data_5FC6 # _entry.id 5FC6 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 5FC6 WWPDB D_1000216359 # loop_ _pdbx_database_related.db_name _pdbx_database_related.details _pdbx_database_related.db_id _pdbx_database_related.content_type PDB . 5FC1 unspecified PDB . 5FC5 unspecified PDB . 5FC7 unspecified PDB . 5FCA unspecified PDB . 5FCB unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 5FC6 _pdbx_database_status.recvd_initial_deposition_date 2015-12-15 _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 'Gorelik, A.' 1 'Illes, K.' 2 'Superti-Furga, G.' 3 'Nagar, B.' 4 # _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 US _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev J.Biol.Chem. _citation.journal_id_ASTM JBCHA3 _citation.journal_id_CSD 0071 _citation.journal_id_ISSN 1083-351X _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 291 _citation.language ? _citation.page_first 6376 _citation.page_last 6385 _citation.title 'Structural Basis for Nucleotide Hydrolysis by the Acid Sphingomyelinase-like Phosphodiesterase SMPDL3A.' _citation.year 2016 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1074/jbc.M115.711085 _citation.pdbx_database_id_PubMed 26792860 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Gorelik, A.' 1 primary 'Illes, K.' 2 primary 'Superti-Furga, G.' 3 primary 'Nagar, B.' 4 # _cell.entry_id 5FC6 _cell.length_a 124.351 _cell.length_b 132.888 _cell.length_c 80.519 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 8 _cell.pdbx_unique_axis ? # _symmetry.entry_id 5FC6 _symmetry.space_group_name_H-M 'C 2 2 21' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 20 # 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 'Acid sphingomyelinase-like phosphodiesterase 3a' 48997.258 1 3.1.4.- ? 'UNP residues 23-445' ? 2 non-polymer syn 'ZINC ION' 65.409 2 ? ? ? ? 3 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 8 ? ? ? ? 4 non-polymer man ALPHA-L-FUCOSE 164.156 2 ? ? ? ? 5 non-polymer man BETA-D-MANNOSE 180.156 1 ? ? ? ? 6 non-polymer man ALPHA-D-MANNOSE 180.156 2 ? ? ? ? 7 non-polymer syn GLYCEROL 92.094 4 ? ? ? ? 8 non-polymer syn 'PHOSPHOMETHYLPHOSPHONIC ACID ADENOSYL ESTER' 425.228 1 ? ? ? ? 9 water nat water 18.015 520 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'ASM-like phosphodiesterase 3a' # _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 ;DRHHHHHHKLVPLAPADRAPAVGQFWHVTDLHLDPTYHITDDRTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFI KNSGQEASFMIWTGDSPPHVPVPELSTGTVIKVITNMTMTVQNLFPNLQVFPALGNHDYWPQDQLPIVTSKVYSAVADLW KPWLGEEAISTLKKGGFYSQKVASNPGLRIISLNTNLYYGPNIMTLNKTDPANQFEWLENTLNSSLWNKEKVYIIAHVPV GYLPYATDTPAIRQYYNEKLLDIFRRYSSVIAGQFYGHTHRDSLMVLSDKNGNPLNSVFVAPAVTPVKGVLQKETNNPGV RLFQYKPGDYTLLDMVQYYLNLTEANLKGESNWTLEYVLTQAYSVADLQPKSLYALVQQFATKDSKQFLKYYHYYFVSYD SSATCDQHCKTLQVCAIMNLDSMSYDDCLKQHL ; _entity_poly.pdbx_seq_one_letter_code_can ;DRHHHHHHKLVPLAPADRAPAVGQFWHVTDLHLDPTYHITDDRTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFI KNSGQEASFMIWTGDSPPHVPVPELSTGTVIKVITNMTMTVQNLFPNLQVFPALGNHDYWPQDQLPIVTSKVYSAVADLW KPWLGEEAISTLKKGGFYSQKVASNPGLRIISLNTNLYYGPNIMTLNKTDPANQFEWLENTLNSSLWNKEKVYIIAHVPV GYLPYATDTPAIRQYYNEKLLDIFRRYSSVIAGQFYGHTHRDSLMVLSDKNGNPLNSVFVAPAVTPVKGVLQKETNNPGV RLFQYKPGDYTLLDMVQYYLNLTEANLKGESNWTLEYVLTQAYSVADLQPKSLYALVQQFATKDSKQFLKYYHYYFVSYD SSATCDQHCKTLQVCAIMNLDSMSYDDCLKQHL ; _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 ASP n 1 2 ARG n 1 3 HIS n 1 4 HIS n 1 5 HIS n 1 6 HIS n 1 7 HIS n 1 8 HIS n 1 9 LYS n 1 10 LEU n 1 11 VAL n 1 12 PRO n 1 13 LEU n 1 14 ALA n 1 15 PRO n 1 16 ALA n 1 17 ASP n 1 18 ARG n 1 19 ALA n 1 20 PRO n 1 21 ALA n 1 22 VAL n 1 23 GLY n 1 24 GLN n 1 25 PHE n 1 26 TRP n 1 27 HIS n 1 28 VAL n 1 29 THR n 1 30 ASP n 1 31 LEU n 1 32 HIS n 1 33 LEU n 1 34 ASP n 1 35 PRO n 1 36 THR n 1 37 TYR n 1 38 HIS n 1 39 ILE n 1 40 THR n 1 41 ASP n 1 42 ASP n 1 43 ARG n 1 44 THR n 1 45 LYS n 1 46 VAL n 1 47 CYS n 1 48 ALA n 1 49 SER n 1 50 SER n 1 51 LYS n 1 52 GLY n 1 53 ALA n 1 54 ASN n 1 55 ALA n 1 56 SER n 1 57 ASN n 1 58 PRO n 1 59 GLY n 1 60 PRO n 1 61 PHE n 1 62 GLY n 1 63 ASP n 1 64 VAL n 1 65 LEU n 1 66 CYS n 1 67 ASP n 1 68 SER n 1 69 PRO n 1 70 TYR n 1 71 GLN n 1 72 LEU n 1 73 ILE n 1 74 LEU n 1 75 SER n 1 76 ALA n 1 77 PHE n 1 78 ASP n 1 79 PHE n 1 80 ILE n 1 81 LYS n 1 82 ASN n 1 83 SER n 1 84 GLY n 1 85 GLN n 1 86 GLU n 1 87 ALA n 1 88 SER n 1 89 PHE n 1 90 MET n 1 91 ILE n 1 92 TRP n 1 93 THR n 1 94 GLY n 1 95 ASP n 1 96 SER n 1 97 PRO n 1 98 PRO n 1 99 HIS n 1 100 VAL n 1 101 PRO n 1 102 VAL n 1 103 PRO n 1 104 GLU n 1 105 LEU n 1 106 SER n 1 107 THR n 1 108 GLY n 1 109 THR n 1 110 VAL n 1 111 ILE n 1 112 LYS n 1 113 VAL n 1 114 ILE n 1 115 THR n 1 116 ASN n 1 117 MET n 1 118 THR n 1 119 MET n 1 120 THR n 1 121 VAL n 1 122 GLN n 1 123 ASN n 1 124 LEU n 1 125 PHE n 1 126 PRO n 1 127 ASN n 1 128 LEU n 1 129 GLN n 1 130 VAL n 1 131 PHE n 1 132 PRO n 1 133 ALA n 1 134 LEU n 1 135 GLY n 1 136 ASN n 1 137 HIS n 1 138 ASP n 1 139 TYR n 1 140 TRP n 1 141 PRO n 1 142 GLN n 1 143 ASP n 1 144 GLN n 1 145 LEU n 1 146 PRO n 1 147 ILE n 1 148 VAL n 1 149 THR n 1 150 SER n 1 151 LYS n 1 152 VAL n 1 153 TYR n 1 154 SER n 1 155 ALA n 1 156 VAL n 1 157 ALA n 1 158 ASP n 1 159 LEU n 1 160 TRP n 1 161 LYS n 1 162 PRO n 1 163 TRP n 1 164 LEU n 1 165 GLY n 1 166 GLU n 1 167 GLU n 1 168 ALA n 1 169 ILE n 1 170 SER n 1 171 THR n 1 172 LEU n 1 173 LYS n 1 174 LYS n 1 175 GLY n 1 176 GLY n 1 177 PHE n 1 178 TYR n 1 179 SER n 1 180 GLN n 1 181 LYS n 1 182 VAL n 1 183 ALA n 1 184 SER n 1 185 ASN n 1 186 PRO n 1 187 GLY n 1 188 LEU n 1 189 ARG n 1 190 ILE n 1 191 ILE n 1 192 SER n 1 193 LEU n 1 194 ASN n 1 195 THR n 1 196 ASN n 1 197 LEU n 1 198 TYR n 1 199 TYR n 1 200 GLY n 1 201 PRO n 1 202 ASN n 1 203 ILE n 1 204 MET n 1 205 THR n 1 206 LEU n 1 207 ASN n 1 208 LYS n 1 209 THR n 1 210 ASP n 1 211 PRO n 1 212 ALA n 1 213 ASN n 1 214 GLN n 1 215 PHE n 1 216 GLU n 1 217 TRP n 1 218 LEU n 1 219 GLU n 1 220 ASN n 1 221 THR n 1 222 LEU n 1 223 ASN n 1 224 SER n 1 225 SER n 1 226 LEU n 1 227 TRP n 1 228 ASN n 1 229 LYS n 1 230 GLU n 1 231 LYS n 1 232 VAL n 1 233 TYR n 1 234 ILE n 1 235 ILE n 1 236 ALA n 1 237 HIS n 1 238 VAL n 1 239 PRO n 1 240 VAL n 1 241 GLY n 1 242 TYR n 1 243 LEU n 1 244 PRO n 1 245 TYR n 1 246 ALA n 1 247 THR n 1 248 ASP n 1 249 THR n 1 250 PRO n 1 251 ALA n 1 252 ILE n 1 253 ARG n 1 254 GLN n 1 255 TYR n 1 256 TYR n 1 257 ASN n 1 258 GLU n 1 259 LYS n 1 260 LEU n 1 261 LEU n 1 262 ASP n 1 263 ILE n 1 264 PHE n 1 265 ARG n 1 266 ARG n 1 267 TYR n 1 268 SER n 1 269 SER n 1 270 VAL n 1 271 ILE n 1 272 ALA n 1 273 GLY n 1 274 GLN n 1 275 PHE n 1 276 TYR n 1 277 GLY n 1 278 HIS n 1 279 THR n 1 280 HIS n 1 281 ARG n 1 282 ASP n 1 283 SER n 1 284 LEU n 1 285 MET n 1 286 VAL n 1 287 LEU n 1 288 SER n 1 289 ASP n 1 290 LYS n 1 291 ASN n 1 292 GLY n 1 293 ASN n 1 294 PRO n 1 295 LEU n 1 296 ASN n 1 297 SER n 1 298 VAL n 1 299 PHE n 1 300 VAL n 1 301 ALA n 1 302 PRO n 1 303 ALA n 1 304 VAL n 1 305 THR n 1 306 PRO n 1 307 VAL n 1 308 LYS n 1 309 GLY n 1 310 VAL n 1 311 LEU n 1 312 GLN n 1 313 LYS n 1 314 GLU n 1 315 THR n 1 316 ASN n 1 317 ASN n 1 318 PRO n 1 319 GLY n 1 320 VAL n 1 321 ARG n 1 322 LEU n 1 323 PHE n 1 324 GLN n 1 325 TYR n 1 326 LYS n 1 327 PRO n 1 328 GLY n 1 329 ASP n 1 330 TYR n 1 331 THR n 1 332 LEU n 1 333 LEU n 1 334 ASP n 1 335 MET n 1 336 VAL n 1 337 GLN n 1 338 TYR n 1 339 TYR n 1 340 LEU n 1 341 ASN n 1 342 LEU n 1 343 THR n 1 344 GLU n 1 345 ALA n 1 346 ASN n 1 347 LEU n 1 348 LYS n 1 349 GLY n 1 350 GLU n 1 351 SER n 1 352 ASN n 1 353 TRP n 1 354 THR n 1 355 LEU n 1 356 GLU n 1 357 TYR n 1 358 VAL n 1 359 LEU n 1 360 THR n 1 361 GLN n 1 362 ALA n 1 363 TYR n 1 364 SER n 1 365 VAL n 1 366 ALA n 1 367 ASP n 1 368 LEU n 1 369 GLN n 1 370 PRO n 1 371 LYS n 1 372 SER n 1 373 LEU n 1 374 TYR n 1 375 ALA n 1 376 LEU n 1 377 VAL n 1 378 GLN n 1 379 GLN n 1 380 PHE n 1 381 ALA n 1 382 THR n 1 383 LYS n 1 384 ASP n 1 385 SER n 1 386 LYS n 1 387 GLN n 1 388 PHE n 1 389 LEU n 1 390 LYS n 1 391 TYR n 1 392 TYR n 1 393 HIS n 1 394 TYR n 1 395 TYR n 1 396 PHE n 1 397 VAL n 1 398 SER n 1 399 TYR n 1 400 ASP n 1 401 SER n 1 402 SER n 1 403 ALA n 1 404 THR n 1 405 CYS n 1 406 ASP n 1 407 GLN n 1 408 HIS n 1 409 CYS n 1 410 LYS n 1 411 THR n 1 412 LEU n 1 413 GLN n 1 414 VAL n 1 415 CYS n 1 416 ALA n 1 417 ILE n 1 418 MET n 1 419 ASN n 1 420 LEU n 1 421 ASP n 1 422 SER n 1 423 MET n 1 424 SER n 1 425 TYR n 1 426 ASP n 1 427 ASP n 1 428 CYS n 1 429 LEU n 1 430 LYS n 1 431 GLN n 1 432 HIS n 1 433 LEU 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 'Smpdl3a, Asml3a' _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 'fall armyworm' _entity_src_gen.pdbx_host_org_scientific_name 'Spodoptera frugiperda' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 7108 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type baculovirus _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.db_code ASM3A_MOUSE _struct_ref.db_name UNP _struct_ref.details ? _struct_ref.entity_id 1 _struct_ref.id 1 _struct_ref.seq_align ? _struct_ref.seq_dif ? _struct_ref.pdbx_db_accession P70158 _struct_ref.pdbx_db_isoform ? _struct_ref.pdbx_seq_one_letter_code ;VPLAPADRAPAVGQFWHVTDLHLDPTYHITDDRTKVCASSKGANASNPGPFGDVLCDSPYQLILSAFDFIKNSGQEASFM IWTGDSPPHVPVPELSTGTVIKVITNMTMTVQNLFPNLQVFPALGNHDYWPQDQLPIVTSKVYSAVADLWKPWLGEEAIS TLKKGGFYSQKVASNPGLRIISLNTNLYYGPNIMTLNKTDPANQFEWLENTLNSSLWNKEKVYIIAHVPVGYLPYATDTP AIRQYYNEKLLDIFRRYSSVIAGQFYGHTHRDSLMVLSDKNGNPLNSVFVAPAVTPVKGVLQKETNNPGVRLFQYKPGDY TLLDMVQYYLNLTEANLKGESNWTLEYVLTQAYSVADLQPKSLYALVQQFATKDSKQFLKYYHYYFVSYDSSATCDQHCK TLQVCAIMNLDSMSYDDCLKQHL ; _struct_ref.pdbx_align_begin 23 _struct_ref.pdbx_align_end ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 5FC6 _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 11 _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 P70158 _struct_ref_seq.db_align_beg 23 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 445 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 23 _struct_ref_seq.pdbx_auth_seq_align_end 445 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 5FC6 ASP A 1 ? UNP P70158 ? ? 'expression tag' 13 1 1 5FC6 ARG A 2 ? UNP P70158 ? ? 'expression tag' 14 2 1 5FC6 HIS A 3 ? UNP P70158 ? ? 'expression tag' 15 3 1 5FC6 HIS A 4 ? UNP P70158 ? ? 'expression tag' 16 4 1 5FC6 HIS A 5 ? UNP P70158 ? ? 'expression tag' 17 5 1 5FC6 HIS A 6 ? UNP P70158 ? ? 'expression tag' 18 6 1 5FC6 HIS A 7 ? UNP P70158 ? ? 'expression tag' 19 7 1 5FC6 HIS A 8 ? UNP P70158 ? ? 'expression tag' 20 8 1 5FC6 LYS A 9 ? UNP P70158 ? ? 'expression tag' 21 9 1 5FC6 LEU A 10 ? UNP P70158 ? ? 'expression tag' 22 10 # 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 AP2 non-polymer . 'PHOSPHOMETHYLPHOSPHONIC ACID ADENOSYL ESTER' ? 'C11 H17 N5 O9 P2' 425.228 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 BMA D-saccharide . BETA-D-MANNOSE ? 'C6 H12 O6' 180.156 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 FUC saccharide . ALPHA-L-FUCOSE ? 'C6 H12 O5' 164.156 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 GOL non-polymer . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3' 92.094 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 MAN D-saccharide . ALPHA-D-MANNOSE ? 'C6 H12 O6' 180.156 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 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 ZN non-polymer . 'ZINC ION' ? 'Zn 2' 65.409 # _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 5FC6 _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 3.39 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 63.76 _exptl_crystal.description ? _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 ? _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 'citrate, PEG' _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 CCD _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'RAYONIX MX-300' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2015-01-21 # _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 0.97949 _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 SYNCHROTRON _diffrn_source.target ? _diffrn_source.type 'CLSI BEAMLINE 08ID-1' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 0.97949 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline 08ID-1 _diffrn_source.pdbx_synchrotron_site CLSI # _reflns.B_iso_Wilson_estimate ? _reflns.entry_id 5FC6 _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 1.658 _reflns.d_resolution_low 45.4 _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 78590 _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 99.6 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 7.2 _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 15.8 _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.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 5FC6 _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.ls_number_reflns_obs 78504 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.33 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 45.399 _refine.ls_d_res_high 1.658 _refine.ls_percent_reflns_obs 99.25 _refine.ls_R_factor_obs 0.1625 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.1611 _refine.ls_R_factor_R_free 0.1907 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.01 _refine.ls_number_reflns_R_free 3932 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean ? _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol ? _refine.solvent_model_param_bsol ? _refine.pdbx_solvent_vdw_probe_radii 1.11 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.90 _refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.23 _refine.pdbx_overall_phase_error 19.97 _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 3389 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 218 _refine_hist.number_atoms_solvent 520 _refine_hist.number_atoms_total 4127 _refine_hist.d_res_high 1.658 _refine_hist.d_res_low 45.399 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function f_bond_d 0.011 ? ? 3817 'X-RAY DIFFRACTION' ? f_angle_d 1.083 ? ? 5262 'X-RAY DIFFRACTION' ? f_dihedral_angle_d 10.753 ? ? 2284 'X-RAY DIFFRACTION' ? f_chiral_restr 0.063 ? ? 617 'X-RAY DIFFRACTION' ? f_plane_restr 0.008 ? ? 645 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all 'X-RAY DIFFRACTION' . 1.6578 1.6781 2231 0.3787 85.00 0.4401 . . 120 . . 'X-RAY DIFFRACTION' . 1.6781 1.6993 2606 0.3548 98.00 0.3777 . . 137 . . 'X-RAY DIFFRACTION' . 1.6993 1.7217 2629 0.3334 99.00 0.3829 . . 139 . . 'X-RAY DIFFRACTION' . 1.7217 1.7452 2667 0.3159 100.00 0.3519 . . 143 . . 'X-RAY DIFFRACTION' . 1.7452 1.7702 2612 0.2910 100.00 0.3262 . . 136 . . 'X-RAY DIFFRACTION' . 1.7702 1.7966 2646 0.2654 99.00 0.2759 . . 142 . . 'X-RAY DIFFRACTION' . 1.7966 1.8247 2664 0.2467 100.00 0.2625 . . 139 . . 'X-RAY DIFFRACTION' . 1.8247 1.8546 2659 0.2392 100.00 0.2602 . . 143 . . 'X-RAY DIFFRACTION' . 1.8546 1.8866 2642 0.2240 100.00 0.2488 . . 138 . . 'X-RAY DIFFRACTION' . 1.8866 1.9209 2671 0.2147 100.00 0.2565 . . 140 . . 'X-RAY DIFFRACTION' . 1.9209 1.9578 2659 0.2095 100.00 0.2620 . . 140 . . 'X-RAY DIFFRACTION' . 1.9578 1.9978 2656 0.2051 100.00 0.2443 . . 138 . . 'X-RAY DIFFRACTION' . 1.9978 2.0412 2652 0.2022 100.00 0.2228 . . 139 . . 'X-RAY DIFFRACTION' . 2.0412 2.0887 2677 0.1763 100.00 0.1960 . . 141 . . 'X-RAY DIFFRACTION' . 2.0887 2.1409 2675 0.1697 100.00 0.2274 . . 144 . . 'X-RAY DIFFRACTION' . 2.1409 2.1988 2658 0.1641 100.00 0.2110 . . 140 . . 'X-RAY DIFFRACTION' . 2.1988 2.2635 2676 0.1536 100.00 0.1988 . . 139 . . 'X-RAY DIFFRACTION' . 2.2635 2.3366 2698 0.1471 100.00 0.1479 . . 142 . . 'X-RAY DIFFRACTION' . 2.3366 2.4201 2666 0.1423 100.00 0.1449 . . 142 . . 'X-RAY DIFFRACTION' . 2.4201 2.5170 2706 0.1407 100.00 0.1831 . . 140 . . 'X-RAY DIFFRACTION' . 2.5170 2.6315 2660 0.1440 100.00 0.1806 . . 142 . . 'X-RAY DIFFRACTION' . 2.6315 2.7703 2713 0.1373 100.00 0.1635 . . 143 . . 'X-RAY DIFFRACTION' . 2.7703 2.9438 2685 0.1471 100.00 0.1825 . . 142 . . 'X-RAY DIFFRACTION' . 2.9438 3.1710 2702 0.1441 100.00 0.1624 . . 141 . . 'X-RAY DIFFRACTION' . 3.1710 3.4900 2732 0.1389 100.00 0.1761 . . 143 . . 'X-RAY DIFFRACTION' . 3.4900 3.9948 2715 0.1296 100.00 0.1668 . . 143 . . 'X-RAY DIFFRACTION' . 3.9948 5.0320 2755 0.1096 100.00 0.1277 . . 146 . . 'X-RAY DIFFRACTION' . 5.0320 45.4158 2860 0.1556 100.00 0.1882 . . 150 . . # _struct.entry_id 5FC6 _struct.title 'Murine SMPDL3A in complex with ADP analog AMPCP' _struct.pdbx_descriptor 'Acid sphingomyelinase-like phosphodiesterase 3a (E.C.3.1.4.-)' _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 5FC6 _struct_keywords.text 'SMPDL3A, sphingomyelin, nucleotide, HYDROLASE' _struct_keywords.pdbx_keywords HYDROLASE # 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 3 ? E N N 4 ? F N N 3 ? G N N 3 ? H N N 3 ? I N N 5 ? J N N 6 ? K N N 6 ? L N N 3 ? M N N 3 ? N N N 4 ? O N N 3 ? P N N 3 ? Q N N 7 ? R N N 7 ? S N N 7 ? T N N 7 ? U N N 8 ? V N N 9 ? # 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 CYS A 47 ? LYS A 51 ? CYS A 59 LYS A 63 5 ? 5 HELX_P HELX_P2 AA2 PRO A 69 ? ASN A 82 ? PRO A 81 ASN A 94 1 ? 14 HELX_P HELX_P3 AA3 PRO A 101 ? LEU A 105 ? PRO A 113 LEU A 117 5 ? 5 HELX_P HELX_P4 AA4 SER A 106 ? PHE A 125 ? SER A 118 PHE A 137 1 ? 20 HELX_P HELX_P5 AA5 SER A 150 ? TRP A 160 ? SER A 162 TRP A 172 1 ? 11 HELX_P HELX_P6 AA6 GLY A 165 ? GLY A 176 ? GLY A 177 GLY A 188 1 ? 12 HELX_P HELX_P7 AA7 ASN A 194 ? TYR A 199 ? ASN A 206 TYR A 211 5 ? 6 HELX_P HELX_P8 AA8 ASN A 202 ? LEU A 206 ? ASN A 214 LEU A 218 5 ? 5 HELX_P HELX_P9 AA9 ASP A 210 ? ALA A 212 ? ASP A 222 ALA A 224 5 ? 3 HELX_P HELX_P10 AB1 ASN A 213 ? ASN A 228 ? ASN A 225 ASN A 240 1 ? 16 HELX_P HELX_P11 AB2 ARG A 253 ? TYR A 267 ? ARG A 265 TYR A 279 1 ? 15 HELX_P HELX_P12 AB3 ASN A 341 ? GLY A 349 ? ASN A 353 GLY A 361 1 ? 9 HELX_P HELX_P13 AB4 LEU A 359 ? SER A 364 ? LEU A 371 SER A 376 1 ? 6 HELX_P HELX_P14 AB5 GLN A 369 ? ALA A 381 ? GLN A 381 ALA A 393 1 ? 13 HELX_P HELX_P15 AB6 SER A 385 ? PHE A 396 ? SER A 397 PHE A 408 1 ? 12 HELX_P HELX_P16 AB7 ASP A 406 ? ASN A 419 ? ASP A 418 ASN A 431 1 ? 14 HELX_P HELX_P17 AB8 ASP A 421 ? LEU A 433 ? ASP A 433 LEU A 445 1 ? 13 # _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 47 SG ? ? ? 1_555 A CYS 66 SG ? ? A CYS 59 A CYS 78 1_555 ? ? ? ? ? ? ? 2.045 ? disulf2 disulf ? ? A CYS 405 SG ? ? ? 1_555 A CYS 409 SG A ? A CYS 417 A CYS 421 1_555 ? ? ? ? ? ? ? 2.072 ? disulf3 disulf ? ? A CYS 415 SG A ? ? 1_555 A CYS 428 SG ? ? A CYS 427 A CYS 440 1_555 ? ? ? ? ? ? ? 2.085 ? metalc1 metalc ? ? A ASP 30 OD2 ? ? ? 1_555 B ZN . ZN ? ? A ASP 42 A ZN 501 1_555 ? ? ? ? ? ? ? 2.002 ? metalc2 metalc ? ? A HIS 32 NE2 ? ? ? 1_555 B ZN . ZN ? ? A HIS 44 A ZN 501 1_555 ? ? ? ? ? ? ? 2.125 ? covale1 covale one ? A ASN 54 ND2 ? ? ? 1_555 D NAG . C1 ? ? A ASN 66 A NAG 503 1_555 ? ? ? ? ? ? ? 1.443 ? metalc3 metalc ? ? A ASP 95 OD2 ? ? ? 1_555 C ZN . ZN ? ? A ASP 107 A ZN 502 1_555 ? ? ? ? ? ? ? 2.376 ? metalc4 metalc ? ? A ASP 95 OD2 ? ? ? 1_555 B ZN . ZN ? ? A ASP 107 A ZN 501 1_555 ? ? ? ? ? ? ? 2.432 ? covale2 covale one ? A ASN 116 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 128 A NAG 506 1_555 ? ? ? ? ? ? ? 1.453 ? metalc5 metalc ? ? A ASN 136 OD1 ? ? ? 1_555 C ZN . ZN ? ? A ASN 148 A ZN 502 1_555 ? ? ? ? ? ? ? 2.043 ? covale3 covale one ? A ASN 223 ND2 ? ? ? 1_555 O NAG . C1 ? ? A ASN 235 A NAG 514 1_555 ? ? ? ? ? ? ? 1.440 ? metalc6 metalc ? ? A HIS 237 NE2 ? ? ? 1_555 C ZN . ZN ? ? A HIS 249 A ZN 502 1_555 ? ? ? ? ? ? ? 2.055 ? metalc7 metalc ? ? A HIS 278 ND1 ? ? ? 1_555 C ZN . ZN ? ? A HIS 290 A ZN 502 1_555 ? ? ? ? ? ? ? 2.203 ? metalc8 metalc ? ? A HIS 280 NE2 ? ? ? 1_555 B ZN . ZN ? ? A HIS 292 A ZN 501 1_555 ? ? ? ? ? ? ? 2.181 ? covale4 covale one ? A ASN 341 ND2 ? ? ? 1_555 L NAG . C1 ? ? A ASN 353 A NAG 511 1_555 ? ? ? ? ? ? ? 1.417 ? metalc9 metalc ? ? B ZN . ZN ? ? ? 1_555 U AP2 . O1B ? ? A ZN 501 A AP2 520 1_555 ? ? ? ? ? ? ? 2.609 ? metalc10 metalc ? ? B ZN . ZN ? ? ? 1_555 U AP2 . O3B ? ? A ZN 501 A AP2 520 1_555 ? ? ? ? ? ? ? 2.111 ? metalc11 metalc ? ? C ZN . ZN ? ? ? 1_555 U AP2 . O2B ? ? A ZN 502 A AP2 520 1_555 ? ? ? ? ? ? ? 2.181 ? metalc12 metalc ? ? C ZN . ZN ? ? ? 1_555 U AP2 . O3B ? ? A ZN 502 A AP2 520 1_555 ? ? ? ? ? ? ? 2.311 ? covale5 covale both ? D NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? A NAG 503 A NAG 505 1_555 ? ? ? ? ? ? ? 1.460 ? covale6 covale one ? D NAG . O6 ? ? ? 1_555 E FUC . C1 ? ? A NAG 503 A FUC 504 1_555 ? ? ? ? ? ? ? 1.423 ? covale7 covale both ? G NAG . O4 ? ? ? 1_555 H NAG . C1 ? ? A NAG 506 A NAG 507 1_555 ? ? ? ? ? ? ? 1.467 ? covale8 covale both ? I BMA . C1 ? ? ? 1_555 M NAG . O4 ? ? A BMA 508 A NAG 512 1_555 ? ? ? ? ? ? ? 1.441 ? covale9 covale one ? I BMA . O3 ? ? ? 1_555 J MAN . C1 ? ? A BMA 508 A MAN 509 1_555 ? ? ? ? ? ? ? 1.454 ? covale10 covale one ? I BMA . O6 ? ? ? 1_555 K MAN . C1 ? ? A BMA 508 A MAN 510 1_555 ? ? ? ? ? ? ? 1.469 ? covale11 covale both ? L NAG . O4 ? ? ? 1_555 M NAG . C1 ? ? A NAG 511 A NAG 512 1_555 ? ? ? ? ? ? ? 1.431 ? covale12 covale one ? N FUC . C1 ? ? ? 1_555 O NAG . O6 ? ? A FUC 513 A NAG 514 1_555 ? ? ? ? ? ? ? 1.440 ? covale13 covale both ? O NAG . O4 ? ? ? 1_555 P NAG . C1 ? ? A NAG 514 A NAG 515 1_555 ? ? ? ? ? ? ? 1.445 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? metalc ? ? covale ? ? # _struct_mon_prot_cis.pdbx_id 1 _struct_mon_prot_cis.label_comp_id TRP _struct_mon_prot_cis.label_seq_id 140 _struct_mon_prot_cis.label_asym_id A _struct_mon_prot_cis.label_alt_id . _struct_mon_prot_cis.pdbx_PDB_ins_code ? _struct_mon_prot_cis.auth_comp_id TRP _struct_mon_prot_cis.auth_seq_id 152 _struct_mon_prot_cis.auth_asym_id A _struct_mon_prot_cis.pdbx_label_comp_id_2 PRO _struct_mon_prot_cis.pdbx_label_seq_id_2 141 _struct_mon_prot_cis.pdbx_label_asym_id_2 A _struct_mon_prot_cis.pdbx_PDB_ins_code_2 ? _struct_mon_prot_cis.pdbx_auth_comp_id_2 PRO _struct_mon_prot_cis.pdbx_auth_seq_id_2 153 _struct_mon_prot_cis.pdbx_auth_asym_id_2 A _struct_mon_prot_cis.pdbx_PDB_model_num 1 _struct_mon_prot_cis.pdbx_omega_angle -8.18 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 6 ? AA2 ? 6 ? # 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 ? parallel AA1 2 3 ? parallel AA1 3 4 ? anti-parallel AA1 4 5 ? anti-parallel AA1 5 6 ? anti-parallel AA2 1 2 ? anti-parallel AA2 2 3 ? parallel AA2 3 4 ? parallel AA2 4 5 ? parallel AA2 5 6 ? 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 GLN A 129 ? PRO A 132 ? GLN A 141 PRO A 144 AA1 2 PHE A 89 ? TRP A 92 ? PHE A 101 TRP A 104 AA1 3 GLY A 23 ? VAL A 28 ? GLY A 35 VAL A 40 AA1 4 GLY A 319 ? TYR A 325 ? GLY A 331 TYR A 337 AA1 5 LEU A 332 ? TYR A 339 ? LEU A 344 TYR A 351 AA1 6 THR A 354 ? VAL A 358 ? THR A 366 VAL A 370 AA2 1 TYR A 178 ? LYS A 181 ? TYR A 190 LYS A 193 AA2 2 LEU A 188 ? SER A 192 ? LEU A 200 SER A 204 AA2 3 LYS A 231 ? ALA A 236 ? LYS A 243 ALA A 248 AA2 4 ILE A 271 ? TYR A 276 ? ILE A 283 TYR A 288 AA2 5 PRO A 294 ? VAL A 300 ? PRO A 306 VAL A 312 AA2 6 SER A 283 ? SER A 288 ? SER A 295 SER A 300 # 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 O PHE A 131 ? O PHE A 143 N MET A 90 ? N MET A 102 AA1 2 3 O ILE A 91 ? O ILE A 103 N TRP A 26 ? N TRP A 38 AA1 3 4 N PHE A 25 ? N PHE A 37 O PHE A 323 ? O PHE A 335 AA1 4 5 N LEU A 322 ? N LEU A 334 O VAL A 336 ? O VAL A 348 AA1 5 6 N GLN A 337 ? N GLN A 349 O GLU A 356 ? O GLU A 368 AA2 1 2 N TYR A 178 ? N TYR A 190 O SER A 192 ? O SER A 204 AA2 2 3 N ILE A 191 ? N ILE A 203 O ILE A 235 ? O ILE A 247 AA2 3 4 N VAL A 232 ? N VAL A 244 O ALA A 272 ? O ALA A 284 AA2 4 5 N GLN A 274 ? N GLN A 286 O PHE A 299 ? O PHE A 311 AA2 5 6 O LEU A 295 ? O LEU A 307 N LEU A 287 ? N LEU A 299 # 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 ZN 501 ? 6 'binding site for residue ZN A 501' AC2 Software A ZN 502 ? 6 'binding site for residue ZN A 502' AC3 Software A GOL 516 ? 7 'binding site for residue GOL A 516' AC4 Software A GOL 517 ? 5 'binding site for residue GOL A 517' AC5 Software A GOL 518 ? 5 'binding site for residue GOL A 518' AC6 Software A GOL 519 ? 1 'binding site for residue GOL A 519' AC7 Software A AP2 520 ? 22 'binding site for residue AP2 A 520' AC8 Software A ASN 66 ? 2 'binding site for Poly-Saccharide residues NAG A 503 through NAG A 505 bound to ASN A 66' AC9 Software A ASN 128 ? 3 'binding site for Poly-Saccharide residues NAG A 506 through NAG A 507 bound to ASN A 128' AD1 Software A ASN 235 ? 2 'binding site for Poly-Saccharide residues FUC A 513 through NAG A 515 bound to ASN A 235' AD2 Software A ASN 353 ? 16 'binding site for Poly-Saccharide residues BMA A 508 through NAG A 512 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 6 ASP A 30 ? ASP A 42 . ? 1_555 ? 2 AC1 6 HIS A 32 ? HIS A 44 . ? 1_555 ? 3 AC1 6 ASP A 95 ? ASP A 107 . ? 1_555 ? 4 AC1 6 HIS A 280 ? HIS A 292 . ? 1_555 ? 5 AC1 6 ZN C . ? ZN A 502 . ? 1_555 ? 6 AC1 6 AP2 U . ? AP2 A 520 . ? 1_555 ? 7 AC2 6 ASP A 95 ? ASP A 107 . ? 1_555 ? 8 AC2 6 ASN A 136 ? ASN A 148 . ? 1_555 ? 9 AC2 6 HIS A 237 ? HIS A 249 . ? 1_555 ? 10 AC2 6 HIS A 278 ? HIS A 290 . ? 1_555 ? 11 AC2 6 ZN B . ? ZN A 501 . ? 1_555 ? 12 AC2 6 AP2 U . ? AP2 A 520 . ? 1_555 ? 13 AC3 7 SER A 49 ? SER A 61 . ? 1_555 ? 14 AC3 7 LYS A 51 ? LYS A 63 . ? 1_555 ? 15 AC3 7 VAL A 307 ? VAL A 319 . ? 1_555 ? 16 AC3 7 AP2 U . ? AP2 A 520 . ? 1_555 ? 17 AC3 7 HOH V . ? HOH A 622 . ? 1_555 ? 18 AC3 7 HOH V . ? HOH A 674 . ? 1_555 ? 19 AC3 7 HOH V . ? HOH A 755 . ? 1_555 ? 20 AC4 5 TRP A 26 ? TRP A 38 . ? 1_555 ? 21 AC4 5 ILE A 80 ? ILE A 92 . ? 1_555 ? 22 AC4 5 LYS A 81 ? LYS A 93 . ? 1_555 ? 23 AC4 5 GLN A 85 ? GLN A 97 . ? 1_555 ? 24 AC4 5 ALA A 87 ? ALA A 99 . ? 1_555 ? 25 AC5 5 ASN A 207 ? ASN A 219 . ? 1_555 ? 26 AC5 5 LYS A 208 ? LYS A 220 . ? 1_555 ? 27 AC5 5 TYR A 255 ? TYR A 267 . ? 1_555 ? 28 AC5 5 TYR A 256 ? TYR A 268 . ? 1_555 ? 29 AC5 5 HOH V . ? HOH A 719 . ? 1_555 ? 30 AC6 1 GLN A 85 ? GLN A 97 . ? 1_555 ? 31 AC7 22 ASP A 30 ? ASP A 42 . ? 1_555 ? 32 AC7 22 HIS A 32 ? HIS A 44 . ? 1_555 ? 33 AC7 22 ASP A 95 ? ASP A 107 . ? 1_555 ? 34 AC7 22 HIS A 99 ? HIS A 111 . ? 1_555 ? 35 AC7 22 ASN A 136 ? ASN A 148 . ? 1_555 ? 36 AC7 22 HIS A 137 ? HIS A 149 . ? 1_555 ? 37 AC7 22 TYR A 199 ? TYR A 211 . ? 1_555 ? 38 AC7 22 HIS A 237 ? HIS A 249 . ? 1_555 ? 39 AC7 22 TYR A 245 ? TYR A 257 . ? 1_555 ? 40 AC7 22 HIS A 278 ? HIS A 290 . ? 1_555 ? 41 AC7 22 HIS A 280 ? HIS A 292 . ? 1_555 ? 42 AC7 22 ARG A 281 ? ARG A 293 . ? 1_555 ? 43 AC7 22 ZN B . ? ZN A 501 . ? 1_555 ? 44 AC7 22 ZN C . ? ZN A 502 . ? 1_555 ? 45 AC7 22 GOL Q . ? GOL A 516 . ? 1_555 ? 46 AC7 22 HOH V . ? HOH A 633 . ? 1_555 ? 47 AC7 22 HOH V . ? HOH A 711 . ? 1_555 ? 48 AC7 22 HOH V . ? HOH A 714 . ? 1_555 ? 49 AC7 22 HOH V . ? HOH A 735 . ? 1_555 ? 50 AC7 22 HOH V . ? HOH A 746 . ? 1_555 ? 51 AC7 22 HOH V . ? HOH A 768 . ? 1_555 ? 52 AC7 22 HOH V . ? HOH A 789 . ? 1_555 ? 53 AC8 2 ASN A 54 ? ASN A 66 . ? 1_555 ? 54 AC8 2 HOH V . ? HOH A 722 . ? 1_555 ? 55 AC9 3 TYR A 70 ? TYR A 82 . ? 1_555 ? 56 AC9 3 ASN A 116 ? ASN A 128 . ? 1_555 ? 57 AC9 3 HOH V . ? HOH A 615 . ? 1_555 ? 58 AD1 2 ASN A 223 ? ASN A 235 . ? 1_555 ? 59 AD1 2 TRP A 227 ? TRP A 239 . ? 1_555 ? 60 AD2 16 MET A 119 ? MET A 131 . ? 6_554 ? 61 AD2 16 ASN A 123 ? ASN A 135 . ? 6_554 ? 62 AD2 16 ASN A 127 ? ASN A 139 . ? 6_554 ? 63 AD2 16 TYR A 339 ? TYR A 351 . ? 1_555 ? 64 AD2 16 ASN A 341 ? ASN A 353 . ? 1_555 ? 65 AD2 16 THR A 343 ? THR A 355 . ? 1_555 ? 66 AD2 16 SER A 398 ? SER A 410 . ? 1_555 ? 67 AD2 16 HOH V . ? HOH A 629 . ? 1_555 ? 68 AD2 16 HOH V . ? HOH A 796 . ? 1_555 ? 69 AD2 16 HOH V . ? HOH A 808 . ? 1_555 ? 70 AD2 16 HOH V . ? HOH A 827 . ? 1_555 ? 71 AD2 16 HOH V . ? HOH A 835 . ? 1_555 ? 72 AD2 16 HOH V . ? HOH A 878 . ? 1_555 ? 73 AD2 16 HOH V . ? HOH A 879 . ? 1_555 ? 74 AD2 16 HOH V . ? HOH A 909 . ? 6_554 ? 75 AD2 16 HOH V . ? HOH A 913 . ? 1_555 ? # _atom_sites.entry_id 5FC6 _atom_sites.fract_transf_matrix[1][1] 0.008042 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.007525 _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] 0.012419 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C H N O P S ZN # 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 . HIS A 1 8 ? 55.119 49.058 65.272 1.00 87.32 ? 20 HIS A N 1 ATOM 2 C CA . HIS A 1 8 ? 54.857 47.891 66.111 1.00 76.83 ? 20 HIS A CA 1 ATOM 3 C C . HIS A 1 8 ? 53.420 47.874 66.638 1.00 70.69 ? 20 HIS A C 1 ATOM 4 O O . HIS A 1 8 ? 53.190 47.475 67.779 1.00 68.63 ? 20 HIS A O 1 ATOM 5 C CB . HIS A 1 8 ? 55.845 47.846 67.290 1.00 68.46 ? 20 HIS A CB 1 ATOM 6 C CG . HIS A 1 8 ? 55.970 49.143 68.034 1.00 105.29 ? 20 HIS A CG 1 ATOM 7 N ND1 . HIS A 1 8 ? 56.720 50.200 67.563 1.00 128.12 ? 20 HIS A ND1 1 ATOM 8 C CD2 . HIS A 1 8 ? 55.455 49.547 69.220 1.00 93.37 ? 20 HIS A CD2 1 ATOM 9 C CE1 . HIS A 1 8 ? 56.655 51.202 68.422 1.00 119.60 ? 20 HIS A CE1 1 ATOM 10 N NE2 . HIS A 1 8 ? 55.894 50.832 69.436 1.00 116.08 ? 20 HIS A NE2 1 ATOM 11 H HA . HIS A 1 8 ? 54.989 47.089 65.582 1.00 92.20 ? 20 HIS A HA 1 ATOM 12 H HB2 . HIS A 1 8 ? 55.547 47.172 67.920 1.00 82.16 ? 20 HIS A HB2 1 ATOM 13 H HB3 . HIS A 1 8 ? 56.723 47.613 66.951 1.00 82.16 ? 20 HIS A HB3 1 ATOM 14 H HD2 . HIS A 1 8 ? 54.904 49.050 69.781 1.00 112.04 ? 20 HIS A HD2 1 ATOM 15 H HE1 . HIS A 1 8 ? 57.074 52.027 68.328 1.00 143.52 ? 20 HIS A HE1 1 ATOM 16 H HE2 . HIS A 1 8 ? 55.703 51.317 70.121 1.00 139.30 ? 20 HIS A HE2 1 ATOM 17 N N . LYS A 1 9 ? 52.446 48.277 65.798 1.00 70.93 ? 21 LYS A N 1 ATOM 18 C CA . LYS A 1 9 ? 51.083 48.451 66.289 1.00 73.92 ? 21 LYS A CA 1 ATOM 19 C C . LYS A 1 9 ? 49.993 48.070 65.282 1.00 60.63 ? 21 LYS A C 1 ATOM 20 O O . LYS A 1 9 ? 48.859 48.539 65.422 1.00 55.07 ? 21 LYS A O 1 ATOM 21 C CB . LYS A 1 9 ? 50.867 49.902 66.751 1.00 68.89 ? 21 LYS A CB 1 ATOM 22 C CG . LYS A 1 9 ? 51.188 50.963 65.718 1.00 60.18 ? 21 LYS A CG 1 ATOM 23 C CD . LYS A 1 9 ? 50.844 52.339 66.282 1.00 78.15 ? 21 LYS A CD 1 ATOM 24 C CE . LYS A 1 9 ? 51.146 53.456 65.303 1.00 76.67 ? 21 LYS A CE 1 ATOM 25 N NZ . LYS A 1 9 ? 50.728 54.773 65.857 1.00 86.59 ? 21 LYS A NZ 1 ATOM 26 H H . LYS A 1 9 ? 52.554 48.451 64.963 1.00 85.11 ? 21 LYS A H 1 ATOM 27 H HA . LYS A 1 9 ? 50.967 47.881 67.065 1.00 88.70 ? 21 LYS A HA 1 ATOM 28 H HB2 . LYS A 1 9 ? 49.936 50.010 67.000 1.00 82.67 ? 21 LYS A HB2 1 ATOM 29 H HB3 . LYS A 1 9 ? 51.431 50.066 67.523 1.00 82.67 ? 21 LYS A HB3 1 ATOM 30 H HG2 . LYS A 1 9 ? 52.136 50.940 65.510 1.00 72.21 ? 21 LYS A HG2 1 ATOM 31 H HG3 . LYS A 1 9 ? 50.658 50.813 64.920 1.00 72.21 ? 21 LYS A HG3 1 ATOM 32 H HD2 . LYS A 1 9 ? 49.897 52.369 66.490 1.00 93.78 ? 21 LYS A HD2 1 ATOM 33 H HD3 . LYS A 1 9 ? 51.367 52.493 67.085 1.00 93.78 ? 21 LYS A HD3 1 ATOM 34 H HE2 . LYS A 1 9 ? 52.101 53.485 65.132 1.00 92.00 ? 21 LYS A HE2 1 ATOM 35 H HE3 . LYS A 1 9 ? 50.659 53.302 64.479 1.00 92.00 ? 21 LYS A HE3 1 ATOM 36 H HZ1 . LYS A 1 9 ? 50.910 55.420 65.274 1.00 103.91 ? 21 LYS A HZ1 1 ATOM 37 H HZ2 . LYS A 1 9 ? 49.853 54.769 66.021 1.00 103.91 ? 21 LYS A HZ2 1 ATOM 38 H HZ3 . LYS A 1 9 ? 51.164 54.936 66.616 1.00 103.91 ? 21 LYS A HZ3 1 ATOM 39 N N . LEU A 1 10 ? 50.291 47.237 64.282 1.00 51.54 ? 22 LEU A N 1 ATOM 40 C CA . LEU A 1 10 ? 49.272 46.489 63.530 1.00 62.56 ? 22 LEU A CA 1 ATOM 41 C C . LEU A 1 10 ? 48.173 47.388 62.941 1.00 46.74 ? 22 LEU A C 1 ATOM 42 O O . LEU A 1 10 ? 46.973 47.156 63.125 1.00 39.82 ? 22 LEU A O 1 ATOM 43 C CB . LEU A 1 10 ? 48.648 45.404 64.421 1.00 55.27 ? 22 LEU A CB 1 ATOM 44 C CG . LEU A 1 10 ? 49.566 44.273 64.893 1.00 48.21 ? 22 LEU A CG 1 ATOM 45 C CD1 . LEU A 1 10 ? 48.838 43.409 65.909 1.00 52.78 ? 22 LEU A CD1 1 ATOM 46 C CD2 . LEU A 1 10 ? 50.036 43.441 63.726 1.00 38.42 ? 22 LEU A CD2 1 ATOM 47 H H . LEU A 1 10 ? 51.093 47.084 64.014 1.00 61.84 ? 22 LEU A H 1 ATOM 48 H HA . LEU A 1 10 ? 49.708 46.041 62.788 1.00 75.07 ? 22 LEU A HA 1 ATOM 49 H HB2 . LEU A 1 10 ? 48.294 45.833 65.215 1.00 66.33 ? 22 LEU A HB2 1 ATOM 50 H HB3 . LEU A 1 10 ? 47.920 44.993 63.930 1.00 66.33 ? 22 LEU A HB3 1 ATOM 51 H HG . LEU A 1 10 ? 50.346 44.656 65.325 1.00 57.85 ? 22 LEU A HG 1 ATOM 52 H HD11 . LEU A 1 10 ? 49.429 42.698 66.199 1.00 63.33 ? 22 LEU A HD11 1 ATOM 53 H HD12 . LEU A 1 10 ? 48.584 43.959 66.666 1.00 63.33 ? 22 LEU A HD12 1 ATOM 54 H HD13 . LEU A 1 10 ? 48.046 43.033 65.493 1.00 63.33 ? 22 LEU A HD13 1 ATOM 55 H HD21 . LEU A 1 10 ? 50.614 42.735 64.055 1.00 46.11 ? 22 LEU A HD21 1 ATOM 56 H HD22 . LEU A 1 10 ? 49.264 43.056 63.282 1.00 46.11 ? 22 LEU A HD22 1 ATOM 57 H HD23 . LEU A 1 10 ? 50.524 44.008 63.109 1.00 46.11 ? 22 LEU A HD23 1 ATOM 58 N N . VAL A 1 11 ? 48.596 48.385 62.169 1.00 49.89 ? 23 VAL A N 1 ATOM 59 C CA . VAL A 1 11 ? 47.669 49.262 61.447 1.00 52.01 ? 23 VAL A CA 1 ATOM 60 C C . VAL A 1 11 ? 47.511 48.727 60.027 1.00 48.80 ? 23 VAL A C 1 ATOM 61 O O . VAL A 1 11 ? 48.508 48.300 59.426 1.00 47.30 ? 23 VAL A O 1 ATOM 62 C CB . VAL A 1 11 ? 48.176 50.716 61.438 1.00 54.55 ? 23 VAL A CB 1 ATOM 63 C CG1 . VAL A 1 11 ? 47.292 51.596 60.559 1.00 54.87 ? 23 VAL A CG1 1 ATOM 64 C CG2 . VAL A 1 11 ? 48.239 51.258 62.854 1.00 49.74 ? 23 VAL A CG2 1 ATOM 65 H H . VAL A 1 11 ? 49.424 48.580 62.044 1.00 59.86 ? 23 VAL A H 1 ATOM 66 H HA . VAL A 1 11 ? 46.802 49.241 61.881 1.00 62.42 ? 23 VAL A HA 1 ATOM 67 H HB . VAL A 1 11 ? 49.073 50.734 61.072 1.00 65.46 ? 23 VAL A HB 1 ATOM 68 H HG11 . VAL A 1 11 ? 47.636 52.503 60.574 1.00 65.84 ? 23 VAL A HG11 1 ATOM 69 H HG12 . VAL A 1 11 ? 47.306 51.252 59.652 1.00 65.84 ? 23 VAL A HG12 1 ATOM 70 H HG13 . VAL A 1 11 ? 46.386 51.580 60.906 1.00 65.84 ? 23 VAL A HG13 1 ATOM 71 H HG21 . VAL A 1 11 ? 48.560 52.173 62.827 1.00 59.69 ? 23 VAL A HG21 1 ATOM 72 H HG22 . VAL A 1 11 ? 47.351 51.229 63.242 1.00 59.69 ? 23 VAL A HG22 1 ATOM 73 H HG23 . VAL A 1 11 ? 48.846 50.709 63.374 1.00 59.69 ? 23 VAL A HG23 1 ATOM 74 N N . PRO A 1 12 ? 46.308 48.722 59.447 1.00 44.64 ? 24 PRO A N 1 ATOM 75 C CA . PRO A 1 12 ? 46.166 48.257 58.061 1.00 47.99 ? 24 PRO A CA 1 ATOM 76 C C . PRO A 1 12 ? 47.174 48.939 57.144 1.00 55.95 ? 24 PRO A C 1 ATOM 77 O O . PRO A 1 12 ? 47.497 50.118 57.309 1.00 48.08 ? 24 PRO A O 1 ATOM 78 C CB . PRO A 1 12 ? 44.723 48.631 57.706 1.00 43.86 ? 24 PRO A CB 1 ATOM 79 C CG . PRO A 1 12 ? 44.012 48.615 58.997 1.00 45.83 ? 24 PRO A CG 1 ATOM 80 C CD . PRO A 1 12 ? 45.006 49.068 60.041 1.00 43.36 ? 24 PRO A CD 1 ATOM 81 H HA . PRO A 1 12 ? 46.276 47.295 58.010 1.00 57.59 ? 24 PRO A HA 1 ATOM 82 H HB2 . PRO A 1 12 ? 44.701 49.517 57.311 1.00 52.63 ? 24 PRO A HB2 1 ATOM 83 H HB3 . PRO A 1 12 ? 44.352 47.972 57.099 1.00 52.63 ? 24 PRO A HB3 1 ATOM 84 H HG2 . PRO A 1 12 ? 43.259 49.226 58.958 1.00 55.00 ? 24 PRO A HG2 1 ATOM 85 H HG3 . PRO A 1 12 ? 43.707 47.714 59.187 1.00 55.00 ? 24 PRO A HG3 1 ATOM 86 H HD2 . PRO A 1 12 ? 44.940 50.026 60.178 1.00 52.03 ? 24 PRO A HD2 1 ATOM 87 H HD3 . PRO A 1 12 ? 44.872 48.580 60.869 1.00 52.03 ? 24 PRO A HD3 1 ATOM 88 N N . LEU A 1 13 ? 47.692 48.171 56.189 1.00 60.79 ? 25 LEU A N 1 ATOM 89 C CA . LEU A 1 13 ? 48.739 48.657 55.300 1.00 57.21 ? 25 LEU A CA 1 ATOM 90 C C . LEU A 1 13 ? 48.151 49.613 54.270 1.00 65.54 ? 25 LEU A C 1 ATOM 91 O O . LEU A 1 13 ? 47.214 49.263 53.546 1.00 55.71 ? 25 LEU A O 1 ATOM 92 C CB . LEU A 1 13 ? 49.431 47.477 54.612 1.00 56.47 ? 25 LEU A CB 1 ATOM 93 C CG . LEU A 1 13 ? 50.354 46.632 55.507 1.00 50.00 ? 25 LEU A CG 1 ATOM 94 C CD1 . LEU A 1 13 ? 50.546 45.249 54.938 1.00 43.71 ? 25 LEU A CD1 1 ATOM 95 C CD2 . LEU A 1 13 ? 51.708 47.316 55.673 1.00 60.45 ? 25 LEU A CD2 1 ATOM 96 H H . LEU A 1 13 ? 47.452 47.360 56.035 1.00 72.95 ? 25 LEU A H 1 ATOM 97 H HA . LEU A 1 13 ? 49.402 49.138 55.819 1.00 68.66 ? 25 LEU A HA 1 ATOM 98 H HB2 . LEU A 1 13 ? 48.749 46.885 54.258 1.00 67.76 ? 25 LEU A HB2 1 ATOM 99 H HB3 . LEU A 1 13 ? 49.970 47.821 53.882 1.00 67.76 ? 25 LEU A HB3 1 ATOM 100 H HG . LEU A 1 13 ? 49.952 46.544 56.385 1.00 60.00 ? 25 LEU A HG 1 ATOM 101 H HD11 . LEU A 1 13 ? 51.132 44.745 55.524 1.00 52.45 ? 25 LEU A HD11 1 ATOM 102 H HD12 . LEU A 1 13 ? 49.683 44.811 54.875 1.00 52.45 ? 25 LEU A HD12 1 ATOM 103 H HD13 . LEU A 1 13 ? 50.945 45.323 54.056 1.00 52.45 ? 25 LEU A HD13 1 ATOM 104 H HD21 . LEU A 1 13 ? 52.271 46.766 56.240 1.00 72.54 ? 25 LEU A HD21 1 ATOM 105 H HD22 . LEU A 1 13 ? 52.117 47.420 54.800 1.00 72.54 ? 25 LEU A HD22 1 ATOM 106 H HD23 . LEU A 1 13 ? 51.574 48.185 56.081 1.00 72.54 ? 25 LEU A HD23 1 ATOM 107 N N . ALA A 1 14 ? 48.707 50.818 54.203 1.00 73.54 ? 26 ALA A N 1 ATOM 108 C CA . ALA A 1 14 ? 48.147 51.855 53.341 1.00 86.11 ? 26 ALA A CA 1 ATOM 109 C C . ALA A 1 14 ? 48.405 51.530 51.870 1.00 82.88 ? 26 ALA A C 1 ATOM 110 O O . ALA A 1 14 ? 49.535 51.177 51.507 1.00 74.35 ? 26 ALA A O 1 ATOM 111 C CB . ALA A 1 14 ? 48.748 53.214 53.695 1.00 75.21 ? 26 ALA A CB 1 ATOM 112 H H . ALA A 1 14 ? 49.405 51.060 54.643 1.00 88.24 ? 26 ALA A H 1 ATOM 113 H HA . ALA A 1 14 ? 47.187 51.901 53.478 1.00 103.33 ? 26 ALA A HA 1 ATOM 114 H HB1 . ALA A 1 14 ? 48.365 53.890 53.114 1.00 90.25 ? 26 ALA A HB1 1 ATOM 115 H HB2 . ALA A 1 14 ? 48.542 53.419 54.621 1.00 90.25 ? 26 ALA A HB2 1 ATOM 116 H HB3 . ALA A 1 14 ? 49.709 53.176 53.570 1.00 90.25 ? 26 ALA A HB3 1 ATOM 117 N N . PRO A 1 15 ? 47.402 51.631 50.998 1.00 86.81 ? 27 PRO A N 1 ATOM 118 C CA . PRO A 1 15 ? 47.655 51.463 49.560 1.00 84.75 ? 27 PRO A CA 1 ATOM 119 C C . PRO A 1 15 ? 48.447 52.636 48.994 1.00 89.91 ? 27 PRO A C 1 ATOM 120 O O . PRO A 1 15 ? 48.718 53.634 49.667 1.00 82.70 ? 27 PRO A O 1 ATOM 121 C CB . PRO A 1 15 ? 46.251 51.386 48.955 1.00 91.09 ? 27 PRO A CB 1 ATOM 122 C CG . PRO A 1 15 ? 45.368 52.077 49.943 1.00 92.16 ? 27 PRO A CG 1 ATOM 123 C CD . PRO A 1 15 ? 45.967 51.803 51.290 1.00 80.87 ? 27 PRO A CD 1 ATOM 124 H HA . PRO A 1 15 ? 48.130 50.635 49.390 1.00 101.69 ? 27 PRO A HA 1 ATOM 125 H HB2 . PRO A 1 15 ? 46.236 51.845 48.101 1.00 109.31 ? 27 PRO A HB2 1 ATOM 126 H HB3 . PRO A 1 15 ? 45.989 50.457 48.852 1.00 109.31 ? 27 PRO A HB3 1 ATOM 127 H HG2 . PRO A 1 15 ? 45.360 53.029 49.761 1.00 110.59 ? 27 PRO A HG2 1 ATOM 128 H HG3 . PRO A 1 15 ? 44.471 51.712 49.889 1.00 110.59 ? 27 PRO A HG3 1 ATOM 129 H HD2 . PRO A 1 15 ? 45.830 52.560 51.880 1.00 97.05 ? 27 PRO A HD2 1 ATOM 130 H HD3 . PRO A 1 15 ? 45.597 50.988 51.664 1.00 97.05 ? 27 PRO A HD3 1 ATOM 131 N N . ALA A 1 16 ? 48.814 52.502 47.720 1.00 93.22 ? 28 ALA A N 1 ATOM 132 C CA . ALA A 1 16 ? 49.646 53.491 47.052 1.00 96.23 ? 28 ALA A CA 1 ATOM 133 C C . ALA A 1 16 ? 48.841 54.739 46.698 1.00 101.04 ? 28 ALA A C 1 ATOM 134 O O . ALA A 1 16 ? 47.607 54.747 46.710 1.00 103.45 ? 28 ALA A O 1 ATOM 135 C CB . ALA A 1 16 ? 50.268 52.902 45.786 1.00 90.94 ? 28 ALA A CB 1 ATOM 136 H H . ALA A 1 16 ? 48.589 51.840 47.220 1.00 111.86 ? 28 ALA A H 1 ATOM 137 H HA . ALA A 1 16 ? 50.366 53.754 47.646 1.00 115.48 ? 28 ALA A HA 1 ATOM 138 H HB1 . ALA A 1 16 ? 50.816 53.579 45.360 1.00 109.12 ? 28 ALA A HB1 1 ATOM 139 H HB2 . ALA A 1 16 ? 50.813 52.138 46.029 1.00 109.12 ? 28 ALA A HB2 1 ATOM 140 H HB3 . ALA A 1 16 ? 49.558 52.625 45.186 1.00 109.12 ? 28 ALA A HB3 1 ATOM 141 N N . ASP A 1 17 ? 49.567 55.811 46.369 1.00 113.33 ? 29 ASP A N 1 ATOM 142 C CA . ASP A 1 17 ? 48.952 57.037 45.868 1.00 122.28 ? 29 ASP A CA 1 ATOM 143 C C . ASP A 1 17 ? 48.383 56.879 44.466 1.00 124.91 ? 29 ASP A C 1 ATOM 144 O O . ASP A 1 17 ? 47.841 57.850 43.923 1.00 121.56 ? 29 ASP A O 1 ATOM 145 C CB . ASP A 1 17 ? 49.972 58.179 45.877 1.00 113.85 ? 29 ASP A CB 1 ATOM 146 C CG . ASP A 1 17 ? 50.239 58.710 47.271 1.00 123.12 ? 29 ASP A CG 1 ATOM 147 O OD1 . ASP A 1 17 ? 49.347 58.581 48.136 1.00 112.66 ? 29 ASP A OD1 1 ATOM 148 O OD2 . ASP A 1 17 ? 51.338 59.261 47.500 1.00 135.12 ? 29 ASP A OD2 1 ATOM 149 H H . ASP A 1 17 ? 50.424 55.851 46.428 1.00 136.00 ? 29 ASP A H 1 ATOM 150 H HA . ASP A 1 17 ? 48.223 57.284 46.458 1.00 146.74 ? 29 ASP A HA 1 ATOM 151 H HB2 . ASP A 1 17 ? 50.811 57.857 45.513 1.00 136.62 ? 29 ASP A HB2 1 ATOM 152 H HB3 . ASP A 1 17 ? 49.633 58.910 45.337 1.00 136.62 ? 29 ASP A HB3 1 ATOM 153 N N . ARG A 1 18 ? 48.495 55.693 43.873 1.00 117.24 ? 30 ARG A N 1 ATOM 154 C CA . ARG A 1 18 ? 47.960 55.447 42.546 1.00 99.80 ? 30 ARG A CA 1 ATOM 155 C C . ARG A 1 18 ? 46.454 55.698 42.525 1.00 104.90 ? 30 ARG A C 1 ATOM 156 O O . ARG A 1 18 ? 45.785 55.725 43.562 1.00 102.80 ? 30 ARG A O 1 ATOM 157 C CB . ARG A 1 18 ? 48.268 54.011 42.118 1.00 87.21 ? 30 ARG A CB 1 ATOM 158 C CG . ARG A 1 18 ? 49.751 53.658 42.177 1.00 98.53 ? 30 ARG A CG 1 ATOM 159 C CD . ARG A 1 18 ? 49.979 52.156 42.090 1.00 100.05 ? 30 ARG A CD 1 ATOM 160 N NE . ARG A 1 18 ? 51.405 51.821 42.090 1.00 123.86 ? 30 ARG A NE 1 ATOM 161 C CZ . ARG A 1 18 ? 52.132 51.575 41.000 1.00 115.16 ? 30 ARG A CZ 1 ATOM 162 N NH1 . ARG A 1 18 ? 51.582 51.614 39.791 1.00 102.56 ? 30 ARG A NH1 1 ATOM 163 N NH2 . ARG A 1 18 ? 53.423 51.282 41.119 1.00 98.68 ? 30 ARG A NH2 1 ATOM 164 H H . ARG A 1 18 ? 48.881 55.010 44.226 1.00 140.69 ? 30 ARG A H 1 ATOM 165 H HA . ARG A 1 18 ? 48.379 56.051 41.913 1.00 119.76 ? 30 ARG A HA 1 ATOM 166 H HB2 . ARG A 1 18 ? 47.794 53.402 42.704 1.00 104.65 ? 30 ARG A HB2 1 ATOM 167 H HB3 . ARG A 1 18 ? 47.970 53.887 41.203 1.00 104.65 ? 30 ARG A HB3 1 ATOM 168 H HG2 . ARG A 1 18 ? 50.209 54.078 41.433 1.00 118.23 ? 30 ARG A HG2 1 ATOM 169 H HG3 . ARG A 1 18 ? 50.120 53.972 43.018 1.00 118.23 ? 30 ARG A HG3 1 ATOM 170 H HD2 . ARG A 1 18 ? 49.566 51.725 42.855 1.00 120.06 ? 30 ARG A HD2 1 ATOM 171 H HD3 . ARG A 1 18 ? 49.589 51.822 41.267 1.00 120.06 ? 30 ARG A HD3 1 ATOM 172 H HE . ARG A 1 18 ? 51.803 51.779 42.851 1.00 148.63 ? 30 ARG A HE 1 ATOM 173 H HH11 . ARG A 1 18 ? 50.747 51.803 39.704 1.00 123.07 ? 30 ARG A HH11 1 ATOM 174 H HH12 . ARG A 1 18 ? 52.060 51.453 39.095 1.00 123.07 ? 30 ARG A HH12 1 ATOM 175 H HH21 . ARG A 1 18 ? 53.787 51.253 41.897 1.00 118.41 ? 30 ARG A HH21 1 ATOM 176 H HH22 . ARG A 1 18 ? 53.894 51.121 40.417 1.00 118.41 ? 30 ARG A HH22 1 ATOM 177 N N . ALA A 1 19 ? 45.924 55.897 41.325 1.00 109.33 ? 31 ALA A N 1 ATOM 178 C CA . ALA A 1 19 ? 44.483 56.062 41.167 1.00 100.23 ? 31 ALA A CA 1 ATOM 179 C C . ALA A 1 19 ? 43.795 54.715 41.368 1.00 105.28 ? 31 ALA A C 1 ATOM 180 O O . ALA A 1 19 ? 44.192 53.726 40.736 1.00 95.35 ? 31 ALA A O 1 ATOM 181 C CB . ALA A 1 19 ? 44.152 56.622 39.785 1.00 87.64 ? 31 ALA A CB 1 ATOM 182 H H . ALA A 1 19 ? 46.371 55.940 40.591 1.00 131.20 ? 31 ALA A H 1 ATOM 183 H HA . ALA A 1 19 ? 44.152 56.680 41.837 1.00 120.27 ? 31 ALA A HA 1 ATOM 184 H HB1 . ALA A 1 19 ? 43.190 56.722 39.707 1.00 105.17 ? 31 ALA A HB1 1 ATOM 185 H HB2 . ALA A 1 19 ? 44.584 57.485 39.682 1.00 105.17 ? 31 ALA A HB2 1 ATOM 186 H HB3 . ALA A 1 19 ? 44.477 56.006 39.109 1.00 105.17 ? 31 ALA A HB3 1 ATOM 187 N N . PRO A 1 20 ? 42.783 54.620 42.236 1.00 109.45 ? 32 PRO A N 1 ATOM 188 C CA . PRO A 1 20 ? 42.083 53.337 42.398 1.00 88.78 ? 32 PRO A CA 1 ATOM 189 C C . PRO A 1 20 ? 41.442 52.903 41.088 1.00 72.29 ? 32 PRO A C 1 ATOM 190 O O . PRO A 1 20 ? 40.852 53.709 40.364 1.00 71.70 ? 32 PRO A O 1 ATOM 191 C CB . PRO A 1 20 ? 41.033 53.628 43.480 1.00 67.87 ? 32 PRO A CB 1 ATOM 192 C CG . PRO A 1 20 ? 41.510 54.858 44.173 1.00 71.88 ? 32 PRO A CG 1 ATOM 193 C CD . PRO A 1 20 ? 42.245 55.656 43.137 1.00 86.07 ? 32 PRO A CD 1 ATOM 194 H HA . PRO A 1 20 ? 42.693 52.650 42.710 1.00 106.53 ? 32 PRO A HA 1 ATOM 195 H HB2 . PRO A 1 20 ? 40.170 53.783 43.064 1.00 81.45 ? 32 PRO A HB2 1 ATOM 196 H HB3 . PRO A 1 20 ? 40.986 52.883 44.099 1.00 81.45 ? 32 PRO A HB3 1 ATOM 197 H HG2 . PRO A 1 20 ? 40.750 55.356 44.511 1.00 86.25 ? 32 PRO A HG2 1 ATOM 198 H HG3 . PRO A 1 20 ? 42.106 54.611 44.898 1.00 86.25 ? 32 PRO A HG3 1 ATOM 199 H HD2 . PRO A 1 20 ? 41.632 56.236 42.658 1.00 103.28 ? 32 PRO A HD2 1 ATOM 200 H HD3 . PRO A 1 20 ? 42.967 56.159 43.545 1.00 103.28 ? 32 PRO A HD3 1 ATOM 201 N N . ALA A 1 21 ? 41.583 51.621 40.771 1.00 59.48 ? 33 ALA A N 1 ATOM 202 C CA . ALA A 1 21 ? 41.030 51.116 39.524 1.00 77.23 ? 33 ALA A CA 1 ATOM 203 C C . ALA A 1 21 ? 39.511 51.142 39.592 1.00 62.07 ? 33 ALA A C 1 ATOM 204 O O . ALA A 1 21 ? 38.917 50.898 40.645 1.00 60.06 ? 33 ALA A O 1 ATOM 205 C CB . ALA A 1 21 ? 41.521 49.695 39.243 1.00 58.93 ? 33 ALA A CB 1 ATOM 206 H H . ALA A 1 21 ? 41.988 51.033 41.252 1.00 71.37 ? 33 ALA A H 1 ATOM 207 H HA . ALA A 1 21 ? 41.313 51.687 38.793 1.00 92.68 ? 33 ALA A HA 1 ATOM 208 H HB1 . ALA A 1 21 ? 41.135 49.388 38.407 1.00 70.71 ? 33 ALA A HB1 1 ATOM 209 H HB2 . ALA A 1 21 ? 42.488 49.703 39.178 1.00 70.71 ? 33 ALA A HB2 1 ATOM 210 H HB3 . ALA A 1 21 ? 41.242 49.115 39.969 1.00 70.71 ? 33 ALA A HB3 1 ATOM 211 N N . VAL A 1 22 ? 38.880 51.454 38.460 1.00 40.70 ? 34 VAL A N 1 ATOM 212 C CA . VAL A 1 22 ? 37.431 51.406 38.397 1.00 34.91 ? 34 VAL A CA 1 ATOM 213 C C . VAL A 1 22 ? 36.983 49.987 38.706 1.00 28.58 ? 34 VAL A C 1 ATOM 214 O O . VAL A 1 22 ? 37.706 49.014 38.479 1.00 31.97 ? 34 VAL A O 1 ATOM 215 C CB . VAL A 1 22 ? 36.905 51.855 37.023 1.00 32.24 ? 34 VAL A CB 1 ATOM 216 C CG1 . VAL A 1 22 ? 37.420 53.238 36.687 1.00 49.45 ? 34 VAL A CG1 1 ATOM 217 C CG2 . VAL A 1 22 ? 37.289 50.841 35.961 1.00 38.47 ? 34 VAL A CG2 1 ATOM 218 H H . VAL A 1 22 ? 39.265 51.692 37.729 1.00 48.84 ? 34 VAL A H 1 ATOM 219 H HA . VAL A 1 22 ? 37.061 51.996 39.073 1.00 41.89 ? 34 VAL A HA 1 ATOM 220 H HB . VAL A 1 22 ? 35.936 51.897 37.057 1.00 38.69 ? 34 VAL A HB 1 ATOM 221 H HG11 . VAL A 1 22 ? 37.076 53.500 35.818 1.00 59.34 ? 34 VAL A HG11 1 ATOM 222 H HG12 . VAL A 1 22 ? 37.115 53.861 37.365 1.00 59.34 ? 34 VAL A HG12 1 ATOM 223 H HG13 . VAL A 1 22 ? 38.389 53.218 36.667 1.00 59.34 ? 34 VAL A HG13 1 ATOM 224 H HG21 . VAL A 1 22 ? 36.950 51.140 35.102 1.00 46.17 ? 34 VAL A HG21 1 ATOM 225 H HG22 . VAL A 1 22 ? 38.256 50.769 35.928 1.00 46.17 ? 34 VAL A HG22 1 ATOM 226 H HG23 . VAL A 1 22 ? 36.901 49.982 36.189 1.00 46.17 ? 34 VAL A HG23 1 ATOM 227 N N . GLY A 1 23 ? 35.785 49.869 39.241 1.00 21.75 ? 35 GLY A N 1 ATOM 228 C CA . GLY A 1 23 ? 35.137 48.583 39.376 1.00 19.33 ? 35 GLY A CA 1 ATOM 229 C C . GLY A 1 23 ? 34.391 48.255 38.095 1.00 18.99 ? 35 GLY A C 1 ATOM 230 O O . GLY A 1 23 ? 34.025 49.153 37.349 1.00 18.37 ? 35 GLY A O 1 ATOM 231 H H . GLY A 1 23 ? 35.319 50.528 39.538 1.00 26.10 ? 35 GLY A H 1 ATOM 232 H HA2 . GLY A 1 23 ? 35.799 47.894 39.544 1.00 23.20 ? 35 GLY A HA2 1 ATOM 233 H HA3 . GLY A 1 23 ? 34.507 48.604 40.114 1.00 23.20 ? 35 GLY A HA3 1 ATOM 234 N N . GLN A 1 24 ? 34.193 46.958 37.835 1.00 22.51 ? 36 GLN A N 1 ATOM 235 C CA . GLN A 1 24 ? 33.489 46.519 36.642 1.00 20.20 ? 36 GLN A CA 1 ATOM 236 C C . GLN A 1 24 ? 32.522 45.390 36.979 1.00 17.01 ? 36 GLN A C 1 ATOM 237 O O . GLN A 1 24 ? 32.777 44.563 37.861 1.00 19.20 ? 36 GLN A O 1 ATOM 238 C CB . GLN A 1 24 ? 34.469 46.062 35.519 1.00 19.94 ? 36 GLN A CB 1 ATOM 239 C CG . GLN A 1 24 ? 35.501 47.093 35.216 1.00 24.86 ? 36 GLN A CG 1 ATOM 240 C CD . GLN A 1 24 ? 36.267 46.835 33.947 1.00 21.91 ? 36 GLN A CD 1 ATOM 241 O OE1 . GLN A 1 24 ? 36.513 47.756 33.183 1.00 28.22 ? 36 GLN A OE1 1 ATOM 242 N NE2 . GLN A 1 24 ? 36.704 45.589 33.743 1.00 28.74 ? 36 GLN A NE2 1 ATOM 243 H H . GLN A 1 24 ? 34.461 46.316 38.340 1.00 27.02 ? 36 GLN A H 1 ATOM 244 H HA . GLN A 1 24 ? 32.968 47.261 36.297 1.00 24.24 ? 36 GLN A HA 1 ATOM 245 H HB2 . GLN A 1 24 ? 34.925 45.255 35.804 1.00 23.92 ? 36 GLN A HB2 1 ATOM 246 H HB3 . GLN A 1 24 ? 33.966 45.892 34.708 1.00 23.92 ? 36 GLN A HB3 1 ATOM 247 H HG2 . GLN A 1 24 ? 35.065 47.955 35.130 1.00 29.83 ? 36 GLN A HG2 1 ATOM 248 H HG3 . GLN A 1 24 ? 36.139 47.119 35.946 1.00 29.83 ? 36 GLN A HG3 1 ATOM 249 H HE21 . GLN A 1 24 ? 36.544 44.976 34.324 1.00 34.49 ? 36 GLN A HE21 1 ATOM 250 H HE22 . GLN A 1 24 ? 37.146 45.400 33.029 1.00 34.49 ? 36 GLN A HE22 1 ATOM 251 N N . PHE A 1 25 ? 31.412 45.324 36.232 1.00 16.97 ? 37 PHE A N 1 ATOM 252 C CA . PHE A 1 25 ? 30.541 44.169 36.309 1.00 18.01 ? 37 PHE A CA 1 ATOM 253 C C . PHE A 1 25 ? 29.951 43.903 34.934 1.00 17.45 ? 37 PHE A C 1 ATOM 254 O O . PHE A 1 25 ? 29.818 44.809 34.124 1.00 18.40 ? 37 PHE A O 1 ATOM 255 C CB . PHE A 1 25 ? 29.416 44.292 37.362 1.00 18.62 ? 37 PHE A CB 1 ATOM 256 C CG . PHE A 1 25 ? 28.408 45.410 37.100 1.00 15.15 ? 37 PHE A CG 1 ATOM 257 C CD1 . PHE A 1 25 ? 27.213 45.141 36.451 1.00 17.56 ? 37 PHE A CD1 1 ATOM 258 C CD2 . PHE A 1 25 ? 28.657 46.684 37.541 1.00 20.07 ? 37 PHE A CD2 1 ATOM 259 C CE1 . PHE A 1 25 ? 26.296 46.153 36.253 1.00 17.63 ? 37 PHE A CE1 1 ATOM 260 C CE2 . PHE A 1 25 ? 27.744 47.704 37.333 1.00 21.35 ? 37 PHE A CE2 1 ATOM 261 C CZ . PHE A 1 25 ? 26.566 47.422 36.689 1.00 19.13 ? 37 PHE A CZ 1 ATOM 262 H H . PHE A 1 25 ? 31.152 45.932 35.682 1.00 20.36 ? 37 PHE A H 1 ATOM 263 H HA . PHE A 1 25 ? 31.078 43.398 36.549 1.00 21.61 ? 37 PHE A HA 1 ATOM 264 H HB2 . PHE A 1 25 ? 28.925 43.455 37.388 1.00 22.35 ? 37 PHE A HB2 1 ATOM 265 H HB3 . PHE A 1 25 ? 29.820 44.459 38.228 1.00 22.35 ? 37 PHE A HB3 1 ATOM 266 H HD1 . PHE A 1 25 ? 27.025 44.278 36.159 1.00 21.07 ? 37 PHE A HD1 1 ATOM 267 H HD2 . PHE A 1 25 ? 29.455 46.868 37.982 1.00 24.09 ? 37 PHE A HD2 1 ATOM 268 H HE1 . PHE A 1 25 ? 25.497 45.976 35.810 1.00 21.16 ? 37 PHE A HE1 1 ATOM 269 H HE2 . PHE A 1 25 ? 27.924 48.567 37.631 1.00 25.62 ? 37 PHE A HE2 1 ATOM 270 H HZ . PHE A 1 25 ? 25.948 48.102 36.542 1.00 22.95 ? 37 PHE A HZ 1 ATOM 271 N N . TRP A 1 26 ? 29.707 42.628 34.663 1.00 16.40 ? 38 TRP A N 1 ATOM 272 C CA . TRP A 1 26 ? 29.075 42.182 33.432 1.00 17.90 ? 38 TRP A CA 1 ATOM 273 C C . TRP A 1 26 ? 27.553 42.159 33.571 1.00 15.12 ? 38 TRP A C 1 ATOM 274 O O . TRP A 1 26 ? 27.006 41.888 34.642 1.00 17.55 ? 38 TRP A O 1 ATOM 275 C CB . TRP A 1 26 ? 29.540 40.766 33.065 1.00 17.12 ? 38 TRP A CB 1 ATOM 276 C CG . TRP A 1 26 ? 30.951 40.675 32.680 1.00 16.95 ? 38 TRP A CG 1 ATOM 277 C CD1 . TRP A 1 26 ? 31.990 40.271 33.474 1.00 20.49 ? 38 TRP A CD1 1 ATOM 278 C CD2 . TRP A 1 26 ? 31.530 40.983 31.386 1.00 17.26 ? 38 TRP A CD2 1 ATOM 279 N NE1 . TRP A 1 26 ? 33.156 40.296 32.756 1.00 21.60 ? 38 TRP A NE1 1 ATOM 280 C CE2 . TRP A 1 26 ? 32.912 40.728 31.483 1.00 20.52 ? 38 TRP A CE2 1 ATOM 281 C CE3 . TRP A 1 26 ? 31.006 41.407 30.160 1.00 20.09 ? 38 TRP A CE3 1 ATOM 282 C CZ2 . TRP A 1 26 ? 33.782 40.901 30.404 1.00 23.75 ? 38 TRP A CZ2 1 ATOM 283 C CZ3 . TRP A 1 26 ? 31.882 41.599 29.083 1.00 22.33 ? 38 TRP A CZ3 1 ATOM 284 C CH2 . TRP A 1 26 ? 33.255 41.345 29.227 1.00 23.77 ? 38 TRP A CH2 1 ATOM 285 H H . TRP A 1 26 ? 29.905 41.983 35.196 1.00 19.68 ? 38 TRP A H 1 ATOM 286 H HA . TRP A 1 26 ? 29.311 42.784 32.709 1.00 21.48 ? 38 TRP A HA 1 ATOM 287 H HB2 . TRP A 1 26 ? 29.405 40.186 33.830 1.00 20.55 ? 38 TRP A HB2 1 ATOM 288 H HB3 . TRP A 1 26 ? 29.010 40.449 32.317 1.00 20.55 ? 38 TRP A HB3 1 ATOM 289 H HD1 . TRP A 1 26 ? 31.916 40.015 34.365 1.00 24.58 ? 38 TRP A HD1 1 ATOM 290 H HE1 . TRP A 1 26 ? 33.931 40.089 33.066 1.00 25.92 ? 38 TRP A HE1 1 ATOM 291 H HE3 . TRP A 1 26 ? 30.097 41.579 30.068 1.00 24.11 ? 38 TRP A HE3 1 ATOM 292 H HZ2 . TRP A 1 26 ? 34.694 40.740 30.491 1.00 28.50 ? 38 TRP A HZ2 1 ATOM 293 H HZ3 . TRP A 1 26 ? 31.551 41.893 28.265 1.00 26.79 ? 38 TRP A HZ3 1 ATOM 294 H HH2 . TRP A 1 26 ? 33.818 41.473 28.498 1.00 28.52 ? 38 TRP A HH2 1 ATOM 295 N N . HIS A 1 27 ? 26.878 42.366 32.443 1.00 16.39 ? 39 HIS A N 1 ATOM 296 C CA . HIS A 1 27 ? 25.432 42.188 32.315 1.00 15.48 ? 39 HIS A CA 1 ATOM 297 C C . HIS A 1 27 ? 25.165 41.312 31.101 1.00 15.49 ? 39 HIS A C 1 ATOM 298 O O . HIS A 1 27 ? 25.540 41.677 29.977 1.00 17.35 ? 39 HIS A O 1 ATOM 299 C CB . HIS A 1 27 ? 24.730 43.544 32.167 1.00 15.10 ? 39 HIS A CB 1 ATOM 300 C CG . HIS A 1 27 ? 23.232 43.466 32.085 1.00 14.80 ? 39 HIS A CG 1 ATOM 301 N ND1 . HIS A 1 27 ? 22.448 44.563 31.778 1.00 16.52 ? 39 HIS A ND1 1 ATOM 302 C CD2 . HIS A 1 27 ? 22.377 42.438 32.291 1.00 13.43 ? 39 HIS A CD2 1 ATOM 303 C CE1 . HIS A 1 27 ? 21.175 44.198 31.784 1.00 14.19 ? 39 HIS A CE1 1 ATOM 304 N NE2 . HIS A 1 27 ? 21.100 42.916 32.081 1.00 16.29 ? 39 HIS A NE2 1 ATOM 305 H H . HIS A 1 27 ? 27.251 42.621 31.711 1.00 19.66 ? 39 HIS A H 1 ATOM 306 H HA . HIS A 1 27 ? 25.085 41.742 33.104 1.00 18.58 ? 39 HIS A HA 1 ATOM 307 H HB2 . HIS A 1 27 ? 24.955 44.094 32.933 1.00 18.12 ? 39 HIS A HB2 1 ATOM 308 H HB3 . HIS A 1 27 ? 25.048 43.970 31.355 1.00 18.12 ? 39 HIS A HB3 1 ATOM 309 H HD2 . HIS A 1 27 ? 22.608 41.564 32.510 1.00 16.12 ? 39 HIS A HD2 1 ATOM 310 H HE1 . HIS A 1 27 ? 20.452 44.755 31.602 1.00 17.02 ? 39 HIS A HE1 1 ATOM 311 H HE2 . HIS A 1 27 ? 20.375 42.459 32.151 1.00 19.55 ? 39 HIS A HE2 1 ATOM 312 N N . VAL A 1 28 ? 24.518 40.178 31.329 1.00 16.34 ? 40 VAL A N 1 ATOM 313 C CA . VAL A 1 28 ? 24.097 39.282 30.253 1.00 15.85 ? 40 VAL A CA 1 ATOM 314 C C . VAL A 1 28 ? 22.599 39.050 30.400 1.00 16.78 ? 40 VAL A C 1 ATOM 315 O O . VAL A 1 28 ? 22.069 39.071 31.517 1.00 16.14 ? 40 VAL A O 1 ATOM 316 C CB . VAL A 1 28 ? 24.853 37.936 30.294 1.00 21.74 ? 40 VAL A CB 1 ATOM 317 C CG1 . VAL A 1 28 ? 26.360 38.140 30.154 1.00 18.74 ? 40 VAL A CG1 1 ATOM 318 C CG2 . VAL A 1 28 ? 24.566 37.251 31.566 1.00 25.04 ? 40 VAL A CG2 1 ATOM 319 H H . VAL A 1 28 ? 24.306 39.896 32.114 1.00 19.61 ? 40 VAL A H 1 ATOM 320 H HA . VAL A 1 28 ? 24.262 39.704 29.395 1.00 19.02 ? 40 VAL A HA 1 ATOM 321 H HB . VAL A 1 28 ? 24.550 37.372 29.565 1.00 26.09 ? 40 VAL A HB 1 ATOM 322 H HG11 . VAL A 1 28 ? 26.799 37.276 30.184 1.00 22.49 ? 40 VAL A HG11 1 ATOM 323 H HG12 . VAL A 1 28 ? 26.542 38.576 29.307 1.00 22.49 ? 40 VAL A HG12 1 ATOM 324 H HG13 . VAL A 1 28 ? 26.672 38.696 30.886 1.00 22.49 ? 40 VAL A HG13 1 ATOM 325 H HG21 . VAL A 1 28 ? 25.043 36.408 31.585 1.00 30.04 ? 40 VAL A HG21 1 ATOM 326 H HG22 . VAL A 1 28 ? 24.858 37.814 32.300 1.00 30.04 ? 40 VAL A HG22 1 ATOM 327 H HG23 . VAL A 1 28 ? 23.611 37.093 31.630 1.00 30.04 ? 40 VAL A HG23 1 ATOM 328 N N . THR A 1 29 ? 21.899 38.890 29.275 1.00 15.51 ? 41 THR A N 1 ATOM 329 C CA . THR A 1 29 ? 20.456 38.732 29.366 1.00 15.65 ? 41 THR A CA 1 ATOM 330 C C . THR A 1 29 ? 19.934 37.973 28.155 1.00 14.49 ? 41 THR A C 1 ATOM 331 O O . THR A 1 29 ? 20.527 37.990 27.075 1.00 14.72 ? 41 THR A O 1 ATOM 332 C CB . THR A 1 29 ? 19.796 40.120 29.524 1.00 17.79 ? 41 THR A CB 1 ATOM 333 O OG1 . THR A 1 29 ? 18.434 39.997 29.905 1.00 19.64 ? 41 THR A OG1 1 ATOM 334 C CG2 . THR A 1 29 ? 19.900 40.916 28.313 1.00 18.77 ? 41 THR A CG2 1 ATOM 335 H H . THR A 1 29 ? 22.224 38.870 28.479 1.00 18.62 ? 41 THR A H 1 ATOM 336 H HA . THR A 1 29 ? 20.246 38.211 30.157 1.00 18.78 ? 41 THR A HA 1 ATOM 337 H HB . THR A 1 29 ? 20.265 40.601 30.224 1.00 21.34 ? 41 THR A HB 1 ATOM 338 H HG1 . THR A 1 29 ? 18.376 39.591 30.638 1.00 23.57 ? 41 THR A HG1 1 ATOM 339 H HG21 . THR A 1 29 ? 19.477 41.779 28.446 1.00 22.52 ? 41 THR A HG21 1 ATOM 340 H HG22 . THR A 1 29 ? 20.833 41.054 28.086 1.00 22.52 ? 41 THR A HG22 1 ATOM 341 H HG23 . THR A 1 29 ? 19.461 40.459 27.578 1.00 22.52 ? 41 THR A HG23 1 ATOM 342 N N . ASP A 1 30 ? 18.780 37.345 28.352 1.00 15.27 ? 42 ASP A N 1 ATOM 343 C CA . ASP A 1 30 ? 17.968 36.795 27.265 1.00 15.32 ? 42 ASP A CA 1 ATOM 344 C C . ASP A 1 30 ? 18.772 35.789 26.438 1.00 16.04 ? 42 ASP A C 1 ATOM 345 O O . ASP A 1 30 ? 18.951 35.930 25.230 1.00 16.20 ? 42 ASP A O 1 ATOM 346 C CB . ASP A 1 30 ? 17.412 37.926 26.399 1.00 16.01 ? 42 ASP A CB 1 ATOM 347 C CG . ASP A 1 30 ? 16.323 38.723 27.136 1.00 14.61 ? 42 ASP A CG 1 ATOM 348 O OD1 . ASP A 1 30 ? 16.670 39.746 27.768 1.00 18.77 ? 42 ASP A OD1 1 ATOM 349 O OD2 . ASP A 1 30 ? 15.145 38.286 27.108 1.00 15.31 ? 42 ASP A OD2 1 ATOM 350 H H . ASP A 1 30 ? 18.434 37.220 29.130 1.00 18.32 ? 42 ASP A H 1 ATOM 351 H HA . ASP A 1 30 ? 17.214 36.322 27.650 1.00 18.38 ? 42 ASP A HA 1 ATOM 352 H HB2 . ASP A 1 30 ? 18.131 38.535 26.168 1.00 19.22 ? 42 ASP A HB2 1 ATOM 353 H HB3 . ASP A 1 30 ? 17.021 37.549 25.595 1.00 19.22 ? 42 ASP A HB3 1 ATOM 354 N N . LEU A 1 31 ? 19.255 34.770 27.142 1.00 15.83 ? 43 LEU A N 1 ATOM 355 C CA . LEU A 1 31 ? 20.068 33.738 26.501 1.00 16.58 ? 43 LEU A CA 1 ATOM 356 C C . LEU A 1 31 ? 19.232 32.878 25.556 1.00 18.37 ? 43 LEU A C 1 ATOM 357 O O . LEU A 1 31 ? 