0.1718 0.0523 369 GLN A N 4927 C CA . GLN A 340 ? 0.7764 0.3857 0.6016 0.0205 -0.1684 0.0497 369 GLN A CA 4928 C C . GLN A 340 ? 0.7554 0.3803 0.5979 0.0246 -0.1575 0.0481 369 GLN A C 4929 O O . GLN A 340 ? 0.7471 0.3792 0.5989 0.0249 -0.1564 0.0471 369 GLN A O 4930 C CB . GLN A 340 ? 0.7986 0.3895 0.5947 0.0206 -0.1646 0.0478 369 GLN A CB 4931 C CG . GLN A 340 ? 0.7931 0.3832 0.5842 0.0220 -0.1589 0.0454 369 GLN A CG 4932 C CD . GLN A 340 ? 0.8044 0.3772 0.5700 0.0244 -0.1499 0.0446 369 GLN A CD 4933 O OE1 . GLN A 340 ? 0.7902 0.3660 0.5574 0.0276 -0.1401 0.0438 369 GLN A OE1 4934 N NE2 . GLN A 340 ? 0.8290 0.3827 0.5713 0.0231 -0.1523 0.0454 369 GLN A NE2 4943 N N . HIS A 341 ? 0.7330 0.3616 0.5781 0.0271 -0.1502 0.0482 370 HIS A N 4944 C CA . HIS A 341 ? 0.7008 0.3411 0.5594 0.0295 -0.1419 0.0471 370 HIS A CA 4945 C C . HIS A 341 ? 0.6749 0.3223 0.5486 0.0306 -0.1423 0.0484 370 HIS A C 4946 O O . HIS A 341 ? 0.6779 0.3301 0.5573 0.0320 -0.1362 0.0478 370 HIS A O 4947 C CB . HIS A 341 ? 0.7090 0.3469 0.5602 0.0309 -0.1339 0.0474 370 HIS A CB 4948 C CG . HIS A 341 ? 0.7353 0.3647 0.5726 0.0315 -0.1303 0.0472 370 HIS A CG 4949 N ND1 . HIS A 341 ? 0.7518 0.3763 0.5825 0.0334 -0.1222 0.0497 370 HIS A ND1 4950 C CD2 . HIS A 341 ? 0.7528 0.3764 0.5817 0.0307 -0.1329 0.0457 370 HIS A CD2 4951 C CE1 . HIS A 341 ? 0.7724 0.3877 0.5910 0.0346 -0.1186 0.0497 370 HIS A CE1 4952 N NE2 . HIS A 341 ? 0.7716 0.3857 0.5871 0.0327 -0.1255 0.0467 370 HIS A NE2 4959 N N . CYS A 342 ? 0.6155 0.2620 0.4950 0.0296 -0.1497 0.0510 371 CYS A N 4960 C CA . CYS A 342 ? 0.6065 0.2577 0.5006 0.0315 -0.1492 0.0536 371 CYS A CA 4961 C C . CYS A 342 ? 0.6217 0.2704 0.5099 0.0324 -0.1450 0.0531 371 CYS A C 4962 O O . CYS A 342 ? 0.6212 0.2730 0.5173 0.0347 -0.1396 0.0532 371 CYS A O 4963 C CB . CYS A 342 ? 0.5488 0.2077 0.4584 0.0345 -0.1428 0.0536 371 CYS A CB 4964 S SG . CYS A 342 ? 0.5472 0.2104 0.4683 0.0336 -0.1474 0.0557 371 CYS A SG 4969 N N . GLN A 343 ? 0.5424 0.1833 0.4151 0.0306 -0.1471 0.0530 372 GLN A N 4970 C CA . GLN A 343 ? 0.5437 0.1822 0.4108 0.0311 -0.1427 0.0532 372 GLN A CA 4971 C C . GLN A 343 ? 0.5519 0.1867 0.4192 0.0308 -0.1473 0.0557 372 GLN A C 4972 O O . GLN A 343 ? 0.5541 0.1865 0.4169 0.0310 -0.1444 0.0564 372 GLN A O 4973 C CB . GLN A 343 ? 0.5504 0.1820 0.4020 0.0306 -0.1394 0.0530 372 GLN A CB 4974 C CG . GLN A 343 ? 0.5690 0.1872 0.4030 0.0289 -0.1446 0.0539 372 GLN A CG 4975 C CD . GLN A 343 ? 0.5744 0.1885 0.4027 0.0274 -0.1495 0.0525 372 GLN A CD 4976 O OE1 . GLN A 343 ? 1.0155 0.6389 0.8561 0.0278 -0.1492 0.0512 372 GLN A OE1 4977 N NE2 . GLN A 343 ? 0.5956 0.1936 0.4029 0.0253 -0.1543 0.0529 372 GLN A NE2 4986 N N . ARG A 344 ? 0.5570 0.1915 0.4308 0.0299 -0.1549 0.0580 373 ARG A N 4987 C CA . ARG A 344 ? 0.5656 0.1967 0.4414 0.0294 -0.1602 0.0612 373 ARG A CA 4988 C C . ARG A 344 ? 0.5625 0.2006 0.4596 0.0310 -0.1630 0.0651 373 ARG A C 4989 O O . ARG A 344 ? 0.5575 0.2009 0.4656 0.0315 -0.1636 0.0660 373 ARG A O 4990 C CB . ARG A 344 ? 0.5838 0.2024 0.4414 0.0253 -0.1690 0.0622 373 ARG A CB 4991 C CG . ARG A 344 ? 0.5934 0.2096 0.4557 0.0218 -0.1813 0.0655 373 ARG A CG 4992 C CD . ARG A 344 ? 0.6817 0.2806 0.5201 0.0168 -0.1909 0.0662 373 ARG A CD 4993 N NE . ARG A 344 ? 0.6893 0.2762 0.5040 0.0156 -0.1887 0.0626 373 ARG A NE 4994 C CZ . ARG A 344 ? 0.6898 0.2708 0.4979 0.0122 -0.1958 0.0623 373 ARG A CZ 4995 N NH1 . ARG A 344 ? 0.6871 0.2749 0.5132 0.0091 -0.2064 0.0659 373 ARG A NH1 4996 N NH2 . ARG A 344 ? 0.6983 0.2662 0.4825 0.0121 -0.1917 0.0590 373 ARG A NH2 5010 N N . CYS A 345 ? 0.6090 0.2468 0.5132 0.0323 -0.1640 0.0683 374 CYS A N 5011 C CA . CYS A 345 ? 0.6088 0.2524 0.5355 0.0348 -0.1653 0.0740 374 CYS A CA 5012 C C . CYS A 345 ? 0.6613 0.3032 0.5922 0.0301 -0.1793 0.0791 374 CYS A C 5013 O O . CYS A 345 ? 0.6323 0.2647 0.5457 0.0253 -0.1879 0.0784 374 CYS A O 5014 C CB . CYS A 345 ? 0.8724 0.5148 0.8044 0.0384 -0.1602 0.0758 374 CYS A CB 5015 S SG . CYS A 345 ? 0.6039 0.2440 0.5265 0.0414 -0.1472 0.0702 374 CYS A SG 5020 N N . LYS A 346 ? 0.7342 0.3838 0.6877 0.0312 -0.1818 0.0849 375 LYS A N 5021 C CA . LYS A 346 ? 0.7476 0.3965 0.7090 0.0253 -0.1973 0.0913 375 LYS A CA 5022 C C . LYS A 346 ? 0.7494 0.3943 0.7123 0.0235 -0.2044 0.0957 375 LYS A C 5023 O O . LYS A 346 ? 0.7549 0.4007 0.7206 0.0286 -0.1955 0.0953 375 LYS A O 5024 C CB . LYS A 346 ? 0.7602 0.4208 0.7523 0.0274 -0.1975 0.0989 375 LYS A CB 5025 C CG . LYS A 346 ? 0.7730 0.4379 0.7663 0.0289 -0.1915 0.0957 375 LYS A CG 5026 C CD . LYS A 346 ? 0.7954 0.4699 0.8163 0.0274 -0.1979 0.1046 375 LYS A CD 5027 C CE . LYS A 346 ? 0.8103 0.4938 0.8629 0.0325 -0.1943 0.1148 375 LYS A CE 5028 N NZ . LYS A 346 ? 0.8087 0.4919 0.8637 0.0432 -0.1744 0.1126 375 LYS A NZ 5042 N N . PRO A 347 ? 0.6146 0.2534 0.5740 0.0156 -0.2214 0.0999 376 PRO A N 5043 C CA . PRO A 347 ? 0.6260 0.2626 0.5924 0.0134 -0.2296 0.1059 376 PRO A CA 5044 C C . PRO A 347 ? 0.6178 0.2688 0.6208 0.0199 -0.2233 0.1144 376 PRO A C 5045 O O . PRO A 347 ? 0.6103 0.2718 0.6359 0.0224 -0.2202 0.1189 376 PRO A O 5046 C CB . PRO A 347 ? 0.6468 0.2737 0.6048 0.0024 -0.2503 0.1096 376 PRO A CB 5047 C CG . PRO A 347 ? 0.6501 0.2669 0.5814 -0.0006 -0.2506 0.1021 376 PRO A CG 5048 C CD . PRO A 347 ? 0.6269 0.2569 0.5710 0.0075 -0.2343 0.0989 376 PRO A CD 5056 N N . GLY A 348 ? 0.6441 0.2946 0.6524 0.0230 -0.2206 0.1171 377 GLY A N 5057 C CA . GLY A 348 ? 0.6389 0.2997 0.6777 0.0313 -0.2105 0.1246 377 GLY A CA 5058 C C . GLY A 348 ? 0.6346 0.2943 0.6672 0.0411 -0.1898 0.1184 377 GLY A C 5059 O O . GLY A 348 ? 0.6265 0.2900 0.6781 0.0497 -0.1775 0.1231 377 GLY A O 5063 N N . PHE A 349 ? 0.6845 0.3373 0.6894 0.0395 -0.1859 0.1082 378 PHE A N 5064 C CA . PHE A 349 ? 0.6897 0.3394 0.6851 0.0461 -0.1693 0.1018 378 PHE A CA 5065 C C . PHE A 349 ? 0.7082 0.3497 0.6758 0.0422 -0.1708 0.0941 378 PHE A C 5066 O O . PHE A 349 ? 0.7191 0.3557 0.6730 0.0356 -0.1825 0.0933 378 PHE A O 5067 C CB . PHE A 349 ? 0.6740 0.3273 0.6708 0.0486 -0.1610 0.0985 378 PHE A CB 5068 C CG . PHE A 349 ? 0.6732 0.3340 0.6975 0.0539 -0.1563 0.1064 378 PHE A CG 5069 C CD1 . PHE A 349 ? 0.6733 0.3419 0.7133 0.0491 -0.1683 0.1124 378 PHE A CD1 5070 C CD2 . PHE A 349 ? 0.6788 0.3366 0.7120 0.0635 -0.1394 0.1083 378 PHE A CD2 5071 C CE1 . PHE A 349 ? 0.6774 0.3545 0.7459 0.0539 -0.1638 0.1210 378 PHE A CE1 5072 C CE2 . PHE A 349 ? 0.6841 0.3472 0.7419 0.0696 -0.1330 0.1163 378 PHE A CE2 5073 C CZ . PHE A 349 ? 0.6818 0.3564 0.7595 0.0647 -0.1453 0.1230 378 PHE A CZ 5083 N N . TYR A 350 ? 0.7898 0.4279 0.7481 0.0460 -0.1589 0.0889 379 TYR A N 5084 C CA . TYR A 350 ? 0.7975 0.4293 0.7330 0.0424 -0.1594 0.0829 379 TYR A CA 5085 C C . TYR A 350 ? 0.8031 0.4332 0.7305 0.0449 -0.1481 0.0774 379 TYR A C 5086 O O . TYR A 350 ? 0.7979 0.4279 0.7347 0.0499 -0.1386 0.0780 379 TYR A O 5087 C CB . TYR A 350 ? 0.8001 0.4270 0.7331 0.0418 -0.1633 0.0856 379 TYR A CB 5088 C CG . TYR A 350 ? 0.7963 0.4207 0.7372 0.0478 -0.1532 0.0871 379 TYR A CG 5089 C CD1 . TYR A 350 ? 0.7964 0.4229 0.7586 0.0537 -0.1491 0.0938 379 TYR A CD1 5090 C CD2 . TYR A 350 ? 0.7915 0.4098 0.7179 0.0475 -0.1477 0.0825 379 TYR A CD2 5091 C CE1 . TYR A 350 ? 0.7943 0.4146 0.7605 0.0600 -0.1380 0.0953 379 TYR A CE1 5092 C CE2 . TYR A 350 ? 0.7930 0.4055 0.7230 0.0523 -0.1391 0.0836 379 TYR A CE2 5093 C CZ . TYR A 350 ? 0.7959 0.4082 0.7445 0.0589 -0.1335 0.0897 379 TYR A CZ 5094 O OH . TYR A 350 ? 0.8075 0.4105 0.7572 0.0645 -0.1231 0.0909 379 TYR A OH 5104 N N . ARG A 351 ? 0.7134 0.3404 0.6228 0.0410 -0.1490 0.0728 380 ARG A N 5105 C CA . ARG A 351 ? 0.7207 0.3463 0.6220 0.0412 -0.1415 0.0683 380 ARG A CA 5106 C C . ARG A 351 ? 0.7494 0.3688 0.6507 0.0437 -0.1356 0.0686 380 ARG A C 5107 O O . ARG A 351 ? 0.7740 0.3894 0.6707 0.0426 -0.1383 0.0699 380 ARG A O 5108 C CB . ARG A 351 ? 0.7079 0.3319 0.5934 0.0366 -0.1441 0.0659 380 ARG A CB 5109 C CG . ARG A 351 ? 0.6920 0.3157 0.5712 0.0355 -0.1386 0.0629 380 ARG A CG 5110 C CD . ARG A 351 ? 0.6767 0.3050 0.5584 0.0358 -0.1359 0.0605 380 ARG A CD 5111 N NE . ARG A 351 ? 0.6698 0.2969 0.5466 0.0342 -0.1319 0.0584 380 ARG A NE 5112 C CZ . ARG A 351 ? 0.6760 0.2986 0.5531 0.0353 -0.1278 0.0571 380 ARG A CZ 5113 N NH1 . ARG A 351 ? 0.6759 0.2949 0.5597 0.0395 -0.1245 0.0580 380 ARG A NH1 5114 N NH2 . ARG A 351 ? 0.6845 0.3042 0.5546 0.0322 -0.1268 0.0556 380 ARG A NH2 5128 N N . ASP A 352 ? 0.8266 0.4431 0.7312 0.0470 -0.1273 0.0673 381 ASP A N 5129 C CA . ASP A 352 ? 0.8392 0.4455 0.7386 0.0488 -0.1211 0.0667 381 ASP A CA 5130 C C . ASP A 352 ? 0.8418 0.4442 0.7250 0.0436 -0.1222 0.0624 381 ASP A C 5131 O O . ASP A 352 ? 0.8460 0.4462 0.7247 0.0430 -0.1186 0.0597 381 ASP A O 5132 C CB . ASP A 352 ? 0.8418 0.4424 0.7501 0.0552 -0.1105 0.0681 381 ASP A CB 5133 C CG . ASP A 352 ? 0.8500 0.4360 0.7518 0.0579 -0.1034 0.0681 381 ASP A CG 5134 O OD1 . ASP A 352 ? 0.8448 0.4260 0.7343 0.0538 -0.1081 0.0665 381 ASP A OD1 5135 O OD2 . ASP A 352 ? 0.8608 0.4388 0.7697 0.0641 -0.0924 0.0702 381 ASP A OD2 5140 N N . LEU A 353 ? 0.8058 0.4070 0.6811 0.0397 -0.1274 0.0629 382 LEU A N 5141 C CA . LEU A 353 ? 0.8107 0.4099 0.6746 0.0342 -0.1298 0.0612 382 LEU A CA 5142 C C . LEU A 353 ? 0.8254 0.4124 0.6795 0.0331 -0.1267 0.0593 382 LEU A C 5143 O O . LEU A 353 ? 0.8135 0.3983 0.6592 0.0281 -0.1293 0.0584 382 LEU A O 5144 C CB . LEU A 353 ? 0.8212 0.4209 0.6811 0.0309 -0.1349 0.0638 382 LEU A CB 5145 C CG . LEU A 353 ? 0.8225 0.4295 0.6857 0.0309 -0.1382 0.0656 382 LEU A CG 5146 C CD1 . LEU A 353 ? 0.8359 0.4402 0.6938 0.0284 -0.1415 0.0685 382 LEU A CD1 5147 C CD2 . LEU A 353 ? 0.8179 0.4312 0.6806 0.0295 -0.1376 0.0647 382 LEU A CD2 5159 N N . ARG A 354 ? 1.0287 0.6061 0.8834 0.0378 -0.1211 0.0594 383 ARG A N 5160 C CA . ARG A 354 ? 1.0361 0.5969 0.8771 0.0373 -0.1170 0.0572 383 ARG A CA 5161 C C . ARG A 354 ? 1.0294 0.5886 0.8660 0.0365 -0.1140 0.0543 383 ARG A C 5162 O O . ARG A 354 ? 1.0411 0.5866 0.8610 0.0328 -0.1143 0.0520 383 ARG A O 5163 C CB . ARG A 354 ? 1.0343 0.5842 0.8790 0.0442 -0.1087 0.0586 383 ARG A CB 5164 C CG . ARG A 354 ? 1.0338 0.5623 0.8615 0.0448 -0.1022 0.0560 383 ARG A CG 5165 C CD . ARG A 354 ? 1.0469 0.5636 0.8798 0.0524 -0.0925 0.0585 383 ARG A CD 5166 N NE . ARG A 354 ? 1.0319 0.5602 0.8909 0.0603 -0.0855 0.0630 383 ARG A NE 5167 C CZ . ARG A 354 ? 0.9979 0.5392 0.8742 0.0625 -0.0889 0.0676 383 ARG A CZ 5168 N NH1 . ARG A 354 ? 0.9901 0.5346 0.8607 0.0578 -0.0983 0.0677 383 ARG A NH1 5169 N NH2 . ARG A 354 ? 0.9947 0.5450 0.8939 0.0691 -0.0836 0.0729 383 ARG A NH2 5183 N N . ARG A 355 ? 0.6910 0.2628 0.5409 0.0394 -0.1120 0.0546 384 ARG A N 5184 C CA . ARG A 355 ? 0.6249 0.1966 0.4726 0.0391 -0.1089 0.0521 384 ARG A CA 5185 C C . ARG A 355 ? 0.6079 0.1938 0.4588 0.0345 -0.1156 0.0518 384 ARG A C 5186 O O . ARG A 355 ? 0.6626 0.2590 0.5203 0.0336 -0.1204 0.0538 384 ARG A O 5187 C CB . ARG A 355 ? 0.6231 0.1967 0.4852 0.0467 -0.0998 0.0534 384 ARG A CB 5188 C CG . ARG A 355 ? 0.6399 0.2004 0.5047 0.0530 -0.0905 0.0556 384 ARG A CG 5189 C CD . ARG A 355 ? 0.6624 0.2018 0.5077 0.0527 -0.0842 0.0523 384 ARG A CD 5190 N NE . ARG A 355 ? 0.6626 0.2003 0.5083 0.0544 -0.0779 0.0506 384 ARG A NE 5191 C CZ . ARG A 355 ? 0.6681 0.1989 0.4953 0.0488 -0.0810 0.0465 384 ARG A CZ 5192 N NH1 . ARG A 355 ? 0.6740 0.1994 0.4824 0.0407 -0.0908 0.0444 384 ARG A NH1 5193 N NH2 . ARG A 355 ? 0.6686 0.1979 0.4973 0.0510 -0.0746 0.0454 384 ARG A NH2 5207 N N . PRO A 356 ? 0.6527 0.2373 0.4976 0.0318 -0.1155 0.0496 385 PRO A N 5208 C CA . PRO A 356 ? 0.6368 0.2349 0.4874 0.0288 -0.1199 0.0499 385 PRO A CA 5209 C C . PRO A 356 ? 0.6243 0.2332 0.4885 0.0336 -0.1171 0.0501 385 PRO A C 5210 O O . PRO A 356 ? 0.6286 0.2345 0.4988 0.0388 -0.1111 0.0502 385 PRO A O 5211 C CB . PRO A 356 ? 0.6426 0.2341 0.4829 0.0248 -0.1205 0.0480 385 PRO A CB 5212 C CG . PRO A 356 ? 0.8432 0.4192 0.6745 0.0281 -0.1135 0.0457 385 PRO A CG 5213 C CD . PRO A 356 ? 0.8542 0.4233 0.6853 0.0313 -0.1112 0.0470 385 PRO A CD 5221 N N . PHE A 357 ? 0.6093 0.2294 0.4784 0.0320 -0.1209 0.0509 386 PHE A N 5222 C CA . PHE A 357 ? 0.6008 0.2291 0.4801 0.0353 -0.1207 0.0513 386 PHE A CA 5223 C C . PHE A 357 ? 0.5973 0.2269 0.4805 0.0372 -0.1166 0.0496 386 PHE A C 5224 O O . PHE A 357 ? 0.5943 0.2280 0.4879 0.0407 -0.1152 0.0508 386 PHE A O 5225 C CB . PHE A 357 ? 0.5940 0.2293 0.4725 0.0330 -0.1251 0.0524 386 PHE A CB 5226 C CG . PHE A 357 ? 0.5902 0.2305 0.4747 0.0350 -0.1273 0.0529 386 PHE A CG 5227 C CD1 . PHE A 357 ? 0.5950 0.2344 0.4830 0.0363 -0.1307 0.0552 386 PHE A CD1 5228 C CD2 . PHE A 357 ? 0.5838 0.2285 0.4699 0.0348 -0.1271 0.0515 386 PHE A CD2 5229 C CE1 . PHE A 357 ? 0.5950 0.2370 0.4873 0.0367 -0.1353 0.0565 386 PHE A CE1 5230 C CE2 . PHE A 357 ? 0.5833 0.2305 0.4732 0.0356 -0.1308 0.0524 386 PHE A CE2 5231 C CZ . PHE A 357 ? 0.5897 0.2352 0.4824 0.0361 -0.1356 0.0550 386 PHE A CZ 5241 N N . SER A 358 ? 0.6284 0.2542 0.5039 0.0345 -0.1153 0.0474 387 SER A N 5242 C CA . SER A 358 ? 0.6265 0.2522 0.5038 0.0359 -0.1112 0.0456 387 SER A CA 5243 C C . SER A 358 ? 0.6374 0.2536 0.5169 0.0409 -0.1031 0.0459 387 SER A C 5244 O O . SER A 358 ? 0.6368 0.2528 0.5217 0.0438 -0.0978 0.0457 387 SER A O 5245 C CB . SER A 358 ? 0.6281 0.2505 0.4951 0.0309 -0.1131 0.0439 387 SER A CB 5246 O OG . SER A 358 ? 0.6421 0.2526 0.4967 0.0277 -0.1144 0.0438 387 SER A OG 5252 N N . ALA A 359 ? 0.6651 0.2723 0.5409 0.0423 -0.1010 0.0469 388 ALA A N 5253 C CA . ALA A 359 ? 0.6789 0.2745 0.5571 0.0481 -0.0910 0.0481 388 ALA A CA 5254 C C . ALA A 359 ? 0.6724 0.2766 0.5724 0.0544 -0.0870 0.0527 388 ALA A C 5255 O O . ALA A 359 ? 0.6615 0.2776 0.5708 0.0537 -0.0941 0.0549 388 ALA A O 5256 C CB . ALA A 359 ? 0.6937 0.2773 0.5627 0.0481 -0.0902 0.0484 388 ALA A CB 5262 N N . PRO A 360 ? 0.5817 0.1787 0.4901 0.0605 -0.0757 0.0551 389 PRO A N 5263 C CA . PRO A 360 ? 0.5779 0.1825 0.5104 0.0670 -0.0716 0.0620 389 PRO A CA 5264 C C . PRO A 360 ? 0.5807 0.1871 0.5225 0.0697 -0.0736 0.0668 389 PRO A C 5265 O O . PRO A 360 ? 0.5737 0.1911 0.5307 0.0710 -0.0790 0.0718 389 PRO A O 5266 C CB . PRO A 360 ? 0.5917 0.1843 0.5307 0.0737 -0.0564 0.0644 389 PRO A CB 5267 C CG . PRO A 360 ? 0.6738 0.2560 0.5897 0.0687 -0.0562 0.0570 389 PRO A CG 5268 C CD . PRO A 360 ? 0.5977 0.1784 0.4934 0.0614 -0.0667 0.0522 389 PRO A CD 5276 N N . ASP A 361 ? 0.7887 0.3832 0.7196 0.0698 -0.0706 0.0653 390 ASP A N 5277 C CA . ASP A 361 ? 0.7927 0.3874 0.7308 0.0721 -0.0723 0.0696 390 ASP A CA 5278 C C . ASP A 361 ? 0.7844 0.3855 0.7103 0.0647 -0.0860 0.0660 390 ASP A C 5279 O O . ASP A 361 ? 0.7916 0.3872 0.7120 0.0642 -0.0875 0.0663 390 ASP A O 5280 C CB . ASP A 361 ? 0.8128 0.3898 0.7472 0.0767 -0.0609 0.0705 390 ASP A CB 5281 C CG . ASP A 361 ? 0.8231 0.3866 0.7292 0.0705 -0.0635 0.0626 390 ASP A CG 5282 O OD1 . ASP A 361 ? 0.8155 0.3824 0.7082 0.0643 -0.0702 0.0576 390 ASP A OD1 5283 O OD2 . ASP A 361 ? 0.8407 0.3892 0.7372 0.0717 -0.0595 0.0621 390 ASP A OD2 5288 N N . ALA A 362 ? 0.6852 0.2969 0.6071 0.0593 -0.0949 0.0630 391 ALA A N 5289 C CA . ALA A 362 ? 0.6786 0.2958 0.5910 0.0531 -0.1058 0.0608 391 ALA A CA 5290 C C . ALA A 362 ? 0.6779 0.3009 0.6006 0.0539 -0.1120 0.0654 391 ALA A C 5291 O O . ALA A 362 ? 0.6801 0.3017 0.5954 0.0510 -0.1174 0.0651 391 ALA A O 5292 C CB . ALA A 362 ? 0.6669 0.2921 0.5742 0.0485 -0.1113 0.0576 391 ALA A CB 5298 N N . CYS A 363 ? 0.5662 0.1950 0.5060 0.0574 -0.1120 0.0703 392 CYS A N 5299 C CA . CYS A 363 ? 0.5682 0.2019 0.5188 0.0573 -0.1200 0.0757 392 CYS A CA 5300 C C . CYS A 363 ? 1.0406 0.6702 1.0070 0.0645 -0.1123 0.0825 392 CYS A C 5301 O O . CYS A 363 ? 1.0609 0.6875 1.0376 0.0708 -0.1013 0.0855 392 CYS A O 5302 C CB . CYS A 363 ? 0.5621 0.2049 0.5210 0.0545 -0.1287 0.0778 392 CYS A CB 5303 S SG . CYS A 363 ? 0.5540 0.1988 0.4934 0.0473 -0.1360 0.0708 392 CYS A SG 5308 N N . LYS A 364 ? 0.7995 0.4276 0.7674 0.0642 -0.1170 0.0855 393 LYS A N 5309 C CA . LYS A 364 ? 0.7641 0.3877 0.7468 0.0716 -0.1096 0.0927 393 LYS A CA 5310 C C . LYS A 364 ? 0.6981 0.3307 0.6990 0.0706 -0.1207 0.1006 393 LYS A C 5311 O O . LYS A 364 ? 0.6784 0.3156 0.6733 0.0631 -0.1350 0.0994 393 LYS A O 5312 C CB . LYS A 364 ? 0.7878 0.4008 0.7581 0.0720 -0.1059 0.0904 393 LYS A CB 5313 C CG . LYS A 364 ? 0.8065 0.4121 0.7898 0.0804 -0.0967 0.0978 393 LYS A CG 5314 C CD . LYS A 364 ? 0.8135 0.4061 0.7823 0.0806 -0.0914 0.0944 393 LYS A CD 5315 C CE . LYS A 364 ? 0.8239 0.4090 0.8048 0.0885 -0.0839 0.1022 393 LYS A CE 5316 N NZ . LYS A 364 ? 0.8338 0.4111 0.8283 0.0997 -0.0668 0.1088 393 LYS A NZ 5330 N N . ALA A 365 ? 0.7278 0.3613 0.7502 0.0781 -0.1141 0.1092 394 ALA A N 5331 C CA . ALA A 365 ? 0.6962 0.3399 0.7410 0.0763 -0.1262 0.1184 394 ALA A CA 5332 C C . ALA A 365 ? 0.7250 0.3667 0.7670 0.0731 -0.1350 0.1202 394 ALA A C 5333 O O . ALA A 365 ? 0.7307 0.3623 0.7626 0.0772 -0.1263 0.1181 394 ALA A O 5334 C CB . ALA A 365 ? 0.6702 0.3153 0.7402 0.0858 -0.1161 0.1279 394 ALA A CB 5340 N N . CYS A 366 ? 0.7080 0.3576 0.7574 0.0651 -0.1530 0.1241 395 CYS A N 5341 C CA . CYS A 366 ? 0.7525 0.3996 0.7993 0.0612 -0.1632 0.1265 395 CYS A CA 5342 C C . CYS A 366 ? 0.7879 0.4386 0.8627 0.0671 -0.1613 0.1379 395 CYS A C 5343 O O . CYS A 366 ? 0.7949 0.4542 0.8958 0.0703 -0.1598 0.1459 395 CYS A O 5344 C CB . CYS A 366 ? 0.7584 0.4077 0.7966 0.0494 -0.1835 0.1257 395 CYS A CB 5345 S SG . CYS A 366 ? 0.9499 0.5931 0.9542 0.0434 -0.1849 0.1132 395 CYS A SG 5350 N N . SER A 367 ? 1.2193 0.9707 1.1546 -0.0063 -0.1038 0.1841 396 SER A N 5351 C CA . SER A 367 ? 1.2481 0.9921 1.1666 -0.0070 -0.0827 0.1833 396 SER A CA 5352 C C . SER A 367 ? 1.1896 0.9529 1.1427 -0.0011 -0.0753 0.1711 396 SER A C 5353 O O . SER A 367 ? 1.2083 0.9672 1.1522 -0.0007 -0.0669 0.1668 396 SER A O 5354 C CB . SER A 367 ? 1.3071 1.0292 1.1804 -0.0127 -0.0859 0.1843 396 SER A CB 5355 O OG . SER A 367 ? 1.3595 1.0615 1.1907 -0.0182 -0.0942 0.1953 396 SER A OG 5361 N N . CYS A 368 ? 0.8441 0.6261 0.8341 0.0036 -0.0797 0.1659 397 CYS A N 5362 C CA . CYS A 368 ? 0.7762 0.5756 0.7937 0.0095 -0.0745 0.1553 397 CYS A CA 5363 C C . CYS A 368 ? 0.7521 0.5484 0.7671 0.0110 -0.0577 0.1561 397 CYS A C 5364 O O . CYS A 368 ? 0.7561 0.5501 0.7781 0.0092 -0.0521 0.1618 397 CYS A O 5365 C CB . CYS A 368 ? 0.7412 0.5565 0.7940 0.0141 -0.0837 0.1500 397 CYS A CB 5366 S SG . CYS A 368 ? 0.6821 0.5046 0.7515 0.0150 -0.1041 0.1484 397 CYS A SG 5371 N N . HIS A 369 ? 0.5198 0.3156 0.5290 0.0138 -0.0505 0.1515 398 HIS A N 5372 C CA . HIS A 369 ? 0.5009 0.2956 0.5146 0.0172 -0.0369 0.1522 398 HIS A CA 5373 C C . HIS A 369 ? 0.4714 0.2854 0.5212 0.0221 -0.0397 0.1475 398 HIS A C 5374 O O . HIS A 369 ? 0.4554 0.2823 0.5196 0.0266 -0.0484 0.1397 398 HIS A O 5375 C CB . HIS A 369 ? 0.4907 0.2797 0.4940 0.0209 -0.0317 0.1478 398 HIS A CB 5376 C CG . HIS A 369 ? 0.4930 0.2778 0.5015 0.0261 -0.0174 0.1500 398 HIS A CG 5377 N ND1 . HIS A 369 ? 0.4721 0.2737 0.5098 0.0343 -0.0162 0.1458 398 HIS A ND1 5378 C CD2 . HIS A 369 ? 0.5174 0.2865 0.5068 0.0259 -0.0025 0.1530 398 HIS A CD2 5379 C CE1 . HIS A 369 ? 0.4794 0.2762 0.5234 0.0398 -0.0020 0.1487 398 HIS A CE1 5380 N NE2 . HIS A 369 ? 0.5063 0.2860 0.5190 0.0347 0.0087 0.1494 398 HIS A NE2 5387 N N . PRO A 370 ? 0.5400 0.3554 0.6065 0.0208 -0.0320 0.1534 399 PRO A N 5388 C CA . PRO A 370 ? 0.5098 0.3411 0.6146 0.0235 -0.0386 0.1494 399 PRO A CA 5389 C C . PRO A 370 ? 0.4612 0.3057 0.5818 0.0334 -0.0429 0.1395 399 PRO A C 5390 O O . PRO A 370 ? 0.4488 0.3040 0.5909 0.0371 -0.0544 0.1322 399 PRO A O 5391 C CB . PRO A 370 ? 0.5315 0.3610 0.6546 0.0183 -0.0262 0.1606 399 PRO A CB 5392 C CG . PRO A 370 ? 0.5543 0.3714 0.6516 0.0180 -0.0090 0.1677 399 PRO A CG 5393 C CD . PRO A 370 ? 0.5653 0.3681 0.6204 0.0164 -0.0155 0.1650 399 PRO A CD 5401 N N . VAL A 371 ? 0.5420 0.3829 0.6495 0.0384 -0.0350 0.1394 400 VAL A N 5402 C CA . VAL A 371 ? 0.4959 0.3463 0.6127 0.0486 -0.0396 0.1325 400 VAL A CA 5403 C C . VAL A 371 ? 0.4639 0.3125 0.5578 0.0509 -0.0451 0.1276 400 VAL A C 5404 O O . VAL A 371 ? 0.4538 0.3111 0.5539 0.0579 -0.0536 0.1225 400 VAL A O 5405 C CB . VAL A 371 ? 0.3745 0.2210 0.4936 0.0547 -0.0286 0.1356 400 VAL A CB 5406 C CG1 . VAL A 371 ? 0.3699 0.2259 0.4982 0.0662 -0.0372 0.1294 400 VAL A CG1 5407 C CG2 . VAL A 371 ? 0.3792 0.2288 0.5278 0.0526 -0.0175 0.1435 400 VAL A CG2 5417 N N . GLY A 372 ? 0.4281 0.2646 0.4969 0.0451 -0.0405 0.1304 401 GLY A N 5418 C CA . GLY A 372 ? 0.4047 0.2397 0.4593 0.0452 -0.0433 0.1290 401 GLY A CA 5419 C C . GLY A 372 ? 0.3765 0.2217 0.4423 0.0438 -0.0524 0.1267 401 GLY A C 5420 O O . GLY A 372 ? 0.3709 0.2201 0.4361 0.0463 -0.0546 0.1269 401 GLY A O 5424 N N . SER A 373 ? 0.4562 0.3042 0.5345 0.0404 -0.0572 0.1262 402 SER A N 5425 C CA . SER A 373 ? 0.4364 0.2920 0.5298 0.0406 -0.0671 0.1232 402 SER A CA 5426 C C . SER A 373 ? 0.4320 0.2981 0.5470 0.0496 -0.0744 0.1154 402 SER A C 5427 O O . SER A 373 ? 0.4280 0.2955 0.5552 0.0513 -0.0764 0.1126 402 SER A O 5428 C CB . SER A 373 ? 0.4214 0.2714 0.5167 0.0338 -0.0710 0.1268 402 SER A CB 5429 O OG . SER A 373 ? 0.4241 0.2619 0.4952 0.0269 -0.0675 0.1333 402 SER A OG 5435 N N . ALA A 374 ? 0.5489 0.4218 0.6715 0.0559 -0.0793 0.1119 403 ALA A N 5436 C CA . ALA A 374 ? 0.5434 0.4240 0.6832 0.0671 -0.0877 0.1014 403 ALA A CA 5437 C C . ALA A 374 ? 0.5373 0.4179 0.7006 0.0665 -0.0970 0.0940 403 ALA A C 5438 O O . ALA A 374 ? 0.5239 0.4018 0.6908 0.0597 -0.0981 0.0982 403 ALA A O 5439 C CB . ALA A 374 ? 0.5443 0.4389 0.6753 0.0721 -0.0815 0.0941 403 ALA A CB 5445 N N . ILE A 375 ? 0.5384 0.4205 0.7169 0.0735 -0.1057 0.0825 404 ILE A N 5446 C CA . ILE A 375 ? 0.5451 0.4239 0.7481 0.0725 -0.1153 0.0743 404 ILE A CA 5447 C C . ILE A 375 ? 0.5797 0.4632 0.7977 0.0876 -0.1251 0.0553 404 ILE A C 5448 O O . ILE A 375 ? 0.5884 0.4791 0.7932 0.0962 -0.1252 0.0444 404 ILE A O 5449 C CB . ILE A 375 ? 0.5226 0.3960 0.7384 0.0653 -0.1188 0.0754 404 ILE A CB 5450 C CG1 . ILE A 375 ? 0.5100 0.3806 0.7115 0.0543 -0.1065 0.0917 404 ILE A CG1 5451 C CG2 . ILE A 375 ? 0.5234 0.3890 0.7650 0.0610 -0.1284 0.0712 404 ILE A CG2 5452 C CD1 . ILE A 375 ? 0.5125 0.3820 0.7344 0.0486 -0.1074 0.0947 404 ILE A CD1 5464 N N . LEU A 376 ? 0.3973 0.2796 0.6346 0.0894 -0.1303 0.0486 405 LEU A N 5465 C CA . LEU A 376 ? 0.4426 0.3291 0.6971 0.1057 -0.1381 0.0262 405 LEU A CA 5466 C C . LEU A 376 ? 0.4993 0.3757 0.7672 0.1072 -0.1511 0.0110 405 LEU A C 5467 O O . LEU A 376 ? 0.5000 0.3671 0.7756 0.0934 -0.1544 0.0206 405 LEU A O 5468 C CB . LEU A 376 ? 0.4391 0.3285 0.7141 0.1076 -0.1392 0.0237 405 LEU A CB 5469 C CG . LEU A 376 ? 0.4287 0.3303 0.7010 0.1061 -0.1306 0.0362 405 LEU A CG 5470 C CD1 . LEU A 376 ? 0.4306 0.3370 0.7302 0.1097 -0.1359 0.0312 405 LEU A CD1 5471 C CD2 . LEU A 376 ? 0.4373 0.3599 0.6884 0.1115 -0.1145 0.0294 405 LEU A CD2 5483 N N . PRO A 377 ? 0.5373 0.4171 0.8072 0.1234 -0.1577 -0.0144 406 PRO A N 5484 C CA . PRO A 377 ? 0.5773 0.4438 0.8655 0.1264 -0.1755 -0.0326 406 PRO A CA 5485 C C . PRO A 377 ? 