19.704 32.523 24.468 1.00 20.54 ? 43 LEU A O 1 ATOM 358 C CB . LEU A 1 31 ? 20.724 32.872 27.575 1.00 17.03 ? 43 LEU A CB 1 ATOM 359 C CG . LEU A 1 31 ? 21.619 33.625 28.560 1.00 21.06 ? 43 LEU A CG 1 ATOM 360 C CD1 . LEU A 1 31 ? 22.034 32.703 29.707 1.00 25.57 ? 43 LEU A CD1 1 ATOM 361 C CD2 . LEU A 1 31 ? 22.801 34.140 27.887 1.00 22.58 ? 43 LEU A CD2 1 ATOM 362 H H . LEU A 1 31 ? 19.129 34.651 27.984 1.00 18.99 ? 43 LEU A H 1 ATOM 363 H HA . LEU A 1 31 ? 20.770 34.162 25.982 1.00 19.89 ? 43 LEU A HA 1 ATOM 364 H HB2 . LEU A 1 31 ? 20.026 32.437 28.089 1.00 20.43 ? 43 LEU A HB2 1 ATOM 365 H HB3 . LEU A 1 31 ? 21.271 32.201 27.139 1.00 20.43 ? 43 LEU A HB3 1 ATOM 366 H HG . LEU A 1 31 ? 21.128 34.375 28.933 1.00 25.27 ? 43 LEU A HG 1 ATOM 367 H HD11 . LEU A 1 31 ? 22.600 33.198 30.320 1.00 30.68 ? 43 LEU A HD11 1 ATOM 368 H HD12 . LEU A 1 31 ? 21.238 32.394 30.167 1.00 30.68 ? 43 LEU A HD12 1 ATOM 369 H HD13 . LEU A 1 31 ? 22.521 31.948 29.343 1.00 30.68 ? 43 LEU A HD13 1 ATOM 370 H HD21 . LEU A 1 31 ? 23.351 34.613 28.531 1.00 27.10 ? 43 LEU A HD21 1 ATOM 371 H HD22 . LEU A 1 31 ? 23.298 33.398 27.509 1.00 27.10 ? 43 LEU A HD22 1 ATOM 372 H HD23 . LEU A 1 31 ? 22.524 34.746 27.181 1.00 27.10 ? 43 LEU A HD23 1 ATOM 373 N N . HIS A 1 32 ? 18.009 32.524 25.969 1.00 17.41 ? 44 HIS A N 1 ATOM 374 C CA . HIS A 1 32 ? 17.040 31.742 25.181 1.00 18.20 ? 44 HIS A CA 1 ATOM 375 C C . HIS A 1 32 ? 17.708 30.567 24.464 1.00 20.88 ? 44 HIS A C 1 ATOM 376 O O . HIS A 1 32 ? 17.758 30.501 23.235 1.00 20.01 ? 44 HIS A O 1 ATOM 377 C CB . HIS A 1 32 ? 16.305 32.617 24.162 1.00 19.80 ? 44 HIS A CB 1 ATOM 378 C CG . HIS A 1 32 ? 15.385 33.625 24.781 1.00 17.38 ? 44 HIS A CG 1 ATOM 379 N ND1 . HIS A 1 32 ? 14.199 33.279 25.411 1.00 19.52 ? 44 HIS A ND1 1 ATOM 380 C CD2 . HIS A 1 32 ? 15.466 34.974 24.833 1.00 17.39 ? 44 HIS A CD2 1 ATOM 381 C CE1 . HIS A 1 32 ? 13.590 34.386 25.820 1.00 18.29 ? 44 HIS A CE1 1 ATOM 382 N NE2 . HIS A 1 32 ? 14.337 35.416 25.476 1.00 13.98 ? 44 HIS A NE2 1 ATOM 383 H H . HIS A 1 32 ? 17.702 32.737 26.744 1.00 20.89 ? 44 HIS A H 1 ATOM 384 H HA . HIS A 1 32 ? 16.375 31.376 25.785 1.00 21.84 ? 44 HIS A HA 1 ATOM 385 H HB2 . HIS A 1 32 ? 16.961 33.099 23.634 1.00 23.76 ? 44 HIS A HB2 1 ATOM 386 H HB3 . HIS A 1 32 ? 15.774 32.046 23.585 1.00 23.76 ? 44 HIS A HB3 1 ATOM 387 H HD1 . HIS A 1 32 ? 13.901 32.479 25.510 1.00 23.42 ? 44 HIS A HD1 1 ATOM 388 H HD2 . HIS A 1 32 ? 16.147 35.502 24.484 1.00 20.87 ? 44 HIS A HD2 1 ATOM 389 H HE1 . HIS A 1 32 ? 12.782 34.426 26.279 1.00 21.95 ? 44 HIS A HE1 1 ATOM 390 N N . LEU A 1 33 ? 18.224 29.633 25.263 1.00 21.99 ? 45 LEU A N 1 ATOM 391 C CA . LEU A 1 33 ? 18.770 28.392 24.704 1.00 23.71 ? 45 LEU A CA 1 ATOM 392 C C . LEU A 1 33 ? 17.688 27.634 23.958 1.00 19.78 ? 45 LEU A C 1 ATOM 393 O O . LEU A 1 33 ? 16.615 27.397 24.512 1.00 23.49 ? 45 LEU A O 1 ATOM 394 C CB . LEU A 1 33 ? 19.318 27.511 25.821 1.00 23.92 ? 45 LEU A CB 1 ATOM 395 C CG . LEU A 1 33 ? 19.756 26.097 25.384 1.00 25.89 ? 45 LEU A CG 1 ATOM 396 C CD1 . LEU A 1 33 ? 20.989 26.185 24.479 1.00 24.62 ? 45 LEU A CD1 1 ATOM 397 C CD2 . LEU A 1 33 ? 20.008 25.206 26.593 1.00 25.58 ? 45 LEU A CD2 1 ATOM 398 H H . LEU A 1 33 ? 18.269 29.689 26.119 1.00 26.39 ? 45 LEU A H 1 ATOM 399 H HA . LEU A 1 33 ? 19.489 28.599 24.087 1.00 28.45 ? 45 LEU A HA 1 ATOM 400 H HB2 . LEU A 1 33 ? 20.091 27.950 26.209 1.00 28.70 ? 45 LEU A HB2 1 ATOM 401 H HB3 . LEU A 1 33 ? 18.630 27.408 26.498 1.00 28.70 ? 45 LEU A HB3 1 ATOM 402 H HG . LEU A 1 33 ? 19.040 25.696 24.867 1.00 31.07 ? 45 LEU A HG 1 ATOM 403 H HD11 . LEU A 1 33 ? 21.250 25.289 24.214 1.00 29.54 ? 45 LEU A HD11 1 ATOM 404 H HD12 . LEU A 1 33 ? 20.768 26.711 23.695 1.00 29.54 ? 45 LEU A HD12 1 ATOM 405 H HD13 . LEU A 1 33 ? 21.711 26.609 24.970 1.00 29.54 ? 45 LEU A HD13 1 ATOM 406 H HD21 . LEU A 1 33 ? 20.281 24.328 26.286 1.00 30.69 ? 45 LEU A HD21 1 ATOM 407 H HD22 . LEU A 1 33 ? 20.710 25.600 27.134 1.00 30.69 ? 45 LEU A HD22 1 ATOM 408 H HD23 . LEU A 1 33 ? 19.190 25.137 27.110 1.00 30.69 ? 45 LEU A HD23 1 ATOM 409 N N . ASP A 1 34 ? 17.982 27.224 22.711 1.00 22.18 ? 46 ASP A N 1 ATOM 410 C CA . ASP A 1 34 ? 17.130 26.257 22.023 1.00 26.22 ? 46 ASP A CA 1 ATOM 411 C C . ASP A 1 34 ? 17.873 24.917 21.897 1.00 22.63 ? 46 ASP A C 1 ATOM 412 O O . ASP A 1 34 ? 18.720 24.760 21.004 1.00 27.10 ? 46 ASP A O 1 ATOM 413 C CB . ASP A 1 34 ? 16.712 26.760 20.643 1.00 24.27 ? 46 ASP A CB 1 ATOM 414 C CG . ASP A 1 34 ? 15.647 25.858 20.000 1.00 25.25 ? 46 ASP A CG 1 ATOM 415 O OD1 . ASP A 1 34 ? 15.446 24.730 20.511 1.00 26.80 ? 46 ASP A OD1 1 ATOM 416 O OD2 . ASP A 1 34 ? 15.000 26.269 18.995 1.00 29.10 ? 46 ASP A OD2 1 ATOM 417 H H . ASP A 1 34 ? 18.660 27.491 22.255 1.00 26.61 ? 46 ASP A H 1 ATOM 418 H HA . ASP A 1 34 ? 16.328 26.110 22.547 1.00 31.46 ? 46 ASP A HA 1 ATOM 419 H HB2 . ASP A 1 34 ? 16.341 27.652 20.729 1.00 29.12 ? 46 ASP A HB2 1 ATOM 420 H HB3 . ASP A 1 34 ? 17.487 26.775 20.061 1.00 29.12 ? 46 ASP A HB3 1 ATOM 421 N N . PRO A 1 35 ? 17.612 23.952 22.776 1.00 25.35 ? 47 PRO A N 1 ATOM 422 C CA . PRO A 1 35 ? 18.302 22.648 22.679 1.00 29.39 ? 47 PRO A CA 1 ATOM 423 C C . PRO A 1 35 ? 17.966 21.862 21.424 1.00 39.85 ? 47 PRO A C 1 ATOM 424 O O . PRO A 1 35 ? 18.633 20.850 21.155 1.00 34.15 ? 47 PRO A O 1 ATOM 425 C CB . PRO A 1 35 ? 17.822 21.895 23.922 1.00 29.37 ? 47 PRO A CB 1 ATOM 426 C CG . PRO A 1 35 ? 17.295 22.959 24.865 1.00 41.30 ? 47 PRO A CG 1 ATOM 427 C CD . PRO A 1 35 ? 16.744 24.030 23.962 1.00 25.66 ? 47 PRO A CD 1 ATOM 428 H HA . PRO A 1 35 ? 19.263 22.771 22.731 1.00 35.27 ? 47 PRO A HA 1 ATOM 429 H HB2 . PRO A 1 35 ? 17.116 21.277 23.676 1.00 35.25 ? 47 PRO A HB2 1 ATOM 430 H HB3 . PRO A 1 35 ? 18.567 21.421 24.324 1.00 35.25 ? 47 PRO A HB3 1 ATOM 431 H HG2 . PRO A 1 35 ? 16.595 22.585 25.423 1.00 49.57 ? 47 PRO A HG2 1 ATOM 432 H HG3 . PRO A 1 35 ? 18.021 23.305 25.407 1.00 49.57 ? 47 PRO A HG3 1 ATOM 433 H HD2 . PRO A 1 35 ? 15.825 23.832 23.723 1.00 30.79 ? 47 PRO A HD2 1 ATOM 434 H HD3 . PRO A 1 35 ? 16.823 24.901 24.382 1.00 30.79 ? 47 PRO A HD3 1 ATOM 435 N N . THR A 1 36 ? 16.958 22.269 20.651 1.00 29.07 ? 48 THR A N 1 ATOM 436 C CA . THR A 1 36 ? 16.637 21.535 19.432 1.00 28.70 ? 48 THR A CA 1 ATOM 437 C C . THR A 1 36 ? 17.518 21.929 18.263 1.00 30.24 ? 48 THR A C 1 ATOM 438 O O . THR A 1 36 ? 17.434 21.277 17.211 1.00 35.92 ? 48 THR A O 1 ATOM 439 C CB . THR A 1 36 ? 15.169 21.738 19.025 1.00 30.08 ? 48 THR A CB 1 ATOM 440 O OG1 . THR A 1 36 ? 14.973 23.063 18.527 1.00 29.88 ? 48 THR A OG1 1 ATOM 441 C CG2 . THR A 1 36 ? 14.232 21.481 20.186 1.00 31.54 ? 48 THR A CG2 1 ATOM 442 H H . THR A 1 36 ? 16.457 22.950 20.807 1.00 34.89 ? 48 THR A H 1 ATOM 443 H HA . THR A 1 36 ? 16.770 20.589 19.595 1.00 34.44 ? 48 THR A HA 1 ATOM 444 H HB . THR A 1 36 ? 14.949 21.105 18.323 1.00 36.10 ? 48 THR A HB 1 ATOM 445 H HG1 . THR A 1 36 ? 15.170 23.624 19.120 1.00 35.85 ? 48 THR A HG1 1 ATOM 446 H HG21 . THR A 1 36 ? 13.313 21.615 19.907 1.00 37.85 ? 48 THR A HG21 1 ATOM 447 H HG22 . THR A 1 36 ? 14.337 20.570 20.501 1.00 37.85 ? 48 THR A HG22 1 ATOM 448 H HG23 . THR A 1 36 ? 14.432 22.091 20.914 1.00 37.85 ? 48 THR A HG23 1 ATOM 449 N N . TYR A 1 37 ? 18.358 22.964 18.406 1.00 24.46 ? 49 TYR A N 1 ATOM 450 C CA . TYR A 1 37 ? 19.018 23.538 17.250 1.00 23.64 ? 49 TYR A CA 1 ATOM 451 C C . TYR A 1 37 ? 19.969 22.520 16.631 1.00 35.99 ? 49 TYR A C 1 ATOM 452 O O . TYR A 1 37 ? 20.813 21.935 17.321 1.00 34.15 ? 49 TYR A O 1 ATOM 453 C CB . TYR A 1 37 ? 19.791 24.811 17.614 1.00 25.11 ? 49 TYR A CB 1 ATOM 454 C CG . TYR A 1 37 ? 20.324 25.578 16.420 1.00 23.16 ? 49 TYR A CG 1 ATOM 455 C CD1 . TYR A 1 37 ? 19.626 26.647 15.888 1.00 21.90 ? 49 TYR A CD1 1 ATOM 456 C CD2 . TYR A 1 37 ? 21.530 25.247 15.823 1.00 25.55 ? 49 TYR A CD2 1 ATOM 457 C CE1 . TYR A 1 37 ? 20.098 27.354 14.812 1.00 24.27 ? 49 TYR A CE1 1 ATOM 458 C CE2 . TYR A 1 37 ? 22.010 25.947 14.758 1.00 24.80 ? 49 TYR A CE2 1 ATOM 459 C CZ . TYR A 1 37 ? 21.288 26.987 14.230 1.00 25.45 ? 49 TYR A CZ 1 ATOM 460 O OH . TYR A 1 37 ? 21.756 27.703 13.168 1.00 25.30 ? 49 TYR A OH 1 ATOM 461 H H . TYR A 1 37 ? 18.554 23.339 19.155 1.00 29.35 ? 49 TYR A H 1 ATOM 462 H HA . TYR A 1 37 ? 18.350 23.771 16.587 1.00 28.36 ? 49 TYR A HA 1 ATOM 463 H HB2 . TYR A 1 37 ? 19.201 25.403 18.106 1.00 30.13 ? 49 TYR A HB2 1 ATOM 464 H HB3 . TYR A 1 37 ? 20.548 24.567 18.170 1.00 30.13 ? 49 TYR A HB3 1 ATOM 465 H HD1 . TYR A 1 37 ? 18.813 26.891 16.268 1.00 26.28 ? 49 TYR A HD1 1 ATOM 466 H HD2 . TYR A 1 37 ? 22.024 24.535 16.161 1.00 30.66 ? 49 TYR A HD2 1 ATOM 467 H HE1 . TYR A 1 37 ? 19.608 28.065 14.466 1.00 29.12 ? 49 TYR A HE1 1 ATOM 468 H HE2 . TYR A 1 37 ? 22.817 25.701 14.369 1.00 29.76 ? 49 TYR A HE2 1 ATOM 469 H HH . TYR A 1 37 ? 22.486 27.381 12.904 1.00 30.37 ? 49 TYR A HH 1 ATOM 470 N N . HIS A 1 38 ? 19.842 22.329 15.323 1.00 29.37 ? 50 HIS A N 1 ATOM 471 C CA . HIS A 1 38 ? 20.789 21.486 14.602 1.00 37.47 ? 50 HIS A CA 1 ATOM 472 C C . HIS A 1 38 ? 20.628 21.734 13.117 1.00 35.29 ? 50 HIS A C 1 ATOM 473 O O . HIS A 1 38 ? 19.508 21.889 12.629 1.00 39.47 ? 50 HIS A O 1 ATOM 474 C CB . HIS A 1 38 ? 20.572 20.008 14.927 1.00 33.95 ? 50 HIS A CB 1 ATOM 475 C CG . HIS A 1 38 ? 19.342 19.426 14.313 1.00 45.01 ? 50 HIS A CG 1 ATOM 476 N ND1 . HIS A 1 38 ? 19.327 18.181 13.721 1.00 54.96 ? 50 HIS A ND1 1 ATOM 477 C CD2 . HIS A 1 38 ? 18.083 19.912 14.201 1.00 58.82 ? 50 HIS A CD2 1 ATOM 478 C CE1 . HIS A 1 38 ? 18.110 17.927 13.268 1.00 71.75 ? 50 HIS A CE1 1 ATOM 479 N NE2 . HIS A 1 38 ? 17.336 18.961 13.546 1.00 56.72 ? 50 HIS A NE2 1 ATOM 480 H H . HIS A 1 38 ? 19.223 22.671 14.833 1.00 35.24 ? 50 HIS A H 1 ATOM 481 H HA . HIS A 1 38 ? 21.694 21.726 14.857 1.00 44.96 ? 50 HIS A HA 1 ATOM 482 H HB2 . HIS A 1 38 ? 21.333 19.502 14.602 1.00 40.74 ? 50 HIS A HB2 1 ATOM 483 H HB3 . HIS A 1 38 ? 20.498 19.908 15.889 1.00 40.74 ? 50 HIS A HB3 1 ATOM 484 H HD2 . HIS A 1 38 ? 17.780 20.736 14.508 1.00 70.59 ? 50 HIS A HD2 1 ATOM 485 H HE1 . HIS A 1 38 ? 17.845 17.151 12.829 1.00 86.09 ? 50 HIS A HE1 1 ATOM 486 H HE2 . HIS A 1 38 ? 16.502 19.028 13.350 0.57 68.07 ? 50 HIS A HE2 1 ATOM 487 N N . ILE A 1 39 ? 21.749 21.797 12.408 1.00 33.24 ? 51 ILE A N 1 ATOM 488 C CA . ILE A 1 39 ? 21.701 22.061 10.976 1.00 35.61 ? 51 ILE A CA 1 ATOM 489 C C . ILE A 1 39 ? 21.163 20.832 10.258 1.00 45.32 ? 51 ILE A C 1 ATOM 490 O O . ILE A 1 39 ? 21.605 19.703 10.509 1.00 41.66 ? 51 ILE A O 1 ATOM 491 C CB . ILE A 1 39 ? 23.092 22.441 10.446 1.00 39.47 ? 51 ILE A CB 1 ATOM 492 C CG1 . ILE A 1 39 ? 23.707 23.592 11.258 1.00 41.85 ? 51 ILE A CG1 1 ATOM 493 C CG2 . ILE A 1 39 ? 23.004 22.814 8.981 1.00 38.94 ? 51 ILE A CG2 1 ATOM 494 C CD1 . ILE A 1 39 ? 23.080 24.966 10.989 1.00 38.63 ? 51 ILE A CD1 1 ATOM 495 H H . ILE A 1 39 ? 22.540 21.693 12.727 1.00 39.89 ? 51 ILE A H 1 ATOM 496 H HA . ILE A 1 39 ? 21.097 22.802 10.806 1.00 42.74 ? 51 ILE A HA 1 ATOM 497 H HB . ILE A 1 39 ? 23.670 21.666 10.529 1.00 47.37 ? 51 ILE A HB 1 ATOM 498 H HG12 . ILE A 1 39 ? 23.599 23.399 12.202 1.00 50.22 ? 51 ILE A HG12 1 ATOM 499 H HG13 . ILE A 1 39 ? 24.652 23.652 11.044 1.00 50.22 ? 51 ILE A HG13 1 ATOM 500 H HG21 . ILE A 1 39 ? 23.889 23.050 8.662 1.00 46.73 ? 51 ILE A HG21 1 ATOM 501 H HG22 . ILE A 1 39 ? 22.664 22.055 8.482 1.00 46.73 ? 51 ILE A HG22 1 ATOM 502 H HG23 . ILE A 1 39 ? 22.404 23.570 8.883 1.00 46.73 ? 51 ILE A HG23 1 ATOM 503 H HD11 . ILE A 1 39 ? 23.526 25.629 11.539 1.00 46.36 ? 51 ILE A HD11 1 ATOM 504 H HD12 . ILE A 1 39 ? 23.192 25.185 10.051 1.00 46.36 ? 51 ILE A HD12 1 ATOM 505 H HD13 . ILE A 1 39 ? 22.137 24.931 11.211 1.00 46.36 ? 51 ILE A HD13 1 ATOM 506 N N . THR A 1 40 ? 20.212 21.046 9.354 1.00 38.29 ? 52 THR A N 1 ATOM 507 C CA . THR A 1 40 ? 19.599 19.954 8.617 1.00 38.39 ? 52 THR A CA 1 ATOM 508 C C . THR A 1 40 ? 19.076 20.504 7.301 1.00 44.47 ? 52 THR A C 1 ATOM 509 O O . THR A 1 40 ? 18.842 21.707 7.161 1.00 40.11 ? 52 THR A O 1 ATOM 510 C CB . THR A 1 40 ? 18.493 19.276 9.437 1.00 50.58 ? 52 THR A CB 1 ATOM 511 O OG1 . THR A 1 40 ? 18.039 18.102 8.749 1.00 61.06 ? 52 THR A OG1 1 ATOM 512 C CG2 . THR A 1 40 ? 17.324 20.231 9.681 1.00 47.05 ? 52 THR A CG2 1 ATOM 513 H H . THR A 1 40 ? 19.902 21.822 9.151 1.00 45.95 ? 52 THR A H 1 ATOM 514 H HA . THR A 1 40 ? 20.276 19.288 8.418 1.00 46.07 ? 52 THR A HA 1 ATOM 515 H HB . THR A 1 40 ? 18.854 19.016 10.300 1.00 60.70 ? 52 THR A HB 1 ATOM 516 H HG1 . THR A 1 40 ? 17.433 17.726 9.192 1.00 73.27 ? 52 THR A HG1 1 ATOM 517 H HG21 . THR A 1 40 ? 16.636 19.786 10.200 1.00 56.46 ? 52 THR A HG21 1 ATOM 518 H HG22 . THR A 1 40 ? 17.631 21.012 10.168 1.00 56.46 ? 52 THR A HG22 1 ATOM 519 H HG23 . THR A 1 40 ? 16.947 20.516 8.835 1.00 56.46 ? 52 THR A HG23 1 ATOM 520 N N . ASP A 1 41 ? 18.932 19.607 6.317 1.00 43.40 ? 53 ASP A N 1 ATOM 521 C CA . ASP A 1 41 ? 18.575 20.021 4.962 1.00 42.88 ? 53 ASP A CA 1 ATOM 522 C C . ASP A 1 41 ? 17.228 20.733 4.938 1.00 36.13 ? 53 ASP A C 1 ATOM 523 O O . ASP A 1 41 ? 17.067 21.774 4.294 1.00 34.95 ? 53 ASP A O 1 ATOM 524 C CB . ASP A 1 41 ? 18.529 18.796 4.037 1.00 59.17 ? 53 ASP A CB 1 ATOM 525 C CG . ASP A 1 41 ? 19.895 18.162 3.811 1.00 70.81 ? 53 ASP A CG 1 ATOM 526 O OD1 . ASP A 1 41 ? 20.906 18.897 3.793 1.00 72.22 ? 53 ASP A OD1 1 ATOM 527 O OD2 . ASP A 1 41 ? 19.945 16.923 3.630 1.00 70.90 ? 53 ASP A OD2 1 ATOM 528 H H . ASP A 1 41 ? 19.035 18.758 6.412 1.00 52.08 ? 53 ASP A H 1 ATOM 529 H HA . ASP A 1 41 ? 19.249 20.632 4.625 1.00 51.45 ? 53 ASP A HA 1 ATOM 530 H HB2 . ASP A 1 41 ? 17.950 18.125 4.433 1.00 71.01 ? 53 ASP A HB2 1 ATOM 531 H HB3 . ASP A 1 41 ? 18.178 19.066 3.174 1.00 71.01 ? 53 ASP A HB3 1 ATOM 532 N N . ASP A 1 42 ? 16.233 20.155 5.593 1.00 30.96 ? 54 ASP A N 1 ATOM 533 C CA . ASP A 1 42 ? 14.912 20.764 5.673 1.00 38.71 ? 54 ASP A CA 1 ATOM 534 C C . ASP A 1 42 ? 15.009 21.884 6.708 1.00 33.85 ? 54 ASP A C 1 ATOM 535 O O . ASP A 1 42 ? 15.015 21.620 7.907 1.00 35.21 ? 54 ASP A O 1 ATOM 536 C CB . ASP A 1 42 ? 13.870 19.725 6.068 1.00 39.22 ? 54 ASP A CB 1 ATOM 537 C CG . ASP A 1 42 ? 12.480 20.302 6.111 1.00 46.71 ? 54 ASP A CG 1 ATOM 538 O OD1 . ASP A 1 42 ? 12.368 21.537 5.934 1.00 39.82 ? 54 ASP A OD1 1 ATOM 539 O OD2 . ASP A 1 42 ? 11.513 19.536 6.334 1.00 46.78 ? 54 ASP A OD2 1 ATOM 540 H H . ASP A 1 42 ? 16.297 19.402 6.004 1.00 37.15 ? 54 ASP A H 1 ATOM 541 H HA . ASP A 1 42 ? 14.669 21.146 4.815 1.00 46.45 ? 54 ASP A HA 1 ATOM 542 H HB2 . ASP A 1 42 ? 13.878 19.004 5.419 1.00 47.07 ? 54 ASP A HB2 1 ATOM 543 H HB3 . ASP A 1 42 ? 14.082 19.382 6.951 1.00 47.07 ? 54 ASP A HB3 1 ATOM 544 N N . ARG A 1 43 ? 15.123 23.128 6.240 1.00 33.28 ? 55 ARG A N 1 ATOM 545 C CA A ARG A 1 43 ? 15.368 24.259 7.128 0.50 34.89 ? 55 ARG A CA 1 ATOM 546 C CA B ARG A 1 43 ? 15.374 24.251 7.134 0.50 34.90 ? 55 ARG A CA 1 ATOM 547 C C . ARG A 1 43 ? 14.200 24.567 8.054 1.00 35.01 ? 55 ARG A C 1 ATOM 548 O O . ARG A 1 43 ? 14.343 25.460 8.903 1.00 33.29 ? 55 ARG A O 1 ATOM 549 C CB A ARG A 1 43 ? 15.687 25.515 6.322 0.50 32.90 ? 55 ARG A CB 1 ATOM 550 C CB B ARG A 1 43 ? 15.768 25.477 6.316 0.50 32.86 ? 55 ARG A CB 1 ATOM 551 C CG A ARG A 1 43 ? 16.867 25.401 5.389 0.50 37.23 ? 55 ARG A CG 1 ATOM 552 C CG B ARG A 1 43 ? 17.144 25.319 5.688 0.50 37.83 ? 55 ARG A CG 1 ATOM 553 C CD A ARG A 1 43 ? 18.130 25.002 6.117 0.50 33.50 ? 55 ARG A CD 1 ATOM 554 C CD B ARG A 1 43 ? 17.656 26.583 5.024 0.50 34.70 ? 55 ARG A CD 1 ATOM 555 N NE A ARG A 1 43 ? 19.307 25.478 5.413 0.50 35.54 ? 55 ARG A NE 1 ATOM 556 N NE B ARG A 1 43 ? 19.078 26.470 4.720 0.50 36.18 ? 55 ARG A NE 1 ATOM 557 C CZ A ARG A 1 43 ? 20.486 24.861 5.406 0.50 38.27 ? 55 ARG A CZ 1 ATOM 558 C CZ B ARG A 1 43 ? 19.779 27.367 4.038 0.50 31.63 ? 55 ARG A CZ 1 ATOM 559 N NH1 A ARG A 1 43 ? 20.658 23.720 6.061 0.50 30.15 ? 55 ARG A NH1 1 ATOM 560 N NH1 B ARG A 1 43 ? 19.197 28.458 3.574 0.50 34.76 ? 55 ARG A NH1 1 ATOM 561 N NH2 A ARG A 1 43 ? 21.494 25.392 4.727 0.50 45.17 ? 55 ARG A NH2 1 ATOM 562 N NH2 B ARG A 1 43 ? 21.072 27.172 3.821 0.50 36.55 ? 55 ARG A NH2 1 ATOM 563 H HA . ARG A 1 43 ? 16.134 24.042 7.691 1.00 41.88 ? 55 ARG A HA 1 ATOM 564 H HB2 A ARG A 1 43 ? 14.912 25.741 5.785 0.50 39.48 ? 55 ARG A HB2 1 ATOM 565 H HB2 B ARG A 1 43 ? 15.123 25.606 5.604 0.50 39.43 ? 55 ARG A HB2 1 ATOM 566 H HB3 A ARG A 1 43 ? 15.875 26.238 6.941 0.50 39.48 ? 55 ARG A HB3 1 ATOM 567 H HB3 B ARG A 1 43 ? 15.787 26.255 6.896 0.50 39.43 ? 55 ARG A HB3 1 ATOM 568 H HG2 A ARG A 1 43 ? 16.678 24.726 4.719 0.50 44.67 ? 55 ARG A HG2 1 ATOM 569 H HG2 B ARG A 1 43 ? 17.777 25.069 6.379 0.50 45.39 ? 55 ARG A HG2 1 ATOM 570 H HG3 A ARG A 1 43 ? 17.021 26.259 4.965 0.50 44.67 ? 55 ARG A HG3 1 ATOM 571 H HG3 B ARG A 1 43 ? 17.102 24.625 5.013 0.50 45.39 ? 55 ARG A HG3 1 ATOM 572 H HD2 A ARG A 1 43 ? 18.126 25.391 7.005 0.50 40.20 ? 55 ARG A HD2 1 ATOM 573 H HD2 B ARG A 1 43 ? 17.176 26.728 4.194 0.50 41.63 ? 55 ARG A HD2 1 ATOM 574 H HD3 A ARG A 1 43 ? 18.177 24.034 6.173 0.50 40.20 ? 55 ARG A HD3 1 ATOM 575 H HD3 B ARG A 1 43 ? 17.530 27.335 5.623 0.50 41.63 ? 55 ARG A HD3 1 ATOM 576 H HE A ARG A 1 43 ? 19.237 26.211 4.969 0.50 42.65 ? 55 ARG A HE 1 ATOM 577 H HE B ARG A 1 43 ? 19.492 25.771 5.002 0.50 43.41 ? 55 ARG A HE 1 ATOM 578 H HH11 A ARG A 1 43 ? 20.004 23.375 6.502 0.50 36.19 ? 55 ARG A HH11 1 ATOM 579 H HH11 B ARG A 1 43 ? 18.359 28.590 3.713 0.50 41.72 ? 55 ARG A HH11 1 ATOM 580 H HH12 A ARG A 1 43 ? 21.423 23.327 6.049 0.50 36.19 ? 55 ARG A HH12 1 ATOM 581 H HH12 B ARG A 1 43 ? 19.656 29.036 3.132 0.50 41.72 ? 55 ARG A HH12 1 ATOM 582 H HH21 A ARG A 1 43 ? 21.383 26.130 4.300 0.50 54.20 ? 55 ARG A HH21 1 ATOM 583 H HH21 B ARG A 1 43 ? 21.456 26.463 4.120 0.50 43.86 ? 55 ARG A HH21 1 ATOM 584 H HH22 A ARG A 1 43 ? 22.258 24.998 4.714 0.50 54.20 ? 55 ARG A HH22 1 ATOM 585 H HH22 B ARG A 1 43 ? 21.526 27.752 3.377 0.50 43.86 ? 55 ARG A HH22 1 ATOM 586 N N . THR A 1 44 ? 13.059 23.868 7.922 1.00 29.94 ? 56 THR A N 1 ATOM 587 C CA . THR A 1 44 ? 11.958 23.987 8.872 1.00 27.45 ? 56 THR A CA 1 ATOM 588 C C . THR A 1 44 ? 12.170 23.095 10.075 1.00 29.62 ? 56 THR A C 1 ATOM 589 O O . THR A 1 44 ? 11.335 23.081 10.982 1.00 31.67 ? 56 THR A O 1 ATOM 590 C CB . THR A 1 44 ? 10.598 23.620 8.233 1.00 37.03 ? 56 THR A CB 1 ATOM 591 O OG1 . THR A 1 44 ? 10.509 22.198 8.067 1.00 36.26 ? 56 THR A OG1 1 ATOM 592 C CG2 . THR A 1 44 ? 10.401 24.292 6.898 1.00 36.65 ? 56 THR A CG2 1 ATOM 593 H H . THR A 1 44 ? 12.905 23.315 7.282 1.00 35.92 ? 56 THR A H 1 ATOM 594 H HA . THR A 1 44 ? 11.907 24.904 9.183 1.00 32.94 ? 56 THR A HA 1 ATOM 595 H HB . THR A 1 44 ? 9.885 23.913 8.822 1.00 44.44 ? 56 THR A HB 1 ATOM 596 H HG1 . THR A 1 44 ? 11.128 21.927 7.569 1.00 43.51 ? 56 THR A HG1 1 ATOM 597 H HG21 . THR A 1 44 ? 9.541 24.042 6.525 1.00 43.98 ? 56 THR A HG21 1 ATOM 598 H HG22 . THR A 1 44 ? 10.430 25.255 7.004 1.00 43.98 ? 56 THR A HG22 1 ATOM 599 H HG23 . THR A 1 44 ? 11.101 24.020 6.284 1.00 43.98 ? 56 THR A HG23 1 ATOM 600 N N . LYS A 1 45 ? 13.267 22.335 10.089 1.00 32.95 ? 57 LYS A N 1 ATOM 601 C CA . LYS A 1 45 ? 13.597 21.452 11.188 1.00 33.41 ? 57 LYS A CA 1 ATOM 602 C C . LYS A 1 45 ? 14.912 21.845 11.861 1.00 28.29 ? 57 LYS A C 1 ATOM 603 O O . LYS A 1 45 ? 15.406 21.100 12.714 1.00 31.29 ? 57 LYS A O 1 ATOM 604 C CB . LYS A 1 45 ? 13.660 20.005 10.681 1.00 39.87 ? 57 LYS A CB 1 ATOM 605 C CG . LYS A 1 45 ? 12.319 19.507 10.131 1.00 41.79 ? 57 LYS A CG 1 ATOM 606 C CD . LYS A 1 45 ? 12.394 18.046 9.723 1.00 78.63 ? 57 LYS A CD 1 ATOM 607 C CE . LYS A 1 45 ? 11.052 17.357 9.907 1.00 81.66 ? 57 LYS A CE 1 ATOM 608 N NZ . LYS A 1 45 ? 9.929 18.174 9.375 1.00 86.31 ? 57 LYS A NZ 1 ATOM 609 H H . LYS A 1 45 ? 13.845 22.320 9.452 1.00 39.54 ? 57 LYS A H 1 ATOM 610 H HA . LYS A 1 45 ? 12.895 21.504 11.855 1.00 40.09 ? 57 LYS A HA 1 ATOM 611 H HB2 . LYS A 1 45 ? 14.315 19.949 9.967 1.00 47.84 ? 57 LYS A HB2 1 ATOM 612 H HB3 . LYS A 1 45 ? 13.918 19.425 11.414 1.00 47.84 ? 57 LYS A HB3 1 ATOM 613 H HG2 . LYS A 1 45 ? 11.638 19.596 10.817 1.00 50.15 ? 57 LYS A HG2 1 ATOM 614 H HG3 . LYS A 1 45 ? 12.079 20.029 9.350 1.00 50.15 ? 57 LYS A HG3 1 ATOM 615 H HD2 . LYS A 1 45 ? 12.641 17.987 8.787 1.00 94.35 ? 57 LYS A HD2 1 ATOM 616 H HD3 . LYS A 1 45 ? 13.049 17.592 10.274 1.00 94.35 ? 57 LYS A HD3 1 ATOM 617 H HE2 . LYS A 1 45 ? 11.061 16.510 9.434 1.00 98.00 ? 57 LYS A HE2 1 ATOM 618 H HE3 . LYS A 1 45 ? 10.897 17.210 10.853 1.00 98.00 ? 57 LYS A HE3 1 ATOM 619 H HZ1 . LYS A 1 45 ? 9.158 17.746 9.496 1.00 103.57 ? 57 LYS A HZ1 1 ATOM 620 H HZ2 . LYS A 1 45 ? 9.895 18.956 9.797 1.00 103.57 ? 57 LYS A HZ2 1 ATOM 621 H HZ3 . LYS A 1 45 ? 10.045 18.319 8.504 1.00 103.57 ? 57 LYS A HZ3 1 ATOM 622 N N . VAL A 1 46 ? 15.493 22.984 11.494 1.00 29.36 ? 58 VAL A N 1 ATOM 623 C CA . VAL A 1 46 ? 16.724 23.429 12.155 1.00 28.50 ? 58 VAL A CA 1 ATOM 624 C C . VAL A 1 46 ? 16.469 23.727 13.628 1.00 28.88 ? 58 VAL A C 1 ATOM 625 O O . VAL A 1 46 ? 17.270 23.362 14.498 1.00 27.63 ? 58 VAL A O 1 ATOM 626 C CB . VAL A 1 46 ? 17.315 24.643 11.420 1.00 28.39 ? 58 VAL A CB 1 ATOM 627 C CG1 . VAL A 1 46 ? 18.467 25.303 12.225 1.00 27.94 ? 58 VAL A CG1 1 ATOM 628 C CG2 . VAL A 1 46 ? 17.832 24.215 10.064 1.00 31.31 ? 58 VAL A CG2 1 ATOM 629 H H . VAL A 1 46 ? 15.203 23.510 10.879 1.00 35.23 ? 58 VAL A H 1 ATOM 630 H HA . VAL A 1 46 ? 17.376 22.713 12.110 1.00 34.20 ? 58 VAL A HA 1 ATOM 631 H HB . VAL A 1 46 ? 16.620 25.305 11.285 1.00 34.07 ? 58 VAL A HB 1 ATOM 632 H HG11 . VAL A 1 46 ? 18.808 26.061 11.724 1.00 33.52 ? 58 VAL A HG11 1 ATOM 633 H HG12 . VAL A 1 46 ? 18.124 25.599 13.082 1.00 33.52 ? 58 VAL A HG12 1 ATOM 634 H HG13 . VAL A 1 46 ? 19.173 24.650 12.359 1.00 33.52 ? 58 VAL A HG13 1 ATOM 635 H HG21 . VAL A 1 46 ? 18.203 24.987 9.610 1.00 37.57 ? 58 VAL A HG21 1 ATOM 636 H HG22 . VAL A 1 46 ? 18.520 23.541 10.187 1.00 37.57 ? 58 VAL A HG22 1 ATOM 637 H HG23 . VAL A 1 46 ? 17.098 23.847 9.548 1.00 37.57 ? 58 VAL A HG23 1 ATOM 638 N N . CYS A 1 47 ? 15.346 24.368 13.943 1.00 29.30 ? 59 CYS A N 1 ATOM 639 C CA . CYS A 1 47 ? 15.085 24.769 15.321 1.00 26.90 ? 59 CYS A CA 1 ATOM 640 C C . CYS A 1 47 ? 13.585 24.854 15.547 1.00 23.81 ? 59 CYS A C 1 ATOM 641 O O . CYS A 1 47 ? 12.858 25.438 14.733 1.00 27.08 ? 59 CYS A O 1 ATOM 642 C CB . CYS A 1 47 ? 15.747 26.129 15.631 1.00 24.65 ? 59 CYS A CB 1 ATOM 643 S SG . CYS A 1 47 ? 15.106 27.477 14.625 1.00 31.16 ? 59 CYS A SG 1 ATOM 644 H H . CYS A 1 47 ? 14.726 24.579 13.384 1.00 35.16 ? 59 CYS A H 1 ATOM 645 H HA . CYS A 1 47 ? 15.450 24.105 15.925 1.00 32.28 ? 59 CYS A HA 1 ATOM 646 H HB2 . CYS A 1 47 ? 15.589 26.350 16.562 1.00 29.58 ? 59 CYS A HB2 1 ATOM 647 H HB3 . CYS A 1 47 ? 16.700 26.059 15.465 1.00 29.58 ? 59 CYS A HB3 1 ATOM 648 N N . ALA A 1 48 ? 13.142 24.304 16.670 1.00 21.49 ? 60 ALA A N 1 ATOM 649 C CA . ALA A 1 48 ? 11.739 24.387 17.039 1.00 27.83 ? 60 ALA A CA 1 ATOM 650 C C . ALA A 1 48 ? 11.306 25.835 17.248 1.00 28.56 ? 60 ALA A C 1 ATOM 651 O O . ALA A 1 48 ? 10.127 26.163 17.085 1.00 25.97 ? 60 ALA A O 1 ATOM 652 C CB . ALA A 1 48 ? 11.489 23.575 18.302 1.00 28.54 ? 60 ALA A CB 1 ATOM 653 H H . ALA A 1 48 ? 13.633 23.879 17.234 1.00 25.79 ? 60 ALA A H 1 ATOM 654 H HA . ALA A 1 48 ? 11.200 24.011 16.326 1.00 33.40 ? 60 ALA A HA 1 ATOM 655 H HB1 . ALA A 1 48 ? 10.550 23.638 18.537 1.00 34.25 ? 60 ALA A HB1 1 ATOM 656 H HB2 . ALA A 1 48 ? 11.727 22.649 18.134 1.00 34.25 ? 60 ALA A HB2 1 ATOM 657 H HB3 . ALA A 1 48 ? 12.035 23.932 19.020 1.00 34.25 ? 60 ALA A HB3 1 ATOM 658 N N . SER A 1 49 ? 12.237 26.712 17.625 1.00 25.54 ? 61 SER A N 1 ATOM 659 C CA . SER A 1 49 ? 11.850 28.094 17.886 1.00 25.53 ? 61 SER A CA 1 ATOM 660 C C . SER A 1 49 ? 11.481 28.865 16.625 1.00 31.09 ? 61 SER A C 1 ATOM 661 O O . SER A 1 49 ? 10.867 29.935 16.744 1.00 25.03 ? 61 SER A O 1 ATOM 662 C CB . SER A 1 49 ? 12.968 28.821 18.648 1.00 24.14 ? 61 SER A CB 1 ATOM 663 O OG . SER A 1 49 ? 14.240 28.664 18.027 1.00 24.11 ? 61 SER A OG 1 ATOM 664 H H . SER A 1 49 ? 13.072 26.538 17.734 1.00 30.65 ? 61 SER A H 1 ATOM 665 H HA . SER A 1 49 ? 11.067 28.087 18.458 1.00 30.64 ? 61 SER A HA 1 ATOM 666 H HB2 . SER A 1 49 ? 12.754 29.767 18.684 1.00 28.97 ? 61 SER A HB2 1 ATOM 667 H HB3 . SER A 1 49 ? 13.015 28.462 19.548 1.00 28.97 ? 61 SER A HB3 1 ATOM 668 H HG . SER A 1 49 ? 14.443 27.850 17.991 1.00 28.93 ? 61 SER A HG 1 ATOM 669 N N . SER A 1 50 ? 11.808 28.370 15.423 1.00 23.91 ? 62 SER A N 1 ATOM 670 C CA . SER A 1 50 ? 11.284 29.032 14.236 1.00 26.25 ? 62 SER A CA 1 ATOM 671 C C . SER A 1 50 ? 9.833 28.645 13.951 1.00 24.83 ? 62 SER A C 1 ATOM 672 O O . SER A 1 50 ? 9.232 29.215 13.033 1.00 27.21 ? 62 SER A O 1 ATOM 673 C CB . SER A 1 50 ? 12.143 28.724 13.007 1.00 33.39 ? 62 SER A CB 1 ATOM 674 O OG . SER A 1 50 ? 11.896 27.404 12.560 1.00 30.53 ? 62 SER A OG 1 ATOM 675 H H . SER A 1 50 ? 12.307 27.684 15.277 1.00 28.70 ? 62 SER A H 1 ATOM 676 H HA . SER A 1 50 ? 11.310 29.991 14.380 1.00 31.50 ? 62 SER A HA 1 ATOM 677 H HB2 . SER A 1 50 ? 11.919 29.347 12.298 1.00 40.07 ? 62 SER A HB2 1 ATOM 678 H HB3 . SER A 1 50 ? 13.079 28.810 13.243 1.00 40.07 ? 62 SER A HB3 1 ATOM 679 H HG . SER A 1 50 ? 12.368 27.237 11.885 1.00 36.64 ? 62 SER A HG 1 ATOM 680 N N . LYS A 1 51 ? 9.278 27.710 14.719 1.00 25.50 ? 63 LYS A N 1 ATOM 681 C CA . LYS A 1 51 ? 7.867 27.354 14.655 1.00 31.32 ? 63 LYS A CA 1 ATOM 682 C C . LYS A 1 51 ? 7.461 27.051 13.215 1.00 32.99 ? 63 LYS A C 1 ATOM 683 O O . LYS A 1 51 ? 6.463 27.544 12.704 1.00 29.76 ? 63 LYS A O 1 ATOM 684 C CB . LYS A 1 51 ? 7.012 28.463 15.274 1.00 26.59 ? 63 LYS A CB 1 ATOM 685 C CG . LYS A 1 51 ? 7.325 28.635 16.766 1.00 33.82 ? 63 LYS A CG 1 ATOM 686 C CD . LYS A 1 51 ? 6.659 29.847 17.360 1.00 34.43 ? 63 LYS A CD 1 ATOM 687 C CE . LYS A 1 51 ? 7.478 31.093 17.119 1.00 38.06 ? 63 LYS A CE 1 ATOM 688 N NZ . LYS A 1 51 ? 8.634 31.171 18.036 1.00 29.79 ? 63 LYS A NZ 1 ATOM 689 H H . LYS A 1 51 ? 9.715 27.255 15.304 1.00 30.60 ? 63 LYS A H 1 ATOM 690 H HA . LYS A 1 51 ? 7.726 26.548 15.176 1.00 37.58 ? 63 LYS A HA 1 ATOM 691 H HB2 . LYS A 1 51 ? 7.198 29.302 14.825 1.00 31.91 ? 63 LYS A HB2 1 ATOM 692 H HB3 . LYS A 1 51 ? 6.073 28.234 15.184 1.00 31.91 ? 63 LYS A HB3 1 ATOM 693 H HG2 . LYS A 1 51 ? 7.012 27.853 17.248 1.00 40.58 ? 63 LYS A HG2 1 ATOM 694 H HG3 . LYS A 1 51 ? 8.284 28.733 16.879 1.00 40.58 ? 63 LYS A HG3 1 ATOM 695 H HD2 . LYS A 1 51 ? 5.789 29.969 16.948 1.00 41.31 ? 63 LYS A HD2 1 ATOM 696 H HD3 . LYS A 1 51 ? 6.564 29.724 18.317 1.00 41.31 ? 63 LYS A HD3 1 ATOM 697 H HE2 . LYS A 1 51 ? 7.812 31.085 16.208 1.00 45.67 ? 63 LYS A HE2 1 ATOM 698 H HE3 . LYS A 1 51 ? 6.921 31.874 17.264 1.00 45.67 ? 63 LYS A HE3 1 ATOM 699 H HZ1 . LYS A 1 51 ? 9.100 31.912 17.875 1.00 35.74 ? 63 LYS A HZ1 1 ATOM 700 H HZ2 . LYS A 1 51 ? 8.352 31.184 18.880 1.00 35.74 ? 63 LYS A HZ2 1 ATOM 701 H HZ3 . LYS A 1 51 ? 9.163 30.465 17.919 1.00 35.74 ? 63 LYS A HZ3 1 ATOM 702 N N . GLY A 1 52 ? 8.287 26.260 12.541 1.00 31.24 ? 64 GLY A N 1 ATOM 703 C CA . GLY A 1 52 ? 7.955 25.774 11.218 1.00 32.82 ? 64 GLY A CA 1 ATOM 704 C C . GLY A 1 52 ? 8.413 26.647 10.084 1.00 34.69 ? 64 GLY A C 1 ATOM 705 O O . GLY A 1 52 ? 8.343 26.214 8.929 1.00 35.56 ? 64 GLY A O 1 ATOM 706 H H . GLY A 1 52 ? 9.050 25.991 12.833 1.00 37.49 ? 64 GLY A H 1 ATOM 707 H HA2 . GLY A 1 52 ? 8.350 24.897 11.098 1.00 39.38 ? 64 GLY A HA2 1 ATOM 708 H HA3 . GLY A 1 52 ? 6.991 25.680 11.152 1.00 39.38 ? 64 GLY A HA3 1 ATOM 709 N N . ALA A 1 53 ? 8.864 27.865 10.358 1.00 29.35 ? 65 ALA A N 1 ATOM 710 C CA . ALA A 1 53 ? 9.457 28.662 9.309 1.00 25.99 ? 65 ALA A CA 1 ATOM 711 C C . ALA A 1 53 ? 10.801 28.076 8.902 1.00 33.17 ? 65 ALA A C 1 ATOM 712 O O . ALA A 1 53 ? 11.457 27.360 9.666 1.00 32.49 ? 65 ALA A O 1 ATOM 713 C CB . ALA A 1 53 ? 9.646 30.105 9.754 1.00 30.88 ? 65 ALA A CB 1 ATOM 714 H H . ALA A 1 53 ? 8.837 28.242 11.131 1.00 35.22 ? 65 ALA A H 1 ATOM 715 H HA . ALA A 1 53 ? 8.875 28.656 8.534 1.00 31.19 ? 65 ALA A HA 1 ATOM 716 H HB1 . ALA A 1 53 ? 10.044 30.609 9.028 1.00 37.05 ? 65 ALA A HB1 1 ATOM 717 H HB2 . ALA A 1 53 ? 8.781 30.480 9.982 1.00 37.05 ? 65 ALA A HB2 1 ATOM 718 H HB3 . ALA A 1 53 ? 10.229 30.123 10.529 1.00 37.05 ? 65 ALA A HB3 1 ATOM 719 N N . ASN A 1 54 ? 11.193 28.373 7.669 1.00 31.99 ? 66 ASN A N 1 ATOM 720 C CA . ASN A 1 54 ? 12.524 28.022 7.200 1.00 34.97 ? 66 ASN A CA 1 ATOM 721 C C . ASN A 1 54 ? 13.536 28.934 7.866 1.00 31.13 ? 66 ASN A C 1 ATOM 722 O O . ASN A 1 54 ? 13.494 30.153 7.674 1.00 33.25 ? 66 ASN A O 1 ATOM 723 C CB . ASN A 1 54 ? 12.627 28.174 5.684 1.00 38.08 ? 66 ASN A CB 1 ATOM 724 C CG . ASN A 1 54 ? 12.148 26.950 4.943 1.00 42.53 ? 66 ASN A CG 1 ATOM 725 O OD1 . ASN A 1 54 ? 12.562 25.833 5.236 1.00 30.65 ? 66 ASN A OD1 1 ATOM 726 N ND2 . ASN A 1 54 ? 11.254 27.151 3.995 1.00 46.11 ? 66 ASN A ND2 1 ATOM 727 H H . ASN A 1 54 ? 10.707 28.776 7.086 1.00 38.38 ? 66 ASN A H 1 ATOM 728 H HA . ASN A 1 54 ? 12.725 27.104 7.437 1.00 41.97 ? 66 ASN A HA 1 ATOM 729 H HB2 . ASN A 1 54 ? 12.083 28.926 5.403 1.00 45.70 ? 66 ASN A HB2 1 ATOM 730 H HB3 . ASN A 1 54 ? 13.554 28.326 5.444 1.00 45.70 ? 66 ASN A HB3 1 ATOM 731 H HD21 . ASN A 1 54 ? 10.978 27.945 3.816 1.00 55.33 ? 66 ASN A HD21 1 ATOM 732 N N . ALA A 1 55 ? 14.480 28.350 8.600 1.00 31.27 ? 67 ALA A N 1 ATOM 733 C CA . ALA A 1 55 ? 15.665 29.110 8.969 1.00 29.82 ? 67 ALA A CA 1 ATOM 734 C C . ALA A 1 55 ? 16.200 29.829 7.739 1.00 35.09 ? 67 ALA A C 1 ATOM 735 O O . ALA A 1 55 ? 16.153 29.306 6.626 1.00 37.12 ? 67 ALA A O 1 ATOM 736 C CB . ALA A 1 55 ? 16.723 28.182 9.574 1.00 34.50 ? 67 ALA A CB 1 ATOM 737 H H . ALA A 1 55 ? 14.458 27.540 8.889 1.00 37.53 ? 67 ALA A H 1 ATOM 738 H HA . ALA A 1 55 ? 15.426 29.776 9.633 1.00 35.79 ? 67 ALA A HA 1 ATOM 739 H HB1 . ALA A 1 55 ? 17.503 28.707 9.813 1.00 41.40 ? 67 ALA A HB1 1 ATOM 740 H HB2 . ALA A 1 55 ? 16.355 27.758 10.365 1.00 41.40 ? 67 ALA A HB2 1 ATOM 741 H HB3 . ALA A 1 55 ? 16.964 27.509 8.919 1.00 41.40 ? 67 ALA A HB3 1 ATOM 742 N N . SER A 1 56 ? 16.686 31.050 7.938 1.00 32.29 ? 68 SER A N 1 ATOM 743 C CA . SER A 1 56 ? 17.028 31.919 6.821 1.00 31.98 ? 68 SER A CA 1 ATOM 744 C C . SER A 1 56 ? 18.398 31.582 6.223 1.00 42.61 ? 68 SER A C 1 ATOM 745 O O . SER A 1 56 ? 18.551 31.497 4.996 1.00 37.34 ? 68 SER A O 1 ATOM 746 C CB . SER A 1 56 ? 16.978 33.379 7.284 1.00 35.17 ? 68 SER A CB 1 ATOM 747 O OG . SER A 1 56 ? 17.383 34.247 6.253 1.00 52.95 ? 68 SER A OG 1 ATOM 748 H H . SER A 1 56 ? 16.827 31.399 8.712 1.00 38.74 ? 68 SER A H 1 ATOM 749 H HA . SER A 1 56 ? 16.364 31.806 6.122 1.00 38.37 ? 68 SER A HA 1 ATOM 750 H HB2 . SER A 1 56 ? 16.069 33.598 7.541 1.00 42.21 ? 68 SER A HB2 1 ATOM 751 H HB3 . SER A 1 56 ? 17.573 33.491 8.042 1.00 42.21 ? 68 SER A HB3 1 ATOM 752 H HG . SER A 1 56 ? 17.351 35.043 6.519 1.00 63.54 ? 68 SER A HG 1 ATOM 753 N N . ASN A 1 57 ? 19.403 31.397 7.062 1.00 33.78 ? 69 ASN A N 1 ATOM 754 C CA . ASN A 1 57 ? 20.756 31.121 6.607 1.00 30.76 ? 69 ASN A CA 1 ATOM 755 C C . ASN A 1 57 ? 21.541 30.566 7.778 1.00 23.07 ? 69 ASN A C 1 ATOM 756 O O . ASN A 1 57 ? 22.506 31.193 8.233 1.00 33.83 ? 69 ASN A O 1 ATOM 757 C CB . ASN A 1 57 ? 21.439 32.372 6.058 1.00 33.59 ? 69 ASN A CB 1 ATOM 758 C CG . ASN A 1 57 ? 22.835 32.077 5.516 1.00 44.02 ? 69 ASN A CG 1 ATOM 759 O OD1 . ASN A 1 57 ? 23.170 30.925 5.219 1.00 41.49 ? 69 ASN A OD1 1 ATOM 760 N ND2 . ASN A 1 57 ? 23.659 33.109 5.421 1.00 38.84 ? 69 ASN A ND2 1 ATOM 761 H H . ASN A 1 57 ? 19.326 31.428 7.918 1.00 40.54 ? 69 ASN A H 1 ATOM 762 H HA . ASN A 1 57 ? 20.732 30.450 5.907 1.00 36.91 ? 69 ASN A HA 1 ATOM 763 H HB2 . ASN A 1 57 ? 20.904 32.734 5.334 1.00 40.31 ? 69 ASN A HB2 1 ATOM 764 H HB3 . ASN A 1 57 ? 21.523 33.026 6.770 1.00 40.31 ? 69 ASN A HB3 1 ATOM 765 H HD21 . ASN A 1 57 ? 24.457 32.995 5.121 1.00 46.61 ? 69 ASN A HD21 1 ATOM 766 H HD22 . ASN A 1 57 ? 23.397 33.892 5.658 1.00 46.61 ? 69 ASN A HD22 1 ATOM 767 N N . PRO A 1 58 ? 21.164 29.395 8.271 1.00 29.51 ? 70 PRO A N 1 ATOM 768 C CA . PRO A 1 58 ? 21.632 28.953 9.581 1.00 28.25 ? 70 PRO A CA 1 ATOM 769 C C . PRO A 1 58 ? 23.079 28.499 9.553 1.00 39.01 ? 70 PRO A C 1 ATOM 770 O O . PRO A 1 58 ? 23.569 27.949 8.563 1.00 36.74 ? 70 PRO A O 1 ATOM 771 C CB . PRO A 1 58 ? 20.699 27.783 9.904 1.00 29.98 ? 70 PRO A CB 1 ATOM 772 C CG . PRO A 1 58 ? 20.349 27.229 8.561 1.00 35.70 ? 70 PRO A CG 1 ATOM 773 C CD . PRO A 1 58 ? 20.238 28.424 7.662 1.00 32.88 ? 70 PRO A CD 1 ATOM 774 H HA . PRO A 1 58 ? 21.520 29.654 10.241 1.00 33.90 ? 70 PRO A HA 1 ATOM 775 H HB2 . PRO A 1 58 ? 21.168 27.125 10.441 1.00 35.98 ? 70 PRO A HB2 1 ATOM 776 H HB3 . PRO A 1 58 ? 19.909 28.108 10.363 1.00 35.98 ? 70 PRO A HB3 1 ATOM 777 H HG2 . PRO A 1 58 ? 21.054 26.636 8.258 1.00 42.84 ? 70 PRO A HG2 1 ATOM 778 H HG3 . PRO A 1 58 ? 19.502 26.758 8.612 1.00 42.84 ? 70 PRO A HG3 1 ATOM 779 H HD2 . PRO A 1 58 ? 20.526 28.200 6.763 1.00 39.45 ? 70 PRO A HD2 1 ATOM 780 H HD3 . PRO A 1 58 ? 19.331 28.770 7.669 1.00 39.45 ? 70 PRO A HD3 1 ATOM 781 N N . GLY A 1 59 ? 23.753 28.717 10.675 1.00 31.89 ? 71 GLY A N 1 ATOM 782 C CA . GLY A 1 59 ? 25.111 28.265 10.863 1.00 28.98 ? 71 GLY A CA 1 ATOM 783 C C . GLY A 1 59 ? 25.321 27.743 12.264 1.00 30.04 ? 71 GLY A C 1 ATOM 784 O O . GLY A 1 59 ? 24.375 27.580 13.040 1.00 29.53 ? 71 GLY A O 1 ATOM 785 H H . GLY A 1 59 ? 23.432 29.135 11.355 1.00 38.27 ? 71 GLY A H 1 ATOM 786 H HA2 . GLY A 1 59 ? 25.310 27.555 10.233 1.00 34.78 ? 71 GLY A HA2 1 ATOM 787 H HA3 . GLY A 1 59 ? 25.725 29.000 10.709 1.00 34.78 ? 71 GLY A HA3 1 ATOM 788 N N . PRO A 1 60 ? 26.578 27.455 12.610 1.00 26.86 ? 72 PRO A N 1 ATOM 789 C CA . PRO A 1 60 ? 26.858 26.856 13.916 1.00 24.89 ? 72 PRO A CA 1 ATOM 790 C C . PRO A 1 60 ? 26.541 27.766 15.088 1.00 25.31 ? 72 PRO A C 1 ATOM 791 O O . PRO A 1 60 ? 26.342 27.261 16.194 1.00 27.89 ? 72 PRO A O 1 ATOM 792 C CB . PRO A 1 60 ? 28.365 26.549 13.848 1.00 32.59 ? 72 PRO A CB 1 ATOM 793 C CG . PRO A 1 60 ? 28.877 27.356 12.729 1.00 36.41 ? 72 PRO A CG 1 ATOM 794 C CD . PRO A 1 60 ? 27.777 27.517 11.757 1.00 33.24 ? 72 PRO A CD 1 ATOM 795 H HA . PRO A 1 60 ? 26.368 26.024 14.015 1.00 29.87 ? 72 PRO A HA 1 ATOM 796 H HB2 . PRO A 1 60 ? 28.789 26.812 14.681 1.00 39.11 ? 72 PRO A HB2 1 ATOM 797 H HB3 . PRO A 1 60 ? 28.499 25.604 13.679 1.00 39.11 ? 72 PRO A HB3 1 ATOM 798 H HG2 . PRO A 1 60 ? 29.161 28.221 13.062 1.00 43.69 ? 72 PRO A HG2 1 ATOM 799 H HG3 . PRO A 1 60 ? 29.624 26.893 12.317 1.00 43.69 ? 72 PRO A HG3 1 ATOM 800 H HD2 . PRO A 1 60 ? 27.837 28.379 11.316 1.00 39.89 ? 72 PRO A HD2 1 ATOM 801 H HD3 . PRO A 1 60 ? 27.778 26.787 11.118 1.00 39.89 ? 72 PRO A HD3 1 ATOM 802 N N . PHE A 1 61 ? 26.531 29.079 14.893 1.00 23.99 ? 73 PHE A N 1 ATOM 803 C CA . PHE A 1 61 ? 26.236 29.993 15.987 1.00 29.08 ? 73 PHE A CA 1 ATOM 804 C C . PHE A 1 61 ? 24.803 30.505 15.955 1.00 27.60 ? 73 PHE A C 1 ATOM 805 O O . PHE A 1 61 ? 24.424 31.290 16.833 1.00 25.19 ? 73 PHE A O 1 ATOM 806 C CB . PHE A 1 61 ? 27.206 31.160 15.964 1.00 23.54 ? 73 PHE A CB 1 ATOM 807 C CG . PHE A 1 61 ? 28.632 30.728 16.133 1.00 27.03 ? 73 PHE A CG 1 ATOM 808 C CD1 . PHE A 1 61 ? 29.124 30.408 17.377 1.00 28.14 ? 73 PHE A CD1 1 ATOM 809 C CD2 . PHE A 1 61 ? 29.454 30.601 15.040 1.00 26.44 ? 73 PHE A CD2 1 ATOM 810 C CE1 . PHE A 1 61 ? 30.445 29.977 17.540 1.00 35.47 ? 73 PHE A CE1 1 ATOM 811 C CE2 . PHE A 1 61 ? 30.792 30.169 15.188 1.00 32.95 ? 73 PHE A CE2 1 ATOM 812 C CZ . PHE A 1 61 ? 31.274 29.858 16.432 1.00 31.99 ? 73 PHE A CZ 1 ATOM 813 H H . PHE A 1 61 ? 26.692 29.465 14.141 1.00 28.79 ? 73 PHE A H 1 ATOM 814 H HA . PHE A 1 61 ? 26.361 29.523 16.826 1.00 34.89 ? 73 PHE A HA 1 ATOM 815 H HB2 . PHE A 1 61 ? 27.130 31.619 15.113 1.00 28.24 ? 73 PHE A HB2 1 ATOM 816 H HB3 . PHE A 1 61 ? 26.988 31.767 16.689 1.00 28.24 ? 73 PHE A HB3 1 ATOM 817 H HD1 . PHE A 1 61 ? 28.571 30.481 18.121 1.00 33.77 ? 73 PHE A HD1 1 ATOM 818 H HD2 . PHE A 1 61 ? 29.129 30.807 14.193 1.00 31.73 ? 73 PHE A HD2 1 ATOM 819 H HE1 . PHE A 1 61 ? 30.767 29.771 18.388 1.00 42.56 ? 73 PHE A HE1 1 ATOM 820 H HE2 . PHE A 1 61 ? 31.343 30.093 14.443 1.00 39.54 ? 73 PHE A HE2 1 ATOM 821 H HZ . PHE A 1 61 ? 32.155 29.579 16.536 1.00 38.39 ? 73 PHE A HZ 1 ATOM 822 N N . GLY A 1 62 ? 24.001 30.074 14.981 1.00 22.70 ? 74 GLY A N 1 ATOM 823 C CA . GLY A 1 62 ? 22.568 30.280 15.037 1.00 22.44 ? 74 GLY A CA 1 ATOM 824 C C . GLY A 1 62 ? 22.032 30.830 13.741 1.00 28.23 ? 74 GLY A C 1 ATOM 825 O O . GLY A 1 62 ? 22.700 30.811 12.705 1.00 25.31 ? 74 GLY A O 1 ATOM 826 H H . GLY A 1 62 ? 24.269 29.659 14.277 1.00 27.24 ? 74 GLY A H 1 ATOM 827 H HA2 . GLY A 1 62 ? 22.125 29.437 15.223 1.00 26.93 ? 74 GLY A HA2 1 ATOM 828 H HA3 . GLY A 1 62 ? 22.357 30.904 15.749 1.00 26.93 ? 74 GLY A HA3 1 ATOM 829 N N . ASP A 1 63 ? 20.813 31.368 13.813 1.00 23.71 ? 75 ASP A N 1 ATOM 830 C CA . ASP A 1 63 ? 20.116 31.922 12.664 1.00 24.31 ? 75 ASP A CA 1 ATOM 831 C C . ASP A 1 63 ? 19.151 32.978 13.175 1.00 18.96 ? 75 ASP A C 1 ATOM 832 O O . ASP A 1 63 ? 18.656 32.863 14.301 1.00 21.14 ? 75 ASP A O 1 ATOM 833 C CB . ASP A 1 63 ? 19.324 30.822 11.943 1.00 25.38 ? 75 ASP A CB 1 ATOM 834 C CG . ASP A 1 63 ? 18.721 31.301 10.674 1.00 31.59 ? 75 ASP A CG 1 ATOM 835 O OD1 . ASP A 1 63 ? 19.501 31.482 9.711 1.00 31.20 ? 75 ASP A OD1 1 ATOM 836 O OD2 . ASP A 1 63 ? 17.486 31.515 10.642 1.00 28.70 ? 75 ASP A OD2 1 ATOM 837 H H . ASP A 1 63 ? 20.361 31.423 14.542 1.00 28.45 ? 75 ASP A H 1 ATOM 838 H HA . ASP A 1 63 ? 20.745 32.327 12.047 1.00 29.17 ? 75 ASP A HA 1 ATOM 839 H HB2 . ASP A 1 63 ? 19.920 30.086 11.735 1.00 30.46 ? 75 ASP A HB2 1 ATOM 840 H HB3 . ASP A 1 63 ? 18.607 30.517 12.521 1.00 30.46 ? 75 ASP A HB3 1 ATOM 841 N N . VAL A 1 64 ? 18.847 33.972 12.341 1.00 22.05 ? 76 VAL A N 1 ATOM 842 C CA . VAL A 1 64 ? 17.975 35.049 12.820 1.00 23.68 ? 76 VAL A CA 1 ATOM 843 C C . VAL A 1 64 ? 16.563 34.580 13.118 1.00 29.38 ? 76 VAL A C 1 ATOM 844 O O . VAL A 1 64 ? 15.854 35.261 13.877 1.00 23.20 ? 76 VAL A O 1 ATOM 845 C CB . VAL A 1 64 ? 17.929 36.239 11.856 1.00 24.89 ? 76 VAL A CB 1 ATOM 846 C CG1 . VAL A 1 64 ? 19.292 36.887 11.787 1.00 27.50 ? 76 VAL A CG1 1 ATOM 847 C CG2 . VAL A 1 64 ? 17.447 35.844 10.459 1.00 27.10 ? 76 VAL A CG2 1 ATOM 848 H H . VAL A 1 64 ? 19.117 34.047 11.529 1.00 26.46 ? 76 VAL A H 1 ATOM 849 H HA . VAL A 1 64 ? 18.343 35.379 13.654 1.00 28.42 ? 76 VAL A HA 1 ATOM 850 H HB . VAL A 1 64 ? 17.308 36.897 12.205 1.00 29.87 ? 76 VAL A HB 1 ATOM 851 H HG11 . VAL A 1 64 ? 19.253 37.638 11.175 1.00 33.00 ? 76 VAL A HG11 1 ATOM 852 H HG12 . VAL A 1 64 ? 19.540 37.194 12.673 1.00 33.00 ? 76 VAL A HG12 1 ATOM 853 H HG13 . VAL A 1 64 ? 19.935 36.234 11.470 1.00 33.00 ? 76 VAL A HG13 1 ATOM 854 H HG21 . VAL A 1 64 ? 17.438 36.632 9.894 1.00 32.52 ? 76 VAL A HG21 1 ATOM 855 H HG22 . VAL A 1 64 ? 18.053 35.180 10.093 1.00 32.52 ? 76 VAL A HG22 1 ATOM 856 H HG23 . VAL A 1 64 ? 16.553 35.475 10.527 1.00 32.52 ? 76 VAL A HG23 1 ATOM 857 N N . LEU A 1 65 ? 16.120 33.429 12.593 1.00 25.25 ? 77 LEU A N 1 ATOM 858 C CA . LEU A 1 65 ? 14.776 32.945 12.904 1.00 21.67 ? 77 LEU A CA 1 ATOM 859 C C . LEU A 1 65 ? 14.774 31.903 14.013 1.00 22.94 ? 77 LEU A C 1 ATOM 860 O O . LEU A 1 65 ? 13.722 31.315 14.323 1.00 23.25 ? 77 LEU A O 1 ATOM 861 C CB . LEU A 1 65 ? 14.100 32.403 11.627 1.00 23.71 ? 77 LEU A CB 1 ATOM 862 C CG . LEU A 1 65 ? 13.831 33.457 10.560 1.00 27.46 ? 77 LEU A CG 1 ATOM 863 C CD1 . LEU A 1 65 ? 13.161 32.780 9.344 1.00 34.61 ? 77 LEU A CD1 1 ATOM 864 C CD2 . LEU A 1 65 ? 12.936 34.552 11.106 1.00 28.42 ? 77 LEU A CD2 1 ATOM 865 H H . LEU A 1 65 ? 16.572 32.922 12.065 1.00 30.30 ? 77 LEU A H 1 ATOM 866 H HA . LEU A 1 65 ? 14.246 33.696 13.214 1.00 26.00 ? 77 LEU A HA 1 ATOM 867 H HB2 . LEU A 1 65 ? 14.675 31.727 11.235 1.00 28.46 ? 77 LEU A HB2 1 ATOM 868 H HB3 . LEU A 1 65 ? 13.249 32.006 11.871 1.00 28.46 ? 77 LEU A HB3 1 ATOM 869 H HG . LEU A 1 65 ? 14.668 33.854 10.274 1.00 32.95 ? 77 LEU A HG 1 ATOM 870 H HD11 . LEU A 1 65 ? 12.990 33.451 8.665 1.00 41.53 ? 77 LEU A HD11 1 ATOM 871 H HD12 . LEU A 1 65 ? 13.758 32.100 8.995 1.00 41.53 ? 77 LEU A HD12 1 ATOM 872 H HD13 . LEU A 1 65 ? 12.327 32.376 9.628 1.00 41.53 ? 77 LEU A HD13 1 ATOM 873 H HD21 . LEU A 1 65 ? 12.780 35.208 10.409 1.00 34.11 ? 77 LEU A HD21 1 ATOM 874 H HD22 . LEU A 1 65 ? 12.094 34.160 11.385 1.00 34.11 ? 77 LEU A HD22 1 ATOM 875 H HD23 . LEU A 1 65 ? 13.374 34.970 11.863 1.00 34.11 ? 77 LEU A HD23 1 ATOM 876 N N . CYS A 1 66 ? 15.913 31.720 14.668 1.00 19.49 ? 78 CYS A N 1 ATOM 877 C CA . CYS A 1 66 ? 16.093 30.730 15.708 1.00 21.94 ? 78 CYS A CA 1 ATOM 878 C C . CYS A 1 66 ? 16.588 31.372 16.995 1.00 18.74 ? 78 CYS A C 1 ATOM 879 O O . CYS A 1 66 ? 17.269 32.401 16.974 1.00 21.73 ? 78 CYS A O 1 ATOM 880 C CB . CYS A 1 66 ? 17.122 29.654 15.306 1.00 27.02 ? 78 CYS A CB 1 ATOM 881 S SG . CYS A 1 66 ? 16.630 28.612 13.869 1.00 30.16 ? 78 CYS A SG 1 ATOM 882 H H . CYS A 1 66 ? 16.623 32.180 14.517 1.00 23.39 ? 78 CYS A H 1 ATOM 883 H HA . CYS A 1 66 ? 15.245 30.293 15.888 1.00 26.33 ? 78 CYS A HA 1 ATOM 884 H HB2 . CYS A 1 66 ? 17.956 30.093 15.078 1.00 32.43 ? 78 CYS A HB2 1 ATOM 885 H HB3 . CYS A 1 66 ? 17.262 29.062 16.062 1.00 32.43 ? 78 CYS A HB3 1 ATOM 886 N N . ASP A 1 67 ? 16.263 30.720 18.099 1.00 20.81 ? 79 ASP A N 1 ATOM 887 C CA . ASP A 1 67 ? 16.901 31.028 19.367 1.00 19.74 ? 79 ASP A CA 1 ATOM 888 C C . ASP A 1 67 ? 18.303 30.396 19.424 1.00 22.31 ? 79 ASP A C 1 ATOM 889 O O . ASP A 1 67 ? 18.811 29.833 18.448 1.00 22.93 ? 79 ASP A O 1 ATOM 890 C CB . ASP A 1 67 ? 16.021 30.579 20.514 1.00 19.44 ? 79 ASP A CB 1 ATOM 891 C CG . ASP A 1 67 ? 15.034 31.662 20.941 1.00 21.17 ? 79 ASP A CG 1 ATOM 892 O OD1 . ASP A 1 67 ? 15.450 32.846 21.007 1.00 21.46 ? 79 ASP A OD1 1 ATOM 893 O OD2 . ASP A 1 67 ? 13.877 31.321 21.218 1.00 24.54 ? 79 ASP A OD2 1 ATOM 894 H H . ASP A 1 67 ? 15.676 30.093 18.141 1.00 24.97 ? 79 ASP A H 1 ATOM 895 H HA . ASP A 1 67 ? 17.008 31.990 19.436 1.00 23.68 ? 79 ASP A HA 1 ATOM 896 H HB2 . ASP A 1 67 ? 15.514 29.799 20.240 1.00 23.33 ? 79 ASP A HB2 1 ATOM 897 H HB3 . ASP A 1 67 ? 16.580 30.362 21.277 1.00 23.33 ? 79 ASP A HB3 1 ATOM 898 N N . SER A 1 68 ? 18.964 30.558 20.560 1.00 22.00 ? 80 SER A N 1 ATOM 899 C CA . SER A 1 68 ? 20.409 30.392 20.632 1.00 18.42 ? 80 SER A CA 1 ATOM 900 C C . SER A 1 68 ? 20.793 28.919 20.616 1.00 18.34 ? 80 SER A C 1 ATOM 901 O O . SER A 1 68 ? 20.387 28.182 21.511 1.00 22.04 ? 80 SER A O 1 ATOM 902 C CB . SER A 1 68 ? 20.938 31.010 21.931 1.00 19.61 ? 80 SER A CB 1 ATOM 903 O OG . SER A 1 68 ? 20.679 32.398 21.969 1.00 23.50 ? 80 SER A OG 1 ATOM 904 H H . SER A 1 68 ? 18.597 30.765 21.310 1.00 26.41 ? 80 SER A H 1 ATOM 905 H HA . SER A 1 68 ? 20.830 30.836 19.878 1.00 22.11 ? 80 SER A HA 1 ATOM 906 H HB2 . SER A 1 68 ? 20.498 30.586 22.684 1.00 23.53 ? 80 SER A HB2 1 ATOM 907 H HB3 . SER A 1 68 ? 21.896 30.866 21.982 1.00 23.53 ? 80 SER A HB3 1 ATOM 908 H HG . SER A 1 68 ? 20.973 32.725 22.685 1.00 28.20 ? 80 SER A HG 1 ATOM 909 N N . PRO A 1 69 ? 21.657 28.476 19.697 1.00 22.91 ? 81 PRO A N 1 ATOM 910 C CA . PRO A 1 69 ? 22.343 27.192 19.920 1.00 23.47 ? 81 PRO A CA 1 ATOM 911 C C . PRO A 1 69 ? 23.221 27.261 21.156 1.00 22.34 ? 81 PRO A C 1 ATOM 912 O O . PRO A 1 69 ? 23.783 28.309 21.490 1.00 23.13 ? 81 PRO A O 1 ATOM 913 C CB . PRO A 1 69 ? 23.212 26.999 18.668 1.00 23.59 ? 81 PRO A CB 1 ATOM 914 C CG . PRO A 1 69 ? 22.943 28.085 17.764 1.00 26.86 ? 81 PRO A CG 1 ATOM 915 C CD . PRO A 1 69 ? 22.125 29.159 18.506 1.00 19.95 ? 81 PRO A CD 1 ATOM 916 H HA . PRO A 1 69 ? 21.707 26.464 20.001 1.00 28.17 ? 81 PRO A HA 1 ATOM 917 H HB2 . PRO A 1 69 ? 24.147 27.003 18.927 1.00 28.31 ? 81 PRO A HB2 1 ATOM 918 H HB3 . PRO A 1 69 ? 22.985 26.153 18.251 1.00 28.31 ? 81 PRO A HB3 1 ATOM 919 H HG2 . PRO A 1 69 ? 23.785 28.459 17.462 1.00 32.23 ? 81 PRO A HG2 1 ATOM 920 H HG3 . PRO A 1 69 ? 22.439 27.748 17.007 1.00 32.23 ? 81 PRO A HG3 1 ATOM 921 H HD2 . PRO A 1 69 ? 22.692 29.908 18.748 1.00 23.94 ? 81 PRO A HD2 1 ATOM 922 H HD3 . PRO A 1 69 ? 21.373 29.444 17.964 1.00 23.94 ? 81 PRO A HD3 1 ATOM 923 N N . TYR A 1 70 ? 23.369 26.119 21.827 1.00 23.08 ? 82 TYR A N 1 ATOM 924 C CA . TYR A 1 70 ? 24.277 26.082 22.971 1.00 26.81 ? 82 TYR A CA 1 ATOM 925 C C . TYR A 1 70 ? 25.643 26.641 22.603 1.00 25.93 ? 82 TYR A C 1 ATOM 926 O O . TYR A 1 70 ? 26.279 27.329 23.414 1.00 26.20 ? 82 TYR A O 1 ATOM 927 C CB . TYR A 1 70 ? 24.414 24.665 23.526 1.00 29.07 ? 82 TYR A CB 1 ATOM 928 C CG . TYR A 1 70 ? 25.254 24.599 24.809 1.00 27.88 ? 82 TYR A CG 1 ATOM 929 C CD1 . TYR A 1 70 ? 24.794 25.157 25.987 1.00 30.97 ? 82 TYR A CD1 1 ATOM 930 C CD2 . TYR A 1 70 ? 26.485 23.957 24.831 1.00 38.27 ? 82 TYR A CD2 1 ATOM 931 C CE1 . TYR A 1 70 ? 25.535 25.089 27.156 1.00 44.61 ? 82 TYR A CE1 1 ATOM 932 C CE2 . TYR A 1 70 ? 27.240 23.887 26.010 1.00 37.75 ? 82 TYR A CE2 1 ATOM 933 C CZ . TYR A 1 70 ? 26.755 24.454 27.162 1.00 47.78 ? 82 TYR A CZ 1 ATOM 934 O OH . TYR A 1 70 ? 27.486 24.394 28.334 1.00 60.35 ? 82 TYR A OH 1 ATOM 935 H H . TYR A 1 70 ? 22.972 25.378 21.648 1.00 27.69 ? 82 TYR A H 1 ATOM 936 H HA . TYR A 1 70 ? 23.911 26.640 23.675 1.00 32.17 ? 82 TYR A HA 1 ATOM 937 H HB2 . TYR A 1 70 ? 23.531 24.320 23.729 1.00 34.89 ? 82 TYR A HB2 1 ATOM 938 H HB3 . TYR A 1 70 ? 24.842 24.106 22.859 1.00 34.89 ? 82 TYR A HB3 1 ATOM 939 H HD1 . TYR A 1 70 ? 23.969 25.586 25.995 1.00 37.16 ? 82 TYR A HD1 1 ATOM 940 H HD2 . TYR A 1 70 ? 26.814 23.570 24.053 1.00 45.93 ? 82 TYR A HD2 1 ATOM 941 H HE1 . TYR A 1 70 ? 25.208 25.474 27.937 1.00 53.53 ? 82 TYR A HE1 1 ATOM 942 H HE2 . TYR A 1 70 ? 28.065 23.457 26.011 1.00 45.30 ? 82 TYR A HE2 1 ATOM 943 H HH . TYR A 1 70 ? 28.207 23.983 28.202 1.00 72.42 ? 82 TYR A HH 1 ATOM 944 N N . GLN A 1 71 ? 26.102 26.393 21.374 1.00 24.54 ? 83 GLN A N 1 ATOM 945 C CA . GLN A 1 71 ? 27.425 26.874 20.985 1.00 27.68 ? 83 GLN A CA 1 ATOM 946 C C . GLN A 1 71 ? 27.506 28.400 21.030 1.00 25.77 ? 83 GLN A C 1 ATOM 947 O O . GLN A 1 71 ? 28.564 28.962 21.323 1.00 23.80 ? 83 GLN A O 1 ATOM 948 C CB . GLN A 1 71 ? 27.766 26.362 19.588 1.00 29.02 ? 83 GLN A CB 1 ATOM 949 C CG . GLN A 1 71 ? 29.113 26.756 19.074 1.00 38.80 ? 83 GLN A CG 1 ATOM 950 C CD . GLN A 1 71 ? 29.479 26.032 17.779 1.00 73.85 ? 83 GLN A CD 1 ATOM 951 O OE1 . GLN A 1 71 ? 28.729 25.178 17.291 1.00 70.66 ? 83 GLN A OE1 1 ATOM 952 N NE2 . GLN A 1 71 ? 30.644 26.368 17.221 1.00 87.25 ? 83 GLN A NE2 1 ATOM 953 H H . GLN A 1 71 ? 25.679 25.960 20.764 1.00 29.44 ? 83 GLN A H 1 ATOM 954 H HA . GLN A 1 71 ? 28.083 26.521 21.603 1.00 33.22 ? 83 GLN A HA 1 ATOM 955 H HB2 . GLN A 1 71 ? 27.730 25.393 19.599 1.00 34.82 ? 83 GLN A HB2 1 ATOM 956 H HB3 . GLN A 1 71 ? 27.105 26.703 18.966 1.00 34.82 ? 83 GLN A HB3 1 ATOM 957 H HG2 . GLN A 1 71 ? 29.118 27.710 18.898 1.00 46.55 ? 83 GLN A HG2 1 ATOM 958 H HG3 . GLN A 1 71 ? 29.783 26.537 19.741 1.00 46.55 ? 83 GLN A HG3 1 ATOM 959 H HE21 . GLN A 1 71 ? 31.142 26.963 17.592 1.00 104.70 ? 83 GLN A HE21 1 ATOM 960 H HE22 . GLN A 1 71 ? 30.896 25.990 16.492 1.00 104.70 ? 83 GLN A HE22 1 ATOM 961 N N . LEU A 1 72 ? 26.418 29.096 20.681 1.00 25.45 ? 84 LEU A N 1 ATOM 962 C CA . LEU A 1 72 ? 26.440 30.556 20.745 1.00 20.54 ? 84 LEU A CA 1 ATOM 963 C C . LEU A 1 72 ? 26.577 31.025 22.191 1.00 19.17 ? 84 LEU A C 1 ATOM 964 O O . LEU A 1 72 ? 27.389 31.908 22.491 1.00 20.77 ? 84 LEU A O 1 ATOM 965 C CB . LEU A 1 72 ? 25.164 31.137 20.112 1.00 21.62 ? 84 LEU A CB 1 ATOM 966 C CG . LEU A 1 72 ? 24.980 32.638 20.317 1.00 21.46 ? 84 LEU A CG 1 ATOM 967 C CD1 . LEU A 1 72 ? 26.061 33.407 19.625 1.00 20.39 ? 84 LEU A CD1 1 ATOM 968 C CD2 . LEU A 1 72 ? 23.611 33.069 19.793 1.00 24.32 ? 84 LEU A CD2 1 ATOM 969 H H . LEU A 1 72 ? 25.676 28.756 20.411 1.00 30.54 ? 84 LEU A H 1 ATOM 970 H HA . LEU A 1 72 ? 27.203 30.886 20.245 1.00 24.65 ? 84 LEU A HA 1 ATOM 971 H HB2 . LEU A 1 72 ? 25.190 30.973 19.156 1.00 25.94 ? 84 LEU A HB2 1 ATOM 972 H HB3 . LEU A 1 72 ? 24.395 30.691 20.500 1.00 25.94 ? 84 LEU A HB3 1 ATOM 973 H HG . LEU A 1 72 ? 25.021 32.839 21.265 1.00 25.75 ? 84 LEU A HG 1 ATOM 974 H HD11 . LEU A 1 72 ? 25.918 34.355 19.773 1.00 24.47 ? 84 LEU A HD11 1 ATOM 975 H HD12 . LEU A 1 72 ? 26.920 33.142 19.990 1.00 24.47 ? 84 LEU A HD12 1 ATOM 976 H HD13 . LEU A 1 72 ? 26.030 33.212 18.676 1.00 24.47 ? 84 LEU A HD13 1 ATOM 977 H HD21 . LEU A 1 72 ? 23.508 34.024 19.930 1.00 29.19 ? 84 LEU A HD21 1 ATOM 978 H HD22 . LEU A 1 72 ? 23.556 32.863 18.847 1.00 29.19 ? 84 LEU A HD22 1 ATOM 979 H HD23 . LEU A 1 72 ? 22.922 32.589 20.278 1.00 29.19 ? 84 LEU A HD23 1 ATOM 980 N N . ILE A 1 73 ? 25.802 30.435 23.092 1.00 21.17 ? 85 ILE A N 1 ATOM 981 C CA . ILE A 1 73 ? 25.829 30.852 24.491 1.00 18.18 ? 85 ILE A CA 1 ATOM 982 C C . ILE A 1 73 ? 27.188 30.542 25.084 1.00 23.61 ? 85 ILE A C 1 ATOM 983 O O . ILE A 1 73 ? 27.797 31.374 25.762 1.00 20.45 ? 85 ILE A O 1 ATOM 984 C CB . ILE A 1 73 ? 24.685 30.176 25.254 1.00 20.82 ? 85 ILE A CB 1 ATOM 985 C CG1 . ILE A 1 73 ? 23.331 30.813 24.846 1.00 22.63 ? 85 ILE A CG1 1 ATOM 986 C CG2 . ILE A 1 73 ? 24.893 30.257 26.772 1.00 24.60 ? 85 ILE A CG2 1 ATOM 987 C CD1 . ILE A 1 73 ? 22.157 30.007 25.221 1.00 26.53 ? 85 ILE A CD1 1 ATOM 988 H H . ILE A 1 73 ? 25.254 29.795 22.922 1.00 25.40 ? 85 ILE A H 1 ATOM 989 H HA . ILE A 1 73 ? 25.695 31.811 24.537 1.00 21.82 ? 85 ILE A HA 1 ATOM 990 H HB . ILE A 1 73 ? 24.666 29.240 25.001 1.00 24.98 ? 85 ILE A HB 1 ATOM 991 H HG12 . ILE A 1 73 ? 23.249 31.676 25.281 1.00 27.16 ? 85 ILE A HG12 1 ATOM 992 H HG13 . ILE A 1 73 ? 23.317 30.927 23.883 1.00 27.16 ? 85 ILE A HG13 1 ATOM 993 H HG21 . ILE A 1 73 ? 24.150 29.819 27.216 1.00 29.53 ? 85 ILE A HG21 1 ATOM 994 H HG22 . ILE A 1 73 ? 25.724 29.811 27.000 1.00 29.53 ? 85 ILE A HG22 1 ATOM 995 H HG23 . ILE A 1 73 ? 24.934 31.189 27.036 1.00 29.53 ? 85 ILE A HG23 1 ATOM 996 H HD11 . ILE A 1 73 ? 21.354 30.469 24.934 1.00 31.84 ? 85 ILE A HD11 1 ATOM 997 H HD12 . ILE A 1 73 ? 22.216 29.143 24.785 1.00 31.84 ? 85 ILE A HD12 1 ATOM 998 H HD13 . ILE A 1 73 ? 22.148 29.893 26.184 1.00 31.84 ? 85 ILE A HD13 1 ATOM 999 N N . LEU A 1 74 ? 27.726 29.369 24.763 1.00 24.14 ? 86 LEU A N 1 ATOM 1000 C CA . LEU A 1 74 ? 29.069 29.052 25.224 1.00 27.21 ? 86 LEU A CA 1 ATOM 1001 C C . LEU A 1 74 ? 30.090 30.051 24.698 1.00 22.88 ? 86 LEU A C 1 ATOM 1002 O O . LEU A 1 74 ? 30.998 30.448 25.434 1.00 25.15 ? 86 LEU A O 1 ATOM 1003 C CB . LEU A 1 74 ? 29.427 27.616 24.812 1.00 28.63 ? 86 LEU A CB 1 ATOM 1004 C CG . LEU A 1 74 ? 30.606 26.971 25.534 1.00 47.59 ? 86 LEU A CG 1 ATOM 1005 C CD1 . LEU A 1 74 ? 30.383 26.959 27.033 1.00 38.60 ? 86 LEU A CD1 1 ATOM 1006 C CD2 . LEU A 1 74 ? 30.799 25.544 25.020 1.00 39.84 ? 86 LEU A CD2 1 ATOM 1007 H H . LEU A 1 74 ? 27.346 28.757 24.293 1.00 28.96 ? 86 LEU A H 1 ATOM 1008 H HA . LEU A 1 74 ? 29.085 29.095 26.193 1.00 32.65 ? 86 LEU A HA 1 ATOM 1009 H HB2 . LEU A 1 74 ? 28.652 27.054 24.969 1.00 34.36 ? 86 LEU A HB2 1 ATOM 1010 H HB3 . LEU A 1 74 ? 29.635 27.616 23.865 1.00 34.36 ? 86 LEU A HB3 1 ATOM 1011 H HG . LEU A 1 74 ? 31.413 27.476 25.348 1.00 57.11 ? 86 LEU A HG 1 ATOM 1012 H HD11 . LEU A 1 74 ? 31.147 26.544 27.463 1.00 46.32 ? 86 LEU A HD11 1 ATOM 1013 H HD12 . LEU A 1 74 ? 30.283 27.872 27.345 1.00 46.32 ? 86 LEU A HD12 1 ATOM 1014 H HD13 . LEU A 1 74 ? 29.578 26.453 27.229 1.00 46.32 ? 86 LEU A HD13 1 ATOM 1015 H HD21 . LEU A 1 74 ? 31.550 25.141 25.484 1.00 47.80 ? 86 LEU A HD21 1 ATOM 1016 H HD22 . LEU A 1 74 ? 29.992 25.035 25.192 1.00 47.80 ? 86 LEU A HD22 1 ATOM 1017 H HD23 . LEU A 1 74 ? 30.976 25.574 24.067 1.00 47.80 ? 86 LEU A HD23 1 ATOM 1018 N N . SER A 1 75 ? 29.970 30.480 23.432 1.00 24.80 ? 87 SER A N 1 ATOM 1019 C CA . SER A 1 75 ? 30.954 31.418 22.908 1.00 21.94 ? 87 SER A CA 1 ATOM 1020 C C . SER A 1 75 ? 30.883 32.758 23.630 1.00 25.93 ? 87 SER A C 1 ATOM 1021 O O . SER A 1 75 ? 31.913 33.419 23.806 1.00 22.53 ? 87 SER A O 1 ATOM 1022 C CB . SER A 1 75 ? 30.792 31.605 21.403 1.00 26.03 ? 87 SER A CB 1 ATOM 1023 O OG . SER A 1 75 ? 29.676 32.429 21.043 1.00 25.25 ? 87 SER A OG 1 ATOM 1024 H H . SER A 1 75 ? 29.350 30.249 22.882 1.00 29.76 ? 87 SER A H 1 ATOM 1025 H HA . SER A 1 75 ? 31.839 31.051 23.061 1.00 26.32 ? 87 SER A HA 1 ATOM 1026 H HB2 . SER A 1 75 ? 31.600 32.015 21.057 1.00 31.23 ? 87 SER A HB2 1 ATOM 1027 H HB3 . SER A 1 75 ? 30.673 30.733 20.997 1.00 31.23 ? 87 SER A HB3 1 ATOM 1028 H HG . SER A 1 75 ? 28.963 32.087 21.327 1.00 30.30 ? 87 SER A HG 1 ATOM 1029 N N . ALA A 1 76 ? 29.687 33.165 24.072 1.00 19.41 ? 88 ALA A N 1 ATOM 1030 C CA . ALA A 1 76 ? 29.561 34.426 24.809 1.00 20.42 ? 88 ALA A CA 1 ATOM 1031 C C . ALA A 1 76 ? 30.246 34.344 26.171 1.00 18.47 ? 88 ALA A C 1 ATOM 1032 O O . ALA A 1 76 ? 31.020 35.238 26.542 1.00 19.52 ? 88 ALA A O 1 ATOM 1033 C CB . ALA A 1 76 ? 28.074 34.783 24.957 1.00 21.37 ? 88 ALA A CB 1 ATOM 1034 H H . ALA A 1 76 ? 28.948 32.739 23.961 1.00 23.29 ? 88 ALA A H 1 ATOM 1035 H HA . ALA A 1 76 ? 29.990 35.132 24.300 1.00 24.51 ? 88 ALA A HA 1 ATOM 1036 H HB1 . ALA A 1 76 ? 27.998 35.618 25.445 1.00 25.65 ? 88 ALA A HB1 1 ATOM 1037 H HB2 . ALA A 1 76 ? 27.683 34.878 24.075 1.00 25.65 ? 88 ALA A HB2 1 ATOM 1038 H HB3 . ALA A 1 76 ? 27.626 34.073 25.444 1.00 25.65 ? 88 ALA A HB3 1 ATOM 1039 N N . PHE A 1 77 ? 30.005 33.268 26.920 1.00 19.35 ? 89 PHE A N 1 ATOM 1040 C CA . PHE A 1 77 ? 30.626 33.158 28.239 1.00 23.97 ? 89 PHE A CA 1 ATOM 1041 C C . PHE A 1 77 ? 32.125 32.862 28.135 1.00 26.19 ? 89 PHE A C 1 ATOM 1042 O O . PHE A 1 77 ? 32.902 33.363 28.952 1.00 24.21 ? 89 PHE A O 1 ATOM 1043 C CB . PHE A 1 77 ? 29.938 32.100 29.087 1.00 22.05 ? 89 PHE A CB 1 ATOM 1044 C CG . PHE A 1 77 ? 28.578 32.517 29.611 1.00 20.91 ? 89 PHE A CG 1 ATOM 1045 C CD1 . PHE A 1 77 ? 28.449 33.632 30.437 1.00 23.68 ? 89 PHE A CD1 1 ATOM 1046 C CD2 . PHE A 1 77 ? 27.451 31.802 29.279 1.00 23.42 ? 89 PHE A CD2 1 ATOM 1047 C CE1 . PHE A 1 77 ? 27.220 34.024 30.911 1.00 24.42 ? 89 PHE A CE1 1 ATOM 1048 C CE2 . PHE A 1 77 ? 26.201 32.188 29.764 1.00 27.95 ? 89 PHE A CE2 1 ATOM 1049 C CZ . PHE A 1 77 ? 26.096 33.301 30.571 1.00 23.94 ? 89 PHE A CZ 1 ATOM 1050 H H . PHE A 1 77 ? 29.502 32.607 26.696 1.00 23.22 ? 89 PHE A H 1 ATOM 1051 H HA . PHE A 1 77 ? 30.528 34.008 28.696 1.00 28.77 ? 89 PHE A HA 1 ATOM 1052 H HB2 . PHE A 1 77 ? 29.816 31.301 28.550 1.00 26.46 ? 89 PHE A HB2 1 ATOM 1053 H HB3 . PHE A 1 77 ? 30.501 31.899 29.851 1.00 26.46 ? 89 PHE A HB3 1 ATOM 1054 H HD1 . PHE A 1 77 ? 29.205 34.124 30.663 1.00 28.41 ? 89 PHE A HD1 1 ATOM 1055 H HD2 . PHE A 1 77 ? 27.524 31.055 28.731 1.00 28.10 ? 89 PHE A HD2 1 ATOM 1056 H HE1 . PHE A 1 77 ? 27.147 34.771 31.461 1.00 29.31 ? 89 PHE A HE1 1 ATOM 1057 H HE2 . PHE A 1 77 ? 25.441 31.703 29.535 1.00 33.54 ? 89 PHE A HE2 1 ATOM 1058 H HZ . PHE A 1 77 ? 25.263 33.560 30.896 1.00 28.73 ? 89 PHE A HZ 1 ATOM 1059 N N . ASP A 1 78 ? 32.555 32.107 27.112 1.00 25.02 ? 90 ASP A N 1 ATOM 1060 C CA . ASP A 1 78 ? 33.993 31.956 26.855 1.00 26.93 ? 90 ASP A CA 1 ATOM 1061 C C . ASP A 1 78 ? 34.653 33.292 26.550 1.00 29.85 ? 90 ASP A C 1 ATOM 1062 O O . ASP A 1 78 ? 35.785 33.550 26.990 1.00 28.04 ? 90 ASP A O 1 ATOM 1063 C CB . ASP A 1 78 ? 34.252 30.997 25.687 1.00 29.58 ? 90 ASP A CB 1 ATOM 1064 C CG . ASP A 1 78 ? 33.940 29.545 26.032 1.00 43.82 ? 90 ASP A CG 1 ATOM 1065 O OD1 . ASP A 1 78 ? 33.943 29.199 27.226 1.00 44.30 ? 90 ASP A OD1 1 ATOM 1066 O OD2 . ASP A 1 78 ? 33.695 28.743 25.098 1.00 65.36 ? 90 ASP A OD2 1 ATOM 1067 H H . ASP A 1 78 ? 32.045 31.682 26.565 1.00 30.03 ? 90 ASP A H 1 ATOM 1068 H HA . ASP A 1 78 ? 34.416 31.586 27.645 1.00 32.32 ? 90 ASP A HA 1 ATOM 1069 H HB2 . ASP A 1 78 ? 33.692 31.253 24.938 1.00 35.50 ? 90 ASP A HB2 1 ATOM 1070 H HB3 . ASP A 1 78 ? 35.187 31.050 25.436 1.00 35.50 ? 90 ASP A HB3 1 ATOM 1071 N N . PHE A 1 79 ? 33.987 34.142 25.761 1.00 25.14 ? 91 PHE A N 1 ATOM 1072 C CA . PHE A 1 79 ? 34.511 35.471 25.510 1.00 21.20 ? 91 PHE A CA 1 ATOM 1073 C C . PHE A 1 79 ? 34.709 36.239 26.808 1.00 23.13 ? 91 PHE A C 1 ATOM 1074 O O . PHE A 1 79 ? 35.772 36.826 27.039 1.00 22.21 ? 