0.6121 0.4658 0.9298 0.1167 -0.1820 -0.0323 406 PRO A C 5486 O O . PRO A 377 ? 0.4340 0.2902 0.7581 0.1165 -0.1760 -0.0262 406 PRO A O 5487 C CB . PRO A 377 ? 0.5990 0.4763 0.8658 0.1429 -0.1744 -0.0622 406 PRO A CB 5488 C CG . PRO A 377 ? 0.5893 0.4841 0.8448 0.1491 -0.1554 -0.0601 406 PRO A CG 5489 C CD . PRO A 377 ? 0.5553 0.4546 0.8033 0.1353 -0.1444 -0.0292 406 PRO A CD 5497 N N . PHE A 378 ? 0.6329 0.4734 0.9710 0.1090 -0.1961 -0.0380 407 PHE A N 5498 C CA . PHE A 378 ? 0.6542 0.4803 1.0218 0.0985 -0.2041 -0.0344 407 PHE A CA 5499 C C . PHE A 378 ? 0.5997 0.4256 0.9631 0.0825 -0.1929 -0.0031 407 PHE A C 5500 O O . PHE A 378 ? 0.6153 0.4331 0.9911 0.0790 -0.1955 0.0036 407 PHE A O 5501 C CB . PHE A 378 ? 0.7157 0.5378 1.0960 0.1128 -0.2096 -0.0562 407 PHE A CB 5502 C CG . PHE A 378 ? 0.7650 0.5856 1.1443 0.1306 -0.2203 -0.0914 407 PHE A CG 5503 C CD1 . PHE A 378 ? 0.5263 0.3313 0.9278 0.1278 -0.2399 -0.1085 407 PHE A CD1 5504 C CD2 . PHE A 378 ? 0.7793 0.6142 1.1347 0.1508 -0.2110 -0.1087 407 PHE A CD2 5505 C CE1 . PHE A 378 ? 0.5559 0.3573 0.9504 0.1450 -0.2521 -0.1445 407 PHE A CE1 5506 C CE2 . PHE A 378 ? 0.5356 0.3678 0.8808 0.1695 -0.2200 -0.1442 407 PHE A CE2 5507 C CZ . PHE A 378 ? 0.5626 0.3768 0.9246 0.1666 -0.2416 -0.1633 407 PHE A CZ 5517 N N . SER A 379 ? 0.5407 0.3746 0.8843 0.0745 -0.1816 0.0146 408 SER A N 5518 C CA . SER A 379 ? 0.5075 0.3396 0.8424 0.0597 -0.1712 0.0415 408 SER A CA 5519 C C . SER A 379 ? 0.4916 0.3306 0.8156 0.0524 -0.1622 0.0529 408 SER A C 5520 O O . SER A 379 ? 0.4366 0.2848 0.7495 0.0607 -0.1613 0.0437 408 SER A O 5521 C CB . SER A 379 ? 0.4953 0.3333 0.8090 0.0629 -0.1625 0.0502 408 SER A CB 5522 O OG . SER A 379 ? 0.4881 0.3394 0.7770 0.0682 -0.1519 0.0509 408 SER A OG 5528 N N . SER A 380 ? 0.8065 0.6409 1.1336 0.0385 -0.1553 0.0729 409 SER A N 5529 C CA . SER A 380 ? 0.8217 0.6627 1.1479 0.0319 -0.1459 0.0832 409 SER A CA 5530 C C . SER A 380 ? 0.8027 0.6453 1.0962 0.0263 -0.1282 0.1024 409 SER A C 5531 O O . SER A 380 ? 0.8259 0.6721 1.1185 0.0207 -0.1174 0.1129 409 SER A O 5532 C CB . SER A 380 ? 0.8422 0.6773 1.2076 0.0206 -0.1512 0.0886 409 SER A CB 5533 O OG . SER A 380 ? 0.8604 0.6829 1.2290 0.0115 -0.1497 0.1028 409 SER A OG 5539 N N . VAL A 381 ? 0.5935 0.4331 0.8631 0.0288 -0.1264 0.1054 410 VAL A N 5540 C CA . VAL A 381 ? 0.5356 0.3733 0.7719 0.0240 -0.1136 0.1203 410 VAL A CA 5541 C C . VAL A 381 ? 0.6015 0.4429 0.8185 0.0308 -0.1157 0.1159 410 VAL A C 5542 O O . VAL A 381 ? 0.4838 0.3254 0.7155 0.0368 -0.1264 0.1069 410 VAL A O 5543 C CB . VAL A 381 ? 0.4089 0.2322 0.6411 0.0133 -0.1106 0.1377 410 VAL A CB 5544 C CG1 . VAL A 381 ? 0.4258 0.2396 0.6695 0.0147 -0.1246 0.1363 410 VAL A CG1 5545 C CG2 . VAL A 381 ? 0.4172 0.2349 0.6094 0.0092 -0.0980 0.1510 410 VAL A CG2 5555 N N . THR A 382 ? 0.9099 0.7539 1.0984 0.0298 -0.1058 0.1218 411 THR A N 5556 C CA . THR A 382 ? 0.7995 0.6474 0.9749 0.0337 -0.1082 0.1201 411 THR A CA 5557 C C . THR A 382 ? 0.7739 0.6112 0.9364 0.0277 -0.1129 0.1313 411 THR A C 5558 O O . THR A 382 ? 0.7856 0.6108 0.9286 0.0202 -0.1069 0.1434 411 THR A O 5559 C CB . THR A 382 ? 0.7738 0.6266 0.9264 0.0345 -0.0979 0.1210 411 THR A CB 5560 O OG1 . THR A 382 ? 0.7781 0.6391 0.9389 0.0414 -0.0953 0.1124 411 THR A OG1 5561 C CG2 . THR A 382 ? 0.7741 0.6316 0.9221 0.0366 -0.1021 0.1204 411 THR A CG2 5569 N N . PHE A 383 ? 0.5947 0.4360 0.7685 0.0323 -0.1242 0.1274 412 PHE A N 5570 C CA . PHE A 383 ? 0.5928 0.4253 0.7553 0.0284 -0.1333 0.1374 412 PHE A CA 5571 C C . PHE A 383 ? 0.5601 0.4037 0.7257 0.0318 -0.1391 0.1338 412 PHE A C 5572 O O . PHE A 383 ? 0.5399 0.3982 0.7295 0.0399 -0.1397 0.1228 412 PHE A O 5573 C CB . PHE A 383 ? 0.6268 0.4515 0.8114 0.0303 -0.1464 0.1384 412 PHE A CB 5574 C CG . PHE A 383 ? 0.6810 0.4915 0.8644 0.0242 -0.1423 0.1465 412 PHE A CG 5575 C CD1 . PHE A 383 ? 0.7078 0.5076 0.8613 0.0156 -0.1302 0.1598 412 PHE A CD1 5576 C CD2 . PHE A 383 ? 0.7047 0.5115 0.9193 0.0269 -0.1503 0.1406 412 PHE A CD2 5577 C CE1 . PHE A 383 ? 0.7245 0.5123 0.8822 0.0091 -0.1249 0.1690 412 PHE A CE1 5578 C CE2 . PHE A 383 ? 0.7209 0.5146 0.9404 0.0195 -0.1475 0.1494 412 PHE A CE2 5579 C CZ . PHE A 383 ? 0.7281 0.5133 0.9205 0.0102 -0.1341 0.1646 412 PHE A CZ 5589 N N . CYS A 384 ? 0.5773 0.4131 0.7194 0.0257 -0.1438 0.1435 413 CYS A N 5590 C CA . CYS A 384 ? 0.5803 0.4258 0.7279 0.0261 -0.1512 0.1418 413 CYS A CA 5591 C C . CYS A 384 ? 0.5877 0.4432 0.7707 0.0322 -0.1693 0.1383 413 CYS A C 5592 O O . CYS A 384 ? 0.5935 0.4427 0.7878 0.0351 -0.1778 0.1392 413 CYS A O 5593 C CB . CYS A 384 ? 0.6065 0.4373 0.7160 0.0169 -0.1535 0.1519 413 CYS A CB 5594 S SG . CYS A 384 ? 0.5683 0.3796 0.6563 0.0128 -0.1702 0.1647 413 CYS A SG 5599 N N . ASP A 385 ? 0.5079 0.3791 0.7122 0.0343 -0.1750 0.1348 414 ASP A N 5600 C CA . ASP A 385 ? 0.5325 0.4180 0.7770 0.0408 -0.1920 0.1308 414 ASP A CA 5601 C C . ASP A 385 ? 0.5617 0.4312 0.7900 0.0353 -0.2118 0.1411 414 ASP A C 5602 O O . ASP A 385 ? 0.5855 0.4446 0.7844 0.0262 -0.2187 0.1495 414 ASP A O 5603 C CB . ASP A 385 ? 0.5371 0.4455 0.8104 0.0418 -0.1933 0.1278 414 ASP A CB 5604 C CG . ASP A 385 ? 0.5512 0.4848 0.8798 0.0514 -0.2055 0.1194 414 ASP A CG 5605 O OD1 . ASP A 385 ? 0.5736 0.5000 0.9101 0.0550 -0.2189 0.1188 414 ASP A OD1 5606 O OD2 . ASP A 385 ? 0.5393 0.5018 0.9066 0.0554 -0.2004 0.1138 414 ASP A OD2 5611 N N . PRO A 386 ? 0.4638 0.3283 0.7087 0.0412 -0.2222 0.1407 415 PRO A N 5612 C CA . PRO A 386 ? 0.5030 0.3490 0.7280 0.0368 -0.2417 0.1531 415 PRO A CA 5613 C C . PRO A 386 ? 0.5167 0.3712 0.7532 0.0348 -0.2632 0.1548 415 PRO A C 5614 O O . PRO A 386 ? 0.5539 0.3905 0.7621 0.0295 -0.2805 0.1659 415 PRO A O 5615 C CB . PRO A 386 ? 0.5173 0.3591 0.7700 0.0456 -0.2491 0.1506 415 PRO A CB 5616 C CG . PRO A 386 ? 0.4895 0.3386 0.7579 0.0510 -0.2301 0.1388 415 PRO A CG 5617 C CD . PRO A 386 ? 0.4556 0.3262 0.7325 0.0519 -0.2172 0.1297 415 PRO A CD 5625 N N . SER A 387 ? 0.4926 0.3747 0.7710 0.0388 -0.2626 0.1443 416 SER A N 5626 C CA . SER A 387 ? 0.5040 0.4003 0.8073 0.0368 -0.2843 0.1440 416 SER A CA 5627 C C . SER A 387 ? 0.5119 0.4027 0.7851 0.0240 -0.2880 0.1496 416 SER A C 5628 O O . SER A 387 ? 0.5310 0.4209 0.8043 0.0183 -0.3117 0.1525 416 SER A O 5629 C CB . SER A 387 ? 0.4786 0.4127 0.8504 0.0473 -0.2805 0.1297 416 SER A CB 5630 O OG . SER A 387 ? 0.5706 0.5218 0.9521 0.0478 -0.2574 0.1237 416 SER A OG 5636 N N . ASN A 388 ? 0.6787 0.5638 0.9260 0.0196 -0.2663 0.1502 417 ASN A N 5637 C CA . ASN A 388 ? 0.7010 0.5774 0.9205 0.0080 -0.2686 0.1546 417 ASN A CA 5638 C C . ASN A 388 ? 0.6881 0.5384 0.8497 0.0026 -0.2467 0.1592 417 ASN A C 5639 O O . ASN A 388 ? 0.7123 0.5469 0.8409 -0.0068 -0.2471 0.1623 417 ASN A O 5640 C CB . ASN A 388 ? 0.6959 0.6038 0.9674 0.0082 -0.2652 0.1490 417 ASN A CB 5641 C CG . ASN A 388 ? 0.6807 0.6051 0.9710 0.0163 -0.2342 0.1413 417 ASN A CG 5642 O OD1 . ASN A 388 ? 0.6815 0.5859 0.9357 0.0180 -0.2175 0.1444 417 ASN A OD1 5643 N ND2 . ASN A 388 ? 0.6690 0.6315 1.0155 0.0212 -0.2256 0.1302 417 ASN A ND2 5650 N N . GLY A 389 ? 0.4782 0.3242 0.6305 0.0084 -0.2280 0.1582 418 GLY A N 5651 C CA . GLY A 389 ? 0.4805 0.3074 0.5862 0.0045 -0.2066 0.1612 418 GLY A CA 5652 C C . GLY A 389 ? 0.4525 0.2853 0.5586 0.0038 -0.1853 0.1562 418 GLY A C 5653 O O . GLY A 389 ? 0.4571 0.2748 0.5264 0.0001 -0.1688 0.1577 418 GLY A O 5657 N N . ASP A 390 ? 0.6321 0.4869 0.7812 0.0082 -0.1848 0.1511 419 ASP A N 5658 C CA . ASP A 390 ? 0.6106 0.4697 0.7604 0.0082 -0.1646 0.1486 419 ASP A CA 5659 C C . ASP A 390 ? 0.5918 0.4568 0.7438 0.0171 -0.1465 0.1423 419 ASP A C 5660 O O . ASP A 390 ? 0.5818 0.4614 0.7658 0.0266 -0.1496 0.1365 419 ASP A O 5661 C CB . ASP A 390 ? 0.6073 0.4968 0.7958 0.0065 -0.1607 0.1395 419 ASP A CB 5662 C CG . ASP A 390 ? 0.6458 0.5343 0.8333 -0.0063 -0.1746 0.1400 419 ASP A CG 5663 O OD1 . ASP A 390 ? 0.6770 0.5379 0.8210 -0.0145 -0.1799 0.1444 419 ASP A OD1 5664 O OD2 . ASP A 390 ? 0.6432 0.5596 0.8751 -0.0082 -0.1798 0.1346 419 ASP A OD2 5669 N N . CYS A 391 ? 0.4811 0.3343 0.6012 0.0148 -0.1293 0.1422 420 CYS A N 5670 C CA . CYS A 391 ? 0.4662 0.3243 0.5891 0.0223 -0.1160 0.1364 420 CYS A CA 5671 C C . CYS A 391 ? 0.4493 0.3202 0.5898 0.0285 -0.1072 0.1328 420 CYS A C 5672 O O . CYS A 391 ? 0.4505 0.3232 0.5829 0.0229 -0.1001 0.1340 420 CYS A O 5673 C CB . CYS A 391 ? 0.4737 0.3168 0.5625 0.0187 -0.1031 0.1384 420 CYS A CB 5674 S SG . CYS A 391 ? 0.5046 0.3278 0.5633 0.0113 -0.1093 0.1473 420 CYS A SG 5679 N N . PRO A 392 ? 0.4521 0.3335 0.6120 0.0391 -0.1051 0.1253 421 PRO A N 5680 C CA . PRO A 392 ? 0.4440 0.3417 0.6072 0.0449 -0.0919 0.1169 421 PRO A CA 5681 C C . PRO A 392 ? 0.4447 0.3314 0.5791 0.0440 -0.0808 0.1198 421 PRO A C 5682 O O . PRO A 392 ? 0.4432 0.3215 0.5747 0.0481 -0.0830 0.1193 421 PRO A O 5683 C CB . PRO A 392 ? 0.4406 0.3489 0.6289 0.0574 -0.0966 0.1049 421 PRO A CB 5684 C CG . PRO A 392 ? 0.4448 0.3358 0.6328 0.0559 -0.1074 0.1084 421 PRO A CG 5685 C CD . PRO A 392 ? 0.4538 0.3347 0.6243 0.0437 -0.1111 0.1188 421 PRO A CD 5693 N N . CYS A 393 ? 0.3486 0.2354 0.4664 0.0386 -0.0701 0.1232 422 CYS A N 5694 C CA . CYS A 393 ? 0.3537 0.2268 0.4458 0.0386 -0.0618 0.1276 422 CYS A CA 5695 C C . CYS A 393 ? 0.3559 0.2381 0.4412 0.0480 -0.0549 0.1226 422 CYS A C 5696 O O . CYS A 393 ? 0.3587 0.2577 0.4504 0.0514 -0.0500 0.1169 422 CYS A O 5697 C CB . CYS A 393 ? 0.3650 0.2263 0.4407 0.0283 -0.0558 0.1347 422 CYS A CB 5698 S SG . CYS A 393 ? 0.5264 0.3721 0.5977 0.0173 -0.0663 0.1387 422 CYS A SG 5703 N N . LYS A 394 ? 0.4072 0.2791 0.4793 0.0526 -0.0548 0.1243 423 LYS A N 5704 C CA . LYS A 394 ? 0.4172 0.2932 0.4750 0.0614 -0.0517 0.1218 423 LYS A CA 5705 C C . LYS A 394 ? 0.4334 0.3046 0.4704 0.0568 -0.0402 0.1306 423 LYS A C 5706 O O . LYS A 394 ? 0.4392 0.3008 0.4756 0.0464 -0.0361 0.1375 423 LYS A O 5707 C CB . LYS A 394 ? 0.4175 0.2847 0.4730 0.0674 -0.0573 0.1224 423 LYS A CB 5708 C CG . LYS A 394 ? 0.4057 0.2778 0.4856 0.0701 -0.0676 0.1149 423 LYS A CG 5709 C CD . LYS A 394 ? 0.4096 0.2771 0.4961 0.0737 -0.0711 0.1163 423 LYS A CD 5710 C CE . LYS A 394 ? 0.3971 0.2712 0.5102 0.0721 -0.0784 0.1086 423 LYS A CE 5711 N NZ . LYS A 394 ? 0.3967 0.2727 0.5227 0.0722 -0.0776 0.1090 423 LYS A NZ 5725 N N . PRO A 395 ? 0.3939 0.2694 0.4116 0.0637 -0.0358 0.1308 424 PRO A N 5726 C CA . PRO A 395 ? 0.4162 0.2843 0.4126 0.0580 -0.0234 0.1427 424 PRO A CA 5727 C C . PRO A 395 ? 0.4238 0.2663 0.4105 0.0532 -0.0233 0.1541 424 PRO A C 5728 O O . PRO A 395 ? 0.4223 0.2543 0.4066 0.0608 -0.0311 0.1537 424 PRO A O 5729 C CB . PRO A 395 ? 0.4408 0.3132 0.4103 0.0692 -0.0224 0.1418 424 PRO A CB 5730 C CG . PRO A 395 ? 0.4294 0.3191 0.4125 0.0785 -0.0314 0.1243 424 PRO A CG 5731 C CD . PRO A 395 ? 0.4007 0.2864 0.4129 0.0762 -0.0427 0.1201 424 PRO A CD 5739 N N . GLY A 396 ? 0.6074 0.4404 0.5924 0.0408 -0.0145 0.1627 425 GLY A N 5740 C CA . GLY A 396 ? 0.6066 0.4112 0.5819 0.0364 -0.0141 0.1713 425 GLY A CA 5741 C C . GLY A 396 ? 0.5713 0.3669 0.5594 0.0317 -0.0200 0.1649 425 GLY A C 5742 O O . GLY A 396 ? 0.5894 0.3639 0.5658 0.0280 -0.0186 0.1623 425 GLY A O 5746 N N . VAL A 397 ? 0.5197 0.3325 0.5247 0.0321 -0.0261 0.1559 426 VAL A N 5747 C CA . VAL A 397 ? 0.4840 0.2894 0.4937 0.0269 -0.0311 0.1503 426 VAL A CA 5748 C C . VAL A 397 ? 0.4879 0.3008 0.5116 0.0149 -0.0350 0.1500 426 VAL A C 5749 O O . VAL A 397 ? 0.4868 0.3222 0.5273 0.0148 -0.0349 0.1478 426 VAL A O 5750 C CB . VAL A 397 ? 0.4385 0.2546 0.4562 0.0348 -0.0365 0.1425 426 VAL A CB 5751 C CG1 . VAL A 397 ? 0.4348 0.2412 0.4469 0.0293 -0.0374 0.1384 426 VAL A CG1 5752 C CG2 . VAL A 397 ? 0.4355 0.2514 0.4480 0.0464 -0.0354 0.1406 426 VAL A CG2 5762 N N . ALA A 398 ? 0.5859 0.3813 0.6027 0.0057 -0.0389 0.1492 427 ALA A N 5763 C CA . ALA A 398 ? 0.6115 0.4130 0.6416 -0.0068 -0.0463 0.1475 427 ALA A CA 5764 C C . ALA A 398 ? 0.6470 0.4389 0.6692 -0.0099 -0.0585 0.1436 427 ALA A C 5765 O O . ALA A 398 ? 0.6574 0.4403 0.6651 -0.0030 -0.0577 0.1431 427 ALA A O 5766 C CB . ALA A 398 ? 0.6277 0.4142 0.6545 -0.0187 -0.0419 0.1509 427 ALA A CB 5772 N N . GLY A 399 ? 0.9388 0.7334 0.9709 -0.0209 -0.0700 0.1416 428 GLY A N 5773 C CA . GLY A 399 ? 0.9563 0.7402 0.9750 -0.0246 -0.0850 0.1391 428 GLY A CA 5774 C C . GLY A 399 ? 0.9376 0.7404 0.9741 -0.0183 -0.0952 0.1410 428 GLY A C 5775 O O . GLY A 399 ? 0.9194 0.7422 0.9778 -0.0099 -0.0893 0.1414 428 GLY A O 5779 N N . PRO A 400 ? 0.7857 0.5793 0.8103 -0.0220 -0.1120 0.1419 429 PRO A N 5780 C CA . PRO A 400 ? 0.7853 0.5899 0.8248 -0.0159 -0.1244 0.1461 429 PRO A CA 5781 C C . PRO A 400 ? 0.7818 0.5802 0.8055 -0.0075 -0.1136 0.1489 429 PRO A C 5782 O O . PRO A 400 ? 0.7987 0.6100 0.8395 -0.0016 -0.1176 0.1488 429 PRO A O 5783 C CB . PRO A 400 ? 0.8240 0.6154 0.8469 -0.0237 -0.1468 0.1476 429 PRO A CB 5784 C CG . PRO A 400 ? 0.8565 0.6208 0.8372 -0.0310 -0.1409 0.1436 429 PRO A CG 5785 C CD . PRO A 400 ? 0.8339 0.6027 0.8268 -0.0318 -0.1220 0.1388 429 PRO A CD 5793 N N . HIS A 401 ? 0.6343 0.4175 0.6299 -0.0072 -0.0977 0.1474 430 HIS A N 5794 C CA . HIS A 401 ? 0.5846 0.3666 0.5691 -0.0011 -0.0845 0.1479 430 HIS A CA 5795 C C . HIS A 401 ? 0.5350 0.3276 0.5328 0.0068 -0.0685 0.1434 430 HIS A C 5796 O O . HIS A 401 ? 0.4263 0.2214 0.4259 0.0117 -0.0600 0.1437 430 HIS A O 5797 C CB . HIS A 401 ? 0.6065 0.3606 0.5494 -0.0056 -0.0804 0.1520 430 HIS A CB 5798 C CG . HIS A 401 ? 0.6420 0.3813 0.5605 -0.0129 -0.0988 0.1573 430 HIS A CG 5799 N ND1 . HIS A 401 ? 0.6953 0.4034 0.5636 -0.0184 -0.0991 0.1609 430 HIS A ND1 5800 C CD2 . HIS A 401 ? 0.6484 0.3974 0.5825 -0.0148 -0.1194 0.1597 430 HIS A CD2 5801 C CE1 . HIS A 401 ? 0.7365 0.4361 0.5868 -0.0237 -0.1205 0.1655 430 HIS A CE1 5802 N NE2 . HIS A 401 ? 0.7058 0.4310 0.5995 -0.0213 -0.1339 0.1652 430 HIS A NE2 5809 N N . CYS A 402 ? 0.6440 0.4413 0.6511 0.0072 -0.0661 0.1409 431 CYS A N 5810 C CA . CYS A 402 ? 0.5937 0.3987 0.6082 0.0153 -0.0548 0.1381 431 CYS A CA 5811 C C . CYS A 402 ? 0.5948 0.3854 0.5919 0.0190 -0.0432 0.1378 431 CYS A C 5812 O O . CYS A 402 ? 0.5985 0.3973 0.6056 0.0267 -0.0381 0.1361 431 CYS A O 5813 C CB . CYS A 402 ? 0.5588 0.3837 0.5969 0.0226 -0.0578 0.1354 431 CYS A CB 5814 S SG . CYS A 402 ? 0.4572 0.2980 0.5235 0.0219 -0.0716 0.1357 431 CYS A SG 5819 N N . ASP A 403 ? 0.6705 0.4380 0.6444 0.0137 -0.0412 0.1398 432 ASP A N 5820 C CA . ASP A 403 ? 0.6592 0.4088 0.6187 0.0177 -0.0300 0.1414 432 ASP A CA 5821 C C . ASP A 403 ? 0.6482 0.3811 0.5991 0.0207 -0.0233 0.1378 432 ASP A C 5822 O O . ASP A 403 ? 0.6513 0.3692 0.5881 0.0248 -0.0122 0.1334 432 ASP A O 5823 C CB . ASP A 403 ? 0.6933 0.4258 0.6239 0.0110 -0.0299 0.1429 432 ASP A CB 5824 C CG . ASP A 403 ? 0.7211 0.4362 0.6273 0.0017 -0.0403 0.1384 432 ASP A CG 5825 O OD1 . ASP A 403 ? 0.6983 0.4199 0.6202 -0.0022 -0.0499 0.1375 432 ASP A OD1 5826 O OD2 . ASP A 403 ? 0.7692 0.4646 0.6405 -0.0023 -0.0386 0.1351 432 ASP A OD2 5831 N N . ARG A 404 ? 0.5879 0.3260 0.5469 0.0192 -0.0269 0.1372 433 ARG A N 5832 C CA . ARG A 404 ? 0.6001 0.3189 0.5518 0.0210 -0.0217 0.1362 433 ARG A CA 5833 C C . ARG A 404 ? 0.5658 0.2978 0.5277 0.0202 -0.0228 0.1387 433 ARG A C 5834 O O . ARG A 404 ? 0.5515 0.3024 0.5258 0.0148 -0.0286 0.1408 433 ARG A O 5835 C CB . ARG A 404 ? 0.6470 0.3370 0.5761 0.0110 -0.0248 0.1311 433 ARG A CB 5836 C CG . ARG A 404 ? 0.6602 0.3552 0.5924 -0.0032 -0.0379 0.1317 433 ARG A CG 5837 C CD . ARG A 404 ? 0.7095 0.3794 0.6159 -0.0129 -0.0446 0.1226 433 ARG A CD 5838 N NE . ARG A 404 ? 0.7319 0.3975 0.6140 -0.0100 -0.0434 0.1190 433 ARG A NE 5839 C CZ . ARG A 404 ? 0.7755 0.4191 0.6244 -0.0164 -0.0493 0.1103 433 ARG A CZ 5840 N NH1 . ARG A 404 ? 0.8088 0.4324 0.6496 -0.0264 -0.0594 0.1020 433 ARG A NH1 5841 N NH2 . ARG A 404 ? 0.7905 0.4307 0.6126 -0.0136 -0.0452 0.1100 433 ARG A NH2 5855 N N . CYS A 405 ? 0.4721 0.1911 0.4279 0.0258 -0.0177 0.1398 434 CYS A N 5856 C CA . CYS A 405 ? 0.4716 0.1983 0.4297 0.0254 -0.0176 0.1457 434 CYS A CA 5857 C C . CYS A 405 ? 0.4809 0.2034 0.4433 0.0103 -0.0182 0.1507 434 CYS A C 5858 O O . CYS A 405 ? 0.4999 0.2017 0.4583 0.0010 -0.0196 0.1483 434 CYS A O 5859 C CB . CYS A 405 ? 0.4931 0.2020 0.4401 0.0342 -0.0162 0.1474 434 CYS A CB 5860 S SG . CYS A 405 ? 1.0203 0.7461 0.9773 0.0513 -0.0209 0.1445 434 CYS A SG 5865 N N . MET A 406 ? 0.5987 0.3410 0.5724 0.0073 -0.0180 0.1580 435 MET A N 5866 C CA . MET A 406 ? 0.6078 0.3513 0.5941 -0.0081 -0.0167 0.1659 435 MET A CA 5867 C C . MET A 406 ? 0.6415 0.3571 0.6146 -0.0140 -0.0104 0.1703 435 MET A C 5868 O O . MET A 406 ? 0.6565 0.3557 0.6104 -0.0031 -0.0073 0.1700 435 MET A O 5869 C CB . MET A 406 ? 0.5947 0.3665 0.5943 -0.0065 -0.0117 0.1738 435 MET A CB 5870 C CG . MET A 406 ? 0.5966 0.3862 0.6188 -0.0218 -0.0075 0.1758 435 MET A CG 5871 S SD . MET A 406 ? 0.7616 0.5914 0.7963 -0.0154 0.0030 0.1760 435 MET A SD 5872 C CE . MET A 406 ? 1.1827 1.0300 1.2279 -0.0021 -0.0108 0.1615 435 MET A CE 5882 N N . VAL A 407 ? 0.6678 0.3770 0.6546 -0.0317 -0.0105 0.1742 436 VAL A N 5883 C CA . VAL A 407 ? 0.7045 0.3845 0.6823 -0.0396 -0.0048 0.1783 436 VAL A CA 5884 C C . VAL A 407 ? 0.7203 0.4000 0.6835 -0.0343 0.0058 0.1918 436 VAL A C 5885 O O . VAL A 407 ? 0.7242 0.4282 0.6979 -0.0387 0.0129 0.2029 436 VAL A O 5886 C CB . VAL A 407 ? 0.7181 0.3958 0.7209 -0.0629 -0.0079 0.1803 436 VAL A CB 5887 C CG1 . VAL A 407 ? 0.7606 0.4042 0.7553 -0.0713 -0.0024 0.1833 436 VAL A CG1 5888 C CG2 . VAL A 407 ? 0.7095 0.3854 0.7212 -0.0692 -0.0246 0.1672 436 VAL A CG2 5898 N N . GLY A 408 ? 0.7683 0.4197 0.7070 -0.0243 0.0064 0.1918 437 GLY A N 5899 C CA . GLY A 408 ? 0.8139 0.4586 0.7316 -0.0190 0.0100 0.2051 437 GLY A CA 5900 C C . GLY A 408 ? 0.8229 0.4841 0.7293 -0.0001 0.0031 0.2034 437 GLY A C 5901 O O . GLY A 408 ? 0.8528 0.5201 0.7450 0.0041 0.0043 0.2156 437 GLY A O 5905 N N . TYR A 409 ? 0.6826 0.3511 0.5960 0.0105 -0.0040 0.1891 438 TYR A N 5906 C CA . TYR A 409 ? 0.6727 0.3574 0.5839 0.0272 -0.0120 0.1853 438 TYR A CA 5907 C C . TYR A 409 ? 0.6688 0.3413 0.5836 0.0372 -0.0191 0.1734 438 TYR A C 5908 O O . TYR A 409 ? 0.6760 0.3326 0.5938 0.0317 -0.0165 0.1661 438 TYR A O 5909 C CB . TYR A 409 ? 0.6480 0.3666 0.5747 0.0290 -0.0109 0.1819 438 TYR A CB 5910 C CG . TYR A 409 ? 0.6674 0.4033 0.5939 0.0241 -0.0029 0.1953 438 TYR A CG 5911 C CD1 . TYR A 409 ? 0.6733 0.4140 0.6137 0.0077 0.0069 0.2022 438 TYR A CD1 5912 C CD2 . TYR A 409 ? 0.6758 0.4242 0.5894 0.0365 -0.0042 0.2018 438 TYR A CD2 5913 C CE1 . TYR A 409 ? 0.6800 0.4404 0.6229 0.0036 0.0191 0.2149 438 TYR A CE1 5914 C CE2 . TYR A 409 ? 0.6888 0.4528 0.5952 0.0345 0.0078 0.2141 438 TYR A CE2 5915 C CZ . TYR A 409 ? 0.6903 0.4635 0.6117 0.0172 0.0206 0.2168 438 TYR A CZ 5916 O OH . TYR A 409 ? 0.7019 0.4986 0.6179 0.0137 0.0348 0.2202 438 TYR A OH 5926 N N . TRP A 410 ? 0.6864 0.3690 0.6048 0.0520 -0.0272 0.1715 439 TRP A N 5927 C CA . TRP A 410 ? 0.6788 0.3558 0.6100 0.0626 -0.0314 0.1624 439 TRP A CA 5928 C C . TRP A 410 ? 0.6595 0.3606 0.6037 0.0768 -0.0361 0.1575 439 TRP A C 5929 O O . TRP A 410 ? 0.6653 0.3847 0.6066 0.0791 -0.0392 0.1609 439 TRP A O 5930 C CB . TRP A 410 ? 0.6979 0.3509 0.6268 0.0675 -0.0369 0.1673 439 TRP A CB 5931 C CG . TRP A 410 ? 0.6985 0.3563 0.6219 0.0789 -0.0467 0.1757 439 TRP A CG 5932 C CD1 . TRP A 410 ? 0.7157 0.3750 0.6224 0.0739 -0.0493 0.1901 439 TRP A CD1 5933 C CD2 . TRP A 410 ? 0.6957 0.3573 0.6307 0.0975 -0.0557 0.1715 439 TRP A CD2 5934 N NE1 . TRP A 410 ? 0.7275 0.3934 0.6368 0.0867 -0.0621 0.1965 439 TRP A NE1 5935 C CE2 . TRP A 410 ? 0.7183 0.3842 0.6437 0.1019 -0.0673 0.1833 439 TRP A CE2 5936 C CE3 . TRP A 410 ? 0.6770 0.3399 0.6325 0.1112 -0.0545 0.1602 439 TRP A CE3 5937 C CZ2 . TRP A 410 ? 0.7311 0.3998 0.6611 0.1205 -0.0800 0.1811 439 TRP A CZ2 5938 C CZ3 . TRP A 410 ? 0.6878 0.3563 0.6513 0.1312 -0.0626 0.1588 439 TRP A CZ3 5939 C CH2 . TRP A 410 ? 0.7173 0.3867 0.6602 0.1395 -0.0717 0.1681 439 TRP A CH2 5950 N N . GLY A 411 ? 0.6741 0.3754 0.6357 0.0864 -0.0354 0.1496 440 GLY A N 5951 C CA . GLY A 411 ? 0.6475 0.3726 0.6291 0.0991 -0.0385 0.1450 440 GLY A CA 5952 C C . GLY A 411 ? 0.6168 0.3664 0.6074 0.0923 -0.0352 0.1415 440 GLY A C 5953 O O . GLY A 411 ? 0.6117 0.3791 0.6042 0.0956 -0.0419 0.1430 440 GLY A O 5957 N N . PHE A 412 ? 0.5553 0.3033 0.5502 0.0836 -0.0263 0.1374 441 PHE A N 5958 C CA . PHE A 412 ? 0.5361 0.3035 0.5404 0.0770 -0.0247 0.1352 441 PHE A CA 5959 C C . PHE A 412 ? 0.5159 0.3057 0.5483 0.0864 -0.0283 0.1328 441 PHE A C 5960 O O . PHE A 412 ? 0.4764 0.2669 0.5283 0.0952 -0.0243 0.1313 441 PHE A O 5961 C CB . PHE A 412 ? 0.5492 0.3050 0.5487 0.0680 -0.0157 0.1334 441 PHE A CB 5962 C CG . PHE A 412 ? 0.5401 0.3109 0.5450 0.0601 -0.0164 0.1333 441 PHE A CG 5963 C CD1 . PHE A 412 ? 0.5313 0.3074 0.5281 0.0512 -0.0216 0.1342 441 PHE A CD1 5964 C CD2 . PHE A 412 ? 0.5391 0.3185 0.5611 0.0618 -0.0109 0.1336 441 PHE A CD2 5965 C CE1 . PHE A 412 ? 0.5120 0.3007 0.5166 0.0455 -0.0247 0.1338 441 PHE A CE1 5966 C CE2 . PHE A 412 ? 0.5232 0.3126 0.5488 0.0537 -0.0135 0.1351 441 PHE A CE2 5967 C CZ . PHE A 412 ? 0.5094 0.3028 0.5255 0.0463 -0.0219 0.1342 441 PHE A CZ 5977 N N . GLY A 413 ? 0.5472 0.3556 0.5868 0.0849 -0.0357 0.1321 442 GLY A N 5978 C CA . GLY A 413 ? 0.5452 0.3742 0.6149 0.0922 -0.0430 0.1291 442 GLY A CA 5979 C C . GLY A 413 ? 0.5406 0.3849 0.6194 0.0875 -0.0506 0.1263 442 GLY A C 5980 O O . GLY A 413 ? 0.5307 0.3719 0.5947 0.0796 -0.0490 0.1270 442 GLY A O 5984 N N . ASP A 414 ? 0.5048 0.3659 0.6128 0.0928 -0.0605 0.1221 443 ASP A N 5985 C CA . ASP A 414 ? 0.4979 0.3710 0.6216 0.0888 -0.0696 0.1170 443 ASP A CA 5986 C C . ASP A 414 ? 0.5260 0.3990 0.6295 0.0932 -0.0800 0.1147 443 ASP A C 5987 O O . ASP A 414 ? 0.5470 0.4267 0.6615 0.0919 -0.0885 0.1083 443 ASP A O 5988 C CB . ASP A 414 ? 0.4688 0.3585 0.6338 0.0926 -0.0797 0.1118 443 ASP A CB 5989 C CG . ASP A 414 ? 0.4342 0.3313 0.6231 0.0853 -0.0869 0.1066 443 ASP A CG 5990 O OD1 . ASP A 414 ? 0.4410 0.3305 0.6179 0.0767 -0.0805 0.1090 443 ASP A OD1 5991 O OD2 . ASP A 414 ? 0.4061 0.3161 0.6278 0.0879 -0.1008 0.0995 443 ASP A OD2 5996 N N . TYR A 415 ? 0.4204 0.2835 0.4952 0.0990 -0.0791 0.1206 444 TYR A N 5997 C CA . TYR A 415 ? 0.4276 0.2892 0.4792 0.1036 -0.0862 0.1221 444 TYR A CA 5998 C C . TYR A 415 ? 0.4326 0.2822 0.4575 0.0962 -0.0717 0.1315 444 TYR A C 5999 O O . TYR A 415 ? 0.4505 0.3000 0.4494 0.0978 -0.0697 0.1337 444 TYR A O 6000 C CB . TYR A 415 ? 0.4758 0.3379 0.5129 0.1166 -0.1003 0.1219 444 TYR A CB 6001 C CG . TYR A 415 ? 0.5008 0.3771 0.5692 0.1234 -0.1186 0.1109 444 TYR A CG 6002 C CD1 . TYR A 415 ? 0.5172 0.4048 0.5904 0.1249 -0.1312 0.0961 444 TYR A CD1 6003 C CD2 . TYR A 415 ? 0.5098 0.3928 0.6027 0.1256 -0.1183 0.1106 444 TYR A CD2 6004 C CE1 . TYR A 415 ? 0.5233 0.4229 0.6296 0.1291 -0.1502 0.0849 444 TYR A CE1 6005 C CE2 . TYR A 415 ? 0.5139 0.4139 0.6417 0.1288 -0.1339 0.1001 444 TYR A CE2 6006 C CZ . TYR A 415 ? 0.5153 0.4228 0.6504 0.1296 -0.1508 0.0877 444 TYR A CZ 6007 O OH . TYR A 415 ? 0.5092 0.4326 0.6825 0.1305 -0.1680 0.0759 444 TYR A OH 6017 N N . GLY A 416 ? 