91 PHE A O 1 ATOM 1075 C CB . PHE A 1 79 ? 33.592 36.267 24.575 1.00 24.29 ? 91 PHE A CB 1 ATOM 1076 C CG . PHE A 1 79 ? 33.882 37.720 24.614 1.00 23.62 ? 91 PHE A CG 1 ATOM 1077 C CD1 . PHE A 1 79 ? 35.076 38.211 24.094 1.00 25.10 ? 91 PHE A CD1 1 ATOM 1078 C CD2 . PHE A 1 79 ? 33.041 38.587 25.291 1.00 27.71 ? 91 PHE A CD2 1 ATOM 1079 C CE1 . PHE A 1 79 ? 35.391 39.548 24.180 1.00 33.73 ? 91 PHE A CE1 1 ATOM 1080 C CE2 . PHE A 1 79 ? 33.364 39.927 25.388 1.00 25.80 ? 91 PHE A CE2 1 ATOM 1081 C CZ . PHE A 1 79 ? 34.519 40.409 24.834 1.00 29.62 ? 91 PHE A CZ 1 ATOM 1082 H H . PHE A 1 79 ? 33.241 33.970 25.368 1.00 30.17 ? 91 PHE A H 1 ATOM 1083 H HA . PHE A 1 79 ? 35.375 35.389 25.078 1.00 25.44 ? 91 PHE A HA 1 ATOM 1084 H HB2 . PHE A 1 79 ? 33.719 35.957 23.664 1.00 29.15 ? 91 PHE A HB2 1 ATOM 1085 H HB3 . PHE A 1 79 ? 32.670 36.135 24.847 1.00 29.15 ? 91 PHE A HB3 1 ATOM 1086 H HD1 . PHE A 1 79 ? 35.657 37.632 23.656 1.00 30.12 ? 91 PHE A HD1 1 ATOM 1087 H HD2 . PHE A 1 79 ? 32.253 38.270 25.670 1.00 33.25 ? 91 PHE A HD2 1 ATOM 1088 H HE1 . PHE A 1 79 ? 36.179 39.871 23.806 1.00 40.48 ? 91 PHE A HE1 1 ATOM 1089 H HE2 . PHE A 1 79 ? 32.781 40.510 25.817 1.00 30.96 ? 91 PHE A HE2 1 ATOM 1090 H HZ . PHE A 1 79 ? 34.720 41.315 24.894 1.00 35.54 ? 91 PHE A HZ 1 ATOM 1091 N N . ILE A 1 80 ? 33.666 36.310 27.638 1.00 21.71 ? 92 ILE A N 1 ATOM 1092 C CA . ILE A 1 80 ? 33.783 36.976 28.935 1.00 20.27 ? 92 ILE A CA 1 ATOM 1093 C C . ILE A 1 80 ? 34.972 36.414 29.714 1.00 24.31 ? 92 ILE A C 1 ATOM 1094 O O . ILE A 1 80 ? 35.799 37.168 30.238 1.00 23.43 ? 92 ILE A O 1 ATOM 1095 C CB . ILE A 1 80 ? 32.475 36.837 29.723 1.00 20.88 ? 92 ILE A CB 1 ATOM 1096 C CG1 . ILE A 1 80 ? 31.399 37.702 29.042 1.00 23.01 ? 92 ILE A CG1 1 ATOM 1097 C CG2 . ILE A 1 80 ? 32.680 37.232 31.182 1.00 22.51 ? 92 ILE A CG2 1 ATOM 1098 C CD1 . ILE A 1 80 ? 30.000 37.545 29.615 1.00 22.12 ? 92 ILE A CD1 1 ATOM 1099 H H . ILE A 1 80 ? 32.887 35.985 27.475 1.00 26.05 ? 92 ILE A H 1 ATOM 1100 H HA . ILE A 1 80 ? 33.943 37.921 28.789 1.00 24.33 ? 92 ILE A HA 1 ATOM 1101 H HB . ILE A 1 80 ? 32.192 35.910 29.692 1.00 25.05 ? 92 ILE A HB 1 ATOM 1102 H HG12 . ILE A 1 80 ? 31.650 38.634 29.132 1.00 27.62 ? 92 ILE A HG12 1 ATOM 1103 H HG13 . ILE A 1 80 ? 31.360 37.463 28.103 1.00 27.62 ? 92 ILE A HG13 1 ATOM 1104 H HG21 . ILE A 1 80 ? 31.839 37.135 31.656 1.00 27.02 ? 92 ILE A HG21 1 ATOM 1105 H HG22 . ILE A 1 80 ? 33.350 36.651 31.574 1.00 27.02 ? 92 ILE A HG22 1 ATOM 1106 H HG23 . ILE A 1 80 ? 32.977 38.155 31.220 1.00 27.02 ? 92 ILE A HG23 1 ATOM 1107 H HD11 . ILE A 1 80 ? 29.393 38.124 29.127 1.00 26.55 ? 92 ILE A HD11 1 ATOM 1108 H HD12 . ILE A 1 80 ? 29.723 36.620 29.522 1.00 26.55 ? 92 ILE A HD12 1 ATOM 1109 H HD13 . ILE A 1 80 ? 30.013 37.794 30.552 1.00 26.55 ? 92 ILE A HD13 1 ATOM 1110 N N . LYS A 1 81 ? 35.059 35.084 29.809 1.00 23.30 ? 93 LYS A N 1 ATOM 1111 C CA . LYS A 1 81 ? 36.082 34.457 30.643 1.00 28.19 ? 93 LYS A CA 1 ATOM 1112 C C . LYS A 1 81 ? 37.483 34.810 30.171 1.00 30.13 ? 93 LYS A C 1 ATOM 1113 O O . LYS A 1 81 ? 38.381 35.028 30.985 1.00 33.16 ? 93 LYS A O 1 ATOM 1114 C CB . LYS A 1 81 ? 35.903 32.947 30.643 1.00 32.95 ? 93 LYS A CB 1 ATOM 1115 C CG . LYS A 1 81 ? 36.856 32.203 31.606 1.00 40.31 ? 93 LYS A CG 1 ATOM 1116 C CD . LYS A 1 81 ? 36.455 30.745 31.797 1.00 60.71 ? 93 LYS A CD 1 ATOM 1117 C CE . LYS A 1 81 ? 37.315 30.028 32.854 1.00 61.91 ? 93 LYS A CE 1 ATOM 1118 N NZ . LYS A 1 81 ? 38.461 29.288 32.232 1.00 90.08 ? 93 LYS A NZ 1 ATOM 1119 H H . LYS A 1 81 ? 34.542 34.530 29.403 1.00 27.96 ? 93 LYS A H 1 ATOM 1120 H HA . LYS A 1 81 ? 35.983 34.772 31.556 1.00 33.83 ? 93 LYS A HA 1 ATOM 1121 H HB2 . LYS A 1 81 ? 34.993 32.741 30.909 1.00 39.54 ? 93 LYS A HB2 1 ATOM 1122 H HB3 . LYS A 1 81 ? 36.067 32.613 29.747 1.00 39.54 ? 93 LYS A HB3 1 ATOM 1123 H HG2 . LYS A 1 81 ? 37.755 32.224 31.242 1.00 48.37 ? 93 LYS A HG2 1 ATOM 1124 H HG3 . LYS A 1 81 ? 36.836 32.638 32.473 1.00 48.37 ? 93 LYS A HG3 1 ATOM 1125 H HD2 . LYS A 1 81 ? 35.530 30.707 32.085 1.00 72.85 ? 93 LYS A HD2 1 ATOM 1126 H HD3 . LYS A 1 81 ? 36.561 30.275 30.955 1.00 72.85 ? 93 LYS A HD3 1 ATOM 1127 H HE2 . LYS A 1 81 ? 37.676 30.684 33.471 1.00 74.29 ? 93 LYS A HE2 1 ATOM 1128 H HE3 . LYS A 1 81 ? 36.765 29.387 33.332 1.00 74.29 ? 93 LYS A HE3 1 ATOM 1129 H HZ1 . LYS A 1 81 ? 38.940 28.884 32.864 1.00 108.10 ? 93 LYS A HZ1 1 ATOM 1130 H HZ2 . LYS A 1 81 ? 38.155 28.675 31.664 1.00 108.10 ? 93 LYS A HZ2 1 ATOM 1131 H HZ3 . LYS A 1 81 ? 38.985 29.856 31.791 1.00 108.10 ? 93 LYS A HZ3 1 ATOM 1132 N N . ASN A 1 82 ? 37.693 34.843 28.866 1.00 26.40 ? 94 ASN A N 1 ATOM 1133 C CA . ASN A 1 82 ? 39.002 35.101 28.282 1.00 31.45 ? 94 ASN A CA 1 ATOM 1134 C C . ASN A 1 82 ? 39.192 36.549 27.875 1.00 34.99 ? 94 ASN A C 1 ATOM 1135 O O . ASN A 1 82 ? 40.167 36.864 27.190 1.00 31.03 ? 94 ASN A O 1 ATOM 1136 C CB . ASN A 1 82 ? 39.208 34.183 27.074 1.00 34.76 ? 94 ASN A CB 1 ATOM 1137 C CG . ASN A 1 82 ? 39.110 32.707 27.447 1.00 40.82 ? 94 ASN A CG 1 ATOM 1138 O OD1 . ASN A 1 82 ? 39.678 32.267 28.454 1.00 39.15 ? 94 ASN A OD1 1 ATOM 1139 N ND2 . ASN A 1 82 ? 38.370 31.946 26.651 1.00 45.58 ? 94 ASN A ND2 1 ATOM 1140 H H . ASN A 1 82 ? 37.076 34.716 28.280 1.00 31.67 ? 94 ASN A H 1 ATOM 1141 H HA . ASN A 1 82 ? 39.684 34.887 28.937 1.00 37.74 ? 94 ASN A HA 1 ATOM 1142 H HB2 . ASN A 1 82 ? 38.527 34.372 26.411 1.00 41.72 ? 94 ASN A HB2 1 ATOM 1143 H HB3 . ASN A 1 82 ? 40.090 34.341 26.702 1.00 41.72 ? 94 ASN A HB3 1 ATOM 1144 H HD21 . ASN A 1 82 ? 38.283 31.107 26.819 1.00 54.70 ? 94 ASN A HD21 1 ATOM 1145 H HD22 . ASN A 1 82 ? 37.978 32.291 25.968 1.00 54.70 ? 94 ASN A HD22 1 ATOM 1146 N N . SER A 1 83 ? 38.300 37.451 28.300 1.00 28.77 ? 95 SER A N 1 ATOM 1147 C CA . SER A 1 83 ? 38.340 38.811 27.783 1.00 28.54 ? 95 SER A CA 1 ATOM 1148 C C . SER A 1 83 ? 39.495 39.625 28.333 1.00 30.81 ? 95 SER A C 1 ATOM 1149 O O . SER A 1 83 ? 39.798 40.682 27.765 1.00 33.37 ? 95 SER A O 1 ATOM 1150 C CB . SER A 1 83 ? 37.048 39.557 28.143 1.00 26.86 ? 95 SER A CB 1 ATOM 1151 O OG . SER A 1 83 ? 36.953 39.668 29.550 1.00 24.66 ? 95 SER A OG 1 ATOM 1152 H H . SER A 1 83 ? 37.677 37.301 28.874 1.00 34.52 ? 95 SER A H 1 ATOM 1153 H HA . SER A 1 83 ? 38.418 38.784 26.816 1.00 34.25 ? 95 SER A HA 1 ATOM 1154 H HB2 . SER A 1 83 ? 37.070 40.445 27.752 1.00 32.23 ? 95 SER A HB2 1 ATOM 1155 H HB3 . SER A 1 83 ? 36.285 39.060 27.808 1.00 32.23 ? 95 SER A HB3 1 ATOM 1156 H HG . SER A 1 83 ? 36.940 38.904 29.898 1.00 29.60 ? 95 SER A HG 1 ATOM 1157 N N . GLY A 1 84 ? 40.074 39.212 29.460 1.00 28.19 ? 96 GLY A N 1 ATOM 1158 C CA . GLY A 1 84 ? 41.043 40.021 30.156 1.00 37.45 ? 96 GLY A CA 1 ATOM 1159 C C . GLY A 1 84 ? 40.444 41.106 31.027 1.00 35.28 ? 96 GLY A C 1 ATOM 1160 O O . GLY A 1 84 ? 41.191 41.843 31.673 1.00 32.78 ? 96 GLY A O 1 ATOM 1161 H H . GLY A 1 84 ? 39.913 38.456 29.839 1.00 33.83 ? 96 GLY A H 1 ATOM 1162 H HA2 . GLY A 1 84 ? 41.586 39.448 30.720 1.00 44.94 ? 96 GLY A HA2 1 ATOM 1163 H HA3 . GLY A 1 84 ? 41.626 40.444 29.506 1.00 44.94 ? 96 GLY A HA3 1 ATOM 1164 N N . GLN A 1 85 ? 39.124 41.248 31.050 1.00 28.42 ? 97 GLN A N 1 ATOM 1165 C CA . GLN A 1 85 ? 38.479 42.252 31.881 1.00 33.18 ? 97 GLN A CA 1 ATOM 1166 C C . GLN A 1 85 ? 38.278 41.685 33.275 1.00 31.04 ? 97 GLN A C 1 ATOM 1167 O O . GLN A 1 85 ? 37.731 40.593 33.433 1.00 35.25 ? 97 GLN A O 1 ATOM 1168 C CB . GLN A 1 85 ? 37.124 42.670 31.295 1.00 24.37 ? 97 GLN A CB 1 ATOM 1169 C CG . GLN A 1 85 ? 37.206 43.332 29.970 1.00 26.31 ? 97 GLN A CG 1 ATOM 1170 C CD . GLN A 1 85 ? 37.865 44.686 30.043 1.00 34.05 ? 97 GLN A CD 1 ATOM 1171 O OE1 . GLN A 1 85 ? 38.045 45.249 31.124 1.00 30.49 ? 97 GLN A OE1 1 ATOM 1172 N NE2 . GLN A 1 85 ? 38.252 45.208 28.894 1.00 55.02 ? 97 GLN A NE2 1 ATOM 1173 H H . GLN A 1 85 ? 38.576 40.772 30.588 1.00 34.10 ? 97 GLN A H 1 ATOM 1174 H HA . GLN A 1 85 ? 39.046 43.036 31.944 1.00 39.82 ? 97 GLN A HA 1 ATOM 1175 H HB2 . GLN A 1 85 ? 36.572 41.880 31.195 1.00 29.24 ? 97 GLN A HB2 1 ATOM 1176 H HB3 . GLN A 1 85 ? 36.699 43.291 31.908 1.00 29.24 ? 97 GLN A HB3 1 ATOM 1177 H HG2 . GLN A 1 85 ? 37.727 42.776 29.370 1.00 31.57 ? 97 GLN A HG2 1 ATOM 1178 H HG3 . GLN A 1 85 ? 36.310 43.452 29.620 1.00 31.57 ? 97 GLN A HG3 1 ATOM 1179 H HE21 . GLN A 1 85 ? 38.123 44.777 28.161 1.00 66.02 ? 97 GLN A HE21 1 ATOM 1180 H HE22 . GLN A 1 85 ? 38.634 45.978 28.878 1.00 66.02 ? 97 GLN A HE22 1 ATOM 1181 N N . GLU A 1 86 ? 38.703 42.436 34.279 1.00 24.94 ? 98 GLU A N 1 ATOM 1182 C CA . GLU A 1 86 ? 38.381 42.093 35.651 1.00 36.67 ? 98 GLU A CA 1 ATOM 1183 C C . GLU A 1 86 ? 36.954 42.532 35.923 1.00 28.41 ? 98 GLU A C 1 ATOM 1184 O O . GLU A 1 86 ? 36.483 43.534 35.389 1.00 38.04 ? 98 GLU A O 1 ATOM 1185 C CB . GLU A 1 86 ? 39.331 42.775 36.638 1.00 41.44 ? 98 GLU A CB 1 ATOM 1186 C CG . GLU A 1 86 ? 39.015 42.500 38.127 1.00 76.58 ? 98 GLU A CG 1 ATOM 1187 C CD . GLU A 1 86 ? 37.866 43.361 38.719 1.00 83.40 ? 98 GLU A CD 1 ATOM 1188 O OE1 . GLU A 1 86 ? 37.416 44.357 38.095 1.00 55.61 ? 98 GLU A OE1 1 ATOM 1189 O OE2 . GLU A 1 86 ? 37.405 43.028 39.832 1.00 66.55 ? 98 GLU A OE2 1 ATOM 1190 H H . GLU A 1 86 ? 39.179 43.147 34.192 1.00 29.93 ? 98 GLU A H 1 ATOM 1191 H HA . GLU A 1 86 ? 38.441 41.133 35.772 1.00 44.00 ? 98 GLU A HA 1 ATOM 1192 H HB2 . GLU A 1 86 ? 40.233 42.462 36.466 1.00 49.73 ? 98 GLU A HB2 1 ATOM 1193 H HB3 . GLU A 1 86 ? 39.286 43.734 36.500 1.00 49.73 ? 98 GLU A HB3 1 ATOM 1194 H HG2 . GLU A 1 86 ? 38.763 41.569 38.223 1.00 91.90 ? 98 GLU A HG2 1 ATOM 1195 H HG3 . GLU A 1 86 ? 39.813 42.677 38.650 1.00 91.90 ? 98 GLU A HG3 1 ATOM 1196 N N . ALA A 1 87 ? 36.261 41.760 36.736 1.00 29.13 ? 99 ALA A N 1 ATOM 1197 C CA . ALA A 1 87 ? 34.895 42.096 37.100 1.00 27.34 ? 99 ALA A CA 1 ATOM 1198 C C . ALA A 1 87 ? 34.649 41.515 38.465 1.00 23.44 ? 99 ALA A C 1 ATOM 1199 O O . ALA A 1 87 ? 35.077 40.385 38.746 1.00 23.45 ? 99 ALA A O 1 ATOM 1200 C CB . ALA A 1 87 ? 33.879 41.526 36.111 1.00 25.56 ? 99 ALA A CB 1 ATOM 1201 H H . ALA A 1 87 ? 36.556 41.035 37.093 1.00 34.95 ? 99 ALA A H 1 ATOM 1202 H HA . ALA A 1 87 ? 34.790 43.059 37.142 1.00 32.80 ? 99 ALA A HA 1 ATOM 1203 H HB1 . ALA A 1 87 ? 32.987 41.776 36.396 1.00 30.67 ? 99 ALA A HB1 1 ATOM 1204 H HB2 . ALA A 1 87 ? 34.060 41.888 35.230 1.00 30.67 ? 99 ALA A HB2 1 ATOM 1205 H HB3 . ALA A 1 87 ? 33.963 40.559 36.095 1.00 30.67 ? 99 ALA A HB3 1 ATOM 1206 N N . SER A 1 88 ? 33.950 42.268 39.314 1.00 20.67 ? 100 SER A N 1 ATOM 1207 C CA . SER A 1 88 ? 33.692 41.763 40.645 1.00 22.61 ? 100 SER A CA 1 ATOM 1208 C C . SER A 1 88 ? 32.343 41.076 40.775 1.00 22.82 ? 100 SER A C 1 ATOM 1209 O O . SER A 1 88 ? 32.132 40.361 41.759 1.00 23.83 ? 100 SER A O 1 ATOM 1210 C CB . SER A 1 88 ? 33.826 42.882 41.702 1.00 27.03 ? 100 SER A CB 1 ATOM 1211 O OG . SER A 1 88 ? 33.111 44.042 41.382 1.00 29.75 ? 100 SER A OG 1 ATOM 1212 H H . SER A 1 88 ? 33.626 43.046 39.145 1.00 24.80 ? 100 SER A H 1 ATOM 1213 H HA . SER A 1 88 ? 34.369 41.098 40.848 1.00 27.13 ? 100 SER A HA 1 ATOM 1214 H HB2 . SER A 1 88 ? 33.499 42.544 42.550 1.00 32.44 ? 100 SER A HB2 1 ATOM 1215 H HB3 . SER A 1 88 ? 34.764 43.114 41.786 1.00 32.44 ? 100 SER A HB3 1 ATOM 1216 H HG . SER A 1 88 ? 32.293 43.864 41.313 1.00 35.70 ? 100 SER A HG 1 ATOM 1217 N N . PHE A 1 89 ? 31.432 41.237 39.813 1.00 18.82 ? 101 PHE A N 1 ATOM 1218 C CA . PHE A 1 89 ? 30.209 40.451 39.811 1.00 16.81 ? 101 PHE A CA 1 ATOM 1219 C C . PHE A 1 89 ? 29.593 40.523 38.417 1.00 15.85 ? 101 PHE A C 1 ATOM 1220 O O . PHE A 1 89 ? 30.128 41.160 37.502 1.00 17.40 ? 101 PHE A O 1 ATOM 1221 C CB . PHE A 1 89 ? 29.227 40.926 40.901 1.00 20.57 ? 101 PHE A CB 1 ATOM 1222 C CG . PHE A 1 89 ? 28.780 42.373 40.768 1.00 18.21 ? 101 PHE A CG 1 ATOM 1223 C CD1 . PHE A 1 89 ? 27.554 42.691 40.166 1.00 18.15 ? 101 PHE A CD1 1 ATOM 1224 C CD2 . PHE A 1 89 ? 29.562 43.405 41.251 1.00 19.25 ? 101 PHE A CD2 1 ATOM 1225 C CE1 . PHE A 1 89 ? 27.148 44.017 40.076 1.00 15.74 ? 101 PHE A CE1 1 ATOM 1226 C CE2 . PHE A 1 89 ? 29.169 44.729 41.145 1.00 20.58 ? 101 PHE A CE2 1 ATOM 1227 C CZ . PHE A 1 89 ? 27.943 45.031 40.555 1.00 17.42 ? 101 PHE A CZ 1 ATOM 1228 H H . PHE A 1 89 ? 31.501 41.790 39.158 1.00 22.58 ? 101 PHE A H 1 ATOM 1229 H HA . PHE A 1 89 ? 30.430 39.524 39.993 1.00 20.17 ? 101 PHE A HA 1 ATOM 1230 H HB2 . PHE A 1 89 ? 28.434 40.369 40.866 1.00 24.69 ? 101 PHE A HB2 1 ATOM 1231 H HB3 . PHE A 1 89 ? 29.655 40.829 41.766 1.00 24.69 ? 101 PHE A HB3 1 ATOM 1232 H HD1 . PHE A 1 89 ? 27.005 42.013 39.843 1.00 21.78 ? 101 PHE A HD1 1 ATOM 1233 H HD2 . PHE A 1 89 ? 30.378 43.206 41.650 1.00 23.10 ? 101 PHE A HD2 1 ATOM 1234 H HE1 . PHE A 1 89 ? 26.336 44.222 39.672 1.00 18.89 ? 101 PHE A HE1 1 ATOM 1235 H HE2 . PHE A 1 89 ? 29.711 45.408 41.477 1.00 24.69 ? 101 PHE A HE2 1 ATOM 1236 H HZ . PHE A 1 89 ? 27.668 45.916 40.478 1.00 20.90 ? 101 PHE A HZ 1 ATOM 1237 N N . MET A 1 90 ? 28.495 39.802 38.258 1.00 16.43 ? 102 MET A N 1 ATOM 1238 C CA . MET A 1 90 ? 27.734 39.766 37.016 1.00 20.19 ? 102 MET A CA 1 ATOM 1239 C C . MET A 1 90 ? 26.251 39.858 37.359 1.00 17.48 ? 102 MET A C 1 ATOM 1240 O O . MET A 1 90 ? 25.813 39.315 38.375 1.00 19.02 ? 102 MET A O 1 ATOM 1241 C CB . MET A 1 90 ? 28.012 38.464 36.233 1.00 17.95 ? 102 MET A CB 1 ATOM 1242 C CG . MET A 1 90 ? 27.128 38.254 35.004 1.00 22.67 ? 102 MET A CG 1 ATOM 1243 S SD . MET A 1 90 ? 27.535 36.668 34.176 1.00 28.54 ? 102 MET A SD 1 ATOM 1244 C CE . MET A 1 90 ? 28.947 37.159 33.304 1.00 30.18 ? 102 MET A CE 1 ATOM 1245 H H . MET A 1 90 ? 28.157 39.307 38.876 1.00 19.72 ? 102 MET A H 1 ATOM 1246 H HA . MET A 1 90 ? 27.986 40.520 36.459 1.00 24.23 ? 102 MET A HA 1 ATOM 1247 H HB2 . MET A 1 90 ? 28.934 38.474 35.933 1.00 21.54 ? 102 MET A HB2 1 ATOM 1248 H HB3 . MET A 1 90 ? 27.872 37.710 36.828 1.00 21.54 ? 102 MET A HB3 1 ATOM 1249 H HG2 . MET A 1 90 ? 26.198 38.228 35.277 1.00 27.20 ? 102 MET A HG2 1 ATOM 1250 H HG3 . MET A 1 90 ? 27.276 38.977 34.374 1.00 27.20 ? 102 MET A HG3 1 ATOM 1251 H HE1 . MET A 1 90 ? 29.287 36.401 32.802 1.00 36.21 ? 102 MET A HE1 1 ATOM 1252 H HE2 . MET A 1 90 ? 28.710 37.878 32.699 1.00 36.21 ? 102 MET A HE2 1 ATOM 1253 H HE3 . MET A 1 90 ? 29.617 37.464 33.936 1.00 36.21 ? 102 MET A HE3 1 ATOM 1254 N N . ILE A 1 91 ? 25.477 40.581 36.545 1.00 15.31 ? 103 ILE A N 1 ATOM 1255 C CA . ILE A 1 91 ? 24.031 40.555 36.646 1.00 15.81 ? 103 ILE A CA 1 ATOM 1256 C C . ILE A 1 91 ? 23.485 39.826 35.424 1.00 15.29 ? 103 ILE A C 1 ATOM 1257 O O . ILE A 1 91 ? 24.065 39.894 34.331 1.00 16.06 ? 103 ILE A O 1 ATOM 1258 C CB . ILE A 1 91 ? 23.445 41.974 36.793 1.00 14.19 ? 103 ILE A CB 1 ATOM 1259 C CG1 . ILE A 1 91 ? 23.810 42.873 35.629 1.00 16.60 ? 103 ILE A CG1 1 ATOM 1260 C CG2 . ILE A 1 91 ? 23.932 42.592 38.074 1.00 17.44 ? 103 ILE A CG2 1 ATOM 1261 C CD1 . ILE A 1 91 ? 22.923 44.203 35.561 1.00 18.84 ? 103 ILE A CD1 1 ATOM 1262 H H . ILE A 1 91 ? 25.775 41.095 35.923 1.00 18.38 ? 103 ILE A H 1 ATOM 1263 H HA . ILE A 1 91 ? 23.780 40.047 37.433 1.00 18.97 ? 103 ILE A HA 1 ATOM 1264 H HB . ILE A 1 91 ? 22.478 41.904 36.834 1.00 17.03 ? 103 ILE A HB 1 ATOM 1265 H HG12 . ILE A 1 91 ? 24.739 43.138 35.714 1.00 19.93 ? 103 ILE A HG12 1 ATOM 1266 H HG13 . ILE A 1 91 ? 23.680 42.385 34.801 1.00 19.93 ? 103 ILE A HG13 1 ATOM 1267 H HG21 . ILE A 1 91 ? 23.558 43.483 38.156 1.00 20.93 ? 103 ILE A HG21 1 ATOM 1268 H HG22 . ILE A 1 91 ? 23.644 42.041 38.819 1.00 20.93 ? 103 ILE A HG22 1 ATOM 1269 H HG23 . ILE A 1 91 ? 24.900 42.640 38.053 1.00 20.93 ? 103 ILE A HG23 1 ATOM 1270 H HD11 . ILE A 1 91 ? 23.205 44.732 34.798 1.00 22.61 ? 103 ILE A HD11 1 ATOM 1271 H HD12 . ILE A 1 91 ? 21.990 43.955 35.465 1.00 22.61 ? 103 ILE A HD12 1 ATOM 1272 H HD13 . ILE A 1 91 ? 23.049 44.708 36.379 1.00 22.61 ? 103 ILE A HD13 1 ATOM 1273 N N . TRP A 1 92 ? 22.414 39.078 35.632 1.00 16.09 ? 104 TRP A N 1 ATOM 1274 C CA . TRP A 1 92 ? 21.891 38.172 34.607 1.00 15.22 ? 104 TRP A CA 1 ATOM 1275 C C . TRP A 1 92 ? 20.367 38.278 34.641 1.00 18.70 ? 104 TRP A C 1 ATOM 1276 O O . TRP A 1 92 ? 19.735 37.715 35.530 1.00 18.68 ? 104 TRP A O 1 ATOM 1277 C CB . TRP A 1 92 ? 22.358 36.745 34.894 1.00 16.96 ? 104 TRP A CB 1 ATOM 1278 C CG . TRP A 1 92 ? 21.710 35.693 34.068 1.00 17.93 ? 104 TRP A CG 1 ATOM 1279 C CD1 . TRP A 1 92 ? 21.149 35.823 32.836 1.00 19.69 ? 104 TRP A CD1 1 ATOM 1280 C CD2 . TRP A 1 92 ? 21.552 34.322 34.447 1.00 19.06 ? 104 TRP A CD2 1 ATOM 1281 N NE1 . TRP A 1 92 ? 20.653 34.614 32.421 1.00 16.63 ? 104 TRP A NE1 1 ATOM 1282 C CE2 . TRP A 1 92 ? 20.886 33.671 33.392 1.00 19.66 ? 104 TRP A CE2 1 ATOM 1283 C CE3 . TRP A 1 92 ? 21.923 33.587 35.583 1.00 21.69 ? 104 TRP A CE3 1 ATOM 1284 C CZ2 . TRP A 1 92 ? 20.554 32.306 33.435 1.00 22.57 ? 104 TRP A CZ2 1 ATOM 1285 C CZ3 . TRP A 1 92 ? 21.600 32.221 35.636 1.00 24.38 ? 104 TRP A CZ3 1 ATOM 1286 C CH2 . TRP A 1 92 ? 20.932 31.596 34.561 1.00 24.27 ? 104 TRP A CH2 1 ATOM 1287 H H . TRP A 1 92 ? 21.963 39.074 36.364 1.00 19.31 ? 104 TRP A H 1 ATOM 1288 H HA . TRP A 1 92 ? 22.209 38.440 33.730 1.00 18.26 ? 104 TRP A HA 1 ATOM 1289 H HB2 . TRP A 1 92 ? 23.313 36.695 34.734 1.00 20.35 ? 104 TRP A HB2 1 ATOM 1290 H HB3 . TRP A 1 92 ? 22.173 36.541 35.824 1.00 20.35 ? 104 TRP A HB3 1 ATOM 1291 H HD1 . TRP A 1 92 ? 21.109 36.614 32.348 1.00 23.62 ? 104 TRP A HD1 1 ATOM 1292 H HE1 . TRP A 1 92 ? 20.254 34.470 31.673 1.00 19.96 ? 104 TRP A HE1 1 ATOM 1293 H HE3 . TRP A 1 92 ? 22.360 33.999 36.293 1.00 26.02 ? 104 TRP A HE3 1 ATOM 1294 H HZ2 . TRP A 1 92 ? 20.120 31.892 32.725 1.00 27.08 ? 104 TRP A HZ2 1 ATOM 1295 H HZ3 . TRP A 1 92 ? 21.838 31.721 36.383 1.00 29.26 ? 104 TRP A HZ3 1 ATOM 1296 H HH2 . TRP A 1 92 ? 20.731 30.689 34.616 1.00 29.12 ? 104 TRP A HH2 1 ATOM 1297 N N . THR A 1 93 ? 19.770 38.979 33.677 1.00 17.35 ? 105 THR A N 1 ATOM 1298 C CA . THR A 1 93 ? 18.369 39.377 33.836 1.00 16.93 ? 105 THR A CA 1 ATOM 1299 C C . THR A 1 93 ? 17.389 38.511 33.060 1.00 21.54 ? 105 THR A C 1 ATOM 1300 O O . THR A 1 93 ? 16.366 39.003 32.578 1.00 22.48 ? 105 THR A O 1 ATOM 1301 C CB . THR A 1 93 ? 18.184 40.850 33.498 1.00 16.15 ? 105 THR A CB 1 ATOM 1302 O OG1 . THR A 1 93 ? 18.819 41.208 32.279 1.00 16.63 ? 105 THR A OG1 1 ATOM 1303 C CG2 . THR A 1 93 ? 18.802 41.719 34.583 1.00 21.32 ? 105 THR A CG2 1 ATOM 1304 H H . THR A 1 93 ? 20.140 39.230 32.942 1.00 20.82 ? 105 THR A H 1 ATOM 1305 H HA . THR A 1 93 ? 18.142 39.277 34.774 1.00 20.31 ? 105 THR A HA 1 ATOM 1306 H HB . THR A 1 93 ? 17.237 41.054 33.442 1.00 19.38 ? 105 THR A HB 1 ATOM 1307 H HG1 . THR A 1 93 ? 19.644 41.059 32.331 1.00 19.96 ? 105 THR A HG1 1 ATOM 1308 H HG21 . THR A 1 93 ? 18.682 42.657 34.364 1.00 25.59 ? 105 THR A HG21 1 ATOM 1309 H HG22 . THR A 1 93 ? 18.377 41.537 35.435 1.00 25.59 ? 105 THR A HG22 1 ATOM 1310 H HG23 . THR A 1 93 ? 19.751 41.531 34.657 1.00 25.59 ? 105 THR A HG23 1 ATOM 1311 N N . GLY A 1 94 ? 17.633 37.207 32.925 1.00 22.21 ? 106 GLY A N 1 ATOM 1312 C CA . GLY A 1 94 ? 16.538 36.264 32.715 1.00 21.97 ? 106 GLY A CA 1 ATOM 1313 C C . GLY A 1 94 ? 16.333 35.815 31.282 1.00 17.05 ? 106 GLY A C 1 ATOM 1314 O O . GLY A 1 94 ? 17.041 36.210 30.354 1.00 19.79 ? 106 GLY A O 1 ATOM 1315 H H . GLY A 1 94 ? 18.414 36.848 32.952 1.00 26.66 ? 106 GLY A H 1 ATOM 1316 H HA2 . GLY A 1 94 ? 16.698 35.474 33.254 1.00 26.36 ? 106 GLY A HA2 1 ATOM 1317 H HA3 . GLY A 1 94 ? 15.712 36.671 33.020 1.00 26.36 ? 106 GLY A HA3 1 ATOM 1318 N N . ASP A 1 95 ? 15.291 34.966 31.142 1.00 19.94 ? 107 ASP A N 1 ATOM 1319 C CA . ASP A 1 95 ? 14.752 34.432 29.878 1.00 18.36 ? 107 ASP A CA 1 ATOM 1320 C C . ASP A 1 95 ? 15.644 33.374 29.238 1.00 16.91 ? 107 ASP A C 1 ATOM 1321 O O . ASP A 1 95 ? 16.286 33.613 28.212 1.00 19.96 ? 107 ASP A O 1 ATOM 1322 C CB . ASP A 1 95 ? 14.484 35.568 28.893 1.00 16.37 ? 107 ASP A CB 1 ATOM 1323 C CG . ASP A 1 95 ? 13.015 35.970 28.829 1.00 18.03 ? 107 ASP A CG 1 ATOM 1324 O OD1 . ASP A 1 95 ? 12.229 35.500 29.671 1.00 18.38 ? 107 ASP A OD1 1 ATOM 1325 O OD2 . ASP A 1 95 ? 12.683 36.739 27.885 1.00 17.34 ? 107 ASP A OD2 1 ATOM 1326 H H . ASP A 1 95 ? 14.854 34.670 31.820 1.00 23.92 ? 107 ASP A H 1 ATOM 1327 H HA . ASP A 1 95 ? 13.900 34.010 30.069 1.00 22.03 ? 107 ASP A HA 1 ATOM 1328 H HB2 . ASP A 1 95 ? 14.995 36.346 29.164 1.00 19.64 ? 107 ASP A HB2 1 ATOM 1329 H HB3 . ASP A 1 95 ? 14.756 35.286 28.006 1.00 19.64 ? 107 ASP A HB3 1 ATOM 1330 N N . SER A 1 96 ? 15.662 32.189 29.836 1.00 20.88 ? 108 SER A N 1 ATOM 1331 C CA . SER A 1 96 ? 16.575 31.115 29.414 1.00 21.65 ? 108 SER A CA 1 ATOM 1332 C C . SER A 1 96 ? 15.953 30.082 28.466 1.00 18.63 ? 108 SER A C 1 ATOM 1333 O O . SER A 1 96 ? 16.642 29.656 27.527 1.00 21.25 ? 108 SER A O 1 ATOM 1334 C CB . SER A 1 96 ? 17.134 30.449 30.663 1.00 20.94 ? 108 SER A CB 1 ATOM 1335 O OG . SER A 1 96 ? 18.043 31.331 31.293 1.00 23.64 ? 108 SER A OG 1 ATOM 1336 H H . SER A 1 96 ? 15.152 31.973 30.494 1.00 25.06 ? 108 SER A H 1 ATOM 1337 H HA . SER A 1 96 ? 17.322 31.519 28.946 1.00 25.98 ? 108 SER A HA 1 ATOM 1338 H HB2 . SER A 1 96 ? 16.406 30.248 31.272 1.00 25.12 ? 108 SER A HB2 1 ATOM 1339 H HB3 . SER A 1 96 ? 17.598 29.635 30.412 1.00 25.12 ? 108 SER A HB3 1 ATOM 1340 H HG . SER A 1 96 ? 18.357 30.973 31.985 1.00 28.37 ? 108 SER A HG 1 ATOM 1341 N N . PRO A 1 97 ? 14.687 29.692 28.623 1.00 21.41 ? 109 PRO A N 1 ATOM 1342 C CA . PRO A 1 97 ? 14.061 28.759 27.657 1.00 23.87 ? 109 PRO A CA 1 ATOM 1343 C C . PRO A 1 97 ? 13.758 29.433 26.328 1.00 22.48 ? 109 PRO A C 1 ATOM 1344 O O . PRO A 1 97 ? 13.642 30.665 26.250 1.00 22.65 ? 109 PRO A O 1 ATOM 1345 C CB . PRO A 1 97 ? 12.764 28.333 28.358 1.00 23.68 ? 109 PRO A CB 1 ATOM 1346 C CG . PRO A 1 97 ? 12.937 28.680 29.812 1.00 22.60 ? 109 PRO A CG 1 ATOM 1347 C CD . PRO A 1 97 ? 13.787 29.940 29.763 1.00 20.08 ? 109 PRO A CD 1 ATOM 1348 H HA . PRO A 1 97 ? 14.626 27.984 27.512 1.00 28.64 ? 109 PRO A HA 1 ATOM 1349 H HB2 . PRO A 1 97 ? 12.016 28.822 27.980 1.00 28.42 ? 109 PRO A HB2 1 ATOM 1350 H HB3 . PRO A 1 97 ? 12.636 27.378 28.250 1.00 28.42 ? 109 PRO A HB3 1 ATOM 1351 H HG2 . PRO A 1 97 ? 12.073 28.856 30.217 1.00 27.12 ? 109 PRO A HG2 1 ATOM 1352 H HG3 . PRO A 1 97 ? 13.401 27.963 30.272 1.00 27.12 ? 109 PRO A HG3 1 ATOM 1353 H HD2 . PRO A 1 97 ? 13.231 30.717 29.594 1.00 24.10 ? 109 PRO A HD2 1 ATOM 1354 H HD3 . PRO A 1 97 ? 14.296 30.037 30.583 1.00 24.10 ? 109 PRO A HD3 1 ATOM 1355 N N . PRO A 1 98 ? 13.525 28.653 25.282 1.00 20.96 ? 110 PRO A N 1 ATOM 1356 C CA . PRO A 1 98 ? 13.328 29.206 23.940 1.00 19.99 ? 110 PRO A CA 1 ATOM 1357 C C . PRO A 1 98 ? 11.877 29.588 23.669 1.00 18.25 ? 110 PRO A C 1 ATOM 1358 O O . PRO A 1 98 ? 10.968 29.260 24.433 1.00 23.34 ? 110 PRO A O 1 ATOM 1359 C CB . PRO A 1 98 ? 13.755 28.044 23.036 1.00 24.68 ? 110 PRO A CB 1 ATOM 1360 C CG . PRO A 1 98 ? 13.360 26.842 23.810 1.00 24.34 ? 110 PRO A CG 1 ATOM 1361 C CD . PRO A 1 98 ? 13.524 27.180 25.278 1.00 27.02 ? 110 PRO A CD 1 ATOM 1362 H HA . PRO A 1 98 ? 13.906 29.970 23.791 1.00 23.99 ? 110 PRO A HA 1 ATOM 1363 H HB2 . PRO A 1 98 ? 13.278 28.087 22.193 1.00 29.61 ? 110 PRO A HB2 1 ATOM 1364 H HB3 . PRO A 1 98 ? 14.715 28.068 22.897 1.00 29.61 ? 110 PRO A HB3 1 ATOM 1365 H HG2 . PRO A 1 98 ? 12.434 26.626 23.616 1.00 29.21 ? 110 PRO A HG2 1 ATOM 1366 H HG3 . PRO A 1 98 ? 13.937 26.101 23.568 1.00 29.21 ? 110 PRO A HG3 1 ATOM 1367 H HD2 . PRO A 1 98 ? 12.775 26.840 25.791 1.00 32.43 ? 110 PRO A HD2 1 ATOM 1368 H HD3 . PRO A 1 98 ? 14.369 26.840 25.611 1.00 32.43 ? 110 PRO A HD3 1 ATOM 1369 N N . HIS A 1 99 ? 11.681 30.279 22.542 1.00 19.45 ? 111 HIS A N 1 ATOM 1370 C CA . HIS A 1 99 ? 10.357 30.721 22.097 1.00 24.54 ? 111 HIS A CA 1 ATOM 1371 C C . HIS A 1 99 ? 9.705 29.587 21.308 1.00 22.28 ? 111 HIS A C 1 ATOM 1372 O O . HIS A 1 99 ? 9.854 29.488 20.081 1.00 21.24 ? 111 HIS A O 1 ATOM 1373 C CB . HIS A 1 99 ? 10.462 31.964 21.231 1.00 20.19 ? 111 HIS A CB 1 ATOM 1374 C CG . HIS A 1 99 ? 11.065 33.149 21.927 1.00 22.86 ? 111 HIS A CG 1 ATOM 1375 N ND1 . HIS A 1 99 ? 12.426 33.322 22.043 1.00 20.35 ? 111 HIS A ND1 1 ATOM 1376 C CD2 . HIS A 1 99 ? 10.494 34.224 22.531 1.00 25.62 ? 111 HIS A CD2 1 ATOM 1377 C CE1 . HIS A 1 99 ? 12.672 34.456 22.686 1.00 28.84 ? 111 HIS A CE1 1 ATOM 1378 N NE2 . HIS A 1 99 ? 11.518 35.017 22.995 1.00 20.89 ? 111 HIS A NE2 1 ATOM 1379 H H . HIS A 1 99 ? 12.314 30.508 22.007 1.00 23.34 ? 111 HIS A H 1 ATOM 1380 H HA . HIS A 1 99 ? 9.803 30.924 22.867 1.00 29.45 ? 111 HIS A HA 1 ATOM 1381 H HB2 . HIS A 1 99 ? 11.016 31.761 20.461 1.00 24.23 ? 111 HIS A HB2 1 ATOM 1382 H HB3 . HIS A 1 99 ? 9.572 32.216 20.937 1.00 24.23 ? 111 HIS A HB3 1 ATOM 1383 H HD1 . HIS A 1 99 ? 13.024 32.783 21.739 1.00 24.42 ? 111 HIS A HD1 1 ATOM 1384 H HD2 . HIS A 1 99 ? 9.583 34.393 22.613 1.00 30.75 ? 111 HIS A HD2 1 ATOM 1385 H HE1 . HIS A 1 99 ? 13.514 34.793 22.893 1.00 34.61 ? 111 HIS A HE1 1 ATOM 1386 H HE2 . HIS A 1 99 ? 11.422 35.759 23.419 1.00 25.07 ? 111 HIS A HE2 1 ATOM 1387 N N . VAL A 1 100 ? 9.000 28.724 22.029 1.00 23.74 ? 112 VAL A N 1 ATOM 1388 C CA . VAL A 1 100 ? 8.231 27.632 21.435 1.00 23.44 ? 112 VAL A CA 1 ATOM 1389 C C . VAL A 1 100 ? 6.853 27.621 22.079 1.00 27.15 ? 112 VAL A C 1 ATOM 1390 O O . VAL A 1 100 ? 6.652 28.168 23.174 1.00 25.97 ? 112 VAL A O 1 ATOM 1391 C CB . VAL A 1 100 ? 8.942 26.267 21.610 1.00 24.15 ? 112 VAL A CB 1 ATOM 1392 C CG1 . VAL A 1 100 ? 10.240 26.238 20.824 1.00 28.61 ? 112 VAL A CG1 1 ATOM 1393 C CG2 . VAL A 1 100 ? 9.164 25.935 23.063 1.00 26.51 ? 112 VAL A CG2 1 ATOM 1394 H H . VAL A 1 100 ? 8.949 28.749 22.887 1.00 28.49 ? 112 VAL A H 1 ATOM 1395 H HA . VAL A 1 100 ? 8.122 27.798 20.485 1.00 28.13 ? 112 VAL A HA 1 ATOM 1396 H HB . VAL A 1 100 ? 8.368 25.577 21.242 1.00 28.98 ? 112 VAL A HB 1 ATOM 1397 H HG11 . VAL A 1 100 ? 10.665 25.376 20.950 1.00 34.34 ? 112 VAL A HG11 1 ATOM 1398 H HG12 . VAL A 1 100 ? 10.043 26.377 19.885 1.00 34.34 ? 112 VAL A HG12 1 ATOM 1399 H HG13 . VAL A 1 100 ? 10.821 26.945 21.149 1.00 34.34 ? 112 VAL A HG13 1 ATOM 1400 H HG21 . VAL A 1 100 ? 9.610 25.076 23.126 1.00 31.82 ? 112 VAL A HG21 1 ATOM 1401 H HG22 . VAL A 1 100 ? 9.716 26.625 23.463 1.00 31.82 ? 112 VAL A HG22 1 ATOM 1402 H HG23 . VAL A 1 100 ? 8.305 25.896 23.512 1.00 31.82 ? 112 VAL A HG23 1 ATOM 1403 N N . PRO A 1 101 ? 5.871 27.004 21.421 1.00 25.93 ? 113 PRO A N 1 ATOM 1404 C CA . PRO A 1 101 ? 4.514 26.966 21.985 1.00 25.28 ? 113 PRO A CA 1 ATOM 1405 C C . PRO A 1 101 ? 4.481 26.310 23.351 1.00 27.16 ? 113 PRO A C 1 ATOM 1406 O O . PRO A 1 101 ? 5.298 25.456 23.680 1.00 26.51 ? 113 PRO A O 1 ATOM 1407 C CB . PRO A 1 101 ? 3.714 26.148 20.954 1.00 33.32 ? 113 PRO A CB 1 ATOM 1408 C CG . PRO A 1 101 ? 4.478 26.248 19.705 1.00 30.10 ? 113 PRO A CG 1 ATOM 1409 C CD . PRO A 1 101 ? 5.935 26.406 20.080 1.00 29.63 ? 113 PRO A CD 1 ATOM 1410 H HA . PRO A 1 101 ? 4.145 27.861 22.045 1.00 30.33 ? 113 PRO A HA 1 ATOM 1411 H HB2 . PRO A 1 101 ? 3.654 25.224 21.246 1.00 39.98 ? 113 PRO A HB2 1 ATOM 1412 H HB3 . PRO A 1 101 ? 2.830 26.532 20.847 1.00 39.98 ? 113 PRO A HB3 1 ATOM 1413 H HG2 . PRO A 1 101 ? 4.350 25.439 19.185 1.00 36.12 ? 113 PRO A HG2 1 ATOM 1414 H HG3 . PRO A 1 101 ? 4.173 27.021 19.205 1.00 36.12 ? 113 PRO A HG3 1 ATOM 1415 H HD2 . PRO A 1 101 ? 6.372 25.541 20.116 1.00 35.55 ? 113 PRO A HD2 1 ATOM 1416 H HD3 . PRO A 1 101 ? 6.381 27.006 19.462 1.00 35.55 ? 113 PRO A HD3 1 ATOM 1417 N N . VAL A 1 102 ? 3.516 26.731 24.150 1.00 23.96 ? 114 VAL A N 1 ATOM 1418 C CA . VAL A 1 102 ? 3.390 26.277 25.528 1.00 24.15 ? 114 VAL A CA 1 ATOM 1419 C C . VAL A 1 102 ? 3.364 24.749 25.607 1.00 34.86 ? 114 VAL A C 1 ATOM 1420 O O . VAL A 1 102 ? 4.022 24.179 26.480 1.00 28.23 ? 114 VAL A O 1 ATOM 1421 C CB . VAL A 1 102 ? 2.154 26.908 26.187 1.00 29.30 ? 114 VAL A CB 1 ATOM 1422 C CG1 . VAL A 1 102 ? 1.819 26.260 27.506 1.00 28.99 ? 114 VAL A CG1 1 ATOM 1423 C CG2 . VAL A 1 102 ? 2.409 28.423 26.409 1.00 32.52 ? 114 VAL A CG2 1 ATOM 1424 H H . VAL A 1 102 ? 2.908 27.292 23.914 1.00 28.75 ? 114 VAL A H 1 ATOM 1425 H HA . VAL A 1 102 ? 4.168 26.579 26.022 1.00 28.99 ? 114 VAL A HA 1 ATOM 1426 H HB . VAL A 1 102 ? 1.391 26.811 25.597 1.00 35.15 ? 114 VAL A HB 1 ATOM 1427 H HG11 . VAL A 1 102 ? 1.034 26.692 27.880 1.00 34.79 ? 114 VAL A HG11 1 ATOM 1428 H HG12 . VAL A 1 102 ? 1.639 25.318 27.358 1.00 34.79 ? 114 VAL A HG12 1 ATOM 1429 H HG13 . VAL A 1 102 ? 2.572 26.362 28.109 1.00 34.79 ? 114 VAL A HG13 1 ATOM 1430 H HG21 . VAL A 1 102 ? 1.627 28.817 26.825 1.00 39.02 ? 114 VAL A HG21 1 ATOM 1431 H HG22 . VAL A 1 102 ? 3.181 28.532 26.986 1.00 39.02 ? 114 VAL A HG22 1 ATOM 1432 H HG23 . VAL A 1 102 ? 2.576 28.844 25.551 1.00 39.02 ? 114 VAL A HG23 1 ATOM 1433 N N . PRO A 1 103 ? 2.645 24.037 24.735 1.00 28.95 ? 115 PRO A N 1 ATOM 1434 C CA . PRO A 1 103 ? 2.620 22.564 24.860 1.00 36.77 ? 115 PRO A CA 1 ATOM 1435 C C . PRO A 1 103 ? 3.958 21.896 24.583 1.00 35.55 ? 115 PRO A C 1 ATOM 1436 O O . PRO A 1 103 ? 4.114 20.715 24.915 1.00 37.71 ? 115 PRO A O 1 ATOM 1437 C CB . PRO A 1 103 ? 1.562 22.133 23.828 1.00 35.02 ? 115 PRO A CB 1 ATOM 1438 C CG . PRO A 1 103 ? 0.695 23.316 23.651 1.00 38.24 ? 115 PRO A CG 1 ATOM 1439 C CD . PRO A 1 103 ? 1.584 24.534 23.849 1.00 30.41 ? 115 PRO A CD 1 ATOM 1440 H HA . PRO A 1 103 ? 2.318 22.311 25.746 1.00 44.12 ? 115 PRO A HA 1 ATOM 1441 H HB2 . PRO A 1 103 ? 1.995 21.897 22.993 1.00 42.02 ? 115 PRO A HB2 1 ATOM 1442 H HB3 . PRO A 1 103 ? 1.053 21.383 24.175 1.00 42.02 ? 115 PRO A HB3 1 ATOM 1443 H HG2 . PRO A 1 103 ? 0.320 23.312 22.756 1.00 45.89 ? 115 PRO A HG2 1 ATOM 1444 H HG3 . PRO A 1 103 ? -0.012 23.301 24.315 1.00 45.89 ? 115 PRO A HG3 1 ATOM 1445 H HD2 . PRO A 1 103 ? 1.958 24.821 23.002 1.00 36.49 ? 115 PRO A HD2 1 ATOM 1446 H HD3 . PRO A 1 103 ? 1.089 25.248 24.281 1.00 36.49 ? 115 PRO A HD3 1 ATOM 1447 N N . GLU A 1 104 ? 4.919 22.587 23.975 1.00 31.69 ? 116 GLU A N 1 ATOM 1448 C CA . GLU A 1 104 ? 6.242 22.019 23.759 1.00 29.40 ? 116 GLU A CA 1 ATOM 1449 C C . GLU A 1 104 ? 7.174 22.217 24.947 1.00 30.98 ? 116 GLU A C 1 ATOM 1450 O O . GLU A 1 104 ? 8.340 21.816 24.879 1.00 31.90 ? 116 GLU A O 1 ATOM 1451 C CB . GLU A 1 104 ? 6.866 22.606 22.498 1.00 31.39 ? 116 GLU A CB 1 ATOM 1452 C CG . GLU A 1 104 ? 5.998 22.367 21.273 1.00 37.98 ? 116 GLU A CG 1 ATOM 1453 C CD . GLU A 1 104 ? 6.663 22.715 19.962 1.00 41.56 ? 116 GLU A CD 1 ATOM 1454 O OE1 . GLU A 1 104 ? 7.886 22.985 19.927 1.00 44.23 ? 116 GLU A OE1 1 ATOM 1455 O OE2 . GLU A 1 104 ? 5.942 22.709 18.944 1.00 50.39 ? 116 GLU A OE2 1 ATOM 1456 H H . GLU A 1 104 ? 4.828 23.389 23.677 1.00 38.03 ? 116 GLU A H 1 ATOM 1457 H HA . GLU A 1 104 ? 6.147 21.064 23.619 1.00 35.28 ? 116 GLU A HA 1 ATOM 1458 H HB2 . GLU A 1 104 ? 6.974 23.563 22.612 1.00 37.67 ? 116 GLU A HB2 1 ATOM 1459 H HB3 . GLU A 1 104 ? 7.728 22.188 22.345 1.00 37.67 ? 116 GLU A HB3 1 ATOM 1460 H HG2 . GLU A 1 104 ? 5.756 21.428 21.242 1.00 45.58 ? 116 GLU A HG2 1 ATOM 1461 H HG3 . GLU A 1 104 ? 5.196 22.908 21.350 1.00 45.58 ? 116 GLU A HG3 1 ATOM 1462 N N . LEU A 1 105 ? 6.681 22.783 26.040 1.00 29.73 ? 117 LEU A N 1 ATOM 1463 C CA . LEU A 1 105 ? 7.460 22.970 27.245 1.00 29.90 ? 117 LEU A CA 1 ATOM 1464 C C . LEU A 1 105 ? 6.701 22.378 28.417 1.00 29.77 ? 117 LEU A C 1 ATOM 1465 O O . LEU A 1 105 ? 5.614 21.813 28.265 1.00 32.36 ? 117 LEU A O 1 ATOM 1466 C CB . LEU A 1 105 ? 7.768 24.464 27.472 1.00 28.15 ? 117 LEU A CB 1 ATOM 1467 C CG . LEU A 1 105 ? 8.718 25.070 26.457 1.00 30.89 ? 117 LEU A CG 1 ATOM 1468 C CD1 . LEU A 1 105 ? 8.744 26.622 26.550 1.00 26.91 ? 117 LEU A CD1 1 ATOM 1469 C CD2 . LEU A 1 105 ? 10.100 24.527 26.644 1.00 29.47 ? 117 LEU A CD2 1 ATOM 1470 H H . LEU A 1 105 ? 5.874 23.073 26.105 1.00 35.68 ? 117 LEU A H 1 ATOM 1471 H HA . LEU A 1 105 ? 8.302 22.497 27.158 1.00 35.88 ? 117 LEU A HA 1 ATOM 1472 H HB2 . LEU A 1 105 ? 6.936 24.962 27.432 1.00 33.78 ? 117 LEU A HB2 1 ATOM 1473 H HB3 . LEU A 1 105 ? 8.169 24.567 28.349 1.00 33.78 ? 117 LEU A HB3 1 ATOM 1474 H HG . LEU A 1 105 ? 8.420 24.829 25.566 1.00 37.06 ? 117 LEU A HG 1 ATOM 1475 H HD11 . LEU A 1 105 ? 9.361 26.967 25.887 1.00 32.29 ? 117 LEU A HD11 1 ATOM 1476 H HD12 . LEU A 1 105 ? 7.852 26.963 26.382 1.00 32.29 ? 117 LEU A HD12 1 ATOM 1477 H HD13 . LEU A 1 105 ? 9.035 26.879 27.439 1.00 32.29 ? 117 LEU A HD13 1 ATOM 1478 H HD21 . LEU A 1 105 ? 10.689 24.928 25.985 1.00 35.37 ? 117 LEU A HD21 1 ATOM 1479 H HD22 . LEU A 1 105 ? 10.407 24.745 27.538 1.00 35.37 ? 117 LEU A HD22 1 ATOM 1480 H HD23 . LEU A 1 105 ? 10.080 23.564 26.527 1.00 35.37 ? 117 LEU A HD23 1 ATOM 1481 N N . SER A 1 106 ? 7.300 22.503 29.595 1.00 27.45 ? 118 SER A N 1 ATOM 1482 C CA . SER A 1 106 ? 6.697 22.076 30.849 1.00 29.02 ? 118 SER A CA 1 ATOM 1483 C C . SER A 1 106 ? 7.509 22.700 31.965 1.00 22.61 ? 118 SER A C 1 ATOM 1484 O O . SER A 1 106 ? 8.610 23.207 31.739 1.00 32.32 ? 118 SER A O 1 ATOM 1485 C CB . SER A 1 106 ? 6.701 20.552 30.994 1.00 31.17 ? 118 SER A CB 1 ATOM 1486 O OG . SER A 1 106 ? 8.033 20.101 31.126 1.00 33.33 ? 118 SER A OG 1 ATOM 1487 H H . SER A 1 106 ? 8.083 22.844 29.695 1.00 32.94 ? 118 SER A H 1 ATOM 1488 H HA . SER A 1 106 ? 5.783 22.396 30.905 1.00 34.82 ? 118 SER A HA 1 ATOM 1489 H HB2 . SER A 1 106 ? 6.198 20.303 31.785 1.00 37.40 ? 118 SER A HB2 1 ATOM 1490 H HB3 . SER A 1 106 ? 6.305 20.153 30.203 1.00 37.40 ? 118 SER A HB3 1 ATOM 1491 H HG . SER A 1 106 ? 8.046 19.265 31.206 1.00 39.99 ? 118 SER A HG 1 ATOM 1492 N N . THR A 1 107 ? 6.982 22.609 33.181 1.00 28.60 ? 119 THR A N 1 ATOM 1493 C CA . THR A 1 107 ? 7.731 23.077 34.336 1.00 30.84 ? 119 THR A CA 1 ATOM 1494 C C . THR A 1 107 ? 9.087 22.381 34.434 1.00 35.35 ? 119 THR A C 1 ATOM 1495 O O . THR A 1 107 ? 10.118 23.023 34.660 1.00 29.07 ? 119 THR A O 1 ATOM 1496 C CB . THR A 1 107 ? 6.891 22.868 35.586 1.00 32.14 ? 119 THR A CB 1 ATOM 1497 O OG1 . THR A 1 107 ? 5.738 23.712 35.506 1.00 31.75 ? 119 THR A OG1 1 ATOM 1498 C CG2 . THR A 1 107 ? 7.662 23.194 36.838 1.00 27.45 ? 119 THR A CG2 1 ATOM 1499 H H . THR A 1 107 ? 6.205 22.285 33.361 1.00 34.32 ? 119 THR A H 1 ATOM 1500 H HA . THR A 1 107 ? 7.892 24.029 34.241 1.00 37.00 ? 119 THR A HA 1 ATOM 1501 H HB . THR A 1 107 ? 6.609 21.941 35.633 1.00 38.57 ? 119 THR A HB 1 ATOM 1502 H HG1 . THR A 1 107 ? 5.974 24.516 35.454 1.00 38.10 ? 119 THR A HG1 1 ATOM 1503 H HG21 . THR A 1 107 ? 7.103 23.052 37.618 1.00 32.94 ? 119 THR A HG21 1 ATOM 1504 H HG22 . THR A 1 107 ? 8.445 22.625 36.903 1.00 32.94 ? 119 THR A HG22 1 ATOM 1505 H HG23 . THR A 1 107 ? 7.947 24.121 36.819 1.00 32.94 ? 119 THR A HG23 1 ATOM 1506 N N . GLY A 1 108 ? 9.112 21.064 34.269 1.00 35.61 ? 120 GLY A N 1 ATOM 1507 C CA . GLY A 1 108 ? 10.380 20.359 34.354 1.00 33.76 ? 120 GLY A CA 1 ATOM 1508 C C . GLY A 1 108 ? 11.351 20.750 33.256 1.00 32.95 ? 120 GLY A C 1 ATOM 1509 O O . GLY A 1 108 ? 12.565 20.803 33.473 1.00 35.60 ? 120 GLY A O 1 ATOM 1510 H H . GLY A 1 108 ? 8.428 20.568 34.112 1.00 42.73 ? 120 GLY A H 1 ATOM 1511 H HA2 . GLY A 1 108 ? 10.795 20.546 35.210 1.00 40.52 ? 120 GLY A HA2 1 ATOM 1512 H HA3 . GLY A 1 108 ? 10.220 19.404 34.294 1.00 40.52 ? 120 GLY A HA3 1 ATOM 1513 N N . THR A 1 109 ? 10.835 21.028 32.059 1.00 27.93 ? 121 THR A N 1 ATOM 1514 C CA . THR A 1 109 ? 11.711 21.443 30.969 1.00 24.75 ? 121 THR A CA 1 ATOM 1515 C C . THR A 1 109 ? 12.280 22.834 31.228 1.00 28.13 ? 121 THR A C 1 ATOM 1516 O O . THR A 1 109 ? 13.452 23.101 30.918 1.00 25.28 ? 121 THR A O 1 ATOM 1517 C CB . THR A 1 109 ? 10.956 21.416 29.643 1.00 36.20 ? 121 THR A CB 1 ATOM 1518 O OG1 . THR A 1 109 ? 10.385 20.117 29.450 1.00 41.28 ? 121 THR A OG1 1 ATOM 1519 C CG2 . THR A 1 109 ? 11.873 21.726 28.477 1.00 30.09 ? 121 THR A CG2 1 ATOM 1520 H H . THR A 1 109 ? 10.001 20.984 31.857 1.00 33.51 ? 121 THR A H 1 ATOM 1521 H HA . THR A 1 109 ? 12.454 20.821 30.905 1.00 29.70 ? 121 THR A HA 1 ATOM 1522 H HB . THR A 1 109 ? 10.248 22.079 29.661 1.00 43.44 ? 121 THR A HB 1 ATOM 1523 H HG1 . THR A 1 109 ? 9.853 19.941 30.076 1.00 49.53 ? 121 THR A HG1 1 ATOM 1524 H HG21 . THR A 1 109 ? 11.373 21.704 27.646 1.00 36.11 ? 121 THR A HG21 1 ATOM 1525 H HG22 . THR A 1 109 ? 12.262 22.608 28.587 1.00 36.11 ? 121 THR A HG22 1 ATOM 1526 H HG23 . THR A 1 109 ? 12.587 21.071 28.433 1.00 36.11 ? 121 THR A HG23 1 ATOM 1527 N N . VAL A 1 110 ? 11.444 23.748 31.719 1.00 25.52 ? 122 VAL A N 1 ATOM 1528 C CA . VAL A 1 110 ? 11.914 25.100 32.023 1.00 28.58 ? 122 VAL A CA 1 ATOM 1529 C C . VAL A 1 110 ? 13.008 25.037 33.068 1.00 25.97 ? 122 VAL A C 1 ATOM 1530 O O . VAL A 1 110 ? 14.080 25.636 32.908 1.00 23.96 ? 122 VAL A O 1 ATOM 1531 C CB . VAL A 1 110 ? 10.737 25.984 32.478 1.00 23.52 ? 122 VAL A CB 1 ATOM 1532 C CG1 . VAL A 1 110 ? 11.213 27.254 33.197 1.00 27.10 ? 122 VAL A CG1 1 ATOM 1533 C CG2 . VAL A 1 110 ? 9.885 26.354 31.265 1.00 25.44 ? 122 VAL A CG2 1 ATOM 1534 H H . VAL A 1 110 ? 10.611 23.613 31.884 1.00 30.63 ? 122 VAL A H 1 ATOM 1535 H HA . VAL A 1 110 ? 12.290 25.492 31.219 1.00 34.29 ? 122 VAL A HA 1 ATOM 1536 H HB . VAL A 1 110 ? 10.182 25.481 33.094 1.00 28.22 ? 122 VAL A HB 1 ATOM 1537 H HG11 . VAL A 1 110 ? 10.439 27.775 33.463 1.00 32.52 ? 122 VAL A HG11 1 ATOM 1538 H HG12 . VAL A 1 110 ? 11.726 26.999 33.979 1.00 32.52 ? 122 VAL A HG12 1 ATOM 1539 H HG13 . VAL A 1 110 ? 11.767 27.770 32.590 1.00 32.52 ? 122 VAL A HG13 1 ATOM 1540 H HG21 . VAL A 1 110 ? 9.146 26.910 31.556 1.00 30.53 ? 122 VAL A HG21 1 ATOM 1541 H HG22 . VAL A 1 110 ? 10.434 26.839 30.630 1.00 30.53 ? 122 VAL A HG22 1 ATOM 1542 H HG23 . VAL A 1 110 ? 9.547 25.540 30.858 1.00 30.53 ? 122 VAL A HG23 1 ATOM 1543 N N . ILE A 1 111 ? 12.764 24.281 34.147 1.00 27.05 ? 123 ILE A N 1 ATOM 1544 C CA . ILE A 1 111 ? 13.750 24.175 35.217 1.00 27.09 ? 123 ILE A CA 1 ATOM 1545 C C . ILE A 1 111 ? 15.035 23.567 34.675 1.00 30.05 ? 123 ILE A C 1 ATOM 1546 O O . ILE A 1 111 ? 16.144 23.988 35.030 1.00 29.26 ? 123 ILE A O 1 ATOM 1547 C CB . ILE A 1 111 ? 13.170 23.374 36.397 1.00 29.38 ? 123 ILE A CB 1 ATOM 1548 C CG1 . ILE A 1 111 ? 12.085 24.194 37.089 1.00 30.31 ? 123 ILE A CG1 1 ATOM 1549 C CG2 . ILE A 1 111 ? 14.269 22.990 37.407 1.00 31.06 ? 123 ILE A CG2 1 ATOM 1550 C CD1 . ILE A 1 111 ? 11.339 23.486 38.174 1.00 30.78 ? 123 ILE A CD1 1 ATOM 1551 H H . ILE A 1 111 ? 12.044 23.827 34.277 1.00 32.46 ? 123 ILE A H 1 ATOM 1552 H HA . ILE A 1 111 ? 13.958 25.066 35.538 1.00 32.51 ? 123 ILE A HA 1 ATOM 1553 H HB . ILE A 1 111 ? 12.770 22.560 36.052 1.00 35.25 ? 123 ILE A HB 1 ATOM 1554 H HG12 . ILE A 1 111 ? 12.498 24.978 37.483 1.00 36.37 ? 123 ILE A HG12 1 ATOM 1555 H HG13 . ILE A 1 111 ? 11.437 24.469 36.422 1.00 36.37 ? 123 ILE A HG13 1 ATOM 1556 H HG21 . ILE A 1 111 ? 13.867 22.489 38.134 1.00 37.27 ? 123 ILE A HG21 1 ATOM 1557 H HG22 . ILE A 1 111 ? 14.934 22.446 36.958 1.00 37.27 ? 123 ILE A HG22 1 ATOM 1558 H HG23 . ILE A 1 111 ? 14.679 23.800 37.750 1.00 37.27 ? 123 ILE A HG23 1 ATOM 1559 H HD11 . ILE A 1 111 ? 10.677 24.089 38.547 1.00 36.93 ? 123 ILE A HD11 1 ATOM 1560 H HD12 . ILE A 1 111 ? 10.903 22.705 37.799 1.00 36.93 ? 123 ILE A HD12 1 ATOM 1561 H HD13 . ILE A 1 111 ? 11.967 23.216 38.863 1.00 36.93 ? 123 ILE A HD13 1 ATOM 1562 N N . LYS A 1 112 ? 14.904 22.627 33.742 1.00 28.20 ? 124 LYS A N 1 ATOM 1563 C CA . LYS A 1 112 ? 16.081 21.987 33.165 1.00 28.93 ? 124 LYS A CA 1 ATOM 1564 C C . LYS A 1 112 ? 16.936 22.970 32.379 1.00 26.58 ? 124 LYS A C 1 ATOM 1565 O O . LYS A 1 112 ? 18.170 22.892 32.406 1.00 27.17 ? 124 LYS A O 1 ATOM 1566 C CB . LYS A 1 112 ? 15.638 20.824 32.278 1.00 31.45 ? 124 LYS A CB 1 ATOM 1567 C CG . LYS A 1 112 ? 16.751 20.126 31.539 1.00 35.31 ? 124 LYS A CG 1 ATOM 1568 C CD . LYS A 1 112 ? 16.218 18.946 30.737 1.00 48.65 ? 124 LYS A CD 1 ATOM 1569 C CE . LYS A 1 112 ? 17.332 18.217 30.016 1.00 55.25 ? 124 LYS A CE 1 ATOM 1570 N NZ . LYS A 1 112 ? 16.775 17.138 29.156 1.00 73.93 ? 124 LYS A NZ 1 ATOM 1571 H H . LYS A 1 112 ? 14.154 22.345 33.430 1.00 33.84 ? 124 LYS A H 1 ATOM 1572 H HA . LYS A 1 112 ? 16.625 21.625 33.882 1.00 34.71 ? 124 LYS A HA 1 ATOM 1573 H HB2 . LYS A 1 112 ? 15.196 20.163 32.833 1.00 37.75 ? 124 LYS A HB2 1 ATOM 1574 H HB3 . LYS A 1 112 ? 15.014 21.162 31.616 1.00 37.75 ? 124 LYS A HB3 1 ATOM 1575 H HG2 . LYS A 1 112 ? 17.170 20.749 30.925 1.00 42.38 ? 124 LYS A HG2 1 ATOM 1576 H HG3 . LYS A 1 112 ? 17.402 19.793 32.177 1.00 42.38 ? 124 LYS A HG3 1 ATOM 1577 H HD2 . LYS A 1 112 ? 15.784 18.320 31.338 1.00 58.38 ? 124 LYS A HD2 1 ATOM 1578 H HD3 . LYS A 1 112 ? 15.587 19.268 30.075 1.00 58.38 ? 124 LYS A HD3 1 ATOM 1579 H HE2 . LYS A 1 112 ? 17.815 18.841 29.452 1.00 66.30 ? 124 LYS A HE2 1 ATOM 1580 H HE3 . LYS A 1 112 ? 17.929 17.814 30.666 1.00 66.30 ? 124 LYS A HE3 1 ATOM 1581 H HZ1 . LYS A 1 112 ? 17.435 16.714 28.735 1.00 88.72 ? 124 LYS A HZ1 1 ATOM 1582 H HZ2 . LYS A 1 112 ? 16.327 16.553 29.654 1.00 88.72 ? 124 LYS A HZ2 1 ATOM 1583 H HZ3 . LYS A 1 112 ? 16.223 17.486 28.551 1.00 88.72 ? 124 LYS A HZ3 1 ATOM 1584 N N . VAL A 1 113 ? 16.307 23.884 31.633 1.00 27.53 ? 125 VAL A N 1 ATOM 1585 C CA . VAL A 1 113 ? 17.079 24.850 30.860 1.00 26.34 ? 125 VAL A CA 1 ATOM 1586 C C . VAL A 1 113 ? 17.738 25.878 31.777 1.00 24.10 ? 125 VAL A C 1 ATOM 1587 O O . VAL A 1 113 ? 18.903 26.243 31.579 1.00 25.10 ? 125 VAL A O 1 ATOM 1588 C CB . VAL A 1 113 ? 16.176 25.532 29.816 1.00 22.03 ? 125 VAL A CB 1 ATOM 1589 C CG1 . VAL A 1 113 ? 16.924 26.661 29.126 1.00 23.89 ? 125 VAL A CG1 1 ATOM 1590 C CG2 . VAL A 1 113 ? 15.688 24.504 28.799 1.00 23.25 ? 125 VAL A CG2 1 ATOM 1591 H H . VAL A 1 113 ? 15.453 23.963 31.561 1.00 33.04 ? 125 VAL A H 1 ATOM 1592 H HA . VAL A 1 113 ? 17.782 24.381 30.384 1.00 31.61 ? 125 VAL A HA 1 ATOM 1593 H HB . VAL A 1 113 ? 15.401 25.909 30.262 1.00 26.43 ? 125 VAL A HB 1 ATOM 1594 H HG11 . VAL A 1 113 ? 16.337 27.076 28.475 1.00 28.67 ? 125 VAL A HG11 1 ATOM 1595 H HG12 . VAL A 1 113 ? 17.194 27.313 29.792 1.00 28.67 ? 125 VAL A HG12 1 ATOM 1596 H HG13 . VAL A 1 113 ? 17.706 26.296 28.683 1.00 28.67 ? 125 VAL A HG13 1 ATOM 1597 H HG21 . VAL A 1 113 ? 15.121 24.948 28.149 1.00 27.90 ? 125 VAL A HG21 1 ATOM 1598 H HG22 . VAL A 1 113 ? 16.455 24.111 28.355 1.00 27.90 ? 125 VAL A HG22 1 ATOM 1599 H HG23 . VAL A 1 113 ? 15.185 23.816 29.262 1.00 27.90 ? 125 VAL A HG23 1 ATOM 1600 N N . ILE A 1 114 ? 16.994 26.382 32.765 1.00 21.86 ? 126 ILE A N 1 ATOM 1601 C CA . ILE A 1 114 ? 17.556 27.338 33.718 1.00 21.67 ? 126 ILE A CA 1 ATOM 1602 C C . ILE A 1 114 ? 18.729 26.705 34.447 1.00 26.70 ? 126 ILE A C 1 ATOM 1603 O O . ILE A 1 114 ? 19.744 27.355 34.705 1.00 23.45 ? 126 ILE A O 1 ATOM 1604 C CB . ILE A 1 114 ? 16.489 27.829 34.712 1.00 22.65 ? 126 ILE A CB 1 ATOM 1605 C CG1 . ILE A 1 114 ? 15.373 28.583 33.965 1.00 23.51 ? 126 ILE A CG1 1 ATOM 1606 C CG2 . ILE A 1 114 ? 17.123 28.785 35.733 1.00 21.69 ? 126 ILE A CG2 1 ATOM 1607 C CD1 . ILE A 1 114 ? 14.170 28.886 34.825 1.00 21.22 ? 126 ILE A CD1 1 ATOM 1608 H H . ILE A 1 114 ? 16.167 26.188 32.903 1.00 26.23 ? 126 ILE A H 1 ATOM 1609 H HA . ILE A 1 114 ? 17.888 28.109 33.231 1.00 26.01 ? 126 ILE A HA 1 ATOM 1610 H HB . ILE A 1 114 ? 16.107 27.068 35.177 1.00 27.18 ? 126 ILE A HB 1 ATOM 1611 H HG12 . ILE A 1 114 ? 15.727 29.426 33.641 1.00 28.21 ? 126 ILE A HG12 1 ATOM 1612 H HG13 . ILE A 1 114 ? 15.075 28.042 33.217 1.00 28.21 ? 126 ILE A HG13 1 ATOM 1613 H HG21 . ILE A 1 114 ? 16.438 29.085 36.351 1.00 26.02 ? 126 ILE A HG21 1 ATOM 1614 H HG22 . ILE A 1 114 ? 17.821 28.314 36.214 1.00 26.02 ? 126 ILE A HG22 1 ATOM 1615 H HG23 . ILE A 1 114 ? 17.500 29.545 35.262 1.00 26.02 ? 126 ILE A HG23 1 ATOM 1616 H HD11 . ILE A 1 114 ? 13.512 29.359 34.292 1.00 25.47 ? 126 ILE A HD11 1 ATOM 1617 H HD12 . ILE A 1 114 ? 13.796 28.052 35.150 1.00 25.47 ? 126 ILE A HD12 1 ATOM 1618 H HD13 . ILE A 1 114 ? 14.449 29.437 35.574 1.00 25.47 ? 126 ILE A HD13 1 ATOM 1619 N N . THR A 1 115 ? 18.590 25.432 34.807 1.00 27.05 ? 127 THR A N 1 ATOM 1620 C CA . THR A 1 115 ? 19.680 24.709 35.460 1.00 23.11 ? 127 THR A CA 1 ATOM 1621 C C . THR A 1 115 ? 20.892 24.640 34.556 1.00 23.40 ? 127 THR A C 1 ATOM 1622 O O . THR A 1 115 ? 22.016 24.958 34.968 1.00 28.57 ? 127 THR A O 1 ATOM 1623 C CB . THR A 1 115 ? 19.200 23.310 35.852 1.00 24.07 ? 127 THR A CB 1 ATOM 1624 O OG1 . THR A 1 115 ? 18.112 23.415 36.760 1.00 26.08 ? 127 THR A OG1 1 ATOM 1625 C CG2 . THR A 1 115 ? 20.343 22.496 36.477 1.00 31.18 ? 127 THR A CG2 1 ATOM 1626 H H . THR A 1 115 ? 17.878 24.965 34.685 1.00 32.46 ? 127 THR A H 1 ATOM 1627 H HA . THR A 1 115 ? 19.933 25.179 36.270 1.00 27.74 ? 127 THR A HA 1 ATOM 1628 H HB . THR A 1 115 ? 18.902 22.844 35.055 1.00 28.88 ? 127 THR A HB 1 ATOM 1629 H HG1 . THR A 1 115 ? 17.477 23.832 36.401 1.00 31.30 ? 127 THR A HG1 1 ATOM 1630 H HG21 . THR A 1 115 ? 20.025 21.613 36.721 1.00 37.42 ? 127 THR A HG21 1 ATOM 1631 H HG22 . THR A 1 115 ? 21.071 22.406 35.843 1.00 37.42 ? 127 THR A HG22 1 ATOM 1632 H HG23 . THR A 1 115 ? 20.671 22.944 37.273 1.00 37.42 ? 127 THR A HG23 1 ATOM 1633 N N . ASN A 1 116 ? 20.675 24.296 33.291 1.00 26.37 ? 128 ASN A N 1 ATOM 1634 C CA . ASN A 1 116 ? 21.783 24.234 32.356 1.00 24.02 ? 128 ASN A CA 1 ATOM 1635 C C . ASN A 1 116 ? 22.510 25.571 32.290 1.00 29.81 ? 128 ASN A C 1 ATOM 1636 O O . ASN A 1 116 ? 23.746 25.622 32.364 1.00 25.14 ? 128 ASN A O 1 ATOM 1637 C CB . ASN A 1 116 ? 21.289 23.819 30.972 1.00 24.56 ? 128 ASN A CB 1 ATOM 1638 C CG . ASN A 1 116 ? 22.408 23.655 29.990 1.00 28.04 ? 128 ASN A CG 1 ATOM 1639 O OD1 . ASN A 1 116 ? 23.044 24.624 29.569 1.00 28.78 ? 128 ASN A OD1 1 ATOM 1640 N ND2 . ASN A 1 116 ? 22.671 22.415 29.605 1.00 41.80 ? 128 ASN A ND2 1 ATOM 1641 H H . ASN A 1 116 ? 19.909 24.097 32.956 1.00 31.65 ? 128 ASN A H 1 ATOM 1642 H HA . ASN A 1 116 ? 22.415 23.565 32.661 1.00 28.82 ? 128 ASN A HA 1 ATOM 1643 H HB2 . ASN A 1 116 ? 20.824 22.971 31.043 1.00 29.47 ? 128 ASN A HB2 1 ATOM 1644 H HB3 . ASN A 1 116 ? 20.688 24.501 30.633 1.00 29.47 ? 128 ASN A HB3 1 ATOM 1645 H HD21 . ASN A 1 116 ? 22.206 21.760 29.914 1.00 50.16 ? 128 ASN A HD21 1 ATOM 1646 N N . MET A 1 117 ? 21.761 26.673 32.124 1.00 24.26 ? 129 MET A N 1 ATOM 1647 C CA . MET A 1 117 ? 22.404 27.983 32.051 1.00 21.26 ? 129 MET A CA 1 ATOM 1648 C C . MET A 1 117 ? 23.113 28.330 33.360 1.00 19.31 ? 129 MET A C 1 ATOM 1649 O O . MET A 1 117 ? 24.234 28.842 33.346 1.00 25.38 ? 129 MET A O 1 ATOM 1650 C CB . MET A 1 117 ? 21.362 29.060 31.700 1.00 20.25 ? 129 MET A CB 1 ATOM 1651 C CG . MET A 1 117 ? 20.753 28.889 30.320 1.00 24.11 ? 129 MET A CG 1 ATOM 1652 S SD . MET A 1 117 ? 21.856 29.199 28.972 1.00 26.75 ? 129 MET A SD 1 ATOM 1653 C CE . MET A 1 117 ? 22.683 27.588 28.626 1.00 26.67 ? 129 MET A CE 1 ATOM 1654 H H . MET A 1 117 ? 20.904 26.685 32.053 1.00 29.11 ? 129 MET A H 1 ATOM 1655 H HA . MET A 1 117 ? 23.061 27.967 31.338 1.00 25.51 ? 129 MET A HA 1 ATOM 1656 H HB2 . MET A 1 117 ? 20.643 29.024 32.350 1.00 24.30 ? 129 MET A HB2 1 ATOM 1657 H HB3 . MET A 1 117 ? 21.790 29.931 31.730 1.00 24.30 ? 129 MET A HB3 1 ATOM 1658 H HG2 . MET A 1 117 ? 20.435 27.977 30.234 1.00 28.94 ? 129 MET A HG2 1 ATOM 1659 H HG3 . MET A 1 117 ? 20.006 29.503 30.234 1.00 28.94 ? 129 MET A HG3 1 ATOM 1660 H HE1 . MET A 1 117 ? 23.303 27.704 27.890 1.00 32.01 ? 129 MET A HE1 1 ATOM 1661 H HE2 . MET A 1 117 ? 23.161 27.302 29.420 1.00 32.01 ? 129 MET A HE2 1 ATOM 1662 H HE3 . MET A 1 117 ? 22.008 26.931 28.391 1.00 32.01 ? 129 MET A HE3 1 ATOM 1663 N N . THR A 1 118 ? 22.471 28.066 34.489 1.00 20.42 ? 130 THR A N 1 ATOM 1664 C CA . THR A 1 118 ? 23.082 28.374 35.775 1.00 25.43 ? 130 THR A CA 1 ATOM 1665 C C . THR A 1 118 ? 24.380 27.597 35.952 1.00 26.06 ? 130 THR A C 1 ATOM 1666 O O . THR A 1 118 ? 25.405 28.160 36.350 1.00 22.81 ? 130 THR A O 1 ATOM 1667 C CB . THR A 1 118 ? 22.115 28.051 36.902 1.00 26.74 ? 130 THR A CB 1 ATOM 1668 O OG1 . THR A 1 118 ? 20.935 28.866 36.789 1.00 25.60 ? 130 THR A OG1 1 ATOM 1669 C CG2 . THR A 1 118 ? 22.755 28.302 38.256 1.00 25.20 ? 130 THR A CG2 1 ATOM 1670 H H . THR A 1 118 ? 21.689 27.713 34.539 1.00 24.51 ? 130 THR A H 1 ATOM 1671 H HA . THR A 1 118 ? 23.287 29.321 35.813 1.00 30.51 ? 130 THR A HA 1 ATOM 1672 H HB . THR A 1 118 ? 21.864 27.115 36.852 1.00 32.09 ? 130 THR A HB 1 ATOM 1673 H HG1 . THR A 1 118 ? 20.555 28.720 36.054 1.00 30.71 ? 130 THR A HG1 1 ATOM 1674 H HG21 . THR A 1 118 ? 22.127 28.092 38.964 1.00 30.24 ? 130 THR A HG21 1 ATOM 1675 H HG22 . THR A 1 118 ? 23.543 27.745 38.358 1.00 30.24 ? 130 THR A HG22 1 ATOM 1676 H HG23 . THR A 1 118 ? 23.016 29.233 38.332 1.00 30.24 ? 130 THR A HG23 1 ATOM 1677 N N . MET A 1 119 ? 24.353 26.298 35.627 1.00 25.33 ? 131 MET A N 1 ATOM 1678 C CA . MET A 1 119 ? 25.528 25.451 35.829 1.00 26.61 ? 131 MET A CA 1 ATOM 1679 C C . MET A 1 119 ? 26.621 25.795 34.839 1.00 24.78 ? 131 MET A C 1 ATOM 1680 O O . MET A 1 119 ? 27.811 25.680 35.166 1.00 29.87 ? 131 MET A O 1 ATOM 1681 C CB . MET A 1 119 ? 25.134 23.981 35.701 1.00 28.73 ? 131 MET A CB 1 ATOM 1682 C CG . MET A 1 119 ? 24.231 23.470 36.809 1.00 33.94 ? 131 MET A CG 1 ATOM 1683 S SD . MET A 1 119 ? 24.933 23.761 38.460 1.00 45.50 ? 131 MET A SD 1 ATOM 1684 C CE . MET A 1 119 ? 26.517 22.921 38.283 1.00 43.30 ? 131 MET A CE 1 ATOM 1685 H H . MET A 1 119 ? 23.674 25.891 35.291 1.00 30.39 ? 131 MET A H 1 ATOM 1686 H HA . MET A 1 119 ? 25.864 25.592 36.728 1.00 31.93 ? 131 MET A HA 1 ATOM 1687 H HB2 . MET A 1 119 ? 24.666 23.857 34.860 1.00 34.47 ? 131 MET A HB2 1 ATOM 1688 H HB3 . MET A 1 119 ? 25.941 23.442 35.708 1.00 34.47 ? 131 MET A HB3 1 ATOM 1689 H HG2 . MET A 1 119 ? 23.377 23.928 36.759 1.00 40.73 ? 131 MET A HG2 1 ATOM 1690 H HG3 . MET A 1 119 ? 24.104 22.515 36.700 1.00 40.73 ? 131 MET A HG3 1 ATOM 1691 H HE1 . MET A 1 119 ? 27.010 23.000 39.114 1.00 51.96 ? 131 MET A HE1 1 ATOM 1692 H HE2 . MET A 1 119 ? 26.357 21.987 38.079 1.00 51.96 ? 131 MET A HE2 1 ATOM 1693 H HE3 . MET A 1 119 ? 27.015 23.337 37.561 1.00 51.96 ? 131 MET A HE3 1 ATOM 1694 N N . THR A 1 120 ? 26.249 26.202 33.615 1.00 23.11 ? 132 THR A N 1 ATOM 1695 C CA . THR A 1 120 ? 27.241 26.714 32.679 1.00 27.87 ? 132 THR A CA 1 ATOM 1696 C C . THR A 1 120 ? 28.001 27.869 33.307 1.00 29.53 ? 132 THR A C 1 ATOM 1697 O O . THR A 1 120 ? 29.237 27.954 33.219 1.00 26.78 ? 132 THR A O 1 ATOM 1698 C CB . THR A 1 120 ? 26.555 27.159 31.381 1.00 23.74 ? 132 THR A CB 1 ATOM 1699 O OG1 . THR A 1 120 ? 25.899 26.045 30.765 1.00 28.88 ? 132 THR A OG1 1 ATOM 1700 C CG2 . THR A 1 120 ? 27.559 27.744 30.391 1.00 28.13 ? 132 THR A CG2 1 ATOM 1701 H H . THR A 1 120 ? 25.443 26.189 33.314 1.00 27.73 ? 132 THR A H 1 ATOM 1702 H HA . THR A 1 120 ? 27.874 26.012 32.465 1.00 33.44 ? 132 THR A HA 1 ATOM 1703 H HB . THR A 1 120 ? 25.898 27.842 31.585 1.00 28.49 ? 132 THR A HB 1 ATOM 1704 H HG1 . THR A 1 120 ? 25.320 25.730 31.285 1.00 34.65 ? 132 THR A HG1 1 ATOM 1705 H HG21 . THR A 1 120 ? 27.103 28.017 29.579 1.00 33.76 ? 132 THR A HG21 1 ATOM 1706 H HG22 . THR A 1 120 ? 27.998 28.515 30.781 1.00 33.76 ? 132 THR A HG22 1 ATOM 1707 H HG23 . THR A 1 120 ? 28.229 27.079 30.167 1.00 33.76 ? 132 THR A HG23 1 ATOM 1708 N N . VAL A 1 121 ? 27.269 28.799 33.915 1.00 25.72 ? 133 VAL A N 1 ATOM 1709 C CA . VAL A 1 121 ? 27.904 29.963 34.508 1.00 22.65 ? 133 VAL A CA 1 ATOM 1710 C C . VAL A 1 121 ? 28.747 29.554 35.711 1.00 22.06 ? 133 VAL A C 1 ATOM 1711 O O . VAL A 1 121 ? 29.882 30.014 35.866 1.00 24.85 ? 133 VAL A O 1 ATOM 1712 C CB . VAL A 1 121 ? 26.848 31.017 34.900 1.00 29.15 ? 133 VAL A CB 1 ATOM 1713 C CG1 . VAL A 1 121 ? 27.506 32.167 35.667 1.00 26.55 ? 133 VAL A CG1 1 ATOM 1714 C CG2 . VAL A 1 121 ? 26.158 31.546 33.663 1.00 27.86 ? 133 VAL A CG2 1 ATOM 1715 H H . VAL A 1 121 ? 26.413 28.777 33.996 1.00 30.87 ? 133 VAL A H 1 ATOM 1716 H HA . VAL A 1 121 ? 28.496 30.364 33.853 1.00 27.18 ? 133 VAL A HA 1 ATOM 1717 H HB . VAL A 1 121 ? 26.181 30.609 35.473 1.00 34.98 ? 133 VAL A HB 1 ATOM 1718 H HG11 . VAL A 1 121 ? 26.827 32.818 35.903 1.00 31.86 ? 133 VAL A HG11 1 ATOM 1719 H HG12 . VAL A 1 121 ? 27.921 31.815 36.469 1.00 31.86 ? 133 VAL A HG12 1 ATOM 1720 H HG13 . VAL A 1 121 ? 28.177 32.580 35.101 1.00 31.86 ? 133 VAL A HG13 1 ATOM 1721 H HG21 . VAL A 1 121 ? 25.499 32.206 33.928 1.00 33.43 ? 133 VAL A HG21 1 ATOM 1722 H HG22 . VAL A 1 121 ? 26.820 31.953 33.083 1.00 33.43 ? 133 VAL A HG22 1 ATOM 1723 H HG23 . VAL A 1 121 ? 25.723 30.810 33.206 1.00 33.43 ? 133 VAL A HG23 1 ATOM 1724 N N . GLN A 1 122 ? 28.191 28.715 36.590 1.00 26.49 ? 134 GLN A N 1 ATOM 1725 C CA . GLN A 1 122 ? 28.909 28.343 37.806 1.00 23.01 ? 134 GLN A CA 1 ATOM 1726 C C . GLN A 1 122 ? 30.166 27.538 37.465 1.00 29.92 ? 134 GLN A C 1 ATOM 1727 O O . GLN A 1 122 ? 31.225 27.749 38.070 1.00 30.53 ? 134 GLN A O 1 ATOM 1728 C CB . GLN A 1 122 ? 27.974 27.589 38.754 1.00 30.60 ? 134 GLN A CB 1 ATOM 1729 C CG . GLN A 1 122 ? 27.006 28.536 39.503 1.00 30.88 ? 134 GLN A CG 1 ATOM 1730 C CD . GLN A 1 122 ? 25.929 27.832 40.311 1.00 35.34 ? 134 GLN A CD 1 ATOM 1731 O OE1 . GLN A 1 122 ? 25.919 26.613 40.430 1.00 39.60 ? 134 GLN A OE1 1 ATOM 1732 N NE2 . GLN A 1 122 ? 24.991 28.612 40.858 1.00 32.71 ? 134 GLN A NE2 1 ATOM 1733 H H . GLN A 1 122 ? 27.414 28.355 36.506 1.00 31.79 ? 134 GLN A H 1 ATOM 1734 H HA . GLN A 1 122 ? 29.194 29.153 38.257 1.00 27.61 ? 134 GLN A HA 1 ATOM 1735 H HB2 . GLN A 1 122 ? 27.443 26.959 38.242 1.00 36.72 ? 134 GLN A HB2 1 ATOM 1736 H HB3 . GLN A 1 122 ? 28.504 27.117 39.415 1.00 36.72 ? 134 GLN A HB3 1 ATOM 1737 H HG2 . GLN A 1 122 ? 27.521 29.085 40.115 1.00 37.05 ? 134 GLN A HG2 1 ATOM 1738 H HG3 . GLN A 1 122 ? 26.562 29.102 38.852 1.00 37.05 ? 134 GLN A HG3 1 ATOM 1739 H HE21 . GLN A 1 122 ? 25.020 29.464 40.742 1.00 39.25 ? 134 GLN A HE21 1 ATOM 1740 H HE22 . GLN A 1 122 ? 24.360 28.262 41.325 1.00 39.25 ? 134 GLN A HE22 1 ATOM 1741 N N . ASN A 1 123 ? 30.100 26.694 36.432 1.00 29.57 ? 135 ASN A N 1 ATOM 1742 C CA . ASN A 1 123 ? 31.278 25.921 36.020 1.00 30.01 ? 135 ASN A CA 1 ATOM 1743 C C . ASN A 1 123 ? 32.363 26.813 35.424 1.00 36.13 ? 135 ASN A C 1 ATOM 1744 O O . ASN A 1 123 ? 33.553 26.626 35.701 1.00 30.76 ? 135 ASN A O 1 ATOM 1745 C CB . ASN A 1 123 ? 30.876 24.838 35.024 1.00 29.65 ? 135 ASN A CB 1 ATOM 1746 C CG . ASN A 1 123 ? 30.012 23.743 35.650 1.00 33.80 ? 135 ASN A CG 1 ATOM 1747 O OD1 . ASN A 1 123 ? 30.020 23.534 36.865 1.00 40.07 ? 135 ASN A OD1 1 ATOM 1748 N ND2 . ASN A 1 123 ? 29.261 23.036 34.810 1.00 37.92 ? 135 ASN A ND2 1 ATOM 1749 H H . ASN A 1 123 ? 29.396 26.552 35.959 1.00 35.48 ? 135 ASN A H 1 ATOM 1750 H HA . ASN A 1 123 ? 31.652 25.482 36.800 1.00 36.01 ? 135 ASN A HA 1 ATOM 1751 H HB2 . ASN A 1 123 ? 30.369 25.245 34.304 1.00 35.58 ? 135 ASN A HB2 1 ATOM 1752 H HB3 . ASN A 1 123 ? 31.678 24.422 34.671 1.00 35.58 ? 135 ASN A HB3 1 ATOM 1753 H HD21 . ASN A 1 123 ? 28.756 22.407 35.109 1.00 45.50 ? 135 ASN A HD21 1 ATOM 1754 H HD22 . ASN A 1 123 ? 29.280 23.207 33.967 1.00 45.50 ? 135 ASN A HD22 1 ATOM 1755 N N . LEU A 1 124 ? 31.990 27.785 34.597 1.00 28.28 ? 136 LEU A N 1 ATOM 1756 C CA . LEU A 1 124 ? 32.998 28.633 33.992 1.00 26.76 ? 136 LEU A CA 1 ATOM 1757 C C . LEU A 1 124 ? 33.517 29.713 34.938 1.00 30.93 ? 136 LEU A C 1 ATOM 1758 O O . LEU A 1 124 ? 34.653 30.173 34.765 1.00 28.90 ? 136 LEU A O 1 ATOM 1759 C CB . LEU A 1 124 ? 32.442 29.280 32.722 1.00 25.54 ? 136 LEU A CB 1 ATOM 1760 C CG . LEU A 1 124 ? 32.334 28.385 31.503 1.00 39.15 ? 136 LEU A CG 1 ATOM 1761 C CD1 . LEU A 1 124 ? 31.567 29.087 30.405 1.00 42.91 ? 136 LEU A CD1 1 ATOM 1762 C CD2 . LEU A 1 124 ? 33.735 28.024 31.024 1.00 48.39 ? 136 LEU A CD2 1 ATOM 1763 H H . LEU A 1 124 ? 31.179 27.968 34.377 1.00 33.94 ? 136 LEU A H 1 ATOM 1764 H HA . LEU A 1 124 ? 33.753 28.081 33.734 1.00 32.12 ? 136 LEU A HA 1 ATOM 1765 H HB2 . LEU A 1 124 ? 31.551 29.612 32.916 1.00 30.65 ? 136 LEU A HB2 1 ATOM 1766 H HB3 . LEU A 1 124 ? 33.016 30.024 32.483 1.00 30.65 ? 136 LEU A HB3 1 ATOM 1767 H HG . LEU A 1 124 ? 31.865 27.568 31.737 1.00 46.98 ? 136 LEU A HG 1 ATOM 1768 H HD11 . LEU A 1 124 ? 31.509 28.499 29.635 1.00 51.49 ? 136 LEU A HD11 1 ATOM 1769 H HD12 . LEU A 1 124 ? 30.677 29.299 30.727 1.00 51.49 ? 136 LEU A HD12 1 ATOM 1770 H HD13 . LEU A 1 124 ? 32.036 29.902 30.165 1.00 51.49 ? 136 LEU A HD13 1 ATOM 1771 H HD21 . LEU A 1 124 ? 33.664 27.451 30.245 1.00 58.06 ? 136 LEU A HD21 1 ATOM 1772 H HD22 . LEU A 1 124 ? 34.209 28.838 30.795 1.00 58.06 ? 136 LEU A HD22 1 ATOM 1773 H HD23 . LEU A 1 124 ? 34.201 27.558 31.736 1.00 58.06 ? 136 LEU A HD23 1 ATOM 1774 N N . PHE A 1 125 ? 32.718 30.145 35.920 1.00 23.25 ? 137 PHE A N 1 ATOM 1775 C CA . PHE A 1 125 ? 33.031 31.322 36.742 1.00 24.14 ? 137 PHE A CA 1 ATOM 1776 C C . PHE A 1 125 ? 32.891 30.960 38.215 1.00 29.44 ? 137 PHE A C 1 ATOM 1777 O O . PHE A 1 125 ? 32.049 31.506 38.937 1.00 24.02 ? 137 PHE A O 1 ATOM 1778 C CB . PHE A 1 125 ? 32.124 32.510 36.398 1.00 23.31 ? 137 PHE A CB 1 ATOM 1779 C CG . PHE A 1 125 ? 32.215 32.949 34.974 1.00 23.14 ? 137 PHE A CG 1 ATOM 1780 C CD1 . PHE A 1 125 ? 33.254 33.754 34.549 1.00 27.97 ? 137 PHE A CD1 1 ATOM 1781 C CD2 . PHE A 1 125 ? 31.259 32.563 34.069 1.00 31.63 ? 137 PHE A CD2 1 ATOM 1782 C CE1 . PHE A 1 125 ? 33.341 34.157 33.226 1.00 27.64 ? 137 PHE A CE1 1 ATOM 1783 C CE2 . PHE A 1 125 ? 31.340 32.968 32.746 1.00 28.20 ? 137 PHE A CE2 1 ATOM 1784 C CZ . PHE A 1 125 ? 32.374 33.753 32.333 1.00 24.94 ? 137 PHE A CZ 1 ATOM 1785 H H . PHE A 1 125 ? 31.976 29.767 36.132 1.00 27.90 ? 137 PHE A H 1 ATOM 1786 H HA . PHE A 1 125 ? 33.951 31.587 36.582 1.00 28.97 ? 137 PHE A HA 1 ATOM 1787 H HB2 . PHE A 1 125 ? 31.203 32.260 36.573 1.00 27.97 ? 137 PHE A HB2 1 ATOM 1788 H HB3 . PHE A 1 125 ? 32.371 33.263 36.957 1.00 27.97 ? 137 PHE A HB3 1 ATOM 1789 H HD1 . PHE A 1 125 ? 33.908 34.019 35.155 1.00 33.57 ? 137 PHE A HD1 1 ATOM 1790 H HD2 . PHE A 1 125 ? 30.554 32.023 34.344 1.00 37.96 ? 137 PHE A HD2 1 ATOM 1791 H HE1 . PHE A 1 125 ? 34.044 34.696 32.945 1.00 33.17 ? 137 PHE A HE1 1 ATOM 1792 H HE2 . PHE A 1 125 ? 30.691 32.699 32.138 1.00 33.84 ? 137 PHE A HE2 1 ATOM 1793 H HZ . PHE A 1 125 ? 32.423 34.024 31.445 1.00 29.92 ? 137 PHE A HZ 1 ATOM 1794 N N . PRO A 1 126 ? 33.713 30.033 38.708 1.00 28.82 ? 138 PRO A N 1 ATOM 1795 C CA . PRO A 1 126 ? 33.459 29.490 40.051 1.00 26.13 ? 138 PRO A CA 1 ATOM 1796 C C . PRO A 1 126 ? 33.646 30.501 41.169 1.00 21.50 ? 138 PRO A C 1 ATOM 1797 O O . PRO A 1 126 ? 33.164 30.263 42.283 1.00 29.41 ? 138 PRO A O 1 ATOM 1798 C CB . PRO A 1 126 ? 34.466 28.327 40.162 1.00 34.02 ? 138 PRO A CB 1 ATOM 1799 C CG . PRO A 1 126 ? 35.518 28.633 39.135 1.00 32.61 ? 138 PRO A CG 1 ATOM 1800 C CD . PRO A 1 126 ? 34.792 29.320 38.006 1.00 29.27 ? 138 PRO A CD 1 ATOM 1801 H HA . PRO A 1 126 ? 32.559 29.132 40.098 1.00 31.36 ? 138 PRO A HA 1 ATOM 1802 H HB2 . PRO A 1 126 ? 34.849 28.308 41.053 1.00 40.83 ? 138 PRO A HB2 1 ATOM 1803 H HB3 . PRO A 1 126 ? 34.022 27.488 39.960 1.00 40.83 ? 138 PRO A HB3 1 ATOM 1804 H HG2 . PRO A 1 126 ? 36.187 29.221 39.519 1.00 39.13 ? 138 PRO A HG2 1 ATOM 1805 H HG3 . PRO A 1 126 ? 35.924 27.807 38.828 1.00 39.13 ? 138 PRO A HG3 1 ATOM 1806 H HD2 . PRO A 1 126 ? 35.379 29.947 37.555 1.00 35.12 ? 138 PRO A HD2 1 ATOM 1807 H HD3 . PRO A 1 126 ? 34.424 28.666 37.390 1.00 35.12 ? 138 PRO A HD3 1 ATOM 1808 N N . ASN A 1 127 ? 34.350 31.599 40.930 1.00 22.90 ? 139 ASN A N 1 ATOM 1809 C CA . ASN A 1 127 ? 34.616 32.583 41.968 1.00 32.83 ? 139 ASN A CA 1 ATOM 1810 C C . ASN A 1 127 ? 33.869 33.893 41.738 1.00 30.95 ? 139 ASN A C 1 ATOM 1811 O O . ASN A 1 127 ? 34.226 34.906 42.338 1.00 30.64 ? 139 ASN A O 1 ATOM 1812 C CB . ASN A 1 127 ? 36.122 32.849 42.062 1.00 37.61 ? 139 ASN A CB 1 ATOM 1813 C CG . ASN A 1 127 ? 36.889 31.634 42.552 1.00 44.05 ? 139 ASN A CG 1 ATOM 1814 O OD1 . ASN A 1 127 ? 36.586 31.084 43.609 1.00 43.07 ? 139 ASN A OD1 1 ATOM 1815 N ND2 . ASN A 1 127 ? 37.860 31.192 41.769 1.00 53.56 ? 139 ASN A ND2 1 ATOM 1816 H H . ASN A 1 127 ? 34.688 31.800 40.165 1.00 27.48 ? 139 ASN A H 1 ATOM 1817 H HA . ASN A 1 127 ? 34.325 32.222 42.821 1.00 39.40 ? 139 ASN A HA 1 ATOM 1818 H HB2 . ASN A 1 127 ? 36.459 33.084 41.183 1.00 45.13 ? 139 ASN A HB2 1 ATOM 1819 H HB3 . ASN A 1 127 ? 36.279 33.576 42.685 1.00 45.13 ? 139 ASN A HB3 1 ATOM 1820 H HD21 . ASN A 1 127 ? 38.323 30.507 42.004 1.00 64.27 ? 139 ASN A HD21 1 ATOM 1821 H HD22 . ASN A 1 127 ? 38.028 31.591 41.026 1.00 64.27 ? 139 ASN A HD22 1 ATOM 1822 N N . LEU A 1 128 ? 32.851 33.896 40.869 1.00 26.75 ? 140 LEU A N 1 ATOM 1823 C CA . LEU A 1 128 ? 32.124 35.113 40.496 1.00 24.18 ? 140 LEU A CA 1 ATOM 1824 C C . LEU A 1 128 ? 30.738 35.098 41.133 1.00 20.17 ? 140 LEU A C 1 ATOM 1825 O O . LEU A 1 128 ? 29.981 34.153 40.922 1.00 23.93 ? 140 LEU A O 1 ATOM 1826 C CB . LEU A 1 128 ? 31.999 35.212 38.977 1.00 30.43 ? 140 LEU A CB 1 ATOM 1827 C CG . LEU A 1 128 ? 31.421 36.529 38.444 1.00 23.00 ? 140 LEU A CG 1 ATOM 1828 C CD1 . LEU A 1 128 ? 32.304 37.645 38.795 1.00 22.66 ? 140 LEU A CD1 1 ATOM 1829 C CD2 . LEU A 1 128 ? 31.249 36.440 36.938 1.00 24.40 ? 140 LEU A CD2 1 ATOM 1830 H H . LEU A 1 128 ? 32.558 33.190 40.475 1.00 32.10 ? 140 LEU A H 1 ATOM 1831 H HA . LEU A 1 128 ? 32.605 35.891 40.819 1.00 29.01 ? 140 LEU A HA 1 ATOM 1832 H HB2 . LEU A 1 128 ? 32.881 35.105 38.589 1.00 36.52 ? 140 LEU A HB2 1 ATOM 1833 H HB3 . LEU A 1 128 ? 31.421 34.496 38.669 1.00 36.52 ? 140 LEU A HB3 1 ATOM 1834 H HG . LEU A 1 128 ? 30.551 36.686 38.845 1.00 27.60 ? 140 LEU A HG 1 ATOM 1835 H HD11 . LEU A 1 128 ? 31.923 38.468 38.451 1.00 27.19 ? 140 LEU A HD11 1 ATOM 1836 H HD12 . LEU A 1 128 ? 32.381 37.694 39.761 1.00 27.19 ? 140 LEU A HD12 1 ATOM 1837 H HD13 . LEU A 1 128 ? 33.176 37.493 38.400 1.00 27.19 ? 140 LEU A HD13 1 ATOM 1838 H HD21 . LEU A 1 128 ? 30.883 37.277 36.613 1.00 29.28 ? 140 LEU A HD21 1 ATOM 1839 H HD22 . LEU A 1 128 ? 32.114 36.276 36.532 1.00 29.28 ? 140 LEU A HD22 1 ATOM 1840 H HD23 . LEU A 1 128 ? 30.643 35.711 36.733 1.00 29.28 ? 140 LEU A HD23 1 ATOM 1841 N N . GLN A 1 129 ? 30.415 36.144 41.907 1.00 23.91 ? 141 GLN A N 1 ATOM 1842 C CA . GLN A 1 129 ? 29.059 36.318 42.422 1.00 21.68 ? 141 GLN A CA 1 ATOM 1843 C C . GLN A 1 129 ? 28.182 36.817 41.271 1.00 18.83 ? 141 GLN A C 1 ATOM 1844 O O . GLN A 1 129 ? 28.523 37.811 40.617 1.00 22.43 ? 141 GLN A O 1 ATOM 1845 C CB . GLN A 1 129 ? 29.006 37.318 43.584 1.00 20.67 ? 141 GLN A CB 1 ATOM 1846 C CG . GLN A 1 129 ? 27.673 37.347 44.319 1.00 17.35 ? 141 GLN A CG 1 ATOM 1847 C CD . GLN A 1 129 ? 27.659 38.184 45.593 1.00 17.59 ? 141 GLN A CD 1 ATOM 1848 O OE1 . GLN A 1 129 ? 28.405 39.153 45.735 1.00 23.17 ? 141 GLN A OE1 1 ATOM 1849 N NE2 . GLN A 1 129 ? 26.772 37.836 46.508 1.00 22.25 ? 141 GLN A NE2 1 ATOM 1850 H H . GLN A 1 129 ? 30.964 36.761 42.145 1.00 28.69 ? 141 GLN A H 1 ATOM 1851 H HA . GLN A 1 129 ? 28.713 35.465 42.730 1.00 26.02 ? 141 GLN A HA 1 ATOM 1852 H HB2 . GLN A 1 129 ? 29.693 37.084 44.227 1.00 24.80 ? 141 GLN A HB2 1 ATOM 1853 H HB3 . GLN A 1 129 ? 29.171 38.208 43.236 1.00 24.80 ? 141 GLN A HB3 1 ATOM 1854 H HG2 . GLN A 1 129 ? 26.999 37.710 43.723 1.00 20.82 ? 141 GLN A HG2 1 ATOM 1855 H HG3 . GLN A 1 129 ? 27.435 36.438 44.564 1.00 20.82 ? 141 GLN A HG3 1 ATOM 1856 H HE21 . GLN A 1 129 ? 26.246 37.171 46.366 1.00 26.70 ? 141 GLN A HE21 1 ATOM 1857 H HE22 . GLN A 1 129 ? 26.721 38.275 47.246 1.00 26.70 ? 141 GLN A HE22 1 ATOM 1858 N N . VAL A 1 130 ? 27.068 36.133 41.045 1.00 20.27 ? 142 VAL A N 1 ATOM 1859 C CA . VAL A 1 130 ? 26.124 36.443 39.974 1.00 19.00 ? 142 VAL A CA 1 ATOM 1860 C C . VAL A 1 130 ? 24.773 36.750 40.607 1.00 20.27 ? 142 VAL A C 1 ATOM 1861 O O . VAL A 1 130 ? 24.342 36.071 41.548 1.00 19.71 ? 142 VAL A O 1 ATOM 1862 C CB . VAL A 1 130 ? 26.029 35.277 38.971 1.00 19.75 ? 142 VAL A CB 1 ATOM 1863 C CG1 . VAL A 1 130 ? 25.054 35.566 37.816 1.00 19.10 ? 142 VAL A CG1 1 ATOM 1864 C CG2 . VAL A 1 130 ? 27.431 34.918 38.402 1.00 21.73 ? 142 VAL A CG2 1 ATOM 1865 H H . VAL A 1 130 ? 26.827 35.457 41.519 1.00 24.32 ? 142 VAL A H 1 ATOM 1866 H HA . VAL A 1 130 ? 26.425 37.232 39.497 1.00 22.80 ? 142 VAL A HA 1 ATOM 1867 H HB . VAL A 1 130 ? 25.698 34.496 39.442 1.00 23.70 ? 142 VAL A HB 1 ATOM 1868 H HG11 . VAL A 1 130 ? 25.035 34.801 37.220 1.00 22.92 ? 142 VAL A HG11 1 ATOM 1869 H HG12 . VAL A 1 130 ? 24.169 35.723 38.181 1.00 22.92 ? 142 VAL A HG12 1 ATOM 1870 H HG13 . VAL A 1 130 ? 25.358 36.352 37.336 1.00 22.92 ? 142 VAL A HG13 1 ATOM 1871 H HG21 . VAL A 1 130 ? 27.339 34.183 37.776 1.00 26.08 ? 142 VAL A HG21 1 ATOM 1872 H HG22 . VAL A 1 130 ? 27.796 35.695 37.949 1.00 26.08 ? 142 VAL A HG22 1 ATOM 1873 H HG23 . VAL A 1 130 ? 28.012 34.659 39.135 1.00 26.08 ? 142 VAL A HG23 1 ATOM 1874 N N . PHE A 1 131 ? 24.100 37.776 40.080 1.00 16.76 ? 143 PHE A N 1 ATOM 1875 C CA . PHE A 1 131 ? 22.802 38.217 40.578 1.00 16.84 ? 143 PHE A CA 1 ATOM 1876 C C . PHE A 1 131 ? 21.778 38.011 39.474 1.00 18.16 ? 143 PHE A C 1 ATOM 1877 O O . PHE A 1 131 ? 21.733 38.808 38.515 1.00 18.06 ? 143 PHE A O 1 ATOM 1878 C CB . PHE A 1 131 ? 22.861 39.677 40.988 1.00 17.38 ? 143 PHE A CB 1 ATOM 1879 C CG . PHE A 1 131 ? 23.851 39.943 42.091 1.00 15.84 ? 143 PHE A CG 1 ATOM 1880 C CD1 . PHE A 1 131 ? 23.456 39.804 43.396 1.00 20.85 ? 143 PHE A CD1 1 ATOM 1881 C CD2 . PHE A 1 131 ? 25.153 40.325 41.818 1.00 17.94 ? 143 PHE A CD2 1 ATOM 1882 C CE1 . PHE A 1 131 ? 24.374 40.025 44.446 1.00 22.13 ? 143 PHE A CE1 1 ATOM 1883 C CE2 . PHE A 1 131 ? 26.054 40.537 42.846 1.00 18.89 ? 143 PHE A CE2 1 ATOM 1884 C CZ . PHE A 1 131 ? 25.642 40.394 44.161 1.00 17.93 ? 143 PHE A CZ 1 ATOM 1885 H H . PHE A 1 131 ? 24.386 38.241 39.415 1.00 20.11 ? 143 PHE A H 1 ATOM 1886 H HA . PHE A 1 131 ? 22.546 37.686 41.348 1.00 20.21 ? 143 PHE A HA 1 ATOM 1887 H HB2 . PHE A 1 131 ? 23.121 40.209 40.219 1.00 20.86 ? 143 PHE A HB2 1 ATOM 1888 H HB3 . PHE A 1 131 ? 21.985 39.952 41.299 1.00 20.86 ? 143 PHE A HB3 1 ATOM 1889 H HD1 . PHE A 1 131 ? 22.584 39.545 43.590 1.00 25.02 ? 143 PHE A HD1 1 ATOM 1890 H HD2 . PHE A 1 131 ? 25.431 40.416 40.936 1.00 21.53 ? 143 PHE A HD2 1 ATOM 1891 H HE1 . PHE A 1 131 ? 24.103 39.931 45.330 1.00 26.55 ? 143 PHE A HE1 1 ATOM 1892 H HE2 . PHE A 1 131 ? 26.927 40.795 42.655 1.00 22.66 ? 143 PHE A HE2 1 ATOM 1893 H HZ . PHE A 1 131 ? 26.245 40.547 44.853 1.00 21.51 ? 143 PHE A HZ 1 ATOM 1894 N N . PRO A 1 132 ? 21.008 36.924 39.515 1.00 17.84 ? 144 PRO A N 1 ATOM 1895 C CA . PRO A 1 132 ? 20.020 36.667 38.472 1.00 17.02 ? 144 PRO A CA 1 ATOM 1896 C C . PRO A 1 132 ? 18.686 37.325 38.799 1.00 16.86 ? 144 PRO A C 1 ATOM 1897 O O . PRO A 1 132 ? 18.373 37.639 39.954 1.00 19.00 ? 144 PRO A O 1 ATOM 1898 C CB . PRO A 1 132 ? 19.870 35.140 38.494 1.00 21.50 ? 144 PRO A CB 1 ATOM 1899 C CG . PRO A 1 132 ? 21.022 34.639 39.369 1.00 20.99 ? 144 PRO A CG 1 ATOM 1900 C CD . PRO A 1 132 ? 21.186 35.726 40.358 1.00 19.02 ? 144 PRO A CD 1 ATOM 1901 H HA . PRO A 1 132 ? 20.339 36.961 37.604 1.00 20.43 ? 144 PRO A HA 1 ATOM 1902 H HB2 . PRO A 1 132 ? 19.015 34.901 38.884 1.00 25.80 ? 144 PRO A HB2 1 ATOM 1903 H HB3 . PRO A 1 132 ? 19.947 34.790 37.593 1.00 25.80 ? 144 PRO A HB3 1 ATOM 1904 H HG2 . PRO A 1 132 ? 20.774 33.807 39.802 1.00 25.18 ? 144 PRO A HG2 1 ATOM 1905 H HG3 . PRO A 1 132 ? 21.824 34.530 38.834 1.00 25.18 ? 144 PRO A HG3 1 ATOM 1906 H HD2 . PRO A 1 132 ? 20.495 35.678 41.037 1.00 22.83 ? 144 PRO A HD2 1 ATOM 1907 H HD3 . PRO A 1 132 ? 22.076 35.707 40.744 1.00 22.83 ? 144 PRO A HD3 1 ATOM 1908 N N . ALA A 1 133 ? 17.933 37.557 37.730 1.00 19.11 ? 145 ALA A N 1 ATOM 1909 C CA . ALA A 1 133 ? 16.522 37.854 37.807 1.00 18.07 ? 145 ALA A CA 1 ATOM 1910 C C . ALA A 1 133 ? 15.778 36.910 36.879 1.00 18.97 ? 145 ALA A C 1 ATOM 1911 O O . ALA A 1 133 ? 16.298 36.469 35.847 1.00 20.95 ? 145 ALA A O 1 ATOM 1912 C CB . ALA A 1 133 ? 16.243 39.304 37.422 1.00 16.24 ? 145 ALA A CB 1 ATOM 1913 H H . ALA A 1 133 ? 18.235 37.546 36.925 1.00 22.93 ? 145 ALA A H 1 ATOM 1914 H HA . ALA A 1 133 ? 16.208 37.709 38.713 1.00 21.68 ? 145 ALA A HA 1 ATOM 1915 H HB1 . ALA A 1 133 ? 15.289 39.469 37.484 1.00 19.48 ? 145 ALA A HB1 1 ATOM 1916 H HB2 . ALA A 1 133 ? 16.721 39.889 38.031 1.00 19.48 ? 145 ALA A HB2 1 ATOM 1917 H HB3 . ALA A 1 133 ? 16.547 39.453 36.513 1.00 19.48 ? 145 ALA A HB3 1 ATOM 1918 N N . LEU A 1 134 ? 14.542 36.634 37.243 1.00 18.44 ? 146 LEU A N 1 ATOM 1919 C CA . LEU A 1 134 ? 13.670 35.809 36.411 1.00 14.78 ? 146 LEU A CA 1 ATOM 1920 C C . LEU A 1 134 ? 13.092 36.598 35.251 1.00 18.62 ? 146 LEU A C 1 ATOM 1921 O O . LEU A 1 134 ? 12.713 37.761 35.400 1.00 20.04 ? 146 LEU A O 1 ATOM 1922 C CB . LEU A 1 134 ? 12.534 35.239 37.246 1.00 18.42 ? 146 LEU A CB 1 ATOM 1923 C CG . LEU A 1 134 ? 12.970 34.150 38.222 1.00 21.55 ? 146 LEU A CG 1 ATOM 1924 C CD1 . LEU A 1 134 ? 11.918 34.018 39.267 1.00 23.85 ? 146 LEU A CD1 1 ATOM 1925 C CD2 . LEU A 1 134 ? 13.190 32.849 37.445 1.00 22.64 ? 146 LEU A CD2 1 ATOM 1926 H H . LEU A 1 134 ? 14.176 36.912 37.970 1.00 22.12 ? 146 LEU A H 1 ATOM 1927 H HA . LEU A 1 134 ? 14.182 35.068 36.049 1.00 17.74 ? 146 LEU A HA 1 ATOM 1928 H HB2 . LEU A 1 134 ? 12.134 35.957 37.761 1.00 22.10 ? 146 LEU A HB2 1 ATOM 1929 H HB3 . LEU A 1 134 ? 11.871 34.854 36.650 1.00 22.10 ? 146 LEU A HB3 1 ATOM 1930 H HG . LEU A 1 134 ? 13.803 34.406 38.647 1.00 25.86 ? 146 LEU A HG 1 ATOM 1931 H HD11 . LEU A 1 134 ? 12.183 33.328 39.896 1.00 28.62 ? 146 LEU A HD11 1 ATOM 1932 H HD12 . LEU A 1 134 ? 11.823 34.867 39.728 1.00 28.62 ? 146 LEU A HD12 1 ATOM 1933 H HD13 . LEU A 1 134 ? 11.081 33.775 38.843 1.00 28.62 ? 146 LEU A HD13 1 ATOM 1934 H HD21 . LEU A 1 134 ? 13.468 32.156 38.063 1.00 27.17 ? 146 LEU A HD21 1 ATOM 1935 H HD22 . LEU A 1 134 ? 12.359 32.595 37.013 1.00 27.17 ? 146 LEU A HD22 1 ATOM 1936 H HD23 . LEU A 1 134 ? 13.879 32.993 36.778 1.00 27.17 ? 146 LEU A HD23 1 ATOM 1937 N N . GLY A 1 135 ? 13.006 35.944 34.108 1.00 18.44 ? 147 GLY A N 1 ATOM 1938 C CA . GLY A 1 135 ? 12.305 36.478 32.954 1.00 18.94 ? 147 GLY A CA 1 ATOM 1939 C C . GLY A 1 135 ? 10.928 35.833 32.788 1.00 18.93 ? 147 GLY A C 1 ATOM 1940 O O . GLY A 1 135 ? 10.567 34.858 33.451 1.00 17.53 ? 147 GLY A O 1 ATOM 1941 H H . GLY A 1 135 ? 13.354 35.170 33.972 1.00 22.13 ? 147 GLY A H 1 ATOM 1942 H HA2 . GLY A 1 135 ? 12.189 37.436 33.057 1.00 22.73 ? 147 GLY A HA2 1 ATOM 1943 H HA3 . GLY A 1 135 ? 12.825 36.313 32.152 1.00 22.73 ? 147 GLY A HA3 1 ATOM 1944 N N . ASN A 1 136 ? 10.155 36.381 31.851 1.00 17.93 ? 148 ASN A N 1 ATOM 1945 C CA . ASN A 1 136 ? 8.790 35.890 31.660 1.00 15.10 ? 148 ASN A CA 1 ATOM 1946 C C . ASN A 1 136 ? 8.763 34.501 31.031 1.00 19.13 ? 148 ASN A C 1 ATOM 1947 O O . ASN A 1 136 ? 7.773 33.782 31.203 1.00 19.82 ? 148 ASN A O 1 ATOM 1948 C CB . ASN A 1 136 ? 7.982 36.900 30.815 1.00 17.02 ? 148 ASN A CB 1 ATOM 1949 C CG . ASN A 1 136 ? 8.662 37.246 29.490 1.00 17.66 ? 148 ASN A CG 1 ATOM 1950 O OD1 . ASN A 1 136 ? 9.753 37.822 29.457 1.00 17.63 ? 148 ASN A OD1 1 ATOM 1951 N ND2 . ASN A 1 136 ? 8.049 36.834 28.394 1.00 16.85 ? 148 ASN A ND2 1 ATOM 1952 H H . ASN A 1 136 ? 10.389 37.021 31.326 1.00 21.52 ? 148 ASN A H 1 ATOM 1953 H HA . ASN A 1 136 ? 8.362 35.826 32.528 1.00 18.12 ? 148 ASN A HA 1 ATOM 1954 H HB2 . ASN A 1 136 ? 7.112 36.519 30.615 1.00 20.42 ? 148 ASN A HB2 1 ATOM 1955 H HB3 . ASN A 1 136 ? 7.875 37.721 31.321 1.00 20.42 ? 148 ASN A HB3 1 ATOM 1956 H HD21 . ASN A 1 136 ? 8.389 37.002 27.622 1.00 20.22 ? 148 ASN A HD21 1 ATOM 1957 H HD22 . ASN A 1 136 ? 7.310 36.398 28.453 1.00 20.22 ? 148 ASN A HD22 1 ATOM 1958 N N . HIS A 1 137 ? 9.813 34.102 30.321 1.00 16.39 ? 149 HIS A N 1 ATOM 1959 C CA . HIS A 1 137 ? 9.884 32.746 29.804 1.00 18.01 ? 149 HIS A CA 1 ATOM 1960 C C . HIS A 1 137 ? 10.432 31.776 30.832 1.00 21.88 ? 149 HIS A C 1 ATOM 1961 O O . HIS A 1 137 ? 10.457 30.571 30.558 1.00 21.95 ? 149 HIS A O 1 ATOM 1962 C CB . HIS A 1 137 ? 10.734 32.711 28.529 1.00 19.97 ? 149 HIS A CB 1 ATOM 1963 C CG . HIS A 1 137 ? 10.066 33.361 27.355 1.00 20.04 ? 149 HIS A CG 1 ATOM 1964 N ND1 . HIS A 1 137 ? 9.254 32.664 26.487 1.00 23.47 ? 149 HIS A ND1 1 ATOM 1965 C CD2 . HIS A 1 137 ? 10.064 34.649 26.926 1.00 19.87 ? 149 HIS A CD2 1 ATOM 1966 C CE1 . HIS A 1 137 ? 8.794 33.496 25.561 1.00 29.61 ? 149 HIS A CE1 1 ATOM 1967 N NE2 . HIS A 1 137 ? 9.277 34.704 25.805 1.00 22.96 ? 149 HIS A NE2 1 ATOM 1968 H H . HIS A 1 137 ? 10.491 34.594 30.127 1.00 19.67 ? 149 HIS A H 1 ATOM 1969 H HA . HIS A 1 137 ? 8.989 32.455 29.570 1.00 21.61 ? 149 HIS A HA 1 ATOM 1970 H HB2 . HIS A 1 137 ? 11.568 33.179 28.694 1.00 23.97 ? 149 HIS A HB2 1 ATOM 1971 H HB3 . HIS A 1 137 ? 10.914 31.787 28.296 1.00 23.97 ? 149 HIS A HB3 1 ATOM 1972 H HD2 . HIS A 1 137 ? 10.524 35.360 27.312 1.00 23.84 ? 149 HIS A HD2 1 ATOM 1973 H HE1 . HIS A 1 137 ? 8.230 33.268 24.857 1.00 35.54 ? 149 HIS A HE1 1 ATOM 1974 H HE2 . HIS A 1 137 ? 9.116 35.411 25.342 1.00 27.55 ? 149 HIS A HE2 1 ATOM 1975 N N . ASP A 1 138 ? 10.864 32.269 31.989 1.00 19.30 ? 150 ASP A N 1 ATOM 1976 C CA . ASP A 1 138 ? 11.404 31.430 33.057 1.00 23.62 ? 150 ASP A CA 1 ATOM 1977 C C . ASP A 1 138 ? 10.321 30.836 33.940 1.00 21.98 ? 150 ASP A C 1 ATOM 1978 O O . ASP A 1 138 ? 10.463 30.788 35.166 1.00 21.80 ? 150 ASP A O 1 ATOM 1979 C CB . ASP A 1 138 ? 12.393 32.239 33.896 1.00 19.50 ? 150 ASP A CB 1 ATOM 1980 C CG . ASP A 1 138 ? 13.679 32.550 33.152 1.00 23.37 ? 150 ASP A CG 1 ATOM 1981 O OD1 . ASP A 1 138 ? 14.047 31.782 32.228 1.00 23.45 ? 150 ASP A OD1 1 ATOM 1982 O OD2 . ASP A 1 138 ? 14.354 33.554 33.518 1.00 22.42 ? 150 ASP A OD2 1 ATOM 1983 H H . ASP A 1 138 ? 10.853 33.106 32.185 1.00 23.15 ? 150 ASP A H 1 ATOM 1984 H HA . ASP A 1 138 ? 11.892 30.694 32.656 1.00 28.34 ? 150 ASP A HA 1 ATOM 1985 H HB2 . ASP A 1 138 ? 11.980 33.080 34.147 1.00 23.40 ? 150 ASP A HB2 1 ATOM 1986 H HB3 . ASP A 1 138 ? 12.622 31.732 34.691 1.00 23.40 ? 150 ASP A HB3 1 ATOM 1987 N N . TYR A 1 139 ? 9.231 30.387 33.327 1.00 21.68 ? 151 TYR A N 1 ATOM 1988 C CA . TYR A 1 139 ? 8.103 29.818 34.029 1.00 23.64 ? 151 TYR A CA 1 ATOM 1989 C C . TYR A 1 139 ? 7.278 29.048 33.012 1.00 24.98 ? 151 TYR A C 1 ATOM 1990 O O . TYR A 1 139 ? 7.294 29.359 31.822 1.00 24.71 ? 151 TYR A O 1 ATOM 1991 C CB . TYR A 1 139 ? 7.246 30.893 34.716 1.00 21.31 ? 151 TYR A CB 1 ATOM 1992 C CG . TYR A 1 139 ? 6.403 30.318 35.843 1.00 20.64 ? 151 TYR A CG 1 ATOM 1993 C CD1 . TYR A 1 139 ? 6.954 30.091 37.069 1.00 25.67 ? 151 TYR A CD1 1 ATOM 1994 C CD2 . TYR A 1 139 ? 5.086 29.949 35.640 1.00 26.09 ? 151 TYR A CD2 1 ATOM 1995 C CE1 . TYR A 1 139 ? 6.243 29.544 38.075 1.00 26.72 ? 151 TYR A CE1 1 ATOM 1996 C CE2 . TYR A 1 139 ? 4.343 29.381 36.670 1.00 25.77 ? 151 TYR A CE2 1 ATOM 1997 C CZ . TYR A 1 139 ? 4.947 29.177 37.877 1.00 27.22 ? 151 TYR A CZ 1 ATOM 1998 O OH . TYR A 1 139 ? 4.263 28.626 38.934 1.00 31.10 ? 151 TYR A OH 1 ATOM 1999 H H . TYR A 1 139 ? 9.125 30.404 32.473 1.00 26.01 ? 151 TYR A H 1 ATOM 2000 H HA . TYR A 1 139 ? 8.420 29.198 34.704 1.00 28.37 ? 151 TYR A HA 1 ATOM 2001 H HB2 . TYR A 1 139 ? 7.828 31.573 35.091 1.00 25.57 ? 151 TYR A HB2 1 ATOM 2002 H HB3 . TYR A 1 139 ? 6.648 31.289 34.063 1.00 25.57 ? 151 TYR A HB3 1 ATOM 2003 H HD1 . TYR A 1 139 ? 7.843 30.322 37.215 1.00 30.80 ? 151 TYR A HD1 1 ATOM 2004 H HD2 . TYR A 1 139 ? 4.694 30.081 34.807 1.00 31.30 ? 151 TYR A HD2 1 ATOM 2005 H HE1 . TYR A 1 139 ? 6.644 29.404 38.903 1.00 32.06 ? 151 TYR A HE1 1 ATOM 2006 H HE2 . TYR A 1 139 ? 3.455 29.137 36.536 1.00 30.92 ? 151 TYR A HE2 1 ATOM 2007 H HH . TYR A 1 139 ? 3.478 28.438 38.702 1.00 37.32 ? 151 TYR A HH 1 ATOM 2008 N N . TRP A 1 140 ? 6.521 28.062 33.497 1.00 24.01 ? 152 TRP A N 1 ATOM 2009 C CA . TRP A 1 140 ? 5.598 27.333 32.638 1.00 20.30 ? 152 TRP A CA 1 ATOM 2010 C C . TRP A 1 140 ? 4.169 27.369 33.202 1.00 21.39 ? 152 TRP A C 1 ATOM 2011 O O . TRP A 1 140 ? 3.942 27.060 34.378 1.00 25.36 ? 152 TRP A O 1 ATOM 2012 C CB . TRP A 1 140 ? 6.018 25.865 32.450 1.00 27.62 ? 152 TRP A CB 1 ATOM 2013 C CG . TRP A 1 140 ? 5.171 25.217 31.395 1.00 26.24 ? 152 TRP A CG 1 ATOM 2014 C CD1 . TRP A 1 140 ? 5.407 25.217 30.081 1.00 24.43 ? 152 TRP A CD1 1 ATOM 2015 C CD2 . TRP A 1 140 ? 3.938 24.501 31.589 1.00 26.24 ? 152 TRP A CD2 1 ATOM 2016 N NE1 . TRP A 1 140 ? 4.394 24.559 29.403 1.00 28.35 ? 152 TRP A NE1 1 ATOM 2017 C CE2 . TRP A 1 140 ? 3.484 24.104 30.316 1.00 30.39 ? 152 TRP A CE2 1 ATOM 2018 C CE3 . TRP A 1 140 ? 3.174 24.171 32.715 1.00 32.69 ? 152 TRP A CE3 1 ATOM 2019 C CZ2 . TRP A 1 140 ? 2.303 23.366 30.134 1.00 33.86 ? 152 TRP A CZ2 1 ATOM 2020 C CZ3 . TRP A 1 140 ? 1.998 23.448 32.534 1.00 38.33 ? 152 TRP A CZ3 1 ATOM 2021 C CH2 . TRP A 1 140 ? 1.579 23.055 31.253 1.00 29.62 ? 152 TRP A CH2 1 ATOM 2022 H H . TRP A 1 140 ? 6.526 27.799 34.316 1.00 28.81 ? 152 TRP A H 1 ATOM 2023 H HA . TRP A 1 140 ? 5.584 27.753 31.764 1.00 24.36 ? 152 TRP A HA 1 ATOM 2024 H HB2 . TRP A 1 140 ? 6.945 25.827 32.169 1.00 33.15 ? 152 TRP A HB2 1 ATOM 2025 H HB3 . TRP A 1 140 ? 5.895 25.383 33.283 1.00 33.15 ? 152 TRP A HB3 1 ATOM 2026 H HD1 . TRP A 1 140 ? 6.137 25.625 29.674 1.00 29.32 ? 152 TRP A HD1 1 ATOM 2027 H HE1 . TRP A 1 140 ? 4.357 24.435 28.553 1.00 34.02 ? 152 TRP A HE1 1 ATOM 2028 H HE3 . TRP A 1 140 ? 3.447 24.428 33.566 1.00 39.23 ? 152 TRP A HE3 1 ATOM 2029 H HZ2 . TRP A 1 140 ? 2.019 23.108 29.286 1.00 40.64 ? 152 TRP A HZ2 1 ATOM 2030 H HZ3 . TRP A 1 140 ? 1.485 23.217 33.274 1.00 46.00 ? 152 TRP A HZ3 1 ATOM 2031 H HH2 . TRP A 1 140 ? 0.790 22.571 31.162 1.00 35.54 ? 152 TRP A HH2 1 ATOM 2032 N N . PRO A 1 141 ? 3.186 27.774 32.378 1.00 24.19 ? 153 PRO A N 1 ATOM 2033 C CA . PRO A 1 141 ? 3.328 28.348 31.039 1.00 22.66 ? 153 PRO A CA 1 ATOM 2034 C C . PRO A 1 141 ? 3.998 29.723 31.088 1.00 20.74 ? 153 PRO A C 1 ATOM 2035 O O . PRO A 1 141 ? 3.951 30.398 32.121 1.00 19.67 ? 153 PRO A O 1 ATOM 2036 C CB . PRO A 1 141 ? 1.884 28.499 30.549 1.00 25.40 ? 153 PRO A CB 1 ATOM 2037 C CG . PRO A 1 141 ? 1.038 27.835 31.553 1.00 31.89 ? 153 PRO A CG 1 ATOM 2038 C CD . PRO A 1 141 ? 1.782 27.784 32.826 1.00 30.07 ? 153 PRO A CD 1 ATOM 2039 H HA . PRO A 1 141 ? 3.821 27.754 30.452 1.00 27.19 ? 153 PRO A HA 1 ATOM 2040 H HB2 . PRO A 1 141 ? 1.661 29.441 30.485 1.00 30.49 ? 153 PRO A HB2 1 ATOM 2041 H HB3 . PRO A 1 141 ? 1.789 28.067 29.685 1.00 30.49 ? 153 PRO A HB3 1 ATOM 2042 H HG2 . PRO A 1 141 ? 0.220 28.344 31.665 1.00 38.26 ? 153 PRO A HG2 1 ATOM 2043 H HG3 . PRO A 1 141 ? 0.833 26.937 31.251 1.00 38.26 ? 153 PRO A HG3 1 ATOM 2044 H HD2 . PRO A 1 141 ? 1.600 28.574 33.358 1.00 36.08 ? 153 PRO A HD2 1 ATOM 2045 H HD3 . PRO A 1 141 ? 1.573 26.969 33.309 1.00 36.08 ? 153 PRO A HD3 1 ATOM 2046 N N . GLN A 1 142 ? 4.577 30.131 29.970 1.00 21.08 ? 154 GLN A N 1 ATOM 2047 C CA . GLN A 1 142 ? 5.280 31.399 29.939 1.00 25.44 ? 154 GLN A CA 1 ATOM 2048 C C . GLN A 1 142 ? 4.362 32.521 30.393 1.00 18.70 ? 154 GLN A C 1 ATOM 2049 O O . GLN A 1 142 ? 3.139 32.489 30.188 1.00 20.82 ? 154 GLN A O 1 ATOM 2050 C CB . GLN A 1 142 ? 5.821 31.686 28.534 1.00 25.96 ? 154 GLN A CB 1 ATOM 2051 C CG . GLN A 1 142 ? 4.792 31.998 27.469 1.00 25.06 ? 154 GLN A CG 1 ATOM 2052 C CD . GLN A 1 142 ? 5.437 32.525 26.186 1.00 27.65 ? 154 GLN A CD 1 ATOM 2053 O OE1 . GLN A 1 142 ? 5.956 31.765 25.357 1.00 27.86 ? 154 GLN A OE1 1 ATOM 2054 N NE2 . GLN A 1 142 ? 5.448 33.850 26.038 1.00 26.86 ? 154 GLN A NE2 1 ATOM 2055 H H . GLN A 1 142 ? 4.577 29.699 29.226 1.00 25.29 ? 154 GLN A H 1 ATOM 2056 H HA . GLN A 1 142 ? 6.033 31.360 30.549 1.00 30.52 ? 154 GLN A HA 1 ATOM 2057 H HB2 . GLN A 1 142 ? 6.418 32.448 28.588 1.00 31.15 ? 154 GLN A HB2 1 ATOM 2058 H HB3 . GLN A 1 142 ? 6.318 30.909 28.235 1.00 31.15 ? 154 GLN A HB3 1 ATOM 2059 H HG2 . GLN A 1 142 ? 4.304 31.188 27.252 1.00 30.08 ? 154 GLN A HG2 1 ATOM 2060 H HG3 . GLN A 1 142 ? 4.184 32.676 27.803 1.00 30.08 ? 154 GLN A HG3 1 ATOM 2061 H HE21 . GLN A 1 142 ? 5.105 34.354 26.645 1.00 32.23 ? 154 GLN A HE21 1 ATOM 2062 H HE22 . GLN A 1 142 ? 5.797 34.201 25.335 1.00 32.23 ? 154 GLN A HE22 1 ATOM 2063 N N . ASP A 1 143 ? 4.980 33.511 31.031 1.00 17.47 ? 155 ASP A N 1 ATOM 2064 C CA . ASP A 1 143 ? 4.419 34.779 31.452 1.00 19.97 ? 155 ASP A CA 1 ATOM 2065 C C . ASP A 1 143 ? 3.531 34.640 32.688 1.00 22.41 ? 155 ASP A C 1 ATOM 2066 O O . ASP A 1 143 ? 3.149 35.655 33.254 1.00 20.62 ? 155 ASP A O 1 ATOM 2067 C CB . ASP A 1 143 ? 3.599 35.470 30.346 1.00 20.59 ? 155 ASP A CB 1 ATOM 2068 C CG . ASP A 1 143 ? 4.330 35.579 29.030 1.00 26.22 ? 155 ASP A CG 1 ATOM 2069 O OD1 . ASP A 1 143 ? 5.575 35.697 29.008 1.00 22.76 ? 155 ASP A OD1 1 ATOM 2070 O OD2 . ASP A 1 143 ? 3.637 35.555 27.981 1.00 24.38 ? 155 ASP A OD2 1 ATOM 2071 H H . ASP A 1 143 ? 5.810 33.454 31.248 1.00 20.96 ? 155 ASP A H 1 ATOM 2072 H HA . ASP A 1 143 ? 5.149 35.372 31.686 1.00 23.97 ? 155 ASP A HA 1 ATOM 2073 H HB2 . ASP A 1 143 ? 2.787 34.962 30.194 1.00 24.71 ? 155 ASP A HB2 1 ATOM 2074 H HB3 . ASP A 1 143 ? 3.376 36.369 30.637 1.00 24.71 ? 155 ASP A HB3 1 ATOM 2075 N N . GLN A 1 144 ? 3.175 33.429 33.115 1.00 20.33 ? 156 GLN A N 1 ATOM 2076 C CA . GLN A 1 144 ? 2.208 33.264 34.206 1.00 20.25 ? 156 GLN A CA 1 ATOM 2077 C C . GLN A 1 144 ? 2.876 33.165 35.574 1.00 23.85 ? 156 GLN A C 1 ATOM 2078 O O . GLN A 1 144 ? 2.595 32.259 36.369 1.00 26.36 ? 156 GLN A O 1 ATOM 2079 C CB . GLN A 1 144 ? 1.347 32.034 33.938 1.00 24.66 ? 156 GLN A CB 1 ATOM 2080 C CG . GLN A 1 144 ? 0.714 32.059 32.566 1.00 22.77 ? 156 GLN A CG 1 ATOM 2081 C CD . GLN A 1 144 ? -0.005 33.363 32.294 1.00 21.80 ? 156 GLN A CD 1 ATOM 2082 O OE1 . GLN A 1 144 ? -0.845 33.795 33.096 1.00 25.28 ? 156 GLN A OE1 1 ATOM 2083 N NE2 . GLN A 1 144 ? 0.307 34.007 31.153 1.00 24.98 ? 156 GLN A NE2 1 ATOM 2084 H H . GLN A 1 144 ? 3.475 32.691 32.794 1.00 24.40 ? 156 GLN A H 1 ATOM 2085 H HA . GLN A 1 144 ? 1.622 34.036 34.221 1.00 24.30 ? 156 GLN A HA 1 ATOM 2086 H HB2 . GLN A 1 144 ? 1.901 31.240 34.000 1.00 29.59 ? 156 GLN A HB2 1 ATOM 2087 H HB3 . GLN A 1 144 ? 0.636 31.995 34.596 1.00 29.59 ? 156 GLN A HB3 1 ATOM 2088 H HG2 . GLN A 1 144 ? 1.406 31.950 31.895 1.00 27.32 ? 156 GLN A HG2 1 ATOM 2089 H HG3 . GLN A 1 144 ? 0.068 31.338 32.500 1.00 27.32 ? 156 GLN A HG3 1 ATOM 2090 H HE21 . GLN A 1 144 ? 0.892 33.674 30.618 1.00 29.98 ? 156 GLN A HE21 1 ATOM 2091 H HE22 . GLN A 1 144 ? -0.078 34.751 30.960 1.00 29.98 ? 156 GLN A HE22 1 ATOM 2092 N N . LEU A 1 145 ? 3.740 34.108 35.871 1.00 21.50 ? 157 LEU A N 1 ATOM 2093 C CA . LEU A 1 145 ? 4.530 34.024 37.093 1.00 18.06 ? 157 LEU A CA 1 ATOM 2094 C C . LEU A 1 145 ? 3.650 34.301 38.300 1.00 21.73 ? 157 LEU A C 1 ATOM 2095 O O . LEU A 1 145 ? 2.915 35.297 38.313 1.00 21.69 ? 157 LEU A O 1 ATOM 2096 C CB . LEU A 1 145 ? 5.714 34.996 37.040 1.00 19.88 ? 157 LEU A CB 1 ATOM 2097 C CG . LEU A 1 145 ? 6.879 34.353 36.260 1.00 24.86 ? 157 LEU A CG 1 ATOM 2098 C CD1 . LEU A 1 145 ? 6.771 34.561 34.755 1.00 20.81 ? 157 LEU A CD1 1 ATOM 2099 C CD2 . LEU A 1 145 ? 8.184 34.778 36.793 1.00 28.61 ? 157 LEU A CD2 1 ATOM 2100 H H . LEU A 1 145 ? 3.893 34.805 35.392 1.00 25.80 ? 157 LEU A H 1 ATOM 2101 H HA . LEU A 1 145 ? 4.883 33.125 37.180 1.00 21.67 ? 157 LEU A HA 1 ATOM 2102 H HB2 . LEU A 1 145 ? 5.448 35.810 36.584 1.00 23.85 ? 157 LEU A HB2 1 ATOM 2103 H HB3 . LEU A 1 145 ? 6.016 35.192 37.941 1.00 23.85 ? 157 LEU A HB3 1 ATOM 2104 H HG . LEU A 1 145 ? 6.827 33.396 36.404 1.00 29.83 ? 157 LEU A HG 1 ATOM 2105 H HD11 . LEU A 1 145 ? 7.528 34.135 34.323 1.00 24.97 ? 157 LEU A HD11 1 ATOM 2106 H HD12 . LEU A 1 145 ? 5.944 34.163 34.441 1.00 24.97 ? 157 LEU A HD12 1 ATOM 2107 H HD13 . LEU A 1 145 ? 6.774 35.512 34.567 1.00 24.97 ? 157 LEU A HD13 1 ATOM 2108 H HD21 . LEU A 1 145 ? 8.889 34.354 36.279 1.00 34.34 ? 157 LEU A HD21 1 ATOM 2109 H HD22 . LEU A 1 145 ? 8.255 35.743 36.721 1.00 34.34 ? 157 LEU A HD22 1 ATOM 2110 H HD23 . LEU A 1 145 ? 8.247 34.510 37.724 1.00 34.34 ? 157 LEU A HD23 1 ATOM 2111 N N . PRO A 1 146 ? 3.680 33.442 39.319 1.00 22.15 ? 158 PRO A N 1 ATOM 2112 C CA . PRO A 1 146 ? 2.677 33.485 40.382 1.00 23.79 ? 158 PRO A CA 1 ATOM 2113 C C . PRO A 1 146 ? 3.026 34.421 41.535 1.00 25.56 ? 158 PRO A C 1 ATOM 2114 O O . PRO A 1 146 ? 4.157 34.894 41.684 1.00 25.52 ? 158 PRO A O 1 ATOM 2115 C CB . PRO A 1 146 ? 2.640 32.021 40.858 1.00 24.27 ? 158 PRO A CB 1 ATOM 2116 C CG . PRO A 1 146 ? 3.982 31.514 40.615 1.00 29.19 ? 158 PRO A CG 1 ATOM 2117 C CD . PRO A 1 146 ? 4.465 32.190 39.351 1.00 26.61 ? 158 PRO A CD 1 ATOM 2118 H HA . PRO A 1 146 ? 1.810 33.728 40.020 1.00 28.55 ? 158 PRO A HA 1 ATOM 2119 H HB2 . PRO A 1 146 ? 2.426 31.989 41.803 1.00 29.13 ? 158 PRO A HB2 1 ATOM 2120 H HB3 . PRO A 1 146 ? 1.986 31.525 40.340 1.00 29.13 ? 158 PRO A HB3 1 ATOM 2121 H HG2 . PRO A 1 146 ? 4.555 31.744 41.363 1.00 35.03 ? 158 PRO A HG2 1 ATOM 2122 H HG3 . PRO A 1 146 ? 3.949 30.553 40.495 1.00 35.03 ? 158 PRO A HG3 1 ATOM 2123 H HD2 . PRO A 1 146 ? 5.413 32.386 39.413 1.00 31.94 ? 158 PRO A HD2 1 ATOM 2124 H HD3 . PRO A 1 146 ? 4.263 31.643 38.576 1.00 31.94 ? 158 PRO A HD3 1 ATOM 2125 N N . ILE A 1 147 ? 2.015 34.666 42.374 1.00 23.26 ? 159 ILE A N 1 ATOM 2126 C CA . ILE A 1 147 ? 2.133 35.586 43.493 1.00 24.71 ? 159 ILE A CA 1 ATOM 2127 C C . ILE A 1 147 ? 2.364 34.847 44.817 1.00 23.29 ? 159 ILE A C 1 ATOM 2128 O O . ILE A 1 147 ? 2.393 35.487 45.875 1.00 25.36 ? 159 ILE A O 1 ATOM 2129 C CB . ILE A 1 147 ? 0.910 36.520 43.593 1.00 26.54 ? 159 ILE A CB 1 ATOM 2130 C CG1 . ILE A 1 147 ? -0.376 35.717 43.808 1.00 30.47 ? 159 ILE A CG1 1 ATOM 2131 C CG2 . ILE A 1 147 ? 0.795 37.399 42.347 1.00 31.28 ? 159 ILE A CG2 1 ATOM 2132 C CD1 . ILE A 1 147 ? -1.623 36.587 44.024 1.00 33.99 ? 159 ILE A CD1 1 ATOM 2133 H H . ILE A 1 147 ? 1.239 34.301 42.309 1.00 27.91 ? 159 ILE A H 1 ATOM 2134 H HA . ILE A 1 147 ? 2.909 36.147 43.341 1.00 29.65 ? 159 ILE A HA 1 ATOM 2135 H HB . ILE A 1 147 ? 1.035 37.100 44.361 1.00 31.85 ? 159 ILE A HB 1 ATOM 2136 H HG12 . ILE A 1 147 ? -0.533 35.163 43.027 1.00 36.56 ? 159 ILE A HG12 1 ATOM 2137 H HG13 . ILE A 1 147 ? -0.267 35.156 44.592 1.00 36.56 ? 159 ILE A HG13 1 ATOM 2138 H HG21 . ILE A 1 147 ? 0.019 37.974 42.437 1.00 37.53 ? 159 ILE A HG21 1 ATOM 2139 H HG22 . ILE A 1 147 ? 1.598 37.937 42.265 1.00 37.53 ? 159 ILE A HG22 1 ATOM 2140 H HG23 . ILE A 1 147 ? 0.696 36.830 41.567 1.00 37.53 ? 159 ILE A HG23 1 ATOM 2141 H HD11 . ILE A 1 147 ? -2.392 36.010 44.152 1.00 40.78 ? 159 ILE A HD11 1 ATOM 2142 H HD12 . ILE A 1 147 ? -1.489 37.140 44.809 1.00 40.78 ? 159 ILE A HD12 1 ATOM 2143 H HD13 . ILE A 1 147 ? -1.756 37.147 43.243 1.00 40.78 ? 159 ILE A HD13 1 ATOM 2144 N N . VAL A 1 148 ? 2.580 33.526 44.757 1.00 30.03 ? 160 VAL A N 1 ATOM 2145 C CA . VAL A 1 148 ? 2.924 32.668 45.889 1.00 31.96 ? 160 VAL A CA 1 ATOM 2146 C C . VAL A 1 148 ? 4.049 31.728 45.462 1.00 31.06 ? 160 VAL A C 1 ATOM 2147 O O . VAL A 1 148 ? 4.441 31.669 44.292 1.00 30.21 ? 160 VAL A O 1 ATOM 2148 C CB . VAL A 1 148 ? 1.711 31.847 46.373 1.00 30.37 ? 160 VAL A CB 1 ATOM 2149 C CG1 . VAL A 1 148 ? 0.642 32.770 46.917 1.00 32.83 ? 160 VAL A CG1 1 ATOM 2150 C CG2 . VAL A 1 148 ? 1.159 30.997 45.248 1.00 30.81 ? 160 VAL A CG2 1 ATOM 2151 H H . VAL A 1 148 ? 2.528 33.084 44.022 1.00 36.04 ? 160 VAL A H 1 ATOM 2152 H HA . VAL A 1 148 ? 3.240 33.214 46.626 1.00 38.35 ? 160 VAL A HA 1 ATOM 2153 H HB . VAL A 1 148 ? 1.993 31.255 47.089 1.00 36.44 ? 160 VAL A HB 1 ATOM 2154 H HG11 . VAL A 1 148 ? -0.112 32.238 47.216 1.00 39.39 ? 160 VAL A HG11 1 ATOM 2155 H HG12 . VAL A 1 148 ? 1.008 33.273 47.661 1.00 39.39 ? 160 VAL A HG12 1 ATOM 2156 H HG13 . VAL A 1 148 ? 0.361 33.376 46.213 1.00 39.39 ? 160 VAL A HG13 1 ATOM 2157 H HG21 . VAL A 1 148 ? 0.399 30.492 45.578 1.00 36.97 ? 160 VAL A HG21 1 ATOM 2158 H HG22 . VAL A 1 148 ? 0.880 31.577 44.522 1.00 36.97 ? 160 VAL A HG22 1 ATOM 2159 H HG23 . VAL A 1 148 ? 1.851 30.391 44.941 1.00 36.97 ? 160 VAL A HG23 1 ATOM 2160 N N . THR A 1 149 ? 4.562 30.961 46.421 1.00 27.33 ? 161 THR A N 1 ATOM 2161 C CA . THR A 1 149 ? 5.671 30.075 46.104 1.00 28.42 ? 161 THR A CA 1 ATOM 2162 C C . THR A 1 149 ? 5.234 29.045 45.069 1.00 24.85 ? 161 THR A C 1 ATOM 2163 O O . THR A 1 149 ? 4.048 28.762 44.889 1.00 28.72 ? 161 THR A O 1 ATOM 2164 C CB . THR A 1 149 ? 6.209 29.394 47.365 1.00 31.51 ? 161 THR A CB 1 ATOM 2165 O OG1 . THR A 1 149 ? 7.372 28.616 47.024 1.00 34.39 ? 161 THR A OG1 1 ATOM 2166 C CG2 . THR A 1 149 ? 5.131 28.498 47.983 1.00 32.64 ? 161 THR A CG2 1 ATOM 2167 H H . THR A 1 149 ? 4.295 30.937 47.238 1.00 32.79 ? 161 THR A H 1 ATOM 2168 H HA . THR A 1 149 ? 6.391 30.598 45.719 1.00 34.11 ? 161 THR A HA 1 ATOM 2169 H HB . THR A 1 149 ? 6.454 30.070 48.016 1.00 37.81 ? 161 THR A HB 1 ATOM 2170 H HG1 . THR A 1 149 ? 7.967 29.115 46.702 1.00 41.27 ? 161 THR A HG1 1 ATOM 2171 H HG21 . THR A 1 149 ? 5.476 28.068 48.782 1.00 39.16 ? 161 THR A HG21 1 ATOM 2172 H HG22 . THR A 1 149 ? 4.355 29.029 48.221 1.00 39.16 ? 161 THR A HG22 1 ATOM 2173 H HG23 . THR A 1 149 ? 4.864 27.815 47.348 1.00 39.16 ? 161 THR A HG23 1 ATOM 2174 N N . SER A 1 150 ? 6.216 28.523 44.348 1.00 27.88 ? 162 SER A N 1 ATOM 2175 C CA . SER A 1 150 ? 5.990 27.622 43.236 1.00 25.99 ? 162 SER A CA 1 ATOM 2176 C C . SER A 1 150 ? 7.233 26.769 43.065 1.00 26.94 ? 162 SER A C 1 ATOM 2177 O O . SER A 1 150 ? 8.294 27.076 43.616 1.00 26.66 ? 162 SER A O 1 ATOM 2178 C CB . SER A 1 150 ? 5.709 28.401 41.941 1.00 32.40 ? 162 SER A CB 1 ATOM 2179 O OG . SER A 1 150 ? 6.907 29.037 41.499 1.00 27.51 ? 162 SER A OG 1 ATOM 2180 H H . SER A 1 150 ? 7.049 28.682 44.492 1.00 33.45 ? 162 SER A H 1 ATOM 2181 H HA . SER A 1 150 ? 5.235 27.044 43.427 1.00 31.19 ? 162 SER A HA 1 ATOM 2182 H HB2 . SER A 1 150 ? 5.402 27.786 41.257 1.00 38.89 ? 162 SER A HB2 1 ATOM 2183 H HB3 . SER A 1 150 ? 5.033 29.076 42.113 1.00 38.89 ? 162 SER A HB3 1 ATOM 2184 H HG . SER A 1 150 ? 7.184 29.569 42.087 1.00 33.01 ? 162 SER A HG 1 ATOM 2185 N N . LYS A 1 151 ? 7.103 25.726 42.237 1.00 26.93 ? 163 LYS A N 1 ATOM 2186 C CA . LYS A 1 151 ? 8.228 24.830 41.965 1.00 32.34 ? 163 LYS A CA 1 ATOM 2187 C C . LYS A 1 151 ? 9.389 25.563 41.303 1.00 28.94 ? 163 LYS A C 1 ATOM 2188 O O . LYS A 1 151 ? 10.550 25.310 41.624 1.00 32.29 ? 163 LYS A O 1 ATOM 2189 C CB . LYS A 1 151 ? 7.785 23.679 41.069 1.00 36.30 ? 163 LYS A CB 1 ATOM 2190 C CG . LYS A 1 151 ? 6.868 22.688 41.761 1.00 63.02 ? 163 LYS A CG 1 ATOM 2191 C CD . LYS A 1 151 ? 6.614 21.456 40.912 1.00 80.05 ? 163 LYS A CD 1 ATOM 2192 C CE . LYS A 1 151 ? 5.741 20.448 41.655 1.00 88.57 ? 163 LYS A CE 1 ATOM 2193 N NZ . LYS A 1 151 ? 5.574 19.181 40.884 1.00 108.48 ? 163 LYS A NZ 1 ATOM 2194 H H . LYS A 1 151 ? 6.377 25.518 41.825 1.00 32.31 ? 163 LYS A H 1 ATOM 2195 H HA . LYS A 1 151 ? 8.546 24.456 42.801 1.00 38.81 ? 163 LYS A HA 1 ATOM 2196 H HB2 . LYS A 1 151 ? 7.309 24.042 40.305 1.00 43.56 ? 163 LYS A HB2 1 ATOM 2197 H HB3 . LYS A 1 151 ? 8.571 23.196 40.768 1.00 43.56 ? 163 LYS A HB3 1 ATOM 2198 H HG2 . LYS A 1 151 ? 7.278 22.403 42.593 1.00 75.63 ? 163 LYS A HG2 1 ATOM 2199 H HG3 . LYS A 1 151 ? 6.015 23.115 41.939 1.00 75.63 ? 163 LYS A HG3 1 ATOM 2200 H HD2 . LYS A 1 151 ? 6.155 21.716 40.098 1.00 96.06 ? 163 LYS A HD2 1 ATOM 2201 H HD3 . LYS A 1 151 ? 7.460 21.031 40.701 1.00 96.06 ? 163 LYS A HD3 1 ATOM 2202 H HE2 . LYS A 1 151 ? 6.156 20.233 42.505 1.00 106.29 ? 163 LYS A HE2 1 ATOM 2203 H HE3 . LYS A 1 151 ? 4.862 20.832 41.799 1.00 106.29 ? 163 LYS A HE3 1 ATOM 2204 H HZ1 . LYS A 1 151 ? 5.062 18.613 41.340 1.00 130.17 ? 163 LYS A HZ1 1 ATOM 2205 H HZ2 . LYS A 1 151 ? 5.190 19.351 40.099 1.00 130.17 ? 163 LYS A HZ2 1 ATOM 2206 H HZ3 . LYS A 1 151 ? 6.368 18.805 40.742 1.00 130.17 ? 163 LYS A HZ3 1 ATOM 2207 N N . VAL A 1 152 ? 9.098 26.450 40.349 1.00 27.55 ? 164 VAL A N 1 ATOM 2208 C CA . VAL A 1 152 ? 10.173 27.197 39.691 1.00 26.87 ? 164 VAL A CA 1 ATOM 2209 C C . VAL A 1 152 ? 10.874 28.108 40.689 1.00 20.30 ? 164 VAL A C 1 ATOM 2210 O O . VAL A 1 152 ? 12.108 28.184 40.715 1.00 24.72 ? 164 VAL A O 1 ATOM 2211 C CB . VAL A 1 152 ? 9.633 28.002 38.491 1.00 28.39 ? 164 VAL A CB 1 ATOM 2212 C CG1 . VAL A 1 152 ? 10.678 29.015 38.008 1.00 24.34 ? 164 VAL A CG1 1 ATOM 2213 C CG2 . VAL A 1 152 ? 9.249 27.078 37.364 1.00 29.33 ? 164 VAL A CG2 1 ATOM 2214 H H . VAL A 1 152 ? 8.306 26.636 40.070 1.00 33.07 ? 164 VAL A H 1 ATOM 2215 H HA . VAL A 1 152 ? 10.829 26.567 39.353 1.00 32.25 ? 164 VAL A HA 1 ATOM 2216 H HB . VAL A 1 152 ? 8.841 28.490 38.766 1.00 34.07 ? 164 VAL A HB 1 ATOM 2217 H HG11 . VAL A 1 152 ? 10.315 29.507 37.255 1.00 29.20 ? 164 VAL A HG11 1 ATOM 2218 H HG12 . VAL A 1 152 ? 10.885 29.624 38.734 1.00 29.20 ? 164 VAL A HG12 1 ATOM 2219 H HG13 . VAL A 1 152 ? 11.478 28.538 37.738 1.00 29.20 ? 164 VAL A HG13 1 ATOM 2220 H HG21 . VAL A 1 152 ? 8.912 27.607 36.623 1.00 35.20 ? 164 VAL A HG21 1 ATOM 2221 H HG22 . VAL A 1 152 ? 10.032 26.578 37.085 1.00 35.20 ? 164 VAL A HG22 1 ATOM 2222 H HG23 . VAL A 1 152 ? 8.560 26.469 37.676 1.00 35.20 ? 164 VAL A HG23 1 ATOM 2223 N N . TYR A 1 153 ? 10.104 28.849 41.492 1.00 22.55 ? 165 TYR A N 1 ATOM 2224 C CA . TYR A 1 153 ? 10.726 29.737 42.467 1.00 23.54 ? 165 TYR A CA 1 ATOM 2225 C C . TYR A 1 153 ? 11.591 28.950 43.444 1.00 28.70 ? 165 TYR A C 1 ATOM 2226 O O . TYR A 1 153 ? 12.654 29.419 43.861 1.00 23.26 ? 165 TYR A O 1 ATOM 2227 C CB . TYR A 1 153 ? 9.691 30.510 43.258 1.00 25.45 ? 165 TYR A CB 1 ATOM 2228 C CG . TYR A 1 153 ? 8.884 31.561 42.513 1.00 22.72 ? 165 TYR A CG 1 ATOM 2229 C CD1 . TYR A 1 153 ? 9.295 32.066 41.280 1.00 23.60 ? 165 TYR A CD1 1 ATOM 2230 C CD2 . TYR A 1 153 ? 7.722 32.074 43.091 1.00 23.58 ? 165 TYR A CD2 1 ATOM 2231 C CE1 . TYR A 1 153 ? 8.532 33.045 40.621 1.00 22.41 ? 165 TYR A CE1 1 ATOM 2232 C CE2 . TYR A 1 153 ? 6.948 33.049 42.441 1.00 25.68 ? 165 TYR A CE2 1 ATOM 2233 C CZ . TYR A 1 153 ? 7.371 33.537 41.211 1.00 21.54 ? 165 TYR A CZ 1 ATOM 2234 O OH . TYR A 1 153 ? 6.596 34.510 40.566 1.00 21.98 ? 165 TYR A OH 1 ATOM 2235 H H . TYR A 1 153 ? 9.244 28.854 41.490 1.00 27.06 ? 165 TYR A H 1 ATOM 2236 H HA . TYR A 1 153 ? 11.292 30.374 42.004 1.00 28.25 ? 165 TYR A HA 1 ATOM 2237 H HB2 . TYR A 1 153 ? 9.058 29.874 43.627 1.00 30.54 ? 165 TYR A HB2 1 ATOM 2238 H HB3 . TYR A 1 153 ? 10.146 30.964 43.985 1.00 30.54 ? 165 TYR A HB3 1 ATOM 2239 H HD1 . TYR A 1 153 ? 10.071 31.741 40.884 1.00 28.32 ? 165 TYR A HD1 1 ATOM 2240 H HD2 . TYR A 1 153 ? 7.442 31.747 43.915 1.00 28.30 ? 165 TYR A HD2 1 ATOM 2241 H HE1 . TYR A 1 153 ? 8.809 33.371 39.796 1.00 26.90 ? 165 TYR A HE1 1 ATOM 2242 H HE2 . TYR A 1 153 ? 6.172 33.376 42.837 1.00 30.82 ? 165 TYR A HE2 1 ATOM 2243 H HH . TYR A 1 153 ? 5.931 34.707 41.040 1.00 26.37 ? 165 TYR A HH 1 ATOM 2244 N N . SER A 1 154 ? 11.128 27.772 43.848 1.00 27.27 ? 166 SER A N 1 ATOM 2245 C CA A SER A 1 154 ? 11.923 26.943 44.756 0.56 27.15 ? 166 SER A CA 1 ATOM 2246 C CA B SER A 1 154 ? 11.919 26.945 44.758 0.44 27.21 ? 166 SER A CA 1 ATOM 2247 C C . SER A 1 154 ? 13.159 26.401 44.064 1.00 27.43 ? 166 SER A C 1 ATOM 2248 O O . SER A 1 154 ? 14.244 26.361 44.660 1.00 28.42 ? 166 SER A O 1 ATOM 2249 C CB A SER A 1 154 ? 11.076 25.798 45.303 0.56 34.05 ? 166 SER A CB 1 ATOM 2250 C CB B SER A 1 154 ? 11.055 25.810 45.310 0.44 34.01 ? 166 SER A CB 1 ATOM 2251 O OG A SER A 1 154 ? 10.137 26.293 46.221 0.56 31.28 ? 166 SER A OG 1 ATOM 2252 O OG B SER A 1 154 ? 11.784 25.024 46.235 0.44 36.32 ? 166 SER A OG 1 ATOM 2253 H H . SER A 1 154 ? 10.374 27.428 43.619 1.00 32.72 ? 166 SER A H 1 ATOM 2254 H HA . SER A 1 154 ? 12.211 27.488 45.506 1.00 32.66 ? 166 SER A HA 1 ATOM 2255 H HB2 A SER A 1 154 ? 10.609 25.369 44.569 0.56 40.86 ? 166 SER A HB2 1 ATOM 2256 H HB2 B SER A 1 154 ? 10.284 26.189 45.759 0.44 40.81 ? 166 SER A HB2 1 ATOM 2257 H HB3 A SER A 1 154 ? 11.653 25.161 45.751 0.56 40.86 ? 166 SER A HB3 1 ATOM 2258 H HB3 B SER A 1 154 ? 10.768 25.246 44.575 0.44 40.81 ? 166 SER A HB3 1 ATOM 2259 H HG A SER A 1 154 ? 9.670 25.663 46.522 0.56 37.53 ? 166 SER A HG 1 ATOM 2260 H HG B SER A 1 154 ? 12.040 25.501 46.877 0.44 43.58 ? 166 SER A HG 1 ATOM 2261 N N . ALA A 1 155 ? 13.028 25.989 42.799 1.00 26.02 ? 167 ALA A N 1 ATOM 2262 C CA . ALA A 1 155 ? 14.176 25.480 42.065 1.00 28.34 ? 167 ALA A CA 1 ATOM 2263 C C . ALA A 1 155 ? 15.252 26.544 41.886 1.00 33.12 ? 167 ALA A C 1 ATOM 2264 O O . ALA A 1 155 ? 16.447 26.253 42.047 1.00 27.30 ? 167 ALA A O 1 ATOM 2265 C CB . ALA A 1 155 ? 13.740 24.919 40.719 1.00 30.43 ? 167 ALA A CB 1 ATOM 2266 H H . ALA A 1 155 ? 12.293 25.997 42.354 1.00 31.22 ? 167 ALA A H 1 ATOM 2267 H HA . ALA A 1 155 ? 14.567 24.752 42.572 1.00 34.01 ? 167 ALA A HA 1 ATOM 2268 H HB1 . ALA A 1 155 ? 14.520 24.586 40.249 1.00 36.51 ? 167 ALA A HB1 1 ATOM 2269 H HB2 . ALA A 1 155 ? 13.109 24.197 40.868 1.00 36.51 ? 167 ALA A HB2 1 ATOM 2270 H HB3 . ALA A 1 155 ? 13.319 25.625 40.205 1.00 36.51 ? 167 ALA A HB3 1 ATOM 2271 N N . VAL A 1 156 ? 14.871 27.787 41.543 1.00 27.47 ? 168 VAL A N 1 ATOM 2272 C CA . VAL A 1 156 ? 15.922 28.784 41.336 1.00 24.74 ? 168 VAL A CA 1 ATOM 2273 C C . VAL A 1 156 ? 16.502 29.226 42.670 1.00 22.23 ? 168 VAL A C 1 ATOM 2274 O O . VAL A 1 156 ? 17.665 29.626 42.739 1.00 26.22 ? 168 VAL A O 1 ATOM 2275 C CB . VAL A 1 156 ? 15.434 29.991 40.493 1.00 23.92 ? 168 VAL A CB 1 ATOM 2276 C CG1 . VAL A 1 156 ? 15.014 29.490 39.106 1.00 24.56 ? 168 VAL A CG1 1 ATOM 2277 C CG2 . VAL A 1 156 ? 14.326 30.746 41.168 1.00 26.25 ? 168 VAL A CG2 1 ATOM 2278 H H . VAL A 1 156 ? 14.064 28.060 41.430 1.00 32.96 ? 168 VAL A H 1 ATOM 2279 H HA . VAL A 1 156 ? 16.641 28.363 40.839 1.00 29.68 ? 168 VAL A HA 1 ATOM 2280 H HB . VAL A 1 156 ? 16.175 30.605 40.372 1.00 28.70 ? 168 VAL A HB 1 ATOM 2281 H HG11 . VAL A 1 156 ? 14.708 30.244 38.578 1.00 29.47 ? 168 VAL A HG11 1 ATOM 2282 H HG12 . VAL A 1 156 ? 15.777 29.073 38.677 1.00 29.47 ? 168 VAL A HG12 1 ATOM 2283 H HG13 . VAL A 1 156 ? 14.297 28.845 39.207 1.00 29.47 ? 168 VAL A HG13 1 ATOM 2284 H HG21 . VAL A 1 156 ? 14.058 31.487 40.602 1.00 31.50 ? 168 VAL A HG21 1 ATOM 2285 H HG22 . VAL A 1 156 ? 13.575 30.147 41.306 1.00 31.50 ? 168 VAL A HG22 1 ATOM 2286 H HG23 . VAL A 1 156 ? 14.645 31.079 42.021 1.00 31.50 ? 168 VAL A HG23 1 ATOM 2287 N N . ALA A 1 157 ? 15.731 29.149 43.748 1.00 23.62 ? 169 ALA A N 1 ATOM 2288 C CA . ALA A 1 157 ? 16.315 29.458 45.051 1.00 28.01 ? 169 ALA A CA 1 ATOM 2289 C C . ALA A 1 157 ? 17.412 28.456 45.399 1.00 34.02 ? 169 ALA A C 1 ATOM 2290 O O . ALA A 1 157 ? 18.430 28.819 45.999 1.00 31.22 ? 169 ALA A O 1 ATOM 2291 C CB . ALA A 1 157 ? 15.233 29.480 46.116 1.00 26.42 ? 169 ALA A CB 1 ATOM 2292 H H . ALA A 1 157 ? 14.900 28.929 43.758 1.00 28.34 ? 169 ALA A H 1 ATOM 2293 H HA . ALA A 1 157 ? 16.717 30.340 45.015 1.00 33.62 ? 169 ALA A HA 1 ATOM 2294 H HB1 . ALA A 1 157 ? 15.638 29.687 46.973 1.00 31.70 ? 169 ALA A HB1 1 ATOM 2295 H HB2 . ALA A 1 157 ? 14.579 30.159 45.887 1.00 31.70 ? 169 ALA A HB2 1 ATOM 2296 H HB3 . ALA A 1 157 ? 14.808 28.609 46.152 1.00 31.70 ? 169 ALA A HB3 1 ATOM 2297 N N . ASP A 1 158 ? 17.237 27.199 45.000 1.00 29.27 ? 170 ASP A N 1 ATOM 2298 C CA . ASP A 1 158 ? 18.284 26.199 45.210 1.00 30.68 ? 170 ASP A CA 1 ATOM 2299 C C . ASP A 1 158 ? 19.428 26.382 44.236 1.00 32.55 ? 170 ASP A C 1 ATOM 2300 O O . ASP A 1 158 ? 20.591 26.273 44.621 1.00 32.01 ? 170 ASP A O 1 ATOM 2301 C CB . ASP A 1 158 ? 17.703 24.785 45.081 1.00 31.70 ? 170 ASP A CB 1 ATOM 2302 C CG . ASP A 1 158 ? 16.717 24.461 46.198 1.00 51.21 ? 170 ASP A CG 1 ATOM 2303 O OD1 . ASP A 1 158 ? 16.799 25.116 47.263 1.00 51.39 ? 170 ASP A OD1 1 ATOM 2304 O OD2 . ASP A 1 158 ? 15.863 23.562 46.013 1.00 60.88 ? 170 ASP A OD2 1 ATOM 2305 H H . ASP A 1 158 ? 16.531 26.900 44.609 1.00 35.12 ? 170 ASP A H 1 ATOM 2306 H HA . ASP A 1 158 ? 18.637 26.296 46.108 1.00 36.81 ? 170 ASP A HA 1 ATOM 2307 H HB2 . ASP A 1 158 ? 17.235 24.710 44.235 1.00 38.04 ? 170 ASP A HB2 1 ATOM 2308 H HB3 . ASP A 1 158 ? 18.426 24.139 45.120 1.00 38.04 ? 170 ASP A HB3 1 ATOM 2309 N N . LEU A 1 159 ? 19.128 26.695 42.976 1.00 25.74 ? 171 LEU A N 1 ATOM 2310 C CA . LEU A 1 159 ? 20.192 26.866 41.995 1.00 25.74 ? 171 LEU A CA 1 ATOM 2311 C C . LEU A 1 159 ? 21.083 28.053 42.325 1.00 23.16 ? 171 LEU A C 1 ATOM 2312 O O . LEU A 1 159 ? 22.292 28.015 42.074 1.00 24.77 ? 171 LEU A O 1 ATOM 2313 C CB . LEU A 1 159 ? 19.588 27.046 40.599 1.00 27.05 ? 171 LEU A CB 1 ATOM 2314 C CG . LEU A 1 159 ? 19.024 25.802 39.931 1.00 28.78 ? 171 LEU A CG 1 ATOM 2315 C CD1 . LEU A 1 159 ? 18.274 26.215 38.643 1.00 28.36 ? 171 LEU A CD1 1 ATOM 2316 C CD2 . LEU A 1 159 ? 20.159 24.825 39.625 1.00 32.85 ? 171 LEU A CD2 1 ATOM 2317 H H . LEU A 1 159 ? 18.333 26.811 42.670 1.00 30.88 ? 171 LEU A H 1 ATOM 2318 H HA . LEU A 1 159 ? 20.745 26.069 41.984 1.00 30.89 ? 171 LEU A HA 1 ATOM 2319 H HB2 . LEU A 1 159 ? 18.865 27.690 40.663 1.00 32.45 ? 171 LEU A HB2 1 ATOM 2320 H HB3 . LEU A 1 159 ? 20.278 27.397 40.014 1.00 32.45 ? 171 LEU A HB3 1 ATOM 2321 H HG . LEU A 1 159 ? 18.395 25.368 40.529 1.00 34.54 ? 171 LEU A HG 1 ATOM 2322 H HD11 . LEU A 1 159 ? 17.915 25.420 38.219 1.00 34.03 ? 171 LEU A HD11 1 ATOM 2323 H HD12 . LEU A 1 159 ? 17.553 26.819 38.878 1.00 34.03 ? 171 LEU A HD12 1 ATOM 2324 H HD13 . LEU A 1 159 ? 18.896 26.657 38.044 1.00 34.03 ? 171 LEU A HD13 1 ATOM 2325 H HD21 . LEU A 1 159 ? 19.790 24.035 39.200 1.00 39.42 ? 171 LEU A HD21 1 ATOM 2326 H HD22 . LEU A 1 159 ? 20.794 25.255 39.031 1.00 39.42 ? 171 LEU A HD22 1 ATOM 2327 H HD23 . LEU A 1 159 ? 20.597 24.580 40.456 1.00 39.42 ? 171 LEU A HD23 1 ATOM 2328 N N . TRP A 1 160 ? 20.504 29.136 42.841 1.00 24.20 ? 172 TRP A N 1 ATOM 2329 C CA . TRP A 1 160 ? 21.234 30.381 43.014 1.00 25.58 ? 172 TRP A CA 1 ATOM 2330 C C . TRP A 1 160 ? 21.765 30.563 44.439 1.00 27.14 ? 172 TRP A C 1 ATOM 2331 O O . TRP A 1 160 ? 22.352 31.618 44.747 1.00 23.29 ? 172 TRP A O 1 ATOM 2332 C CB . TRP A 1 160 ? 20.333 31.556 42.576 1.00 21.89 ? 172 TRP A CB 1 ATOM 2333 C CG . TRP A 1 160 ? 19.936 31.430 41.116 1.00 22.25 ? 172 TRP A CG 1 ATOM 2334 C CD1 . TRP A 1 160 ? 20.542 30.663 40.172 1.00 22.19 ? 172 TRP A CD1 1 ATOM 2335 C CD2 . TRP A 1 160 ? 18.843 32.083 40.457 1.00 19.83 ? 172 TRP A CD2 1 ATOM 2336 N NE1 . TRP A 1 160 ? 19.900 30.788 38.957 1.00 22.66 ? 172 TRP A NE1 1 ATOM 2337 C CE2 . TRP A 1 160 ? 18.856 31.665 39.106 1.00 21.65 ? 172 TRP A CE2 1 ATOM 2338 C CE3 . TRP A 1 160 ? 17.871 32.991 40.874 1.00 20.29 ? 172 TRP A CE3 1 ATOM 2339 C CZ2 . TRP A 1 160 ? 17.907 32.108 38.178 1.00 23.41 ? 172 TRP A CZ2 1 ATOM 2340 C CZ3 . TRP A 1 160 ? 16.931 33.443 39.938 1.00 22.28 ? 172 TRP A CZ3 1 ATOM 2341 C CH2 . TRP A 1 160 ? 16.958 33.000 38.621 1.00 21.06 ? 172 TRP A CH2 1 ATOM 2342 H H . TRP A 1 160 ? 19.684 29.171 43.100 1.00 29.04 ? 172 TRP A H 1 ATOM 2343 H HA . TRP A 1 160 ? 22.001 30.369 42.420 1.00 30.70 ? 172 TRP A HA 1 ATOM 2344 H HB2 . TRP A 1 160 ? 19.524 31.558 43.113 1.00 26.27 ? 172 TRP A HB2 1 ATOM 2345 H HB3 . TRP A 1 160 ? 20.815 32.390 42.691 1.00 26.27 ? 172 TRP A HB3 1 ATOM 2346 H HD1 . TRP A 1 160 ? 21.281 30.120 40.326 1.00 26.63 ? 172 TRP A HD1 1 ATOM 2347 H HE1 . TRP A 1 160 ? 20.119 30.387 38.228 1.00 27.20 ? 172 TRP A HE1 1 ATOM 2348 H HE3 . TRP A 1 160 ? 17.841 33.283 41.756 1.00 24.35 ? 172 TRP A HE3 1 ATOM 2349 H HZ2 . TRP A 1 160 ? 17.929 31.826 37.292 1.00 28.09 ? 172 TRP A HZ2 1 ATOM 2350 H HZ3 . TRP A 1 160 ? 16.272 34.041 40.206 1.00 26.73 ? 172 TRP A HZ3 1 ATOM 2351 H HH2 . TRP A 1 160 ? 16.323 33.321 38.022 1.00 25.27 ? 172 TRP A HH2 1 ATOM 2352 N N . LYS A 1 161 ? 21.635 29.537 45.289 1.00 28.69 ? 173 LYS A N 1 ATOM 2353 C CA . LYS A 1 161 ? 22.165 29.609 46.655 1.00 27.57 ? 173 LYS A CA 1 ATOM 2354 C C . LYS A 1 161 ? 23.645 29.950 46.730 1.00 25.08 ? 173 LYS A C 1 ATOM 2355 O O . LYS A 1 161 ? 24.042 30.603 47.706 1.00 26.39 ? 173 LYS A O 1 ATOM 2356 C CB . LYS A 1 161 ? 21.924 28.284 47.396 1.00 35.09 ? 173 LYS A CB 1 ATOM 2357 C CG . LYS A 1 161 ? 20.760 28.295 48.343 1.00 55.72 ? 173 LYS A CG 1 ATOM 2358 C CD . LYS A 1 161 ? 20.484 26.900 48.898 1.00 78.99 ? 173 LYS A CD 1 ATOM 2359 C CE . LYS A 1 161 ? 19.002 26.707 49.242 1.00 66.33 ? 173 LYS A CE 1 ATOM 2360 N NZ . LYS A 1 161 ? 18.695 25.272 49.569 1.00 73.15 ? 173 LYS A NZ 1 ATOM 2361 H H . LYS A 1 161 ? 21.246 28.794 45.100 1.00 34.43 ? 173 LYS A H 1 ATOM 2362 H HA . LYS A 1 161 ? 21.683 30.302 47.133 1.00 33.09 ? 173 LYS A HA 1 ATOM 2363 H HB2 . LYS A 1 161 ? 21.761 27.588 46.740 1.00 42.11 ? 173 LYS A HB2 1 ATOM 2364 H HB3 . LYS A 1 161 ? 22.718 28.068 47.910 1.00 42.11 ? 173 LYS A HB3 1 ATOM 2365 H HG2 . LYS A 1 161 ? 20.958 28.885 49.087 1.00 66.86 ? 173 LYS A HG2 1 ATOM 2366 H HG3 . LYS A 1 161 ? 19.967 28.598 47.874 1.00 66.86 ? 173 LYS A HG3 1 ATOM 2367 H HD2 . LYS A 1 161 ? 20.730 26.238 48.234 1.00 94.78 ? 173 LYS A HD2 1 ATOM 2368 H HD3 . LYS A 1 161 ? 21.002 26.770 49.708 1.00 94.78 ? 173 LYS A HD3 1 ATOM 2369 H HE2 . LYS A 1 161 ? 18.779 27.250 50.014 1.00 79.59 ? 173 LYS A HE2 1 ATOM 2370 H HE3 . LYS A 1 161 ? 18.460 26.968 48.480 1.00 79.59 ? 173 LYS A HE3 1 ATOM 2371 H HZ1 . LYS A 1 161 ? 17.831 25.183 49.765 1.00 87.78 ? 173 LYS A HZ1 1 ATOM 2372 H HZ2 . LYS A 1 161 ? 18.888 24.753 48.872 1.00 87.78 ? 173 LYS A HZ2 1 ATOM 2373 H HZ3 . LYS A 1 161 ? 19.178 25.010 50.268 1.00 87.78 ? 173 LYS A HZ3 1 ATOM 2374 N N . PRO A 1 162 ? 24.509 29.537 45.804 1.00 26.11 ? 174 PRO A N 1 ATOM 2375 C CA . PRO A 1 162 ? 25.932 29.895 45.953 1.00 27.50 ? 174 PRO A CA 1 ATOM 2376 C C . PRO A 1 162 ? 26.165 31.384 45.940 1.00 29.40 ? 174 PRO A C 1 ATOM 2377 O O . PRO A 1 162 ? 27.209 31.847 46.422 1.00 23.76 ? 174 PRO A O 1 ATOM 2378 C CB . PRO A 1 162 ? 26.600 29.212 44.753 1.00 32.82 ? 174 PRO A CB 1 ATOM 2379 C CG . PRO A 1 162 ? 25.701 28.095 44.411 1.00 31.93 ? 174 PRO A CG 1 ATOM 2380 C CD . PRO A 1 162 ? 24.298 28.598 44.689 1.00 28.25 ? 174 PRO A CD 1 ATOM 2381 H HA . PRO A 1 162 ? 26.289 29.522 46.774 1.00 33.00 ? 174 PRO A HA 1 ATOM 2382 H HB2 . PRO A 1 162 ? 26.668 29.838 44.015 1.00 39.39 ? 174 PRO A HB2 1 ATOM 2383 H HB3 . PRO A 1 162 ? 27.476 28.884 45.009 1.00 39.39 ? 174 PRO A HB3 1 ATOM 2384 H HG2 . PRO A 1 162 ? 25.804 27.870 43.473 1.00 38.32 ? 174 PRO A HG2 1 ATOM 2385 H HG3 . PRO A 1 162 ? 25.906 27.329 44.971 1.00 38.32 ? 174 PRO A HG3 1 ATOM 2386 H HD2 . PRO A 1 162 ? 23.944 29.063 43.915 1.00 33.91 ? 174 PRO A HD2 1 ATOM 2387 H HD3 . PRO A 1 162 ? 23.722 27.867 44.963 1.00 33.91 ? 174 PRO A HD3 1 ATOM 2388 N N . TRP A 1 163 ? 25.212 32.161 45.400 1.00 22.76 ? 175 TRP A N 1 ATOM 2389 C CA . TRP A 1 163 ? 25.378 33.598 45.222 1.00 23.49 ? 175 TRP A CA 1 ATOM 2390 C C . TRP A 1 163 ? 24.614 34.434 46.231 1.00 22.52 ? 175 TRP A C 1 ATOM 2391 O O . TRP A 1 163 ? 24.917 35.627 46.388 1.00 24.83 ? 175 TRP A O 1 ATOM 2392 C CB . TRP A 1 163 ? 24.894 33.969 43.808 1.00 24.50 ? 175 TRP A CB 1 ATOM 2393 C CG . TRP A 1 163 ? 25.656 33.288 42.717 1.00 19.56 ? 175 TRP A CG 1 ATOM 2394 C CD1 . TRP A 1 163 ? 27.008 33.015 42.700 1.00 23.51 ? 175 TRP A CD1 1 ATOM 2395 C CD2 . TRP A 1 163 ? 25.134 32.775 41.485 1.00 18.74 ? 175 TRP A CD2 1 ATOM 2396 N NE1 . TRP A 1 163 ? 27.350 32.395 41.525 1.00 22.52 ? 175 TRP A NE1 1 ATOM 2397 C CE2 . TRP A 1 163 ? 26.224 32.226 40.765 1.00 24.11 ? 175 TRP A CE2 1 ATOM 2398 C CE3 . TRP A 1 163 ? 23.857 32.746 40.904 1.00 24.94 ? 175 TRP A CE3 1 ATOM 2399 C CZ2 . TRP A 1 163 ? 26.077 31.663 39.493 1.00 26.37 ? 175 TRP A CZ2 1 ATOM 2400 C CZ3 . TRP A 1 163 ? 23.713 32.191 39.644 1.00 24.18 ? 175 TRP A CZ3 1 ATOM 2401 C CH2 . TRP A 1 163 ? 24.820 31.649 38.949 1.00 24.22 ? 175 TRP A CH2 1 ATOM 2402 H H . TRP A 1 163 ? 24.452 31.867 45.127 1.00 27.31 ? 175 TRP A H 1 ATOM 2403 H HA . TRP A 1 163 ? 26.319 33.822 45.291 1.00 28.19 ? 175 TRP A HA 1 ATOM 2404 H HB2 . TRP A 1 163 ? 23.961 33.719 43.720 1.00 29.40 ? 175 TRP A HB2 1 ATOM 2405 H HB3 . TRP A 1 163 ? 24.992 34.927 43.685 1.00 29.40 ? 175 TRP A HB3 1 ATOM 2406 H HD1 . TRP A 1 163 ? 27.603 33.230 43.381 1.00 28.22 ? 175 TRP A HD1 1 ATOM 2407 H HE1 . TRP A 1 163 ? 28.141 32.134 41.310 1.00 27.02 ? 175 TRP A HE1 1 ATOM 2408 H HE3 . TRP A 1 163 ? 23.127 33.113 41.346 1.00 29.93 ? 175 TRP A HE3 1 ATOM 2409 H HZ2 . TRP A 1 163 ? 26.804 31.302 39.039 1.00 31.65 ? 175 TRP A HZ2 1 ATOM 2410 H HZ3 . TRP A 1 163 ? 22.869 32.160 39.253 1.00 29.02 ? 175 TRP A HZ3 1 ATOM 2411 H HH2 . TRP A 1 163 ? 24.689 31.265 38.113 1.00 29.06 ? 175 TRP A HH2 1 ATOM 2412 N N . LEU A 1 164 ? 23.646 33.840 46.917 1.00 22.25 ? 176 LEU A N 1 ATOM 2413 C CA . LEU A 1 164 ? 22.648 34.574 47.678 1.00 24.44 ? 176 LEU A CA 1 ATOM 2414 C C . LEU A 1 164 ? 22.610 34.124 49.134 1.00 26.78 ? 176 LEU A C 1 ATOM 2415 O O . LEU A 1 164 ? 22.729 32.930 49.426 1.00 26.61 ? 176 LEU A O 1 ATOM 2416 C CB . LEU A 1 164 ? 21.278 34.385 47.049 1.00 21.46 ? 176 LEU A CB 1 ATOM 2417 C CG . LEU A 1 164 ? 21.197 34.740 45.568 1.00 24.37 ? 176 LEU A CG 1 ATOM 2418 C CD1 . LEU A 1 164 ? 19.775 34.468 45.068 1.00 31.01 ? 176 LEU A CD1 1 ATOM 2419 C CD2 . LEU A 1 164 ? 21.586 36.181 45.312 1.00 27.76 ? 176 LEU A CD2 1 ATOM 2420 H H . LEU A 1 164 ? 23.545 32.987 46.957 1.00 26.70 ? 176 LEU A H 1 ATOM 2421 H HA . LEU A 1 164 ? 22.863 35.520 47.658 1.00 29.32 ? 176 LEU A HA 1 ATOM 2422 H HB2 . LEU A 1 164 ? 21.021 33.454 47.142 1.00 25.75 ? 176 LEU A HB2 1 ATOM 2423 H HB3 . LEU A 1 164 ? 20.642 34.946 47.520 1.00 25.75 ? 176 LEU A HB3 1 ATOM 2424 H HG . LEU A 1 164 ? 21.805 34.171 45.071 1.00 29.24 ? 176 LEU A HG 1 ATOM 2425 H HD11 . LEU A 1 164 ? 19.724 34.694 44.126 1.00 37.21 ? 176 LEU A HD11 1 ATOM 2426 H HD12 . LEU A 1 164 ? 19.571 33.529 45.195 1.00 37.21 ? 176 LEU A HD12 1 ATOM 2427 H HD13 . LEU A 1 164 ? 19.153 35.014 45.574 1.00 37.21 ? 176 LEU A HD13 1 ATOM 2428 H HD21 . LEU A 1 164 ? 21.520 36.361 44.361 1.00 33.32 ? 176 LEU A HD21 1 ATOM 2429 H HD22 . LEU A 1 164 ? 20.983 36.762 45.802 1.00 33.32 ? 176 LEU A HD22 1 ATOM 2430 H HD23 . LEU A 1 164 ? 22.497 36.320 45.614 1.00 33.32 ? 176 LEU A HD23 1 ATOM 2431 N N . GLY A 1 165 ? 22.432 35.100 50.036 1.00 27.39 ? 177 GLY A N 1 ATOM 2432 C CA . GLY A 1 165 ? 22.260 34.851 51.458 1.00 29.96 ? 177 GLY A CA 1 ATOM 2433 C C . GLY A 1 165 ? 20.882 34.309 51.795 1.00 28.34 ? 177 GLY A C 1 ATOM 2434 O O . GLY A 1 165 ? 19.991 34.183 50.952 1.00 26.07 ? 177 GLY A O 1 ATOM 2435 H H . GLY A 1 165 ? 22.408 35.935 49.833 1.00 32.87 ? 177 GLY A H 1 ATOM 2436 H HA2 . GLY A 1 165 ? 22.923 34.208 51.755 1.00 35.96 ? 177 GLY A HA2 1 ATOM 2437 H HA3 . GLY A 1 165 ? 22.393 35.677 51.948 1.00 35.96 ? 177 GLY A HA3 1 ATOM 2438 N N . GLU A 1 166 ? 20.714 33.972 53.076 1.00 24.16 ? 178 GLU A N 1 ATOM 2439 C CA . GLU A 1 166 ? 19.500 33.293 53.517 1.00 28.27 ? 178 GLU A CA 1 ATOM 2440 C C . GLU A 1 166 ? 18.253 34.132 53.271 1.00 21.79 ? 178 GLU A C 1 ATOM 2441 O O . GLU A 1 166 ? 17.208 33.600 52.908 1.00 25.86 ? 178 GLU A O 1 ATOM 2442 C CB . GLU A 1 166 ? 19.585 32.961 55.015 1.00 32.03 ? 178 GLU A CB 1 ATOM 2443 C CG . GLU A 1 166 ? 20.437 31.754 55.351 1.00 67.36 ? 178 GLU A CG 1 ATOM 2444 C CD . GLU A 1 166 ? 20.198 31.273 56.772 1.00 90.68 ? 178 GLU A CD 1 ATOM 2445 O OE1 . GLU A 1 166 ? 20.122 32.125 57.687 1.00 80.11 ? 178 GLU A OE1 1 ATOM 2446 O OE2 . GLU A 1 166 ? 20.064 30.045 56.967 1.00 102.29 ? 178 GLU A OE2 1 ATOM 2447 H H . GLU A 1 166 ? 21.283 34.124 53.702 1.00 28.99 ? 178 GLU A H 1 ATOM 2448 H HA . GLU A 1 166 ? 19.405 32.461 53.028 1.00 33.93 ? 178 GLU A HA 1 ATOM 2449 H HB2 . GLU A 1 166 ? 19.961 33.724 55.480 1.00 38.44 ? 178 GLU A HB2 1 ATOM 2450 H HB3 . GLU A 1 166 ? 18.689 32.788 55.345 1.00 38.44 ? 178 GLU A HB3 1 ATOM 2451 H HG2 . GLU A 1 166 ? 20.217 31.030 54.744 1.00 80.83 ? 178 GLU A HG2 1 ATOM 2452 H HG3 . GLU A 1 166 ? 21.374 31.991 55.264 1.00 80.83 ? 178 GLU A HG3 1 ATOM 2453 N N . GLU A 1 167 ? 18.325 35.423 53.551 1.00 23.41 ? 179 GLU A N 1 ATOM 2454 C CA . GLU A 1 167 ? 17.149 36.264 53.387 1.00 26.80 ? 179 GLU A CA 1 ATOM 2455 C C . GLU A 1 167 ? 16.738 36.355 51.918 1.00 26.82 ? 179 GLU A C 1 ATOM 2456 O O . GLU A 1 167 ? 15.546 36.270 51.593 1.00 26.89 ? 179 GLU A O 1 ATOM 2457 C CB . GLU A 1 167 ? 17.431 37.640 53.964 1.00 27.44 ? 179 GLU A CB 1 ATOM 2458 C CG . GLU A 1 167 ? 16.229 38.574 53.833 1.00 43.84 ? 179 GLU A CG 1 ATOM 2459 C CD . GLU A 1 167 ? 16.336 39.807 54.710 1.00 74.30 ? 179 GLU A CD 1 ATOM 2460 O OE1 . GLU A 1 167 ? 17.397 40.002 55.343 1.00 78.53 ? 179 GLU A OE1 1 ATOM 2461 O OE2 . GLU A 1 167 ? 15.352 40.576 54.769 1.00 92.14 ? 