0.5942 0.4352 0.6232 0.0867 -0.0604 0.1344 445 GLY A N 6018 C CA . GLY A 416 ? 0.6105 0.4393 0.6212 0.0775 -0.0495 0.1417 445 GLY A CA 6019 C C . GLY A 416 ? 0.6380 0.4474 0.6313 0.0775 -0.0439 0.1456 445 GLY A C 6020 O O . GLY A 416 ? 0.6204 0.4258 0.6218 0.0811 -0.0436 0.1410 445 GLY A O 6024 N N . CYS A 417 ? 0.6125 0.4094 0.5851 0.0734 -0.0390 0.1551 446 CYS A N 6025 C CA . CYS A 417 ? 0.6727 0.4462 0.6292 0.0724 -0.0363 0.1589 446 CYS A CA 6026 C C . CYS A 417 ? 0.7484 0.5130 0.6820 0.0756 -0.0384 0.1718 446 CYS A C 6027 O O . CYS A 417 ? 0.7501 0.5216 0.6741 0.0714 -0.0321 0.1810 446 CYS A O 6028 C CB . CYS A 417 ? 0.6666 0.4261 0.6208 0.0583 -0.0275 0.1584 446 CYS A CB 6029 S SG . CYS A 417 ? 0.4931 0.2551 0.4622 0.0543 -0.0254 0.1470 446 CYS A SG 6034 N N . ARG A 418 ? 1.0239 0.7734 0.9491 0.0835 -0.0465 0.1743 447 ARG A N 6035 C CA . ARG A 418 ? 1.0686 0.8079 0.9712 0.0850 -0.0509 0.1895 447 ARG A CA 6036 C C . ARG A 418 ? 1.0795 0.8006 0.9672 0.0696 -0.0383 0.1998 447 ARG A C 6037 O O . ARG A 418 ? 1.0733 0.7790 0.9688 0.0614 -0.0339 0.1942 447 ARG A O 6038 C CB . ARG A 418 ? 1.0888 0.8194 0.9979 0.0955 -0.0648 0.1907 447 ARG A CB 6039 C CG . ARG A 418 ? 1.0738 0.8245 1.0050 0.1099 -0.0772 0.1796 447 ARG A CG 6040 C CD . ARG A 418 ? 1.0886 0.8533 1.0489 0.1238 -0.0767 0.1920 447 ARG A CD 6041 N NE . ARG A 418 ? 1.0918 0.8671 1.0559 0.1473 -0.0792 0.1782 447 ARG A NE 6042 C CZ . ARG A 418 ? 1.0862 0.8558 1.0680 0.1519 -0.0789 0.1629 447 ARG A CZ 6043 N NH1 . ARG A 418 ? 1.0841 0.8309 1.0627 0.1424 -0.0708 0.1568 447 ARG A NH1 6044 N NH2 . ARG A 418 ? 1.0743 0.8685 1.0905 0.1611 -0.0894 0.1558 447 ARG A NH2 6058 N N . PRO A 419 ? 0.9068 0.6290 0.7710 0.0659 -0.0309 0.2150 448 PRO A N 6059 C CA . PRO A 419 ? 0.9375 0.6404 0.7905 0.0499 -0.0190 0.2268 448 PRO A CA 6060 C C . PRO A 419 ? 1.0033 0.6765 0.8498 0.0495 -0.0291 0.2336 448 PRO A C 6061 O O . PRO A 419 ? 0.9956 0.6677 0.8334 0.0608 -0.0414 0.2419 448 PRO A O 6062 C CB . PRO A 419 ? 0.9430 0.6563 0.7688 0.0486 -0.0064 0.2425 448 PRO A CB 6063 C CG . PRO A 419 ? 0.9138 0.6530 0.7385 0.0639 -0.0094 0.2345 448 PRO A CG 6064 C CD . PRO A 419 ? 0.9022 0.6423 0.7458 0.0760 -0.0298 0.2206 448 PRO A CD 6072 N N . CYS A 420 ? 0.8856 0.5357 0.7390 0.0380 -0.0252 0.2307 449 CYS A N 6073 C CA . CYS A 420 ? 0.9899 0.6124 0.8414 0.0382 -0.0327 0.2360 449 CYS A CA 6074 C C . CYS A 420 ? 1.0646 0.6678 0.8935 0.0240 -0.0245 0.2564 449 CYS A C 6075 O O . CYS A 420 ? 1.0700 0.6669 0.8970 0.0075 -0.0096 0.2585 449 CYS A O 6076 C CB . CYS A 420 ? 0.9910 0.5960 0.8585 0.0358 -0.0322 0.2200 449 CYS A CB 6077 S SG . CYS A 420 ? 1.1887 0.7895 1.0590 0.0169 -0.0150 0.2134 449 CYS A SG 6082 N N . ASP A 421 ? 1.1825 0.7785 0.9982 0.0299 -0.0336 0.2733 450 ASP A N 6083 C CA . ASP A 421 ? 1.2512 0.8277 1.0412 0.0164 -0.0258 0.2959 450 ASP A CA 6084 C C . ASP A 421 ? 1.2772 0.8147 1.0717 0.0075 -0.0287 0.2971 450 ASP A C 6085 O O . ASP A 421 ? 1.3223 0.8440 1.1170 0.0124 -0.0411 0.3113 450 ASP A O 6086 C CB . ASP A 421 ? 1.2991 0.8835 1.0679 0.0276 -0.0344 0.3162 450 ASP A CB 6089 N N . CYS A 422 ? 1.2745 0.7972 1.0751 -0.0041 -0.0164 0.2834 451 CYS A N 6090 C CA . CYS A 422 ? 1.2760 0.7528 1.0706 -0.0102 -0.0123 0.2809 451 CYS A CA 6091 C C . CYS A 422 ? 1.2971 0.7526 1.0763 -0.0316 0.0045 0.3003 451 CYS A C 6092 O O . CYS A 422 ? 1.3562 0.7720 1.1162 -0.0317 0.0035 0.3115 451 CYS A O 6093 C CB . CYS A 422 ? 1.2383 0.7112 1.0534 -0.0087 -0.0032 0.2573 451 CYS A CB 6094 S SG . CYS A 422 ? 1.3068 0.7807 1.1334 0.0165 -0.0183 0.2360 451 CYS A SG 6099 N N . ALA A 423 ? 1.3785 0.8582 1.1675 -0.0496 0.0215 0.3056 452 ALA A N 6100 C CA . ALA A 423 ? 1.2971 0.8195 1.1057 -0.0487 0.0263 0.2946 452 ALA A CA 6101 C C . ALA A 423 ? 1.2863 0.8193 1.1210 -0.0717 0.0447 0.2944 452 ALA A C 6102 O O . ALA A 423 ? 1.2781 0.8437 1.1194 -0.0819 0.0597 0.3052 452 ALA A O 6103 C CB . ALA A 423 ? 1.2773 0.8309 1.0680 -0.0416 0.0272 0.3074 452 ALA A CB 6109 N N . GLY A 424 ? 1.4028 0.9166 1.2601 -0.0790 0.0445 0.2810 453 GLY A N 6110 C CA . GLY A 424 ? 1.4165 0.9008 1.2723 -0.0638 0.0335 0.2654 453 GLY A CA 6111 C C . GLY A 424 ? 1.3567 0.8624 1.2304 -0.0518 0.0268 0.2436 453 GLY A C 6112 O O . GLY A 424 ? 1.3316 0.8699 1.2044 -0.0435 0.0227 0.2408 453 GLY A O 6116 N N . SER A 425 ? 1.3024 0.7892 1.1940 -0.0517 0.0263 0.2292 454 SER A N 6117 C CA . SER A 425 ? 1.1957 0.6995 1.1039 -0.0428 0.0209 0.2102 454 SER A CA 6118 C C . SER A 425 ? 1.1921 0.6975 1.0899 -0.0164 0.0158 0.2021 454 SER A C 6119 O O . SER A 425 ? 1.2373 0.7185 1.1285 -0.0048 0.0167 0.2056 454 SER A O 6120 C CB . SER A 425 ? 1.1663 0.6495 1.0992 -0.0556 0.0193 0.1985 454 SER A CB 6123 N N . CYS A 426 ? 0.9903 0.5250 0.8917 -0.0074 0.0110 0.1923 455 CYS A N 6124 C CA . CYS A 426 ? 1.0019 0.5425 0.8948 0.0142 0.0040 0.1842 455 CYS A CA 6125 C C . CYS A 426 ? 0.9991 0.5548 0.9457 0.0214 0.0074 0.1755 455 CYS A C 6126 O O . CYS A 426 ? 1.0164 0.5616 0.9638 0.0086 0.0051 0.1661 455 CYS A O 6127 C CB . CYS A 426 ? 0.9627 0.5388 0.8524 0.0158 -0.0092 0.1841 455 CYS A CB 6128 S SG . CYS A 426 ? 0.9425 0.5331 0.8322 0.0313 -0.0264 0.1927 455 CYS A SG 6133 N N . ASP A 427 ? 1.1785 0.7405 1.1501 0.0316 -0.0141 0.1742 456 ASP A N 6134 C CA . ASP A 427 ? 1.1500 0.6991 1.1184 0.0407 -0.0168 0.1561 456 ASP A CA 6135 C C . ASP A 427 ? 1.1035 0.6816 1.0642 0.0489 -0.0225 0.1526 456 ASP A C 6136 O O . ASP A 427 ? 1.0883 0.6737 1.0453 0.0610 -0.0300 0.1559 456 ASP A O 6137 C CB . ASP A 427 ? 1.1866 0.7044 1.1614 0.0552 -0.0200 0.1498 456 ASP A CB 6138 C CG . ASP A 427 ? 1.2128 0.7184 1.1822 0.0690 -0.0158 0.1303 456 ASP A CG 6139 O OD1 . ASP A 427 ? 1.2187 0.7429 1.1917 0.0843 -0.0172 0.1279 456 ASP A OD1 6140 O OD2 . ASP A 427 ? 1.2367 0.7150 1.1936 0.0647 -0.0087 0.1154 456 ASP A OD2 6145 N N . PRO A 428 ? 0.7620 0.3535 0.7192 0.0437 -0.0172 0.1460 457 PRO A N 6146 C CA . PRO A 428 ? 0.7534 0.3745 0.7061 0.0487 -0.0199 0.1451 457 PRO A CA 6147 C C . PRO A 428 ? 0.8006 0.4276 0.7608 0.0684 -0.0189 0.1392 457 PRO A C 6148 O O . PRO A 428 ? 0.7496 0.4024 0.7132 0.0743 -0.0212 0.1403 457 PRO A O 6149 C CB . PRO A 428 ? 0.7273 0.3544 0.6780 0.0397 -0.0137 0.1394 457 PRO A CB 6150 C CG . PRO A 428 ? 0.7578 0.3487 0.6973 0.0370 -0.0077 0.1295 457 PRO A CG 6151 C CD . PRO A 428 ? 0.7751 0.3470 0.7233 0.0343 -0.0097 0.1361 457 PRO A CD 6159 N N . LEU A 429 ? 0.7765 0.3806 0.7428 0.0794 -0.0140 0.1319 458 LEU A N 6160 C CA . LEU A 429 ? 0.8663 0.4785 0.8481 0.0994 -0.0101 0.1258 458 LEU A CA 6161 C C . LEU A 429 ? 0.8571 0.4727 0.8465 0.1109 -0.0240 0.1331 458 LEU A C 6162 O O . LEU A 429 ? 0.8302 0.4703 0.8316 0.1219 -0.0275 0.1335 458 LEU A O 6163 C CB . LEU A 429 ? 0.9964 0.5801 0.9800 0.1097 0.0033 0.1123 458 LEU A CB 6164 C CG . LEU A 429 ? 1.0749 0.6567 1.0470 0.1090 0.0217 0.1022 458 LEU A CG 6165 C CD1 . LEU A 429 ? 1.0947 0.6751 1.0422 0.0880 0.0185 0.1057 458 LEU A CD1 6166 C CD2 . LEU A 429 ? 1.1449 0.6896 1.1076 0.1202 0.0368 0.0855 458 LEU A CD2 6178 N N . THR A 430 ? 0.7946 0.3835 0.7767 0.1081 -0.0327 0.1398 459 THR A N 6179 C CA . THR A 430 ? 0.8491 0.4335 0.8311 0.1202 -0.0456 0.1468 459 THR A CA 6180 C C . THR A 430 ? 0.8840 0.4720 0.8450 0.1075 -0.0539 0.1621 459 THR A C 6181 O O . THR A 430 ? 0.9110 0.5050 0.8633 0.1169 -0.0640 0.1689 459 THR A O 6182 C CB . THR A 430 ? 0.9003 0.4507 0.8910 0.1296 -0.0477 0.1429 459 THR A CB 6183 O OG1 . THR A 430 ? 0.9223 0.4509 0.9090 0.1115 -0.0448 0.1473 459 THR A OG1 6184 C CG2 . THR A 430 ? 0.9088 0.4541 0.9202 0.1464 -0.0363 0.1259 459 THR A CG2 6192 N N . GLY A 431 ? 1.0733 0.6567 1.0258 0.0874 -0.0485 0.1675 460 GLY A N 6193 C CA . GLY A 431 ? 1.0599 0.6439 0.9933 0.0750 -0.0515 0.1829 460 GLY A CA 6194 C C . GLY A 431 ? 1.0548 0.6107 0.9902 0.0695 -0.0558 0.1952 460 GLY A C 6195 O O . GLY A 431 ? 1.0634 0.6142 0.9805 0.0599 -0.0573 0.2110 460 GLY A O 6199 N N . ASP A 432 ? 1.2784 0.8158 1.2389 0.0764 -0.0552 0.1892 461 ASP A N 6200 C CA . ASP A 432 ? 1.3292 0.8518 1.3198 0.0749 -0.0452 0.2058 461 ASP A CA 6201 C C . ASP A 432 ? 1.3420 0.8572 1.3298 0.0608 -0.0163 0.2118 461 ASP A C 6202 O O . ASP A 432 ? 1.3180 0.8402 1.3037 0.0491 -0.0168 0.1989 461 ASP A O 6203 C CB . ASP A 432 ? 1.3557 0.8545 1.3688 0.0915 -0.0410 0.1935 461 ASP A CB 6204 C CG . ASP A 432 ? 1.3684 0.8698 1.3823 0.1109 -0.0625 0.1864 461 ASP A CG 6205 O OD1 . ASP A 432 ? 1.3613 0.8931 1.3724 0.1299 -0.0254 0.2108 461 ASP A OD1 6206 O OD2 . ASP A 432 ? 1.3876 0.8614 1.3861 0.1274 -0.0692 0.1624 461 ASP A OD2 6211 N N . CYS A 433 ? 1.1104 0.5812 1.0534 0.0649 0.0086 0.2232 462 CYS A N 6212 C CA . CYS A 433 ? 1.0574 0.4943 0.9682 0.0438 0.0172 0.2214 462 CYS A CA 6213 C C . CYS A 433 ? 1.0409 0.4482 0.9778 0.0373 0.0166 0.2097 462 CYS A C 6214 O O . CYS A 433 ? 1.0248 0.4198 0.9608 0.0176 0.0186 0.2027 462 CYS A O 6215 C CB . CYS A 433 ? 1.0770 0.4836 0.9472 0.0368 0.0191 0.2406 462 CYS A CB 6216 S SG . CYS A 433 ? 1.7792 1.1995 1.5952 0.0381 0.0031 0.2487 462 CYS A SG 6221 C C1 . NAG B . ? 1.2193 0.9569 0.8580 0.1365 -0.0055 -0.0342 501 NAG A C1 6222 C C2 . NAG B . ? 1.1917 0.9168 0.8113 0.1279 -0.0224 -0.0443 501 NAG A C2 6223 C C3 . NAG B . ? 1.2058 0.8991 0.7959 0.1293 -0.0185 -0.0496 501 NAG A C3 6224 C C4 . NAG B . ? 1.2118 0.8882 0.7822 0.1360 -0.0033 -0.0472 501 NAG A C4 6225 C C5 . NAG B . ? 1.2119 0.8938 0.7924 0.1494 0.0166 -0.0405 501 NAG A C5 6226 C C6 . NAG B . ? 1.1868 0.8752 0.7688 0.1532 0.0270 -0.0341 501 NAG A C6 6227 C C7 . NAG B . ? 1.1162 0.8518 0.7516 0.1156 -0.0466 -0.0507 501 NAG A C7 6228 C C8 . NAG B . ? 1.0840 0.8361 0.7437 0.1120 -0.0535 -0.0492 501 NAG A C8 6229 N N2 . NAG B . ? 1.1500 0.8906 0.7920 0.1230 -0.0322 -0.0443 501 NAG A N2 6230 O O3 . NAG B . ? 1.1863 0.8796 0.7785 0.1164 -0.0343 -0.0520 501 NAG A O3 6231 O O4 . NAG B . ? 1.2584 0.9077 0.8069 0.1341 -0.0016 -0.0496 501 NAG A O4 6232 O O5 . NAG B . ? 1.2103 0.9241 0.8315 0.1468 0.0115 -0.0341 501 NAG A O5 6233 O O6 . NAG B . ? 1.1772 0.8787 0.7844 0.1627 0.0447 -0.0230 501 NAG A O6 6234 O O7 . NAG B . ? 1.1140 0.8423 0.7442 0.1082 -0.0521 -0.0520 501 NAG A O7 6247 C C1 . NAG C . ? 1.7965 1.4353 1.3430 0.1382 0.0020 -0.0512 502 NAG A C1 6248 C C2 . NAG C . ? 1.8280 1.4542 1.3660 0.1276 -0.0128 -0.0552 502 NAG A C2 6249 C C3 . NAG C . ? 1.8457 1.4628 1.3830 0.1317 -0.0096 -0.0567 502 NAG A C3 6250 C C4 . NAG C . ? 1.8770 1.4749 1.3996 0.1447 0.0125 -0.0540 502 NAG A C4 6251 C C5 . NAG C . ? 1.8574 1.4706 1.3934 0.1552 0.0277 -0.0490 502 NAG A C5 6252 C C6 . NAG C . ? 1.8797 1.4765 1.4067 0.1687 0.0522 -0.0438 502 NAG A C6 6253 C C7 . NAG C . ? 1.7925 1.4337 1.3446 0.1058 -0.0437 -0.0572 502 NAG A C7 6254 C C8 . NAG C . ? 1.7572 1.4232 1.3350 0.0960 -0.0591 -0.0569 502 NAG A C8 6255 N N2 . NAG C . ? 1.7955 1.4424 1.3526 0.1160 -0.0315 -0.0563 502 NAG A N2 6256 O O3 . NAG C . ? 1.8618 1.4645 1.3884 0.1223 -0.0226 -0.0595 502 NAG A O3 6257 O O4 . NAG C . ? 1.8854 1.4784 1.4123 0.1491 0.0161 -0.0548 502 NAG A O4 6258 O O5 . NAG C . ? 1.8466 1.4663 1.3791 0.1502 0.0229 -0.0483 502 NAG A O5 6259 O O6 . NAG C . ? 1.8596 1.4744 1.4067 0.1793 0.0668 -0.0370 502 NAG A O6 6260 O O7 . NAG C . ? 1.8193 1.4357 1.3473 0.1047 -0.0417 -0.0577 502 NAG A O7 6274 C C1 . NAG D . ? 1.5515 1.4317 1.7913 -0.0760 -0.1418 0.1975 503 NAG A C1 6275 C C2 . NAG D . ? 1.5524 1.4192 1.7658 -0.0806 -0.1651 0.1800 503 NAG A C2 6276 C C3 . NAG D . ? 1.5519 1.4251 1.7885 -0.0900 -0.1902 0.1871 503 NAG A C3 6277 C C4 . NAG D . ? 