179 GLU A OE2 1 ATOM 2462 H H . GLU A 1 167 ? 19.028 35.832 53.832 1.00 28.09 ? 179 GLU A H 1 ATOM 2463 H HA . GLU A 1 167 ? 16.411 35.876 53.882 1.00 32.17 ? 179 GLU A HA 1 ATOM 2464 H HB2 . GLU A 1 167 ? 17.645 37.553 54.906 1.00 32.93 ? 179 GLU A HB2 1 ATOM 2465 H HB3 . GLU A 1 167 ? 18.177 38.038 53.487 1.00 32.93 ? 179 GLU A HB3 1 ATOM 2466 H HG2 . GLU A 1 167 ? 16.158 38.868 52.911 1.00 52.61 ? 179 GLU A HG2 1 ATOM 2467 H HG3 . GLU A 1 167 ? 15.427 38.093 54.090 1.00 52.61 ? 179 GLU A HG3 1 ATOM 2468 N N . ALA A 1 168 ? 17.714 36.504 51.020 1.00 24.99 ? 180 ALA A N 1 ATOM 2469 C CA . ALA A 1 168 ? 17.414 36.545 49.584 1.00 18.26 ? 180 ALA A CA 1 ATOM 2470 C C . ALA A 1 168 ? 16.788 35.247 49.117 1.00 26.83 ? 180 ALA A C 1 ATOM 2471 O O . ALA A 1 168 ? 15.821 35.244 48.339 1.00 24.18 ? 180 ALA A O 1 ATOM 2472 C CB . ALA A 1 168 ? 18.695 36.834 48.796 1.00 19.53 ? 180 ALA A CB 1 ATOM 2473 H H . ALA A 1 168 ? 18.548 36.584 51.212 1.00 29.98 ? 180 ALA A H 1 ATOM 2474 H HA . ALA A 1 168 ? 16.785 37.263 49.410 1.00 21.92 ? 180 ALA A HA 1 ATOM 2475 H HB1 . ALA A 1 168 ? 18.484 36.858 47.849 1.00 23.43 ? 180 ALA A HB1 1 ATOM 2476 H HB2 . ALA A 1 168 ? 19.052 37.691 49.077 1.00 23.43 ? 180 ALA A HB2 1 ATOM 2477 H HB3 . ALA A 1 168 ? 19.340 36.131 48.973 1.00 23.43 ? 180 ALA A HB3 1 ATOM 2478 N N . ILE A 1 169 ? 17.312 34.119 49.589 1.00 24.70 ? 181 ILE A N 1 ATOM 2479 C CA . ILE A 1 169 ? 16.735 32.841 49.208 1.00 28.37 ? 181 ILE A CA 1 ATOM 2480 C C . ILE A 1 169 ? 15.282 32.767 49.654 1.00 22.10 ? 181 ILE A C 1 ATOM 2481 O O . ILE A 1 169 ? 14.431 32.213 48.949 1.00 24.46 ? 181 ILE A O 1 ATOM 2482 C CB . ILE A 1 169 ? 17.580 31.690 49.796 1.00 30.70 ? 181 ILE A CB 1 ATOM 2483 C CG1 . ILE A 1 169 ? 18.970 31.683 49.165 1.00 30.61 ? 181 ILE A CG1 1 ATOM 2484 C CG2 . ILE A 1 169 ? 16.901 30.353 49.608 1.00 31.05 ? 181 ILE A CG2 1 ATOM 2485 C CD1 . ILE A 1 169 ? 18.989 31.539 47.644 1.00 41.90 ? 181 ILE A CD1 1 ATOM 2486 H H . ILE A 1 169 ? 17.987 34.069 50.119 1.00 29.64 ? 181 ILE A H 1 ATOM 2487 H HA . ILE A 1 169 ? 16.754 32.763 48.242 1.00 34.04 ? 181 ILE A HA 1 ATOM 2488 H HB . ILE A 1 169 ? 17.681 31.846 50.748 1.00 36.84 ? 181 ILE A HB 1 ATOM 2489 H HG12 . ILE A 1 169 ? 19.413 32.518 49.385 1.00 36.73 ? 181 ILE A HG12 1 ATOM 2490 H HG13 . ILE A 1 169 ? 19.473 30.941 49.536 1.00 36.73 ? 181 ILE A HG13 1 ATOM 2491 H HG21 . ILE A 1 169 ? 17.461 29.659 49.989 1.00 37.26 ? 181 ILE A HG21 1 ATOM 2492 H HG22 . ILE A 1 169 ? 16.042 30.370 50.058 1.00 37.26 ? 181 ILE A HG22 1 ATOM 2493 H HG23 . ILE A 1 169 ? 16.775 30.194 48.659 1.00 37.26 ? 181 ILE A HG23 1 ATOM 2494 H HD11 . ILE A 1 169 ? 19.910 31.544 47.338 1.00 50.28 ? 181 ILE A HD11 1 ATOM 2495 H HD12 . ILE A 1 169 ? 18.565 30.701 47.402 1.00 50.28 ? 181 ILE A HD12 1 ATOM 2496 H HD13 . ILE A 1 169 ? 18.505 32.281 47.251 1.00 50.28 ? 181 ILE A HD13 1 ATOM 2497 N N . SER A 1 170 ? 14.977 33.323 50.829 1.00 23.73 ? 182 SER A N 1 ATOM 2498 C CA A SER A 1 170 ? 13.629 33.212 51.364 0.45 26.79 ? 182 SER A CA 1 ATOM 2499 C CA B SER A 1 170 ? 13.625 33.208 51.366 0.55 26.77 ? 182 SER A CA 1 ATOM 2500 C C . SER A 1 170 ? 12.632 34.026 50.543 1.00 26.43 ? 182 SER A C 1 ATOM 2501 O O . SER A 1 170 ? 11.525 33.547 50.252 1.00 25.09 ? 182 SER A O 1 ATOM 2502 C CB A SER A 1 170 ? 13.625 33.650 52.828 0.45 28.60 ? 182 SER A CB 1 ATOM 2503 C CB B SER A 1 170 ? 13.592 33.617 52.849 0.55 28.57 ? 182 SER A CB 1 ATOM 2504 O OG A SER A 1 170 ? 12.314 33.696 53.334 0.45 31.83 ? 182 SER A OG 1 ATOM 2505 O OG B SER A 1 170 ? 13.700 35.018 53.062 0.55 31.98 ? 182 SER A OG 1 ATOM 2506 H H . SER A 1 170 ? 15.523 33.763 51.327 1.00 28.48 ? 182 SER A H 1 ATOM 2507 H HA . SER A 1 170 ? 13.352 32.281 51.322 1.00 32.12 ? 182 SER A HA 1 ATOM 2508 H HB2 A SER A 1 170 ? 14.142 33.016 53.349 0.45 34.32 ? 182 SER A HB2 1 ATOM 2509 H HB2 B SER A 1 170 ? 12.754 33.313 53.232 0.55 34.28 ? 182 SER A HB2 1 ATOM 2510 H HB3 A SER A 1 170 ? 14.020 34.534 52.894 0.45 34.32 ? 182 SER A HB3 1 ATOM 2511 H HB3 B SER A 1 170 ? 14.331 33.181 53.303 0.55 34.28 ? 182 SER A HB3 1 ATOM 2512 H HG A SER A 1 170 ? 11.959 32.936 53.283 0.45 38.20 ? 182 SER A HG 1 ATOM 2513 H HG B SER A 1 170 ? 14.425 35.301 52.745 0.55 38.37 ? 182 SER A HG 1 ATOM 2514 N N . THR A 1 171 ? 12.999 35.259 50.150 1.00 24.40 ? 183 THR A N 1 ATOM 2515 C CA . THR A 1 171 ? 12.061 36.061 49.340 1.00 22.59 ? 183 THR A CA 1 ATOM 2516 C C . THR A 1 171 ? 11.972 35.547 47.914 1.00 22.51 ? 183 THR A C 1 ATOM 2517 O O . THR A 1 171 ? 10.907 35.638 47.291 1.00 23.08 ? 183 THR A O 1 ATOM 2518 C CB . THR A 1 171 ? 12.449 37.543 49.358 1.00 23.33 ? 183 THR A CB 1 ATOM 2519 O OG1 . THR A 1 171 ? 13.751 37.717 48.800 1.00 21.65 ? 183 THR A OG1 1 ATOM 2520 C CG2 . THR A 1 171 ? 12.478 38.069 50.780 1.00 29.38 ? 183 THR A CG2 1 ATOM 2521 H H . THR A 1 171 ? 13.750 35.639 50.328 1.00 29.28 ? 183 THR A H 1 ATOM 2522 H HA . THR A 1 171 ? 11.176 35.987 49.732 1.00 27.11 ? 183 THR A HA 1 ATOM 2523 H HB . THR A 1 171 ? 11.803 38.057 48.849 1.00 28.00 ? 183 THR A HB 1 ATOM 2524 H HG1 . THR A 1 171 ? 13.762 37.443 48.006 1.00 25.98 ? 183 THR A HG1 1 ATOM 2525 H HG21 . THR A 1 171 ? 12.725 39.007 50.781 1.00 35.25 ? 183 THR A HG21 1 ATOM 2526 H HG22 . THR A 1 171 ? 11.603 37.973 51.188 1.00 35.25 ? 183 THR A HG22 1 ATOM 2527 H HG23 . THR A 1 171 ? 13.126 37.572 51.304 1.00 35.25 ? 183 THR A HG23 1 ATOM 2528 N N . LEU A 1 172 ? 13.074 34.997 47.381 1.00 22.37 ? 184 LEU A N 1 ATOM 2529 C CA . LEU A 1 172 ? 13.072 34.426 46.039 1.00 21.84 ? 184 LEU A CA 1 ATOM 2530 C C . LEU A 1 172 ? 12.141 33.227 45.958 1.00 28.35 ? 184 LEU A C 1 ATOM 2531 O O . LEU A 1 172 ? 11.367 33.086 45.004 1.00 22.56 ? 184 LEU A O 1 ATOM 2532 C CB . LEU A 1 172 ? 14.507 34.026 45.655 1.00 23.09 ? 184 LEU A CB 1 ATOM 2533 C CG . LEU A 1 172 ? 14.789 33.371 44.303 1.00 27.54 ? 184 LEU A CG 1 ATOM 2534 C CD1 . LEU A 1 172 ? 14.323 34.264 43.162 1.00 23.29 ? 184 LEU A CD1 1 ATOM 2535 C CD2 . LEU A 1 172 ? 16.283 33.084 44.161 1.00 24.93 ? 184 LEU A CD2 1 ATOM 2536 H H . LEU A 1 172 ? 13.833 34.946 47.782 1.00 26.84 ? 184 LEU A H 1 ATOM 2537 H HA . LEU A 1 172 ? 12.763 35.094 45.407 1.00 26.20 ? 184 LEU A HA 1 ATOM 2538 H HB2 . LEU A 1 172 ? 15.050 34.830 45.688 1.00 27.70 ? 184 LEU A HB2 1 ATOM 2539 H HB3 . LEU A 1 172 ? 14.827 33.408 46.331 1.00 27.70 ? 184 LEU A HB3 1 ATOM 2540 H HG . LEU A 1 172 ? 14.309 32.530 44.248 1.00 33.04 ? 184 LEU A HG 1 ATOM 2541 H HD11 . LEU A 1 172 ? 14.514 33.823 42.319 1.00 27.95 ? 184 LEU A HD11 1 ATOM 2542 H HD12 . LEU A 1 172 ? 13.369 34.414 43.248 1.00 27.95 ? 184 LEU A HD12 1 ATOM 2543 H HD13 . LEU A 1 172 ? 14.797 35.109 43.209 1.00 27.95 ? 184 LEU A HD13 1 ATOM 2544 H HD21 . LEU A 1 172 ? 16.444 32.668 43.299 1.00 29.92 ? 184 LEU A HD21 1 ATOM 2545 H HD22 . LEU A 1 172 ? 16.773 33.919 44.223 1.00 29.92 ? 184 LEU A HD22 1 ATOM 2546 H HD23 . LEU A 1 172 ? 16.559 32.485 44.873 1.00 29.92 ? 184 LEU A HD23 1 ATOM 2547 N N . LYS A 1 173 ? 12.198 32.351 46.962 1.00 28.39 ? 185 LYS A N 1 ATOM 2548 C CA . LYS A 1 173 ? 11.346 31.175 46.978 1.00 27.44 ? 185 LYS A CA 1 ATOM 2549 C C . LYS A 1 173 ? 9.867 31.555 47.033 1.00 23.61 ? 185 LYS A C 1 ATOM 2550 O O . LYS A 1 173 ? 9.035 30.887 46.409 1.00 27.30 ? 185 LYS A O 1 ATOM 2551 C CB . LYS A 1 173 ? 11.750 30.283 48.176 1.00 31.34 ? 185 LYS A CB 1 ATOM 2552 C CG . LYS A 1 173 ? 11.005 28.988 48.260 1.00 42.91 ? 185 LYS A CG 1 ATOM 2553 C CD . LYS A 1 173 ? 11.641 28.037 49.293 1.00 54.30 ? 185 LYS A CD 1 ATOM 2554 C CE . LYS A 1 173 ? 10.936 26.673 49.271 1.00 55.93 ? 185 LYS A CE 1 ATOM 2555 N NZ . LYS A 1 173 ? 11.663 25.628 50.029 1.00 79.89 ? 185 LYS A NZ 1 ATOM 2556 H H . LYS A 1 173 ? 12.722 32.418 47.641 1.00 34.07 ? 185 LYS A H 1 ATOM 2557 H HA . LYS A 1 173 ? 11.493 30.668 46.164 1.00 32.93 ? 185 LYS A HA 1 ATOM 2558 H HB2 . LYS A 1 173 ? 12.695 30.076 48.104 1.00 37.61 ? 185 LYS A HB2 1 ATOM 2559 H HB3 . LYS A 1 173 ? 11.584 30.772 48.997 1.00 37.61 ? 185 LYS A HB3 1 ATOM 2560 H HG2 . LYS A 1 173 ? 10.089 29.162 48.530 1.00 51.50 ? 185 LYS A HG2 1 ATOM 2561 H HG3 . LYS A 1 173 ? 11.022 28.552 47.394 1.00 51.50 ? 185 LYS A HG3 1 ATOM 2562 H HD2 . LYS A 1 173 ? 12.577 27.903 49.076 1.00 65.16 ? 185 LYS A HD2 1 ATOM 2563 H HD3 . LYS A 1 173 ? 11.549 28.416 50.181 1.00 65.16 ? 185 LYS A HD3 1 ATOM 2564 H HE2 . LYS A 1 173 ? 10.054 26.768 49.664 1.00 67.12 ? 185 LYS A HE2 1 ATOM 2565 H HE3 . LYS A 1 173 ? 10.857 26.374 48.351 1.00 67.12 ? 185 LYS A HE3 1 ATOM 2566 H HZ1 . LYS A 1 173 ? 11.219 24.858 49.987 1.00 95.87 ? 185 LYS A HZ1 1 ATOM 2567 H HZ2 . LYS A 1 173 ? 12.475 25.512 49.684 1.00 95.87 ? 185 LYS A HZ2 1 ATOM 2568 H HZ3 . LYS A 1 173 ? 11.743 25.871 50.881 1.00 95.87 ? 185 LYS A HZ3 1 ATOM 2569 N N . LYS A 1 174 ? 9.539 32.647 47.709 1.00 26.47 ? 186 LYS A N 1 ATOM 2570 C CA . LYS A 1 174 ? 8.164 33.063 47.939 1.00 27.37 ? 186 LYS A CA 1 ATOM 2571 C C . LYS A 1 174 ? 7.584 33.886 46.792 1.00 32.78 ? 186 LYS A C 1 ATOM 2572 O O . LYS A 1 174 ? 6.400 33.758 46.491 1.00 29.95 ? 186 LYS A O 1 ATOM 2573 C CB . LYS A 1 174 ? 8.089 33.880 49.227 1.00 31.83 ? 186 LYS A CB 1 ATOM 2574 C CG . LYS A 1 174 ? 6.739 33.888 49.902 1.00 48.80 ? 186 LYS A CG 1 ATOM 2575 C CD . LYS A 1 174 ? 6.773 34.708 51.196 1.00 47.14 ? 186 LYS A CD 1 ATOM 2576 C CE . LYS A 1 174 ? 5.368 34.833 51.810 1.00 72.15 ? 186 LYS A CE 1 ATOM 2577 N NZ . LYS A 1 174 ? 5.221 35.997 52.738 1.00 69.12 ? 186 LYS A NZ 1 ATOM 2578 H H . LYS A 1 174 ? 10.117 33.182 48.055 1.00 31.77 ? 186 LYS A H 1 ATOM 2579 H HA . LYS A 1 174 ? 7.610 32.274 48.052 1.00 32.85 ? 186 LYS A HA 1 ATOM 2580 H HB2 . LYS A 1 174 ? 8.729 33.518 49.860 1.00 38.20 ? 186 LYS A HB2 1 ATOM 2581 H HB3 . LYS A 1 174 ? 8.319 34.800 49.023 1.00 38.20 ? 186 LYS A HB3 1 ATOM 2582 H HG2 . LYS A 1 174 ? 6.084 34.286 49.307 1.00 58.56 ? 186 LYS A HG2 1 ATOM 2583 H HG3 . LYS A 1 174 ? 6.485 32.979 50.124 1.00 58.56 ? 186 LYS A HG3 1 ATOM 2584 H HD2 . LYS A 1 174 ? 7.350 34.268 51.840 1.00 56.57 ? 186 LYS A HD2 1 ATOM 2585 H HD3 . LYS A 1 174 ? 7.102 35.600 51.003 1.00 56.57 ? 186 LYS A HD3 1 ATOM 2586 H HE2 . LYS A 1 174 ? 4.722 34.940 51.094 1.00 86.58 ? 186 LYS A HE2 1 ATOM 2587 H HE3 . LYS A 1 174 ? 5.172 34.026 52.312 1.00 86.58 ? 186 LYS A HE3 1 ATOM 2588 H HZ1 . LYS A 1 174 ? 4.394 36.023 53.064 1.00 82.95 ? 186 LYS A HZ1 1 ATOM 2589 H HZ2 . LYS A 1 174 ? 5.796 35.921 53.413 1.00 82.95 ? 186 LYS A HZ2 1 ATOM 2590 H HZ3 . LYS A 1 174 ? 5.385 36.755 52.302 1.00 82.95 ? 186 LYS A HZ3 1 ATOM 2591 N N . GLY A 1 175 ? 8.380 34.734 46.136 1.00 25.68 ? 187 GLY A N 1 ATOM 2592 C CA . GLY A 1 175 ? 7.807 35.639 45.144 1.00 23.64 ? 187 GLY A CA 1 ATOM 2593 C C . GLY A 1 175 ? 8.667 35.920 43.922 1.00 26.58 ? 187 GLY A C 1 ATOM 2594 O O . GLY A 1 175 ? 8.244 36.673 43.036 1.00 23.51 ? 187 GLY A O 1 ATOM 2595 H H . GLY A 1 175 ? 9.230 34.804 46.244 1.00 30.82 ? 187 GLY A H 1 ATOM 2596 H HA2 . GLY A 1 175 ? 6.966 35.267 44.833 1.00 28.37 ? 187 GLY A HA2 1 ATOM 2597 H HA3 . GLY A 1 175 ? 7.615 36.488 45.572 1.00 28.37 ? 187 GLY A HA3 1 ATOM 2598 N N . GLY A 1 176 ? 9.861 35.330 43.835 1.00 22.34 ? 188 GLY A N 1 ATOM 2599 C CA . GLY A 1 176 ? 10.692 35.532 42.662 1.00 20.42 ? 188 GLY A CA 1 ATOM 2600 C C . GLY A 1 176 ? 11.543 36.789 42.658 1.00 19.66 ? 188 GLY A C 1 ATOM 2601 O O . GLY A 1 176 ? 12.028 37.192 41.587 1.00 20.89 ? 188 GLY A O 1 ATOM 2602 H H . GLY A 1 176 ? 10.203 34.817 44.434 1.00 26.81 ? 188 GLY A H 1 ATOM 2603 H HA2 . GLY A 1 176 ? 11.288 34.773 42.568 1.00 24.50 ? 188 GLY A HA2 1 ATOM 2604 H HA3 . GLY A 1 176 ? 10.122 35.560 41.878 1.00 24.50 ? 188 GLY A HA3 1 ATOM 2605 N N . PHE A 1 177 ? 11.760 37.414 43.812 1.00 19.52 ? 189 PHE A N 1 ATOM 2606 C CA . PHE A 1 177 ? 12.538 38.637 43.930 1.00 19.63 ? 189 PHE A CA 1 ATOM 2607 C C . PHE A 1 177 ? 13.384 38.576 45.200 1.00 22.36 ? 189 PHE A C 1 ATOM 2608 O O . PHE A 1 177 ? 13.123 37.765 46.093 1.00 21.42 ? 189 PHE A O 1 ATOM 2609 C CB . PHE A 1 177 ? 11.618 39.866 43.925 1.00 17.29 ? 189 PHE A CB 1 ATOM 2610 C CG . PHE A 1 177 ? 10.567 39.884 45.025 1.00 19.16 ? 189 PHE A CG 1 ATOM 2611 C CD1 . PHE A 1 177 ? 10.876 40.336 46.286 1.00 22.35 ? 189 PHE A CD1 1 ATOM 2612 C CD2 . PHE A 1 177 ? 9.250 39.504 44.754 1.00 23.33 ? 189 PHE A CD2 1 ATOM 2613 C CE1 . PHE A 1 177 ? 9.891 40.390 47.289 1.00 20.91 ? 189 PHE A CE1 1 ATOM 2614 C CE2 . PHE A 1 177 ? 8.268 39.558 45.745 1.00 23.76 ? 189 PHE A CE2 1 ATOM 2615 C CZ . PHE A 1 177 ? 8.599 40.001 47.011 1.00 24.25 ? 189 PHE A CZ 1 ATOM 2616 H H . PHE A 1 177 ? 11.453 37.135 44.566 1.00 23.42 ? 189 PHE A H 1 ATOM 2617 H HA . PHE A 1 177 ? 13.138 38.706 43.171 1.00 23.56 ? 189 PHE A HA 1 ATOM 2618 H HB2 . PHE A 1 177 ? 12.164 40.661 44.029 1.00 20.75 ? 189 PHE A HB2 1 ATOM 2619 H HB3 . PHE A 1 177 ? 11.153 39.900 43.075 1.00 20.75 ? 189 PHE A HB3 1 ATOM 2620 H HD1 . PHE A 1 177 ? 11.745 40.604 46.479 1.00 26.81 ? 189 PHE A HD1 1 ATOM 2621 H HD2 . PHE A 1 177 ? 9.024 39.211 43.901 1.00 28.00 ? 189 PHE A HD2 1 ATOM 2622 H HE1 . PHE A 1 177 ? 10.113 40.686 48.143 1.00 25.09 ? 189 PHE A HE1 1 ATOM 2623 H HE2 . PHE A 1 177 ? 7.397 39.291 45.556 1.00 28.51 ? 189 PHE A HE2 1 ATOM 2624 H HZ . PHE A 1 177 ? 7.951 40.029 47.677 1.00 29.10 ? 189 PHE A HZ 1 ATOM 2625 N N . TYR A 1 178 ? 14.409 39.427 45.272 1.00 18.85 ? 190 TYR A N 1 ATOM 2626 C CA . TYR A 1 178 ? 15.309 39.464 46.428 1.00 19.85 ? 190 TYR A CA 1 ATOM 2627 C C . TYR A 1 178 ? 16.168 40.720 46.357 1.00 22.74 ? 190 TYR A C 1 ATOM 2628 O O . TYR A 1 178 ? 16.251 41.375 45.322 1.00 18.48 ? 190 TYR A O 1 ATOM 2629 C CB . TYR A 1 178 ? 16.209 38.228 46.483 1.00 21.18 ? 190 TYR A CB 1 ATOM 2630 C CG . TYR A 1 178 ? 17.187 38.162 45.342 1.00 18.15 ? 190 TYR A CG 1 ATOM 2631 C CD1 . TYR A 1 178 ? 18.401 38.825 45.407 1.00 19.78 ? 190 TYR A CD1 1 ATOM 2632 C CD2 . TYR A 1 178 ? 16.870 37.492 44.173 1.00 19.59 ? 190 TYR A CD2 1 ATOM 2633 C CE1 . TYR A 1 178 ? 19.276 38.812 44.347 1.00 19.37 ? 190 TYR A CE1 1 ATOM 2634 C CE2 . TYR A 1 178 ? 17.778 37.464 43.091 1.00 18.81 ? 190 TYR A CE2 1 ATOM 2635 C CZ . TYR A 1 178 ? 18.969 38.116 43.215 1.00 18.35 ? 190 TYR A CZ 1 ATOM 2636 O OH . TYR A 1 178 ? 19.838 38.102 42.167 1.00 20.09 ? 190 TYR A OH 1 ATOM 2637 H H . TYR A 1 178 ? 14.607 39.998 44.659 1.00 22.62 ? 190 TYR A H 1 ATOM 2638 H HA . TYR A 1 178 ? 14.784 39.498 47.243 1.00 23.82 ? 190 TYR A HA 1 ATOM 2639 H HB2 . TYR A 1 178 ? 16.714 38.243 47.310 1.00 25.41 ? 190 TYR A HB2 1 ATOM 2640 H HB3 . TYR A 1 178 ? 15.654 37.433 46.448 1.00 25.41 ? 190 TYR A HB3 1 ATOM 2641 H HD1 . TYR A 1 178 ? 18.623 39.297 46.177 1.00 23.73 ? 190 TYR A HD1 1 ATOM 2642 H HD2 . TYR A 1 178 ? 16.058 37.045 44.104 1.00 23.51 ? 190 TYR A HD2 1 ATOM 2643 H HE1 . TYR A 1 178 ? 20.093 39.250 44.416 1.00 23.25 ? 190 TYR A HE1 1 ATOM 2644 H HE2 . TYR A 1 178 ? 17.570 37.003 42.311 1.00 22.58 ? 190 TYR A HE2 1 ATOM 2645 H HH . TYR A 1 178 ? 19.525 37.639 41.540 1.00 24.10 ? 190 TYR A HH 1 ATOM 2646 N N . SER A 1 179 ? 16.796 41.061 47.481 1.00 18.03 ? 191 SER A N 1 ATOM 2647 C CA . SER A 1 179 ? 17.904 41.995 47.486 1.00 19.45 ? 191 SER A CA 1 ATOM 2648 C C . SER A 1 179 ? 19.079 41.291 48.159 1.00 20.94 ? 191 SER A C 1 ATOM 2649 O O . SER A 1 179 ? 18.895 40.331 48.913 1.00 21.31 ? 191 SER A O 1 ATOM 2650 C CB . SER A 1 179 ? 17.578 43.329 48.191 1.00 23.87 ? 191 SER A CB 1 ATOM 2651 O OG . SER A 1 179 ? 17.673 43.254 49.607 1.00 24.47 ? 191 SER A OG 1 ATOM 2652 H H . SER A 1 179 ? 16.592 40.758 48.260 1.00 21.64 ? 191 SER A H 1 ATOM 2653 H HA . SER A 1 179 ? 18.156 42.193 46.570 1.00 23.35 ? 191 SER A HA 1 ATOM 2654 H HB2 . SER A 1 179 ? 18.199 44.004 47.876 1.00 28.64 ? 191 SER A HB2 1 ATOM 2655 H HB3 . SER A 1 179 ? 16.673 43.588 47.957 1.00 28.64 ? 191 SER A HB3 1 ATOM 2656 H HG . SER A 1 179 ? 17.136 42.680 49.901 1.00 29.37 ? 191 SER A HG 1 ATOM 2657 N N . GLN A 1 180 ? 20.283 41.732 47.823 1.00 20.22 ? 192 GLN A N 1 ATOM 2658 C CA . GLN A 1 180 ? 21.496 41.043 48.268 1.00 20.51 ? 192 GLN A CA 1 ATOM 2659 C C . GLN A 1 180 ? 22.653 42.026 48.302 1.00 23.83 ? 192 GLN A C 1 ATOM 2660 O O . GLN A 1 180 ? 22.946 42.694 47.311 1.00 21.22 ? 192 GLN A O 1 ATOM 2661 C CB . GLN A 1 180 ? 21.816 39.859 47.362 1.00 21.25 ? 192 GLN A CB 1 ATOM 2662 C CG . GLN A 1 180 ? 23.126 39.097 47.705 1.00 22.65 ? 192 GLN A CG 1 ATOM 2663 C CD . GLN A 1 180 ? 23.093 38.477 49.094 1.00 23.57 ? 192 GLN A CD 1 ATOM 2664 O OE1 . GLN A 1 180 ? 22.153 37.779 49.454 1.00 21.35 ? 192 GLN A OE1 1 ATOM 2665 N NE2 . GLN A 1 180 ? 24.124 38.757 49.890 1.00 28.64 ? 192 GLN A NE2 1 ATOM 2666 H H . GLN A 1 180 ? 20.430 42.427 47.337 1.00 24.26 ? 192 GLN A H 1 ATOM 2667 H HA . GLN A 1 180 ? 21.358 40.707 49.168 1.00 24.61 ? 192 GLN A HA 1 ATOM 2668 H HB2 . GLN A 1 180 ? 21.085 39.224 47.417 1.00 25.50 ? 192 GLN A HB2 1 ATOM 2669 H HB3 . GLN A 1 180 ? 21.897 40.183 46.451 1.00 25.50 ? 192 GLN A HB3 1 ATOM 2670 H HG2 . GLN A 1 180 ? 23.254 38.383 47.061 1.00 27.18 ? 192 GLN A HG2 1 ATOM 2671 H HG3 . GLN A 1 180 ? 23.871 39.716 47.669 1.00 27.18 ? 192 GLN A HG3 1 ATOM 2672 H HE21 . GLN A 1 180 ? 24.759 39.263 49.609 1.00 34.37 ? 192 GLN A HE21 1 ATOM 2673 H HE22 . GLN A 1 180 ? 24.153 38.431 50.685 1.00 34.37 ? 192 GLN A HE22 1 ATOM 2674 N N . LYS A 1 181 ? 23.301 42.131 49.450 1.00 25.11 ? 193 LYS A N 1 ATOM 2675 C CA . LYS A 1 181 ? 24.562 42.866 49.512 1.00 21.92 ? 193 LYS A CA 1 ATOM 2676 C C . LYS A 1 181 ? 25.634 42.221 48.632 1.00 24.86 ? 193 LYS A C 1 ATOM 2677 O O . LYS A 1 181 ? 25.748 40.991 48.538 1.00 24.29 ? 193 LYS A O 1 ATOM 2678 C CB . LYS A 1 181 ? 25.049 42.925 50.962 1.00 27.46 ? 193 LYS A CB 1 ATOM 2679 C CG . LYS A 1 181 ? 24.222 43.855 51.832 1.00 28.51 ? 193 LYS A CG 1 ATOM 2680 C CD . LYS A 1 181 ? 24.733 43.883 53.278 1.00 37.22 ? 193 LYS A CD 1 ATOM 2681 C CE . LYS A 1 181 ? 24.415 42.592 54.007 1.00 57.50 ? 193 LYS A CE 1 ATOM 2682 N NZ . LYS A 1 181 ? 24.631 42.724 55.482 1.00 82.83 ? 193 LYS A NZ 1 ATOM 2683 H H . LYS A 1 181 ? 23.042 41.793 50.198 1.00 30.13 ? 193 LYS A H 1 ATOM 2684 H HA . LYS A 1 181 ? 24.419 43.774 49.201 1.00 26.31 ? 193 LYS A HA 1 ATOM 2685 H HB2 . LYS A 1 181 ? 25.001 42.036 51.346 1.00 32.95 ? 193 LYS A HB2 1 ATOM 2686 H HB3 . LYS A 1 181 ? 25.966 43.242 50.974 1.00 32.95 ? 193 LYS A HB3 1 ATOM 2687 H HG2 . LYS A 1 181 ? 24.272 44.756 51.475 1.00 34.21 ? 193 LYS A HG2 1 ATOM 2688 H HG3 . LYS A 1 181 ? 23.301 43.550 51.842 1.00 34.21 ? 193 LYS A HG3 1 ATOM 2689 H HD2 . LYS A 1 181 ? 25.696 44.000 53.275 1.00 44.67 ? 193 LYS A HD2 1 ATOM 2690 H HD3 . LYS A 1 181 ? 24.308 44.613 53.754 1.00 44.67 ? 193 LYS A HD3 1 ATOM 2691 H HE2 . LYS A 1 181 ? 23.485 42.360 53.857 1.00 69.00 ? 193 LYS A HE2 1 ATOM 2692 H HE3 . LYS A 1 181 ? 24.994 41.887 53.677 1.00 69.00 ? 193 LYS A HE3 1 ATOM 2693 H HZ1 . LYS A 1 181 ? 24.438 41.955 55.887 1.00 99.40 ? 193 LYS A HZ1 1 ATOM 2694 H HZ2 . LYS A 1 181 ? 25.480 42.933 55.647 1.00 99.40 ? 193 LYS A HZ2 1 ATOM 2695 H HZ3 . LYS A 1 181 ? 24.107 43.363 55.810 1.00 99.40 ? 193 LYS A HZ3 1 ATOM 2696 N N . VAL A 1 182 ? 26.436 43.056 47.987 1.00 23.61 ? 194 VAL A N 1 ATOM 2697 C CA . VAL A 1 182 ? 27.493 42.577 47.112 1.00 22.53 ? 194 VAL A CA 1 ATOM 2698 C C . VAL A 1 182 ? 28.746 42.336 47.955 1.00 22.48 ? 194 VAL A C 1 ATOM 2699 O O . VAL A 1 182 ? 29.323 43.283 48.501 1.00 23.13 ? 194 VAL A O 1 ATOM 2700 C CB . VAL A 1 182 ? 27.775 43.568 45.981 1.00 21.38 ? 194 VAL A CB 1 ATOM 2701 C CG1 . VAL A 1 182 ? 28.839 43.024 45.049 1.00 22.13 ? 194 VAL A CG1 1 ATOM 2702 C CG2 . VAL A 1 182 ? 26.473 43.868 45.160 1.00 21.90 ? 194 VAL A CG2 1 ATOM 2703 H H . VAL A 1 182 ? 26.388 43.913 48.040 1.00 28.34 ? 194 VAL A H 1 ATOM 2704 H HA . VAL A 1 182 ? 27.225 41.733 46.717 1.00 27.03 ? 194 VAL A HA 1 ATOM 2705 H HB . VAL A 1 182 ? 28.097 44.402 46.357 1.00 25.65 ? 194 VAL A HB 1 ATOM 2706 H HG11 . VAL A 1 182 ? 28.999 43.669 44.342 1.00 26.56 ? 194 VAL A HG11 1 ATOM 2707 H HG12 . VAL A 1 182 ? 29.654 42.876 45.553 1.00 26.56 ? 194 VAL A HG12 1 ATOM 2708 H HG13 . VAL A 1 182 ? 28.528 42.187 44.669 1.00 26.56 ? 194 VAL A HG13 1 ATOM 2709 H HG21 . VAL A 1 182 ? 26.683 44.497 44.453 1.00 26.27 ? 194 VAL A HG21 1 ATOM 2710 H HG22 . VAL A 1 182 ? 26.143 43.039 44.779 1.00 26.27 ? 194 VAL A HG22 1 ATOM 2711 H HG23 . VAL A 1 182 ? 25.806 44.247 45.754 1.00 26.27 ? 194 VAL A HG23 1 ATOM 2712 N N . ALA A 1 183 ? 29.173 41.074 48.028 1.00 26.59 ? 195 ALA A N 1 ATOM 2713 C CA . ALA A 1 183 ? 30.267 40.697 48.926 1.00 29.14 ? 195 ALA A CA 1 ATOM 2714 C C . ALA A 1 183 ? 31.500 41.549 48.671 1.00 27.69 ? 195 ALA A C 1 ATOM 2715 O O . ALA A 1 183 ? 32.113 42.078 49.607 1.00 31.23 ? 195 ALA A O 1 ATOM 2716 C CB . ALA A 1 183 ? 30.598 39.212 48.750 1.00 29.91 ? 195 ALA A CB 1 ATOM 2717 H H . ALA A 1 183 ? 28.849 40.421 47.571 1.00 31.91 ? 195 ALA A H 1 ATOM 2718 H HA . ALA A 1 183 ? 29.988 40.837 49.844 1.00 34.97 ? 195 ALA A HA 1 ATOM 2719 H HB1 . ALA A 1 183 ? 31.323 38.978 49.350 1.00 35.89 ? 195 ALA A HB1 1 ATOM 2720 H HB2 . ALA A 1 183 ? 29.811 38.687 48.960 1.00 35.89 ? 195 ALA A HB2 1 ATOM 2721 H HB3 . ALA A 1 183 ? 30.865 39.056 47.830 1.00 35.89 ? 195 ALA A HB3 1 ATOM 2722 N N . SER A 1 184 ? 31.876 41.687 47.399 1.00 25.61 ? 196 SER A N 1 ATOM 2723 C CA . SER A 1 184 ? 33.101 42.346 46.990 1.00 25.95 ? 196 SER A CA 1 ATOM 2724 C C . SER A 1 184 ? 32.987 43.862 46.980 1.00 28.71 ? 196 SER A C 1 ATOM 2725 O O . SER A 1 184 ? 33.986 44.530 46.712 1.00 26.73 ? 196 SER A O 1 ATOM 2726 C CB . SER A 1 184 ? 33.504 41.846 45.593 1.00 28.88 ? 196 SER A CB 1 ATOM 2727 O OG . SER A 1 184 ? 32.449 42.090 44.645 1.00 32.26 ? 196 SER A OG 1 ATOM 2728 H H . SER A 1 184 ? 31.415 41.392 46.736 1.00 30.73 ? 196 SER A H 1 ATOM 2729 H HA . SER A 1 184 ? 33.808 42.105 47.609 1.00 31.14 ? 196 SER A HA 1 ATOM 2730 H HB2 . SER A 1 184 ? 34.302 42.316 45.307 1.00 34.65 ? 196 SER A HB2 1 ATOM 2731 H HB3 . SER A 1 184 ? 33.677 40.892 45.636 1.00 34.65 ? 196 SER A HB3 1 ATOM 2732 H HG . SER A 1 184 ? 31.751 41.689 44.882 1.00 38.71 ? 196 SER A HG 1 ATOM 2733 N N . ASN A 1 185 ? 31.819 44.429 47.271 1.00 22.14 ? 197 ASN A N 1 ATOM 2734 C CA . ASN A 1 185 ? 31.595 45.877 47.153 1.00 23.91 ? 197 ASN A CA 1 ATOM 2735 C C . ASN A 1 185 ? 30.757 46.372 48.325 1.00 30.08 ? 197 ASN A C 1 ATOM 2736 O O . ASN A 1 185 ? 29.549 46.638 48.195 1.00 25.60 ? 197 ASN A O 1 ATOM 2737 C CB . ASN A 1 185 ? 30.906 46.226 45.831 1.00 25.04 ? 197 ASN A CB 1 ATOM 2738 C CG . ASN A 1 185 ? 31.815 46.084 44.637 1.00 21.14 ? 197 ASN A CG 1 ATOM 2739 O OD1 . ASN A 1 185 ? 32.536 47.011 44.265 1.00 23.45 ? 197 ASN A OD1 1 ATOM 2740 N ND2 . ASN A 1 185 ? 31.783 44.921 44.022 1.00 27.40 ? 197 ASN A ND2 1 ATOM 2741 H H . ASN A 1 185 ? 31.129 43.995 47.544 1.00 26.57 ? 197 ASN A H 1 ATOM 2742 H HA . ASN A 1 185 ? 32.450 46.334 47.178 1.00 28.69 ? 197 ASN A HA 1 ATOM 2743 H HB2 . ASN A 1 185 ? 30.149 45.633 45.703 1.00 30.05 ? 197 ASN A HB2 1 ATOM 2744 H HB3 . ASN A 1 185 ? 30.603 47.147 45.867 1.00 30.05 ? 197 ASN A HB3 1 ATOM 2745 H HD21 . ASN A 1 185 ? 32.281 44.784 43.335 1.00 32.89 ? 197 ASN A HD21 1 ATOM 2746 H HD22 . ASN A 1 185 ? 31.264 44.298 44.308 1.00 32.89 ? 197 ASN A HD22 1 ATOM 2747 N N . PRO A 1 186 ? 31.372 46.511 49.499 1.00 29.89 ? 198 PRO A N 1 ATOM 2748 C CA . PRO A 1 186 ? 30.634 47.000 50.671 1.00 28.36 ? 198 PRO A CA 1 ATOM 2749 C C . PRO A 1 186 ? 29.975 48.349 50.408 1.00 23.03 ? 198 PRO A C 1 ATOM 2750 O O . PRO A 1 186 ? 30.587 49.270 49.870 1.00 27.04 ? 198 PRO A O 1 ATOM 2751 C CB . PRO A 1 186 ? 31.722 47.097 51.756 1.00 32.89 ? 198 PRO A CB 1 ATOM 2752 C CG . PRO A 1 186 ? 32.791 46.157 51.311 1.00 33.82 ? 198 PRO A CG 1 ATOM 2753 C CD . PRO A 1 186 ? 32.788 46.228 49.812 1.00 35.36 ? 198 PRO A CD 1 ATOM 2754 H HA . PRO A 1 186 ? 29.961 46.356 50.942 1.00 34.04 ? 198 PRO A HA 1 ATOM 2755 H HB2 . PRO A 1 186 ? 32.059 48.005 51.801 1.00 39.46 ? 198 PRO A HB2 1 ATOM 2756 H HB3 . PRO A 1 186 ? 31.357 46.822 52.611 1.00 39.46 ? 198 PRO A HB3 1 ATOM 2757 H HG2 . PRO A 1 186 ? 33.646 46.446 51.666 1.00 40.58 ? 198 PRO A HG2 1 ATOM 2758 H HG3 . PRO A 1 186 ? 32.581 45.259 51.612 1.00 40.58 ? 198 PRO A HG3 1 ATOM 2759 H HD2 . PRO A 1 186 ? 33.355 46.952 49.505 1.00 42.43 ? 198 PRO A HD2 1 ATOM 2760 H HD3 . PRO A 1 186 ? 33.056 45.377 49.432 1.00 42.43 ? 198 PRO A HD3 1 ATOM 2761 N N . GLY A 1 187 ? 28.718 48.468 50.825 1.00 25.16 ? 199 GLY A N 1 ATOM 2762 C CA . GLY A 1 187 ? 27.935 49.661 50.575 1.00 28.78 ? 199 GLY A CA 1 ATOM 2763 C C . GLY A 1 187 ? 27.039 49.570 49.345 1.00 24.97 ? 199 GLY A C 1 ATOM 2764 O O . GLY A 1 187 ? 26.252 50.506 49.107 1.00 21.54 ? 199 GLY A O 1 ATOM 2765 H H . GLY A 1 187 ? 28.295 47.859 51.261 1.00 30.19 ? 199 GLY A H 1 ATOM 2766 H HA2 . GLY A 1 187 ? 27.373 49.840 51.345 1.00 34.54 ? 199 GLY A HA2 1 ATOM 2767 H HA3 . GLY A 1 187 ? 28.534 50.415 50.457 1.00 34.54 ? 199 GLY A HA3 1 ATOM 2768 N N . LEU A 1 188 ? 27.147 48.493 48.566 1.00 22.50 ? 200 LEU A N 1 ATOM 2769 C CA . LEU A 1 188 ? 26.331 48.265 47.362 1.00 21.09 ? 200 LEU A CA 1 ATOM 2770 C C . LEU A 1 188 ? 25.358 47.125 47.608 1.00 21.46 ? 200 LEU A C 1 ATOM 2771 O O . LEU A 1 188 ? 25.741 46.066 48.119 1.00 21.37 ? 200 LEU A O 1 ATOM 2772 C CB . LEU A 1 188 ? 27.203 47.938 46.146 1.00 20.92 ? 200 LEU A CB 1 ATOM 2773 C CG . LEU A 1 188 ? 26.465 47.644 44.827 1.00 19.09 ? 200 LEU A CG 1 ATOM 2774 C CD1 . LEU A 1 188 ? 25.716 48.910 44.390 1.00 19.67 ? 200 LEU A CD1 1 ATOM 2775 C CD2 . LEU A 1 188 ? 27.474 47.177 43.764 1.00 21.57 ? 200 LEU A CD2 1 ATOM 2776 H H . LEU A 1 188 ? 27.705 47.856 48.717 1.00 27.00 ? 200 LEU A H 1 ATOM 2777 H HA . LEU A 1 188 ? 25.820 49.065 47.165 1.00 25.31 ? 200 LEU A HA 1 ATOM 2778 H HB2 . LEU A 1 188 ? 27.792 48.692 45.984 1.00 25.10 ? 200 LEU A HB2 1 ATOM 2779 H HB3 . LEU A 1 188 ? 27.736 47.155 46.357 1.00 25.10 ? 200 LEU A HB3 1 ATOM 2780 H HG . LEU A 1 188 ? 25.817 46.937 44.969 1.00 22.91 ? 200 LEU A HG 1 ATOM 2781 H HD11 . LEU A 1 188 ? 25.250 48.729 43.559 1.00 23.60 ? 200 LEU A HD11 1 ATOM 2782 H HD12 . LEU A 1 188 ? 25.081 49.154 45.081 1.00 23.60 ? 200 LEU A HD12 1 ATOM 2783 H HD13 . LEU A 1 188 ? 26.357 49.626 44.261 1.00 23.60 ? 200 LEU A HD13 1 ATOM 2784 H HD21 . LEU A 1 188 ? 27.000 46.995 42.937 1.00 25.89 ? 200 LEU A HD21 1 ATOM 2785 H HD22 . LEU A 1 188 ? 28.130 47.878 43.622 1.00 25.89 ? 200 LEU A HD22 1 ATOM 2786 H HD23 . LEU A 1 188 ? 27.913 46.372 44.078 1.00 25.89 ? 200 LEU A HD23 1 ATOM 2787 N N . ARG A 1 189 ? 24.097 47.337 47.237 1.00 19.88 ? 201 ARG A N 1 ATOM 2788 C CA . ARG A 1 189 ? 23.073 46.309 47.320 1.00 16.31 ? 201 ARG A CA 1 ATOM 2789 C C . ARG A 1 189 ? 22.406 46.164 45.959 1.00 20.17 ? 201 ARG A C 1 ATOM 2790 O O . ARG A 1 189 ? 22.121 47.172 45.316 1.00 18.46 ? 201 ARG A O 1 ATOM 2791 C CB . ARG A 1 189 ? 22.030 46.677 48.388 1.00 20.75 ? 201 ARG A CB 1 ATOM 2792 C CG . ARG A 1 189 ? 20.840 45.731 48.442 1.00 18.97 ? 201 ARG A CG 1 ATOM 2793 C CD . ARG A 1 189 ? 19.837 46.109 49.532 1.00 25.52 ? 201 ARG A CD 1 ATOM 2794 N NE . ARG A 1 189 ? 20.464 46.132 50.855 1.00 24.35 ? 201 ARG A NE 1 ATOM 2795 C CZ . ARG A 1 189 ? 20.526 45.090 51.676 1.00 25.84 ? 201 ARG A CZ 1 ATOM 2796 N NH1 . ARG A 1 189 ? 19.969 43.939 51.363 1.00 22.96 ? 201 ARG A NH1 1 ATOM 2797 N NH2 . ARG A 1 189 ? 21.140 45.214 52.850 1.00 29.87 ? 201 ARG A NH2 1 ATOM 2798 H H . ARG A 1 189 ? 23.808 48.085 46.927 1.00 23.86 ? 201 ARG A H 1 ATOM 2799 H HA . ARG A 1 189 ? 23.478 45.461 47.559 1.00 19.57 ? 201 ARG A HA 1 ATOM 2800 H HB2 . ARG A 1 189 ? 22.457 46.665 49.259 1.00 24.90 ? 201 ARG A HB2 1 ATOM 2801 H HB3 . ARG A 1 189 ? 21.692 47.567 48.201 1.00 24.90 ? 201 ARG A HB3 1 ATOM 2802 H HG2 . ARG A 1 189 ? 20.379 45.753 47.588 1.00 22.76 ? 201 ARG A HG2 1 ATOM 2803 H HG3 . ARG A 1 189 ? 21.158 44.833 48.624 1.00 22.76 ? 201 ARG A HG3 1 ATOM 2804 H HD2 . ARG A 1 189 ? 19.483 46.994 49.349 1.00 30.62 ? 201 ARG A HD2 1 ATOM 2805 H HD3 . ARG A 1 189 ? 19.119 45.457 49.547 1.00 30.62 ? 201 ARG A HD3 1 ATOM 2806 H HE . ARG A 1 189 ? 20.816 46.871 51.119 1.00 29.22 ? 201 ARG A HE 1 ATOM 2807 H HH11 . ARG A 1 189 ? 19.573 43.844 50.606 1.00 27.56 ? 201 ARG A HH11 1 ATOM 2808 H HH12 . ARG A 1 189 ? 20.013 43.277 51.911 1.00 27.56 ? 201 ARG A HH12 1 ATOM 2809 H HH21 . ARG A 1 189 ? 21.499 45.963 53.070 1.00 35.84 ? 201 ARG A HH21 1 ATOM 2810 H HH22 . ARG A 1 189 ? 21.170 44.547 53.392 1.00 35.84 ? 201 ARG A HH22 1 ATOM 2811 N N . ILE A 1 190 ? 22.223 44.923 45.514 1.00 16.82 ? 202 ILE A N 1 ATOM 2812 C CA . ILE A 1 190 ? 21.444 44.616 44.310 1.00 17.84 ? 202 ILE A CA 1 ATOM 2813 C C . ILE A 1 190 ? 20.009 44.312 44.720 1.00 19.08 ? 202 ILE A C 1 ATOM 2814 O O . ILE A 1 190 ? 19.763 43.492 45.617 1.00 18.25 ? 202 ILE A O 1 ATOM 2815 C CB . ILE A 1 190 ? 22.027 43.412 43.562 1.00 19.21 ? 202 ILE A CB 1 ATOM 2816 C CG1 . ILE A 1 190 ? 23.504 43.602 43.214 1.00 20.23 ? 202 ILE A CG1 1 ATOM 2817 C CG2 . ILE A 1 190 ? 21.168 43.108 42.292 1.00 20.00 ? 202 ILE A CG2 1 ATOM 2818 C CD1 . ILE A 1 190 ? 23.853 44.821 42.425 1.00 20.46 ? 202 ILE A CD1 1 ATOM 2819 H H . ILE A 1 190 ? 22.547 44.226 45.898 1.00 20.18 ? 202 ILE A H 1 ATOM 2820 H HA . ILE A 1 190 ? 21.443 45.382 43.715 1.00 21.41 ? 202 ILE A HA 1 ATOM 2821 H HB . ILE A 1 190 ? 21.962 42.643 44.150 1.00 23.05 ? 202 ILE A HB 1 ATOM 2822 H HG12 . ILE A 1 190 ? 24.007 43.641 44.042 1.00 24.27 ? 202 ILE A HG12 1 ATOM 2823 H HG13 . ILE A 1 190 ? 23.795 42.833 42.699 1.00 24.27 ? 202 ILE A HG13 1 ATOM 2824 H HG21 . ILE A 1 190 ? 21.548 42.345 41.830 1.00 24.00 ? 202 ILE A HG21 1 ATOM 2825 H HG22 . ILE A 1 190 ? 20.259 42.910 42.567 1.00 24.00 ? 202 ILE A HG22 1 ATOM 2826 H HG23 . ILE A 1 190 ? 21.177 43.885 41.712 1.00 24.00 ? 202 ILE A HG23 1 ATOM 2827 H HD11 . ILE A 1 190 ? 24.810 44.832 42.267 1.00 24.55 ? 202 ILE A HD11 1 ATOM 2828 H HD12 . ILE A 1 190 ? 23.378 44.797 41.579 1.00 24.55 ? 202 ILE A HD12 1 ATOM 2829 H HD13 . ILE A 1 190 ? 23.592 45.608 42.928 1.00 24.55 ? 202 ILE A HD13 1 ATOM 2830 N N . ILE A 1 191 ? 19.050 44.951 44.048 1.00 16.32 ? 203 ILE A N 1 ATOM 2831 C CA . ILE A 1 191 ? 17.637 44.611 44.180 1.00 14.49 ? 203 ILE A CA 1 ATOM 2832 C C . ILE A 1 191 ? 17.214 43.963 42.879 1.00 18.28 ? 203 ILE A C 1 ATOM 2833 O O . ILE A 1 191 ? 17.270 44.603 41.828 1.00 17.88 ? 203 ILE A O 1 ATOM 2834 C CB . ILE A 1 191 ? 16.783 45.853 44.499 1.00 16.67 ? 203 ILE A CB 1 ATOM 2835 C CG1 . ILE A 1 191 ? 17.183 46.424 45.858 1.00 20.71 ? 203 ILE A CG1 1 ATOM 2836 C CG2 . ILE A 1 191 ? 15.292 45.506 44.446 1.00 17.75 ? 203 ILE A CG2 1 ATOM 2837 C CD1 . ILE A 1 191 ? 16.380 47.690 46.293 1.00 25.60 ? 203 ILE A CD1 1 ATOM 2838 H H . ILE A 1 191 ? 19.198 45.597 43.501 1.00 19.58 ? 203 ILE A H 1 ATOM 2839 H HA . ILE A 1 191 ? 17.524 43.966 44.896 1.00 17.39 ? 203 ILE A HA 1 ATOM 2840 H HB . ILE A 1 191 ? 16.961 46.526 43.824 1.00 20.01 ? 203 ILE A HB 1 ATOM 2841 H HG12 . ILE A 1 191 ? 17.045 45.741 46.534 1.00 24.85 ? 203 ILE A HG12 1 ATOM 2842 H HG13 . ILE A 1 191 ? 18.122 46.667 45.828 1.00 24.85 ? 203 ILE A HG13 1 ATOM 2843 H HG21 . ILE A 1 191 ? 14.775 46.302 44.650 1.00 21.30 ? 203 ILE A HG21 1 ATOM 2844 H HG22 . ILE A 1 191 ? 15.073 45.189 43.556 1.00 21.30 ? 203 ILE A HG22 1 ATOM 2845 H HG23 . ILE A 1 191 ? 15.106 44.814 45.100 1.00 21.30 ? 203 ILE A HG23 1 ATOM 2846 H HD11 . ILE A 1 191 ? 16.698 47.982 47.161 1.00 30.73 ? 203 ILE A HD11 1 ATOM 2847 H HD12 . ILE A 1 191 ? 16.517 48.391 45.636 1.00 30.73 ? 203 ILE A HD12 1 ATOM 2848 H HD13 . ILE A 1 191 ? 15.438 47.463 46.344 1.00 30.73 ? 203 ILE A HD13 1 ATOM 2849 N N . SER A 1 192 ? 16.820 42.701 42.950 1.00 16.38 ? 204 SER A N 1 ATOM 2850 C CA . SER A 1 192 ? 16.389 41.921 41.795 1.00 16.10 ? 204 SER A CA 1 ATOM 2851 C C . SER A 1 192 ? 14.875 41.775 41.846 1.00 17.50 ? 204 SER A C 1 ATOM 2852 O O . SER A 1 192 ? 14.325 40.970 42.611 1.00 19.84 ? 204 SER A O 1 ATOM 2853 C CB . SER A 1 192 ? 17.064 40.560 41.763 1.00 18.86 ? 204 SER A CB 1 ATOM 2854 O OG . SER A 1 192 ? 16.622 39.862 40.635 1.00 18.75 ? 204 SER A OG 1 ATOM 2855 H H . SER A 1 192 ? 16.793 42.256 43.686 1.00 19.65 ? 204 SER A H 1 ATOM 2856 H HA . SER A 1 192 ? 16.622 42.395 40.982 1.00 19.32 ? 204 SER A HA 1 ATOM 2857 H HB2 . SER A 1 192 ? 18.025 40.679 41.712 1.00 22.63 ? 204 SER A HB2 1 ATOM 2858 H HB3 . SER A 1 192 ? 16.827 40.064 42.563 1.00 22.63 ? 204 SER A HB3 1 ATOM 2859 H HG . SER A 1 192 ? 16.987 39.106 40.603 1.00 22.50 ? 204 SER A HG 1 ATOM 2860 N N . LEU A 1 193 ? 14.199 42.572 41.027 1.00 15.92 ? 205 LEU A N 1 ATOM 2861 C CA . LEU A 1 193 ? 12.751 42.558 40.987 1.00 14.09 ? 205 LEU A CA 1 ATOM 2862 C C . LEU A 1 193 ? 12.228 41.506 40.023 1.00 20.44 ? 205 LEU A C 1 ATOM 2863 O O . LEU A 1 193 ? 12.895 41.130 39.050 1.00 19.12 ? 205 LEU A O 1 ATOM 2864 C CB . LEU A 1 193 ? 12.211 43.924 40.550 1.00 17.15 ? 205 LEU A CB 1 ATOM 2865 C CG . LEU A 1 193 ? 12.561 45.107 41.431 1.00 18.02 ? 205 LEU A CG 1 ATOM 2866 C CD1 . LEU A 1 193 ? 12.067 46.391 40.769 1.00 19.07 ? 205 LEU A CD1 1 ATOM 2867 C CD2 . LEU A 1 193 ? 11.965 44.951 42.813 1.00 21.61 ? 205 LEU A CD2 1 ATOM 2868 H H . LEU A 1 193 ? 14.561 43.132 40.484 1.00 19.10 ? 205 LEU A H 1 ATOM 2869 H HA . LEU A 1 193 ? 12.406 42.361 41.872 1.00 16.91 ? 205 LEU A HA 1 ATOM 2870 H HB2 . LEU A 1 193 ? 12.553 44.116 39.663 1.00 20.58 ? 205 LEU A HB2 1 ATOM 2871 H HB3 . LEU A 1 193 ? 11.243 43.870 40.515 1.00 20.58 ? 205 LEU A HB3 1 ATOM 2872 H HG . LEU A 1 193 ? 13.525 45.163 41.520 1.00 21.63 ? 205 LEU A HG 1 ATOM 2873 H HD11 . LEU A 1 193 ? 12.293 47.145 41.335 1.00 22.88 ? 205 LEU A HD11 1 ATOM 2874 H HD12 . LEU A 1 193 ? 12.496 46.485 39.904 1.00 22.88 ? 205 LEU A HD12 1 ATOM 2875 H HD13 . LEU A 1 193 ? 11.105 46.337 40.656 1.00 22.88 ? 205 LEU A HD13 1 ATOM 2876 H HD21 . LEU A 1 193 ? 12.207 45.722 43.350 1.00 25.93 ? 205 LEU A HD21 1 ATOM 2877 H HD22 . LEU A 1 193 ? 11.000 44.891 42.736 1.00 25.93 ? 205 LEU A HD22 1 ATOM 2878 H HD23 . LEU A 1 193 ? 12.315 44.142 43.218 1.00 25.93 ? 205 LEU A HD23 1 ATOM 2879 N N . ASN A 1 194 ? 11.012 41.045 40.315 1.00 18.33 ? 206 ASN A N 1 ATOM 2880 C CA . ASN A 1 194 ? 10.222 40.197 39.427 1.00 15.56 ? 206 ASN A CA 1 ATOM 2881 C C . ASN A 1 194 ? 9.216 41.109 38.724 1.00 18.44 ? 206 ASN A C 1 ATOM 2882 O O . ASN A 1 194 ? 8.061 41.241 39.136 1.00 17.15 ? 206 ASN A O 1 ATOM 2883 C CB . ASN A 1 194 ? 9.538 39.098 40.249 1.00 17.80 ? 206 ASN A CB 1 ATOM 2884 C CG . ASN A 1 194 ? 8.791 38.092 39.415 1.00 21.34 ? 206 ASN A CG 1 ATOM 2885 O OD1 . ASN A 1 194 ? 8.720 38.186 38.189 1.00 19.48 ? 206 ASN A OD1 1 ATOM 2886 N ND2 . ASN A 1 194 ? 8.213 37.111 40.086 1.00 21.59 ? 206 ASN A ND2 1 ATOM 2887 H H . ASN A 1 194 ? 10.608 41.219 41.055 1.00 21.99 ? 206 ASN A H 1 ATOM 2888 H HA . ASN A 1 194 ? 10.796 39.786 38.762 1.00 18.67 ? 206 ASN A HA 1 ATOM 2889 H HB2 . ASN A 1 194 ? 10.213 38.620 40.756 1.00 21.36 ? 206 ASN A HB2 1 ATOM 2890 H HB3 . ASN A 1 194 ? 8.903 39.510 40.855 1.00 21.36 ? 206 ASN A HB3 1 ATOM 2891 H HD21 . ASN A 1 194 ? 7.772 36.505 39.666 1.00 25.91 ? 206 ASN A HD21 1 ATOM 2892 H HD22 . ASN A 1 194 ? 8.279 37.080 40.943 1.00 25.91 ? 206 ASN A HD22 1 ATOM 2893 N N . THR A 1 195 ? 9.680 41.808 37.669 1.00 18.77 ? 207 THR A N 1 ATOM 2894 C CA . THR A 1 195 ? 8.732 42.684 36.980 1.00 14.82 ? 207 THR A CA 1 ATOM 2895 C C . THR A 1 195 ? 7.808 41.920 36.038 1.00 16.36 ? 207 THR A C 1 ATOM 2896 O O . THR A 1 195 ? 6.895 42.520 35.446 1.00 17.60 ? 207 THR A O 1 ATOM 2897 C CB . THR A 1 195 ? 9.439 43.784 36.193 1.00 14.28 ? 207 THR A CB 1 ATOM 2898 O OG1 . THR A 1 195 ? 10.429 43.201 35.345 1.00 15.25 ? 207 THR A OG1 1 ATOM 2899 C CG2 . THR A 1 195 ? 10.101 44.796 37.140 1.00 18.32 ? 207 THR A CG2 1 ATOM 2900 H H . THR A 1 195 ? 10.481 41.794 37.357 1.00 22.52 ? 207 THR A H 1 ATOM 2901 H HA . THR A 1 195 ? 8.175 43.116 37.646 1.00 17.79 ? 207 THR A HA 1 ATOM 2902 H HB . THR A 1 195 ? 8.790 44.256 35.650 1.00 17.14 ? 207 THR A HB 1 ATOM 2903 H HG1 . THR A 1 195 ? 10.823 43.800 34.908 1.00 18.30 ? 207 THR A HG1 1 ATOM 2904 H HG21 . THR A 1 195 ? 10.546 45.488 36.626 1.00 21.98 ? 207 THR A HG21 1 ATOM 2905 H HG22 . THR A 1 195 ? 9.431 45.207 37.708 1.00 21.98 ? 207 THR A HG22 1 ATOM 2906 H HG23 . THR A 1 195 ? 10.756 44.348 37.698 1.00 21.98 ? 207 THR A HG23 1 ATOM 2907 N N . ASN A 1 196 ? 7.980 40.611 35.921 1.00 18.32 ? 208 ASN A N 1 ATOM 2908 C CA . ASN A 1 196 ? 7.029 39.792 35.207 1.00 14.78 ? 208 ASN A CA 1 ATOM 2909 C C . ASN A 1 196 ? 5.677 39.766 35.893 1.00 17.52 ? 208 ASN A C 1 ATOM 2910 O O . ASN A 1 196 ? 4.681 39.438 35.242 1.00 18.23 ? 208 ASN A O 1 ATOM 2911 C CB . ASN A 1 196 ? 7.576 38.376 35.068 1.00 15.58 ? 208 ASN A CB 1 ATOM 2912 C CG . ASN A 1 196 ? 9.005 38.377 34.583 1.00 19.59 ? 208 ASN A CG 1 ATOM 2913 O OD1 . ASN A 1 196 ? 9.267 38.721 33.440 1.00 20.49 ? 208 ASN A OD1 1 ATOM 2914 N ND2 . ASN A 1 196 ? 9.945 38.070 35.480 1.00 18.37 ? 208 ASN A ND2 1 ATOM 2915 H H . ASN A 1 196 ? 8.644 40.175 36.251 1.00 21.98 ? 208 ASN A H 1 ATOM 2916 H HA . ASN A 1 196 ? 6.906 40.155 34.316 1.00 17.74 ? 208 ASN A HA 1 ATOM 2917 H HB2 . ASN A 1 196 ? 7.549 37.936 35.933 1.00 18.70 ? 208 ASN A HB2 1 ATOM 2918 H HB3 . ASN A 1 196 ? 7.038 37.886 34.426 1.00 18.70 ? 208 ASN A HB3 1 ATOM 2919 H HD21 . ASN A 1 196 ? 10.773 38.058 35.248 1.00 22.04 ? 208 ASN A HD21 1 ATOM 2920 H HD22 . ASN A 1 196 ? 9.723 37.884 36.290 1.00 22.04 ? 208 ASN A HD22 1 ATOM 2921 N N . LEU A 1 197 ? 5.636 40.080 37.193 1.00 18.03 ? 209 LEU A N 1 ATOM 2922 C CA . LEU A 1 197 ? 4.372 40.220 37.897 1.00 15.63 ? 209 LEU A CA 1 ATOM 2923 C C . LEU A 1 197 ? 3.550 41.373 37.342 1.00 23.31 ? 209 LEU A C 1 ATOM 2924 O O . LEU A 1 197 ? 2.335 41.405 37.532 1.00 19.40 ? 209 LEU A O 1 ATOM 2925 C CB . LEU A 1 197 ? 4.628 40.459 39.401 1.00 19.08 ? 209 LEU A CB 1 ATOM 2926 C CG . LEU A 1 197 ? 5.336 39.302 40.122 1.00 20.66 ? 209 LEU A CG 1 ATOM 2927 C CD1 . LEU A 1 197 ? 5.679 39.666 41.571 1.00 23.90 ? 209 LEU A CD1 1 ATOM 2928 C CD2 . LEU A 1 197 ? 4.503 38.043 40.049 1.00 22.87 ? 209 LEU A CD2 1 ATOM 2929 H H . LEU A 1 197 ? 6.329 40.216 37.683 1.00 21.63 ? 209 LEU A H 1 ATOM 2930 H HA . LEU A 1 197 ? 3.857 39.403 37.801 1.00 18.76 ? 209 LEU A HA 1 ATOM 2931 H HB2 . LEU A 1 197 ? 5.183 41.249 39.499 1.00 22.90 ? 209 LEU A HB2 1 ATOM 2932 H HB3 . LEU A 1 197 ? 3.776 40.602 39.842 1.00 22.90 ? 209 LEU A HB3 1 ATOM 2933 H HG . LEU A 1 197 ? 6.172 39.123 39.664 1.00 24.79 ? 209 LEU A HG 1 ATOM 2934 H HD11 . LEU A 1 197 ? 6.123 38.912 41.989 1.00 28.68 ? 209 LEU A HD11 1 ATOM 2935 H HD12 . LEU A 1 197 ? 6.266 40.438 41.571 1.00 28.68 ? 209 LEU A HD12 1 ATOM 2936 H HD13 . LEU A 1 197 ? 4.859 39.873 42.046 1.00 28.68 ? 209 LEU A HD13 1 ATOM 2937 H HD21 . LEU A 1 197 ? 4.969 37.329 40.510 1.00 27.44 ? 209 LEU A HD21 1 ATOM 2938 H HD22 . LEU A 1 197 ? 3.646 38.207 40.472 1.00 27.44 ? 209 LEU A HD22 1 ATOM 2939 H HD23 . LEU A 1 197 ? 4.372 37.806 39.117 1.00 27.44 ? 209 LEU A HD23 1 ATOM 2940 N N . TYR A 1 198 ? 4.190 42.307 36.643 1.00 16.61 ? 210 TYR A N 1 ATOM 2941 C CA . TYR A 1 198 ? 3.529 43.486 36.107 1.00 13.85 ? 210 TYR A CA 1 ATOM 2942 C C . TYR A 1 198 ? 3.304 43.390 34.612 1.00 14.96 ? 210 TYR A C 1 ATOM 2943 O O . TYR A 1 198 ? 2.731 44.310 34.032 1.00 16.58 ? 210 TYR A O 1 ATOM 2944 C CB . TYR A 1 198 ? 4.352 44.726 36.438 1.00 16.81 ? 210 TYR A CB 1 ATOM 2945 C CG . TYR A 1 198 ? 4.715 44.802 37.898 1.00 16.90 ? 210 TYR A CG 1 ATOM 2946 C CD1 . TYR A 1 198 ? 3.762 44.491 38.898 1.00 20.03 ? 210 TYR A CD1 1 ATOM 2947 C CD2 . TYR A 1 198 ? 5.975 45.168 38.303 1.00 14.94 ? 210 TYR A CD2 1 ATOM 2948 C CE1 . TYR A 1 198 ? 4.108 44.560 40.235 1.00 18.88 ? 210 TYR A CE1 1 ATOM 2949 C CE2 . TYR A 1 198 ? 6.318 45.243 39.624 1.00 17.86 ? 210 TYR A CE2 1 ATOM 2950 C CZ . TYR A 1 198 ? 5.384 44.934 40.589 1.00 18.71 ? 210 TYR A CZ 1 ATOM 2951 O OH . TYR A 1 198 ? 5.755 44.968 41.926 1.00 17.86 ? 210 TYR A OH 1 ATOM 2952 H H . TYR A 1 198 ? 5.031 42.276 36.463 1.00 19.94 ? 210 TYR A H 1 ATOM 2953 H HA . TYR A 1 198 ? 2.663 43.581 36.532 1.00 16.62 ? 210 TYR A HA 1 ATOM 2954 H HB2 . TYR A 1 198 ? 5.175 44.708 35.924 1.00 20.17 ? 210 TYR A HB2 1 ATOM 2955 H HB3 . TYR A 1 198 ? 3.838 45.518 36.214 1.00 20.17 ? 210 TYR A HB3 1 ATOM 2956 H HD1 . TYR A 1 198 ? 2.901 44.238 38.655 1.00 24.04 ? 210 TYR A HD1 1 ATOM 2957 H HD2 . TYR A 1 198 ? 6.612 45.377 37.659 1.00 17.93 ? 210 TYR A HD2 1 ATOM 2958 H HE1 . TYR A 1 198 ? 3.484 44.346 40.890 1.00 22.65 ? 210 TYR A HE1 1 ATOM 2959 H HE2 . TYR A 1 198 ? 7.182 45.483 39.870 1.00 21.43 ? 210 TYR A HE2 1 ATOM 2960 H HH . TYR A 1 198 ? 5.108 44.739 42.410 1.00 21.44 ? 210 TYR A HH 1 ATOM 2961 N N . TYR A 1 199 ? 3.736 42.301 33.987 1.00 17.99 ? 211 TYR A N 1 ATOM 2962 C CA . TYR A 1 199 ? 3.746 42.180 32.525 1.00 16.73 ? 211 TYR A CA 1 ATOM 2963 C C . TYR A 1 199 ? 2.357 41.793 32.015 1.00 17.61 ? 211 TYR A C 1 ATOM 2964 O O . TYR A 1 199 ? 1.677 40.927 32.580 1.00 19.41 ? 211 TYR A O 1 ATOM 2965 C CB . TYR A 1 199 ? 4.819 41.154 32.135 1.00 15.19 ? 211 TYR A CB 1 ATOM 2966 C CG . TYR A 1 199 ? 5.044 40.898 30.687 1.00 15.46 ? 211 TYR A CG 1 ATOM 2967 C CD1 . TYR A 1 199 ? 5.203 41.950 29.781 1.00 15.11 ? 211 TYR A CD1 1 ATOM 2968 C CD2 . TYR A 1 199 ? 5.176 39.603 30.216 1.00 17.40 ? 211 TYR A CD2 1 ATOM 2969 C CE1 . TYR A 1 199 ? 5.444 41.697 28.467 1.00 16.41 ? 211 TYR A CE1 1 ATOM 2970 C CE2 . TYR A 1 199 ? 5.411 39.340 28.893 1.00 20.03 ? 211 TYR A CE2 1 ATOM 2971 C CZ . TYR A 1 199 ? 5.539 40.393 28.021 1.00 20.09 ? 211 TYR A CZ 1 ATOM 2972 O OH . TYR A 1 199 ? 5.781 40.132 26.705 1.00 21.94 ? 211 TYR A OH 1 ATOM 2973 H H . TYR A 1 199 ? 4.035 41.603 34.392 1.00 21.59 ? 211 TYR A H 1 ATOM 2974 H HA . TYR A 1 199 ? 3.986 43.035 32.135 1.00 20.08 ? 211 TYR A HA 1 ATOM 2975 H HB2 . TYR A 1 199 ? 5.665 41.453 32.503 1.00 18.23 ? 211 TYR A HB2 1 ATOM 2976 H HB3 . TYR A 1 199 ? 4.580 40.305 32.538 1.00 18.23 ? 211 TYR A HB3 1 ATOM 2977 H HD1 . TYR A 1 199 ? 5.133 42.829 30.078 1.00 18.14 ? 211 TYR A HD1 1 ATOM 2978 H HD2 . TYR A 1 199 ? 5.082 38.893 30.809 1.00 20.87 ? 211 TYR A HD2 1 ATOM 2979 H HE1 . TYR A 1 199 ? 5.532 42.402 27.867 1.00 19.69 ? 211 TYR A HE1 1 ATOM 2980 H HE2 . TYR A 1 199 ? 5.482 38.463 28.590 1.00 24.03 ? 211 TYR A HE2 1 ATOM 2981 H HH . TYR A 1 199 ? 5.813 39.302 26.578 1.00 26.33 ? 211 TYR A HH 1 ATOM 2982 N N . GLY A 1 200 ? 1.912 42.480 30.943 1.00 17.90 ? 212 GLY A N 1 ATOM 2983 C CA . GLY A 1 200 ? 0.538 42.385 30.445 1.00 18.70 ? 212 GLY A CA 1 ATOM 2984 C C . GLY A 1 200 ? -0.042 40.986 30.336 1.00 21.35 ? 212 GLY A C 1 ATOM 2985 O O . GLY A 1 200 ? -1.187 40.733 30.735 1.00 21.32 ? 212 GLY A O 1 ATOM 2986 H H . GLY A 1 200 ? 2.404 43.015 30.484 1.00 21.48 ? 212 GLY A H 1 ATOM 2987 H HA2 . GLY A 1 200 ? -0.040 42.899 31.030 1.00 22.44 ? 212 GLY A HA2 1 ATOM 2988 H HA3 . GLY A 1 200 ? 0.500 42.789 29.563 1.00 22.44 ? 212 GLY A HA3 1 ATOM 2989 N N . PRO A 1 201 ? 0.708 40.047 29.760 1.00 18.77 ? 213 PRO A N 1 ATOM 2990 C CA . PRO A 1 201 ? 0.160 38.691 29.572 1.00 19.17 ? 213 PRO A CA 1 ATOM 2991 C C . PRO A 1 201 ? -0.044 37.888 30.855 1.00 19.01 ? 213 PRO A C 1 ATOM 2992 O O . PRO A 1 201 ? -0.632 36.804 30.776 1.00 21.43 ? 213 PRO A O 1 ATOM 2993 C CB . PRO A 1 201 ? 1.188 38.014 28.660 1.00 24.54 ? 213 PRO A CB 1 ATOM 2994 C CG . PRO A 1 201 ? 1.841 39.115 27.976 1.00 24.08 ? 213 PRO A CG 1 ATOM 2995 C CD . PRO A 1 201 ? 1.909 40.257 28.938 1.00 19.62 ? 213 PRO A CD 1 ATOM 2996 H HA . PRO A 1 201 ? -0.686 38.744 29.101 1.00 23.01 ? 213 PRO A HA 1 ATOM 2997 H HB2 . PRO A 1 201 ? 1.824 37.514 29.195 1.00 29.45 ? 213 PRO A HB2 1 ATOM 2998 H HB3 . PRO A 1 201 ? 0.736 37.434 28.027 1.00 29.45 ? 213 PRO A HB3 1 ATOM 2999 H HG2 . PRO A 1 201 ? 2.734 38.844 27.712 1.00 28.89 ? 213 PRO A HG2 1 ATOM 3000 H HG3 . PRO A 1 201 ? 1.319 39.363 27.197 1.00 28.89 ? 213 PRO A HG3 1 ATOM 3001 H HD2 . PRO A 1 201 ? 2.709 40.197 29.482 1.00 23.55 ? 213 PRO A HD2 1 ATOM 3002 H HD3 . PRO A 1 201 ? 1.856 41.103 28.467 1.00 23.55 ? 213 PRO A HD3 1 ATOM 3003 N N . ASN A 1 202 ? 0.375 38.382 32.017 1.00 19.69 ? 214 ASN A N 1 ATOM 3004 C CA . ASN A 1 202 ? 0.314 37.591 33.251 1.00 18.64 ? 214 ASN A CA 1 ATOM 3005 C C . ASN A 1 202 ? -1.100 37.574 33.830 1.00 21.16 ? 214 ASN A C 1 ATOM 3006 O O . ASN A 1 202 ? -1.528 38.509 34.503 1.00 21.97 ? 214 ASN A O 1 ATOM 3007 C CB . ASN A 1 202 ? 1.305 38.115 34.273 1.00 18.41 ? 214 ASN A CB 1 ATOM 3008 C CG . ASN A 1 202 ? 1.482 37.143 35.431 1.00 20.50 ? 214 ASN A CG 1 ATOM 3009 O OD1 . ASN A 1 202 ? 0.666 36.245 35.601 1.00 21.96 ? 214 ASN A OD1 1 ATOM 3010 N ND2 . ASN A 1 202 ? 2.565 37.294 36.190 1.00 18.13 ? 214 ASN A ND2 1 ATOM 3011 H H . ASN A 1 202 ? 0.699 39.172 32.121 1.00 23.63 ? 214 ASN A H 1 ATOM 3012 H HA . ASN A 1 202 ? 0.559 36.675 33.045 1.00 22.36 ? 214 ASN A HA 1 ATOM 3013 H HB2 . ASN A 1 202 ? 2.167 38.240 33.847 1.00 22.09 ? 214 ASN A HB2 1 ATOM 3014 H HB3 . ASN A 1 202 ? 0.982 38.957 34.629 1.00 22.09 ? 214 ASN A HB3 1 ATOM 3015 H HD21 . ASN A 1 202 ? 2.702 36.765 36.855 1.00 21.75 ? 214 ASN A HD21 1 ATOM 3016 H HD22 . ASN A 1 202 ? 3.128 37.920 36.016 1.00 21.75 ? 214 ASN A HD22 1 ATOM 3017 N N . ILE A 1 203 ? -1.807 36.464 33.624 1.00 19.56 ? 215 ILE A N 1 ATOM 3018 C CA . ILE A 1 203 ? -3.162 36.328 34.159 1.00 22.20 ? 215 ILE A CA 1 ATOM 3019 C C . ILE A 1 203 ? -3.165 36.338 35.688 1.00 21.45 ? 215 ILE A C 1 ATOM 3020 O O . ILE A 1 203 ? -4.128 36.823 36.314 1.00 22.93 ? 215 ILE A O 1 ATOM 3021 C CB . ILE A 1 203 ? -3.793 35.042 33.593 1.00 23.97 ? 215 ILE A CB 1 ATOM 3022 C CG1 . ILE A 1 203 ? -3.972 35.176 32.079 1.00 27.27 ? 215 ILE A CG1 1 ATOM 3023 C CG2 . ILE A 1 203 ? -5.149 34.790 34.259 1.00 29.54 ? 215 ILE A CG2 1 ATOM 3024 C CD1 . ILE A 1 203 ? -4.107 33.825 31.386 1.00 35.28 ? 215 ILE A CD1 1 ATOM 3025 H H . ILE A 1 203 ? -1.528 35.781 33.181 1.00 23.47 ? 215 ILE A H 1 ATOM 3026 H HA . ILE A 1 203 ? -3.696 37.079 33.856 1.00 26.64 ? 215 ILE A HA 1 ATOM 3027 H HB . ILE A 1 203 ? -3.205 34.293 33.778 1.00 28.77 ? 215 ILE A HB 1 ATOM 3028 H HG12 . ILE A 1 203 ? -4.776 35.687 31.899 1.00 32.73 ? 215 ILE A HG12 1 ATOM 3029 H HG13 . ILE A 1 203 ? -3.199 35.628 31.707 1.00 32.73 ? 215 ILE A HG13 1 ATOM 3030 H HG21 . ILE A 1 203 ? -5.534 33.978 33.893 1.00 35.45 ? 215 ILE A HG21 1 ATOM 3031 H HG22 . ILE A 1 203 ? -5.018 34.693 35.215 1.00 35.45 ? 215 ILE A HG22 1 ATOM 3032 H HG23 . ILE A 1 203 ? -5.733 35.544 34.079 1.00 35.45 ? 215 ILE A HG23 1 ATOM 3033 H HD11 . ILE A 1 203 ? -4.218 33.969 30.433 1.00 42.34 ? 215 ILE A HD11 1 ATOM 3034 H HD12 . ILE A 1 203 ? -3.306 33.304 31.551 1.00 42.34 ? 215 ILE A HD12 1 ATOM 3035 H HD13 . ILE A 1 203 ? -4.882 33.363 31.743 1.00 42.34 ? 215 ILE A HD13 1 ATOM 3036 N N . MET A 1 204 ? -2.073 35.860 36.316 1.00 22.65 ? 216 MET A N 1 ATOM 3037 C CA . MET A 1 204 ? -2.056 35.673 37.770 1.00 23.00 ? 216 MET A CA 1 ATOM 3038 C C . MET A 1 204 ? -2.119 36.983 38.548 1.00 24.82 ? 216 MET A C 1 ATOM 3039 O O . MET A 1 204 ? -2.458 36.953 39.736 1.00 25.25 ? 216 MET A O 1 ATOM 3040 C CB . MET A 1 204 ? -0.815 34.878 38.207 1.00 22.25 ? 216 MET A CB 1 ATOM 3041 C CG . MET A 1 204 ? -0.591 33.587 37.436 1.00 25.93 ? 216 MET A CG 1 ATOM 3042 S SD . MET A 1 204 ? -2.093 32.517 37.397 1.00 38.75 ? 216 MET A SD 1 ATOM 3043 C CE . MET A 1 204 ? -2.276 32.230 39.163 1.00 38.15 ? 216 MET A CE 1 ATOM 3044 H H . MET A 1 204 ? -1.341 35.641 35.922 1.00 27.18 ? 216 MET A H 1 ATOM 3045 H HA . MET A 1 204 ? -2.833 35.144 38.012 1.00 27.61 ? 216 MET A HA 1 ATOM 3046 H HB2 . MET A 1 204 ? -0.030 35.434 38.083 1.00 26.70 ? 216 MET A HB2 1 ATOM 3047 H HB3 . MET A 1 204 ? -0.908 34.648 39.145 1.00 26.70 ? 216 MET A HB3 1 ATOM 3048 H HG2 . MET A 1 204 ? -0.351 33.802 36.521 1.00 31.12 ? 216 MET A HG2 1 ATOM 3049 H HG3 . MET A 1 204 ? 0.124 33.086 37.858 1.00 31.12 ? 216 MET A HG3 1 ATOM 3050 H HE1 . MET A 1 204 ? -3.049 31.664 39.313 1.00 45.78 ? 216 MET A HE1 1 ATOM 3051 H HE2 . MET A 1 204 ? -1.477 31.793 39.496 1.00 45.78 ? 216 MET A HE2 1 ATOM 3052 H HE3 . MET A 1 204 ? -2.398 33.082 39.610 1.00 45.78 ? 216 MET A HE3 1 ATOM 3053 N N . THR A 1 205 ? -1.836 38.130 37.930 1.00 20.57 ? 217 THR A N 1 ATOM 3054 C CA . THR A 1 205 ? -1.810 39.400 38.652 1.00 20.90 ? 217 THR A CA 1 ATOM 3055 C C . THR A 1 205 ? -2.889 40.382 38.217 1.00 20.70 ? 217 THR A C 1 ATOM 3056 O O . THR A 1 205 ? -2.862 41.541 38.643 1.00 21.81 ? 217 THR A O 1 ATOM 3057 C CB . THR A 1 205 ? -0.442 40.047 38.511 1.00 20.66 ? 217 THR A CB 1 ATOM 3058 O OG1 . THR A 1 205 ? -0.191 40.256 37.122 1.00 19.23 ? 217 THR A OG1 1 ATOM 3059 C CG2 . THR A 1 205 ? 0.642 39.114 39.063 1.00 21.68 ? 217 THR A CG2 1 ATOM 3060 H H . THR A 1 205 ? -1.656 38.199 37.091 1.00 24.69 ? 217 THR A H 1 ATOM 3061 H HA . THR A 1 205 ? -1.948 39.217 39.594 1.00 25.09 ? 217 THR A HA 1 ATOM 3062 H HB . THR A 1 205 ? -0.416 40.890 38.990 1.00 24.79 ? 217 THR A HB 1 ATOM 3063 H HG1 . THR A 1 205 ? 0.561 40.613 37.017 1.00 23.08 ? 217 THR A HG1 1 ATOM 3064 H HG21 . THR A 1 205 ? 1.514 39.530 38.972 1.00 26.02 ? 217 THR A HG21 1 ATOM 3065 H HG22 . THR A 1 205 ? 0.476 38.932 40.001 1.00 26.02 ? 217 THR A HG22 1 ATOM 3066 H HG23 . THR A 1 205 ? 0.639 38.277 38.573 1.00 26.02 ? 217 THR A HG23 1 ATOM 3067 N N . LEU A 1 206 ? -3.828 39.960 37.385 1.00 21.37 ? 218 LEU A N 1 ATOM 3068 C CA . LEU A 1 206 ? -4.930 40.836 37.003 1.00 27.65 ? 218 LEU A CA 1 ATOM 3069 C C . LEU A 1 206 ? -5.632 41.389 38.233 1.00 25.28 ? 218 LEU A C 1 ATOM 3070 O O . LEU A 1 206 ? -5.925 40.655 39.175 1.00 26.94 ? 218 LEU A O 1 ATOM 3071 C CB . LEU A 1 206 ? -5.926 40.071 36.141 1.00 31.80 ? 218 LEU A CB 1 ATOM 3072 C CG . LEU A 1 206 ? -5.540 39.782 34.717 1.00 34.18 ? 218 LEU A CG 1 ATOM 3073 C CD1 . LEU A 1 206 ? -6.623 38.865 34.105 1.00 39.30 ? 218 LEU A CD1 1 ATOM 3074 C CD2 . LEU A 1 206 ? -5.390 41.100 33.907 1.00 34.10 ? 218 LEU A CD2 1 ATOM 3075 H H . LEU A 1 206 ? -3.853 39.178 37.028 1.00 25.65 ? 218 LEU A H 1 ATOM 3076 H HA . LEU A 1 206 ? -4.586 41.581 36.486 1.00 33.18 ? 218 LEU A HA 1 ATOM 3077 H HB2 . LEU A 1 206 ? -6.096 39.217 36.567 1.00 38.16 ? 218 LEU A HB2 1 ATOM 3078 H HB3 . LEU A 1 206 ? -6.750 40.581 36.113 1.00 38.16 ? 218 LEU A HB3 1 ATOM 3079 H HG . LEU A 1 206 ? -4.692 39.311 34.700 1.00 41.01 ? 218 LEU A HG 1 ATOM 3080 H HD11 . LEU A 1 206 ? -6.388 38.669 33.184 1.00 47.16 ? 218 LEU A HD11 1 ATOM 3081 H HD12 . LEU A 1 206 ? -6.667 38.043 34.617 1.00 47.16 ? 218 LEU A HD12 1 ATOM 3082 H HD13 . LEU A 1 206 ? -7.479 39.322 34.137 1.00 47.16 ? 218 LEU A HD13 1 ATOM 3083 H HD21 . LEU A 1 206 ? -5.142 40.884 32.995 1.00 40.92 ? 218 LEU A HD21 1 ATOM 3084 H HD22 . LEU A 1 206 ? -6.237 41.574 33.916 1.00 40.92 ? 218 LEU A HD22 1 ATOM 3085 H HD23 . LEU A 1 206 ? -4.701 41.646 34.317 1.00 40.92 ? 218 LEU A HD23 1 ATOM 3086 N N . ASN A 1 207 ? -5.808 42.703 38.257 1.00 31.47 ? 219 ASN A N 1 ATOM 3087 C CA . ASN A 1 207 ? -6.548 43.380 39.318 1.00 40.44 ? 219 ASN A CA 1 ATOM 3088 C C . ASN A 1 207 ? -5.891 43.276 40.701 1.00 38.99 ? 219 ASN A C 1 ATOM 3089 O O . ASN A 1 207 ? -6.555 43.490 41.713 1.00 39.02 ? 219 ASN A O 1 ATOM 3090 C CB . ASN A 1 207 ? -7.987 42.854 39.385 1.00 48.84 ? 219 ASN A CB 1 ATOM 3091 C CG . ASN A 1 207 ? -8.936 43.825 40.083 1.00 68.65 ? 219 ASN A CG 1 ATOM 3092 O OD1 . ASN A 1 207 ? -9.592 43.465 41.060 1.00 60.32 ? 219 ASN A OD1 1 ATOM 3093 N ND2 . ASN A 1 207 ? -8.998 45.065 39.590 1.00 51.90 ? 219 ASN A ND2 1 ATOM 3094 H H . ASN A 1 207 ? -5.502 43.238 37.657 1.00 37.77 ? 219 ASN A H 1 ATOM 3095 H HA . ASN A 1 207 ? -6.597 44.323 39.096 1.00 48.53 ? 219 ASN A HA 1 ATOM 3096 H HB2 . ASN A 1 207 ? -8.314 42.711 38.483 1.00 58.61 ? 219 ASN A HB2 1 ATOM 3097 H HB3 . ASN A 1 207 ? -7.996 42.019 39.878 1.00 58.61 ? 219 ASN A HB3 1 ATOM 3098 H HD21 . ASN A 1 207 ? -9.518 45.646 39.951 1.00 62.29 ? 219 ASN A HD21 1 ATOM 3099 H HD22 . ASN A 1 207 ? -8.517 45.282 38.911 1.00 62.29 ? 219 ASN A HD22 1 ATOM 3100 N N . LYS A 1 208 ? -4.598 42.975 40.797 1.00 26.15 ? 220 LYS A N 1 ATOM 3101 C CA . LYS A 1 208 ? -3.878 43.018 42.073 1.00 22.84 ? 220 LYS A CA 1 ATOM 3102 C C . LYS A 1 208 ? -3.160 44.357 42.227 1.00 24.06 ? 220 LYS A C 1 ATOM 3103 O O . LYS A 1 208 ? -2.390 44.754 41.351 1.00 26.91 ? 220 LYS A O 1 ATOM 3104 C CB . LYS A 1 208 ? -2.866 41.870 42.160 1.00 25.40 ? 220 LYS A CB 1 ATOM 3105 C CG . LYS A 1 208 ? -3.453 40.489 41.912 1.00 29.79 ? 220 LYS A CG 1 ATOM 3106 C CD . LYS A 1 208 ? -4.542 40.148 42.913 1.00 37.81 ? 220 LYS A CD 1 ATOM 3107 C CE . LYS A 1 208 ? -4.958 38.687 42.782 1.00 48.67 ? 220 LYS A CE 1 ATOM 3108 N NZ . LYS A 1 208 ? -6.122 38.371 43.665 1.00 70.55 ? 220 LYS A NZ 1 ATOM 3109 H H . LYS A 1 208 ? -4.107 42.740 40.130 1.00 31.38 ? 220 LYS A H 1 ATOM 3110 H HA . LYS A 1 208 ? -4.510 42.924 42.802 1.00 27.41 ? 220 LYS A HA 1 ATOM 3111 H HB2 . LYS A 1 208 ? -2.172 42.018 41.498 1.00 30.47 ? 220 LYS A HB2 1 ATOM 3112 H HB3 . LYS A 1 208 ? -2.475 41.868 43.047 1.00 30.47 ? 220 LYS A HB3 1 ATOM 3113 H HG2 . LYS A 1 208 ? -3.840 40.463 41.023 1.00 35.75 ? 220 LYS A HG2 1 ATOM 3114 H HG3 . LYS A 1 208 ? -2.750 39.826 41.991 1.00 35.75 ? 220 LYS A HG3 1 ATOM 3115 H HD2 . LYS A 1 208 ? -4.209 40.292 43.813 1.00 45.37 ? 220 LYS A HD2 1 ATOM 3116 H HD3 . LYS A 1 208 ? -5.319 40.704 42.747 1.00 45.37 ? 220 LYS A HD3 1 ATOM 3117 H HE2 . LYS A 1 208 ? -5.216 38.508 41.864 1.00 58.41 ? 220 LYS A HE2 1 ATOM 3118 H HE3 . LYS A 1 208 ? -4.217 38.117 43.041 1.00 58.41 ? 220 LYS A HE3 1 ATOM 3119 H HZ1 . LYS A 1 208 ? -6.349 37.515 43.574 1.00 84.66 ? 220 LYS A HZ1 1 ATOM 3120 H HZ2 . LYS A 1 208 ? -5.909 38.525 44.515 1.00 84.66 ? 220 LYS A HZ2 1 ATOM 3121 H HZ3 . LYS A 1 208 ? -6.818 38.880 43.444 1.00 84.66 ? 220 LYS A HZ3 1 ATOM 3122 N N . THR A 1 209 ? -3.375 45.034 43.354 1.00 22.00 ? 221 THR A N 1 ATOM 3123 C CA . THR A 1 209 ? -2.705 46.308 43.584 1.00 26.37 ? 221 THR A CA 1 ATOM 3124 C C . THR A 1 209 ? -1.243 46.120 43.948 1.00 23.59 ? 221 THR A C 1 ATOM 3125 O O . THR A 1 209 ? -0.429 46.986 43.618 1.00 23.98 ? 221 THR A O 1 ATOM 3126 C CB . THR A 1 209 ? -3.395 47.112 44.683 1.00 32.70 ? 221 THR A CB 1 ATOM 3127 O OG1 . THR A 1 209 ? -3.387 46.364 45.897 1.00 33.41 ? 221 THR A OG1 1 ATOM 3128 C CG2 . THR A 1 209 ? -4.820 47.412 44.274 1.00 31.25 ? 221 THR A CG2 1 ATOM 3129 H H . THR A 1 209 ? -3.896 44.781 43.990 1.00 26.39 ? 221 THR A H 1 ATOM 3130 H HA . THR A 1 209 ? -2.742 46.830 42.767 1.00 31.65 ? 221 THR A HA 1 ATOM 3131 H HB . THR A 1 209 ? -2.927 47.952 44.815 1.00 39.24 ? 221 THR A HB 1 ATOM 3132 H HG1 . THR A 1 209 ? -3.795 45.637 45.789 1.00 40.10 ? 221 THR A HG1 1 ATOM 3133 H HG21 . THR A 1 209 ? -5.263 47.923 44.970 1.00 37.50 ? 221 THR A HG21 1 ATOM 3134 H HG22 . THR A 1 209 ? -4.827 47.926 43.452 1.00 37.50 ? 221 THR A HG22 1 ATOM 3135 H HG23 . THR A 1 209 ? -5.305 46.584 44.134 1.00 37.50 ? 221 THR A HG23 1 ATOM 3136 N N . ASP A 1 210 ? -0.901 45.026 44.641 1.00 22.67 ? 222 ASP A N 1 ATOM 3137 C CA . ASP A 1 210 ? 0.491 44.750 45.026 1.00 24.11 ? 222 ASP A CA 1 ATOM 3138 C C . ASP A 1 210 ? 0.745 43.250 44.982 1.00 26.71 ? 222 ASP A C 1 ATOM 3139 O O . ASP A 1 210 ? 0.869 42.586 46.021 1.00 24.27 ? 222 ASP A O 1 ATOM 3140 C CB . ASP A 1 210 ? 0.800 45.338 46.401 1.00 26.47 ? 222 ASP A CB 1 ATOM 3141 C CG . ASP A 1 210 ? 2.286 45.338 46.721 1.00 35.33 ? 222 ASP A CG 1 ATOM 3142 O OD1 . ASP A 1 210 ? 3.074 44.901 45.848 1.00 24.71 ? 222 ASP A OD1 1 ATOM 3143 O OD2 . ASP A 1 210 ? 2.670 45.786 47.833 1.00 26.07 ? 222 ASP A OD2 1 ATOM 3144 H H . ASP A 1 210 ? -1.459 44.426 44.901 1.00 27.20 ? 222 ASP A H 1 ATOM 3145 H HA . ASP A 1 210 ? 1.083 45.170 44.384 1.00 28.94 ? 222 ASP A HA 1 ATOM 3146 H HB2 . ASP A 1 210 ? 0.487 46.256 46.430 1.00 31.77 ? 222 ASP A HB2 1 ATOM 3147 H HB3 . ASP A 1 210 ? 0.347 44.812 47.079 1.00 31.77 ? 222 ASP A HB3 1 ATOM 3148 N N . PRO A 1 211 ? 0.873 42.682 43.775 1.00 21.58 ? 223 PRO A N 1 ATOM 3149 C CA . PRO A 1 211 ? 1.115 41.233 43.644 1.00 28.45 ? 223 PRO A CA 1 ATOM 3150 C C . PRO A 1 211 ? 2.395 40.775 44.349 1.00 25.73 ? 223 PRO A C 1 ATOM 3151 O O . PRO A 1 211 ? 3.479 41.331 44.145 1.00 25.58 ? 223 PRO A O 1 ATOM 3152 C CB . PRO A 1 211 ? 1.204 41.014 42.124 1.00 30.47 ? 223 PRO A CB 1 ATOM 3153 C CG . PRO A 1 211 ? 1.371 42.392 41.517 1.00 26.07 ? 223 PRO A CG 1 ATOM 3154 C CD . PRO A 1 211 ? 0.714 43.350 42.476 1.00 22.01 ? 223 PRO A CD 1 ATOM 3155 H HA . PRO A 1 211 ? 0.361 40.734 43.995 1.00 34.14 ? 223 PRO A HA 1 ATOM 3156 H HB2 . PRO A 1 211 ? 1.971 40.456 41.921 1.00 36.56 ? 223 PRO A HB2 1 ATOM 3157 H HB3 . PRO A 1 211 ? 0.386 40.599 41.807 1.00 36.56 ? 223 PRO A HB3 1 ATOM 3158 H HG2 . PRO A 1 211 ? 2.316 42.595 41.427 1.00 31.29 ? 223 PRO A HG2 1 ATOM 3159 H HG3 . PRO A 1 211 ? 0.933 42.421 40.653 1.00 31.29 ? 223 PRO A HG3 1 ATOM 3160 H HD2 . PRO A 1 211 ? 1.177 44.202 42.474 1.00 26.41 ? 223 PRO A HD2 1 ATOM 3161 H HD3 . PRO A 1 211 ? -0.226 43.453 42.261 1.00 26.41 ? 223 PRO A HD3 1 ATOM 3162 N N . ALA A 1 212 ? 2.252 39.735 45.181 1.00 26.28 ? 224 ALA A N 1 ATOM 3163 C CA . ALA A 1 212 ? 3.325 39.185 46.007 1.00 24.88 ? 224 ALA A CA 1 ATOM 3164 C C . ALA A 1 212 ? 3.915 40.211 46.962 1.00 23.47 ? 224 ALA A C 1 ATOM 3165 O O . ALA A 1 212 ? 5.012 40.012 47.483 1.00 25.45 ? 224 ALA A O 1 ATOM 3166 C CB . ALA A 1 212 ? 4.429 38.575 45.137 1.00 27.53 ? 224 ALA A CB 1 ATOM 3167 H H . ALA A 1 212 ? 1.507 39.318 45.283 1.00 31.54 ? 224 ALA A H 1 ATOM 3168 H HA . ALA A 1 212 ? 2.955 38.469 46.547 1.00 29.85 ? 224 ALA A HA 1 ATOM 3169 H HB1 . ALA A 1 212 ? 5.124 38.220 45.713 1.00 33.03 ? 224 ALA A HB1 1 ATOM 3170 H HB2 . ALA A 1 212 ? 4.049 37.864 44.598 1.00 33.03 ? 224 ALA A HB2 1 ATOM 3171 H HB3 . ALA A 1 212 ? 4.795 39.266 44.563 1.00 33.03 ? 224 ALA A HB3 1 ATOM 3172 N N . ASN A 1 213 ? 3.220 41.319 47.219 1.00 22.13 ? 225 ASN A N 1 ATOM 3173 C CA . ASN A 1 213 ? 3.687 42.358 48.141 1.00 24.61 ? 225 ASN A CA 1 ATOM 3174 C C . ASN A 1 213 ? 5.031 42.949 47.737 1.00 25.83 ? 225 ASN A C 1 ATOM 3175 O O . ASN A 1 213 ? 5.739 43.523 48.570 1.00 20.52 ? 225 ASN A O 1 ATOM 3176 C CB . ASN A 1 213 ? 3.743 41.821 49.577 1.00 28.04 ? 225 ASN A CB 1 ATOM 3177 C CG . ASN A 1 213 ? 2.416 41.245 49.996 1.00 38.52 ? 225 ASN A CG 1 ATOM 3178 O OD1 . ASN A 1 213 ? 1.397 41.942 49.965 1.00 33.93 ? 225 ASN A OD1 1 ATOM 3179 N ND2 . ASN A 1 213 ? 2.398 39.951 50.291 1.00 39.99 ? 225 ASN A ND2 1 ATOM 3180 H H . ASN A 1 213 ? 2.457 41.496 46.864 1.00 26.55 ? 225 ASN A H 1 ATOM 3181 H HA . ASN A 1 213 ? 3.041 43.082 48.131 1.00 29.53 ? 225 ASN A HA 1 ATOM 3182 H HB2 . ASN A 1 213 ? 4.411 41.119 49.631 1.00 33.65 ? 225 ASN A HB2 1 ATOM 3183 H HB3 . ASN A 1 213 ? 3.966 42.545 50.182 1.00 33.65 ? 225 ASN A HB3 1 ATOM 3184 H HD21 . ASN A 1 213 ? 1.664 39.576 50.535 1.00 47.99 ? 225 ASN A HD21 1 ATOM 3185 H HD22 . ASN A 1 213 ? 3.121 39.488 50.238 1.00 47.99 ? 225 ASN A HD22 1 ATOM 3186 N N . GLN A 1 214 ? 5.370 42.910 46.441 1.00 19.76 ? 226 GLN A N 1 ATOM 3187 C CA . GLN A 1 214 ? 6.684 43.383 46.033 1.00 19.71 ? 226 GLN A CA 1 ATOM 3188 C C . GLN A 1 214 ? 6.827 44.891 46.181 1.00 18.69 ? 226 GLN A C 1 ATOM 3189 O O . GLN A 1 214 ? 7.943 45.377 46.423 1.00 21.24 ? 226 GLN A O 1 ATOM 3190 C CB . GLN A 1 214 ? 6.969 42.971 44.579 1.00 16.95 ? 226 GLN A CB 1 ATOM 3191 C CG . GLN A 1 214 ? 8.399 43.308 44.115 1.00 17.05 ? 226 GLN A CG 1 ATOM 3192 C CD . GLN A 1 214 ? 8.712 42.697 42.737 1.00 19.91 ? 226 GLN A CD 1 ATOM 3193 O OE1 . GLN A 1 214 ? 9.723 42.000 42.548 1.00 16.53 ? 226 GLN A OE1 1 ATOM 3194 N NE2 . GLN A 1 214 ? 7.822 42.941 41.780 1.00 18.66 ? 226 GLN A NE2 1 ATOM 3195 H H . GLN A 1 214 ? 4.871 42.623 45.803 1.00 23.72 ? 226 GLN A H 1 ATOM 3196 H HA . GLN A 1 214 ? 7.354 42.966 46.596 1.00 23.65 ? 226 GLN A HA 1 ATOM 3197 H HB2 . GLN A 1 214 ? 6.847 42.012 44.495 1.00 20.34 ? 226 GLN A HB2 1 ATOM 3198 H HB3 . GLN A 1 214 ? 6.349 43.435 43.994 1.00 20.34 ? 226 GLN A HB3 1 ATOM 3199 H HG2 . GLN A 1 214 ? 8.494 44.271 44.048 1.00 20.46 ? 226 GLN A HG2 1 ATOM 3200 H HG3 . GLN A 1 214 ? 9.034 42.953 44.756 1.00 20.46 ? 226 GLN A HG3 1 ATOM 3201 H HE21 . GLN A 1 214 ? 7.125 43.414 41.951 1.00 22.40 ? 226 GLN A HE21 1 ATOM 3202 H HE22 . GLN A 1 214 ? 7.944 42.625 40.989 1.00 22.40 ? 226 GLN A HE22 1 ATOM 3203 N N . PHE A 1 215 ? 5.747 45.670 46.004 1.00 18.76 ? 227 PHE A N 1 ATOM 3204 C CA . PHE A 1 215 ? 5.887 47.114 46.161 1.00 16.90 ? 227 PHE A CA 1 ATOM 3205 C C . PHE A 1 215 ? 6.204 47.476 47.615 1.00 17.82 ? 227 PHE A C 1 ATOM 3206 O O . PHE A 1 215 ? 7.086 48.296 47.882 1.00 22.22 ? 227 PHE A O 1 ATOM 3207 C CB . PHE A 1 215 ? 4.625 47.851 45.717 1.00 22.61 ? 227 PHE A CB 1 ATOM 3208 C CG . PHE A 1 215 ? 4.390 47.850 44.229 1.00 19.96 ? 227 PHE A CG 1 ATOM 3209 C CD1 . PHE A 1 215 ? 5.344 48.355 43.365 1.00 21.33 ? 227 PHE A CD1 1 ATOM 3210 C CD2 . PHE A 1 215 ? 3.194 47.400 43.715 1.00 19.72 ? 227 PHE A CD2 1 ATOM 3211 C CE1 . PHE A 1 215 ? 5.112 48.376 41.976 1.00 19.89 ? 227 PHE A CE1 1 ATOM 3212 C CE2 . PHE A 1 215 ? 2.939 47.400 42.338 1.00 21.63 ? 227 PHE A CE2 1 ATOM 3213 C CZ . PHE A 1 215 ? 3.913 47.905 41.463 1.00 18.80 ? 227 PHE A CZ 1 ATOM 3214 H H . PHE A 1 215 ? 4.958 45.396 45.802 1.00 22.52 ? 227 PHE A H 1 ATOM 3215 H HA . PHE A 1 215 ? 6.623 47.421 45.609 1.00 20.28 ? 227 PHE A HA 1 ATOM 3216 H HB2 . PHE A 1 215 ? 3.857 47.432 46.136 1.00 27.14 ? 227 PHE A HB2 1 ATOM 3217 H HB3 . PHE A 1 215 ? 4.689 48.776 46.003 1.00 27.14 ? 227 PHE A HB3 1 ATOM 3218 H HD1 . PHE A 1 215 ? 6.150 48.673 43.703 1.00 25.59 ? 227 PHE A HD1 1 ATOM 3219 H HD2 . PHE A 1 215 ? 2.548 47.066 44.294 1.00 23.66 ? 227 PHE A HD2 1 ATOM 3220 H HE1 . PHE A 1 215 ? 5.764 48.707 41.402 1.00 23.86 ? 227 PHE A HE1 1 ATOM 3221 H HE2 . PHE A 1 215 ? 2.129 47.083 42.008 1.00 25.95 ? 227 PHE A HE2 1 ATOM 3222 H HZ . PHE A 1 215 ? 3.760 47.914 40.546 1.00 22.56 ? 227 PHE A HZ 1 ATOM 3223 N N . GLU A 1 216 ? 5.465 46.891 48.555 1.00 21.82 ? 228 GLU A N 1 ATOM 3224 C CA . GLU A 1 216 ? 5.710 47.142 49.974 1.00 25.75 ? 228 GLU A CA 1 ATOM 3225 C C . GLU A 1 216 ? 7.120 46.705 50.355 1.00 20.90 ? 228 GLU A C 1 ATOM 3226 O O . GLU A 1 216 ? 7.842 47.421 51.057 1.00 22.10 ? 228 GLU A O 1 ATOM 3227 C CB . GLU A 1 216 ? 4.669 46.393 50.816 1.00 24.72 ? 228 GLU A CB 1 ATOM 3228 C CG . GLU A 1 216 ? 4.874 46.564 52.335 1.00 32.46 ? 228 GLU A CG 1 ATOM 3229 C CD . GLU A 1 216 ? 3.861 45.769 53.150 1.00 55.99 ? 228 GLU A CD 1 ATOM 3230 O OE1 . GLU A 1 216 ? 2.884 45.260 52.558 1.00 54.34 ? 228 GLU A OE1 1 ATOM 3231 O OE2 . GLU A 1 216 ? 4.050 45.651 54.380 1.00 67.85 ? 228 GLU A OE2 1 ATOM 3232 H H . GLU A 1 216 ? 4.819 46.346 48.398 1.00 26.19 ? 228 GLU A H 1 ATOM 3233 H HA . GLU A 1 216 ? 5.624 48.091 50.154 1.00 30.90 ? 228 GLU A HA 1 ATOM 3234 H HB2 . GLU A 1 216 ? 3.786 46.727 50.595 1.00 29.66 ? 228 GLU A HB2 1 ATOM 3235 H HB3 . GLU A 1 216 ? 4.724 45.446 50.613 1.00 29.66 ? 228 GLU A HB3 1 ATOM 3236 H HG2 . GLU A 1 216 ? 5.762 46.254 52.573 1.00 38.95 ? 228 GLU A HG2 1 ATOM 3237 H HG3 . GLU A 1 216 ? 4.776 47.502 52.565 1.00 38.95 ? 228 GLU A HG3 1 ATOM 3238 N N . TRP A 1 217 ? 7.513 45.515 49.913 1.00 20.61 ? 229 TRP A N 1 ATOM 3239 C CA . TRP A 1 217 ? 8.867 45.036 50.163 1.00 21.22 ? 229 TRP A CA 1 ATOM 3240 C C . TRP A 1 217 ? 9.911 45.971 49.558 1.00 25.19 ? 229 TRP A C 1 ATOM 3241 O O . TRP A 1 217 ? 10.935 46.267 50.189 1.00 21.53 ? 229 TRP A O 1 ATOM 3242 C CB . TRP A 1 217 ? 9.016 43.630 49.606 1.00 18.95 ? 229 TRP A CB 1 ATOM 3243 C CG . TRP A 1 217 ? 10.406 43.108 49.625 1.00 22.77 ? 229 TRP A CG 1 ATOM 3244 C CD1 . TRP A 1 217 ? 11.034 42.426 50.643 1.00 22.39 ? 229 TRP A CD1 1 ATOM 3245 C CD2 . TRP A 1 217 ? 11.357 43.223 48.570 1.00 20.23 ? 229 TRP A CD2 1 ATOM 3246 N NE1 . TRP A 1 217 ? 12.315 42.097 50.266 1.00 25.53 ? 229 TRP A NE1 1 ATOM 3247 C CE2 . TRP A 1 217 ? 12.543 42.589 49.001 1.00 22.40 ? 229 TRP A CE2 1 ATOM 3248 C CE3 . TRP A 1 217 ? 11.319 43.803 47.297 1.00 22.95 ? 229 TRP A CE3 1 ATOM 3249 C CZ2 . TRP A 1 217 ? 13.691 42.521 48.204 1.00 23.72 ? 229 TRP A CZ2 1 ATOM 3250 C CZ3 . TRP A 1 217 ? 12.461 43.721 46.488 1.00 21.62 ? 229 TRP A CZ3 1 ATOM 3251 C CH2 . TRP A 1 217 ? 13.635 43.088 46.956 1.00 22.71 ? 229 TRP A CH2 1 ATOM 3252 H H . TRP A 1 217 ? 7.019 44.969 49.468 1.00 24.74 ? 229 TRP A H 1 ATOM 3253 H HA . TRP A 1 217 ? 9.017 44.998 51.121 1.00 25.46 ? 229 TRP A HA 1 ATOM 3254 H HB2 . TRP A 1 217 ? 8.468 43.027 50.133 1.00 22.74 ? 229 TRP A HB2 1 ATOM 3255 H HB3 . TRP A 1 217 ? 8.712 43.626 48.685 1.00 22.74 ? 229 TRP A HB3 1 ATOM 3256 H HD1 . TRP A 1 217 ? 10.644 42.206 51.457 1.00 26.86 ? 229 TRP A HD1 1 ATOM 3257 H HE1 . TRP A 1 217 ? 12.888 41.680 50.753 1.00 30.64 ? 229 TRP A HE1 1 ATOM 3258 H HE3 . TRP A 1 217 ? 10.548 44.222 46.990 1.00 27.54 ? 229 TRP A HE3 1 ATOM 3259 H HZ2 . TRP A 1 217 ? 14.460 42.093 48.504 1.00 28.46 ? 229 TRP A HZ2 1 ATOM 3260 H HZ3 . TRP A 1 217 ? 12.453 44.108 45.642 1.00 25.95 ? 229 TRP A HZ3 1 ATOM 3261 H HH2 . TRP A 1 217 ? 14.384 43.051 46.405 1.00 27.25 ? 229 TRP A HH2 1 ATOM 3262 N N . LEU A 1 218 ? 9.685 46.428 48.319 1.00 21.27 ? 230 LEU A N 1 ATOM 3263 C CA . LEU A 1 218 ? 10.628 47.327 47.669 1.00 17.63 ? 230 LEU A CA 1 ATOM 3264 C C . LEU A 1 218 ? 10.753 48.631 48.420 1.00 20.96 ? 230 LEU A C 1 ATOM 3265 O O . LEU A 1 218 ? 11.860 49.164 48.592 1.00 18.91 ? 230 LEU A O 1 ATOM 3266 C CB . LEU A 1 218 ? 10.190 47.602 46.213 1.00 16.44 ? 230 LEU A CB 1 ATOM 3267 C CG . LEU A 1 218 ? 11.054 48.576 45.427 1.00 19.25 ? 230 LEU A CG 1 ATOM 3268 C CD1 . LEU A 1 218 ? 12.504 48.116 45.303 1.00 18.70 ? 230 LEU A CD1 1 ATOM 3269 C CD2 . LEU A 1 218 ? 10.443 48.806 44.036 1.00 17.92 ? 230 LEU A CD2 1 ATOM 3270 H H . LEU A 1 218 ? 8.996 46.230 47.843 1.00 25.52 ? 230 LEU A H 1 ATOM 3271 H HA . LEU A 1 218 ? 11.502 46.908 47.646 1.00 21.16 ? 230 LEU A HA 1 ATOM 3272 H HB2 . LEU A 1 218 ? 10.192 46.761 45.731 1.00 19.73 ? 230 LEU A HB2 1 ATOM 3273 H HB3 . LEU A 1 218 ? 9.290 47.963 46.229 1.00 19.73 ? 230 LEU A HB3 1 ATOM 3274 H HG . LEU A 1 218 ? 11.057 49.428 45.890 1.00 23.10 ? 230 LEU A HG 1 ATOM 3275 H HD11 . LEU A 1 218 ? 13.002 48.775 44.794 1.00 22.44 ? 230 LEU A HD11 1 ATOM 3276 H HD12 . LEU A 1 218 ? 12.884 48.027 46.191 1.00 22.44 ? 230 LEU A HD12 1 ATOM 3277 H HD13 . LEU A 1 218 ? 12.526 47.260 44.847 1.00 22.44 ? 230 LEU A HD13 1 ATOM 3278 H HD21 . LEU A 1 218 ? 11.002 49.428 43.545 1.00 21.50 ? 230 LEU A HD21 1 ATOM 3279 H HD22 . LEU A 1 218 ? 10.398 47.958 43.566 1.00 21.50 ? 230 LEU A HD22 1 ATOM 3280 H HD23 . LEU A 1 218 ? 9.551 49.174 44.140 1.00 21.50 ? 230 LEU A HD23 1 ATOM 3281 N N . GLU A 1 219 ? 9.613 49.196 48.819 1.00 20.52 ? 231 GLU A N 1 ATOM 3282 C CA . GLU A 1 219 ? 9.617 50.429 49.582 1.00 20.19 ? 231 GLU A CA 1 ATOM 3283 C C . GLU A 1 219 ? 10.445 50.267 50.857 1.00 21.54 ? 231 GLU A C 1 ATOM 3284 O O . GLU A 1 219 ? 11.283 51.124 51.185 1.00 24.39 ? 231 GLU A O 1 ATOM 3285 C CB . GLU A 1 219 ? 8.172 50.798 49.919 1.00 27.04 ? 231 GLU A CB 1 ATOM 3286 C CG . GLU A 1 219 ? 8.043 52.004 50.839 1.00 49.61 ? 231 GLU A CG 1 ATOM 3287 C CD . GLU A 1 219 ? 8.306 53.304 50.122 1.00 51.39 ? 231 GLU A CD 1 ATOM 3288 O OE1 . GLU A 1 219 ? 7.970 53.402 48.909 1.00 41.79 ? 231 GLU A OE1 1 ATOM 3289 O OE2 . GLU A 1 219 ? 8.844 54.229 50.775 1.00 48.88 ? 231 GLU A OE2 1 ATOM 3290 H H . GLU A 1 219 ? 8.829 48.882 48.658 1.00 24.62 ? 231 GLU A H 1 ATOM 3291 H HA . GLU A 1 219 ? 10.003 51.141 49.049 1.00 24.23 ? 231 GLU A HA 1 ATOM 3292 H HB2 . GLU A 1 219 ? 7.701 51.002 49.096 1.00 32.45 ? 231 GLU A HB2 1 ATOM 3293 H HB3 . GLU A 1 219 ? 7.751 50.043 50.360 1.00 32.45 ? 231 GLU A HB3 1 ATOM 3294 H HG2 . GLU A 1 219 ? 7.142 52.034 51.197 1.00 59.53 ? 231 GLU A HG2 1 ATOM 3295 H HG3 . GLU A 1 219 ? 8.685 51.922 51.561 1.00 59.53 ? 231 GLU A HG3 1 ATOM 3296 N N . ASN A 1 220 ? 10.216 49.174 51.580 1.00 24.85 ? 232 ASN A N 1 ATOM 3297 C CA . ASN A 1 220 ? 10.933 48.945 52.843 1.00 23.36 ? 232 ASN A CA 1 ATOM 3298 C C . ASN A 1 220 ? 12.421 48.742 52.595 1.00 27.63 ? 232 ASN A C 1 ATOM 3299 O O . ASN A 1 220 ? 13.262 49.225 53.359 1.00 23.96 ? 232 ASN A O 1 ATOM 3300 C CB . ASN A 1 220 ? 10.359 47.735 53.565 1.00 24.53 ? 232 ASN A CB 1 ATOM 3301 C CG . ASN A 1 220 ? 8.977 48.001 54.126 1.00 33.29 ? 232 ASN A CG 1 ATOM 3302 O OD1 . ASN A 1 220 ? 8.593 49.149 54.285 1.00 36.96 ? 232 ASN A OD1 1 ATOM 3303 N ND2 . ASN A 1 220 ? 8.221 46.939 54.406 1.00 36.17 ? 232 ASN A ND2 1 ATOM 3304 H H . ASN A 1 220 ? 9.659 48.554 51.368 1.00 29.82 ? 232 ASN A H 1 ATOM 3305 H HA . ASN A 1 220 ? 10.825 49.720 53.417 1.00 28.04 ? 232 ASN A HA 1 ATOM 3306 H HB2 . ASN A 1 220 ? 10.293 46.996 52.941 1.00 29.43 ? 232 ASN A HB2 1 ATOM 3307 H HB3 . ASN A 1 220 ? 10.943 47.499 54.302 1.00 29.43 ? 232 ASN A HB3 1 ATOM 3308 H HD21 . ASN A 1 220 ? 7.430 47.047 54.727 1.00 43.41 ? 232 ASN A HD21 1 ATOM 3309 H HD22 . ASN A 1 220 ? 8.524 46.147 54.267 1.00 43.41 ? 232 ASN A HD22 1 ATOM 3310 N N . THR A 1 221 ? 12.760 48.007 51.536 1.00 20.93 ? 233 THR A N 1 ATOM 3311 C CA . THR A 1 221 ? 14.155 47.766 51.200 1.00 20.17 ? 233 THR A CA 1 ATOM 3312 C C . THR A 1 221 ? 14.879 49.067 50.870 1.00 25.16 ? 233 THR A C 1 ATOM 3313 O O . THR A 1 221 ? 15.994 49.305 51.349 1.00 22.10 ? 233 THR A O 1 ATOM 3314 C CB . THR A 1 221 ? 14.220 46.783 50.033 1.00 18.56 ? 233 THR A CB 1 ATOM 3315 O OG1 . THR A 1 221 ? 13.630 45.538 50.403 1.00 22.28 ? 233 THR A OG1 1 ATOM 3316 C CG2 . THR A 1 221 ? 15.640 46.546 49.590 1.00 19.89 ? 233 THR A CG2 1 ATOM 3317 H H . THR A 1 221 ? 12.199 47.638 50.999 1.00 25.12 ? 233 THR A H 1 ATOM 3318 H HA . THR A 1 221 ? 14.598 47.360 51.961 1.00 24.20 ? 233 THR A HA 1 ATOM 3319 H HB . THR A 1 221 ? 13.730 47.152 49.281 1.00 22.27 ? 233 THR A HB 1 ATOM 3320 H HG1 . THR A 1 221 ? 12.825 45.654 50.616 1.00 26.73 ? 233 THR A HG1 1 ATOM 3321 H HG21 . THR A 1 221 ? 15.657 45.920 48.850 1.00 23.86 ? 233 THR A HG21 1 ATOM 3322 H HG22 . THR A 1 221 ? 16.042 47.382 49.305 1.00 23.86 ? 233 THR A HG22 1 ATOM 3323 H HG23 . THR A 1 221 ? 16.159 46.181 50.324 1.00 23.86 ? 233 THR A HG23 1 ATOM 3324 N N . LEU A 1 222 ? 14.271 49.922 50.030 1.00 19.60 ? 234 LEU A N 1 ATOM 3325 C CA . LEU A 1 222 ? 14.918 51.166 49.652 1.00 21.51 ? 234 LEU A CA 1 ATOM 3326 C C . LEU A 1 222 ? 15.033 52.098 50.855 1.00 22.41 ? 234 LEU A C 1 ATOM 3327 O O . LEU A 1 222 ? 16.031 52.812 51.011 1.00 23.96 ? 234 LEU A O 1 ATOM 3328 C CB . LEU A 1 222 ? 14.138 51.836 48.529 1.00 20.69 ? 234 LEU A CB 1 ATOM 3329 C CG . LEU A 1 222 ? 14.362 51.137 47.164 1.00 20.57 ? 234 LEU A CG 1 ATOM 3330 C CD1 . LEU A 1 222 ? 13.337 51.616 46.158 1.00 20.35 ? 234 LEU A CD1 1 ATOM 3331 C CD2 . LEU A 1 222 ? 15.764 51.394 46.621 1.00 22.08 ? 234 LEU A CD2 1 ATOM 3332 H H . LEU A 1 222 ? 13.497 49.798 49.676 1.00 23.52 ? 234 LEU A H 1 ATOM 3333 H HA . LEU A 1 222 ? 15.812 50.975 49.329 1.00 25.81 ? 234 LEU A HA 1 ATOM 3334 H HB2 . LEU A 1 222 ? 13.190 51.799 48.735 1.00 24.83 ? 234 LEU A HB2 1 ATOM 3335 H HB3 . LEU A 1 222 ? 14.426 52.758 48.448 1.00 24.83 ? 234 LEU A HB3 1 ATOM 3336 H HG . LEU A 1 222 ? 14.252 50.180 47.274 1.00 24.69 ? 234 LEU A HG 1 ATOM 3337 H HD11 . LEU A 1 222 ? 13.493 51.169 45.311 1.00 24.42 ? 234 LEU A HD11 1 ATOM 3338 H HD12 . LEU A 1 222 ? 12.450 51.403 46.487 1.00 24.42 ? 234 LEU A HD12 1 ATOM 3339 H HD13 . LEU A 1 222 ? 13.428 52.576 46.048 1.00 24.42 ? 234 LEU A HD13 1 ATOM 3340 H HD21 . LEU A 1 222 ? 15.860 50.940 45.769 1.00 26.50 ? 234 LEU A HD21 1 ATOM 3341 H HD22 . LEU A 1 222 ? 15.887 52.348 46.503 1.00 26.50 ? 234 LEU A HD22 1 ATOM 3342 H HD23 . LEU A 1 222 ? 16.415 51.051 47.253 1.00 26.50 ? 234 LEU A HD23 1 ATOM 3343 N N . ASN A 1 223 ? 14.009 52.112 51.697 1.00 24.27 ? 235 ASN A N 1 ATOM 3344 C CA . ASN A 1 223 ? 14.082 52.940 52.897 1.00 28.27 ? 235 ASN A CA 1 ATOM 3345 C C . ASN A 1 223 ? 15.227 52.495 53.796 1.00 25.34 ? 235 ASN A C 1 ATOM 3346 O O . ASN A 1 223 ? 15.978 53.329 54.310 1.00 24.77 ? 235 ASN A O 1 ATOM 3347 C CB . ASN A 1 223 ? 12.770 52.882 53.657 1.00 25.57 ? 235 ASN A CB 1 ATOM 3348 C CG . ASN A 1 223 ? 12.669 53.986 54.689 1.00 38.24 ? 235 ASN A CG 1 ATOM 3349 O OD1 . ASN A 1 223 ? 13.086 55.124 54.455 1.00 37.80 ? 235 ASN A OD1 1 ATOM 3350 N ND2 . ASN A 1 223 ? 12.129 53.653 55.823 1.00 42.65 ? 235 ASN A ND2 1 ATOM 3351 H H . ASN A 1 223 ? 13.280 51.666 51.604 1.00 29.12 ? 235 ASN A H 1 ATOM 3352 H HA . ASN A 1 223 ? 14.242 53.861 52.638 1.00 33.92 ? 235 ASN A HA 1 ATOM 3353 H HB2 . ASN A 1 223 ? 12.035 52.984 53.032 1.00 30.68 ? 235 ASN A HB2 1 ATOM 3354 H HB3 . ASN A 1 223 ? 12.704 52.030 54.116 1.00 30.68 ? 235 ASN A HB3 1 ATOM 3355 H HD21 . ASN A 1 223 ? 11.827 52.856 55.941 1.00 51.18 ? 235 ASN A HD21 1 ATOM 3356 N N . SER A 1 224 ? 15.381 51.188 53.991 1.00 23.40 ? 236 SER A N 1 ATOM 3357 C CA A SER A 1 224 ? 16.512 50.698 54.777 0.60 26.64 ? 236 SER A CA 1 ATOM 3358 C CA B SER A 1 224 ? 16.509 50.702 54.779 0.40 26.65 ? 236 SER A CA 1 ATOM 3359 C C . SER A 1 224 ? 17.836 51.080 54.135 1.00 29.16 ? 236 SER A C 1 ATOM 3360 O O . SER A 1 224 ? 18.768 51.493 54.823 1.00 27.28 ? 236 SER A O 1 ATOM 3361 C CB A SER A 1 224 ? 16.429 49.189 54.948 0.60 27.26 ? 236 SER A CB 1 ATOM 3362 C CB B SER A 1 224 ? 16.416 49.194 54.964 0.40 27.25 ? 236 SER A CB 1 ATOM 3363 O OG A SER A 1 224 ? 15.330 48.812 55.748 0.60 30.37 ? 236 SER A OG 1 ATOM 3364 O OG B SER A 1 224 ? 17.533 48.717 55.694 0.40 29.57 ? 236 SER A OG 1 ATOM 3365 H H . SER A 1 224 ? 14.861 50.573 53.690 1.00 28.08 ? 236 SER A H 1 ATOM 3366 H HA . SER A 1 224 ? 16.479 51.107 55.658 1.00 31.98 ? 236 SER A HA 1 ATOM 3367 H HB2 A SER A 1 224 ? 16.334 48.780 54.074 0.60 32.71 ? 236 SER A HB2 1 ATOM 3368 H HB2 B SER A 1 224 ? 15.605 48.985 55.453 0.40 32.70 ? 236 SER A HB2 1 ATOM 3369 H HB3 A SER A 1 224 ? 17.244 48.877 55.370 0.60 32.71 ? 236 SER A HB3 1 ATOM 3370 H HB3 B SER A 1 224 ? 16.400 48.768 54.093 0.40 32.70 ? 236 SER A HB3 1 ATOM 3371 H HG A SER A 1 224 ? 14.614 49.072 55.394 0.60 36.44 ? 236 SER A HG 1 ATOM 3372 H HG B SER A 1 224 ? 18.243 48.895 55.282 0.40 35.49 ? 236 SER A HG 1 ATOM 3373 N N . SER A 1 225 ? 17.945 50.940 52.803 1.00 24.68 ? 237 SER A N 1 ATOM 3374 C CA . SER A 1 225 ? 19.173 51.330 52.121 1.00 22.51 ? 237 SER A CA 1 ATOM 3375 C C . SER A 1 225 ? 19.471 52.806 52.314 1.00 25.66 ? 237 SER A C 1 ATOM 3376 O O . SER A 1 225 ? 20.629 53.199 52.518 1.00 25.11 ? 237 SER A O 1 ATOM 3377 C CB . SER A 1 225 ? 19.075 50.982 50.621 1.00 20.82 ? 237 SER A CB 1 ATOM 3378 O OG . SER A 1 225 ? 19.073 49.579 50.465 1.00 24.82 ? 237 SER A OG 1 ATOM 3379 H H . SER A 1 225 ? 17.332 50.627 52.287 1.00 29.61 ? 237 SER A H 1 ATOM 3380 H HA . SER A 1 225 ? 19.912 50.826 52.496 1.00 27.02 ? 237 SER A HA 1 ATOM 3381 H HB2 . SER A 1 225 ? 18.251 51.345 50.261 1.00 24.98 ? 237 SER A HB2 1 ATOM 3382 H HB3 . SER A 1 225 ? 19.839 51.355 50.155 1.00 24.98 ? 237 SER A HB3 1 ATOM 3383 H HG . SER A 1 225 ? 19.781 49.254 50.779 1.00 29.79 ? 237 SER A HG 1 ATOM 3384 N N . LEU A 1 226 ? 18.437 53.641 52.260 1.00 23.46 ? 238 LEU A N 1 ATOM 3385 C CA . LEU A 1 226 ? 18.617 55.078 52.426 1.00 30.64 ? 238 LEU A CA 1 ATOM 3386 C C . LEU A 1 226 ? 19.210 55.402 53.797 1.00 32.94 ? 238 LEU A C 1 ATOM 3387 O O . LEU A 1 226 ? 20.143 56.208 53.915 1.00 29.31 ? 238 LEU A O 1 ATOM 3388 C CB . LEU A 1 226 ? 17.271 55.772 52.247 1.00 29.05 ? 238 LEU A CB 1 ATOM 3389 C CG . LEU A 1 226 ? 17.178 57.251 52.604 1.00 38.02 ? 238 LEU A CG 1 ATOM 3390 C CD1 . LEU A 1 226 ? 18.038 58.087 51.682 1.00 37.31 ? 238 LEU A CD1 1 ATOM 3391 C CD2 . LEU A 1 226 ? 15.732 57.698 52.542 1.00 34.15 ? 238 LEU A CD2 1 ATOM 3392 H H . LEU A 1 226 ? 17.622 53.400 52.128 1.00 28.15 ? 238 LEU A H 1 ATOM 3393 H HA . LEU A 1 226 ? 19.224 55.407 51.744 1.00 36.77 ? 238 LEU A HA 1 ATOM 3394 H HB2 . LEU A 1 226 ? 17.014 55.690 51.316 1.00 34.86 ? 238 LEU A HB2 1 ATOM 3395 H HB3 . LEU A 1 226 ? 16.621 55.308 52.797 1.00 34.86 ? 238 LEU A HB3 1 ATOM 3396 H HG . LEU A 1 226 ? 17.495 57.380 53.511 1.00 45.62 ? 238 LEU A HG 1 ATOM 3397 H HD11 . LEU A 1 226 ? 17.957 59.020 51.934 1.00 44.77 ? 238 LEU A HD11 1 ATOM 3398 H HD12 . LEU A 1 226 ? 18.961 57.800 51.766 1.00 44.77 ? 238 LEU A HD12 1 ATOM 3399 H HD13 . LEU A 1 226 ? 17.735 57.963 50.769 1.00 44.77 ? 238 LEU A HD13 1 ATOM 3400 H HD21 . LEU A 1 226 ? 15.683 58.639 52.770 1.00 40.98 ? 238 LEU A HD21 1 ATOM 3401 H HD22 . LEU A 1 226 ? 15.397 57.557 51.642 1.00 40.98 ? 238 LEU A HD22 1 ATOM 3402 H HD23 . LEU A 1 226 ? 15.213 57.176 53.174 1.00 40.98 ? 238 LEU A HD23 1 ATOM 3403 N N . TRP A 1 227 ? 18.670 54.781 54.841 1.00 29.31 ? 239 TRP A N 1 ATOM 3404 C CA . TRP A 1 227 ? 19.103 55.087 56.204 1.00 39.62 ? 239 TRP A CA 1 ATOM 3405 C C . TRP A 1 227 ? 20.395 54.385 56.580 1.00 39.57 ? 239 TRP A C 1 ATOM 3406 O O . TRP A 1 227 ? 21.084 54.842 57.492 1.00 39.82 ? 239 TRP A O 1 ATOM 3407 C CB . TRP A 1 227 ? 18.002 54.718 57.192 1.00 35.36 ? 239 TRP A CB 1 ATOM 3408 C CG . TRP A 1 227 ? 16.930 55.748 57.221 1.00 39.44 ? 239 TRP A CG 1 ATOM 3409 C CD1 . TRP A 1 227 ? 15.784 55.755 56.489 1.00 44.23 ? 239 TRP A CD1 1 ATOM 3410 C CD2 . TRP A 1 227 ? 16.911 56.943 58.013 1.00 57.41 ? 239 TRP A CD2 1 ATOM 3411 N NE1 . TRP A 1 227 ? 15.048 56.879 56.771 1.00 54.04 ? 239 TRP A NE1 1 ATOM 3412 C CE2 . TRP A 1 227 ? 15.716 57.624 57.708 1.00 64.92 ? 239 TRP A CE2 1 ATOM 3413 C CE3 . TRP A 1 227 ? 17.786 57.502 58.953 1.00 57.30 ? 239 TRP A CE3 1 ATOM 3414 C CZ2 . TRP A 1 227 ? 15.372 58.836 58.310 1.00 73.59 ? 239 TRP A CZ2 1 ATOM 3415 C CZ3 . TRP A 1 227 ? 17.442 58.711 59.548 1.00 55.73 ? 239 TRP A CZ3 1 ATOM 3416 C CH2 . TRP A 1 227 ? 16.246 59.361 59.224 1.00 70.32 ? 239 TRP A CH2 1 ATOM 3417 H H . TRP A 1 227 ? 18.055 54.182 54.790 1.00 35.18 ? 239 TRP A H 1 ATOM 3418 H HA . TRP A 1 227 ? 19.255 56.042 56.274 1.00 47.54 ? 239 TRP A HA 1 ATOM 3419 H HB2 . TRP A 1 227 ? 17.605 53.873 56.929 1.00 42.44 ? 239 TRP A HB2 1 ATOM 3420 H HB3 . TRP A 1 227 ? 18.380 54.648 58.083 1.00 42.44 ? 239 TRP A HB3 1 ATOM 3421 H HD1 . TRP A 1 227 ? 15.537 55.097 55.879 1.00 53.07 ? 239 TRP A HD1 1 ATOM 3422 H HE1 . TRP A 1 227 ? 14.287 57.079 56.423 1.00 64.85 ? 239 TRP A HE1 1 ATOM 3423 H HE3 . TRP A 1 227 ? 18.582 57.075 59.172 1.00 68.76 ? 239 TRP A HE3 1 ATOM 3424 H HZ2 . TRP A 1 227 ? 14.578 59.272 58.096 1.00 88.31 ? 239 TRP A HZ2 1 ATOM 3425 H HZ3 . TRP A 1 227 ? 18.014 59.092 60.174 1.00 66.88 ? 239 TRP A HZ3 1 ATOM 3426 H HH2 . TRP A 1 227 ? 16.040 60.167 59.639 1.00 84.38 ? 239 TRP A HH2 1 ATOM 3427 N N . ASN A 1 228 ? 20.745 53.305 55.892 1.00 30.31 ? 240 ASN A N 1 ATOM 3428 C CA . ASN A 1 228 ? 22.023 52.642 56.084 1.00 27.89 ? 240 ASN A CA 1 ATOM 3429 C C . ASN A 1 228 ? 23.085 53.132 55.126 1.00 26.57 ? 240 ASN A C 1 ATOM 3430 O O . ASN A 1 228 ? 24.156 52.529 55.060 1.00 30.87 ? 240 ASN A O 1 ATOM 3431 C CB . ASN A 1 228 ? 21.845 51.145 55.940 1.00 32.33 ? 240 ASN A CB 1 ATOM 3432 C CG . ASN A 1 228 ? 21.157 50.551 57.130 1.00 40.80 ? 240 ASN A CG 1 ATOM 3433 O OD1 . ASN A 1 228 ? 21.498 50.874 58.269 1.00 45.62 ? 240 ASN A OD1 1 ATOM 3434 N ND2 . ASN A 1 228 ? 20.179 49.696 56.893 1.00 42.82 ? 240 ASN A ND2 1 ATOM 3435 H H . ASN A 1 228 ? 20.249 52.933 55.297 1.00 36.37 ? 240 ASN A H 1 ATOM 3436 H HA . ASN A 1 228 ? 22.334 52.818 56.986 1.00 33.46 ? 240 ASN A HA 1 ATOM 3437 H HB2 . ASN A 1 228 ? 21.305 50.962 55.155 1.00 38.79 ? 240 ASN A HB2 1 ATOM 3438 H HB3 . ASN A 1 228 ? 22.716 50.727 55.853 1.00 38.79 ? 240 ASN A HB3 1 ATOM 3439 H HD21 . ASN A 1 228 ? 19.758 49.332 57.549 1.00 51.39 ? 240 ASN A HD21 1 ATOM 3440 H HD22 . ASN A 1 228 ? 19.963 49.504 56.083 1.00 51.39 ? 240 ASN A HD22 1 ATOM 3441 N N . LYS A 1 229 ? 22.805 54.199 54.384 1.00 29.21 ? 241 LYS A N 1 ATOM 3442 C CA . LYS A 1 229 ? 23.773 54.834 53.493 1.00 34.18 ? 241 LYS A CA 1 ATOM 3443 C C . LYS A 1 229 ? 24.313 53.846 52.457 1.00 32.33 ? 241 LYS A C 1 ATOM 3444 O O . LYS A 1 229 ? 25.480 53.900 52.068 1.00 30.35 ? 241 LYS A O 1 ATOM 3445 C CB . LYS A 1 229 ? 24.911 55.479 54.290 1.00 38.47 ? 241 LYS A CB 1 ATOM 3446 C CG . LYS A 1 229 ? 24.392 56.450 55.357 1.00 46.47 ? 241 LYS A CG 1 ATOM 3447 C CD . LYS A 1 229 ? 25.498 57.321 55.927 1.00 73.05 ? 241 LYS A CD 1 ATOM 3448 C CE . LYS A 1 229 ? 25.183 57.745 57.353 1.00 91.08 ? 241 LYS A CE 1 ATOM 3449 N NZ . LYS A 1 229 ? 25.216 56.594 58.307 1.00 83.15 ? 241 LYS A NZ 1 ATOM 3450 H H . LYS A 1 229 ? 22.036 54.585 54.379 1.00 35.05 ? 241 LYS A H 1 ATOM 3451 H HA . LYS A 1 229 ? 23.321 55.542 53.009 1.00 41.01 ? 241 LYS A HA 1 ATOM 3452 H HB2 . LYS A 1 229 ? 25.420 54.784 54.737 1.00 46.16 ? 241 LYS A HB2 1 ATOM 3453 H HB3 . LYS A 1 229 ? 25.483 55.974 53.684 1.00 46.16 ? 241 LYS A HB3 1 ATOM 3454 H HG2 . LYS A 1 229 ? 23.725 57.031 54.960 1.00 55.77 ? 241 LYS A HG2 1 ATOM 3455 H HG3 . LYS A 1 229 ? 24.002 55.942 56.086 1.00 55.77 ? 241 LYS A HG3 1 ATOM 3456 H HD2 . LYS A 1 229 ? 26.329 56.821 55.934 1.00 87.66 ? 241 LYS A HD2 1 ATOM 3457 H HD3 . LYS A 1 229 ? 25.589 58.119 55.384 1.00 87.66 ? 241 LYS A HD3 1 ATOM 3458 H HE2 . LYS A 1 229 ? 25.840 58.396 57.644 1.00 109.29 ? 241 LYS A HE2 1 ATOM 3459 H HE3 . LYS A 1 229 ? 24.294 58.134 57.380 1.00 109.29 ? 241 LYS A HE3 1 ATOM 3460 H HZ1 . LYS A 1 229 ? 25.028 56.876 59.130 1.00 99.78 ? 241 LYS A HZ1 1 ATOM 3461 H HZ2 . LYS A 1 229 ? 24.616 55.983 58.066 1.00 99.78 ? 241 LYS A HZ2 1 ATOM 3462 H HZ3 . LYS A 1 229 ? 26.024 56.222 58.306 1.00 99.78 ? 241 LYS A HZ3 1 ATOM 3463 N N . GLU A 1 230 ? 23.464 52.934 52.007 1.00 28.09 ? 242 GLU A N 1 ATOM 3464 C CA . GLU A 1 230 ? 23.836 52.071 50.886 1.00 21.40 ? 242 GLU A CA 1 ATOM 3465 C C . GLU A 1 230 ? 23.464 52.718 49.553 1.00 26.54 ? 242 GLU A C 1 ATOM 3466 O O . GLU A 1 230 ? 22.606 53.610 49.476 1.00 24.68 ? 242 GLU A O 1 ATOM 3467 C CB . GLU A 1 230 ? 23.121 50.727 50.960 1.00 26.90 ? 242 GLU A CB 1 ATOM 3468 C CG . GLU A 1 230 ? 23.391 49.907 52.176 1.00 32.74 ? 242 GLU A CG 1 ATOM 3469 C CD . GLU A 1 230 ? 22.527 48.664 52.222 1.00 36.61 ? 242 GLU A CD 1 ATOM 3470 O OE1 . GLU A 1 230 ? 21.416 48.693 51.646 1.00 33.59 ? 242 GLU A OE1 1 ATOM 3471 O OE2 . GLU A 1 230 ? 22.945 47.645 52.826 1.00 36.72 ? 242 GLU A OE2 1 ATOM 3472 H H . GLU A 1 230 ? 22.677 52.793 52.324 1.00 33.71 ? 242 GLU A H 1 ATOM 3473 H HA . GLU A 1 230 ? 24.793 51.914 50.899 1.00 25.68 ? 242 GLU A HA 1 ATOM 3474 H HB2 . GLU A 1 230 ? 22.165 50.888 50.927 1.00 32.28 ? 242 GLU A HB2 1 ATOM 3475 H HB3 . GLU A 1 230 ? 23.385 50.199 50.191 1.00 32.28 ? 242 GLU A HB3 1 ATOM 3476 H HG2 . GLU A 1 230 ? 24.320 49.629 52.173 1.00 39.29 ? 242 GLU A HG2 1 ATOM 3477 H HG3 . GLU A 1 230 ? 23.202 50.436 52.966 1.00 39.29 ? 242 GLU A HG3 1 ATOM 3478 N N . LYS A 1 231 ? 24.094 52.225 48.490 1.00 20.81 ? 243 LYS A N 1 ATOM 3479 C CA . LYS A 1 231 ? 23.653 52.487 47.122 1.00 18.19 ? 243 LYS A CA 1 ATOM 3480 C C . LYS A 1 231 ? 23.052 51.208 46.550 1.00 18.80 ? 243 LYS A C 1 ATOM 3481 O O . LYS A 1 231 ? 23.426 50.101 46.946 1.00 18.79 ? 243 LYS A O 1 ATOM 3482 C CB . LYS A 1 231 ? 24.808 52.953 46.237 1.00 21.58 ? 243 LYS A CB 1 ATOM 3483 C CG . LYS A 1 231 ? 25.405 54.312 46.589 1.00 28.78 ? 243 LYS A CG 1 ATOM 3484 C CD . LYS A 1 231 ? 24.364 55.396 46.466 1.00 29.81 ? 243 LYS A CD 1 ATOM 3485 C CE . LYS A 1 231 ? 24.985 56.779 46.603 1.00 46.43 ? 243 LYS A CE 1 ATOM 3486 N NZ . LYS A 1 231 ? 23.949 57.833 46.470 1.00 64.31 ? 243 LYS A NZ 1 ATOM 3487 H H . LYS A 1 231 ? 24.793 51.727 48.536 1.00 24.98 ? 243 LYS A H 1 ATOM 3488 H HA . LYS A 1 231 ? 22.969 53.175 47.126 1.00 21.82 ? 243 LYS A HA 1 ATOM 3489 H HB2 . LYS A 1 231 ? 25.522 52.299 46.296 1.00 25.90 ? 243 LYS A HB2 1 ATOM 3490 H HB3 . LYS A 1 231 ? 24.492 53.003 45.321 1.00 25.90 ? 243 LYS A HB3 1 ATOM 3491 H HG2 . LYS A 1 231 ? 25.725 54.297 47.505 1.00 34.53 ? 243 LYS A HG2 1 ATOM 3492 H HG3 . LYS A 1 231 ? 26.131 54.514 45.979 1.00 34.53 ? 243 LYS A HG3 1 ATOM 3493 H HD2 . LYS A 1 231 ? 23.941 55.337 45.595 1.00 35.77 ? 243 LYS A HD2 1 ATOM 3494 H HD3 . LYS A 1 231 ? 23.704 55.288 47.169 1.00 35.77 ? 243 LYS A HD3 1 ATOM 3495 H HE2 . LYS A 1 231 ? 25.397 56.863 47.477 1.00 55.72 ? 243 LYS A HE2 1 ATOM 3496 H HE3 . LYS A 1 231 ? 25.644 56.908 45.903 1.00 55.72 ? 243 LYS A HE3 1 ATOM 3497 H HZ1 . LYS A 1 231 ? 23.557 57.775 45.673 1.00 77.17 ? 243 LYS A HZ1 1 ATOM 3498 H HZ2 . LYS A 1 231 ? 23.332 57.735 47.104 1.00 77.17 ? 243 LYS A HZ2 1 ATOM 3499 H HZ3 . LYS A 1 231 ? 24.322 58.637 46.551 1.00 77.17 ? 243 LYS A HZ3 1 ATOM 3500 N N . VAL A 1 232 ? 22.123 51.374 45.592 1.00 18.53 ? 244 VAL A N 1 ATOM 3501 C CA . VAL A 1 232 ? 21.359 50.268 45.037 1.00 18.92 ? 244 VAL A CA 1 ATOM 3502 C C . VAL A 1 232 ? 21.496 50.264 43.518 1.00 17.05 ? 244 VAL A C 1 ATOM 3503 O O . VAL A 1 232 ? 21.447 51.320 42.870 1.00 16.88 ? 244 VAL A O 1 ATOM 3504 C CB . VAL A 1 232 ? 19.875 50.371 45.450 1.00 22.33 ? 244 VAL A CB 1 ATOM 3505 C CG1 . VAL A 1 232 ? 18.962 49.540 44.589 1.00 24.15 ? 244 VAL A CG1 1 ATOM 3506 C CG2 . VAL A 1 232 ? 19.733 49.945 46.952 1.00 25.07 ? 244 VAL A CG2 1 ATOM 3507 H H . VAL A 1 232 ? 21.922 52.136 45.248 1.00 22.24 ? 244 VAL A H 1 ATOM 3508 H HA . VAL A 1 232 ? 21.712 49.431 45.377 1.00 22.70 ? 244 VAL A HA 1 ATOM 3509 H HB . VAL A 1 232 ? 19.592 51.296 45.376 1.00 26.79 ? 244 VAL A HB 1 ATOM 3510 H HG11 . VAL A 1 232 ? 18.050 49.649 44.900 1.00 28.98 ? 244 VAL A HG11 1 ATOM 3511 H HG12 . VAL A 1 232 ? 19.037 49.840 43.669 1.00 28.98 ? 244 VAL A HG12 1 ATOM 3512 H HG13 . VAL A 1 232 ? 19.226 48.609 44.656 1.00 28.98 ? 244 VAL A HG13 1 ATOM 3513 H HG21 . VAL A 1 232 ? 18.801 50.010 47.212 1.00 30.08 ? 244 VAL A HG21 1 ATOM 3514 H HG22 . VAL A 1 232 ? 20.042 49.031 47.051 1.00 30.08 ? 244 VAL A HG22 1 ATOM 3515 H HG23 . VAL A 1 232 ? 20.271 50.538 47.500 1.00 30.08 ? 244 VAL A HG23 1 ATOM 3516 N N . TYR A 1 233 ? 21.702 49.068 42.966 1.00 16.79 ? 245 TYR A N 1 ATOM 3517 C CA . TYR A 1 233 ? 21.471 48.785 41.553 1.00 15.95 ? 245 TYR A CA 1 ATOM 3518 C C . TYR A 1 233 ? 20.203 47.939 41.457 1.00 16.72 ? 245 TYR A C 1 ATOM 3519 O O . TYR A 1 233 ? 20.123 46.861 42.062 1.00 15.83 ? 245 TYR A O 1 ATOM 3520 C CB . TYR A 1 233 ? 22.648 48.054 40.919 1.00 14.95 ? 245 TYR A CB 1 ATOM 3521 C CG . TYR A 1 233 ? 23.931 48.805 40.773 1.00 13.54 ? 245 TYR A CG 1 ATOM 3522 C CD1 . TYR A 1 233 ? 23.987 50.189 40.719 1.00 14.41 ? 245 TYR A CD1 1 ATOM 3523 C CD2 . TYR A 1 233 ? 25.137 48.110 40.652 1.00 16.13 ? 245 TYR A CD2 1 ATOM 3524 C CE1 . TYR A 1 233 ? 25.184 50.858 40.546 1.00 18.93 ? 245 TYR A CE1 1 ATOM 3525 C CE2 . TYR A 1 233 ? 26.330 48.773 40.477 1.00 15.03 ? 245 TYR A CE2 1 ATOM 3526 C CZ . TYR A 1 233 ? 26.362 50.134 40.429 1.00 17.73 ? 245 TYR A CZ 1 ATOM 3527 O OH . TYR A 1 233 ? 27.572 50.766 40.274 1.00 18.86 ? 245 TYR A OH 1 ATOM 3528 H H . TYR A 1 233 ? 21.984 48.386 43.406 1.00 20.15 ? 245 TYR A H 1 ATOM 3529 H HA . TYR A 1 233 ? 21.327 49.616 41.074 1.00 19.14 ? 245 TYR A HA 1 ATOM 3530 H HB2 . TYR A 1 233 ? 22.839 47.269 41.456 1.00 17.94 ? 245 TYR A HB2 1 ATOM 3531 H HB3 . TYR A 1 233 ? 22.382 47.772 40.029 1.00 17.94 ? 245 TYR A HB3 1 ATOM 3532 H HD1 . TYR A 1 233 ? 23.200 50.679 40.788 1.00 17.29 ? 245 TYR A HD1 1 ATOM 3533 H HD2 . TYR A 1 233 ? 25.131 47.180 40.673 1.00 19.36 ? 245 TYR A HD2 1 ATOM 3534 H HE1 . TYR A 1 233 ? 25.200 51.787 40.518 1.00 22.72 ? 245 TYR A HE1 1 ATOM 3535 H HE2 . TYR A 1 233 ? 27.121 48.289 40.405 1.00 18.04 ? 245 TYR A HE2 1 ATOM 3536 H HH . TYR A 1 233 ? 27.463 51.599 40.265 1.00 22.63 ? 245 TYR A HH 1 ATOM 3537 N N . ILE A 1 234 ? 19.213 48.424 40.696 1.00 15.88 ? 246 ILE A N 1 ATOM 3538 C CA . ILE A 1 234 ? 17.977 47.691 40.412 1.00 17.86 ? 246 ILE A CA 1 ATOM 3539 C C . ILE A 1 234 ? 18.195 46.869 39.156 1.00 15.28 ? 246 ILE A C 1 ATOM 3540 O O . ILE A 1 234 ? 18.644 47.409 38.133 1.00 13.98 ? 246 ILE A O 1 ATOM 3541 C CB . ILE A 1 234 ? 16.795 48.646 40.175 1.00 15.00 ? 246 ILE A CB 1 ATOM 3542 C CG1 . ILE A 1 234 ? 16.520 49.570 41.370 1.00 21.23 ? 246 ILE A CG1 1 ATOM 3543 C CG2 . ILE A 1 234 ? 15.555 47.833 39.745 1.00 18.42 ? 246 ILE A CG2 1 ATOM 3544 C CD1 . ILE A 1 234 ? 15.813 48.954 42.464 1.00 26.07 ? 246 ILE A CD1 1 ATOM 3545 H H . ILE A 1 234 ? 19.239 49.199 40.325 1.00 19.05 ? 246 ILE A H 1 ATOM 3546 H HA . ILE A 1 234 ? 17.764 47.097 41.148 1.00 21.43 ? 246 ILE A HA 1 ATOM 3547 H HB . ILE A 1 234 ? 17.034 49.215 39.427 1.00 18.01 ? 246 ILE A HB 1 ATOM 3548 H HG12 . ILE A 1 234 ? 17.369 49.891 41.714 1.00 25.47 ? 246 ILE A HG12 1 ATOM 3549 H HG13 . ILE A 1 234 ? 15.989 50.322 41.064 1.00 25.47 ? 246 ILE A HG13 1 ATOM 3550 H HG21 . ILE A 1 234 ? 14.814 48.442 39.598 1.00 22.11 ? 246 ILE A HG21 1 ATOM 3551 H HG22 . ILE A 1 234 ? 15.759 47.356 38.925 1.00 22.11 ? 246 ILE A HG22 1 ATOM 3552 H HG23 . ILE A 1 234 ? 15.331 47.203 40.448 1.00 22.11 ? 246 ILE A HG23 1 ATOM 3553 H HD11 . ILE A 1 234 ? 15.687 49.610 43.167 1.00 31.28 ? 246 ILE A HD11 1 ATOM 3554 H HD12 . ILE A 1 234 ? 14.953 48.640 42.145 1.00 31.28 ? 246 ILE A HD12 1 ATOM 3555 H HD13 . ILE A 1 234 ? 16.336 48.208 42.797 1.00 31.28 ? 246 ILE A HD13 1 ATOM 3556 N N . ILE A 1 235 ? 17.883 45.578 39.221 1.00 15.20 ? 247 ILE A N 1 ATOM 3557 C CA . ILE A 1 235 ? 17.899 44.728 38.032 1.00 15.70 ? 247 ILE A CA 1 ATOM 3558 C C . ILE A 1 235 ? 16.553 44.041 37.914 1.00 18.33 ? 247 ILE A C 1 ATOM 3559 O O . ILE A 1 235 ? 15.908 43.725 38.917 1.00 14.89 ? 247 ILE A O 1 ATOM 3560 C CB . ILE A 1 235 ? 19.046 43.667 38.062 1.00 15.42 ? 247 ILE A CB 1 ATOM 3561 C CG1 . ILE A 1 235 ? 18.761 42.532 39.054 1.00 14.16 ? 247 ILE A CG1 1 ATOM 3562 C CG2 . ILE A 1 235 ? 20.344 44.356 38.356 1.00 16.09 ? 247 ILE A CG2 1 ATOM 3563 C CD1 . ILE A 1 235 ? 19.758 41.319 38.924 1.00 14.48 ? 247 ILE A CD1 1 ATOM 3564 H H . ILE A 1 235 ? 17.658 45.169 39.943 1.00 18.24 ? 247 ILE A H 1 ATOM 3565 H HA . ILE A 1 235 ? 18.024 45.283 37.247 1.00 18.84 ? 247 ILE A HA 1 ATOM 3566 H HB . ILE A 1 235 ? 19.112 43.276 37.177 1.00 18.50 ? 247 ILE A HB 1 ATOM 3567 H HG12 . ILE A 1 235 ? 18.830 42.880 39.957 1.00 16.99 ? 247 ILE A HG12 1 ATOM 3568 H HG13 . ILE A 1 235 ? 17.864 42.198 38.897 1.00 16.99 ? 247 ILE A HG13 1 ATOM 3569 H HG21 . ILE A 1 235 ? 21.054 43.697 38.374 1.00 19.31 ? 247 ILE A HG21 1 ATOM 3570 H HG22 . ILE A 1 235 ? 20.517 45.011 37.661 1.00 19.31 ? 247 ILE A HG22 1 ATOM 3571 H HG23 . ILE A 1 235 ? 20.278 44.797 39.217 1.00 19.31 ? 247 ILE A HG23 1 ATOM 3572 H HD11 . ILE A 1 235 ? 19.519 40.643 39.578 1.00 17.38 ? 247 ILE A HD11 1 ATOM 3573 H HD12 . ILE A 1 235 ? 19.693 40.952 38.029 1.00 17.38 ? 247 ILE A HD12 1 ATOM 3574 H HD13 . ILE A 1 235 ? 20.661 41.634 39.089 1.00 17.38 ? 247 ILE A HD13 1 ATOM 3575 N N . ALA A 1 236 ? 16.121 43.807 36.679 1.00 14.92 ? 248 ALA A N 1 ATOM 3576 C CA . ALA A 1 236 ? 14.856 43.118 36.428 1.00 13.79 ? 248 ALA A CA 1 ATOM 3577 C C . ALA A 1 236 ? 14.846 42.714 34.960 1.00 13.61 ? 248 ALA A C 1 ATOM 3578 O O . ALA A 1 236 ? 15.674 43.174 34.163 1.00 15.06 ? 248 ALA A O 1 ATOM 3579 C CB . ALA A 1 236 ? 13.647 44.012 36.761 1.00 15.64 ? 248 ALA A CB 1 ATOM 3580 H H . ALA A 1 236 ? 16.542 44.038 35.966 1.00 17.91 ? 248 ALA A H 1 ATOM 3581 H HA . ALA A 1 236 ? 14.807 42.316 36.971 1.00 16.55 ? 248 ALA A HA 1 ATOM 3582 H HB1 . ALA A 1 236 ? 12.832 43.519 36.581 1.00 18.76 ? 248 ALA A HB1 1 ATOM 3583 H HB2 . ALA A 1 236 ? 13.686 44.257 37.699 1.00 18.76 ? 248 ALA A HB2 1 ATOM 3584 H HB3 . ALA A 1 236 ? 13.682 44.808 36.209 1.00 18.76 ? 248 ALA A HB3 1 ATOM 3585 N N . HIS A 1 237 ? 13.877 41.869 34.608 1.00 13.65 ? 249 HIS A N 1 ATOM 3586 C CA . HIS A 1 237 ? 13.723 41.457 33.217 1.00 14.83 ? 249 HIS A CA 1 ATOM 3587 C C . HIS A 1 237 ? 12.960 42.500 32.394 1.00 14.39 ? 249 HIS A C 1 ATOM 3588 O O . HIS A 1 237 ? 13.539 43.140 31.513 1.00 15.50 ? 249 HIS A O 1 ATOM 3589 C CB . HIS A 1 237 ? 13.028 40.100 33.150 1.00 16.44 ? 249 HIS A CB 1 ATOM 3590 C CG . HIS A 1 237 ? 12.944 39.589 31.752 1.00 14.04 ? 249 HIS A CG 1 ATOM 3591 N ND1 . HIS A 1 237 ? 14.068 39.277 31.013 1.00 14.11 ? 249 HIS A ND1 1 ATOM 3592 C CD2 . HIS A 1 237 ? 11.886 39.424 30.928 1.00 15.47 ? 249 HIS A CD2 1 ATOM 3593 C CE1 . HIS A 1 237 ? 13.693 38.898 29.797 1.00 16.32 ? 249 HIS A CE1 1 ATOM 3594 N NE2 . HIS A 1 237 ? 12.379 38.955 29.731 1.00 14.01 ? 249 HIS A NE2 1 ATOM 3595 H H . HIS A 1 237 ? 13.304 41.524 35.149 1.00 16.38 ? 249 HIS A H 1 ATOM 3596 H HA . HIS A 1 237 ? 14.604 41.357 32.822 1.00 17.79 ? 249 HIS A HA 1 ATOM 3597 H HB2 . HIS A 1 237 ? 13.529 39.458 33.677 1.00 19.73 ? 249 HIS A HB2 1 ATOM 3598 H HB3 . HIS A 1 237 ? 12.126 40.186 33.496 1.00 19.73 ? 249 HIS A HB3 1 ATOM 3599 H HD1 . HIS A 1 237 ? 14.879 39.312 31.297 1.00 16.93 ? 249 HIS A HD1 1 ATOM 3600 H HD2 . HIS A 1 237 ? 10.991 39.554 31.144 1.00 18.57 ? 249 HIS A HD2 1 ATOM 3601 H HE1 . HIS A 1 237 ? 14.260 38.615 29.117 1.00 19.58 ? 249 HIS A HE1 1 ATOM 3602 N N . VAL A 1 238 ? 11.659 42.648 32.634 1.00 14.60 ? 250 VAL A N 1 ATOM 3603 C CA . VAL A 1 238 ? 10.860 43.601 31.849 1.00 15.70 ? 250 VAL A CA 1 ATOM 3604 C C . VAL A 1 238 ? 11.154 45.006 32.355 1.00 14.22 ? 250 VAL A C 1 ATOM 3605 O O . VAL A 1 238 ? 11.140 45.227 33.573 1.00 14.26 ? 250 VAL A O 1 ATOM 3606 C CB . VAL A 1 238 ? 9.373 43.295 31.944 1.00 13.86 ? 250 VAL A CB 1 ATOM 3607 C CG1 . VAL A 1 238 ? 8.569 44.230 31.002 1.00 13.97 ? 250 VAL A CG1 1 ATOM 3608 C CG2 . VAL A 1 238 ? 9.098 41.851 31.614 1.00 17.38 ? 250 VAL A CG2 1 ATOM 3609 H H . VAL A 1 238 ? 11.217 42.220 33.235 1.00 17.52 ? 250 VAL A H 1 ATOM 3610 H HA . VAL A 1 238 ? 11.123 43.551 30.917 1.00 18.84 ? 250 VAL A HA 1 ATOM 3611 H HB . VAL A 1 238 ? 9.075 43.457 32.853 1.00 16.64 ? 250 VAL A HB 1 ATOM 3612 H HG11 . VAL A 1 238 ? 7.625 44.019 31.078 1.00 16.77 ? 250 VAL A HG11 1 ATOM 3613 H HG12 . VAL A 1 238 ? 8.724 45.151 31.264 1.00 16.77 ? 250 VAL A HG12 1 ATOM 3614 H HG13 . VAL A 1 238 ? 8.867 44.091 30.090 1.00 16.77 ? 250 VAL A HG13 1 ATOM 3615 H HG21 . VAL A 1 238 ? 8.145 41.688 31.684 1.00 20.85 ? 250 VAL A HG21 1 ATOM 3616 H HG22 . VAL A 1 238 ? 9.400 41.672 30.710 1.00 20.85 ? 250 VAL A HG22 1 ATOM 3617 H HG23 . VAL A 1 238 ? 9.577 41.288 32.242 1.00 20.85 ? 250 VAL A HG23 1 ATOM 3618 N N . PRO A 1 239 ? 11.427 45.961 31.482 1.00 14.13 ? 251 PRO A N 1 ATOM 3619 C CA . PRO A 1 239 ? 11.750 47.314 31.954 1.00 14.26 ? 251 PRO A CA 1 ATOM 3620 C C . PRO A 1 239 ? 10.509 48.125 32.302 1.00 16.40 ? 251 PRO A C 1 ATOM 3621 O O . PRO A 1 239 ? 9.402 47.812 31.880 1.00 15.95 ? 251 PRO A O 1 ATOM 3622 C CB . PRO A 1 239 ? 12.476 47.932 30.757 1.00 17.51 ? 251 PRO A CB 1 ATOM 3623 C CG . PRO A 1 239 ? 11.871 47.256 29.606 1.00 16.45 ? 251 PRO A CG 1 ATOM 3624 C CD . PRO A 1 239 ? 11.630 45.813 30.026 1.00 15.67 ? 251 PRO A CD 1 ATOM 3625 H HA . PRO A 1 239 ? 12.346 47.279 32.718 1.00 17.11 ? 251 PRO A HA 1 ATOM 3626 H HB2 . PRO A 1 239 ? 12.311 48.887 30.726 1.00 21.02 ? 251 PRO A HB2 1 ATOM 3627 H HB3 . PRO A 1 239 ? 13.426 47.743 30.812 1.00 21.02 ? 251 PRO A HB3 1 ATOM 3628 H HG2 . PRO A 1 239 ? 11.032 47.688 29.382 1.00 19.73 ? 251 PRO A HG2 1 ATOM 3629 H HG3 . PRO A 1 239 ? 12.482 47.291 28.853 1.00 19.73 ? 251 PRO A HG3 1 ATOM 3630 H HD2 . PRO A 1 239 ? 10.832 45.460 29.602 1.00 18.80 ? 251 PRO A HD2 1 ATOM 3631 H HD3 . PRO A 1 239 ? 12.410 45.266 29.842 1.00 18.80 ? 251 PRO A HD3 1 ATOM 3632 N N . VAL A 1 240 ? 10.740 49.219 33.037 1.00 17.21 ? 252 VAL A N 1 ATOM 3633 C CA . VAL A 1 240 ? 9.760 50.296 33.131 1.00 14.50 ? 252 VAL A CA 1 ATOM 3634 C C . VAL A 1 240 ? 9.751 51.118 31.843 1.00 17.24 ? 252 VAL A C 1 ATOM 3635 O O . VAL A 1 240 ? 10.579 50.937 30.937 1.00 15.03 ? 252 VAL A O 1 ATOM 3636 C CB . VAL A 1 240 ? 10.020 51.220 34.340 1.00 17.21 ? 252 VAL A CB 1 ATOM 3637 C CG1 . VAL A 1 240 ? 9.777 50.459 35.637 1.00 19.71 ? 252 VAL A CG1 1 ATOM 3638 C CG2 . VAL A 1 240 ? 11.390 51.775 34.301 1.00 17.38 ? 252 VAL A CG2 1 ATOM 3639 H H . VAL A 1 240 ? 11.459 49.358 33.490 1.00 20.65 ? 252 VAL A H 1 ATOM 3640 H HA . VAL A 1 240 ? 8.878 49.907 33.240 1.00 17.40 ? 252 VAL A HA 1 ATOM 3641 H HB . VAL A 1 240 ? 9.397 51.963 34.309 1.00 20.66 ? 252 VAL A HB 1 ATOM 3642 H HG11 . VAL A 1 240 ? 9.944 51.051 36.387 1.00 23.66 ? 252 VAL A HG11 1 ATOM 3643 H HG12 . VAL A 1 240 ? 8.856 50.154 35.655 1.00 23.66 ? 252 VAL A HG12 1 ATOM 3644 H HG13 . VAL A 1 240 ? 10.379 49.699 35.674 1.00 23.66 ? 252 VAL A HG13 1 ATOM 3645 H HG21 . VAL A 1 240 ? 11.520 52.349 35.073 1.00 20.86 ? 252 VAL A HG21 1 ATOM 3646 H HG22 . VAL A 1 240 ? 12.027 51.044 34.322 1.00 20.86 ? 252 VAL A HG22 1 ATOM 3647 H HG23 . VAL A 1 240 ? 11.499 52.288 33.485 1.00 20.86 ? 252 VAL A HG23 1 ATOM 3648 N N . GLY A 1 241 ? 8.830 52.063 31.776 1.00 16.59 ? 253 GLY A N 1 ATOM 3649 C CA . GLY A 1 241 ? 8.779 52.967 30.643 1.00 12.76 ? 253 GLY A CA 1 ATOM 3650 C C . GLY A 1 241 ? 8.001 52.413 29.467 1.00 12.65 ? 253 GLY A C 1 ATOM 3651 O O . GLY A 1 241 ? 7.220 51.469 29.579 1.00 15.96 ? 253 GLY A O 1 ATOM 3652 H H . GLY A 1 241 ? 8.225 52.203 32.372 1.00 19.90 ? 253 GLY A H 1 ATOM 3653 H HA2 . GLY A 1 241 ? 8.364 53.800 30.916 1.00 15.32 ? 253 GLY A HA2 1 ATOM 3654 H HA3 . GLY A 1 241 ? 9.682 53.160 30.347 1.00 15.32 ? 253 GLY A HA3 1 ATOM 3655 N N . TYR A 1 242 ? 8.238 53.037 28.307 1.00 14.35 ? 254 TYR A N 1 ATOM 3656 C CA . TYR A 1 242 ? 7.457 52.807 27.096 1.00 16.43 ? 254 TYR A CA 1 ATOM 3657 C C . TYR A 1 242 ? 8.273 52.063 26.048 1.00 16.64 ? 254 TYR A C 1 ATOM 3658 O O . TYR A 1 242 ? 9.487 52.248 25.947 1.00 15.88 ? 254 TYR A O 1 ATOM 3659 C CB . TYR A 1 242 ? 6.948 54.154 26.528 1.00 15.47 ? 254 TYR A CB 1 ATOM 3660 C CG . TYR A 1 242 ? 5.746 54.619 27.291 1.00 12.51 ? 254 TYR A CG 1 ATOM 3661 C CD1 . TYR A 1 242 ? 5.866 55.119 28.582 1.00 15.22 ? 254 TYR A CD1 1 ATOM 3662 C CD2 . TYR A 1 242 ? 4.468 54.521 26.757 1.00 14.63 ? 254 TYR A CD2 1 ATOM 3663 C CE1 . TYR A 1 242 ? 4.747 55.488 29.313 1.00 17.87 ? 254 TYR A CE1 1 ATOM 3664 C CE2 . TYR A 1 242 ? 3.353 54.897 27.470 1.00 19.20 ? 254 TYR A CE2 1 ATOM 3665 C CZ . TYR A 1 242 ? 3.489 55.362 28.754 1.00 19.15 ? 254 TYR A CZ 1 ATOM 3666 O OH . TYR A 1 242 ? 2.372 55.700 29.499 1.00 19.72 ? 254 TYR A OH 1 ATOM 3667 H H . TYR A 1 242 ? 8.866 53.614 28.200 1.00 17.22 ? 254 TYR A H 1 ATOM 3668 H HA . TYR A 1 242 ? 6.685 52.264 27.317 1.00 19.72 ? 254 TYR A HA 1 ATOM 3669 H HB2 . TYR A 1 242 ? 7.644 54.824 26.610 1.00 18.56 ? 254 TYR A HB2 1 ATOM 3670 H HB3 . TYR A 1 242 ? 6.696 54.038 25.598 1.00 18.56 ? 254 TYR A HB3 1 ATOM 3671 H HD1 . TYR A 1 242 ? 6.708 55.178 28.973 1.00 18.26 ? 254 TYR A HD1 1 ATOM 3672 H HD2 . TYR A 1 242 ? 4.362 54.180 25.898 1.00 17.55 ? 254 TYR A HD2 1 ATOM 3673 H HE1 . TYR A 1 242 ? 4.841 55.805 30.183 1.00 21.44 ? 254 TYR A HE1 1 ATOM 3674 H HE2 . TYR A 1 242 ? 2.507 54.803 27.096 1.00 23.04 ? 254 TYR A HE2 1 ATOM 3675 H HH . TYR A 1 242 ? 1.676 55.578 29.045 1.00 23.67 ? 254 TYR A HH 1 ATOM 3676 N N . LEU A 1 243 ? 7.576 51.232 25.240 1.00 14.97 ? 255 LEU A N 1 ATOM 3677 C CA . LEU A 1 243 ? 8.245 50.537 24.146 1.00 16.38 ? 255 LEU A CA 1 ATOM 3678 C C . LEU A 1 243 ? 8.710 51.552 23.123 1.00 19.71 ? 255 LEU A C 1 ATOM 3679 O O . LEU A 1 243 ? 7.910 52.373 22.686 1.00 19.81 ? 255 LEU A O 1 ATOM 3680 C CB . LEU A 1 243 ? 7.319 49.569 23.427 1.00 19.41 ? 255 LEU A CB 1 ATOM 3681 C CG . LEU A 1 243 ? 6.578 48.534 24.256 1.00 23.68 ? 255 LEU A CG 1 ATOM 3682 C CD1 . LEU A 1 243 ? 5.654 47.674 23.379 1.00 28.55 ? 255 LEU A CD1 1 ATOM 3683 C CD2 . LEU A 1 243 ? 7.560 47.724 24.933 1.00 20.69 ? 255 LEU A CD2 1 ATOM 3684 H H . LEU A 1 243 ? 6.736 51.065 25.311 1.00 17.97 ? 255 LEU A H 1 ATOM 3685 H HA . LEU A 1 243 ? 9.014 50.049 24.481 1.00 19.66 ? 255 LEU A HA 1 ATOM 3686 H HB2 . LEU A 1 243 ? 6.646 50.092 22.963 1.00 23.29 ? 255 LEU A HB2 1 ATOM 3687 H HB3 . LEU A 1 243 ? 7.846 49.082 22.775 1.00 23.29 ? 255 LEU A HB3 1 ATOM 3688 H HG . LEU A 1 243 ? 6.037 48.982 24.925 1.00 28.41 ? 255 LEU A HG 1 ATOM 3689 H HD11 . LEU A 1 243 ? 5.199 47.027 23.939 1.00 34.26 ? 255 LEU A HD11 1 ATOM 3690 H HD12 . LEU A 1 243 ? 5.005 48.251 22.945 1.00 34.26 ? 255 LEU A HD12 1 ATOM 3691 H HD13 . LEU A 1 243 ? 6.189 47.217 22.711 1.00 34.26 ? 255 LEU A HD13 1 ATOM 3692 H HD21 . LEU A 1 243 ? 7.103 47.056 25.468 1.00 24.83 ? 255 LEU A HD21 1 ATOM 3693 H HD22 . LEU A 1 243 ? 8.122 47.291 24.272 1.00 24.83 ? 255 LEU A HD22 1 ATOM 3694 H HD23 . LEU A 1 243 ? 8.099 48.294 25.504 1.00 24.83 ? 255 LEU A HD23 1 ATOM 3695 N N . PRO A 1 244 ? 9.968 51.513 22.682 1.00 14.57 ? 256 PRO A N 1 ATOM 3696 C CA . PRO A 1 244 ? 10.420 52.581 21.779 1.00 15.47 ? 256 PRO A CA 1 ATOM 3697 C C . PRO A 1 244 ? 9.995 52.389 20.339 1.00 18.58 ? 256 PRO A C 1 ATOM 3698 O O . PRO A 1 244 ? 10.142 53.327 19.546 1.00 20.28 ? 256 PRO A O 1 ATOM 3699 C CB . PRO A 1 244 ? 11.952 52.550 21.911 1.00 22.06 ? 256 PRO A CB 1 ATOM 3700 C CG . PRO A 1 244 ? 12.320 51.253 22.490 1.00 19.63 ? 256 PRO A CG 1 ATOM 3701 C CD . PRO A 1 244 ? 11.090 50.717 23.239 1.00 15.12 ? 256 PRO A CD 1 ATOM 3702 H HA . PRO A 1 244 ? 10.094 53.439 22.092 1.00 18.57 ? 256 PRO A HA 1 ATOM 3703 H HB2 . PRO A 1 244 ? 12.351 52.651 21.033 1.00 26.47 ? 256 PRO A HB2 1 ATOM 3704 H HB3 . PRO A 1 244 ? 12.238 53.271 22.494 1.00 26.47 ? 256 PRO A HB3 1 ATOM 3705 H HG2 . PRO A 1 244 ? 12.571 50.644 21.777 1.00 23.56 ? 256 PRO A HG2 1 ATOM 3706 H HG3 . PRO A 1 244 ? 13.061 51.374 23.104 1.00 23.56 ? 256 PRO A HG3 1 ATOM 3707 H HD2 . PRO A 1 244 ? 10.963 49.774 23.048 1.00 18.15 ? 256 PRO A HD2 1 ATOM 3708 H HD3 . PRO A 1 244 ? 11.178 50.878 24.191 1.00 18.15 ? 256 PRO A HD3 1 ATOM 3709 N N . TYR A 1 245 ? 9.475 51.221 19.989 1.00 18.00 ? 257 TYR A N 1 ATOM 3710 C CA . TYR A 1 245 ? 9.088 50.904 18.610 1.00 19.89 ? 257 TYR A CA 1 ATOM 3711 C C . TYR A 1 245 ? 7.587 50.942 18.392 1.00 24.87 ? 257 TYR A C 1 ATOM 3712 O O . TYR A 1 245 ? 7.126 50.635 17.290 1.00 21.39 ? 257 TYR A O 1 ATOM 3713 C CB . TYR A 1 245 ? 9.607 49.510 18.222 1.00 20.87 ? 257 TYR A CB 1 ATOM 3714 C CG . TYR A 1 245 ? 9.093 48.401 19.132 1.00 20.93 ? 257 TYR A CG 1 ATOM 3715 C CD1 . TYR A 1 245 ? 9.833 48.004 20.238 1.00 20.77 ? 257 TYR A CD1 1 ATOM 3716 C CD2 . TYR A 1 245 ? 7.864 47.786 18.911 1.00 22.88 ? 257 TYR A CD2 1 ATOM 3717 C CE1 . TYR A 1 245 ? 9.390 47.031 21.081 1.00 21.27 ? 257 TYR A CE1 1 ATOM 3718 C CE2 . TYR A 1 245 ? 7.393 46.787 19.772 1.00 24.35 ? 257 TYR A CE2 1 ATOM 3719 C CZ . TYR A 1 245 ? 8.171 46.417 20.855 1.00 23.63 ? 257 TYR A CZ 1 ATOM 3720 O OH . TYR A 1 245 ? 7.769 45.445 21.730 1.00 25.85 ? 257 TYR A OH 1 ATOM 3721 H H . TYR A 1 245 ? 9.331 50.578 20.541 1.00 21.60 ? 257 TYR A H 1 ATOM 3722 H HA . TYR A 1 245 ? 9.494 51.551 18.012 1.00 23.87 ? 257 TYR A HA 1 ATOM 3723 H HB2 . TYR A 1 245 ? 9.322 49.309 17.317 1.00 25.05 ? 257 TYR A HB2 1 ATOM 3724 H HB3 . TYR A 1 245 ? 10.576 49.510 18.271 1.00 25.05 ? 257 TYR A HB3 1 ATOM 3725 H HD1 . TYR A 1 245 ? 10.654 48.409 20.404 1.00 24.92 ? 257 TYR A HD1 1 ATOM 3726 H HD2 . TYR A 1 245 ? 7.348 48.043 18.181 1.00 27.45 ? 257 TYR A HD2 1 ATOM 3727 H HE1 . TYR A 1 245 ? 9.908 46.779 21.811 1.00 25.53 ? 257 TYR A HE1 1 ATOM 3728 H HE2 . TYR A 1 245 ? 6.574 46.375 19.615 1.00 29.22 ? 257 TYR A HE2 1 ATOM 3729 H HH . TYR A 1 245 ? 7.020 45.142 21.499 1.00 31.02 ? 257 TYR A HH 1 ATOM 3730 N N . ALA A 1 246 ? 6.813 51.289 19.409 1.00 19.89 ? 258 ALA A N 1 ATOM 3731 C CA . ALA A 1 246 ? 5.366 51.320 19.330 1.00 19.86 ? 258 ALA A CA 1 ATOM 3732 C C . ALA A 1 246 ? 4.908 52.632 19.942 1.00 17.15 ? 258 ALA A C 1 ATOM 3733 O O . ALA A 1 246 ? 5.657 53.289 20.663 1.00 18.91 ? 258 ALA A O 1 ATOM 3734 C CB . ALA A 1 246 ? 4.731 50.132 20.065 1.00 23.46 ? 258 ALA A CB 1 ATOM 3735 H H . ALA A 1 246 ? 7.116 51.518 20.181 1.00 23.87 ? 258 ALA A H 1 ATOM 3736 H HA . ALA A 1 246 ? 5.088 51.296 18.401 1.00 23.83 ? 258 ALA A HA 1 ATOM 3737 H HB1 . ALA A 1 246 ? 3.766 50.192 19.987 1.00 28.15 ? 258 ALA A HB1 1 ATOM 3738 H HB2 . ALA A 1 246 ? 5.045 49.308 19.662 1.00 28.15 ? 258 ALA A HB2 1 ATOM 3739 H HB3 . ALA A 1 246 ? 4.990 50.164 20.999 1.00 28.15 ? 258 ALA A HB3 1 ATOM 3740 N N . THR A 1 247 ? 3.666 53.007 19.673 1.00 18.15 ? 259 THR A N 1 ATOM 3741 C CA . THR A 1 247 ? 3.139 54.278 20.160 1.00 15.97 ? 259 THR A CA 1 ATOM 3742 C C . THR A 1 247 ? 2.401 54.068 21.475 1.00 15.57 ? 259 THR A C 1 ATOM 3743 O O . THR A 1 247 ? 1.470 53.266 21.541 1.00 18.31 ? 259 THR A O 1 ATOM 3744 C CB . THR A 1 247 ? 2.187 54.921 19.153 1.00 18.75 ? 259 THR A CB 1 ATOM 3745 O OG1 . THR A 1 247 ? 2.805 54.934 17.870 1.00 19.12 ? 259 THR A OG1 1 ATOM 3746 C CG2 . THR A 1 247 ? 1.832 56.342 19.599 1.00 18.68 ? 259 THR A CG2 1 ATOM 3747 H H . THR A 1 247 ? 3.105 52.547 19.211 1.00 21.79 ? 259 THR A H 1 ATOM 3748 H HA . THR A 1 247 ? 3.875 54.891 20.318 1.00 19.16 ? 259 THR A HA 1 ATOM 3749 H HB . THR A 1 247 ? 1.368 54.402 19.110 1.00 22.50 ? 259 THR A HB 1 ATOM 3750 H HG1 . THR A 1 247 ? 2.291 55.285 17.307 1.00 22.95 ? 259 THR A HG1 1 ATOM 3751 H HG21 . THR A 1 247 ? 1.228 56.749 18.959 1.00 22.42 ? 259 THR A HG21 1 ATOM 3752 H HG22 . THR A 1 247 ? 1.403 56.319 20.469 1.00 22.42 ? 259 THR A HG22 1 ATOM 3753 H HG23 . THR A 1 247 ? 2.637 56.880 19.660 1.00 22.42 ? 259 THR A HG23 1 ATOM 3754 N N . ASP A 1 248 ? 2.833 54.774 22.535 1.00 15.81 ? 260 ASP A N 1 ATOM 3755 C CA . ASP A 1 248 ? 2.016 54.911 23.746 1.00 18.47 ? 260 ASP A CA 1 ATOM 3756 C C . ASP A 1 248 ? 1.715 53.558 24.392 1.00 20.72 ? 260 ASP A C 1 ATOM 3757 O O . ASP A 1 248 ? 0.599 53.293 24.853 1.00 20.80 ? 260 ASP A O 1 ATOM 3758 C CB . ASP A 1 248 ? 0.728 55.640 23.381 1.00 20.85 ? 260 ASP A CB 1 ATOM 3759 C CG . ASP A 1 248 ? -0.036 56.163 24.559 1.00 29.04 ? 260 ASP A CG 1 ATOM 3760 O OD1 . ASP A 1 248 ? 0.574 56.487 25.604 1.00 24.04 ? 260 ASP A OD1 1 ATOM 3761 O OD2 . ASP A 1 248 ? -1.278 56.260 24.415 1.00 25.82 ? 260 ASP A OD2 1 ATOM 3762 H H . ASP A 1 248 ? 3.590 55.179 22.574 1.00 18.97 ? 260 ASP A H 1 ATOM 3763 H HA . ASP A 1 248 ? 2.496 55.452 24.392 1.00 22.17 ? 260 ASP A HA 1 ATOM 3764 H HB2 . ASP A 1 248 ? 0.948 56.395 22.813 1.00 25.02 ? 260 ASP A HB2 1 ATOM 3765 H HB3 . ASP A 1 248 ? 0.149 55.027 22.902 1.00 25.02 ? 260 ASP A HB3 1 ATOM 3766 N N . THR A 1 249 ? 2.713 52.686 24.422 1.00 16.44 ? 261 THR A N 1 ATOM 3767 C CA . THR A 1 249 ? 2.536 51.328 24.941 1.00 16.30 ? 261 THR A CA 1 ATOM 3768 C C . THR A 1 249 ? 3.540 51.101 26.065 1.00 17.23 ? 261 THR A C 1 ATOM 3769 O O . THR A 1 249 ? 4.734 50.902 25.805 1.00 16.44 ? 261 THR A O 1 ATOM 3770 C CB . THR A 1 249 ? 2.705 50.298 23.835 1.00 21.70 ? 261 THR A CB 1 ATOM 3771 O OG1 . THR A 1 249 ? 1.740 50.550 22.798 1.00 20.40 ? 261 THR A OG1 1 ATOM 3772 C CG2 . THR A 1 249 ? 2.474 48.881 24.352 1.00 20.81 ? 261 THR A CG2 1 ATOM 3773 H H . THR A 1 249 ? 3.510 52.853 24.146 1.00 19.73 ? 261 THR A H 1 ATOM 3774 H HA . THR A 1 249 ? 1.643 51.238 25.308 1.00 19.56 ? 261 THR A HA 1 ATOM 3775 H HB . THR A 1 249 ? 3.601 50.354 23.469 1.00 26.04 ? 261 THR A HB 1 ATOM 3776 H HG1 . THR A 1 249 ? 1.826 49.985 22.182 1.00 24.48 ? 261 THR A HG1 1 ATOM 3777 H HG21 . THR A 1 249 ? 2.587 48.243 23.631 1.00 24.97 ? 261 THR A HG21 1 ATOM 3778 H HG22 . THR A 1 249 ? 3.110 48.678 25.056 1.00 24.97 ? 261 THR A HG22 1 ATOM 3779 H HG23 . THR A 1 249 ? 1.575 48.801 24.708 1.00 24.97 ? 261 THR A HG23 1 ATOM 3780 N N . PRO A 1 250 ? 3.118 51.145 27.317 1.00 16.97 ? 262 PRO A N 1 ATOM 3781 C CA . PRO A 1 250 ? 4.053 50.843 28.410 1.00 17.72 ? 262 PRO A CA 1 ATOM 3782 C C . PRO A 1 250 ? 4.490 49.390 28.363 1.00 19.25 ? 262 PRO A C 1 ATOM 3783 O O . PRO A 1 250 ? 3.723 48.505 27.987 1.00 17.29 ? 262 PRO A O 1 ATOM 3784 C CB . PRO A 1 250 ? 3.229 51.136 29.673 1.00 20.82 ? 262 PRO A CB 1 ATOM 3785 C CG . PRO A 1 250 ? 1.996 51.825 29.262 1.00 28.94 ? 262 PRO A CG 1 ATOM 3786 C CD . PRO A 1 250 ? 1.762 51.483 27.795 1.00 21.19 ? 262 PRO A CD 1 ATOM 3787 H HA . PRO A 1 250 ? 4.827 51.425 28.376 1.00 21.27 ? 262 PRO A HA 1 ATOM 3788 H HB2 . PRO A 1 250 ? 3.013 50.300 30.114 1.00 24.98 ? 262 PRO A HB2 1 ATOM 3789 H HB3 . PRO A 1 250 ? 3.747 51.703 30.266 1.00 24.98 ? 262 PRO A HB3 1 ATOM 3790 H HG2 . PRO A 1 250 ? 1.256 51.510 29.804 1.00 34.73 ? 262 PRO A HG2 1 ATOM 3791 H HG3 . PRO A 1 250 ? 2.111 52.782 29.372 1.00 34.73 ? 262 PRO A HG3 1 ATOM 3792 H HD2 . PRO A 1 250 ? 1.172 50.718 27.715 1.00 25.42 ? 262 PRO A HD2 1 ATOM 3793 H HD3 . PRO A 1 250 ? 1.416 52.254 27.318 1.00 25.42 ? 262 PRO A HD3 1 ATOM 3794 N N . ALA A 1 251 ? 5.737 49.143 28.780 1.00 16.39 ? 263 ALA A N 1 ATOM 3795 C CA . ALA A 1 251 ? 6.281 47.786 28.762 1.00 14.94 ? 263 ALA A CA 1 ATOM 3796 C C . ALA A 1 251 ? 5.615 46.883 29.793 1.00 19.45 ? 263 ALA A C 1 ATOM 3797 O O . ALA A 1 251 ? 5.457 45.692 29.550 1.00 18.15 ? 263 ALA A O 1 ATOM 3798 C CB . ALA A 1 251 ? 7.800 47.796 29.019 1.00 18.16 ? 263 ALA A CB 1 ATOM 3799 H H . ALA A 1 251 ? 6.282 49.740 29.074 1.00 19.67 ? 263 ALA A H 1 ATOM 3800 H HA . ALA A 1 251 ? 6.130 47.399 27.886 1.00 17.93 ? 263 ALA A HA 1 ATOM 3801 H HB1 . ALA A 1 251 ? 8.129 46.884 29.002 1.00 21.79 ? 263 ALA A HB1 1 ATOM 3802 H HB2 . ALA A 1 251 ? 8.233 48.318 28.326 1.00 21.79 ? 263 ALA A HB2 1 ATOM 3803 H HB3 . ALA A 1 251 ? 7.970 48.193 29.888 1.00 21.79 ? 263 ALA A HB3 1 ATOM 3804 N N . ILE A 1 252 ? 5.227 47.425 30.941 1.00 17.14 ? 264 ILE A N 1 ATOM 3805 C CA . ILE A 1 252 ? 4.409 46.718 31.917 1.00 15.79 ? 264 ILE A CA 1 ATOM 3806 C C . ILE A 1 252 ? 3.072 47.464 32.004 1.00 19.02 ? 264 ILE A C 1 ATOM 3807 O O . ILE A 1 252 ? 2.932 48.581 31.507 1.00 19.24 ? 264 ILE A O 1 ATOM 3808 C CB . ILE A 1 252 ? 5.105 46.614 33.296 1.00 13.98 ? 264 ILE A CB 1 ATOM 3809 C CG1 . ILE A 1 252 ? 5.460 47.994 33.834 1.00 16.82 ? 264 ILE A CG1 1 ATOM 3810 C CG2 . ILE A 1 252 ? 6.379 45.773 33.180 1.00 16.55 ? 264 ILE A CG2 1 ATOM 3811 C CD1 . ILE A 1 252 ? 6.105 47.980 35.223 1.00 16.37 ? 264 ILE A CD1 1 ATOM 3812 H H . ILE A 1 252 ? 5.431 48.224 31.184 1.00 20.57 ? 264 ILE A H 1 ATOM 3813 H HA . ILE A 1 252 ? 4.235 45.819 31.597 1.00 18.95 ? 264 ILE A HA 1 ATOM 3814 H HB . ILE A 1 252 ? 4.501 46.182 33.920 1.00 16.77 ? 264 ILE A HB 1 ATOM 3815 H HG12 . ILE A 1 252 ? 6.085 48.415 33.222 1.00 20.18 ? 264 ILE A HG12 1 ATOM 3816 H HG13 . ILE A 1 252 ? 4.650 48.524 33.890 1.00 20.18 ? 264 ILE A HG13 1 ATOM 3817 H HG21 . ILE A 1 252 ? 6.802 45.719 34.051 1.00 19.86 ? 264 ILE A HG21 1 ATOM 3818 H HG22 . ILE A 1 252 ? 6.143 44.885 32.870 1.00 19.86 ? 264 ILE A HG22 1 ATOM 3819 H HG23 . ILE A 1 252 ? 6.980 46.197 32.547 1.00 19.86 ? 264 ILE A HG23 1 ATOM 3820 H HD11 . ILE A 1 252 ? 6.299 48.892 35.490 1.00 19.64 ? 264 ILE A HD11 1 ATOM 3821 H HD12 . ILE A 1 252 ? 5.489 47.574 35.852 1.00 19.64 ? 264 ILE A HD12 1 ATOM 3822 H HD13 . ILE A 1 252 ? 6.926 47.464 35.184 1.00 19.64 ? 264 ILE A HD13 1 ATOM 3823 N N . ARG A 1 253 ? 2.088 46.859 32.674 1.00 16.05 ? 265 ARG A N 1 ATOM 3824 C CA . ARG A 1 253 ? 0.781 47.525 32.760 1.00 14.63 ? 265 ARG A CA 1 ATOM 3825 C C . ARG A 1 253 ? 0.913 48.935 33.326 1.00 16.80 ? 265 ARG A C 1 ATOM 3826 O O . ARG A 1 253 ? 1.614 49.172 34.316 1.00 18.50 ? 265 ARG A O 1 ATOM 3827 C CB . ARG A 1 253 ? -0.212 46.740 33.613 1.00 18.80 ? 265 ARG A CB 1 ATOM 3828 C CG . ARG A 1 253 ? -0.566 45.367 33.106 1.00 19.08 ? 265 ARG A CG 1 ATOM 3829 C CD . ARG A 1 253 ? -1.825 44.768 33.836 1.00 21.88 ? 265 ARG A CD 1 ATOM 3830 N NE . ARG A 1 253 ? -1.927 43.396 33.389 1.00 19.24 ? 265 ARG A NE 1 ATOM 3831 C CZ . ARG A 1 253 ? -1.730 42.316 34.145 1.00 20.81 ? 265 ARG A CZ 1 ATOM 3832 N NH1 . ARG A 1 253 ? -1.583 42.397 35.464 1.00 22.88 ? 265 ARG A NH1 1 ATOM 3833 N NH2 . ARG A 1 253 ? -1.717 41.138 33.555 1.00 20.45 ? 265 ARG A NH2 1 ATOM 3834 H H . ARG A 1 253 ? 2.144 46.098 33.072 1.00 19.26 ? 265 ARG A H 1 ATOM 3835 H HA . ARG A 1 253 ? 0.411 47.598 31.867 1.00 17.56 ? 265 ARG A HA 1 ATOM 3836 H HB2 . ARG A 1 253 ? 0.163 46.634 34.500 1.00 22.56 ? 265 ARG A HB2 1 ATOM 3837 H HB3 . ARG A 1 253 ? -1.036 47.249 33.669 1.00 22.56 ? 265 ARG A HB3 1 ATOM 3838 H HG2 . ARG A 1 253 ? -0.765 45.420 32.158 1.00 22.90 ? 265 ARG A HG2 1 ATOM 3839 H HG3 . ARG A 1 253 ? 0.183 44.770 33.257 1.00 22.90 ? 265 ARG A HG3 1 ATOM 3840 H HD2 . ARG A 1 253 ? -1.696 44.784 34.797 1.00 26.25 ? 265 ARG A HD2 1 ATOM 3841 H HD3 . ARG A 1 253 ? -2.626 45.250 33.578 1.00 26.25 ? 265 ARG A HD3 1 ATOM 3842 H HE . ARG A 1 253 ? -2.132 43.266 32.564 1.00 23.09 ? 265 ARG A HE 1 ATOM 3843 H HH11 . ARG A 1 253 ? -1.557 43.167 35.847 1.00 27.45 ? 