1.5536 1.4461 1.8265 -0.0898 -0.1890 0.2028 503 NAG A C4 6278 C C5 . NAG D . ? 1.5586 1.4654 1.8624 -0.0872 -0.1675 0.2225 503 NAG A C5 6279 C C6 . NAG D . ? 1.5554 1.4742 1.8983 -0.0968 -0.1795 0.2424 503 NAG A C6 6280 C C7 . NAG D . ? 1.5499 1.3956 1.7063 -0.0744 -0.1745 0.1470 503 NAG A C7 6281 C C8 . NAG D . ? 1.5484 1.3907 1.6841 -0.0675 -0.1710 0.1341 503 NAG A C8 6282 N N2 . NAG D . ? 1.5518 1.4125 1.7398 -0.0743 -0.1638 0.1646 503 NAG A N2 6283 O O3 . NAG D . ? 1.5528 1.4251 1.8019 -0.0975 -0.1967 0.1963 503 NAG A O3 6284 O O4 . NAG D . ? 1.5461 1.4391 1.8058 -0.0823 -0.1821 0.1935 503 NAG A O4 6285 O O5 . NAG D . ? 1.5564 1.4514 1.8366 -0.0829 -0.1493 0.2168 503 NAG A O5 6286 O O6 . NAG D . ? 1.5471 1.4861 1.9309 -0.0936 -0.1631 0.2641 503 NAG A O6 6287 O O7 . NAG D . ? 1.5529 1.3884 1.6991 -0.0796 -0.1861 0.1425 503 NAG A O7 6301 C C1 . NAG E . ? 1.6945 1.6271 2.0426 -0.0885 -0.1885 0.2344 504 NAG A C1 6302 C C2 . NAG E . ? 1.6848 1.6248 2.0338 -0.0768 -0.1636 0.2349 504 NAG A C2 6303 C C3 . NAG E . ? 1.6777 1.6335 2.0576 -0.0778 -0.1715 0.2464 504 NAG A C3 6304 C C4 . NAG E . ? 1.6801 1.6260 2.0421 -0.0849 -0.2002 0.2341 504 NAG A C4 6305 C C5 . NAG E . ? 1.6947 1.6297 2.0510 -0.0962 -0.2234 0.2328 504 NAG A C5 6306 C C6 . NAG E . ? 1.7048 1.6234 2.0344 -0.1022 -0.2495 0.2184 504 NAG A C6 6307 C C7 . NAG E . ? 1.6881 1.6213 2.0200 -0.0622 -0.1143 0.2366 504 NAG A C7 6308 C C8 . NAG E . ? 1.6956 1.6329 2.0433 -0.0567 -0.0869 0.2518 504 NAG A C8 6309 N N2 . NAG E . ? 1.6861 1.6321 2.0491 -0.0707 -0.1365 0.2471 504 NAG A N2 6310 O O3 . NAG E . ? 1.6702 1.6307 2.0473 -0.0665 -0.1489 0.2450 504 NAG A O3 6311 O O4 . NAG E . ? 1.6747 1.6344 2.0672 -0.0881 -0.2107 0.2470 504 NAG A O4 6312 O O5 . NAG E . ? 1.6970 1.6197 2.0270 -0.0935 -0.2130 0.2221 504 NAG A O5 6313 O O6 . NAG E . ? 1.7155 1.6161 2.0210 -0.1081 -0.2630 0.2085 504 NAG A O6 6314 O O7 . NAG E . ? 1.6867 1.6047 1.9791 -0.0592 -0.1162 0.2166 504 NAG A O7 6328 C C1 . NAG F . ? 1.8025 1.2856 1.5914 0.1056 -0.1317 -0.0357 505 NAG A C1 6329 C C2 . NAG F . ? 1.8412 1.3292 1.6574 0.1130 -0.1240 -0.0271 505 NAG A C2 6330 C C3 . NAG F . ? 1.8695 1.3417 1.6780 0.1102 -0.1291 -0.0281 505 NAG A C3 6331 C C4 . NAG F . ? 1.9008 1.3434 1.6698 0.1090 -0.1301 -0.0371 505 NAG A C4 6332 C C5 . NAG F . ? 1.8911 1.3334 1.6378 0.1007 -0.1395 -0.0436 505 NAG A C5 6333 C C6 . NAG F . ? 1.8718 1.3308 1.6252 0.0853 -0.1599 -0.0435 505 NAG A C6 6334 C C7 . NAG F . ? 1.8582 1.3277 1.6694 0.1387 -0.0880 -0.0250 505 NAG A C7 6335 C C8 . NAG F . ? 1.8791 1.3252 1.6481 0.1346 -0.0913 -0.0361 505 NAG A C8 6336 N N2 . NAG F . ? 1.8448 1.3317 1.6743 0.1281 -0.1041 -0.0216 505 NAG A N2 6337 O O3 . NAG F . ? 1.8463 1.3353 1.6686 0.0973 -0.1466 -0.0257 505 NAG A O3 6338 O O4 . NAG F . ? 2.0202 1.4404 1.7764 0.1227 -0.1113 -0.0379 505 NAG A O4 6339 O O5 . NAG F . ? 1.8636 1.3178 1.6178 0.1062 -0.1305 -0.0428 505 NAG A O5 6340 O O6 . NAG F . ? 1.8422 1.3255 1.6288 0.0820 -0.1644 -0.0366 505 NAG A O6 6341 O O7 . NAG F . ? 1.8534 1.3266 1.6829 0.1511 -0.0714 -0.0182 505 NAG A O7 6354 C C1 . NAG G . ? 1.7142 1.1106 1.4510 0.1213 -0.1144 -0.0409 506 NAG A C1 6355 C C2 . NAG G . ? 1.7787 1.1455 1.4709 0.1204 -0.1142 -0.0496 506 NAG A C2 6356 C C3 . NAG G . ? 1.8116 1.1530 1.4893 0.1353 -0.0929 -0.0502 506 NAG A C3 6357 C C4 . NAG G . ? 1.7930 1.1524 1.5058 0.1482 -0.0748 -0.0424 506 NAG A C4 6358 C C5 . NAG G . ? 1.7524 1.1317 1.5046 0.1478 -0.0784 -0.0336 506 NAG A C5 6359 C C6 . NAG G . ? 1.7158 1.1256 1.5090 0.1528 -0.0722 -0.0240 506 NAG A C6 6360 C C7 . NAG G . ? 1.8280 1.1891 1.4897 0.0954 -0.1498 -0.0558 506 NAG A C7 6361 C C8 . NAG G . ? 1.8487 1.1968 1.4934 0.0847 -0.1667 -0.0572 506 NAG A C8 6362 N N2 . NAG G . ? 1.8170 1.1715 1.4893 0.1087 -0.1319 -0.0531 506 NAG A N2 6363 O O3 . NAG G . ? 1.8464 1.1658 1.4854 0.1358 -0.0898 -0.0570 506 NAG A O3 6364 O O4 . NAG G . ? 1.8274 1.1645 1.5274 0.1624 -0.0537 -0.0425 506 NAG A O4 6365 O O5 . NAG G . ? 1.7282 1.1168 1.4799 0.1325 -0.1006 -0.0355 506 NAG A O5 6366 O O6 . NAG G . ? 1.7146 1.1243 1.5040 0.1618 -0.0575 -0.0244 506 NAG A O6 6367 O O7 . NAG G . ? 1.8124 1.1896 1.4792 0.0924 -0.1523 -0.0562 506 NAG A O7 6382 C C . TAM I . ? 0.8661 0.6446 0.6653 -0.0366 -0.1627 0.0476 508 TAM A C 6383 C C1 . TAM I . ? 0.8651 0.6481 0.6647 -0.0362 -0.1613 0.0484 508 TAM A C1 6384 C C2 . TAM I . ? 0.8571 0.6556 0.6740 -0.0269 -0.1598 0.0470 508 TAM A C2 6385 C C3 . TAM I . ? 0.8589 0.6170 0.6327 -0.0359 -0.1563 0.0393 508 TAM A C3 6386 C C4 . TAM I . ? 0.8468 0.6539 0.6697 -0.0311 -0.1620 0.0540 508 TAM A C4 6387 C C5 . TAM I . ? 0.8470 0.6618 0.6895 -0.0276 -0.1664 0.0573 508 TAM A C5 6388 C C6 . TAM I . ? 0.8459 0.5965 0.6148 -0.0359 -0.1563 0.0374 508 TAM A C6 6389 N N . TAM I . ? 0.8831 0.6542 0.6871 -0.0471 -0.1730 0.0554 508 TAM A N 6390 O O4 . TAM I . ? 0.8528 0.6641 0.6913 -0.0390 -0.1714 0.0649 508 TAM A O4 6391 O O5 . TAM I . ? 0.8231 0.6549 0.6788 -0.0164 -0.1616 0.0558 508 TAM A O5 6392 O O6 . TAM I . ? 0.8522 0.5816 0.5965 -0.0360 -0.1503 0.0316 508 TAM A O6 6410 O O . HOH J . ? 0.5759 0.4459 0.3309 0.0597 -0.0820 -0.0271 601 HOH A O 6411 O O . HOH J . ? 0.4866 0.2024 0.4299 0.0848 -0.1345 0.0063 602 HOH A O 6412 O O . HOH J . ? 0.7011 0.4801 0.6455 0.1734 0.0102 0.0366 603 HOH A O 6413 O O . HOH J . ? 0.6330 0.3611 0.4216 0.0335 -0.1796 -0.0496 604 HOH A O 6414 O O . HOH J . ? 0.5725 0.2528 0.3431 -0.0398 -0.1572 0.0261 605 HOH A O 6415 O O . HOH J . ? 0.5934 0.2709 0.5194 -0.0551 -0.2646 0.0257 606 HOH A O 6416 O O . HOH J . ? 0.4743 0.2202 0.4166 -0.0404 -0.2478 0.0169 607 HOH A O 6417 O O . HOH J . ? 0.4375 0.2929 0.2091 0.0596 -0.0915 -0.0026 608 HOH A O 6418 O O . HOH J . ? 0.5246 0.4003 0.3233 0.0489 -0.1315 0.0219 609 HOH A O 6419 O O . HOH J . ? 0.3736 0.2325 0.1533 0.0641 -0.0942 -0.0361 610 HOH A O 6420 O O . HOH J . ? 0.4545 0.3205 0.2485 0.0734 -0.0994 -0.0208 611 HOH A O 6421 O O . HOH J . ? 0.6667 0.2400 0.4060 -0.1205 -0.1805 0.0830 612 HOH A O 6422 O O . HOH J . ? 0.4634 0.3056 0.1996 0.0445 -0.1018 -0.0309 613 HOH A O 6423 O O . HOH J . ? 0.6625 0.3448 0.4406 0.0852 -0.1229 -0.0540 614 HOH A O 6424 O O . HOH J . ? 0.5287 0.2378 0.2699 -0.0186 -0.1513 0.0163 615 HOH A O 6425 O O . HOH J . ? 0.6236 0.2705 0.5320 -0.0242 -0.2567 0.0071 616 HOH A O 6426 O O . HOH J . ? 0.4627 0.1936 0.3851 0.0679 -0.1464 -0.0030 617 HOH A O 6427 O O . HOH J . ? 0.4644 0.2250 0.3564 -0.0108 -0.0755 0.0523 618 HOH A O 6428 O O . HOH J . ? 0.6325 0.4708 0.5571 0.0129 -0.2732 0.1401 619 HOH A O 6429 O O . HOH J . ? 0.4059 0.3088 0.2216 0.0435 -0.0984 0.0082 620 HOH A O 6430 O O . HOH J . ? 0.6179 0.2424 0.3633 -0.0595 -0.1171 0.0528 621 HOH A O 6431 O O . HOH J . ? 0.4851 0.3434 0.2582 0.0480 -0.1180 0.0170 622 HOH A O 6432 O O . HOH J . ? 0.6510 0.2160 0.5383 0.0764 -0.1697 -0.0110 623 HOH A O 6433 O O . HOH J . ? 0.5652 0.2090 0.3097 0.1016 -0.1057 -0.0593 624 HOH A O 6434 O O . HOH J . ? 0.6127 0.4188 0.4460 -0.0212 -0.2785 0.1109 625 HOH A O 6435 O O . HOH J . ? 0.5615 0.4075 0.3193 0.0446 -0.1110 0.0146 626 HOH A O 6436 O O . HOH J . ? 0.7065 0.4938 0.4965 -0.0445 -0.2819 0.0981 627 HOH A O # 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 CYS 1 30 30 CYS CYS A . n A 1 2 GLU 2 31 31 GLU GLU A . n A 1 3 LYS 3 32 32 LYS LYS A . n A 1 4 ALA 4 33 33 ALA ALA A . n A 1 5 CYS 5 34 34 CYS CYS A . n A 1 6 ASN 6 35 35 ASN ASN A . n A 1 7 PRO 7 36 36 PRO PRO A . n A 1 8 ARG 8 37 37 ARG ARG A . n A 1 9 MET 9 38 38 MET MET A . n A 1 10 GLY 10 39 39 GLY GLY A . n A 1 11 ASN 11 40 40 ASN ASN A . n A 1 12 LEU 12 41 41 LEU LEU A . n A 1 13 ALA 13 42 42 ALA ALA A . n A 1 14 LEU 14 43 43 LEU LEU A . n A 1 15 GLY 15 44 44 GLY GLY A . n A 1 16 ARG 16 45 45 ARG ARG A . n A 1 17 LYS 17 46 46 LYS LYS A . n A 1 18 LEU 18 47 47 LEU LEU A . n A 1 19 ARG 19 48 48 ARG ARG A . n A 1 20 ALA 20 49 49 ALA ALA A . n A 1 21 ASP 21 50 50 ASP ASP A . n A 1 22 THR 22 51 51 THR THR A . n A 1 23 MET 23 52 52 MET MET A . n A 1 24 CYS 24 53 53 CYS CYS A . n A 1 25 GLY 25 54 54 GLY GLY A . n A 1 26 GLN 26 55 55 GLN GLN A . n A 1 27 ASN 27 56 56 ASN ASN A . n A 1 28 ALA 28 57 57 ALA ALA A . n A 1 29 THR 29 58 58 THR THR A . n A 1 30 GLU 30 59 59 GLU GLU A . n A 1 31 LEU 31 60 60 LEU LEU A . n A 1 32 PHE 32 61 61 PHE PHE A . n A 1 33 CYS 33 62 62 CYS CYS A . n A 1 34 PHE 34 63 63 PHE PHE A . n A 1 35 TYR 35 64 64 TYR TYR A . n A 1 36 SER 36 65 65 SER SER A . n A 1 37 GLU 37 66 66 GLU GLU A . n A 1 38 ASN 38 67 67 ASN ASN A . n A 1 39 ALA 39 68 68 ALA ALA A . n A 1 40 ASP 40 69 69 ASP ASP A . n A 1 41 LEU 41 70 70 LEU LEU A . n A 1 42 THR 42 71 71 THR THR A . n A 1 43 CYS 43 72 72 CYS CYS A . n A 1 44 ARG 44 73 73 ARG ARG A . n A 1 45 GLN 45 74 74 GLN GLN A . n A 1 46 PRO 46 75 75 PRO PRO A . n A 1 47 LYS 47 76 76 LYS LYS A . n A 1 48 CYS 48 77 77 CYS CYS A . n A 1 49 ASP 49 78 78 ASP ASP A . n A 1 50 LYS 50 79 79 LYS LYS A . n A 1 51 CYS 51 80 80 CYS CYS A . n A 1 52 ASN 52 81 81 ASN ASN A . n A 1 53 ALA 53 82 82 ALA ALA A . n A 1 54 ALA 54 83 83 ALA ALA A . n A 1 55 HIS 55 84 84 HIS HIS A . n A 1 56 SER 56 85 85 SER SER A . n A 1 57 HIS 57 86 86 HIS HIS A . n A 1 58 LEU 58 87 87 LEU LEU A . n A 1 59 ALA 59 88 88 ALA ALA A . n A 1 60 HIS 60 89 89 HIS HIS A . n A 1 61 PRO 61 90 90 PRO PRO A . n A 1 62 PRO 62 91 91 PRO PRO A . n A 1 63 SER 63 92 92 SER SER A . n A 1 64 ALA 64 93 93 ALA ALA A . n A 1 65 MET 65 94 94 MET MET A . n A 1 66 ALA 66 95 95 ALA ALA A . n A 1 67 ASP 67 96 96 ASP ASP A . n A 1 68 SER 68 97 97 SER SER A . n A 1 69 SER 69 98 98 SER SER A . n A 1 70 PHE 70 99 99 PHE PHE A . n A 1 71 ARG 71 100 100 ARG ARG A . n A 1 72 PHE 72 101 101 PHE PHE A . n A 1 73 PRO 73 102 102 PRO PRO A . n A 1 74 ARG 74 103 103 ARG ARG A . n A 1 75 THR 75 104 104 THR THR A . n A 1 76 TRP 76 105 105 TRP TRP A . n A 1 77 TRP 77 106 106 TRP TRP A . n A 1 78 GLN 78 107 107 GLN GLN A . n A 1 79 SER 79 108 108 SER SER A . n A 1 80 ALA 80 109 109 ALA ALA A . n A 1 81 GLU 81 110 110 GLU GLU A . n A 1 82 ASP 82 111 111 ASP ASP A . n A 1 83 VAL 83 112 112 VAL VAL A . n A 1 84 HIS 84 113 113 HIS HIS A . n A 1 85 ARG 85 114 114 ARG ARG A . n A 1 86 GLU 86 115 115 GLU GLU A . n A 1 87 LYS 87 116 116 LYS LYS A . n A 1 88 ILE 88 117 117 ILE ILE A . n A 1 89 GLN 89 118 118 GLN GLN A . n A 1 90 LEU 90 119 119 LEU LEU A . n A 1 91 ASP 91 120 120 ASP ASP A . n A 1 92 LEU 92 121 121 LEU LEU A . n A 1 93 GLU 93 122 122 GLU GLU A . n A 1 94 ALA 94 123 123 ALA ALA A . n A 1 95 GLU 95 124 124 GLU GLU A . n A 1 96 PHE 96 125 125 PHE PHE A . n A 1 97 TYR 97 126 126 TYR TYR A . n A 1 98 PHE 98 127 127 PHE PHE A . n A 1 99 THR 99 128 128 THR THR A . n A 1 100 HIS 100 129 129 HIS HIS A . n A 1 101 LEU 101 130 130 LEU LEU A . n A 1 102 ILE 102 131 131 ILE ILE A . n A 1 103 MET 103 132 132 MET MET A . n A 1 104 VAL 104 133 133 VAL VAL A . n A 1 105 PHE 105 134 134 PHE PHE A . n A 1 106 LYS 106 135 135 LYS LYS A . n A 1 107 SER 107 136 136 SER SER A . n A 1 108 PRO 108 137 137 PRO PRO A . n A 1 109 ARG 109 138 138 ARG ARG A . n A 1 110 PRO 110 139 139 PRO PRO A . n A 1 111 ALA 111 140 140 ALA ALA A . n A 1 112 ALA 112 141 141 ALA ALA A . n A 1 113 MET 113 142 142 MET MET A . n A 1 114 VAL 114 143 143 VAL VAL A . n A 1 115 LEU 115 144 144 LEU LEU A . n A 1 116 ASP 116 145 145 ASP ASP A . n A 1 117 ARG 117 146 146 ARG ARG A . n A 1 118 SER 118 147 147 SER SER A . n A 1 119 GLN 119 148 148 GLN GLN A . n A 1 120 ASP 120 149 149 ASP ASP A . n A 1 121 PHE 121 150 150 PHE PHE A . n A 1 122 GLY 122 151 151 GLY GLY A . n A 1 123 LYS 123 152 152 LYS