265 ARG A HH11 1 ATOM 3844 H HH12 . ARG A 1 253 ? -1.484 41.681 35.931 1.00 27.45 ? 265 ARG A HH12 1 ATOM 3845 H HH21 . ARG A 1 253 ? -1.849 41.082 32.707 1.00 24.54 ? 265 ARG A HH21 1 ATOM 3846 H HH22 . ARG A 1 253 ? -1.661 40.422 34.028 1.00 24.54 ? 265 ARG A HH22 1 ATOM 3847 N N . GLN A 1 254 ? 0.169 49.869 32.714 1.00 18.15 ? 266 GLN A N 1 ATOM 3848 C CA . GLN A 1 254 ? 0.275 51.282 33.065 1.00 19.10 ? 266 GLN A CA 1 ATOM 3849 C C . GLN A 1 254 ? 0.172 51.517 34.571 1.00 17.33 ? 266 GLN A C 1 ATOM 3850 O O . GLN A 1 254 ? 0.980 52.266 35.139 1.00 17.72 ? 266 GLN A O 1 ATOM 3851 C CB . GLN A 1 254 ? -0.796 52.086 32.314 1.00 21.28 ? 266 GLN A CB 1 ATOM 3852 C CG . GLN A 1 254 ? -0.693 53.561 32.630 1.00 24.87 ? 266 GLN A CG 1 ATOM 3853 C CD . GLN A 1 254 ? -1.515 54.412 31.686 1.00 38.64 ? 266 GLN A CD 1 ATOM 3854 O OE1 . GLN A 1 254 ? -1.910 53.967 30.621 1.00 38.26 ? 266 GLN A OE1 1 ATOM 3855 N NE2 . GLN A 1 254 ? -1.767 55.638 32.079 1.00 37.55 ? 266 GLN A NE2 1 ATOM 3856 H H . GLN A 1 254 ? -0.403 49.703 32.094 1.00 21.78 ? 266 GLN A H 1 ATOM 3857 H HA . GLN A 1 254 ? 1.142 51.608 32.776 1.00 22.92 ? 266 GLN A HA 1 ATOM 3858 H HB2 . GLN A 1 254 ? -0.674 51.969 31.359 1.00 25.53 ? 266 GLN A HB2 1 ATOM 3859 H HB3 . GLN A 1 254 ? -1.675 51.777 32.582 1.00 25.53 ? 266 GLN A HB3 1 ATOM 3860 H HG2 . GLN A 1 254 ? -1.016 53.715 33.532 1.00 29.84 ? 266 GLN A HG2 1 ATOM 3861 H HG3 . GLN A 1 254 ? 0.233 53.838 32.556 1.00 29.84 ? 266 GLN A HG3 1 ATOM 3862 H HE21 . GLN A 1 254 ? -1.470 55.916 32.836 1.00 45.06 ? 266 GLN A HE21 1 ATOM 3863 H HE22 . GLN A 1 254 ? -2.230 56.163 31.579 1.00 45.06 ? 266 GLN A HE22 1 ATOM 3864 N N . TYR A 1 255 ? -0.779 50.855 35.239 1.00 19.40 ? 267 TYR A N 1 ATOM 3865 C CA . TYR A 1 255 ? -0.957 51.050 36.671 1.00 19.75 ? 267 TYR A CA 1 ATOM 3866 C C . TYR A 1 255 ? 0.335 50.735 37.419 1.00 18.45 ? 267 TYR A C 1 ATOM 3867 O O . TYR A 1 255 ? 0.743 51.477 38.324 1.00 18.06 ? 267 TYR A O 1 ATOM 3868 C CB . TYR A 1 255 ? -2.091 50.163 37.180 1.00 23.64 ? 267 TYR A CB 1 ATOM 3869 C CG . TYR A 1 255 ? -2.229 50.157 38.701 1.00 21.54 ? 267 TYR A CG 1 ATOM 3870 C CD1 . TYR A 1 255 ? -1.561 49.222 39.467 1.00 23.52 ? 267 TYR A CD1 1 ATOM 3871 C CD2 . TYR A 1 255 ? -3.034 51.086 39.352 1.00 32.84 ? 267 TYR A CD2 1 ATOM 3872 C CE1 . TYR A 1 255 ? -1.695 49.193 40.831 1.00 26.03 ? 267 TYR A CE1 1 ATOM 3873 C CE2 . TYR A 1 255 ? -3.168 51.069 40.725 1.00 32.03 ? 267 TYR A CE2 1 ATOM 3874 C CZ . TYR A 1 255 ? -2.485 50.128 41.457 1.00 28.87 ? 267 TYR A CZ 1 ATOM 3875 O OH . TYR A 1 255 ? -2.603 50.091 42.833 1.00 31.30 ? 267 TYR A OH 1 ATOM 3876 H H . TYR A 1 255 ? -1.326 50.293 34.885 1.00 23.28 ? 267 TYR A H 1 ATOM 3877 H HA . TYR A 1 255 ? -1.192 51.976 36.842 1.00 23.69 ? 267 TYR A HA 1 ATOM 3878 H HB2 . TYR A 1 255 ? -2.928 50.480 36.807 1.00 28.37 ? 267 TYR A HB2 1 ATOM 3879 H HB3 . TYR A 1 255 ? -1.928 49.251 36.893 1.00 28.37 ? 267 TYR A HB3 1 ATOM 3880 H HD1 . TYR A 1 255 ? -1.024 48.589 39.048 1.00 28.22 ? 267 TYR A HD1 1 ATOM 3881 H HD2 . TYR A 1 255 ? -3.492 51.723 38.854 1.00 39.40 ? 267 TYR A HD2 1 ATOM 3882 H HE1 . TYR A 1 255 ? -1.234 48.559 41.332 1.00 31.24 ? 267 TYR A HE1 1 ATOM 3883 H HE2 . TYR A 1 255 ? -3.706 51.697 41.152 1.00 38.43 ? 267 TYR A HE2 1 ATOM 3884 H HH . TYR A 1 255 ? -3.109 50.709 43.094 1.00 37.56 ? 267 TYR A HH 1 ATOM 3885 N N . TYR A 1 256 ? 1.005 49.656 37.019 1.00 17.53 ? 268 TYR A N 1 ATOM 3886 C CA . TYR A 1 256 ? 2.235 49.274 37.697 1.00 17.16 ? 268 TYR A CA 1 ATOM 3887 C C . TYR A 1 256 ? 3.404 50.153 37.292 1.00 15.71 ? 268 TYR A C 1 ATOM 3888 O O . TYR A 1 256 ? 4.273 50.446 38.108 1.00 16.99 ? 268 TYR A O 1 ATOM 3889 C CB . TYR A 1 256 ? 2.559 47.821 37.390 1.00 17.46 ? 268 TYR A CB 1 ATOM 3890 C CG . TYR A 1 256 ? 1.543 46.824 37.863 1.00 17.35 ? 268 TYR A CG 1 ATOM 3891 C CD1 . TYR A 1 256 ? 1.055 46.859 39.166 1.00 18.44 ? 268 TYR A CD1 1 ATOM 3892 C CD2 . TYR A 1 256 ? 1.126 45.802 37.019 1.00 15.85 ? 268 TYR A CD2 1 ATOM 3893 C CE1 . TYR A 1 256 ? 0.171 45.899 39.614 1.00 17.88 ? 268 TYR A CE1 1 ATOM 3894 C CE2 . TYR A 1 256 ? 0.228 44.825 37.456 1.00 21.33 ? 268 TYR A CE2 1 ATOM 3895 C CZ . TYR A 1 256 ? -0.254 44.902 38.750 1.00 20.88 ? 268 TYR A CZ 1 ATOM 3896 O OH . TYR A 1 256 ? -1.139 43.943 39.171 1.00 21.33 ? 268 TYR A OH 1 ATOM 3897 H H . TYR A 1 256 ? 0.773 49.140 36.372 1.00 21.04 ? 268 TYR A H 1 ATOM 3898 H HA . TYR A 1 256 ? 2.111 49.360 38.655 1.00 20.59 ? 268 TYR A HA 1 ATOM 3899 H HB2 . TYR A 1 256 ? 2.640 47.720 36.428 1.00 20.95 ? 268 TYR A HB2 1 ATOM 3900 H HB3 . TYR A 1 256 ? 3.404 47.598 37.811 1.00 20.95 ? 268 TYR A HB3 1 ATOM 3901 H HD1 . TYR A 1 256 ? 1.341 47.527 39.746 1.00 22.12 ? 268 TYR A HD1 1 ATOM 3902 H HD2 . TYR A 1 256 ? 1.459 45.761 36.152 1.00 19.02 ? 268 TYR A HD2 1 ATOM 3903 H HE1 . TYR A 1 256 ? -0.162 45.939 40.481 1.00 21.46 ? 268 TYR A HE1 1 ATOM 3904 H HE2 . TYR A 1 256 ? -0.058 44.152 36.881 1.00 25.60 ? 268 TYR A HE2 1 ATOM 3905 H HH . TYR A 1 256 ? -1.345 44.075 39.974 1.00 25.59 ? 268 TYR A HH 1 ATOM 3906 N N . ASN A 1 257 ? 3.490 50.522 36.021 1.00 16.18 ? 269 ASN A N 1 ATOM 3907 C CA . ASN A 1 257 ? 4.535 51.441 35.592 1.00 16.12 ? 269 ASN A CA 1 ATOM 3908 C C . ASN A 1 257 ? 4.470 52.743 36.396 1.00 18.56 ? 269 ASN A C 1 ATOM 3909 O O . ASN A 1 257 ? 5.482 53.207 36.946 1.00 19.09 ? 269 ASN A O 1 ATOM 3910 C CB . ASN A 1 257 ? 4.410 51.691 34.077 1.00 17.99 ? 269 ASN A CB 1 ATOM 3911 C CG . ASN A 1 257 ? 5.555 52.483 33.532 1.00 17.43 ? 269 ASN A CG 1 ATOM 3912 O OD1 . ASN A 1 257 ? 6.719 52.171 33.786 1.00 18.02 ? 269 ASN A OD1 1 ATOM 3913 N ND2 . ASN A 1 257 ? 5.242 53.543 32.798 1.00 18.22 ? 269 ASN A ND2 1 ATOM 3914 H H . ASN A 1 257 ? 2.963 50.259 35.394 1.00 19.42 ? 269 ASN A H 1 ATOM 3915 H HA . ASN A 1 257 ? 5.399 51.032 35.757 1.00 19.34 ? 269 ASN A HA 1 ATOM 3916 H HB2 . ASN A 1 257 ? 4.387 50.839 33.616 1.00 21.59 ? 269 ASN A HB2 1 ATOM 3917 H HB3 . ASN A 1 257 ? 3.593 52.186 33.904 1.00 21.59 ? 269 ASN A HB3 1 ATOM 3918 H HD21 . ASN A 1 257 ? 5.865 54.031 32.462 1.00 21.86 ? 269 ASN A HD21 1 ATOM 3919 H HD22 . ASN A 1 257 ? 4.417 53.741 32.659 1.00 21.86 ? 269 ASN A HD22 1 ATOM 3920 N N . GLU A 1 258 ? 3.272 53.327 36.531 1.00 17.03 ? 270 GLU A N 1 ATOM 3921 C CA . GLU A 1 258 ? 3.192 54.592 37.263 1.00 15.93 ? 270 GLU A CA 1 ATOM 3922 C C . GLU A 1 258 ? 3.625 54.406 38.719 1.00 16.59 ? 270 GLU A C 1 ATOM 3923 O O . GLU A 1 258 ? 4.354 55.240 39.270 1.00 18.13 ? 270 GLU A O 1 ATOM 3924 C CB . GLU A 1 258 ? 1.779 55.169 37.209 1.00 19.10 ? 270 GLU A CB 1 ATOM 3925 C CG . GLU A 1 258 ? 1.325 55.562 35.805 1.00 23.37 ? 270 GLU A CG 1 ATOM 3926 C CD . GLU A 1 258 ? 2.159 56.668 35.190 1.00 29.15 ? 270 GLU A CD 1 ATOM 3927 O OE1 . GLU A 1 258 ? 2.376 57.691 35.873 1.00 26.78 ? 270 GLU A OE1 1 ATOM 3928 O OE2 . GLU A 1 258 ? 2.609 56.505 34.029 1.00 25.37 ? 270 GLU A OE2 1 ATOM 3929 H H . GLU A 1 258 ? 2.527 53.027 36.225 1.00 20.44 ? 270 GLU A H 1 ATOM 3930 H HA . GLU A 1 258 ? 3.793 55.233 36.852 1.00 19.11 ? 270 GLU A HA 1 ATOM 3931 H HB2 . GLU A 1 258 ? 1.157 54.505 37.546 1.00 22.92 ? 270 GLU A HB2 1 ATOM 3932 H HB3 . GLU A 1 258 ? 1.744 55.964 37.764 1.00 22.92 ? 270 GLU A HB3 1 ATOM 3933 H HG2 . GLU A 1 258 ? 1.387 54.786 35.226 1.00 28.04 ? 270 GLU A HG2 1 ATOM 3934 H HG3 . GLU A 1 258 ? 0.406 55.870 35.847 1.00 28.04 ? 270 GLU A HG3 1 ATOM 3935 N N . LYS A 1 259 ? 3.180 53.317 39.341 1.00 17.14 ? 271 LYS A N 1 ATOM 3936 C CA . LYS A 1 259 ? 3.456 53.053 40.753 1.00 18.77 ? 271 LYS A CA 1 ATOM 3937 C C . LYS A 1 259 ? 4.938 52.774 40.978 1.00 21.57 ? 271 LYS A C 1 ATOM 3938 O O . LYS A 1 259 ? 5.555 53.299 41.915 1.00 19.06 ? 271 LYS A O 1 ATOM 3939 C CB . LYS A 1 259 ? 2.582 51.867 41.185 1.00 25.31 ? 271 LYS A CB 1 ATOM 3940 C CG . LYS A 1 259 ? 2.529 51.513 42.655 1.00 34.55 ? 271 LYS A CG 1 ATOM 3941 C CD . LYS A 1 259 ? 1.264 50.632 42.908 1.00 28.18 ? 271 LYS A CD 1 ATOM 3942 C CE . LYS A 1 259 ? 1.083 50.328 44.364 1.00 34.23 ? 271 LYS A CE 1 ATOM 3943 N NZ . LYS A 1 259 ? -0.130 49.492 44.548 1.00 32.30 ? 271 LYS A NZ 1 ATOM 3944 H H . LYS A 1 259 ? 2.709 52.705 38.961 1.00 20.57 ? 271 LYS A H 1 ATOM 3945 H HA . LYS A 1 259 ? 3.206 53.827 41.281 1.00 22.52 ? 271 LYS A HA 1 ATOM 3946 H HB2 . LYS A 1 259 ? 1.671 52.053 40.908 1.00 30.37 ? 271 LYS A HB2 1 ATOM 3947 H HB3 . LYS A 1 259 ? 2.899 51.079 40.717 1.00 30.37 ? 271 LYS A HB3 1 ATOM 3948 H HG2 . LYS A 1 259 ? 3.318 51.005 42.900 1.00 41.46 ? 271 LYS A HG2 1 ATOM 3949 H HG3 . LYS A 1 259 ? 2.459 52.321 43.187 1.00 41.46 ? 271 LYS A HG3 1 ATOM 3950 H HD2 . LYS A 1 259 ? 0.477 51.106 42.597 1.00 33.81 ? 271 LYS A HD2 1 ATOM 3951 H HD3 . LYS A 1 259 ? 1.359 49.792 42.432 1.00 33.81 ? 271 LYS A HD3 1 ATOM 3952 H HE2 . LYS A 1 259 ? 1.852 49.836 44.692 1.00 41.07 ? 271 LYS A HE2 1 ATOM 3953 H HE3 . LYS A 1 259 ? 0.969 51.154 44.858 1.00 41.07 ? 271 LYS A HE3 1 ATOM 3954 H HZ1 . LYS A 1 259 ? -0.243 49.308 45.412 1.00 38.76 ? 271 LYS A HZ1 1 ATOM 3955 H HZ2 . LYS A 1 259 ? -0.846 49.927 44.249 1.00 38.76 ? 271 LYS A HZ2 1 ATOM 3956 H HZ3 . LYS A 1 259 ? -0.045 48.729 44.098 1.00 38.76 ? 271 LYS A HZ3 1 ATOM 3957 N N . LEU A 1 260 ? 5.542 51.992 40.095 1.00 19.49 ? 272 LEU A N 1 ATOM 3958 C CA . LEU A 1 260 ? 6.954 51.680 40.254 1.00 16.33 ? 272 LEU A CA 1 ATOM 3959 C C . LEU A 1 260 ? 7.823 52.911 40.018 1.00 15.61 ? 272 LEU A C 1 ATOM 3960 O O . LEU A 1 260 ? 8.792 53.160 40.745 1.00 18.69 ? 272 LEU A O 1 ATOM 3961 C CB . LEU A 1 260 ? 7.312 50.535 39.309 1.00 18.37 ? 272 LEU A CB 1 ATOM 3962 C CG . LEU A 1 260 ? 8.655 49.879 39.480 1.00 19.64 ? 272 LEU A CG 1 ATOM 3963 C CD1 . LEU A 1 260 ? 8.940 49.524 40.975 1.00 21.55 ? 272 LEU A CD1 1 ATOM 3964 C CD2 . LEU A 1 260 ? 8.699 48.624 38.601 1.00 17.33 ? 272 LEU A CD2 1 ATOM 3965 H H . LEU A 1 260 ? 5.167 51.635 39.408 1.00 23.39 ? 272 LEU A H 1 ATOM 3966 H HA . LEU A 1 260 ? 7.108 51.377 41.162 1.00 19.59 ? 272 LEU A HA 1 ATOM 3967 H HB2 . LEU A 1 260 ? 6.643 49.840 39.415 1.00 22.05 ? 272 LEU A HB2 1 ATOM 3968 H HB3 . LEU A 1 260 ? 7.276 50.874 38.401 1.00 22.05 ? 272 LEU A HB3 1 ATOM 3969 H HG . LEU A 1 260 ? 9.347 50.487 39.175 1.00 23.57 ? 272 LEU A HG 1 ATOM 3970 H HD11 . LEU A 1 260 ? 9.813 49.105 41.039 1.00 25.86 ? 272 LEU A HD11 1 ATOM 3971 H HD12 . LEU A 1 260 ? 8.925 50.339 41.502 1.00 25.86 ? 272 LEU A HD12 1 ATOM 3972 H HD13 . LEU A 1 260 ? 8.256 48.913 41.291 1.00 25.86 ? 272 LEU A HD13 1 ATOM 3973 H HD21 . LEU A 1 260 ? 9.563 48.196 38.706 1.00 20.80 ? 272 LEU A HD21 1 ATOM 3974 H HD22 . LEU A 1 260 ? 7.994 48.019 38.880 1.00 20.80 ? 272 LEU A HD22 1 ATOM 3975 H HD23 . LEU A 1 260 ? 8.567 48.882 37.675 1.00 20.80 ? 272 LEU A HD23 1 ATOM 3976 N N . LEU A 1 261 ? 7.474 53.722 39.027 1.00 14.72 ? 273 LEU A N 1 ATOM 3977 C CA . LEU A 1 261 ? 8.241 54.917 38.750 1.00 16.54 ? 273 LEU A CA 1 ATOM 3978 C C . LEU A 1 261 ? 8.176 55.897 39.910 1.00 16.99 ? 273 LEU A C 1 ATOM 3979 O O . LEU A 1 261 ? 9.152 56.602 40.185 1.00 18.41 ? 273 LEU A O 1 ATOM 3980 C CB . LEU A 1 261 ? 7.747 55.559 37.472 1.00 19.79 ? 273 LEU A CB 1 ATOM 3981 C CG . LEU A 1 261 ? 8.119 54.784 36.199 1.00 17.78 ? 273 LEU A CG 1 ATOM 3982 C CD1 . LEU A 1 261 ? 7.491 55.464 34.986 1.00 17.07 ? 273 LEU A CD1 1 ATOM 3983 C CD2 . LEU A 1 261 ? 9.624 54.717 36.017 1.00 17.40 ? 273 LEU A CD2 1 ATOM 3984 H H . LEU A 1 261 ? 6.801 53.599 38.505 1.00 17.67 ? 273 LEU A H 1 ATOM 3985 H HA . LEU A 1 261 ? 9.171 54.671 38.620 1.00 19.84 ? 273 LEU A HA 1 ATOM 3986 H HB2 . LEU A 1 261 ? 6.780 55.621 37.508 1.00 23.74 ? 273 LEU A HB2 1 ATOM 3987 H HB3 . LEU A 1 261 ? 8.131 56.447 37.400 1.00 23.74 ? 273 LEU A HB3 1 ATOM 3988 H HG . LEU A 1 261 ? 7.775 53.879 36.257 1.00 21.34 ? 273 LEU A HG 1 ATOM 3989 H HD11 . LEU A 1 261 ? 7.731 54.969 34.187 1.00 20.48 ? 273 LEU A HD11 1 ATOM 3990 H HD12 . LEU A 1 261 ? 6.527 55.473 35.094 1.00 20.48 ? 273 LEU A HD12 1 ATOM 3991 H HD13 . LEU A 1 261 ? 7.826 56.373 34.926 1.00 20.48 ? 273 LEU A HD13 1 ATOM 3992 H HD21 . LEU A 1 261 ? 9.823 54.223 35.207 1.00 20.88 ? 273 LEU A HD21 1 ATOM 3993 H HD22 . LEU A 1 261 ? 9.974 55.619 35.949 1.00 20.88 ? 273 LEU A HD22 1 ATOM 3994 H HD23 . LEU A 1 261 ? 10.014 54.268 36.783 1.00 20.88 ? 273 LEU A HD23 1 ATOM 3995 N N . ASP A 1 262 ? 7.032 55.989 40.588 1.00 19.17 ? 274 ASP A N 1 ATOM 3996 C CA . ASP A 1 262 ? 6.971 56.924 41.710 1.00 23.95 ? 274 ASP A CA 1 ATOM 3997 C C . ASP A 1 262 ? 7.907 56.487 42.844 1.00 21.90 ? 274 ASP A C 1 ATOM 3998 O O . ASP A 1 262 ? 8.583 57.327 43.454 1.00 21.59 ? 274 ASP A O 1 ATOM 3999 C CB . ASP A 1 262 ? 5.545 57.090 42.212 1.00 23.52 ? 274 ASP A CB 1 ATOM 4000 C CG . ASP A 1 262 ? 5.388 58.357 43.089 1.00 33.59 ? 274 ASP A CG 1 ATOM 4001 O OD1 . ASP A 1 262 ? 5.546 59.492 42.566 1.00 32.95 ? 274 ASP A OD1 1 ATOM 4002 O OD2 . ASP A 1 262 ? 5.149 58.206 44.294 1.00 33.12 ? 274 ASP A OD2 1 ATOM 4003 H H . ASP A 1 262 ? 6.312 55.546 40.430 1.00 23.01 ? 274 ASP A H 1 ATOM 4004 H HA . ASP A 1 262 ? 7.274 57.792 41.402 1.00 28.74 ? 274 ASP A HA 1 ATOM 4005 H HB2 . ASP A 1 262 ? 4.946 57.172 41.453 1.00 28.23 ? 274 ASP A HB2 1 ATOM 4006 H HB3 . ASP A 1 262 ? 5.303 56.319 42.748 1.00 28.23 ? 274 ASP A HB3 1 ATOM 4007 N N . ILE A 1 263 ? 8.009 55.180 43.096 1.00 17.49 ? 275 ILE A N 1 ATOM 4008 C CA . ILE A 1 263 ? 8.984 54.678 44.070 1.00 19.27 ? 275 ILE A CA 1 ATOM 4009 C C . ILE A 1 263 ? 10.395 55.048 43.633 1.00 19.56 ? 275 ILE A C 1 ATOM 4010 O O . ILE A 1 263 ? 11.210 55.559 44.417 1.00 20.15 ? 275 ILE A O 1 ATOM 4011 C CB . ILE A 1 263 ? 8.833 53.160 44.255 1.00 22.75 ? 275 ILE A CB 1 ATOM 4012 C CG1 . ILE A 1 263 ? 7.502 52.839 44.914 1.00 19.40 ? 275 ILE A CG1 1 ATOM 4013 C CG2 . ILE A 1 263 ? 9.952 52.614 45.103 1.00 23.18 ? 275 ILE A CG2 1 ATOM 4014 C CD1 . ILE A 1 263 ? 7.110 51.393 44.836 1.00 21.58 ? 275 ILE A CD1 1 ATOM 4015 H H . ILE A 1 263 ? 7.532 54.570 42.722 1.00 20.98 ? 275 ILE A H 1 ATOM 4016 H HA . ILE A 1 263 ? 8.817 55.100 44.927 1.00 23.12 ? 275 ILE A HA 1 ATOM 4017 H HB . ILE A 1 263 ? 8.863 52.734 43.384 1.00 27.30 ? 275 ILE A HB 1 ATOM 4018 H HG12 . ILE A 1 263 ? 7.552 53.082 45.852 1.00 23.28 ? 275 ILE A HG12 1 ATOM 4019 H HG13 . ILE A 1 263 ? 6.806 53.357 44.479 1.00 23.28 ? 275 ILE A HG13 1 ATOM 4020 H HG21 . ILE A 1 263 ? 9.833 51.657 45.203 1.00 27.82 ? 275 ILE A HG21 1 ATOM 4021 H HG22 . ILE A 1 263 ? 10.798 52.799 44.666 1.00 27.82 ? 275 ILE A HG22 1 ATOM 4022 H HG23 . ILE A 1 263 ? 9.927 53.044 45.972 1.00 27.82 ? 275 ILE A HG23 1 ATOM 4023 H HD11 . ILE A 1 263 ? 6.254 51.274 45.277 1.00 25.90 ? 275 ILE A HD11 1 ATOM 4024 H HD12 . ILE A 1 263 ? 7.040 51.134 43.904 1.00 25.90 ? 275 ILE A HD12 1 ATOM 4025 H HD13 . ILE A 1 263 ? 7.787 50.858 45.279 1.00 25.90 ? 275 ILE A HD13 1 ATOM 4026 N N . PHE A 1 264 ? 10.718 54.788 42.364 1.00 15.75 ? 276 PHE A N 1 ATOM 4027 C CA . PHE A 1 264 ? 12.056 55.104 41.882 1.00 15.56 ? 276 PHE A CA 1 ATOM 4028 C C . PHE A 1 264 ? 12.371 56.598 41.980 1.00 20.02 ? 276 PHE A C 1 ATOM 4029 O O . PHE A 1 264 ? 13.508 56.971 42.286 1.00 22.20 ? 276 PHE A O 1 ATOM 4030 C CB . PHE A 1 264 ? 12.240 54.633 40.440 1.00 18.72 ? 276 PHE A CB 1 ATOM 4031 C CG . PHE A 1 264 ? 12.274 53.140 40.256 1.00 16.29 ? 276 PHE A CG 1 ATOM 4032 C CD1 . PHE A 1 264 ? 12.396 52.265 41.325 1.00 15.65 ? 276 PHE A CD1 1 ATOM 4033 C CD2 . PHE A 1 264 ? 12.156 52.613 38.970 1.00 18.16 ? 276 PHE A CD2 1 ATOM 4034 C CE1 . PHE A 1 264 ? 12.440 50.858 41.104 1.00 18.78 ? 276 PHE A CE1 1 ATOM 4035 C CE2 . PHE A 1 264 ? 12.176 51.218 38.762 1.00 15.72 ? 276 PHE A CE2 1 ATOM 4036 C CZ . PHE A 1 264 ? 12.298 50.358 39.832 1.00 16.57 ? 276 PHE A CZ 1 ATOM 4037 H H . PHE A 1 264 ? 10.193 54.439 41.779 1.00 18.91 ? 276 PHE A H 1 ATOM 4038 H HA . PHE A 1 264 ? 12.701 54.631 42.430 1.00 18.67 ? 276 PHE A HA 1 ATOM 4039 H HB2 . PHE A 1 264 ? 11.505 54.977 39.908 1.00 22.47 ? 276 PHE A HB2 1 ATOM 4040 H HB3 . PHE A 1 264 ? 13.078 54.988 40.104 1.00 22.47 ? 276 PHE A HB3 1 ATOM 4041 H HD1 . PHE A 1 264 ? 12.482 52.600 42.188 1.00 18.78 ? 276 PHE A HD1 1 ATOM 4042 H HD2 . PHE A 1 264 ? 12.063 53.186 38.243 1.00 21.80 ? 276 PHE A HD2 1 ATOM 4043 H HE1 . PHE A 1 264 ? 12.517 50.277 41.826 1.00 22.54 ? 276 PHE A HE1 1 ATOM 4044 H HE2 . PHE A 1 264 ? 12.097 50.878 37.900 1.00 18.87 ? 276 PHE A HE2 1 ATOM 4045 H HZ . PHE A 1 264 ? 12.324 49.439 39.689 1.00 19.88 ? 276 PHE A HZ 1 ATOM 4046 N N . ARG A 1 265 ? 11.394 57.475 41.698 1.00 17.91 ? 277 ARG A N 1 ATOM 4047 C CA . ARG A 1 265 ? 11.673 58.908 41.778 1.00 20.07 ? 277 ARG A CA 1 ATOM 4048 C C . ARG A 1 265 ? 11.951 59.301 43.223 1.00 17.72 ? 277 ARG A C 1 ATOM 4049 O O . ARG A 1 265 ? 12.906 60.043 43.511 1.00 21.75 ? 277 ARG A O 1 ATOM 4050 C CB . ARG A 1 265 ? 10.488 59.728 41.218 1.00 20.36 ? 277 ARG A CB 1 ATOM 4051 C CG . ARG A 1 265 ? 10.338 59.707 39.698 1.00 21.03 ? 277 ARG A CG 1 ATOM 4052 C CD . ARG A 1 265 ? 9.329 60.694 39.165 1.00 21.18 ? 277 ARG A CD 1 ATOM 4053 N NE . ARG A 1 265 ? 8.009 60.421 39.693 1.00 24.74 ? 277 ARG A NE 1 ATOM 4054 C CZ . ARG A 1 265 ? 7.045 59.771 39.058 1.00 25.01 ? 277 ARG A CZ 1 ATOM 4055 N NH1 . ARG A 1 265 ? 7.225 59.339 37.832 1.00 22.64 ? 277 ARG A NH1 1 ATOM 4056 N NH2 . ARG A 1 265 ? 5.878 59.595 39.642 1.00 23.42 ? 277 ARG A NH2 1 ATOM 4057 H H . ARG A 1 265 ? 10.591 57.272 41.466 1.00 21.50 ? 277 ARG A H 1 ATOM 4058 H HA . ARG A 1 265 ? 12.461 59.112 41.250 1.00 24.09 ? 277 ARG A HA 1 ATOM 4059 H HB2 . ARG A 1 265 ? 9.667 59.378 41.597 1.00 24.43 ? 277 ARG A HB2 1 ATOM 4060 H HB3 . ARG A 1 265 ? 10.601 60.653 41.487 1.00 24.43 ? 277 ARG A HB3 1 ATOM 4061 H HG2 . ARG A 1 265 ? 11.196 59.916 39.298 1.00 25.24 ? 277 ARG A HG2 1 ATOM 4062 H HG3 . ARG A 1 265 ? 10.056 58.820 39.425 1.00 25.24 ? 277 ARG A HG3 1 ATOM 4063 H HD2 . ARG A 1 265 ? 9.585 61.591 39.431 1.00 25.42 ? 277 ARG A HD2 1 ATOM 4064 H HD3 . ARG A 1 265 ? 9.292 60.626 38.198 1.00 25.42 ? 277 ARG A HD3 1 ATOM 4065 H HE . ARG A 1 265 ? 7.836 60.705 40.486 1.00 29.69 ? 277 ARG A HE 1 ATOM 4066 H HH11 . ARG A 1 265 ? 7.982 59.456 37.442 1.00 27.16 ? 277 ARG A HH11 1 ATOM 4067 H HH12 . ARG A 1 265 ? 6.592 58.923 37.426 1.00 27.16 ? 277 ARG A HH12 1 ATOM 4068 H HH21 . ARG A 1 265 ? 5.751 59.881 40.443 1.00 28.10 ? 277 ARG A HH21 1 ATOM 4069 H HH22 . ARG A 1 265 ? 5.249 59.178 39.230 1.00 28.10 ? 277 ARG A HH22 1 ATOM 4070 N N . ARG A 1 266 ? 11.174 58.756 44.138 1.00 18.76 ? 278 ARG A N 1 ATOM 4071 C CA . ARG A 1 266 ? 11.352 59.095 45.545 1.00 25.75 ? 278 ARG A CA 1 ATOM 4072 C C . ARG A 1 266 ? 12.706 58.625 46.071 1.00 34.22 ? 278 ARG A C 1 ATOM 4073 O O . ARG A 1 266 ? 13.321 59.309 46.902 1.00 28.92 ? 278 ARG A O 1 ATOM 4074 C CB . ARG A 1 266 ? 10.201 58.511 46.334 1.00 21.37 ? 278 ARG A CB 1 ATOM 4075 C CG . ARG A 1 266 ? 8.883 59.232 46.082 1.00 33.81 ? 278 ARG A CG 1 ATOM 4076 C CD . ARG A 1 266 ? 7.715 58.458 46.645 1.00 32.05 ? 278 ARG A CD 1 ATOM 4077 N NE . ARG A 1 266 ? 8.084 57.964 47.949 1.00 42.72 ? 278 ARG A NE 1 ATOM 4078 C CZ . ARG A 1 266 ? 7.810 56.755 48.395 1.00 41.29 ? 278 ARG A CZ 1 ATOM 4079 N NH1 . ARG A 1 266 ? 7.135 55.889 47.641 1.00 41.01 ? 278 ARG A NH1 1 ATOM 4080 N NH2 . ARG A 1 266 ? 8.216 56.423 49.617 1.00 60.54 ? 278 ARG A NH2 1 ATOM 4081 H H . ARG A 1 266 ? 10.543 58.193 43.980 1.00 22.51 ? 278 ARG A H 1 ATOM 4082 H HA . ARG A 1 266 ? 11.317 60.060 45.640 1.00 30.90 ? 278 ARG A HA 1 ATOM 4083 H HB2 . ARG A 1 266 ? 10.086 57.581 46.082 1.00 25.64 ? 278 ARG A HB2 1 ATOM 4084 H HB3 . ARG A 1 266 ? 10.402 58.576 47.280 1.00 25.64 ? 278 ARG A HB3 1 ATOM 4085 H HG2 . ARG A 1 266 ? 8.907 60.102 46.511 1.00 40.57 ? 278 ARG A HG2 1 ATOM 4086 H HG3 . ARG A 1 266 ? 8.750 59.332 45.127 1.00 40.57 ? 278 ARG A HG3 1 ATOM 4087 H HD2 . ARG A 1 266 ? 6.946 59.041 46.736 1.00 38.46 ? 278 ARG A HD2 1 ATOM 4088 H HD3 . ARG A 1 266 ? 7.512 57.703 46.070 1.00 38.46 ? 278 ARG A HD3 1 ATOM 4089 H HE . ARG A 1 266 ? 8.513 58.496 48.472 1.00 51.26 ? 278 ARG A HE 1 ATOM 4090 H HH11 . ARG A 1 266 ? 6.878 56.114 46.852 1.00 49.22 ? 278 ARG A HH11 1 ATOM 4091 H HH12 . ARG A 1 266 ? 6.958 55.103 47.942 1.00 49.22 ? 278 ARG A HH12 1 ATOM 4092 H HH21 . ARG A 1 266 ? 8.648 56.991 50.096 1.00 72.65 ? 278 ARG A HH21 1 ATOM 4093 H HH22 . ARG A 1 266 ? 8.043 55.641 49.929 1.00 72.65 ? 278 ARG A HH22 1 ATOM 4094 N N . TYR A 1 267 ? 13.231 57.516 45.542 1.00 22.78 ? 279 TYR A N 1 ATOM 4095 C CA . TYR A 1 267 ? 14.514 56.972 45.989 1.00 22.82 ? 279 TYR A CA 1 ATOM 4096 C C . TYR A 1 267 ? 15.626 57.132 44.962 1.00 24.21 ? 279 TYR A C 1 ATOM 4097 O O . TYR A 1 267 ? 16.621 56.397 44.998 1.00 24.07 ? 279 TYR A O 1 ATOM 4098 C CB . TYR A 1 267 ? 14.347 55.509 46.365 1.00 22.78 ? 279 TYR A CB 1 ATOM 4099 C CG . TYR A 1 267 ? 13.543 55.335 47.617 1.00 24.11 ? 279 TYR A CG 1 ATOM 4100 C CD1 . TYR A 1 267 ? 14.128 55.570 48.865 1.00 26.74 ? 279 TYR A CD1 1 ATOM 4101 C CD2 . TYR A 1 267 ? 12.219 54.940 47.567 1.00 24.50 ? 279 TYR A CD2 1 ATOM 4102 C CE1 . TYR A 1 267 ? 13.427 55.416 49.998 1.00 25.17 ? 279 TYR A CE1 1 ATOM 4103 C CE2 . TYR A 1 267 ? 11.487 54.776 48.719 1.00 31.72 ? 279 TYR A CE2 1 ATOM 4104 C CZ . TYR A 1 267 ? 12.113 55.016 49.942 1.00 33.69 ? 279 TYR A CZ 1 ATOM 4105 O OH . TYR A 1 267 ? 11.407 54.862 51.104 1.00 32.11 ? 279 TYR A OH 1 ATOM 4106 H H . TYR A 1 267 ? 12.858 57.057 44.918 1.00 27.33 ? 279 TYR A H 1 ATOM 4107 H HA . TYR A 1 267 ? 14.787 57.449 46.788 1.00 27.39 ? 279 TYR A HA 1 ATOM 4108 H HB2 . TYR A 1 267 ? 13.890 55.046 45.646 1.00 27.33 ? 279 TYR A HB2 1 ATOM 4109 H HB3 . TYR A 1 267 ? 15.222 55.117 46.512 1.00 27.33 ? 279 TYR A HB3 1 ATOM 4110 H HD1 . TYR A 1 267 ? 15.018 55.836 48.910 1.00 32.09 ? 279 TYR A HD1 1 ATOM 4111 H HD2 . TYR A 1 267 ? 11.820 54.779 46.743 1.00 29.40 ? 279 TYR A HD2 1 ATOM 4112 H HE1 . TYR A 1 267 ? 13.831 55.574 50.820 1.00 30.20 ? 279 TYR A HE1 1 ATOM 4113 H HE2 . TYR A 1 267 ? 10.597 54.508 48.683 1.00 38.07 ? 279 TYR A HE2 1 ATOM 4114 H HH . TYR A 1 267 ? 10.623 54.616 50.933 1.00 38.53 ? 279 TYR A HH 1 ATOM 4115 N N . SER A 1 268 ? 15.521 58.132 44.086 1.00 20.29 ? 280 SER A N 1 ATOM 4116 C CA . SER A 1 268 ? 16.546 58.339 43.077 1.00 20.31 ? 280 SER A CA 1 ATOM 4117 C C . SER A 1 268 ? 17.901 58.658 43.691 1.00 25.18 ? 280 SER A C 1 ATOM 4118 O O . SER A 1 268 ? 18.928 58.410 43.051 1.00 24.46 ? 280 SER A O 1 ATOM 4119 C CB . SER A 1 268 ? 16.118 59.445 42.095 1.00 20.95 ? 280 SER A CB 1 ATOM 4120 O OG . SER A 1 268 ? 15.354 58.902 41.014 1.00 28.94 ? 280 SER A OG 1 ATOM 4121 H H . SER A 1 268 ? 14.873 58.697 44.059 1.00 24.35 ? 280 SER A H 1 ATOM 4122 H HA . SER A 1 268 ? 16.644 57.519 42.567 1.00 24.37 ? 280 SER A HA 1 ATOM 4123 H HB2 . SER A 1 268 ? 15.576 60.095 42.569 1.00 25.14 ? 280 SER A HB2 1 ATOM 4124 H HB3 . SER A 1 268 ? 16.911 59.872 41.737 1.00 25.14 ? 280 SER A HB3 1 ATOM 4125 H HG . SER A 1 268 ? 14.663 58.528 41.311 1.00 34.73 ? 280 SER A HG 1 ATOM 4126 N N . SER A 1 269 ? 17.949 59.193 44.921 1.00 23.37 ? 281 SER A N 1 ATOM 4127 C CA . SER A 1 269 ? 19.252 59.497 45.511 1.00 24.51 ? 281 SER A CA 1 ATOM 4128 C C . SER A 1 269 ? 20.005 58.244 45.946 1.00 23.19 ? 281 SER A C 1 ATOM 4129 O O . SER A 1 269 ? 21.226 58.292 46.098 1.00 27.60 ? 281 SER A O 1 ATOM 4130 C CB . SER A 1 269 ? 19.080 60.419 46.723 1.00 27.37 ? 281 SER A CB 1 ATOM 4131 O OG . SER A 1 269 ? 18.387 59.706 47.708 1.00 27.69 ? 281 SER A OG 1 ATOM 4132 H H . SER A 1 269 ? 17.269 59.382 45.413 1.00 28.05 ? 281 SER A H 1 ATOM 4133 H HA . SER A 1 269 ? 19.795 59.961 44.855 1.00 29.41 ? 281 SER A HA 1 ATOM 4134 H HB2 . SER A 1 269 ? 19.952 60.678 47.061 1.00 32.84 ? 281 SER A HB2 1 ATOM 4135 H HB3 . SER A 1 269 ? 18.568 61.202 46.466 1.00 32.84 ? 281 SER A HB3 1 ATOM 4136 H HG . SER A 1 269 ? 18.277 60.187 48.388 1.00 33.23 ? 281 SER A HG 1 ATOM 4137 N N . VAL A 1 270 ? 19.299 57.141 46.161 1.00 20.24 ? 282 VAL A N 1 ATOM 4138 C CA . VAL A 1 270 ? 19.889 55.872 46.572 1.00 20.03 ? 282 VAL A CA 1 ATOM 4139 C C . VAL A 1 270 ? 20.172 54.968 45.379 1.00 25.18 ? 282 VAL A C 1 ATOM 4140 O O . VAL A 1 270 ? 21.064 54.114 45.442 1.00 23.07 ? 282 VAL A O 1 ATOM 4141 C CB . VAL A 1 270 ? 18.926 55.172 47.543 1.00 26.90 ? 282 VAL A CB 1 ATOM 4142 C CG1 . VAL A 1 270 ? 19.326 53.747 47.799 1.00 30.28 ? 282 VAL A CG1 1 ATOM 4143 C CG2 . VAL A 1 270 ? 18.844 55.950 48.860 1.00 42.06 ? 282 VAL A CG2 1 ATOM 4144 H H . VAL A 1 270 ? 18.445 57.102 46.072 1.00 24.29 ? 282 VAL A H 1 ATOM 4145 H HA . VAL A 1 270 ? 20.725 56.039 47.036 1.00 24.03 ? 282 VAL A HA 1 ATOM 4146 H HB . VAL A 1 270 ? 18.040 55.164 47.150 1.00 32.28 ? 282 VAL A HB 1 ATOM 4147 H HG11 . VAL A 1 270 ? 18.692 53.347 48.415 1.00 36.33 ? 282 VAL A HG11 1 ATOM 4148 H HG12 . VAL A 1 270 ? 19.322 53.263 46.959 1.00 36.33 ? 282 VAL A HG12 1 ATOM 4149 H HG13 . VAL A 1 270 ? 20.216 53.733 48.185 1.00 36.33 ? 282 VAL A HG13 1 ATOM 4150 H HG21 . VAL A 1 270 ? 18.232 55.493 49.458 1.00 50.47 ? 282 VAL A HG21 1 ATOM 4151 H HG22 . VAL A 1 270 ? 19.728 55.991 49.258 1.00 50.47 ? 282 VAL A HG22 1 ATOM 4152 H HG23 . VAL A 1 270 ? 18.521 56.846 48.677 1.00 50.47 ? 282 VAL A HG23 1 ATOM 4153 N N . ILE A 1 271 ? 19.363 55.077 44.334 1.00 19.77 ? 283 ILE A N 1 ATOM 4154 C CA . ILE A 1 271 ? 19.449 54.165 43.190 1.00 20.49 ? 283 ILE A CA 1 ATOM 4155 C C . ILE A 1 271 ? 20.501 54.696 42.224 1.00 18.10 ? 283 ILE A C 1 ATOM 4156 O O . ILE A 1 271 ? 20.354 55.773 41.638 1.00 19.44 ? 283 ILE A O 1 ATOM 4157 C CB . ILE A 1 271 ? 18.082 53.995 42.513 1.00 15.76 ? 283 ILE A CB 1 ATOM 4158 C CG1 . ILE A 1 271 ? 17.097 53.332 43.457 1.00 19.38 ? 283 ILE A CG1 1 ATOM 4159 C CG2 . ILE A 1 271 ? 18.226 53.116 41.276 1.00 15.24 ? 283 ILE A CG2 1 ATOM 4160 C CD1 . ILE A 1 271 ? 15.637 53.460 43.025 1.00 20.41 ? 283 ILE A CD1 1 ATOM 4161 H H . ILE A 1 271 ? 18.749 55.674 44.258 1.00 23.73 ? 283 ILE A H 1 ATOM 4162 H HA . ILE A 1 271 ? 19.740 53.293 43.500 1.00 24.59 ? 283 ILE A HA 1 ATOM 4163 H HB . ILE A 1 271 ? 17.742 54.865 42.252 1.00 18.91 ? 283 ILE A HB 1 ATOM 4164 H HG12 . ILE A 1 271 ? 17.307 52.386 43.513 1.00 23.26 ? 283 ILE A HG12 1 ATOM 4165 H HG13 . ILE A 1 271 ? 17.182 53.739 44.334 1.00 23.26 ? 283 ILE A HG13 1 ATOM 4166 H HG21 . ILE A 1 271 ? 17.357 53.016 40.857 1.00 18.29 ? 283 ILE A HG21 1 ATOM 4167 H HG22 . ILE A 1 271 ? 18.845 53.538 40.659 1.00 18.29 ? 283 ILE A HG22 1 ATOM 4168 H HG23 . ILE A 1 271 ? 18.567 52.248 41.544 1.00 18.29 ? 283 ILE A HG23 1 ATOM 4169 H HD11 . ILE A 1 271 ? 15.075 53.012 43.676 1.00 24.49 ? 283 ILE A HD11 1 ATOM 4170 H HD12 . ILE A 1 271 ? 15.404 54.400 42.976 1.00 24.49 ? 283 ILE A HD12 1 ATOM 4171 H HD13 . ILE A 1 271 ? 15.529 53.046 42.154 1.00 24.49 ? 283 ILE A HD13 1 ATOM 4172 N N . ALA A 1 272 ? 21.597 53.944 42.072 1.00 17.73 ? 284 ALA A N 1 ATOM 4173 C CA . ALA A 1 272 ? 22.712 54.377 41.256 1.00 16.23 ? 284 ALA A CA 1 ATOM 4174 C C . ALA A 1 272 ? 22.692 53.760 39.877 1.00 17.49 ? 284 ALA A C 1 ATOM 4175 O O . ALA A 1 272 ? 23.557 54.092 39.049 1.00 17.81 ? 284 ALA A O 1 ATOM 4176 C CB . ALA A 1 272 ? 24.046 54.031 41.931 1.00 18.82 ? 284 ALA A CB 1 ATOM 4177 H H . ALA A 1 272 ? 21.710 53.174 42.438 1.00 21.27 ? 284 ALA A H 1 ATOM 4178 H HA . ALA A 1 272 ? 22.670 55.341 41.152 1.00 19.48 ? 284 ALA A HA 1 ATOM 4179 H HB1 . ALA A 1 272 ? 24.774 54.331 41.364 1.00 22.58 ? 284 ALA A HB1 1 ATOM 4180 H HB2 . ALA A 1 272 ? 24.090 54.477 42.791 1.00 22.58 ? 284 ALA A HB2 1 ATOM 4181 H HB3 . ALA A 1 272 ? 24.098 53.070 42.054 1.00 22.58 ? 284 ALA A HB3 1 ATOM 4182 N N . GLY A 1 273 ? 21.757 52.859 39.633 1.00 17.69 ? 285 GLY A N 1 ATOM 4183 C CA . GLY A 1 273 ? 21.615 52.292 38.307 1.00 17.17 ? 285 GLY A CA 1 ATOM 4184 C C . GLY A 1 273 ? 20.377 51.429 38.237 1.00 15.08 ? 285 GLY A C 1 ATOM 4185 O O . GLY A 1 273 ? 19.973 50.822 39.228 1.00 15.15 ? 285 GLY A O 1 ATOM 4186 H H . GLY A 1 273 ? 21.196 52.561 40.213 1.00 21.23 ? 285 GLY A H 1 ATOM 4187 H HA2 . GLY A 1 273 ? 21.541 53.001 37.650 1.00 20.60 ? 285 GLY A HA2 1 ATOM 4188 H HA3 . GLY A 1 273 ? 22.390 51.747 38.095 1.00 20.60 ? 285 GLY A HA3 1 ATOM 4189 N N . GLN A 1 274 ? 19.810 51.323 37.035 1.00 14.36 ? 286 GLN A N 1 ATOM 4190 C CA . GLN A 1 274 ? 18.754 50.380 36.720 1.00 12.61 ? 286 GLN A CA 1 ATOM 4191 C C . GLN A 1 274 ? 19.123 49.641 35.450 1.00 13.32 ? 286 GLN A C 1 ATOM 4192 O O . GLN A 1 274 ? 19.565 50.272 34.482 1.00 14.15 ? 286 GLN A O 1 ATOM 4193 C CB . GLN A 1 274 ? 17.416 51.076 36.453 1.00 13.90 ? 286 GLN A CB 1 ATOM 4194 C CG . GLN A 1 274 ? 16.922 51.840 37.640 1.00 17.94 ? 286 GLN A CG 1 ATOM 4195 C CD . GLN A 1 274 ? 15.603 52.505 37.372 1.00 18.34 ? 286 GLN A CD 1 ATOM 4196 O OE1 . GLN A 1 274 ? 14.682 51.918 36.775 1.00 18.77 ? 286 GLN A OE1 1 ATOM 4197 N NE2 . GLN A 1 274 ? 15.494 53.763 37.800 1.00 19.45 ? 286 GLN A NE2 1 ATOM 4198 H H . GLN A 1 274 ? 20.035 51.810 36.363 1.00 17.23 ? 286 GLN A H 1 ATOM 4199 H HA . GLN A 1 274 ? 18.645 49.742 37.442 1.00 15.13 ? 286 GLN A HA 1 ATOM 4200 H HB2 . GLN A 1 274 ? 17.524 51.700 35.718 1.00 16.68 ? 286 GLN A HB2 1 ATOM 4201 H HB3 . GLN A 1 274 ? 16.750 50.408 36.227 1.00 16.68 ? 286 GLN A HB3 1 ATOM 4202 H HG2 . GLN A 1 274 ? 16.807 51.231 38.386 1.00 21.53 ? 286 GLN A HG2 1 ATOM 4203 H HG3 . GLN A 1 274 ? 17.566 52.529 37.867 1.00 21.53 ? 286 GLN A HG3 1 ATOM 4204 H HE21 . GLN A 1 274 ? 16.155 54.140 38.200 1.00 23.34 ? 286 GLN A HE21 1 ATOM 4205 H HE22 . GLN A 1 274 ? 14.762 54.198 37.676 1.00 23.34 ? 286 GLN A HE22 1 ATOM 4206 N N . PHE A 1 275 ? 18.943 48.319 35.462 1.00 14.68 ? 287 PHE A N 1 ATOM 4207 C CA . PHE A 1 275 ? 19.432 47.461 34.381 1.00 14.71 ? 287 PHE A CA 1 ATOM 4208 C C . PHE A 1 275 ? 18.351 46.458 34.022 1.00 14.47 ? 287 PHE A C 1 ATOM 4209 O O . PHE A 1 275 ? 17.904 45.697 34.890 1.00 14.09 ? 287 PHE A O 1 ATOM 4210 C CB . PHE A 1 275 ? 20.721 46.740 34.790 1.00 13.08 ? 287 PHE A CB 1 ATOM 4211 C CG . PHE A 1 275 ? 21.745 47.656 35.354 1.00 13.44 ? 287 PHE A CG 1 ATOM 4212 C CD1 . PHE A 1 275 ? 21.753 47.953 36.726 1.00 16.02 ? 287 PHE A CD1 1 ATOM 4213 C CD2 . PHE A 1 275 ? 22.657 48.289 34.525 1.00 15.41 ? 287 PHE A CD2 1 ATOM 4214 C CE1 . PHE A 1 275 ? 22.678 48.857 37.230 1.00 14.32 ? 287 PHE A CE1 1 ATOM 4215 C CE2 . PHE A 1 275 ? 23.573 49.163 35.029 1.00 15.05 ? 287 PHE A CE2 1 ATOM 4216 C CZ . PHE A 1 275 ? 23.579 49.453 36.402 1.00 15.93 ? 287 PHE A CZ 1 ATOM 4217 H H . PHE A 1 275 ? 18.537 47.892 36.089 1.00 17.62 ? 287 PHE A H 1 ATOM 4218 H HA . PHE A 1 275 ? 19.619 48.003 33.599 1.00 17.65 ? 287 PHE A HA 1 ATOM 4219 H HB2 . PHE A 1 275 ? 20.510 46.076 35.464 1.00 15.69 ? 287 PHE A HB2 1 ATOM 4220 H HB3 . PHE A 1 275 ? 21.103 46.310 34.009 1.00 15.69 ? 287 PHE A HB3 1 ATOM 4221 H HD1 . PHE A 1 275 ? 21.133 47.554 37.293 1.00 19.22 ? 287 PHE A HD1 1 ATOM 4222 H HD2 . PHE A 1 275 ? 22.653 48.106 33.613 1.00 18.49 ? 287 PHE A HD2 1 ATOM 4223 H HE1 . PHE A 1 275 ? 22.693 49.043 38.141 1.00 17.18 ? 287 PHE A HE1 1 ATOM 4224 H HE2 . PHE A 1 275 ? 24.187 49.572 34.464 1.00 18.07 ? 287 PHE A HE2 1 ATOM 4225 H HZ . PHE A 1 275 ? 24.208 50.044 36.749 1.00 19.12 ? 287 PHE A HZ 1 ATOM 4226 N N . TYR A 1 276 ? 17.951 46.446 32.747 1.00 13.51 ? 288 TYR A N 1 ATOM 4227 C CA . TYR A 1 276 ? 16.856 45.590 32.300 1.00 10.55 ? 288 TYR A CA 1 ATOM 4228 C C . TYR A 1 276 ? 17.229 44.822 31.034 1.00 12.40 ? 288 TYR A C 1 ATOM 4229 O O . TYR A 1 276 ? 18.199 45.142 30.348 1.00 14.08 ? 288 TYR A O 1 ATOM 4230 C CB . TYR A 1 276 ? 15.561 46.413 32.024 1.00 14.07 ? 288 TYR A CB 1 ATOM 4231 C CG . TYR A 1 276 ? 15.115 47.202 33.213 1.00 13.79 ? 288 TYR A CG 1 ATOM 4232 C CD1 . TYR A 1 276 ? 14.594 46.547 34.325 1.00 16.89 ? 288 TYR A CD1 1 ATOM 4233 C CD2 . TYR A 1 276 ? 15.223 48.579 33.247 1.00 13.66 ? 288 TYR A CD2 1 ATOM 4234 C CE1 . TYR A 1 276 ? 14.202 47.266 35.449 1.00 19.43 ? 288 TYR A CE1 1 ATOM 4235 C CE2 . TYR A 1 276 ? 14.816 49.302 34.375 1.00 14.24 ? 288 TYR A CE2 1 ATOM 4236 C CZ . TYR A 1 276 ? 14.320 48.639 35.453 1.00 19.56 ? 288 TYR A CZ 1 ATOM 4237 O OH . TYR A 1 276 ? 13.933 49.363 36.567 1.00 18.29 ? 288 TYR A OH 1 ATOM 4238 H H . TYR A 1 276 ? 18.300 46.925 32.124 1.00 16.22 ? 288 TYR A H 1 ATOM 4239 H HA . TYR A 1 276 ? 16.657 44.944 32.996 1.00 12.66 ? 288 TYR A HA 1 ATOM 4240 H HB2 . TYR A 1 276 ? 15.729 47.033 31.298 1.00 16.89 ? 288 TYR A HB2 1 ATOM 4241 H HB3 . TYR A 1 276 ? 14.845 45.804 31.781 1.00 16.89 ? 288 TYR A HB3 1 ATOM 4242 H HD1 . TYR A 1 276 ? 14.524 45.620 34.323 1.00 20.27 ? 288 TYR A HD1 1 ATOM 4243 H HD2 . TYR A 1 276 ? 15.570 49.031 32.512 1.00 16.39 ? 288 TYR A HD2 1 ATOM 4244 H HE1 . TYR A 1 276 ? 13.857 46.824 36.191 1.00 23.32 ? 288 TYR A HE1 1 ATOM 4245 H HE2 . TYR A 1 276 ? 14.896 50.229 34.392 1.00 17.09 ? 288 TYR A HE2 1 ATOM 4246 H HH . TYR A 1 276 ? 14.058 50.183 36.435 1.00 21.95 ? 288 TYR A HH 1 ATOM 4247 N N . GLY A 1 277 ? 16.416 43.802 30.745 1.00 15.64 ? 289 GLY A N 1 ATOM 4248 C CA . GLY A 1 277 ? 16.473 43.064 29.490 1.00 16.62 ? 289 GLY A CA 1 ATOM 4249 C C . GLY A 1 277 ? 15.148 43.048 28.749 1.00 16.87 ? 289 GLY A C 1 ATOM 4250 O O . GLY A 1 277 ? 14.537 44.118 28.569 1.00 15.69 ? 289 GLY A O 1 ATOM 4251 H H . GLY A 1 277 ? 15.807 43.515 31.280 1.00 18.77 ? 289 GLY A H 1 ATOM 4252 H HA2 . GLY A 1 277 ? 17.141 43.465 28.912 1.00 19.94 ? 289 GLY A HA2 1 ATOM 4253 H HA3 . GLY A 1 277 ? 16.734 42.147 29.668 1.00 19.94 ? 289 GLY A HA3 1 ATOM 4254 N N . HIS A 1 278 ? 14.713 41.854 28.291 1.00 14.80 ? 290 HIS A N 1 ATOM 4255 C CA . HIS A 1 278 ? 13.422 41.602 27.637 1.00 13.60 ? 290 HIS A CA 1 ATOM 4256 C C . HIS A 1 278 ? 13.222 42.176 26.236 1.00 17.47 ? 290 HIS A C 1 ATOM 4257 O O . HIS A 1 278 ? 12.521 41.573 25.413 1.00 16.47 ? 290 HIS A O 1 ATOM 4258 C CB . HIS A 1 278 ? 12.287 42.118 28.540 1.00 12.14 ? 290 HIS A CB 1 ATOM 4259 C CG . HIS A 1 278 ? 10.920 41.850 27.999 1.00 13.33 ? 290 HIS A CG 1 ATOM 4260 N ND1 . HIS A 1 278 ? 10.372 40.582 27.916 1.00 15.69 ? 290 HIS A ND1 1 ATOM 4261 C CD2 . HIS A 1 278 ? 9.963 42.703 27.556 1.00 15.91 ? 290 HIS A CD2 1 ATOM 4262 C CE1 . HIS A 1 278 ? 9.152 40.668 27.418 1.00 18.37 ? 290 HIS A CE1 1 ATOM 4263 N NE2 . HIS A 1 278 ? 8.881 41.944 27.183 1.00 17.67 ? 290 HIS A NE2 1 ATOM 4264 H H . HIS A 1 278 ? 15.184 41.138 28.357 1.00 17.76 ? 290 HIS A H 1 ATOM 4265 H HA . HIS A 1 278 ? 13.311 40.642 27.563 1.00 16.32 ? 290 HIS A HA 1 ATOM 4266 H HB2 . HIS A 1 278 ? 12.354 41.684 29.405 1.00 14.56 ? 290 HIS A HB2 1 ATOM 4267 H HB3 . HIS A 1 278 ? 12.381 43.078 28.645 1.00 14.56 ? 290 HIS A HB3 1 ATOM 4268 H HD2 . HIS A 1 278 ? 10.036 43.628 27.491 1.00 19.10 ? 290 HIS A HD2 1 ATOM 4269 H HE1 . HIS A 1 278 ? 8.580 39.953 27.256 1.00 22.04 ? 290 HIS A HE1 1 ATOM 4270 H HE2 . HIS A 1 278 ? 8.143 42.248 26.863 1.00 21.21 ? 290 HIS A HE2 1 ATOM 4271 N N . THR A 1 279 ? 13.736 43.366 25.948 1.00 15.74 ? 291 THR A N 1 ATOM 4272 C CA . THR A 1 279 ? 13.451 43.951 24.648 1.00 13.23 ? 291 THR A CA 1 ATOM 4273 C C . THR A 1 279 ? 14.378 43.418 23.565 1.00 14.67 ? 291 THR A C 1 ATOM 4274 O O . THR A 1 279 ? 14.087 43.568 22.368 1.00 15.39 ? 291 THR A O 1 ATOM 4275 C CB . THR A 1 279 ? 13.591 45.479 24.696 1.00 15.62 ? 291 THR A CB 1 ATOM 4276 O OG1 . THR A 1 279 ? 14.958 45.792 24.767 1.00 15.42 ? 291 THR A OG1 1 ATOM 4277 C CG2 . THR A 1 279 ? 12.858 46.081 25.882 1.00 17.73 ? 291 THR A CG2 1 ATOM 4278 H H . THR A 1 279 ? 14.233 43.839 26.467 1.00 18.88 ? 291 THR A H 1 ATOM 4279 H HA . THR A 1 279 ? 12.538 43.738 24.396 1.00 15.88 ? 291 THR A HA 1 ATOM 4280 H HB . THR A 1 279 ? 13.219 45.860 23.885 1.00 18.75 ? 291 THR A HB 1 ATOM 4281 H HG1 . THR A 1 279 ? 15.062 46.625 24.794 1.00 18.50 ? 291 THR A HG1 1 ATOM 4282 H HG21 . THR A 1 279 ? 12.966 47.045 25.884 1.00 21.28 ? 291 THR A HG21 1 ATOM 4283 H HG22 . THR A 1 279 ? 11.912 45.870 25.829 1.00 21.28 ? 291 THR A HG22 1 ATOM 4284 H HG23 . THR A 1 279 ? 13.215 45.722 26.709 1.00 21.28 ? 291 THR A HG23 1 ATOM 4285 N N . HIS A 1 280 ? 15.494 42.817 23.954 1.00 16.66 ? 292 HIS A N 1 ATOM 4286 C CA . HIS A 1 280 ? 16.502 42.315 23.022 1.00 17.71 ? 292 HIS A CA 1 ATOM 4287 C C . HIS A 1 280 ? 17.142 43.423 22.223 1.00 18.67 ? 292 HIS A C 1 ATOM 4288 O O . HIS A 1 280 ? 17.702 43.189 21.141 1.00 19.45 ? 292 HIS A O 1 ATOM 4289 C CB . HIS A 1 280 ? 15.924 41.239 22.066 1.00 17.25 ? 292 HIS A CB 1 ATOM 4290 C CG . HIS A 1 280 ? 15.417 40.001 22.747 1.00 18.35 ? 292 HIS A CG 1 ATOM 4291 N ND1 . HIS A 1 280 ? 15.271 38.801 22.079 1.00 17.62 ? 292 HIS A ND1 1 ATOM 4292 C CD2 . HIS A 1 280 ? 15.033 39.766 24.024 1.00 16.12 ? 292 HIS A CD2 1 ATOM 4293 C CE1 . HIS A 1 280 ? 14.782 37.896 22.907 1.00 18.86 ? 292 HIS A CE1 1 ATOM 4294 N NE2 . HIS A 1 280 ? 14.635 38.452 24.101 1.00 20.07 ? 292 HIS A NE2 1 ATOM 4295 H H . HIS A 1 280 ? 15.698 42.683 24.778 1.00 19.99 ? 292 HIS A H 1 ATOM 4296 H HA . HIS A 1 280 ? 17.205 41.891 23.538 1.00 21.26 ? 292 HIS A HA 1 ATOM 4297 H HB2 . HIS A 1 280 ? 15.183 41.628 21.575 1.00 20.70 ? 292 HIS A HB2 1 ATOM 4298 H HB3 . HIS A 1 280 ? 16.620 40.969 21.447 1.00 20.70 ? 292 HIS A HB3 1 ATOM 4299 H HD1 . HIS A 1 280 ? 15.436 38.674 21.245 1.00 21.15 ? 292 HIS A HD1 1 ATOM 4300 H HD2 . HIS A 1 280 ? 15.017 40.387 24.717 1.00 19.35 ? 292 HIS A HD2 1 ATOM 4301 H HE1 . HIS A 1 280 ? 14.601 37.009 22.696 1.00 22.63 ? 292 HIS A HE1 1 ATOM 4302 N N . ARG A 1 281 ? 17.101 44.638 22.727 1.00 15.56 ? 293 ARG A N 1 ATOM 4303 C CA . ARG A 1 281 ? 17.648 45.790 22.030 1.00 15.33 ? 293 ARG A CA 1 ATOM 4304 C C . ARG A 1 281 ? 18.522 46.584 22.998 1.00 13.99 ? 293 ARG A C 1 ATOM 4305 O O . ARG A 1 281 ? 18.393 46.454 24.212 1.00 16.46 ? 293 ARG A O 1 ATOM 4306 C CB . ARG A 1 281 ? 16.540 46.697 21.480 1.00 16.58 ? 293 ARG A CB 1 ATOM 4307 C CG . ARG A 1 281 ? 15.618 46.032 20.491 1.00 16.96 ? 293 ARG A CG 1 ATOM 4308 C CD . ARG A 1 281 ? 16.291 45.811 19.138 1.00 17.38 ? 293 ARG A CD 1 ATOM 4309 N NE . ARG A 1 281 ? 15.381 45.169 18.202 1.00 19.62 ? 293 ARG A NE 1 ATOM 4310 C CZ . ARG A 1 281 ? 15.274 43.863 18.023 1.00 18.33 ? 293 ARG A CZ 1 ATOM 4311 N NH1 . ARG A 1 281 ? 16.019 43.004 18.702 1.00 20.08 ? 293 ARG A NH1 1 ATOM 4312 N NH2 . ARG A 1 281 ? 14.392 43.398 17.156 1.00 20.95 ? 293 ARG A NH2 1 ATOM 4313 H H . ARG A 1 281 ? 16.753 44.830 23.490 1.00 18.67 ? 293 ARG A H 1 ATOM 4314 H HA . ARG A 1 281 ? 18.199 45.491 21.290 1.00 18.40 ? 293 ARG A HA 1 ATOM 4315 H HB2 . ARG A 1 281 ? 15.999 47.010 22.222 1.00 19.90 ? 293 ARG A HB2 1 ATOM 4316 H HB3 . ARG A 1 281 ? 16.952 47.454 21.035 1.00 19.90 ? 293 ARG A HB3 1 ATOM 4317 H HG2 . ARG A 1 281 ? 15.348 45.168 20.839 1.00 20.35 ? 293 ARG A HG2 1 ATOM 4318 H HG3 . ARG A 1 281 ? 14.840 46.594 20.353 1.00 20.35 ? 293 ARG A HG3 1 ATOM 4319 H HD2 . ARG A 1 281 ? 16.557 46.667 18.768 1.00 20.86 ? 293 ARG A HD2 1 ATOM 4320 H HD3 . ARG A 1 281 ? 17.065 45.238 19.254 1.00 20.86 ? 293 ARG A HD3 1 ATOM 4321 H HE . ARG A 1 281 ? 14.874 45.678 17.729 1.00 23.54 ? 293 ARG A HE 1 ATOM 4322 H HH11 . ARG A 1 281 ? 16.592 43.292 19.275 1.00 24.10 ? 293 ARG A HH11 1 ATOM 4323 H HH12 . ARG A 1 281 ? 15.932 42.159 18.568 1.00 24.10 ? 293 ARG A HH12 1 ATOM 4324 H HH21 . ARG A 1 281 ? 13.903 43.944 16.706 1.00 25.14 ? 293 ARG A HH21 1 ATOM 4325 H HH22 . ARG A 1 281 ? 14.320 42.551 17.029 1.00 25.14 ? 293 ARG A HH22 1 ATOM 4326 N N . ASP A 1 282 ? 19.383 47.431 22.437 1.00 16.26 ? 294 ASP A N 1 ATOM 4327 C CA . ASP A 1 282 ? 20.243 48.324 23.214 1.00 14.38 ? 294 ASP A CA 1 ATOM 4328 C C . ASP A 1 282 ? 19.533 49.670 23.311 1.00 15.18 ? 294 ASP A C 1 ATOM 4329 O O . ASP A 1 282 ? 19.499 50.435 22.341 1.00 16.15 ? 294 ASP A O 1 ATOM 4330 C CB . ASP A 1 282 ? 21.620 48.417 22.552 1.00 16.66 ? 294 ASP A CB 1 ATOM 4331 C CG . ASP A 1 282 ? 22.623 49.296 23.311 1.00 17.99 ? 294 ASP A CG 1 ATOM 4332 O OD1 . ASP A 1 282 ? 22.203 50.032 24.237 1.00 21.18 ? 294 ASP A OD1 1 ATOM 4333 O OD2 . ASP A 1 282 ? 23.842 49.244 22.948 1.00 18.90 ? 294 ASP A OD2 1 ATOM 4334 H H . ASP A 1 282 ? 19.490 47.509 21.587 1.00 19.51 ? 294 ASP A H 1 ATOM 4335 H HA . ASP A 1 282 ? 20.354 47.969 24.110 1.00 17.25 ? 294 ASP A HA 1 ATOM 4336 H HB2 . ASP A 1 282 ? 21.996 47.525 22.490 1.00 20.00 ? 294 ASP A HB2 1 ATOM 4337 H HB3 . ASP A 1 282 ? 21.513 48.790 21.663 1.00 20.00 ? 294 ASP A HB3 1 ATOM 4338 N N . SER A 1 283 ? 19.027 49.984 24.506 1.00 13.70 ? 295 SER A N 1 ATOM 4339 C CA . SER A 1 283 ? 18.234 51.198 24.710 1.00 14.58 ? 295 SER A CA 1 ATOM 4340 C C . SER A 1 283 ? 18.639 51.904 25.993 1.00 15.90 ? 295 SER A C 1 ATOM 4341 O O . SER A 1 283 ? 19.062 51.266 26.962 1.00 15.14 ? 295 SER A O 1 ATOM 4342 C CB . SER A 1 283 ? 16.721 50.906 24.753 1.00 16.44 ? 295 SER A CB 1 ATOM 4343 O OG . SER A 1 283 ? 16.207 50.544 23.471 1.00 16.43 ? 295 SER A OG 1 ATOM 4344 H H . SER A 1 283 ? 19.129 49.509 25.215 1.00 16.44 ? 295 SER A H 1 ATOM 4345 H HA . SER A 1 283 ? 18.398 51.806 23.972 1.00 17.50 ? 295 SER A HA 1 ATOM 4346 H HB2 . SER A 1 283 ? 16.563 50.174 25.370 1.00 19.73 ? 295 SER A HB2 1 ATOM 4347 H HB3 . SER A 1 283 ? 16.259 51.701 25.062 1.00 19.73 ? 295 SER A HB3 1 ATOM 4348 H HG . SER A 1 283 ? 15.383 50.391 23.525 1.00 19.71 ? 295 SER A HG 1 ATOM 4349 N N . LEU A 1 284 ? 18.517 53.237 25.966 1.00 12.99 ? 296 LEU A N 1 ATOM 4350 C CA . LEU A 1 284 ? 18.702 54.115 27.110 1.00 14.35 ? 296 LEU A CA 1 ATOM 4351 C C . LEU A 1 284 ? 17.349 54.667 27.536 1.00 14.93 ? 296 LEU A C 1 ATOM 4352 O O . LEU A 1 284 ? 16.467 54.864 26.703 1.00 15.94 ? 296 LEU A O 1 ATOM 4353 C CB . LEU A 1 284 ? 19.617 55.291 26.756 1.00 17.10 ? 296 LEU A CB 1 ATOM 4354 C CG . LEU A 1 284 ? 21.085 54.982 26.525 1.00 21.09 ? 296 LEU A CG 1 ATOM 4355 C CD1 . LEU A 1 284 ? 21.789 56.212 26.012 1.00 22.83 ? 296 LEU A CD1 1 ATOM 4356 C CD2 . LEU A 1 284 ? 21.741 54.505 27.836 1.00 21.93 ? 296 LEU A CD2 1 ATOM 4357 H H . LEU A 1 284 ? 18.315 53.670 25.251 1.00 15.59 ? 296 LEU A H 1 ATOM 4358 H HA . LEU A 1 284 ? 19.091 53.622 27.849 1.00 17.22 ? 296 LEU A HA 1 ATOM 4359 H HB2 . LEU A 1 284 ? 19.281 55.699 25.943 1.00 20.52 ? 296 LEU A HB2 1 ATOM 4360 H HB3 . LEU A 1 284 ? 19.572 55.936 27.479 1.00 20.52 ? 296 LEU A HB3 1 ATOM 4361 H HG . LEU A 1 284 ? 21.169 54.279 25.862 1.00 25.31 ? 296 LEU A HG 1 ATOM 4362 H HD11 . LEU A 1 284 ? 22.725 56.002 25.869 1.00 27.39 ? 296 LEU A HD11 1 ATOM 4363 H HD12 . LEU A 1 284 ? 21.379 56.485 25.176 1.00 27.39 ? 296 LEU A HD12 1 ATOM 4364 H HD13 . LEU A 1 284 ? 21.705 56.920 26.669 1.00 27.39 ? 296 LEU A HD13 1 ATOM 4365 H HD21 . LEU A 1 284 ? 22.677 54.313 27.668 1.00 26.32 ? 296 LEU A HD21 1 ATOM 4366 H HD22 . LEU A 1 284 ? 21.661 55.205 28.502 1.00 26.32 ? 296 LEU A HD22 1 ATOM 4367 H HD23 . LEU A 1 284 ? 21.289 53.704 28.142 1.00 26.32 ? 296 LEU A HD23 1 ATOM 4368 N N . MET A 1 285 ? 17.184 54.913 28.835 1.00 14.58 ? 297 MET A N 1 ATOM 4369 C CA . MET A 1 285 ? 16.083 55.722 29.318 1.00 14.10 ? 297 MET A CA 1 ATOM 4370 C C . MET A 1 285 ? 16.628 56.622 30.406 1.00 15.46 ? 297 MET A C 1 ATOM 4371 O O . MET A 1 285 ? 17.614 56.298 31.084 1.00 15.57 ? 297 MET A O 1 ATOM 4372 C CB . MET A 1 285 ? 14.917 54.890 29.853 1.00 14.10 ? 297 MET A CB 1 ATOM 4373 C CG . MET A 1 285 ? 13.934 54.418 28.780 1.00 15.79 ? 297 MET A CG 1 ATOM 4374 S SD . MET A 1 285 ? 12.625 53.338 29.411 1.00 17.42 ? 297 MET A SD 1 ATOM 4375 C CE . MET A 1 285 ? 13.529 51.796 29.601 1.00 17.95 ? 297 MET A CE 1 ATOM 4376 H H . MET A 1 285 ? 17.702 54.618 29.455 1.00 17.50 ? 297 MET A H 1 ATOM 4377 H HA . MET A 1 285 ? 15.750 56.271 28.590 1.00 16.92 ? 297 MET A HA 1 ATOM 4378 H HB2 . MET A 1 285 ? 15.274 54.102 30.292 1.00 16.91 ? 297 MET A HB2 1 ATOM 4379 H HB3 . MET A 1 285 ? 14.421 55.425 30.492 1.00 16.91 ? 297 MET A HB3 1 ATOM 4380 H HG2 . MET A 1 285 ? 13.511 55.195 28.381 1.00 18.94 ? 297 MET A HG2 1 ATOM 4381 H HG3 . MET A 1 285 ? 14.424 53.926 28.102 1.00 18.94 ? 297 MET A HG3 1 ATOM 4382 H HE1 . MET A 1 285 ? 12.925 51.117 29.941 1.00 21.54 ? 297 MET A HE1 1 ATOM 4383 H HE2 . MET A 1 285 ? 13.877 51.527 28.737 1.00 21.54 ? 297 MET A HE2 1 ATOM 4384 H HE3 . MET A 1 285 ? 14.259 51.933 30.225 1.00 21.54 ? 297 MET A HE3 1 ATOM 4385 N N . VAL A 1 286 ? 15.994 57.763 30.570 1.00 15.69 ? 298 VAL A N 1 ATOM 4386 C CA . VAL A 1 286 ? 16.355 58.677 31.661 1.00 17.14 ? 298 VAL A CA 1 ATOM 4387 C C . VAL A 1 286 ? 15.067 59.026 32.376 1.00 17.58 ? 298 VAL A C 1 ATOM 4388 O O . VAL A 1 286 ? 14.184 59.673 31.792 1.00 20.10 ? 298 VAL A O 1 ATOM 4389 C CB . VAL A 1 286 ? 17.065 59.938 31.153 1.00 18.64 ? 298 VAL A CB 1 ATOM 4390 C CG1 . VAL A 1 286 ? 17.390 60.869 32.325 1.00 21.40 ? 298 VAL A CG1 1 ATOM 4391 C CG2 . VAL A 1 286 ? 18.329 59.593 30.378 1.00 22.73 ? 298 VAL A CG2 1 ATOM 4392 H H . VAL A 1 286 ? 15.352 58.043 30.070 1.00 18.83 ? 298 VAL A H 1 ATOM 4393 H HA . VAL A 1 286 ? 16.942 58.222 32.285 1.00 20.57 ? 298 VAL A HA 1 ATOM 4394 H HB . VAL A 1 286 ? 16.469 60.413 30.553 1.00 22.37 ? 298 VAL A HB 1 ATOM 4395 H HG11 . VAL A 1 286 ? 17.838 61.660 31.985 1.00 25.68 ? 298 VAL A HG11 1 ATOM 4396 H HG12 . VAL A 1 286 ? 16.564 61.121 32.767 1.00 25.68 ? 298 VAL A HG12 1 ATOM 4397 H HG13 . VAL A 1 286 ? 17.970 60.402 32.947 1.00 25.68 ? 298 VAL A HG13 1 ATOM 4398 H HG21 . VAL A 1 286 ? 18.748 60.414 30.074 1.00 27.28 ? 298 VAL A HG21 1 ATOM 4399 H HG22 . VAL A 1 286 ? 18.934 59.108 30.961 1.00 27.28 ? 298 VAL A HG22 1 ATOM 4400 H HG23 . VAL A 1 286 ? 18.091 59.041 29.616 1.00 27.28 ? 298 VAL A HG23 1 ATOM 4401 N N . LEU A 1 287 ? 14.930 58.543 33.606 1.00 17.24 ? 299 LEU A N 1 ATOM 4402 C CA . LEU A 1 287 ? 13.802 58.910 34.443 1.00 16.23 ? 299 LEU A CA 1 ATOM 4403 C C . LEU A 1 287 ? 13.986 60.346 34.919 1.00 19.71 ? 299 LEU A C 1 ATOM 4404 O O . LEU A 1 287 ? 15.045 60.687 35.449 1.00 17.88 ? 299 LEU A O 1 ATOM 4405 C CB . LEU A 1 287 ? 13.735 57.971 35.633 1.00 16.16 ? 299 LEU A CB 1 ATOM 4406 C CG . LEU A 1 287 ? 12.726 58.305 36.731 1.00 14.53 ? 299 LEU A CG 1 ATOM 4407 C CD1 . LEU A 1 287 ? 11.290 58.283 36.132 1.00 20.42 ? 299 LEU A CD1 1 ATOM 4408 C CD2 . LEU A 1 287 ? 12.799 57.315 37.859 1.00 20.80 ? 299 LEU A CD2 1 ATOM 4409 H H . LEU A 1 287 ? 15.481 57.998 33.979 1.00 20.69 ? 299 LEU A H 1 ATOM 4410 H HA . LEU A 1 287 ? 12.976 58.844 33.939 1.00 19.47 ? 299 LEU A HA 1 ATOM 4411 H HB2 . LEU A 1 287 ? 13.516 57.085 35.304 1.00 19.39 ? 299 LEU A HB2 1 ATOM 4412 H HB3 . LEU A 1 287 ? 14.611 57.949 36.048 1.00 19.39 ? 299 LEU A HB3 1 ATOM 4413 H HG . LEU A 1 287 ? 12.904 59.191 37.081 1.00 17.44 ? 299 LEU A HG 1 ATOM 4414 H HD11 . LEU A 1 287 ? 10.653 58.495 36.832 1.00 24.50 ? 299 LEU A HD11 1 ATOM 4415 H HD12 . LEU A 1 287 ? 11.234 58.942 35.423 1.00 24.50 ? 299 LEU A HD12 1 ATOM 4416 H HD13 . LEU A 1 287 ? 11.110 57.398 35.777 1.00 24.50 ? 299 LEU A HD13 1 ATOM 4417 H HD21 . LEU A 1 287 ? 12.147 57.558 38.534 1.00 24.96 ? 299 LEU A HD21 1 ATOM 4418 H HD22 . LEU A 1 287 ? 12.605 56.429 37.515 1.00 24.96 ? 299 LEU A HD22 1 ATOM 4419 H HD23 . LEU A 1 287 ? 13.692 57.335 38.238 1.00 24.96 ? 299 LEU A HD23 1 ATOM 4420 N N . SER A 1 288 ? 12.968 61.173 34.709 1.00 19.76 ? 300 SER A N 1 ATOM 4421 C CA . SER A 1 288 ? 12.966 62.585 35.076 1.00 19.11 ? 300 SER A CA 1 ATOM 4422 C C . SER A 1 288 ? 11.749 62.903 35.932 1.00 20.09 ? 300 SER A C 1 ATOM 4423 O O . SER A 1 288 ? 10.793 62.126 36.041 1.00 20.88 ? 300 SER A O 1 ATOM 4424 C CB . SER A 1 288 ? 12.978 63.476 33.823 1.00 20.22 ? 300 SER A CB 1 ATOM 4425 O OG . SER A 1 288 ? 14.209 63.367 33.138 1.00 23.76 ? 300 SER A OG 1 ATOM 4426 H H . SER A 1 288 ? 12.233 60.926 34.338 1.00 23.71 ? 300 SER A H 1 ATOM 4427 H HA . SER A 1 288 ? 13.762 62.781 35.596 1.00 22.93 ? 300 SER A HA 1 ATOM 4428 H HB2 . SER A 1 288 ? 12.262 63.198 33.232 1.00 24.27 ? 300 SER A HB2 1 ATOM 4429 H HB3 . SER A 1 288 ? 12.847 64.399 34.091 1.00 24.27 ? 300 SER A HB3 1 ATOM 4430 H HG . SER A 1 288 ? 14.203 63.858 32.457 1.00 28.51 ? 300 SER A HG 1 ATOM 4431 N N . ASP A 1 289 ? 11.781 64.079 36.552 1.00 19.84 ? 301 ASP A N 1 ATOM 4432 C CA . ASP A 1 289 ? 10.619 64.528 37.289 1.00 23.81 ? 301 ASP A CA 1 ATOM 4433 C C . ASP A 1 289 ? 9.616 65.113 36.298 1.00 20.03 ? 301 ASP A C 1 ATOM 4434 O O . ASP A 1 289 ? 9.860 65.160 35.092 1.00 20.62 ? 301 ASP A O 1 ATOM 4435 C CB . ASP A 1 289 ? 11.018 65.515 38.393 1.00 25.37 ? 301 ASP A CB 1 ATOM 4436 C CG . ASP A 1 289 ? 11.452 66.880 37.864 1.00 25.82 ? 301 ASP A CG 1 ATOM 4437 O OD1 . ASP A 1 289 ? 11.360 67.175 36.661 1.00 27.59 ? 301 ASP A OD1 1 ATOM 4438 O OD2 . ASP A 1 289 ? 11.914 67.679 38.718 1.00 28.39 ? 301 ASP A OD2 1 ATOM 4439 H H . ASP A 1 289 ? 12.449 64.620 36.559 1.00 23.81 ? 301 ASP A H 1 ATOM 4440 H HA . ASP A 1 289 ? 10.202 63.762 37.714 1.00 28.57 ? 301 ASP A HA 1 ATOM 4441 H HB2 . ASP A 1 289 ? 10.258 65.652 38.981 1.00 30.45 ? 301 ASP A HB2 1 ATOM 4442 H HB3 . ASP A 1 289 ? 11.759 65.141 38.894 1.00 30.45 ? 301 ASP A HB3 1 ATOM 4443 N N . LYS A 1 290 ? 8.482 65.578 36.834 1.00 28.67 ? 302 LYS A N 1 ATOM 4444 C CA . LYS A 1 290 ? 7.405 66.094 35.994 1.00 33.90 ? 302 LYS A CA 1 ATOM 4445 C C . LYS A 1 290 ? 7.857 67.299 35.199 1.00 40.79 ? 302 LYS A C 1 ATOM 4446 O O . LYS A 1 290 ? 7.327 67.563 34.112 1.00 36.67 ? 302 LYS A O 1 ATOM 4447 C CB . LYS A 1 290 ? 6.189 66.444 36.864 1.00 39.78 ? 302 LYS A CB 1 ATOM 4448 C CG . LYS A 1 290 ? 6.411 67.582 37.869 1.00 46.72 ? 302 LYS A CG 1 ATOM 4449 C CD . LYS A 1 290 ? 5.101 68.060 38.518 1.00 56.91 ? 302 LYS A CD 1 ATOM 4450 C CE . LYS A 1 290 ? 5.265 69.413 39.297 1.00 69.72 ? 302 LYS A CE 1 ATOM 4451 N NZ . LYS A 1 290 ? 5.668 69.295 40.763 1.00 44.78 ? 302 LYS A NZ 1 ATOM 4452 H H . LYS A 1 290 ? 8.316 65.604 37.678 1.00 34.40 ? 302 LYS A H 1 ATOM 4453 H HA . LYS A 1 290 ? 7.137 65.405 35.367 1.00 40.68 ? 302 LYS A HA 1 ATOM 4454 H HB2 . LYS A 1 290 ? 5.460 66.708 36.282 1.00 47.74 ? 302 LYS A HB2 1 ATOM 4455 H HB3 . LYS A 1 290 ? 5.934 65.656 37.368 1.00 47.74 ? 302 LYS A HB3 1 ATOM 4456 H HG2 . LYS A 1 290 ? 7.000 67.271 38.574 1.00 56.06 ? 302 LYS A HG2 1 ATOM 4457 H HG3 . LYS A 1 290 ? 6.812 68.336 37.410 1.00 56.06 ? 302 LYS A HG3 1 ATOM 4458 H HD2 . LYS A 1 290 ? 4.435 68.192 37.825 1.00 68.29 ? 302 LYS A HD2 1 ATOM 4459 H HD3 . LYS A 1 290 ? 4.796 67.387 39.147 1.00 68.29 ? 302 LYS A HD3 1 ATOM 4460 H HE2 . LYS A 1 290 ? 5.946 69.941 38.852 1.00 83.66 ? 302 LYS A HE2 1 ATOM 4461 H HE3 . LYS A 1 290 ? 4.419 69.887 39.267 1.00 83.66 ? 302 LYS A HE3 1 ATOM 4462 H HZ1 . LYS A 1 290 ? 5.738 70.104 41.125 1.00 53.73 ? 302 LYS A HZ1 1 ATOM 4463 H HZ2 . LYS A 1 290 ? 5.055 68.829 41.210 1.00 53.73 ? 302 LYS A HZ2 1 ATOM 4464 H HZ3 . LYS A 1 290 ? 6.452 68.879 40.829 1.00 53.73 ? 302 LYS A HZ3 1 ATOM 4465 N N . ASN A 1 291 ? 8.837 68.037 35.716 1.00 34.82 ? 303 ASN A N 1 ATOM 4466 C CA . ASN A 1 291 ? 9.336 69.242 35.058 1.00 40.04 ? 303 ASN A CA 1 ATOM 4467 C C . ASN A 1 291 ? 10.540 68.981 34.147 1.00 40.92 ? 303 ASN A C 1 ATOM 4468 O O . ASN A 1 291 ? 11.139 69.938 33.658 1.00 40.90 ? 303 ASN A O 1 ATOM 4469 C CB . ASN A 1 291 ? 9.689 70.308 36.125 1.00 35.43 ? 303 ASN A CB 1 ATOM 4470 C CG . ASN A 1 291 ? 8.453 70.811 36.920 1.00 24.34 ? 303 ASN A CG 1 ATOM 4471 O OD1 . ASN A 1 291 ? 7.490 71.289 36.337 1.00 39.64 ? 303 ASN A OD1 1 ATOM 4472 N ND2 . ASN A 1 291 ? 8.486 70.669 38.261 1.00 32.28 ? 303 ASN A ND2 1 ATOM 4473 H H . ASN A 1 291 ? 9.235 67.858 36.457 1.00 41.78 ? 303 ASN A H 1 ATOM 4474 H HA . ASN A 1 291 ? 8.627 69.605 34.505 1.00 48.05 ? 303 ASN A HA 1 ATOM 4475 H HB2 . ASN A 1 291 ? 10.315 69.924 36.758 1.00 42.52 ? 303 ASN A HB2 1 ATOM 4476 H HB3 . ASN A 1 291 ? 10.092 71.072 35.684 1.00 42.52 ? 303 ASN A HB3 1 ATOM 4477 H HD21 . ASN A 1 291 ? 7.822 70.934 38.739 1.00 38.73 ? 303 ASN A HD21 1 ATOM 4478 H HD22 . ASN A 1 291 ? 9.171 70.312 38.639 1.00 38.73 ? 303 ASN A HD22 1 ATOM 4479 N N . GLY A 1 292 ? 10.901 67.723 33.872 1.00 34.91 ? 304 GLY A N 1 ATOM 4480 C CA . GLY A 1 292 ? 11.992 67.452 32.944 1.00 28.77 ? 304 GLY A CA 1 ATOM 4481 C C . GLY A 1 292 ? 13.391 67.459 33.566 1.00 22.73 ? 304 GLY A C 1 ATOM 4482 O O . GLY A 1 292 ? 14.392 67.504 32.835 1.00 30.29 ? 304 GLY A O 1 ATOM 4483 H H . GLY A 1 292 ? 10.533 67.021 34.207 1.00 41.90 ? 304 GLY A H 1 ATOM 4484 H HA2 . GLY A 1 292 ? 11.851 66.583 32.538 1.00 34.52 ? 304 GLY A HA2 1 ATOM 4485 H HA3 . GLY A 1 292 ? 11.977 68.118 32.239 1.00 34.52 ? 304 GLY A HA3 1 ATOM 4486 N N . ASN A 1 293 ? 13.490 67.432 34.884 1.00 25.28 ? 305 ASN A N 1 ATOM 4487 C CA . ASN A 1 293 ? 14.785 67.356 35.534 1.00 23.31 ? 305 ASN A CA 1 ATOM 4488 C C . ASN A 1 293 ? 15.223 65.898 35.643 1.00 15.85 ? 305 ASN A C 1 ATOM 4489 O O . ASN A 1 293 ? 14.489 65.086 36.219 1.00 19.25 ? 305 ASN A O 1 ATOM 4490 C CB . ASN A 1 293 ? 14.722 67.981 36.899 1.00 21.28 ? 305 ASN A CB 1 ATOM 4491 C CG . ASN A 1 293 ? 14.453 69.460 36.808 1.00 28.66 ? 305 ASN A CG 1 ATOM 4492 O OD1 . ASN A 1 293 ? 15.256 70.195 36.240 1.00 29.01 ? 305 ASN A OD1 1 ATOM 4493 N ND2 . ASN A 1 293 ? 13.288 69.888 37.276 1.00 26.70 ? 305 ASN A ND2 1 ATOM 4494 H H . ASN A 1 293 ? 12.822 67.458 35.426 1.00 30.33 ? 305 ASN A H 1 ATOM 4495 H HA . ASN A 1 293 ? 15.441 67.836 35.005 1.00 27.98 ? 305 ASN A HA 1 ATOM 4496 H HB2 . ASN A 1 293 ? 14.004 67.571 37.407 1.00 25.53 ? 305 ASN A HB2 1 ATOM 4497 H HB3 . ASN A 1 293 ? 15.571 67.852 37.351 1.00 25.53 ? 305 ASN A HB3 1 ATOM 4498 H HD21 . ASN A 1 293 ? 13.093 70.725 37.244 1.00 32.04 ? 305 ASN A HD21 1 ATOM 4499 H HD22 . ASN A 1 293 ? 12.727 69.328 37.611 1.00 32.04 ? 305 ASN A HD22 1 ATOM 4500 N N . PRO A 1 294 ? 16.394 65.541 35.128 1.00 18.34 ? 306 PRO A N 1 ATOM 4501 C CA . PRO A 1 294 ? 16.821 64.133 35.164 1.00 20.98 ? 306 PRO A CA 1 ATOM 4502 C C . PRO A 1 294 ? 17.116 63.641 36.567 1.00 23.11 ? 306 PRO A C 1 ATOM 4503 O O . PRO A 1 294 ? 17.751 64.330 37.374 1.00 19.42 ? 306 PRO A O 1 ATOM 4504 C CB . PRO A 1 294 ? 18.075 64.129 34.285 1.00 19.62 ? 306 PRO A CB 1 ATOM 4505 C CG . PRO A 1 294 ? 18.608 65.527 34.328 1.00 30.39 ? 306 PRO A CG 1 ATOM 4506 C CD . PRO A 1 294 ? 17.392 66.420 34.480 1.00 20.24 ? 306 PRO A CD 1 ATOM 4507 H HA . PRO A 1 294 ? 16.145 63.567 34.760 1.00 25.17 ? 306 PRO A HA 1 ATOM 4508 H HB2 . PRO A 1 294 ? 18.724 63.505 34.647 1.00 23.55 ? 306 PRO A HB2 1 ATOM 4509 H HB3 . PRO A 1 294 ? 17.835 63.883 33.378 1.00 23.55 ? 306 PRO A HB3 1 ATOM 4510 H HG2 . PRO A 1 294 ? 19.202 65.627 35.088 1.00 36.46 ? 306 PRO A HG2 1 ATOM 4511 H HG3 . PRO A 1 294 ? 19.075 65.724 33.500 1.00 36.46 ? 306 PRO A HG3 1 ATOM 4512 H HD2 . PRO A 1 294 ? 17.597 67.177 35.051 1.00 24.29 ? 306 PRO A HD2 1 ATOM 4513 H HD3 . PRO A 1 294 ? 17.073 66.708 33.610 1.00 24.29 ? 306 PRO A HD3 1 ATOM 4514 N N . LEU A 1 295 ? 16.638 62.432 36.852 1.00 17.44 ? 307 LEU A N 1 ATOM 4515 C CA . LEU A 1 295 ? 16.763 61.795 38.157 1.00 18.86 ? 307 LEU A CA 1 ATOM 4516 C C . LEU A 1 295 ? 17.508 60.472 38.146 1.00 19.26 ? 307 LEU A C 1 ATOM 4517 O O . LEU A 1 295 ? 18.193 60.172 39.127 1.00 18.89 ? 307 LEU A O 1 ATOM 4518 C CB . LEU A 1 295 ? 15.412 61.527 38.753 1.00 17.49 ? 307 LEU A CB 1 ATOM 4519 C CG . LEU A 1 295 ? 14.540 62.744 39.080 1.00 20.48 ? 307 LEU A CG 1 ATOM 4520 C CD1 . LEU A 1 295 ? 13.161 62.248 39.521 1.00 19.90 ? 307 LEU A CD1 1 ATOM 4521 C CD2 . LEU A 1 295 ? 15.234 63.528 40.177 1.00 24.25 ? 307 LEU A CD2 1 ATOM 4522 H H . LEU A 1 295 ? 16.220 61.944 36.280 1.00 20.92 ? 307 LEU A H 1 ATOM 4523 H HA . LEU A 1 295 ? 17.236 62.397 38.753 1.00 22.64 ? 307 LEU A HA 1 ATOM 4524 H HB2 . LEU A 1 295 ? 14.912 60.977 38.131 1.00 20.99 ? 307 LEU A HB2 1 ATOM 4525 H HB3 . LEU A 1 295 ? 15.540 61.038 39.581 1.00 20.99 ? 307 LEU A HB3 1 ATOM 4526 H HG . LEU A 1 295 ? 14.442 63.308 38.296 1.00 24.57 ? 307 LEU A HG 1 ATOM 4527 H HD11 . LEU A 1 295 ? 12.602 63.013 39.729 1.00 23.88 ? 307 LEU A HD11 1 ATOM 4528 H HD12 . LEU A 1 295 ? 12.765 61.735 38.799 1.00 23.88 ? 307 LEU A HD12 1 ATOM 4529 H HD13 . LEU A 1 295 ? 13.264 61.688 40.307 1.00 23.88 ? 307 LEU A HD13 1 ATOM 4530 H HD21 . LEU A 1 295 ? 14.696 64.304 40.398 1.00 29.10 ? 307 LEU A HD21 1 ATOM 4531 H HD22 . LEU A 1 295 ? 15.332 62.959 40.956 1.00 29.10 ? 307 LEU A HD22 1 ATOM 4532 H HD23 . LEU A 1 295 ? 16.107 63.809 39.859 1.00 29.10 ? 307 LEU A HD23 1 ATOM 4533 N N . ASN A 1 296 ? 17.363 59.641 37.106 1.00 15.56 ? 308 ASN A N 1 ATOM 4534 C CA . ASN A 1 296 ? 17.905 58.282 37.214 1.00 15.81 ? 308 ASN A CA 1 ATOM 4535 C C . ASN A 1 296 ? 