LYS A . n A 1 124 THR 124 153 153 THR THR A . n A 1 125 TRP 125 154 154 TRP TRP A . n A 1 126 LYS 126 155 155 LYS LYS A . n A 1 127 PRO 127 156 156 PRO PRO A . n A 1 128 TYR 128 157 157 TYR TYR A . n A 1 129 LYS 129 158 158 LYS LYS A . n A 1 130 TYR 130 159 159 TYR TYR A . n A 1 131 PHE 131 160 160 PHE PHE A . n A 1 132 ALA 132 161 161 ALA ALA A . n A 1 133 THR 133 162 162 THR THR A . n A 1 134 ASN 134 163 163 ASN ASN A . n A 1 135 CYS 135 164 164 CYS CYS A . n A 1 136 SER 136 165 165 SER SER A . n A 1 137 ALA 137 166 166 ALA ALA A . n A 1 138 THR 138 167 167 THR THR A . n A 1 139 PHE 139 168 168 PHE PHE A . n A 1 140 GLY 140 169 169 GLY GLY A . n A 1 141 LEU 141 170 170 LEU LEU A . n A 1 142 GLU 142 171 171 GLU GLU A . n A 1 143 ASP 143 172 172 ASP ASP A . n A 1 144 ASP 144 173 173 ASP ASP A . n A 1 145 VAL 145 174 174 VAL VAL A . n A 1 146 VAL 146 175 175 VAL VAL A . n A 1 147 LYS 147 176 176 LYS LYS A . n A 1 148 LYS 148 177 177 LYS LYS A . n A 1 149 GLY 149 178 178 GLY GLY A . n A 1 150 ALA 150 179 179 ALA ALA A . n A 1 151 ILE 151 180 180 ILE ILE A . n A 1 152 CYS 152 181 181 CYS CYS A . n A 1 153 THR 153 182 182 THR THR A . n A 1 154 SER 154 183 183 SER SER A . n A 1 155 ARG 155 184 184 ARG ARG A . n A 1 156 TYR 156 185 185 TYR TYR A . n A 1 157 SER 157 186 186 SER SER A . n A 1 158 ASN 158 187 187 ASN ASN A . n A 1 159 PRO 159 188 188 PRO PRO A . n A 1 160 PHE 160 189 189 PHE PHE A . n A 1 161 PRO 161 190 190 PRO PRO A . n A 1 162 CYS 162 191 191 CYS CYS A . n A 1 163 THR 163 192 192 THR THR A . n A 1 164 GLY 164 193 193 GLY GLY A . n A 1 165 GLY 165 194 194 GLY GLY A . n A 1 166 GLU 166 195 195 GLU GLU A . n A 1 167 VAL 167 196 196 VAL VAL A . n A 1 168 ILE 168 197 197 ILE ILE A . n A 1 169 PHE 169 198 198 PHE PHE A . n A 1 170 ARG 170 199 199 ARG ARG A . n A 1 171 ALA 171 200 200 ALA ALA A . n A 1 172 LEU 172 201 201 LEU LEU A . n A 1 173 SER 173 202 202 SER SER A . n A 1 174 PRO 174 203 203 PRO PRO A . n A 1 175 PRO 175 204 204 PRO PRO A . n A 1 176 TYR 176 205 205 TYR TYR A . n A 1 177 ASP 177 206 206 ASP ASP A . n A 1 178 ILE 178 207 207 ILE ILE A . n A 1 179 GLU 179 208 208 GLU GLU A . n A 1 180 ASN 180 209 209 ASN ASN A . n A 1 181 PRO 181 210 210 PRO PRO A . n A 1 182 TYR 182 211 211 TYR TYR A . n A 1 183 SER 183 212 212 SER SER A . n A 1 184 ALA 184 213 213 ALA ALA A . n A 1 185 LYS 185 214 214 LYS LYS A . n A 1 186 VAL 186 215 215 VAL VAL A . n A 1 187 GLN 187 216 216 GLN GLN A . n A 1 188 GLU 188 217 217 GLU GLU A . n A 1 189 GLN 189 218 218 GLN GLN A . n A 1 190 LEU 190 219 219 LEU LEU A . n A 1 191 LYS 191 220 220 LYS LYS A . n A 1 192 ILE 192 221 221 ILE ILE A . n A 1 193 THR 193 222 222 THR THR A . n A 1 194 ASN 194 223 223 ASN ASN A . n A 1 195 LEU 195 224 224 LEU LEU A . n A 1 196 ARG 196 225 225 ARG ARG A . n A 1 197 VAL 197 226 226 VAL VAL A . n A 1 198 ARG 198 227 227 ARG ARG A . n A 1 199 LEU 199 228 228 LEU LEU A . n A 1 200 LEU 200 229 229 LEU LEU A . n A 1 201 LYS 201 230 230 LYS LYS A . n A 1 202 ARG 202 231 231 ARG ARG A . n A 1 203 GLN 203 232 232 GLN GLN A . n A 1 204 SER 204 233 233 SER SER A . n A 1 205 CYS 205 234 234 CYS CYS A . n A 1 206 PRO 206 235 235 PRO PRO A . n A 1 207 CYS 207 236 236 CYS CYS A . n A 1 208 GLN 208 237 237 GLN GLN A . n A 1 209 ILE 209 238 238 ILE ILE A . n A 1 210 ASN 210 239 239 ASN ASN A . n A 1 211 ASP 211 240 240 ASP ASP A . n A 1 212 LEU 212 241 241 LEU LEU A . n A 1 213 ASN 213 242 242 ASN ASN A . n A 1 214 ALA 214 243 243 ALA ALA A . n A 1 215 LYS 215 244 244 LYS LYS A . n A 1 216 PRO 216 245 245 PRO PRO A . n A 1 217 HIS 217 246 246 HIS HIS A . n A 1 218 HIS 218 247 247 HIS HIS A . n A 1 219 PHE 219 248 248 PHE PHE A . n A 1 220 MET 220 249 249 MET MET A . n A 1 221 HIS 221 250 250 HIS HIS A . n A 1 222 TYR 222 251 251 TYR TYR A . n A 1 223 ALA 223 252 252 ALA ALA A . n A 1 224 VAL 224 253 253 VAL VAL A . n A 1 225 TYR 225 254 254 TYR TYR A . n A 1 226 ASP 226 255 255 ASP ASP A . n A 1 227 PHE 227 256 256 PHE PHE A . n A 1 228 ILE 228 257 257 ILE ILE A . n A 1 229 VAL 229 258 258 VAL VAL A . n A 1 230 LYS 230 259 259 LYS LYS A . n A 1 231 GLY 231 260 260 GLY GLY A . n A 1 232 SER 232 261 261 SER SER A . n A 1 233 CYS 233 262 262 CYS CYS A . n A 1 234 PHE 234 263 263 PHE PHE A . n A 1 235 CYS 235 264 264 CYS CYS A . n A 1 236 ASN 236 265 265 ASN ASN A . n A 1 237 GLY 237 266 266 GLY GLY A . n A 1 238 HIS 238 267 267 HIS HIS A . n A 1 239 ALA 239 268 268 ALA ALA A . n A 1 240 ASP 240 269 269 ASP ASP A . n A 1 241 GLN 241 270 270 GLN GLN A . n A 1 242 CYS 242 271 271 CYS CYS A . n A 1 243 LEU 243 272 272 LEU LEU A . n A 1 244 PRO 244 273 273 PRO PRO A . n A 1 245 VAL 245 274 274 VAL VAL A . n A 1 246 GLU 246 275 275 GLU GLU A . n A 1 247 GLY 247 276 276 GLY GLY A . n A 1 248 PHE 248 277 277 PHE PHE A . n A 1 249 ARG 249 278 278 ARG ARG A . n A 1 250 PRO 250 279 279 PRO PRO A . n A 1 251 ILE 251 280 280 ILE ILE A . n A 1 252 LYS 252 281 ? ? ? A . n A 1 253 ALA 253 282 ? ? ? A . n A 1 254 PRO 254 283 ? ? ? A . n A 1 255 GLY 255 284 ? ? ? A . n A 1 256 ALA 256 285 285 ALA ALA A . n A 1 257 PHE 257 286 286 PHE PHE A . n A 1 258 HIS 258 287 287 HIS HIS A . n A 1 259 VAL 259 288 288 VAL VAL A . n A 1 260 VAL 260 289 289 VAL VAL A . n A 1 261 HIS 261 290 290 HIS HIS A . n A 1 262 GLY 262 291 291 GLY GLY A . n A 1 263 ARG 263 292 292 ARG ARG A . n A 1 264 CYS 264 293 293 CYS CYS A . n A 1 265 MET 265 294 294 MET MET A . n A 1 266 CYS 266 295 295 CYS CYS A . n A 1 267 LYS 267 296 296 LYS LYS A . n A 1 268 HIS 268 297 297 HIS HIS A . n A 1 269 ASN 269 298 298 ASN ASN A . n A 1 270 THR 270 299 299 THR THR A . n A 1 271 ALA 271 300 300 ALA ALA A . n A 1 272 GLY 272 301 301 GLY GLY A . n A 1 273 SER 273 302 302 SER SER A . n A 1 274 HIS 274 303 303 HIS HIS A . n A 1 275 CYS 275 304 304 CYS CYS A . n A 1 276 GLN 276 305 305 GLN GLN A . n A 1 277 HIS 277 306 306 HIS HIS A . n A 1 278 CYS 278 307 307 CYS CYS A . n A 1 279 ALA 279 308 308 ALA ALA A . n A 1 280 PRO 280 309 309 PRO PRO A . n A 1 281 LEU 281 310 310 LEU LEU A . n A 1 282 TYR 282 311 311 TYR TYR A . n A 1 283 ASN 283 312 312 ASN ASN A . n A 1 284 ASP 284 313 313 ASP ASP A . n A 1 285 ARG 285 314 314 ARG ARG A . n A 1 286 PRO 286 315 315 PRO PRO A . n A 1 287 TRP 287 316 316 TRP TRP A . n A 1 288 GLU 288 317 317 GLU GLU A . n A 1 289 ALA 289 318 318 ALA ALA A . n A 1 290 ALA 290 319 319 ALA ALA A . n A 1 291 ASP 291 320 320 ASP ASP A . n A 1 292 GLY 292 321 321 GLY GLY A . n A 1 293 ARG 293 322 322 ARG ARG A . n A 1 294 THR 294 323 323 THR THR A . n A 1 295 GLY 295 324 324 GLY GLY A . n A 1 296 ALA 296 325 325 ALA ALA A . n A 1 297 PRO 297 326 326 PRO PRO A . n A 1 298 ASN 298 327 327 ASN ASN A . n A 1 299 GLU 299 328 328 GLU GLU A . n A 1 300 CYS 300 329 329 CYS CYS A . n A 1 301 ARG 301 330 330 ARG ARG A . n A 1 302 THR 302 331 331 THR THR A . n A 1 303 CYS 303 332 332 CYS CYS A . n A 1 304 LYS 304 333 333 LYS LYS A . n A 1 305 CYS 305 334 334 CYS CYS A . n A 1 306 ASN 306 335 335 ASN ASN A . n A 1 307 GLY 307 336 336 GLY GLY A . n A 1 308 HIS 308 337 337 HIS HIS A . n A 1 309 ALA 309 338 338 ALA ALA A . n A 1 310 ASP 310 339 339 ASP ASP A . n A 1 311 THR 311 340 340 THR THR A . n A 1 312 CYS 312 341 341 CYS CYS A . n A 1 313 HIS 313 342 342 HIS HIS A . n A 1 314 PHE 314 343 343 PHE PHE A . n A 1 315 ASP 315 344 344 ASP ASP A . n A 1 316 VAL 316 345 345 VAL VAL A . n A 1 317 ASN 317 346 346 ASN ASN A . n A 1 318 VAL 318 347 347 VAL VAL A . n A 1 319 TRP 319 348 348 TRP TRP A . n A 1 320 GLU 320 349 349 GLU GLU A . n A 1 321 ALA 321 350 350 ALA ALA A . n A 1 322 SER 322 351 351 SER SER A . n A 1 323 GLY 323 352 352 GLY GLY A . n A 1 324 ASN 324 353 353 ASN ASN A . n A 1 325 ARG 325 354 354 ARG ARG A . n A 1 326 SER 326 355 355 SER SER A . n A 1 327 GLY 327 356 356 GLY GLY A . n A 1 328 GLY 328 357 357 GLY GLY A . n A 1 329 VAL 329 358 358 VAL VAL A . n A 1 330 CYS 330 359 359 CYS CYS A . n A 1 331 ASN 331 360 360 ASN ASN A . n A 1 332 ASN 332 361 361 ASN ASN A . n A 1 333 CYS 333 362 362 CYS CYS A . n A 1 334 GLN 334 363 363 GLN GLN A . n A 1 335 HIS 335 364 364 HIS HIS A . n A 1 336 ASN 336 365 365 ASN ASN A . n A 1 337 THR 337 366 366 THR THR A . n A 1 338 GLU 338 367 367 GLU GLU A . n A 1 339 GLY 339 368 368 GLY GLY A . n A 1 340 GLN 340 369 369 GLN GLN A . n A 1 341 HIS 341 370 370 HIS HIS A . n A 1 342 CYS 342 371 371 CYS CYS A . n A 1 343 GLN 343 372 372 GLN GLN A . n A 1 344 ARG 344 373 373 ARG ARG A . n A 1 345 CYS 345 374 374 CYS CYS A . n A 1 346 LYS 346 375 375 LYS LYS A . n A 1 347 PRO 347 376 376 PRO PRO A . n A 1 348 GLY 348 377 377 GLY GLY A . n A 1 349 PHE 349 378 378 PHE PHE A . n A 1 350 TYR 350 379 379 TYR TYR A . n A 1 351 ARG 351 380 380 ARG ARG A . n A 1 352 ASP 352 381 381 ASP ASP A . n A 1 353 LEU 353 382 382 LEU LEU A . n A 1 354 ARG 354 383 383 ARG ARG A . n A 1 355 ARG 355 384 384 ARG ARG A . n A 1 356 PRO 356 385 385 PRO PRO A . n A 1 357 PHE 357 386 386 PHE PHE A . n A 1 358 SER 358 387 387 SER SER A . n A 1 359 ALA 359 388 388 ALA ALA A . n A 1 360 PRO 360 389 389 PRO PRO A . n A 1 361 ASP 361 390 390 ASP ASP A . n A 1 362 ALA 362 391 391 ALA ALA A . n A 1 363 CYS 363 392 392 CYS CYS A . n A 1 364 LYS 364 393 393 LYS LYS A . n A 1 365 ALA 365 394 394 ALA ALA A . n A 1 366 CYS 366 395 395 CYS CYS A . n A 1 367 SER 367 396 396 SER SER A . n A 1 368 CYS 368 397 397 CYS CYS A . n A 1 369 HIS 369 398 398 HIS HIS A . n A 1 370 PRO 370 399 399 PRO PRO A . n A 1 371 VAL 371 400 400 VAL VAL A . n A 1 372 GLY 372 401 401 GLY GLY A . n A 1 373 SER 373 402 402 SER SER A . n A 1 374 ALA 374 403 403 ALA ALA A . n A 1 375 ILE 375 404 404 ILE ILE A . n A 1 376 LEU 376 405 405 LEU LEU A . n A 1 377 PRO 377 406 406 PRO PRO A . n A 1 378 PHE 378 407 407 PHE PHE A . n A 1 379 SER 379 408 408 SER SER A . n A 1 380 SER 380 409 409 SER SER A . n A 1 381 VAL 381 410 410 VAL VAL A . n A 1 382 THR 382 411 411 THR THR A . n A 1 383 PHE 383 412 412 PHE PHE A . n A 1 384 CYS 384 413 413 CYS CYS A . n A 1 385 ASP 385 414 414 ASP ASP A . n A 1 386 PRO 386 415 415 PRO PRO A . n A 1 387 SER 387 416 416 SER SER A . n A 1 388 ASN 388 417 417 ASN ASN A . n A 1 389 GLY 389 418 418 GLY GLY A . n A 1 390 ASP 390 419 419 ASP ASP A . n A 1 391 CYS 391 420 420 CYS CYS A . n A 1 392 PRO 392 421 421 PRO PRO A . n A 1 393 CYS 393 422 422 CYS CYS A . n A 1 394 LYS 394 423 423 LYS LYS A . n A 1 395 PRO 395 424 424 PRO PRO A . n A 1 396 GLY 396 425 425 GLY GLY A . n A 1 397 VAL 397 426 426 VAL VAL A . n A 1 398 ALA 398 427 427 ALA ALA A . n A 1 399 GLY 399 428 428 GLY GLY A . n A 1 400 PRO 400 429 429 PRO PRO A . n A 1 401 HIS 401 430 430 HIS HIS A . n A 1 402 CYS 402 431 431 CYS CYS A . n A 1 403 ASP 403 432 432 ASP ASP A . n A 1 404 ARG 404 433 433 ARG ARG A . n A 1 405 CYS 405 434 434 CYS CYS A . n A 1 406 MET 406 435 435 MET MET A . n A 1 407 VAL 407 436 436 VAL VAL A . n A 1 408 GLY 408 437 437 GLY GLY A . n A 1 409 TYR 409 438 438 TYR TYR A . n A 1 410 TRP 410 439 439 TRP TRP A . n A 1 411 GLY 411 440 440 GLY GLY A . n A 1 412 PHE 412 441 441 PHE PHE A . n A 1 413 GLY 413 442 442 GLY GLY A . n A 1 414 ASP 414 443 443 ASP ASP A . n A 1 415 TYR 415 444 444 TYR TYR A . n A 1 416 GLY 416 445 445 GLY GLY A . n A 1 417 CYS 417 446 446 CYS CYS A . n A 1 418 ARG 418 447 447 ARG ARG A . n A 1 419 PRO 419 448 448 PRO PRO A . n A 1 420 CYS 420 449 449 CYS CYS A . n A 1 421 ASP 421 450 450 ASP ASP A . n A 1 422 CYS 422 451 451 CYS CYS A . n A 1 423 ALA 423 452 452 ALA ALA A . n A 1 424 GLY 424 453 453 GLY GLY A . n A 1 425 SER 425 454 454 SER SER A . n A 1 426 CYS 426 455 455 CYS CYS A . n A 1 427 ASP 427 456 456 ASP ASP A . n A 1 428 PRO 428 457 457 PRO PRO A . n A 1 429 LEU 429 458 458 LEU LEU A . n A 1 430 THR 430 459 459 THR THR A . n A 1 431 GLY 431 460 460 GLY GLY A . n A 1 432 ASP 432 461 461 ASP ASP A . n A 1 433 CYS 433 462 462 CYS CYS A . 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 B 2 NAG 1 501 1 NAG NAG A . C 2 NAG 2 502 2 NAG NAG A . D 2 NAG 1 503 3 NAG NAG A . E 2 NAG 1 504 4 NAG NAG A . F 2 NAG 1 505 5 NAG NAG A . G 2 NAG 2 506 6 NAG NAG A . H 3 CA 1 507 1 CA CA A . I 4 TAM 1 508 1 TAM TAM A . J 5 HOH 1 601 6 HOH HOH A . J 5 HOH 2 602 27 HOH HOH A . J 5 HOH 3 603 18 HOH HOH A . J 5 HOH 4 604 13 HOH HOH A . J 5 HOH 5 605 1 HOH HOH A . J 5 HOH 6 606 8 HOH HOH A . J 5 HOH 7 607 2 HOH HOH A . J 5 HOH 8 608 14 HOH HOH A . J 5 HOH 9 609 11 HOH HOH A . J 5 HOH 10 610 15 HOH HOH A . J 5 HOH 11 611 9 HOH HOH A . J 5 HOH 12 612 23 HOH HOH A . J 5 HOH 13 613 5 HOH HOH A . J 5 HOH 14 614 12 HOH HOH A . J 5 HOH 15 615 10 HOH HOH A . J 5 HOH 16 616 20 HOH HOH A . J 5 HOH 17 617 4 HOH HOH A . J 5 HOH 18 618 17 HOH HOH A . J 5 HOH 19 619 19 HOH HOH A . J 5 HOH 20 620 7 HOH HOH A . J 5 HOH 21 621 25 HOH HOH A . J 5 HOH 22 622 32 HOH HOH A . J 5 HOH 23 623 16 HOH HOH A . J 5 HOH 24 624 22 HOH HOH A . J 5 HOH 25 625 21 HOH HOH A . J 5 HOH 26 626 26 HOH HOH A . J 5 HOH 27 627 24 HOH HOH A . # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_and_software_defined_assembly _pdbx_struct_assembly.method_details PISA _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 1460 ? 1 MORE 5 ? 1 'SSA (A^2)' 23010 ? # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 O ? A ALA 64 ? A ALA 93 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 OD1 ? A ASP 67 ? A ASP 96 ? 1_555 64.4 ? 2 O ? A ALA 64 ? A ALA 93 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? A THR 75 ? A THR 104 ? 1_555 86.8 ? 3 OD1 ? A ASP 67 ? A ASP 96 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? A THR 75 ? A THR 104 ? 1_555 145.9 ? 4 O ? A ALA 64 ? A ALA 93 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 OG1 ? A THR 75 ? A THR 104 ? 1_555 77.5 ? 5 OD1 ? A ASP 67 ? A ASP 96 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 OG1 ? A THR 75 ? A THR 104 ? 1_555 81.4 ? 6 O ? A THR 75 ? A THR 104 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 OG1 ? A THR 75 ? A THR 104 ? 1_555 74.5 ? 7 O ? A ALA 64 ? A ALA 93 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? A TYR 225 ? A TYR 254 ? 1_555 77.1 ? 8 OD1 ? A ASP 67 ? A ASP 96 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? A TYR 225 ? A TYR 254 ? 1_555 116.5 ? 9 O ? A THR 75 ? A THR 104 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? A TYR 225 ? A TYR 254 ? 1_555 70.5 ? 10 OG1 ? A THR 75 ? A THR 104 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? A TYR 225 ? A TYR 254 ? 1_555 137.5 ? 11 O ? A ALA 64 ? A ALA 93 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? J HOH . ? A HOH 605 ? 1_555 86.7 ? 12 OD1 ? A ASP 67 ? A ASP 96 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? J HOH . ? A HOH 605 ? 1_555 61.6 ? 13 O ? A THR 75 ? A THR 104 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? J HOH . ? A HOH 605 ? 1_555 138.4 ? 14 OG1 ? A THR 75 ? A THR 104 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? J HOH . ? A HOH 605 ? 1_555 143.0 ? 15 O ? A TYR 225 ? A TYR 254 ? 1_555 CA ? H CA . ? A CA 507 ? 1_555 O ? J HOH . ? A HOH 605 ? 1_555 68.0 ? # 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 2016-02-10 2 'Structure model' 1 1 2016-12-14 3 'Structure model' 1 2 2017-11-22 # _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 ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Database references' 2 3 'Structure model' 'Refinement description' # _pdbx_audit_revision_category.ordinal 1 _pdbx_audit_revision_category.revision_ordinal 3 _pdbx_audit_revision_category.data_content_type 'Structure model' _pdbx_audit_revision_category.category software # loop_ _pdbx_audit_revision_item.ordinal _pdbx_audit_revision_item.revision_ordinal _pdbx_audit_revision_item.data_content_type _pdbx_audit_revision_item.item 1 3 'Structure model' '_software.classification' 2 3 'Structure model' '_software.name' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] 'X-RAY DIFFRACTION' 1 ? refined 33.3103 3.9537 67.1661 0.4190 0.1778 0.3037 -0.0051 -0.1780 -0.0048 0.1881 2.1075 0.7752 0.2019 0.0835 -1.0578 0.1540 -0.0541 -0.1024 0.0087 -0.2045 0.0603 0.0359 0.1198 -0.0563 'X-RAY DIFFRACTION' 2 ? refined 37.6699 26.0707 54.2208 0.4849 0.0881 0.3638 0.0199 -0.1488 0.0345 0.2000 2.9000 0.9402 0.2631 0.0087 -1.3601 0.0607 -0.0458 -0.0260 0.0129 0.0074 0.0826 -0.1005 0.0440 -0.0352 'X-RAY DIFFRACTION' 3 ? refined 22.8277 77.9407 21.9274 0.3803 0.1944 0.4054 0.0371 -0.0404 0.1440 3.6795 4.7171 2.5146 -0.1981 0.6381 0.3063 0.1868 -0.0998 -0.0286 0.1816 -0.0035 -0.0474 0.0577 -0.3460 0.1178 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection_details _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection 'X-RAY DIFFRACTION' 1 1 A 30 A 181 '( CHAIN A AND ( RESID 30:181 OR RESID 508:508 ) )' ? ? ? ? ? 'X-RAY DIFFRACTION' 2 1 A 508 A 508 '( CHAIN A AND ( RESID 30:181 OR RESID 508:508 ) )' ? ? ? ? ? 'X-RAY DIFFRACTION' 3 2 A 182 A 395 '( CHAIN A AND RESID 182:395 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 4 3 A 396 A 462 '( CHAIN A AND RESID 396:462 )' ? ? ? ? ? # _phasing.method MR # loop_ _software.citation_id _software.classification _software.compiler_name _software.compiler_version _software.contact_author _software.contact_author_email _software.date _software.description _software.dependencies _software.hardware _software.language _software.location _software.mods _software.name _software.os _software.os_version _software.type _software.version _software.pdbx_ordinal ? 'data collection' ? ? ? ? ? ? ? ? ? ? ? CrystalClear ? ? ? . 1 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 2 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? SCALEPACK ? ? ? . 3 ? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.15 4 ? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? '(phenix.refine: 1.8.4_1496)' 5 ? 'model building' ? ? ? ? ? ? ? ? ? ? ? Coot ? ? ? . 6 ? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 7 ? refinement ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? . 8 ? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? DENZO ? ? ? . 9 # _pdbx_validate_close_contact.id 1 _pdbx_validate_close_contact.PDB_model_num 1 _pdbx_validate_close_contact.auth_atom_id_1 OD2 _pdbx_validate_close_contact.auth_asym_id_1 A _pdbx_validate_close_contact.auth_comp_id_1 ASP _pdbx_validate_close_contact.auth_seq_id_1 96 _pdbx_validate_close_contact.PDB_ins_code_1 ? _pdbx_validate_close_contact.label_alt_id_1 ? _pdbx_validate_close_contact.auth_atom_id_2 OG1 _pdbx_validate_close_contact.auth_asym_id_2 A _pdbx_validate_close_contact.auth_comp_id_2 THR _pdbx_validate_close_contact.auth_seq_id_2 104 _pdbx_validate_close_contact.PDB_ins_code_2 ? _pdbx_validate_close_contact.label_alt_id_2 ? _pdbx_validate_close_contact.dist 2.17 # 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 GLU A 31 ? ? -61.22 -75.07 2 1 LYS A 32 ? ? -79.38 -167.83 3 1 ASN A 56 ? ? -86.86 -93.51 4 1 PHE A 99 ? ? -157.83 72.54 5 1 PHE A 101 ? ? -53.71 -70.30 6 1 ASP A 111 ? ? 53.43 71.71 7 1 HIS A 129 ? ? -173.79 143.20 8 1 TYR A 157 ? ? -122.82 -51.26 9 1 GLU A 208 ? ? 69.12 169.89 10 1 ARG A 231 ? ? -68.52 -179.12 11 1 PRO A 235 ? ? -77.80 23.03 12 1 ILE A 238 ? ? -89.47 32.48 13 1 MET A 249 ? ? -68.94 82.46 14 1 CYS A 264 ? ? -140.18 20.63 15 1 LYS A 296 ? ? -118.00 -169.11 16 1 ASN A 312 ? ? -103.92 41.73 17 1 GLU A 367 ? ? -147.95 -33.83 18 1 ASP A 390 ? ? -93.35 35.37 19 1 ASN A 417 ? ? -143.30 -6.65 # loop_ _pdbx_unobs_or_zero_occ_atoms.id _pdbx_unobs_or_zero_occ_atoms.PDB_model_num _pdbx_unobs_or_zero_occ_atoms.polymer_flag _pdbx_unobs_or_zero_occ_atoms.occupancy_flag _pdbx_unobs_or_zero_occ_atoms.auth_asym_id _pdbx_unobs_or_zero_occ_atoms.auth_comp_id _pdbx_unobs_or_zero_occ_atoms.auth_seq_id _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code _pdbx_unobs_or_zero_occ_atoms.auth_atom_id _pdbx_unobs_or_zero_occ_atoms.label_alt_id _pdbx_unobs_or_zero_occ_atoms.label_asym_id _pdbx_unobs_or_zero_occ_atoms.label_comp_id _pdbx_unobs_or_zero_occ_atoms.label_seq_id _pdbx_unobs_or_zero_occ_atoms.label_atom_id 1 1 Y 1 A GLU 31 ? CG ? A GLU 2 CG 2 1 Y 1 A GLU 31 ? CD ? A GLU 2 CD 3 1 Y 1 A GLU 31 ? OE1 ? A GLU 2 OE1 4 1 Y 1 A GLU 31 ? OE2 ? A GLU 2 OE2 5 1 Y 1 A ASP 69 ? CG ? A ASP 40 CG 6 1 Y 1 A ASP 69 ? OD1 ? A ASP 40 OD1 7 1 Y 1 A ASP 69 ? OD2 ? A ASP 40 OD2 8 1 Y 1 A PHE 99 ? CG ? A PHE 70 CG 9 1 Y 1 A PHE 99 ? CD1 ? A PHE 70 CD1 10 1 Y 1 A PHE 99 ? CD2 ? A PHE 70 CD2 11 1 Y 1 A PHE 99 ? CE1 ? A PHE 70 CE1 12 1 Y 1 A PHE 99 ? CE2 ? A PHE 70 CE2 13 1 Y 1 A PHE 99 ? CZ ? A PHE 70 CZ 14 1 Y 1 A PHE 101 ? CG ? A PHE 72 CG 15 1 Y 1 A PHE 101 ? CD1 ? A PHE 72 CD1 16 1 Y 1 A PHE 101 ? CD2 ? A PHE 72 CD2 17 1 Y 1 A PHE 101 ? CE1 ? A PHE 72 CE1 18 1 Y 1 A PHE 101 ? CE2 ? A PHE 72 CE2 19 1 Y 1 A PHE 101 ? CZ ? A PHE 72 CZ 20 1 Y 1 A LYS 152 ? CG ? A LYS 123 CG 21 1 Y 1 A LYS 152 ? CD ? A LYS 123 CD 22 1 Y 1 A LYS 152 ? CE ? A LYS 123 CE 23 1 Y 1 A LYS 152 ? NZ ? A LYS 123 NZ 24 1 Y 1 A LYS 177 ? CG ? A LYS 148 CG 25 1 Y 1 A LYS 177 ? CD ? A LYS 148 CD 26 1 Y 1 A LYS 177 ? CE ? A LYS 148 CE 27 1 Y 1 A LYS 177 ? NZ ? A LYS 148 NZ 28 1 Y 1 A GLN 237 ? CG ? A GLN 208 CG 29 1 Y 1 A GLN 237 ? CD ? A GLN 208 CD 30 1 Y 1 A GLN 237 ? OE1 ? A GLN 208 OE1 31 1 Y 1 A GLN 237 ? NE2 ? A GLN 208 NE2 32 1 Y 1 A ILE 238 ? CG1 ? A ILE 209 CG1 33 1 Y 1 A ILE 238 ? CG2 ? A ILE 209 CG2 34 1 Y 1 A ILE 238 ? CD1 ? A ILE 209 CD1 35 1 Y 1 A ASN 239 ? CG ? A ASN 210 CG 36 1 Y 1 A ASN 239 ? OD1 ? A ASN 210 OD1 37 1 Y 1 A ASN 239 ? ND2 ? A ASN 210 ND2 38 1 Y 1 A ASP 240 ? CG ? A ASP 211 CG 39 1 Y 1 A ASP 240 ? OD1 ? A ASP 211 OD1 40 1 Y 1 A ASP 240 ? OD2 ? A ASP 211 OD2 41 1 Y 1 A MET 249 ? CG ? A MET 220 CG 42 1 Y 1 A MET 249 ? SD ? A MET 220 SD 43 1 Y 1 A MET 249 ? CE ? A MET 220 CE 44 1 Y 1 A ARG 278 ? CG ? A ARG 249 CG 45 1 Y 1 A ARG 278 ? CD ? A ARG 249 CD 46 1 Y 1 A ARG 278 ? NE ? A ARG 249 NE 47 1 Y 1 A ARG 278 ? CZ ? A ARG 249 CZ 48 1 Y 1 A ARG 278 ? NH1 ? A ARG 249 NH1 49 1 Y 1 A ARG 278 ? NH2 ? A ARG 249 NH2 50 1 Y 1 A PHE 286 ? CG ? A PHE 257 CG 51 1 Y 1 A PHE 286 ? CD1 ? A PHE 257 CD1 52 1 Y 1 A PHE 286 ? CD2 ? A PHE 257 CD2 53 1 Y 1 A PHE 286 ? CE1 ? A PHE 257 CE1 54 1 Y 1 A PHE 286 ? CE2 ? A PHE 257 CE2 55 1 Y 1 A PHE 286 ? CZ ? A PHE 257 CZ 56 1 Y 1 A HIS 287 ? CG ? A HIS 258 CG 57 1 Y 1 A HIS 287 ? ND1 ? A HIS 258 ND1 58 1 Y 1 A HIS 287 ? CD2 ? A HIS 258 CD2 59 1 Y 1 A HIS 287 ? CE1 ? A HIS 258 CE1 60 1 Y 1 A HIS 287 ? NE2 ? A HIS 258 NE2 61 1 Y 1 A GLU 349 ? CG ? A GLU 320 CG 62 1 Y 1 A GLU 349 ? CD ? A GLU 320 CD 63 1 Y 1 A GLU 349 ? OE1 ? A GLU 320 OE1 64 1 Y 1 A GLU 349 ? OE2 ? A GLU 320 OE2 65 1 Y 1 A ASP 450 ? CG ? A ASP 421 CG 66 1 Y 1 A ASP 450 ? OD1 ? A ASP 421 OD1 67 1 Y 1 A ASP 450 ? OD2 ? A ASP 421 OD2 68 1 Y 1 A SER 454 ? OG ? A SER 425 OG 69 1 N 1 A NAG 504 ? O1 ? E NAG 1 O1 # 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 LYS 281 ? A LYS 252 2 1 Y 1 A ALA 282 ? A ALA 253 3 1 Y 1 A PRO 283 ? A PRO 254 4 1 Y 1 A GLY 284 ? A GLY 255 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 'CALCIUM ION' CA 4 'TRIS(HYDROXYETHYL)AMINOMETHANE' TAM 5 water HOH #