18.143 57.678 35.831 1.00 16.68 ? 308 ASN A C 1 ATOM 4536 O O . ASN A 1 296 ? 17.284 57.771 34.963 1.00 18.43 ? 308 ASN A O 1 ATOM 4537 C CB . ASN A 1 296 ? 16.943 57.416 38.014 1.00 17.87 ? 308 ASN A CB 1 ATOM 4538 C CG . ASN A 1 296 ? 17.631 56.561 39.045 1.00 24.92 ? 308 ASN A CG 1 ATOM 4539 O OD1 . ASN A 1 296 ? 17.467 55.348 39.041 1.00 22.85 ? 308 ASN A OD1 1 ATOM 4540 N ND2 . ASN A 1 296 ? 18.337 57.194 39.993 1.00 20.01 ? 308 ASN A ND2 1 ATOM 4541 H H . ASN A 1 296 ? 16.974 59.828 36.361 1.00 18.68 ? 308 ASN A H 1 ATOM 4542 H HA . ASN A 1 296 ? 18.753 58.311 37.684 1.00 18.98 ? 308 ASN A HA 1 ATOM 4543 H HB2 . ASN A 1 296 ? 16.313 57.991 38.476 1.00 21.44 ? 308 ASN A HB2 1 ATOM 4544 H HB3 . ASN A 1 296 ? 16.470 56.827 37.405 1.00 21.44 ? 308 ASN A HB3 1 ATOM 4545 H HD21 . ASN A 1 296 ? 18.744 56.741 40.600 1.00 24.02 ? 308 ASN A HD21 1 ATOM 4546 H HD22 . ASN A 1 296 ? 18.382 58.052 39.993 1.00 24.02 ? 308 ASN A HD22 1 ATOM 4547 N N . SER A 1 297 ? 19.302 57.057 35.641 1.00 15.60 ? 309 SER A N 1 ATOM 4548 C CA . SER A 1 297 ? 19.673 56.510 34.339 1.00 19.42 ? 309 SER A CA 1 ATOM 4549 C C . SER A 1 297 ? 19.258 55.045 34.270 1.00 15.54 ? 309 SER A C 1 ATOM 4550 O O . SER A 1 297 ? 19.362 54.332 35.265 1.00 17.22 ? 309 SER A O 1 ATOM 4551 C CB . SER A 1 297 ? 21.180 56.649 34.116 1.00 18.58 ? 309 SER A CB 1 ATOM 4552 O OG . SER A 1 297 ? 21.593 58.020 34.097 1.00 18.33 ? 309 SER A OG 1 ATOM 4553 H H . SER A 1 297 ? 19.894 56.938 36.252 1.00 18.71 ? 309 SER A H 1 ATOM 4554 H HA . SER A 1 297 ? 19.211 56.996 33.639 1.00 23.30 ? 309 SER A HA 1 ATOM 4555 H HB2 . SER A 1 297 ? 21.645 56.192 34.835 1.00 22.30 ? 309 SER A HB2 1 ATOM 4556 H HB3 . SER A 1 297 ? 21.409 56.242 33.266 1.00 22.30 ? 309 SER A HB3 1 ATOM 4557 H HG . SER A 1 297 ? 22.423 58.068 33.973 1.00 22.00 ? 309 SER A HG 1 ATOM 4558 N N . VAL A 1 298 ? 18.802 54.597 33.091 1.00 13.15 ? 310 VAL A N 1 ATOM 4559 C CA . VAL A 1 298 ? 18.250 53.259 32.890 1.00 14.57 ? 310 VAL A CA 1 ATOM 4560 C C . VAL A 1 298 ? 18.904 52.655 31.653 1.00 14.73 ? 310 VAL A C 1 ATOM 4561 O O . VAL A 1 298 ? 18.956 53.303 30.604 1.00 16.25 ? 310 VAL A O 1 ATOM 4562 C CB . VAL A 1 298 ? 16.726 53.307 32.707 1.00 16.35 ? 310 VAL A CB 1 ATOM 4563 C CG1 . VAL A 1 298 ? 16.173 51.913 32.500 1.00 15.38 ? 310 VAL A CG1 1 ATOM 4564 C CG2 . VAL A 1 298 ? 16.071 53.961 33.896 1.00 17.94 ? 310 VAL A CG2 1 ATOM 4565 H H . VAL A 1 298 ? 18.806 55.070 32.373 1.00 15.78 ? 310 VAL A H 1 ATOM 4566 H HA . VAL A 1 298 ? 18.455 52.701 33.657 1.00 17.49 ? 310 VAL A HA 1 ATOM 4567 H HB . VAL A 1 298 ? 16.517 53.835 31.920 1.00 19.61 ? 310 VAL A HB 1 ATOM 4568 H HG11 . VAL A 1 298 ? 15.211 51.969 32.387 1.00 18.45 ? 310 VAL A HG11 1 ATOM 4569 H HG12 . VAL A 1 298 ? 16.577 51.528 31.707 1.00 18.45 ? 310 VAL A HG12 1 ATOM 4570 H HG13 . VAL A 1 298 ? 16.384 51.371 33.276 1.00 18.45 ? 310 VAL A HG13 1 ATOM 4571 H HG21 . VAL A 1 298 ? 15.111 53.979 33.756 1.00 21.52 ? 310 VAL A HG21 1 ATOM 4572 H HG22 . VAL A 1 298 ? 16.280 53.449 34.693 1.00 21.52 ? 310 VAL A HG22 1 ATOM 4573 H HG23 . VAL A 1 298 ? 16.410 54.865 33.985 1.00 21.52 ? 310 VAL A HG23 1 ATOM 4574 N N . PHE A 1 299 ? 19.362 51.404 31.758 1.00 14.11 ? 311 PHE A N 1 ATOM 4575 C CA . PHE A 1 299 ? 20.133 50.756 30.694 1.00 13.52 ? 311 PHE A CA 1 ATOM 4576 C C . PHE A 1 299 ? 19.486 49.434 30.340 1.00 12.70 ? 311 PHE A C 1 ATOM 4577 O O . PHE A 1 299 ? 19.451 48.524 31.167 1.00 13.39 ? 311 PHE A O 1 ATOM 4578 C CB . PHE A 1 299 ? 21.586 50.556 31.131 1.00 15.22 ? 311 PHE A CB 1 ATOM 4579 C CG . PHE A 1 299 ? 22.222 51.811 31.593 1.00 14.66 ? 311 PHE A CG 1 ATOM 4580 C CD1 . PHE A 1 299 ? 22.838 52.661 30.695 1.00 15.28 ? 311 PHE A CD1 1 ATOM 4581 C CD2 . PHE A 1 299 ? 22.166 52.168 32.925 1.00 16.59 ? 311 PHE A CD2 1 ATOM 4582 C CE1 . PHE A 1 299 ? 23.411 53.826 31.122 1.00 19.16 ? 311 PHE A CE1 1 ATOM 4583 C CE2 . PHE A 1 299 ? 22.710 53.349 33.337 1.00 16.72 ? 311 PHE A CE2 1 ATOM 4584 C CZ . PHE A 1 299 ? 23.339 54.170 32.432 1.00 16.75 ? 311 PHE A CZ 1 ATOM 4585 H H . PHE A 1 299 ? 19.237 50.903 32.446 1.00 16.93 ? 311 PHE A H 1 ATOM 4586 H HA . PHE A 1 299 ? 20.127 51.319 29.904 1.00 16.23 ? 311 PHE A HA 1 ATOM 4587 H HB2 . PHE A 1 299 ? 21.611 49.920 31.863 1.00 18.27 ? 311 PHE A HB2 1 ATOM 4588 H HB3 . PHE A 1 299 ? 22.098 50.219 30.380 1.00 18.27 ? 311 PHE A HB3 1 ATOM 4589 H HD1 . PHE A 1 299 ? 22.883 52.427 29.795 1.00 18.33 ? 311 PHE A HD1 1 ATOM 4590 H HD2 . PHE A 1 299 ? 21.734 51.617 33.537 1.00 19.91 ? 311 PHE A HD2 1 ATOM 4591 H HE1 . PHE A 1 299 ? 23.828 54.391 30.513 1.00 22.99 ? 311 PHE A HE1 1 ATOM 4592 H HE2 . PHE A 1 299 ? 22.682 53.584 34.236 1.00 20.07 ? 311 PHE A HE2 1 ATOM 4593 H HZ . PHE A 1 299 ? 23.728 54.964 32.722 1.00 20.10 ? 311 PHE A HZ 1 ATOM 4594 N N . VAL A 1 300 ? 18.949 49.329 29.111 1.00 13.11 ? 312 VAL A N 1 ATOM 4595 C CA . VAL A 1 300 ? 18.315 48.113 28.622 1.00 12.58 ? 312 VAL A CA 1 ATOM 4596 C C . VAL A 1 300 ? 19.336 47.438 27.719 1.00 14.57 ? 312 VAL A C 1 ATOM 4597 O O . VAL A 1 300 ? 19.841 48.066 26.780 1.00 16.20 ? 312 VAL A O 1 ATOM 4598 C CB . VAL A 1 300 ? 17.009 48.416 27.862 1.00 13.44 ? 312 VAL A CB 1 ATOM 4599 C CG1 . VAL A 1 300 ? 16.368 47.133 27.417 1.00 17.59 ? 312 VAL A CG1 1 ATOM 4600 C CG2 . VAL A 1 300 ? 16.035 49.222 28.738 1.00 15.78 ? 312 VAL A CG2 1 ATOM 4601 H H . VAL A 1 300 ? 18.946 49.969 28.537 1.00 15.74 ? 312 VAL A H 1 ATOM 4602 H HA . VAL A 1 300 ? 18.116 47.523 29.366 1.00 15.10 ? 312 VAL A HA 1 ATOM 4603 H HB . VAL A 1 300 ? 17.214 48.942 27.074 1.00 16.13 ? 312 VAL A HB 1 ATOM 4604 H HG11 . VAL A 1 300 ? 15.548 47.339 26.941 1.00 21.10 ? 312 VAL A HG11 1 ATOM 4605 H HG12 . VAL A 1 300 ? 16.981 46.660 26.832 1.00 21.10 ? 312 VAL A HG12 1 ATOM 4606 H HG13 . VAL A 1 300 ? 16.171 46.592 28.197 1.00 21.10 ? 312 VAL A HG13 1 ATOM 4607 H HG21 . VAL A 1 300 ? 15.226 49.396 28.232 1.00 18.94 ? 312 VAL A HG21 1 ATOM 4608 H HG22 . VAL A 1 300 ? 15.825 48.706 29.532 1.00 18.94 ? 312 VAL A HG22 1 ATOM 4609 H HG23 . VAL A 1 300 ? 16.455 50.060 28.989 1.00 18.94 ? 312 VAL A HG23 1 ATOM 4610 N N . ALA A 1 301 ? 19.692 46.207 28.045 1.00 15.47 ? 313 ALA A N 1 ATOM 4611 C CA . ALA A 1 301 ? 20.762 45.495 27.334 1.00 14.47 ? 313 ALA A CA 1 ATOM 4612 C C . ALA A 1 301 ? 20.194 44.557 26.280 1.00 14.42 ? 313 ALA A C 1 ATOM 4613 O O . ALA A 1 301 ? 19.172 43.880 26.519 1.00 16.27 ? 313 ALA A O 1 ATOM 4614 C CB . ALA A 1 301 ? 21.607 44.670 28.291 1.00 15.43 ? 313 ALA A CB 1 ATOM 4615 H H . ALA A 1 301 ? 19.332 45.751 28.679 1.00 18.57 ? 313 ALA A H 1 ATOM 4616 H HA . ALA A 1 301 ? 21.338 46.138 26.893 1.00 17.37 ? 313 ALA A HA 1 ATOM 4617 H HB1 . ALA A 1 301 ? 22.301 44.216 27.787 1.00 18.52 ? 313 ALA A HB1 1 ATOM 4618 H HB2 . ALA A 1 301 ? 22.008 45.262 28.947 1.00 18.52 ? 313 ALA A HB2 1 ATOM 4619 H HB3 . ALA A 1 301 ? 21.039 44.020 28.734 1.00 18.52 ? 313 ALA A HB3 1 ATOM 4620 N N . PRO A 1 302 ? 20.880 44.450 25.137 1.00 17.32 ? 314 PRO A N 1 ATOM 4621 C CA . PRO A 1 302 ? 20.434 43.514 24.095 1.00 17.29 ? 314 PRO A CA 1 ATOM 4622 C C . PRO A 1 302 ? 20.718 42.068 24.480 1.00 21.43 ? 314 PRO A C 1 ATOM 4623 O O . PRO A 1 302 ? 21.508 41.759 25.361 1.00 20.58 ? 314 PRO A O 1 ATOM 4624 C CB . PRO A 1 302 ? 21.235 43.938 22.861 1.00 17.00 ? 314 PRO A CB 1 ATOM 4625 C CG . PRO A 1 302 ? 22.554 44.494 23.449 1.00 15.36 ? 314 PRO A CG 1 ATOM 4626 C CD . PRO A 1 302 ? 22.056 45.228 24.731 1.00 16.30 ? 314 PRO A CD 1 ATOM 4627 H HA . PRO A 1 302 ? 19.487 43.625 23.921 1.00 20.74 ? 314 PRO A HA 1 ATOM 4628 H HB2 . PRO A 1 302 ? 21.404 43.168 22.296 1.00 20.40 ? 314 PRO A HB2 1 ATOM 4629 H HB3 . PRO A 1 302 ? 20.754 44.627 22.376 1.00 20.40 ? 314 PRO A HB3 1 ATOM 4630 H HG2 . PRO A 1 302 ? 23.155 43.766 23.671 1.00 18.43 ? 314 PRO A HG2 1 ATOM 4631 H HG3 . PRO A 1 302 ? 22.964 45.114 22.825 1.00 18.43 ? 314 PRO A HG3 1 ATOM 4632 H HD2 . PRO A 1 302 ? 22.735 45.199 25.423 1.00 19.56 ? 314 PRO A HD2 1 ATOM 4633 H HD3 . PRO A 1 302 ? 21.801 46.140 24.521 1.00 19.56 ? 314 PRO A HD3 1 ATOM 4634 N N . ALA A 1 303 ? 20.079 41.172 23.747 1.00 15.33 ? 315 ALA A N 1 ATOM 4635 C CA . ALA A 1 303 ? 20.078 39.755 24.058 1.00 14.79 ? 315 ALA A CA 1 ATOM 4636 C C . ALA A 1 303 ? 21.286 39.047 23.429 1.00 15.12 ? 315 ALA A C 1 ATOM 4637 O O . ALA A 1 303 ? 21.902 39.542 22.491 1.00 16.62 ? 315 ALA A O 1 ATOM 4638 C CB . ALA A 1 303 ? 18.809 39.103 23.517 1.00 17.86 ? 315 ALA A CB 1 ATOM 4639 H H . ALA A 1 303 ? 19.626 41.367 23.042 1.00 18.39 ? 315 ALA A H 1 ATOM 4640 H HA . ALA A 1 303 ? 20.109 39.630 25.020 1.00 17.75 ? 315 ALA A HA 1 ATOM 4641 H HB1 . ALA A 1 303 ? 18.824 38.157 23.734 1.00 21.44 ? 315 ALA A HB1 1 ATOM 4642 H HB2 . ALA A 1 303 ? 18.038 39.525 23.928 1.00 21.44 ? 315 ALA A HB2 1 ATOM 4643 H HB3 . ALA A 1 303 ? 18.779 39.222 22.555 1.00 21.44 ? 315 ALA A HB3 1 ATOM 4644 N N . VAL A 1 304 ? 21.583 37.862 23.959 1.00 19.19 ? 316 VAL A N 1 ATOM 4645 C CA . VAL A 1 304 ? 22.495 36.929 23.279 1.00 18.32 ? 316 VAL A CA 1 ATOM 4646 C C . VAL A 1 304 ? 21.787 36.259 22.093 1.00 16.15 ? 316 VAL A C 1 ATOM 4647 O O . VAL A 1 304 ? 22.361 36.144 20.994 1.00 16.45 ? 316 VAL A O 1 ATOM 4648 C CB . VAL A 1 304 ? 23.030 35.907 24.297 1.00 22.48 ? 316 VAL A CB 1 ATOM 4649 C CG1 . VAL A 1 304 ? 23.796 34.765 23.564 1.00 19.20 ? 316 VAL A CG1 1 ATOM 4650 C CG2 . VAL A 1 304 ? 23.909 36.592 25.320 1.00 20.59 ? 316 VAL A CG2 1 ATOM 4651 H H . VAL A 1 304 ? 21.274 37.571 24.708 1.00 23.03 ? 316 VAL A H 1 ATOM 4652 H HA . VAL A 1 304 ? 23.252 37.427 22.932 1.00 21.99 ? 316 VAL A HA 1 ATOM 4653 H HB . VAL A 1 304 ? 22.280 35.510 24.767 1.00 26.98 ? 316 VAL A HB 1 ATOM 4654 H HG11 . VAL A 1 304 ? 24.124 34.132 24.222 1.00 23.04 ? 316 VAL A HG11 1 ATOM 4655 H HG12 . VAL A 1 304 ? 23.189 34.320 22.951 1.00 23.04 ? 316 VAL A HG12 1 ATOM 4656 H HG13 . VAL A 1 304 ? 24.540 35.148 23.073 1.00 23.04 ? 316 VAL A HG13 1 ATOM 4657 H HG21 . VAL A 1 304 ? 24.234 35.930 25.950 1.00 24.71 ? 316 VAL A HG21 1 ATOM 4658 H HG22 . VAL A 1 304 ? 24.656 37.010 24.864 1.00 24.71 ? 316 VAL A HG22 1 ATOM 4659 H HG23 . VAL A 1 304 ? 23.387 37.264 25.785 1.00 24.71 ? 316 VAL A HG23 1 ATOM 4660 N N . THR A 1 305 ? 20.537 35.816 22.270 1.00 18.26 ? 317 THR A N 1 ATOM 4661 C CA . THR A 1 305 ? 19.787 35.273 21.129 1.00 16.50 ? 317 THR A CA 1 ATOM 4662 C C . THR A 1 305 ? 19.596 36.343 20.047 1.00 22.16 ? 317 THR A C 1 ATOM 4663 O O . THR A 1 305 ? 19.358 37.526 20.362 1.00 19.34 ? 317 THR A O 1 ATOM 4664 C CB . THR A 1 305 ? 18.434 34.691 21.554 1.00 19.00 ? 317 THR A CB 1 ATOM 4665 O OG1 . THR A 1 305 ? 17.809 34.067 20.417 1.00 21.45 ? 317 THR A OG1 1 ATOM 4666 C CG2 . THR A 1 305 ? 17.459 35.777 22.082 1.00 16.72 ? 317 THR A CG2 1 ATOM 4667 H H . THR A 1 305 ? 20.111 35.817 23.017 1.00 21.91 ? 317 THR A H 1 ATOM 4668 H HA . THR A 1 305 ? 20.304 34.551 20.738 1.00 19.80 ? 317 THR A HA 1 ATOM 4669 H HB . THR A 1 305 ? 18.569 34.031 22.252 1.00 22.80 ? 317 THR A HB 1 ATOM 4670 H HG1 . THR A 1 305 ? 17.066 33.744 20.638 1.00 25.74 ? 317 THR A HG1 1 ATOM 4671 H HG21 . THR A 1 305 ? 16.617 35.370 22.339 1.00 20.06 ? 317 THR A HG21 1 ATOM 4672 H HG22 . THR A 1 305 ? 17.843 36.221 22.854 1.00 20.06 ? 317 THR A HG22 1 ATOM 4673 H HG23 . THR A 1 305 ? 17.291 36.437 21.391 1.00 20.06 ? 317 THR A HG23 1 ATOM 4674 N N . PRO A 1 306 ? 19.683 35.966 18.768 1.00 21.19 ? 318 PRO A N 1 ATOM 4675 C CA . PRO A 1 306 ? 19.364 36.870 17.653 1.00 16.72 ? 318 PRO A CA 1 ATOM 4676 C C . PRO A 1 306 ? 17.941 36.714 17.096 1.00 17.33 ? 318 PRO A C 1 ATOM 4677 O O . PRO A 1 306 ? 17.638 37.323 16.055 1.00 18.71 ? 318 PRO A O 1 ATOM 4678 C CB . PRO A 1 306 ? 20.376 36.417 16.594 1.00 21.44 ? 318 PRO A CB 1 ATOM 4679 C CG . PRO A 1 306 ? 20.372 34.920 16.786 1.00 19.76 ? 318 PRO A CG 1 ATOM 4680 C CD . PRO A 1 306 ? 20.271 34.690 18.276 1.00 20.95 ? 318 PRO A CD 1 ATOM 4681 H HA . PRO A 1 306 ? 19.528 37.795 17.895 1.00 20.07 ? 318 PRO A HA 1 ATOM 4682 H HB2 . PRO A 1 306 ? 20.067 36.660 15.707 1.00 25.73 ? 318 PRO A HB2 1 ATOM 4683 H HB3 . PRO A 1 306 ? 21.250 36.794 16.781 1.00 25.73 ? 318 PRO A HB3 1 ATOM 4684 H HG2 . PRO A 1 306 ? 19.607 34.536 16.329 1.00 23.71 ? 318 PRO A HG2 1 ATOM 4685 H HG3 . PRO A 1 306 ? 21.198 34.546 16.439 1.00 23.71 ? 318 PRO A HG3 1 ATOM 4686 H HD2 . PRO A 1 306 ? 19.677 33.947 18.466 1.00 25.14 ? 318 PRO A HD2 1 ATOM 4687 H HD3 . PRO A 1 306 ? 21.152 34.551 18.659 1.00 25.14 ? 318 PRO A HD3 1 ATOM 4688 N N . VAL A 1 307 ? 17.087 35.933 17.759 1.00 17.42 ? 319 VAL A N 1 ATOM 4689 C CA . VAL A 1 307 ? 15.814 35.523 17.187 1.00 19.38 ? 319 VAL A CA 1 ATOM 4690 C C . VAL A 1 307 ? 14.934 36.718 16.826 1.00 23.76 ? 319 VAL A C 1 ATOM 4691 O O . VAL A 1 307 ? 14.935 37.752 17.500 1.00 19.33 ? 319 VAL A O 1 ATOM 4692 C CB . VAL A 1 307 ? 15.108 34.563 18.160 1.00 18.77 ? 319 VAL A CB 1 ATOM 4693 C CG1 . VAL A 1 307 ? 14.502 35.302 19.399 1.00 19.96 ? 319 VAL A CG1 1 ATOM 4694 C CG2 . VAL A 1 307 ? 14.054 33.770 17.424 1.00 20.82 ? 319 VAL A CG2 1 ATOM 4695 H H . VAL A 1 307 ? 17.228 35.626 18.550 1.00 20.90 ? 319 VAL A H 1 ATOM 4696 H HA . VAL A 1 307 ? 15.989 35.033 16.368 1.00 23.26 ? 319 VAL A HA 1 ATOM 4697 H HB . VAL A 1 307 ? 15.764 33.931 18.494 1.00 22.52 ? 319 VAL A HB 1 ATOM 4698 H HG11 . VAL A 1 307 ? 14.071 34.651 19.975 1.00 23.95 ? 319 VAL A HG11 1 ATOM 4699 H HG12 . VAL A 1 307 ? 15.216 35.749 19.880 1.00 23.95 ? 319 VAL A HG12 1 ATOM 4700 H HG13 . VAL A 1 307 ? 13.852 35.953 19.091 1.00 23.95 ? 319 VAL A HG13 1 ATOM 4701 H HG21 . VAL A 1 307 ? 13.617 33.170 18.048 1.00 24.99 ? 319 VAL A HG21 1 ATOM 4702 H HG22 . VAL A 1 307 ? 13.405 34.384 17.045 1.00 24.99 ? 319 VAL A HG22 1 ATOM 4703 H HG23 . VAL A 1 307 ? 14.480 33.260 16.717 1.00 24.99 ? 319 VAL A HG23 1 ATOM 4704 N N . LYS A 1 308 ? 14.212 36.583 15.707 1.00 20.10 ? 320 LYS A N 1 ATOM 4705 C CA A LYS A 1 308 ? 13.134 37.483 15.338 0.48 22.48 ? 320 LYS A CA 1 ATOM 4706 C CA B LYS A 1 308 ? 13.133 37.483 15.336 0.52 22.46 ? 320 LYS A CA 1 ATOM 4707 C C . LYS A 1 308 ? 12.014 36.649 14.736 1.00 27.30 ? 320 LYS A C 1 ATOM 4708 O O . LYS A 1 308 ? 12.208 35.486 14.365 1.00 21.79 ? 320 LYS A O 1 ATOM 4709 C CB A LYS A 1 308 ? 13.582 38.558 14.331 0.48 23.21 ? 320 LYS A CB 1 ATOM 4710 C CB B LYS A 1 308 ? 13.577 38.560 14.325 0.52 23.21 ? 320 LYS A CB 1 ATOM 4711 C CG A LYS A 1 308 ? 14.029 37.990 12.985 0.48 21.88 ? 320 LYS A CG 1 ATOM 4712 C CG B LYS A 1 308 ? 13.870 38.015 12.921 0.52 21.85 ? 320 LYS A CG 1 ATOM 4713 C CD A LYS A 1 308 ? 14.116 39.049 11.911 0.48 23.11 ? 320 LYS A CD 1 ATOM 4714 C CD B LYS A 1 308 ? 14.158 39.112 11.915 0.52 23.10 ? 320 LYS A CD 1 ATOM 4715 C CE A LYS A 1 308 ? 14.082 38.413 10.528 0.48 28.19 ? 320 LYS A CE 1 ATOM 4716 C CE B LYS A 1 308 ? 14.143 38.576 10.485 0.52 28.35 ? 320 LYS A CE 1 ATOM 4717 N NZ A LYS A 1 308 ? 14.110 39.429 9.445 0.48 25.02 ? 320 LYS A NZ 1 ATOM 4718 N NZ B LYS A 1 308 ? 12.765 38.252 10.005 0.52 30.43 ? 320 LYS A NZ 1 ATOM 4719 H H . LYS A 1 308 ? 14.342 35.952 15.137 1.00 24.12 ? 320 LYS A H 1 ATOM 4720 H HA . LYS A 1 308 ? 12.795 37.927 16.130 1.00 26.95 ? 320 LYS A HA 1 ATOM 4721 H HB2 A LYS A 1 308 ? 12.841 39.162 14.167 0.48 27.86 ? 320 LYS A HB2 1 ATOM 4722 H HB2 B LYS A 1 308 ? 12.872 39.221 14.244 0.52 27.85 ? 320 LYS A HB2 1 ATOM 4723 H HB3 A LYS A 1 308 ? 14.329 39.049 14.709 0.48 27.86 ? 320 LYS A HB3 1 ATOM 4724 H HB3 B LYS A 1 308 ? 14.386 38.982 14.653 0.52 27.85 ? 320 LYS A HB3 1 ATOM 4725 H HG2 A LYS A 1 308 ? 14.907 37.591 13.085 0.48 26.25 ? 320 LYS A HG2 1 ATOM 4726 H HG2 B LYS A 1 308 ? 14.647 37.436 12.963 0.52 26.22 ? 320 LYS A HG2 1 ATOM 4727 H HG3 A LYS A 1 308 ? 13.390 37.320 12.696 0.48 26.25 ? 320 LYS A HG3 1 ATOM 4728 H HG3 B LYS A 1 308 ? 13.100 37.516 12.609 0.52 26.22 ? 320 LYS A HG3 1 ATOM 4729 H HD2 A LYS A 1 308 ? 13.360 39.652 11.990 0.48 27.73 ? 320 LYS A HD2 1 ATOM 4730 H HD2 B LYS A 1 308 ? 13.478 39.801 11.989 0.52 27.72 ? 320 LYS A HD2 1 ATOM 4731 H HD3 A LYS A 1 308 ? 14.949 39.536 12.004 0.48 27.73 ? 320 LYS A HD3 1 ATOM 4732 H HD3 B LYS A 1 308 ? 15.035 39.487 12.091 0.52 27.72 ? 320 LYS A HD3 1 ATOM 4733 H HE2 A LYS A 1 308 ? 14.857 37.839 10.423 0.48 33.83 ? 320 LYS A HE2 1 ATOM 4734 H HE2 B LYS A 1 308 ? 14.518 39.245 9.892 0.52 34.01 ? 320 LYS A HE2 1 ATOM 4735 H HE3 A LYS A 1 308 ? 13.268 37.895 10.436 0.48 33.83 ? 320 LYS A HE3 1 ATOM 4736 H HE3 B LYS A 1 308 ? 14.673 37.764 10.447 0.52 34.01 ? 320 LYS A HE3 1 ATOM 4737 H HZ1 A LYS A 1 308 ? 13.404 39.967 9.515 0.48 30.02 ? 320 LYS A HZ1 1 ATOM 4738 H HZ1 B LYS A 1 308 ? 12.399 37.633 10.529 0.52 36.51 ? 320 LYS A HZ1 1 ATOM 4739 H HZ2 A LYS A 1 308 ? 14.852 39.916 9.504 0.48 30.02 ? 320 LYS A HZ2 1 ATOM 4740 H HZ2 B LYS A 1 308 ? 12.258 38.983 10.023 0.52 36.51 ? 320 LYS A HZ2 1 ATOM 4741 H HZ3 A LYS A 1 308 ? 14.089 39.027 8.651 0.48 30.02 ? 320 LYS A HZ3 1 ATOM 4742 H HZ3 B LYS A 1 308 ? 12.799 37.943 9.171 0.52 36.51 ? 320 LYS A HZ3 1 ATOM 4743 N N . GLY A 1 309 ? 10.840 37.240 14.659 1.00 27.40 ? 321 GLY A N 1 ATOM 4744 C CA . GLY A 1 309 ? 9.753 36.604 13.940 1.00 27.25 ? 321 GLY A CA 1 ATOM 4745 C C . GLY A 1 309 ? 9.859 36.861 12.445 1.00 22.75 ? 321 GLY A C 1 ATOM 4746 O O . GLY A 1 309 ? 10.538 37.785 11.989 1.00 22.24 ? 321 GLY A O 1 ATOM 4747 H H . GLY A 1 309 ? 10.644 38.001 15.008 1.00 32.88 ? 321 GLY A H 1 ATOM 4748 H HA2 . GLY A 1 309 ? 9.776 35.646 14.093 1.00 32.69 ? 321 GLY A HA2 1 ATOM 4749 H HA3 . GLY A 1 309 ? 8.904 36.950 14.256 1.00 32.69 ? 321 GLY A HA3 1 ATOM 4750 N N . VAL A 1 310 ? 9.133 36.059 11.654 1.00 29.07 ? 322 VAL A N 1 ATOM 4751 C CA . VAL A 1 310 ? 9.187 36.242 10.202 1.00 29.51 ? 322 VAL A CA 1 ATOM 4752 C C . VAL A 1 310 ? 8.718 37.633 9.819 1.00 27.61 ? 322 VAL A C 1 ATOM 4753 O O . VAL A 1 310 ? 9.209 38.217 8.847 1.00 30.66 ? 322 VAL A O 1 ATOM 4754 C CB . VAL A 1 310 ? 8.336 35.171 9.480 1.00 40.42 ? 322 VAL A CB 1 ATOM 4755 C CG1 . VAL A 1 310 ? 8.269 35.488 7.973 1.00 40.00 ? 322 VAL A CG1 1 ATOM 4756 C CG2 . VAL A 1 310 ? 8.912 33.797 9.708 1.00 40.33 ? 322 VAL A CG2 1 ATOM 4757 H H . VAL A 1 310 ? 8.619 35.425 11.923 1.00 34.89 ? 322 VAL A H 1 ATOM 4758 H HA . VAL A 1 310 ? 10.105 36.144 9.906 1.00 35.42 ? 322 VAL A HA 1 ATOM 4759 H HB . VAL A 1 310 ? 7.433 35.185 9.835 1.00 48.51 ? 322 VAL A HB 1 ATOM 4760 H HG11 . VAL A 1 310 ? 7.733 34.810 7.532 1.00 48.00 ? 322 VAL A HG11 1 ATOM 4761 H HG12 . VAL A 1 310 ? 7.863 36.361 7.852 1.00 48.00 ? 322 VAL A HG12 1 ATOM 4762 H HG13 . VAL A 1 310 ? 9.169 35.488 7.610 1.00 48.00 ? 322 VAL A HG13 1 ATOM 4763 H HG21 . VAL A 1 310 ? 8.362 33.144 9.246 1.00 48.40 ? 322 VAL A HG21 1 ATOM 4764 H HG22 . VAL A 1 310 ? 9.817 33.773 9.360 1.00 48.40 ? 322 VAL A HG22 1 ATOM 4765 H HG23 . VAL A 1 310 ? 8.917 33.611 10.660 1.00 48.40 ? 322 VAL A HG23 1 ATOM 4766 N N . LEU A 1 311 ? 7.765 38.189 10.572 1.00 27.05 ? 323 LEU A N 1 ATOM 4767 C CA . LEU A 1 311 ? 7.176 39.480 10.203 1.00 24.03 ? 323 LEU A CA 1 ATOM 4768 C C . LEU A 1 311 ? 8.105 40.659 10.443 1.00 28.34 ? 323 LEU A C 1 ATOM 4769 O O . LEU A 1 311 ? 7.823 41.755 9.940 1.00 27.85 ? 323 LEU A O 1 ATOM 4770 C CB . LEU A 1 311 ? 5.874 39.686 10.979 1.00 24.41 ? 323 LEU A CB 1 ATOM 4771 C CG . LEU A 1 311 ? 4.759 38.679 10.661 1.00 29.41 ? 323 LEU A CG 1 ATOM 4772 C CD1 . LEU A 1 311 ? 3.618 38.773 11.667 1.00 36.39 ? 323 LEU A CD1 1 ATOM 4773 C CD2 . LEU A 1 311 ? 4.226 38.924 9.265 1.00 28.68 ? 323 LEU A CD2 1 ATOM 4774 H H . LEU A 1 311 ? 7.444 37.844 11.291 1.00 32.45 ? 323 LEU A H 1 ATOM 4775 H HA . LEU A 1 311 ? 6.958 39.464 9.258 1.00 28.84 ? 323 LEU A HA 1 ATOM 4776 H HB2 . LEU A 1 311 ? 6.066 39.619 11.927 1.00 29.29 ? 323 LEU A HB2 1 ATOM 4777 H HB3 . LEU A 1 311 ? 5.533 40.572 10.779 1.00 29.29 ? 323 LEU A HB3 1 ATOM 4778 H HG . LEU A 1 311 ? 5.120 37.780 10.695 1.00 35.29 ? 323 LEU A HG 1 ATOM 4779 H HD11 . LEU A 1 311 ? 2.936 38.124 11.433 1.00 43.67 ? 323 LEU A HD11 1 ATOM 4780 H HD12 . LEU A 1 311 ? 3.963 38.586 12.554 1.00 43.67 ? 323 LEU A HD12 1 ATOM 4781 H HD13 . LEU A 1 311 ? 3.246 39.669 11.639 1.00 43.67 ? 323 LEU A HD13 1 ATOM 4782 H HD21 . LEU A 1 311 ? 3.523 38.282 9.078 1.00 34.42 ? 323 LEU A HD21 1 ATOM 4783 H HD22 . LEU A 1 311 ? 3.871 39.826 9.216 1.00 34.42 ? 323 LEU A HD22 1 ATOM 4784 H HD23 . LEU A 1 311 ? 4.949 38.817 8.628 1.00 34.42 ? 323 LEU A HD23 1 ATOM 4785 N N . GLN A 1 312 ? 9.198 40.468 11.188 1.00 24.11 ? 324 GLN A N 1 ATOM 4786 C CA . GLN A 1 312 ? 10.072 41.565 11.568 1.00 23.53 ? 324 GLN A CA 1 ATOM 4787 C C . GLN A 1 312 ? 11.163 41.744 10.537 1.00 23.74 ? 324 GLN A C 1 ATOM 4788 O O . GLN A 1 312 ? 11.752 40.767 10.075 1.00 27.01 ? 324 GLN A O 1 ATOM 4789 C CB . GLN A 1 312 ? 10.718 41.302 12.935 1.00 24.37 ? 324 GLN A CB 1 ATOM 4790 C CG . GLN A 1 312 ? 9.757 41.246 14.103 1.00 32.93 ? 324 GLN A CG 1 ATOM 4791 C CD . GLN A 1 312 ? 10.467 40.810 15.387 1.00 33.07 ? 324 GLN A CD 1 ATOM 4792 O OE1 . GLN A 1 312 ? 10.358 39.659 15.813 1.00 33.19 ? 324 GLN A OE1 1 ATOM 4793 N NE2 . GLN A 1 312 ? 11.233 41.721 15.981 1.00 39.35 ? 324 GLN A NE2 1 ATOM 4794 H H . GLN A 1 312 ? 9.451 39.702 11.486 1.00 28.93 ? 324 GLN A H 1 ATOM 4795 H HA . GLN A 1 312 ? 9.559 42.386 11.622 1.00 28.24 ? 324 GLN A HA 1 ATOM 4796 H HB2 . GLN A 1 312 ? 11.182 40.451 12.898 1.00 29.24 ? 324 GLN A HB2 1 ATOM 4797 H HB3 . GLN A 1 312 ? 11.355 42.011 13.115 1.00 29.24 ? 324 GLN A HB3 1 ATOM 4798 H HG2 . GLN A 1 312 ? 9.377 42.127 14.249 1.00 39.52 ? 324 GLN A HG2 1 ATOM 4799 H HG3 . GLN A 1 312 ? 9.055 40.605 13.911 1.00 39.52 ? 324 GLN A HG3 1 ATOM 4800 H HE21 . GLN A 1 312 ? 11.308 42.507 15.641 1.00 47.22 ? 324 GLN A HE21 1 ATOM 4801 H HE22 . GLN A 1 312 ? 11.653 41.523 16.705 1.00 47.22 ? 324 GLN A HE22 1 ATOM 4802 N N . LYS A 1 313 ? 11.468 42.998 10.223 1.00 25.50 ? 325 LYS A N 1 ATOM 4803 C CA . LYS A 1 313 ? 12.528 43.280 9.262 1.00 25.64 ? 325 LYS A CA 1 ATOM 4804 C C . LYS A 1 313 ? 13.912 43.126 9.881 1.00 31.53 ? 325 LYS A C 1 ATOM 4805 O O . LYS A 1 313 ? 14.788 42.471 9.309 1.00 32.89 ? 325 LYS A O 1 ATOM 4806 C CB . LYS A 1 313 ? 12.364 44.681 8.684 1.00 31.01 ? 325 LYS A CB 1 ATOM 4807 C CG . LYS A 1 313 ? 13.474 45.018 7.689 1.00 53.73 ? 325 LYS A CG 1 ATOM 4808 C CD . LYS A 1 313 ? 13.297 46.376 7.028 1.00 75.55 ? 325 LYS A CD 1 ATOM 4809 C CE . LYS A 1 313 ? 14.412 46.631 6.015 1.00 81.59 ? 325 LYS A CE 1 ATOM 4810 N NZ . LYS A 1 313 ? 15.059 47.965 6.190 1.00 71.38 ? 325 LYS A NZ 1 ATOM 4811 H H . LYS A 1 313 ? 11.082 43.695 10.547 1.00 30.60 ? 325 LYS A H 1 ATOM 4812 H HA . LYS A 1 313 ? 12.460 42.648 8.529 1.00 30.77 ? 325 LYS A HA 1 ATOM 4813 H HB2 . LYS A 1 313 ? 11.514 44.737 8.220 1.00 37.21 ? 325 LYS A HB2 1 ATOM 4814 H HB3 . LYS A 1 313 ? 12.396 45.330 9.404 1.00 37.21 ? 325 LYS A HB3 1 ATOM 4815 H HG2 . LYS A 1 313 ? 14.324 45.022 8.156 1.00 64.47 ? 325 LYS A HG2 1 ATOM 4816 H HG3 . LYS A 1 313 ? 13.484 44.345 6.990 1.00 64.47 ? 325 LYS A HG3 1 ATOM 4817 H HD2 . LYS A 1 313 ? 12.447 46.399 6.562 1.00 90.66 ? 325 LYS A HD2 1 ATOM 4818 H HD3 . LYS A 1 313 ? 13.332 47.070 7.704 1.00 90.66 ? 325 LYS A HD3 1 ATOM 4819 H HE2 . LYS A 1 313 ? 15.095 45.950 6.119 1.00 97.91 ? 325 LYS A HE2 1 ATOM 4820 H HE3 . LYS A 1 313 ? 14.040 46.593 5.120 1.00 97.91 ? 325 LYS A HE3 1 ATOM 4821 H HZ1 . LYS A 1 313 ? 15.700 48.074 5.583 1.00 85.65 ? 325 LYS A HZ1 1 ATOM 4822 H HZ2 . LYS A 1 313 ? 14.454 48.611 6.092 1.00 85.65 ? 325 LYS A HZ2 1 ATOM 4823 H HZ3 . LYS A 1 313 ? 15.416 48.025 7.003 1.00 85.65 ? 325 LYS A HZ3 1 ATOM 4824 N N . GLU A 1 314 ? 14.123 43.724 11.048 1.00 23.59 ? 326 GLU A N 1 ATOM 4825 C CA . GLU A 1 314 ? 15.413 43.789 11.698 1.00 20.49 ? 326 GLU A CA 1 ATOM 4826 C C . GLU A 1 314 ? 15.452 42.879 12.915 1.00 20.06 ? 326 GLU A C 1 ATOM 4827 O O . GLU A 1 314 ? 14.423 42.490 13.473 1.00 20.29 ? 326 GLU A O 1 ATOM 4828 C CB . GLU A 1 314 ? 15.719 45.222 12.148 1.00 21.47 ? 326 GLU A CB 1 ATOM 4829 C CG . GLU A 1 314 ? 15.580 46.311 11.080 1.00 33.17 ? 326 GLU A CG 1 ATOM 4830 C CD . GLU A 1 314 ? 16.618 46.194 9.991 1.00 38.10 ? 326 GLU A CD 1 ATOM 4831 O OE1 . GLU A 1 314 ? 17.398 45.225 10.023 1.00 34.40 ? 326 GLU A OE1 1 ATOM 4832 O OE2 . GLU A 1 314 ? 16.645 47.056 9.097 1.00 48.49 ? 326 GLU A OE2 1 ATOM 4833 H H . GLU A 1 314 ? 13.502 44.115 11.496 1.00 28.31 ? 326 GLU A H 1 ATOM 4834 H HA . GLU A 1 314 ? 16.104 43.506 11.079 1.00 24.59 ? 326 GLU A HA 1 ATOM 4835 H HB2 . GLU A 1 314 ? 15.114 45.449 12.871 1.00 25.76 ? 326 GLU A HB2 1 ATOM 4836 H HB3 . GLU A 1 314 ? 16.632 45.250 12.472 1.00 25.76 ? 326 GLU A HB3 1 ATOM 4837 H HG2 . GLU A 1 314 ? 14.704 46.241 10.668 1.00 39.80 ? 326 GLU A HG2 1 ATOM 4838 H HG3 . GLU A 1 314 ? 15.682 47.180 11.499 1.00 39.80 ? 326 GLU A HG3 1 ATOM 4839 N N . THR A 1 315 ? 16.667 42.572 13.346 1.00 18.87 ? 327 THR A N 1 ATOM 4840 C CA . THR A 1 315 ? 16.866 41.904 14.614 1.00 16.49 ? 327 THR A CA 1 ATOM 4841 C C . THR A 1 315 ? 18.185 42.413 15.184 1.00 16.54 ? 327 THR A C 1 ATOM 4842 O O . THR A 1 315 ? 18.805 43.305 14.605 1.00 18.00 ? 327 THR A O 1 ATOM 4843 C CB . THR A 1 315 ? 16.824 40.391 14.461 1.00 21.96 ? 327 THR A CB 1 ATOM 4844 O OG1 . THR A 1 315 ? 16.723 39.818 15.767 1.00 21.28 ? 327 THR A OG1 1 ATOM 4845 C CG2 . THR A 1 315 ? 18.081 39.855 13.739 1.00 23.06 ? 327 THR A CG2 1 ATOM 4846 H H . THR A 1 315 ? 17.394 42.742 12.919 1.00 22.64 ? 327 THR A H 1 ATOM 4847 H HA . THR A 1 315 ? 16.157 42.163 15.222 1.00 19.79 ? 327 THR A HA 1 ATOM 4848 H HB . THR A 1 315 ? 16.044 40.143 13.941 1.00 26.35 ? 327 THR A HB 1 ATOM 4849 H HG1 . THR A 1 315 ? 16.698 38.980 15.712 1.00 25.54 ? 327 THR A HG1 1 ATOM 4850 H HG21 . THR A 1 315 ? 18.028 38.890 13.655 1.00 27.67 ? 327 THR A HG21 1 ATOM 4851 H HG22 . THR A 1 315 ? 18.146 40.245 12.853 1.00 27.67 ? 327 THR A HG22 1 ATOM 4852 H HG23 . THR A 1 315 ? 18.877 40.084 14.244 1.00 27.67 ? 327 THR A HG23 1 ATOM 4853 N N . ASN A 1 316 ? 18.620 41.832 16.310 1.00 18.96 ? 328 ASN A N 1 ATOM 4854 C CA . ASN A 1 316 ? 19.892 42.195 16.911 1.00 17.34 ? 328 ASN A CA 1 ATOM 4855 C C . ASN A 1 316 ? 20.955 41.175 16.557 1.00 16.14 ? 328 ASN A C 1 ATOM 4856 O O . ASN A 1 316 ? 20.664 39.990 16.402 1.00 19.67 ? 328 ASN A O 1 ATOM 4857 C CB . ASN A 1 316 ? 19.792 42.276 18.440 1.00 19.09 ? 328 ASN A CB 1 ATOM 4858 C CG . ASN A 1 316 ? 19.270 40.998 19.061 1.00 17.91 ? 328 ASN A CG 1 ATOM 4859 O OD1 . ASN A 1 316 ? 18.109 40.608 18.860 1.00 19.00 ? 328 ASN A OD1 1 ATOM 4860 N ND2 . ASN A 1 316 ? 20.115 40.340 19.821 1.00 18.76 ? 328 ASN A ND2 1 ATOM 4861 H H . ASN A 1 316 ? 18.189 41.225 16.741 1.00 22.75 ? 328 ASN A H 1 ATOM 4862 H HA . ASN A 1 316 ? 20.172 43.061 16.575 1.00 20.81 ? 328 ASN A HA 1 ATOM 4863 H HB2 . ASN A 1 316 ? 20.674 42.448 18.806 1.00 22.90 ? 328 ASN A HB2 1 ATOM 4864 H HB3 . ASN A 1 316 ? 19.187 42.995 18.680 1.00 22.90 ? 328 ASN A HB3 1 ATOM 4865 H HD21 . ASN A 1 316 ? 19.872 39.606 20.200 1.00 22.51 ? 328 ASN A HD21 1 ATOM 4866 H HD22 . ASN A 1 316 ? 20.912 40.642 19.941 1.00 22.51 ? 328 ASN A HD22 1 ATOM 4867 N N . ASN A 1 317 ? 22.200 41.641 16.521 1.00 17.40 ? 329 ASN A N 1 ATOM 4868 C CA . ASN A 1 317 ? 23.314 40.739 16.749 1.00 20.39 ? 329 ASN A CA 1 ATOM 4869 C C . ASN A 1 317 ? 23.372 40.367 18.229 1.00 23.61 ? 329 ASN A C 1 ATOM 4870 O O . ASN A 1 317 ? 22.962 41.151 19.107 1.00 19.64 ? 329 ASN A O 1 ATOM 4871 C CB . ASN A 1 317 ? 24.644 41.368 16.326 1.00 16.46 ? 329 ASN A CB 1 ATOM 4872 C CG . ASN A 1 317 ? 24.904 41.292 14.830 1.00 17.05 ? 329 ASN A CG 1 ATOM 4873 O OD1 . ASN A 1 317 ? 24.698 40.249 14.196 1.00 21.15 ? 329 ASN A OD1 1 ATOM 4874 N ND2 . ASN A 1 317 ? 25.396 42.389 14.272 1.00 19.16 ? 329 ASN A ND2 1 ATOM 4875 H H . ASN A 1 317 ? 22.420 42.459 16.370 1.00 20.88 ? 329 ASN A H 1 ATOM 4876 H HA . ASN A 1 317 ? 23.181 39.927 16.234 1.00 24.47 ? 329 ASN A HA 1 ATOM 4877 H HB2 . ASN A 1 317 ? 24.642 42.304 16.581 1.00 19.75 ? 329 ASN A HB2 1 ATOM 4878 H HB3 . ASN A 1 317 ? 25.367 40.905 16.778 1.00 19.75 ? 329 ASN A HB3 1 ATOM 4879 H HD21 . ASN A 1 317 ? 25.563 42.404 13.428 1.00 23.00 ? 329 ASN A HD21 1 ATOM 4880 H HD22 . ASN A 1 317 ? 25.548 43.085 14.753 1.00 23.00 ? 329 ASN A HD22 1 ATOM 4881 N N . PRO A 1 318 ? 23.877 39.184 18.540 1.00 17.77 ? 330 PRO A N 1 ATOM 4882 C CA . PRO A 1 318 ? 24.177 38.842 19.932 1.00 16.36 ? 330 PRO A CA 1 ATOM 4883 C C . PRO A 1 318 ? 25.052 39.883 20.615 1.00 17.31 ? 330 PRO A C 1 ATOM 4884 O O . PRO A 1 318 ? 26.024 40.378 20.039 1.00 18.26 ? 330 PRO A O 1 ATOM 4885 C CB . PRO A 1 318 ? 24.918 37.502 19.806 1.00 19.13 ? 330 PRO A CB 1 ATOM 4886 C CG . PRO A 1 318 ? 24.394 36.924 18.504 1.00 17.79 ? 330 PRO A CG 1 ATOM 4887 C CD . PRO A 1 318 ? 24.261 38.094 17.609 1.00 17.84 ? 330 PRO A CD 1 ATOM 4888 H HA . PRO A 1 318 ? 23.359 38.717 20.439 1.00 19.63 ? 330 PRO A HA 1 ATOM 4889 H HB2 . PRO A 1 318 ? 25.875 37.657 19.758 1.00 22.96 ? 330 PRO A HB2 1 ATOM 4890 H HB3 . PRO A 1 318 ? 24.695 36.929 20.556 1.00 22.96 ? 330 PRO A HB3 1 ATOM 4891 H HG2 . PRO A 1 318 ? 25.032 36.287 18.147 1.00 21.34 ? 330 PRO A HG2 1 ATOM 4892 H HG3 . PRO A 1 318 ? 23.533 36.504 18.654 1.00 21.34 ? 330 PRO A HG3 1 ATOM 4893 H HD2 . PRO A 1 318 ? 25.110 38.294 17.184 1.00 21.41 ? 330 PRO A HD2 1 ATOM 4894 H HD3 . PRO A 1 318 ? 23.561 37.943 16.956 1.00 21.41 ? 330 PRO A HD3 1 ATOM 4895 N N . GLY A 1 319 ? 24.749 40.155 21.889 1.00 19.09 ? 331 GLY A N 1 ATOM 4896 C CA . GLY A 1 319 ? 25.510 41.126 22.652 1.00 16.91 ? 331 GLY A CA 1 ATOM 4897 C C . GLY A 1 319 ? 25.689 40.694 24.100 1.00 19.16 ? 331 GLY A C 1 ATOM 4898 O O . GLY A 1 319 ? 24.910 39.896 24.638 1.00 17.69 ? 331 GLY A O 1 ATOM 4899 H H . GLY A 1 319 ? 24.107 39.786 22.327 1.00 22.90 ? 331 GLY A H 1 ATOM 4900 H HA2 . GLY A 1 319 ? 26.386 41.239 22.252 1.00 20.29 ? 331 GLY A HA2 1 ATOM 4901 H HA3 . GLY A 1 319 ? 25.051 41.980 22.639 1.00 20.29 ? 331 GLY A HA3 1 ATOM 4902 N N . VAL A 1 320 ? 26.792 41.174 24.701 1.00 18.41 ? 332 VAL A N 1 ATOM 4903 C CA . VAL A 1 320 ? 27.004 41.169 26.153 1.00 17.97 ? 332 VAL A CA 1 ATOM 4904 C C . VAL A 1 320 ? 27.669 42.494 26.495 1.00 15.80 ? 332 VAL A C 1 ATOM 4905 O O . VAL A 1 320 ? 28.331 43.111 25.658 1.00 18.29 ? 332 VAL A O 1 ATOM 4906 C CB . VAL A 1 320 ? 27.880 40.010 26.696 1.00 18.93 ? 332 VAL A CB 1 ATOM 4907 C CG1 . VAL A 1 320 ? 27.250 38.668 26.439 1.00 20.41 ? 332 VAL A CG1 1 ATOM 4908 C CG2 . VAL A 1 320 ? 29.280 40.066 26.118 1.00 19.05 ? 332 VAL A CG2 1 ATOM 4909 H H . VAL A 1 320 ? 27.451 41.518 24.269 1.00 22.09 ? 332 VAL A H 1 ATOM 4910 H HA . VAL A 1 320 ? 26.145 41.135 26.601 1.00 21.56 ? 332 VAL A HA 1 ATOM 4911 H HB . VAL A 1 320 ? 27.960 40.112 27.658 1.00 22.72 ? 332 VAL A HB 1 ATOM 4912 H HG11 . VAL A 1 320 ? 27.828 37.975 26.794 1.00 24.49 ? 332 VAL A HG11 1 ATOM 4913 H HG12 . VAL A 1 320 ? 26.386 38.636 26.879 1.00 24.49 ? 332 VAL A HG12 1 ATOM 4914 H HG13 . VAL A 1 320 ? 27.139 38.550 25.483 1.00 24.49 ? 332 VAL A HG13 1 ATOM 4915 H HG21 . VAL A 1 320 ? 29.799 39.330 26.478 1.00 22.86 ? 332 VAL A HG21 1 ATOM 4916 H HG22 . VAL A 1 320 ? 29.225 39.992 25.153 1.00 22.86 ? 332 VAL A HG22 1 ATOM 4917 H HG23 . VAL A 1 320 ? 29.689 40.911 26.364 1.00 22.86 ? 332 VAL A HG23 1 ATOM 4918 N N . ARG A 1 321 ? 27.514 42.945 27.744 1.00 15.20 ? 333 ARG A N 1 ATOM 4919 C CA . ARG A 1 321 ? 28.052 44.259 28.078 1.00 15.86 ? 333 ARG A CA 1 ATOM 4920 C C . ARG A 1 321 ? 28.676 44.287 29.466 1.00 13.47 ? 333 ARG A C 1 ATOM 4921 O O . ARG A 1 321 ? 28.420 43.432 30.319 1.00 16.24 ? 333 ARG A O 1 ATOM 4922 C CB . ARG A 1 321 ? 26.979 45.369 27.969 1.00 21.30 ? 333 ARG A CB 1 ATOM 4923 C CG . ARG A 1 321 ? 25.786 45.141 28.850 1.00 17.44 ? 333 ARG A CG 1 ATOM 4924 C CD . ARG A 1 321 ? 24.780 46.347 28.888 1.00 19.66 ? 333 ARG A CD 1 ATOM 4925 N NE . ARG A 1 321 ? 24.396 46.825 27.558 1.00 16.79 ? 333 ARG A NE 1 ATOM 4926 C CZ . ARG A 1 321 ? 23.531 47.802 27.326 1.00 21.07 ? 333 ARG A CZ 1 ATOM 4927 N NH1 . ARG A 1 321 ? 22.850 48.345 28.325 1.00 17.80 ? 333 ARG A NH1 1 ATOM 4928 N NH2 . ARG A 1 321 ? 23.346 48.246 26.088 1.00 17.92 ? 333 ARG A NH2 1 ATOM 4929 H H . ARG A 1 321 ? 27.121 42.529 28.387 1.00 18.24 ? 333 ARG A H 1 ATOM 4930 H HA . ARG A 1 321 ? 28.752 44.471 27.441 1.00 19.04 ? 333 ARG A HA 1 ATOM 4931 H HB2 . ARG A 1 321 ? 27.378 46.216 28.223 1.00 25.56 ? 333 ARG A HB2 1 ATOM 4932 H HB3 . ARG A 1 321 ? 26.667 45.414 27.052 1.00 25.56 ? 333 ARG A HB3 1 ATOM 4933 H HG2 . ARG A 1 321 ? 25.304 44.363 28.527 1.00 20.93 ? 333 ARG A HG2 1 ATOM 4934 H HG3 . ARG A 1 321 ? 26.093 44.983 29.757 1.00 20.93 ? 333 ARG A HG3 1 ATOM 4935 H HD2 . ARG A 1 321 ? 23.973 46.068 29.348 1.00 23.59 ? 333 ARG A HD2 1 ATOM 4936 H HD3 . ARG A 1 321 ? 25.193 47.085 29.362 1.00 23.59 ? 333 ARG A HD3 1 ATOM 4937 H HE . ARG A 1 321 ? 24.758 46.444 26.877 1.00 20.15 ? 333 ARG A HE 1 ATOM 4938 H HH11 . ARG A 1 321 ? 22.991 48.085 29.132 1.00 21.36 ? 333 ARG A HH11 1 ATOM 4939 H HH12 . ARG A 1 321 ? 22.278 48.967 28.167 1.00 21.36 ? 333 ARG A HH12 1 ATOM 4940 H HH21 . ARG A 1 321 ? 23.764 47.878 25.434 1.00 21.50 ? 333 ARG A HH21 1 ATOM 4941 H HH22 . ARG A 1 321 ? 22.746 48.842 25.932 1.00 21.50 ? 333 ARG A HH22 1 ATOM 4942 N N . LEU A 1 322 ? 29.497 45.318 29.644 1.00 17.28 ? 334 LEU A N 1 ATOM 4943 C CA A LEU A 1 322 ? 30.297 45.545 30.845 0.57 17.80 ? 334 LEU A CA 1 ATOM 4944 C CA B LEU A 1 322 ? 30.291 45.545 30.850 0.43 17.81 ? 334 LEU A CA 1 ATOM 4945 C C . LEU A 1 322 ? 30.086 46.975 31.324 1.00 17.76 ? 334 LEU A C 1 ATOM 4946 O O . LEU A 1 322 ? 30.160 47.907 30.520 1.00 20.29 ? 334 LEU A O 1 ATOM 4947 C CB A LEU A 1 322 ? 31.785 45.300 30.509 0.57 21.92 ? 334 LEU A CB 1 ATOM 4948 C CB B LEU A 1 322 ? 31.784 45.296 30.556 0.43 21.94 ? 334 LEU A CB 1 ATOM 4949 C CG A LEU A 1 322 ? 32.873 45.497 31.549 0.57 24.10 ? 334 LEU A CG 1 ATOM 4950 C CG B LEU A 1 322 ? 32.799 45.574 31.659 0.43 23.81 ? 334 LEU A CG 1 ATOM 4951 C CD1 A LEU A 1 322 ? 32.997 44.266 32.421 0.57 18.74 ? 334 LEU A CD1 1 ATOM 4952 C CD1 B LEU A 1 322 ? 34.034 44.729 31.384 0.43 24.65 ? 334 LEU A CD1 1 ATOM 4953 C CD2 A LEU A 1 322 ? 34.198 45.783 30.821 0.57 24.71 ? 334 LEU A CD2 1 ATOM 4954 C CD2 B LEU A 1 322 ? 33.195 47.047 31.736 0.43 22.39 ? 334 LEU A CD2 1 ATOM 4955 H H . LEU A 1 322 ? 29.608 45.927 29.047 1.00 20.74 ? 334 LEU A H 1 ATOM 4956 H HA . LEU A 1 322 ? 30.015 44.935 31.549 1.00 21.38 ? 334 LEU A HA 1 ATOM 4957 H HB2 A LEU A 1 322 ? 31.862 44.381 30.208 0.57 26.30 ? 334 LEU A HB2 1 ATOM 4958 H HB2 B LEU A 1 322 ? 31.885 44.363 30.310 0.43 26.32 ? 334 LEU A HB2 1 ATOM 4959 H HB3 A LEU A 1 322 ? 32.010 45.885 29.768 0.57 26.30 ? 334 LEU A HB3 1 ATOM 4960 H HB3 B LEU A 1 322 ? 32.033 45.849 29.799 0.43 26.32 ? 334 LEU A HB3 1 ATOM 4961 H HG A LEU A 1 322 ? 32.655 46.257 32.111 0.57 28.93 ? 334 LEU A HG 1 ATOM 4962 H HG B LEU A 1 322 ? 32.429 45.309 32.515 0.43 28.57 ? 334 LEU A HG 1 ATOM 4963 H HD11 A LEU A 1 322 ? 33.696 44.414 33.077 0.57 22.49 ? 334 LEU A HD11 1 ATOM 4964 H HD11 B LEU A 1 322 ? 34.691 44.895 32.079 0.43 29.58 ? 334 LEU A HD11 1 ATOM 4965 H HD12 A LEU A 1 322 ? 32.150 44.110 32.869 0.57 22.49 ? 334 LEU A HD12 1 ATOM 4966 H HD12 B LEU A 1 322 ? 33.782 43.792 31.385 0.43 29.58 ? 334 LEU A HD12 1 ATOM 4967 H HD13 A LEU A 1 322 ? 33.222 43.505 31.863 0.57 22.49 ? 334 LEU A HD13 1 ATOM 4968 H HD13 B LEU A 1 322 ? 34.398 44.974 30.519 0.43 29.58 ? 334 LEU A HD13 1 ATOM 4969 H HD21 A LEU A 1 322 ? 34.899 45.910 31.480 0.57 29.65 ? 334 LEU A HD21 1 ATOM 4970 H HD21 B LEU A 1 322 ? 33.839 47.163 32.451 0.43 26.87 ? 334 LEU A HD21 1 ATOM 4971 H HD22 A LEU A 1 322 ? 34.413 45.028 30.250 0.57 29.65 ? 334 LEU A HD22 1 ATOM 4972 H HD22 B LEU A 1 322 ? 33.587 47.312 30.890 0.43 26.87 ? 334 LEU A HD22 1 ATOM 4973 H HD23 A LEU A 1 322 ? 34.098 46.585 30.286 0.57 29.65 ? 334 LEU A HD23 1 ATOM 4974 H HD23 B LEU A 1 322 ? 32.402 47.577 31.914 0.43 26.87 ? 334 LEU A HD23 1 ATOM 4975 N N . PHE A 1 323 ? 29.831 47.158 32.631 1.00 18.29 ? 335 PHE A N 1 ATOM 4976 C CA . PHE A 1 323 ? 29.790 48.495 33.199 1.00 16.46 ? 335 PHE A CA 1 ATOM 4977 C C . PHE A 1 323 ? 31.034 48.775 34.033 1.00 19.18 ? 335 PHE A C 1 ATOM 4978 O O . PHE A 1 323 ? 31.604 47.870 34.645 1.00 19.04 ? 335 PHE A O 1 ATOM 4979 C CB . PHE A 1 323 ? 28.564 48.706 34.085 1.00 16.65 ? 335 PHE A CB 1 ATOM 4980 C CG . PHE A 1 323 ? 27.283 48.814 33.295 1.00 15.29 ? 335 PHE A CG 1 ATOM 4981 C CD1 . PHE A 1 323 ? 26.580 47.672 32.947 1.00 14.44 ? 335 PHE A CD1 1 ATOM 4982 C CD2 . PHE A 1 323 ? 26.826 50.043 32.857 1.00 18.51 ? 335 PHE A CD2 1 ATOM 4983 C CE1 . PHE A 1 323 ? 25.386 47.793 32.176 1.00 15.86 ? 335 PHE A CE1 1 ATOM 4984 C CE2 . PHE A 1 323 ? 25.677 50.149 32.134 1.00 16.76 ? 335 PHE A CE2 1 ATOM 4985 C CZ . PHE A 1 323 ? 24.965 49.027 31.794 1.00 17.12 ? 335 PHE A CZ 1 ATOM 4986 H H . PHE A 1 323 ? 29.681 46.527 33.195 1.00 21.95 ? 335 PHE A H 1 ATOM 4987 H HA . PHE A 1 323 ? 29.757 49.145 32.479 1.00 19.75 ? 335 PHE A HA 1 ATOM 4988 H HB2 . PHE A 1 323 ? 28.480 47.954 34.692 1.00 19.98 ? 335 PHE A HB2 1 ATOM 4989 H HB3 . PHE A 1 323 ? 28.676 49.528 34.589 1.00 19.98 ? 335 PHE A HB3 1 ATOM 4990 H HD1 . PHE A 1 323 ? 26.880 46.835 33.220 1.00 17.33 ? 335 PHE A HD1 1 ATOM 4991 H HD2 . PHE A 1 323 ? 27.296 50.813 33.085 1.00 22.21 ? 335 PHE A HD2 1 ATOM 4992 H HE1 . PHE A 1 323 ? 24.896 47.036 31.947 1.00 19.04 ? 335 PHE A HE1 1 ATOM 4993 H HE2 . PHE A 1 323 ? 25.380 50.986 31.858 1.00 20.11 ? 335 PHE A HE2 1 ATOM 4994 H HZ . PHE A 1 323 ? 24.186 49.112 31.293 1.00 20.55 ? 335 PHE A HZ 1 ATOM 4995 N N . GLN A 1 324 ? 31.418 50.044 34.046 1.00 18.24 ? 336 GLN A N 1 ATOM 4996 C CA . GLN A 1 324 ? 32.463 50.576 34.923 1.00 20.51 ? 336 GLN A CA 1 ATOM 4997 C C . GLN A 1 324 ? 31.848 51.520 35.943 1.00 22.40 ? 336 GLN A C 1 ATOM 4998 O O . GLN A 1 324 ? 31.004 52.354 35.595 1.00 20.93 ? 336 GLN A O 1 ATOM 4999 C CB . GLN A 1 324 ? 33.506 51.330 34.111 1.00 20.01 ? 336 GLN A CB 1 ATOM 5000 C CG . GLN A 1 324 ? 34.190 50.404 33.098 1.00 21.64 ? 336 GLN A CG 1 ATOM 5001 C CD . GLN A 1 324 ? 35.275 51.076 32.323 1.00 34.43 ? 336 GLN A CD 1 ATOM 5002 O OE1 . GLN A 1 324 ? 35.249 52.290 32.107 1.00 36.58 ? 336 GLN A OE1 1 ATOM 5003 N NE2 . GLN A 1 324 ? 36.242 50.285 31.872 1.00 38.69 ? 336 GLN A NE2 1 ATOM 5004 H H . GLN A 1 324 ? 31.075 50.645 33.534 1.00 21.88 ? 336 GLN A H 1 ATOM 5005 H HA . GLN A 1 324 ? 32.898 49.848 35.393 1.00 24.61 ? 336 GLN A HA 1 ATOM 5006 H HB2 . GLN A 1 324 ? 33.076 52.050 33.625 1.00 24.02 ? 336 GLN A HB2 1 ATOM 5007 H HB3 . GLN A 1 324 ? 34.184 51.683 34.708 1.00 24.02 ? 336 GLN A HB3 1 ATOM 5008 H HG2 . GLN A 1 324 ? 34.583 49.655 33.572 1.00 25.97 ? 336 GLN A HG2 1 ATOM 5009 H HG3 . GLN A 1 324 ? 33.527 50.085 32.466 1.00 25.97 ? 336 GLN A HG3 1 ATOM 5010 H HE21 . GLN A 1 324 ? 36.217 49.440 32.032 1.00 46.42 ? 336 GLN A HE21 1 ATOM 5011 H HE22 . GLN A 1 324 ? 36.893 50.617 31.419 1.00 46.42 ? 336 GLN A HE22 1 ATOM 5012 N N . TYR A 1 325 ? 32.332 51.446 37.182 1.00 20.62 ? 337 TYR A N 1 ATOM 5013 C CA . TYR A 1 325 ? 31.775 52.268 38.246 1.00 17.74 ? 337 TYR A CA 1 ATOM 5014 C C . TYR A 1 325 ? 32.886 52.717 39.187 1.00 23.99 ? 337 TYR A C 1 ATOM 5015 O O . TYR A 1 325 ? 33.980 52.151 39.211 1.00 20.15 ? 337 TYR A O 1 ATOM 5016 C CB . TYR A 1 325 ? 30.682 51.526 39.043 1.00 19.56 ? 337 TYR A CB 1 ATOM 5017 C CG . TYR A 1 325 ? 31.165 50.288 39.745 1.00 18.18 ? 337 TYR A CG 1 ATOM 5018 C CD1 . TYR A 1 325 ? 31.686 50.337 41.038 1.00 17.68 ? 337 TYR A CD1 1 ATOM 5019 C CD2 . TYR A 1 325 ? 31.105 49.055 39.114 1.00 18.95 ? 337 TYR A CD2 1 ATOM 5020 C CE1 . TYR A 1 325 ? 32.145 49.207 41.651 1.00 21.92 ? 337 TYR A CE1 1 ATOM 5021 C CE2 . TYR A 1 325 ? 31.547 47.922 39.725 1.00 21.90 ? 337 TYR A CE2 1 ATOM 5022 C CZ . TYR A 1 325 ? 32.067 47.994 40.995 1.00 22.45 ? 337 TYR A CZ 1 ATOM 5023 O OH . TYR A 1 325 ? 32.504 46.829 41.587 1.00 23.27 ? 337 TYR A OH 1 ATOM 5024 H H . TYR A 1 325 ? 32.977 50.932 37.428 1.00 24.74 ? 337 TYR A H 1 ATOM 5025 H HA . TYR A 1 325 ? 31.374 53.060 37.855 1.00 21.29 ? 337 TYR A HA 1 ATOM 5026 H HB2 . TYR A 1 325 ? 30.325 52.127 39.716 1.00 23.48 ? 337 TYR A HB2 1 ATOM 5027 H HB3 . TYR A 1 325 ? 29.976 51.263 38.432 1.00 23.48 ? 337 TYR A HB3 1 ATOM 5028 H HD1 . TYR A 1 325 ? 31.745 51.154 41.479 1.00 21.22 ? 337 TYR A HD1 1 ATOM 5029 H HD2 . TYR A 1 325 ? 30.759 49.001 38.252 1.00 22.74 ? 337 TYR A HD2 1 ATOM 5030 H HE1 . TYR A 1 325 ? 32.489 49.251 42.514 1.00 26.30 ? 337 TYR A HE1 1 ATOM 5031 H HE2 . TYR A 1 325 ? 31.500 47.104 39.285 1.00 26.28 ? 337 TYR A HE2 1 ATOM 5032 H HH . TYR A 1 325 ? 32.800 46.991 42.357 1.00 27.92 ? 337 TYR A HH 1 ATOM 5033 N N . LYS A 1 326 ? 32.569 53.732 39.972 1.00 20.65 ? 338 LYS A N 1 ATOM 5034 C CA . LYS A 1 326 ? 33.508 54.289 40.941 1.00 22.06 ? 338 LYS A CA 1 ATOM 5035 C C . LYS A 1 326 ? 33.549 53.421 42.197 1.00 20.74 ? 338 LYS A C 1 ATOM 5036 O O . LYS A 1 326 ? 32.514 53.203 42.819 1.00 23.38 ? 338 LYS A O 1 ATOM 5037 C CB . LYS A 1 326 ? 33.109 55.719 41.276 1.00 24.25 ? 338 LYS A CB 1 ATOM 5038 C CG . LYS A 1 326 ? 34.196 56.545 41.942 1.00 41.92 ? 338 LYS A CG 1 ATOM 5039 C CD . LYS A 1 326 ? 33.734 57.985 42.232 1.00 51.09 ? 338 LYS A CD 1 ATOM 5040 C CE . LYS A 1 326 ? 33.058 58.636 41.016 1.00 55.56 ? 338 LYS A CE 1 ATOM 5041 N NZ . LYS A 1 326 ? 32.781 60.103 41.206 1.00 63.28 ? 338 LYS A NZ 1 ATOM 5042 H H . LYS A 1 326 ? 31.804 54.125 39.967 1.00 24.78 ? 338 LYS A H 1 ATOM 5043 H HA . LYS A 1 326 ? 34.397 54.304 40.553 1.00 26.47 ? 338 LYS A HA 1 ATOM 5044 H HB2 . LYS A 1 326 ? 32.858 56.171 40.455 1.00 29.10 ? 338 LYS A HB2 1 ATOM 5045 H HB3 . LYS A 1 326 ? 32.349 55.695 41.879 1.00 29.10 ? 338 LYS A HB3 1 ATOM 5046 H HG2 . LYS A 1 326 ? 34.440 56.131 42.784 1.00 50.30 ? 338 LYS A HG2 1 ATOM 5047 H HG3 . LYS A 1 326 ? 34.967 56.588 41.355 1.00 50.30 ? 338 LYS A HG3 1 ATOM 5048 H HD2 . LYS A 1 326 ? 33.094 57.972 42.961 1.00 61.31 ? 338 LYS A HD2 1 ATOM 5049 H HD3 . LYS A 1 326 ? 34.504 58.523 42.473 1.00 61.31 ? 338 LYS A HD3 1 ATOM 5050 H HE2 . LYS A 1 326 ? 33.638 58.539 40.245 1.00 66.67 ? 338 LYS A HE2 1 ATOM 5051 H HE3 . LYS A 1 326 ? 32.212 58.191 40.851 1.00 66.67 ? 338 LYS A HE3 1 ATOM 5052 H HZ1 . LYS A 1 326 ? 32.390 60.435 40.478 1.00 75.93 ? 338 LYS A HZ1 1 ATOM 5053 H HZ2 . LYS A 1 326 ? 32.241 60.223 41.904 1.00 75.93 ? 338 LYS A HZ2 1 ATOM 5054 H HZ3 . LYS A 1 326 ? 33.542 60.540 41.351 1.00 75.93 ? 338 LYS A HZ3 1 ATOM 5055 N N . PRO A 1 327 ? 34.713 52.895 42.590 1.00 21.60 ? 339 PRO A N 1 ATOM 5056 C CA . PRO A 1 327 ? 34.744 51.957 43.706 1.00 27.54 ? 339 PRO A CA 1 ATOM 5057 C C . PRO A 1 327 ? 34.333 52.638 44.994 1.00 30.79 ? 339 PRO A C 1 ATOM 5058 O O . PRO A 1 327 ? 34.583 53.831 45.203 1.00 27.66 ? 339 PRO A O 1 ATOM 5059 C CB . PRO A 1 327 ? 36.207 51.491 43.739 1.00 35.34 ? 339 PRO A CB 1 ATOM 5060 C CG . PRO A 1 327 ? 36.672 51.661 42.369 1.00 33.91 ? 339 PRO A CG 1 ATOM 5061 C CD . PRO A 1 327 ? 35.993 52.923 41.875 1.00 24.77 ? 339 PRO A CD 1 ATOM 5062 H HA . PRO A 1 327 ? 34.162 51.200 43.535 1.00 33.05 ? 339 PRO A HA 1 ATOM 5063 H HB2 . PRO A 1 327 ? 36.716 52.048 44.348 1.00 42.41 ? 339 PRO A HB2 1 ATOM 5064 H HB3 . PRO A 1 327 ? 36.249 50.559 44.005 1.00 42.41 ? 339 PRO A HB3 1 ATOM 5065 H HG2 . PRO A 1 327 ? 37.636 51.765 42.361 1.00 40.69 ? 339 PRO A HG2 1 ATOM 5066 H HG3 . PRO A 1 327 ? 36.404 50.896 41.836 1.00 40.69 ? 339 PRO A HG3 1 ATOM 5067 H HD2 . PRO A 1 327 ? 36.506 53.707 42.125 1.00 29.72 ? 339 PRO A HD2 1 ATOM 5068 H HD3 . PRO A 1 327 ? 35.848 52.879 40.916 1.00 29.72 ? 339 PRO A HD3 1 ATOM 5069 N N . GLY A 1 328 ? 33.651 51.872 45.833 1.00 26.90 ? 340 GLY A N 1 ATOM 5070 C CA . GLY A 1 328 ? 33.135 52.359 47.097 1.00 32.48 ? 340 GLY A CA 1 ATOM 5071 C C . GLY A 1 328 ? 32.126 53.477 46.966 1.00 34.58 ? 340 GLY A C 1 ATOM 5072 O O . GLY A 1 328 ? 31.656 54.010 47.974 1.00 31.94 ? 340 GLY A O 1 ATOM 5073 H H . GLY A 1 328 ? 33.470 51.044 45.685 1.00 32.28 ? 340 GLY A H 1 ATOM 5074 H HA2 . GLY A 1 328 ? 32.712 51.625 47.570 1.00 38.97 ? 340 GLY A HA2 1 ATOM 5075 H HA3 . GLY A 1 328 ? 33.873 52.681 47.637 1.00 38.97 ? 340 GLY A HA3 1 ATOM 5076 N N . ASP A 1 329 ? 31.762 53.837 45.734 1.00 29.34 ? 341 ASP A N 1 ATOM 5077 C CA . ASP A 1 329 ? 30.887 54.982 45.511 1.00 24.51 ? 341 ASP A CA 1 ATOM 5078 C C . ASP A 1 329 ? 29.702 54.581 44.615 1.00 25.23 ? 341 ASP A C 1 ATOM 5079 O O . ASP A 1 329 ? 28.543 54.934 44.865 1.00 25.62 ? 341 ASP A O 1 ATOM 5080 C CB . ASP A 1 329 ? 31.707 56.107 44.887 1.00 30.10 ? 341 ASP A CB 1 ATOM 5081 C CG . ASP A 1 329 ? 30.840 57.223 44.331 1.00 37.87 ? 341 ASP A CG 1 ATOM 5082 O OD1 . ASP A 1 329 ? 30.265 57.040 43.234 1.00 32.19 ? 341 ASP A OD1 1 ATOM 5083 O OD2 . ASP A 1 329 ? 30.738 58.278 44.984 1.00 44.37 ? 341 ASP A OD2 1 ATOM 5084 H H . ASP A 1 329 ? 32.008 53.434 45.014 1.00 35.21 ? 341 ASP A H 1 ATOM 5085 H HA . ASP A 1 329 ? 30.537 55.292 46.361 1.00 29.41 ? 341 ASP A HA 1 ATOM 5086 H HB2 . ASP A 1 329 ? 32.289 56.487 45.563 1.00 36.12 ? 341 ASP A HB2 1 ATOM 5087 H HB3 . ASP A 1 329 ? 32.235 55.747 44.158 1.00 36.12 ? 341 ASP A HB3 1 ATOM 5088 N N . TYR A 1 330 ? 30.009 53.857 43.547 1.00 23.45 ? 342 TYR A N 1 ATOM 5089 C CA . TYR A 1 330 ? 29.070 53.090 42.714 1.00 22.98 ? 342 TYR A CA 1 ATOM 5090 C C . TYR A 1 330 ? 28.383 53.953 41.671 1.00 24.10 ? 342 TYR A C 1 ATOM 5091 O O . TYR A 1 330 ? 27.553 53.431 40.924 1.00 20.15 ? 342 TYR A O 1 ATOM 5092 C CB . TYR A 1 330 ? 28.062 52.312 43.569 1.00 20.56 ? 342 TYR A CB 1 ATOM 5093 C CG . TYR A 1 330 ? 28.838 51.483 44.576 1.00 21.28 ? 342 TYR A CG 1 ATOM 5094 C CD1 . TYR A 1 330 ? 29.741 50.527 44.145 1.00 23.31 ? 342 TYR A CD1 1 ATOM 5095 C CD2 . TYR A 1 330 ? 28.733 51.725 45.947 1.00 22.95 ? 342 TYR A CD2 1 ATOM 5096 C CE1 . TYR A 1 330 ? 30.507 49.797 45.044 1.00 22.44 ? 342 TYR A CE1 1 ATOM 5097 C CE2 . TYR A 1 330 ? 29.499 50.999 46.860 1.00 20.79 ? 342 TYR A CE2 1 ATOM 5098 C CZ . TYR A 1 330 ? 30.389 50.045 46.388 1.00 24.25 ? 342 TYR A CZ 1 ATOM 5099 O OH . TYR A 1 330 ? 31.169 49.312 47.243 1.00 24.65 ? 342 TYR A OH 1 ATOM 5100 H H . TYR A 1 330 ? 30.818 53.787 43.262 1.00 28.14 ? 342 TYR A H 1 ATOM 5101 H HA . TYR A 1 330 ? 29.587 52.429 42.227 1.00 27.58 ? 342 TYR A HA 1 ATOM 5102 H HB2 . TYR A 1 330 ? 27.487 52.931 44.047 1.00 24.67 ? 342 TYR A HB2 1 ATOM 5103 H HB3 . TYR A 1 330 ? 27.541 51.718 43.007 1.00 24.67 ? 342 TYR A HB3 1 ATOM 5104 H HD1 . TYR A 1 330 ? 29.836 50.369 43.233 1.00 27.97 ? 342 TYR A HD1 1 ATOM 5105 H HD2 . TYR A 1 330 ? 28.146 52.377 46.256 1.00 27.54 ? 342 TYR A HD2 1 ATOM 5106 H HE1 . TYR A 1 330 ? 31.106 49.155 44.737 1.00 26.93 ? 342 TYR A HE1 1 ATOM 5107 H HE2 . TYR A 1 330 ? 29.422 51.160 47.772 1.00 24.95 ? 342 TYR A HE2 1 ATOM 5108 H HH . TYR A 1 330 ? 31.019 49.543 48.037 1.00 29.58 ? 342 TYR A HH 1 ATOM 5109 N N . THR A 1 331 ? 28.784 55.210 41.533 1.00 20.21 ? 343 THR A N 1 ATOM 5110 C CA . THR A 1 331 ? 28.423 56.013 40.376 1.00 19.34 ? 343 THR A CA 1 ATOM 5111 C C . THR A 1 331 ? 28.905 55.340 39.103 1.00 21.45 ? 343 THR A C 1 ATOM 5112 O O . THR A 1 331 ? 30.047 54.881 39.008 1.00 20.07 ? 343 THR A O 1 ATOM 5113 C CB . THR A 1 331 ? 29.034 57.417 40.484 1.00 24.82 ? 343 THR A CB 1 ATOM 5114 O OG1 . THR A 1 331 ? 28.514 58.061 41.650 1.00 27.79 ? 343 THR A OG1 1 ATOM 5115 C CG2 . THR A 1 331 ? 28.645 58.236 39.273 1.00 25.97 ? 343 THR A CG2 1 ATOM 5116 H H . THR A 1 331 ? 29.273 55.626 42.105 1.00 24.26 ? 343 THR A H 1 ATOM 5117 H HA . THR A 1 331 ? 27.458 56.100 40.331 1.00 23.21 ? 343 THR A HA 1 ATOM 5118 H HB . THR A 1 331 ? 30.001 57.360 40.535 1.00 29.79 ? 343 THR A HB 1 ATOM 5119 H HG1 . THR A 1 331 ? 28.711 57.617 42.335 1.00 33.34 ? 343 THR A HG1 1 ATOM 5120 H HG21 . THR A 1 331 ? 29.029 59.125 39.337 1.00 31.16 ? 343 THR A HG21 1 ATOM 5121 H HG22 . THR A 1 331 ? 28.971 57.809 38.465 1.00 31.16 ? 343 THR A HG22 1 ATOM 5122 H HG23 . THR A 1 331 ? 27.679 58.313 39.221 1.00 31.16 ? 343 THR A HG23 1 ATOM 5123 N N . LEU A 1 332 ? 28.021 55.264 38.119 1.00 20.34 ? 344 LEU A N 1 ATOM 5124 C CA . LEU A 1 332 ? 28.361 54.609 36.865 1.00 21.38 ? 344 LEU A CA 1 ATOM 5125 C C . LEU A 1 332 ? 29.225 55.514 36.002 1.00 21.99 ? 344 LEU A C 1 ATOM 5126 O O . LEU A 1 332 ? 28.834 56.641 35.682 1.00 21.17 ? 344 LEU A O 1 ATOM 5127 C CB . LEU A 1 332 ? 27.085 54.227 36.120 1.00 18.56 ? 344 LEU A CB 1 ATOM 5128 C CG . LEU A 1 332 ? 26.276 53.135 36.789 1.00 21.30 ? 344 LEU A CG 1 ATOM 5129 C CD1 . LEU A 1 332 ? 24.942 52.998 36.038 1.00 20.59 ? 344 LEU A CD1 1 ATOM 5130 C CD2 . LEU A 1 332 ? 27.007 51.802 36.810 1.00 22.31 ? 344 LEU A CD2 1 ATOM 5131 H H . LEU A 1 332 ? 27.222 55.582 38.151 1.00 24.41 ? 344 LEU A H 1 ATOM 5132 H HA . LEU A 1 332 ? 28.860 53.798 37.052 1.00 25.65 ? 344 LEU A HA 1 ATOM 5133 H HB2 . LEU A 1 332 ? 26.520 55.012 36.049 1.00 22.27 ? 344 LEU A HB2 1 ATOM 5134 H HB3 . LEU A 1 332 ? 27.325 53.915 35.233 1.00 22.27 ? 344 LEU A HB3 1 ATOM 5135 H HG . LEU A 1 332 ? 26.085 53.393 37.705 1.00 25.56 ? 344 LEU A HG 1 ATOM 5136 H HD11 . LEU A 1 332 ? 24.414 52.301 36.458 1.00 24.71 ? 344 LEU A HD11 1 ATOM 5137 H HD12 . LEU A 1 332 ? 24.468 53.843 36.080 1.00 24.71 ? 344 LEU A HD12 1 ATOM 5138 H HD13 . LEU A 1 332 ? 25.123 52.765 35.114 1.00 24.71 ? 344 LEU A HD13 1 ATOM 5139 H HD21 . LEU A 1 332 ? 26.447 51.142 37.247 1.00 26.77 ? 344 LEU A HD21 1 ATOM 5140 H HD22 . LEU A 1 332 ? 27.190 51.529 35.897 1.00 26.77 ? 344 LEU A HD22 1 ATOM 5141 H HD23 . LEU A 1 332 ? 27.839 51.906 37.297 1.00 26.77 ? 344 LEU A HD23 1 ATOM 5142 N N . LEU A 1 333 ? 30.377 54.993 35.565 1.00 19.80 ? 345 LEU A N 1 ATOM 5143 C CA . LEU A 1 333 ? 31.339 55.761 34.778 1.00 18.88 ? 345 LEU A CA 1 ATOM 5144 C C . LEU A 1 333 ? 31.254 55.487 33.292 1.00 18.50 ? 345 LEU A C 1 ATOM 5145 O O . LEU A 1 333 ? 31.440 56.418 32.502 1.00 19.86 ? 345 LEU A O 1 ATOM 5146 C CB . LEU A 1 333 ? 32.774 55.469 35.238 1.00 20.04 ? 345 LEU A CB 1 ATOM 5147 C CG . LEU A 1 333 ? 33.026 55.807 36.712 1.00 23.04 ? 345 LEU A CG 1 ATOM 5148 C CD1 . LEU A 1 333 ? 34.402 55.369 37.105 1.00 27.15 ? 345 LEU A CD1 1 ATOM 5149 C CD2 . LEU A 1 333 ? 32.853 57.319 36.926 1.00 30.27 ? 345 LEU A CD2 1 ATOM 5150 H H . LEU A 1 333 ? 30.624 54.183 35.715 1.00 23.76 ? 345 LEU A H 1 ATOM 5151 H HA . LEU A 1 333 ? 31.170 56.707 34.915 1.00 22.66 ? 345 LEU A HA 1 ATOM 5152 H HB2 . LEU A 1 333 ? 32.956 54.525 35.114 1.00 24.05 ? 345 LEU A HB2 1 ATOM 5153 H HB3 . LEU A 1 333 ? 33.388 55.996 34.703 1.00 24.05 ? 345 LEU A HB3 1 ATOM 5154 H HG . LEU A 1 333 ? 32.382 55.340 37.268 1.00 27.64 ? 345 LEU A HG 1 ATOM 5155 H HD11 . LEU A 1 333 ? 34.548 55.588 38.038 1.00 32.58 ? 345 LEU A HD11 1 ATOM 5156 H HD12 . LEU A 1 333 ? 34.477 54.410 36.974 1.00 32.58 ? 345 LEU A HD12 1 ATOM 5157 H HD13 . LEU A 1 333 ? 35.050 55.830 36.551 1.00 32.58 ? 345 LEU A HD13 1 ATOM 5158 H HD21 . LEU A 1 333 ? 33.014 57.526 37.861 1.00 36.32 ? 345 LEU A HD21 1 ATOM 5159 H HD22 . LEU A 1 333 ? 33.491 57.791 36.368 1.00 36.32 ? 345 LEU A HD22 1 ATOM 5160 H HD23 . LEU A 1 333 ? 31.949 57.571 36.682 1.00 36.32 ? 345 LEU A HD23 1 ATOM 5161 N N . ASP A 1 334 ? 30.981 54.237 32.892 1.00 19.69 ? 346 ASP A N 1 ATOM 5162 C CA . ASP A 1 334 ? 30.989 53.872 31.484 1.00 19.02 ? 346 ASP A CA 1 ATOM 5163 C C . ASP A 1 334 ? 30.283 52.546 31.275 1.00 15.64 ? 346 ASP A C 1 ATOM 5164 O O . ASP A 1 334 ? 29.975 51.807 32.210 1.00 17.02 ? 346 ASP A O 1 ATOM 5165 C CB . ASP A 1 334 ? 32.407 53.777 30.920 1.00 20.48 ? 346 ASP A CB 1 ATOM 5166 C CG . ASP A 1 334 ? 32.542 54.467 29.562 1.00 26.60 ? 346 ASP A CG 1 ATOM 5167 O OD1 . ASP A 1 334 ? 31.541 54.540 28.807 1.00 22.45 ? 346 ASP A OD1 1 ATOM 5168 O OD2 . ASP A 1 334 ? 33.645 54.960 29.264 1.00 25.61 ? 346 ASP A OD2 1 ATOM 5169 H H . ASP A 1 334 ? 30.789 53.588 33.423 1.00 23.63 ? 346 ASP A H 1 ATOM 5170 H HA . ASP A 1 334 ? 30.510 54.549 30.980 1.00 22.82 ? 346 ASP A HA 1 ATOM 5171 H HB2 . ASP A 1 334 ? 33.022 54.204 31.537 1.00 24.57 ? 346 ASP A HB2 1 ATOM 5172 H HB3 . ASP A 1 334 ? 32.642 52.843 30.808 1.00 24.57 ? 346 ASP A HB3 1 ATOM 5173 N N . MET A 1 335 ? 29.993 52.292 30.006 1.00 17.06 ? 347 MET A N 1 ATOM 5174 C CA A MET A 1 335 ? 29.428 51.033 29.554 0.62 17.57 ? 347 MET A CA 1 ATOM 5175 C CA B MET A 1 335 ? 29.442 51.030 29.560 0.38 17.64 ? 347 MET A CA 1 ATOM 5176 C C . MET A 1 335 ? 30.158 50.641 28.282 1.00 20.50 ? 347 MET A C 1 ATOM 5177 O O . MET A 1 335 ? 30.339 51.477 27.401 1.00 19.52 ? 347 MET A O 1 ATOM 5178 C CB A MET A 1 335 ? 27.923 51.169 29.288 0.62 20.96 ? 347 MET A CB 1 ATOM 5179 C CB B MET A 1 335 ? 27.948 51.136 29.312 0.38 20.96 ? 347 MET A CB 1 ATOM 5180 C CG A MET A 1 335 ? 27.204 49.814 29.065 0.62 20.93 ? 347 MET A CG 1 ATOM 5181 C CG B MET A 1 335 ? 27.311 49.777 29.114 0.38 20.83 ? 347 MET A CG 1 ATOM 5182 S SD A MET A 1 335 ? 27.198 49.234 27.359 0.62 20.10 ? 347 MET A SD 1 ATOM 5183 S SD B MET A 1 335 ? 25.713 50.035 28.383 0.38 17.21 ? 347 MET A SD 1 ATOM 5184 C CE A MET A 1 335 ? 26.179 50.452 26.535 0.62 21.13 ? 347 MET A CE 1 ATOM 5185 C CE B MET A 1 335 ? 26.156 50.250 26.657 0.38 20.48 ? 347 MET A CE 1 ATOM 5186 H H . MET A 1 335 ? 30.118 52.857 29.370 1.00 20.47 ? 347 MET A H 1 ATOM 5187 H HA . MET A 1 335 ? 29.579 50.352 30.234 1.00 21.17 ? 347 MET A HA 1 ATOM 5188 H HB2 A MET A 1 335 ? 27.509 51.603 30.050 0.62 25.15 ? 347 MET A HB2 1 ATOM 5189 H HB2 B MET A 1 335 ? 27.527 51.560 30.076 0.38 25.15 ? 347 MET A HB2 1 ATOM 5190 H HB3 A MET A 1 335 ? 27.794 51.708 28.492 0.62 25.15 ? 347 MET A HB3 1 ATOM 5191 H HB3 B MET A 1 335 ? 27.794 51.662 28.511 0.38 25.15 ? 347 MET A HB3 1 ATOM 5192 H HG2 A MET A 1 335 ? 27.645 49.138 29.603 0.62 25.12 ? 347 MET A HG2 1 ATOM 5193 H HG2 B MET A 1 335 ? 27.852 49.242 28.512 0.38 24.99 ? 347 MET A HG2 1 ATOM 5194 H HG3 A MET A 1 335 ? 26.281 49.904 29.347 0.62 25.12 ? 347 MET A HG3 1 ATOM 5195 H HG3 B MET A 1 335 ? 27.200 49.335 29.970 0.38 24.99 ? 347 MET A HG3 1 ATOM 5196 H HE1 A MET A 1 335 ? 26.113 50.224 25.595 0.62 25.36 ? 347 MET A HE1 1 ATOM 5197 H HE1 B MET A 1 335 ? 25.349 50.402 26.141 0.38 24.57 ? 347 MET A HE1 1 ATOM 5198 H HE2 A MET A 1 335 ? 25.297 50.449 26.939 0.62 25.36 ? 347 MET A HE2 1 ATOM 5199 H HE2 B MET A 1 335 ? 26.750 51.013 26.577 0.38 24.57 ? 347 MET A HE2 1 ATOM 5200 H HE3 A MET A 1 335 ? 26.587 51.326 26.637 0.62 25.36 ? 347 MET A HE3 1 ATOM 5201 H HE3 B MET A 1 335 ? 26.604 49.448 26.344 0.38 24.57 ? 347 MET A HE3 1 ATOM 5202 N N . VAL A 1 336 ? 30.580 49.387 28.215 1.00 18.44 ? 348 VAL A N 1 ATOM 5203 C CA . VAL A 1 336 ? 31.235 48.798 27.049 1.00 19.15 ? 348 VAL A CA 1 ATOM 5204 C C . VAL A 1 336 ? 30.327 47.700 26.509 1.00 18.83 ? 348 VAL A C 1 ATOM 5205 O O . VAL A 1 336 ? 30.030 46.727 27.220 1.00 18.26 ? 348 VAL A O 1 ATOM 5206 C CB . VAL A 1 336 ? 32.614 48.240 27.425 1.00 22.55 ? 348 VAL A CB 1 ATOM 5207 C CG1 . VAL A 1 336 ? 33.365 47.764 26.160 1.00 25.52 ? 348 VAL A CG1 1 ATOM 5208 C CG2 . VAL A 1 336 ? 33.414 49.282 28.211 1.00 27.21 ? 348 VAL A CG2 1 ATOM 5209 H H . VAL A 1 336 ? 30.495 48.829 28.864 1.00 22.13 ? 348 VAL A H 1 ATOM 5210 H HA . VAL A 1 336 ? 31.349 49.474 26.362 1.00 22.98 ? 348 VAL A HA 1 ATOM 5211 H HB . VAL A 1 336 ? 32.490 47.469 28.000 1.00 27.07 ? 348 VAL A HB 1 ATOM 5212 H HG11 . VAL A 1 336 ? 34.232 47.416 26.420 1.00 30.63 ? 348 VAL A HG11 1 ATOM 5213 H HG12 . VAL A 1 336 ? 32.845 47.068 25.727 1.00 30.63 ? 348 VAL A HG12 1 ATOM 5214 H HG13 . VAL A 1 336 ? 33.477 48.516 25.558 1.00 30.63 ? 348 VAL A HG13 1 ATOM 5215 H HG21 . VAL A 1 336 ? 34.280 48.909 28.438 1.00 32.65 ? 348 VAL A HG21 1 ATOM 5216 H HG22 . VAL A 1 336 ? 33.527 50.073 27.662 1.00 32.65 ? 348 VAL A HG22 1 ATOM 5217 H HG23 . VAL A 1 336 ? 32.928 49.507 29.020 1.00 32.65 ? 348 VAL A HG23 1 ATOM 5218 N N . GLN A 1 337 ? 29.874 47.857 25.270 1.00 17.50 ? 349 GLN A N 1 ATOM 5219 C CA . GLN A 1 337 ? 29.022 46.876 24.611 1.00 15.62 ? 349 GLN A CA 1 ATOM 5220 C C . GLN A 1 337 ? 29.875 46.031 23.683 1.00 17.15 ? 349 GLN A C 1 ATOM 5221 O O . GLN A 1 337 ? 30.536 46.579 22.807 1.00 18.06 ? 349 GLN A O 1 ATOM 5222 C CB . GLN A 1 337 ? 27.931 47.565 23.802 1.00 15.81 ? 349 GLN A CB 1 ATOM 5223 C CG . GLN A 1 337 ? 26.970 46.602 23.131 1.00 16.07 ? 349 GLN A CG 1 ATOM 5224 C CD . GLN A 1 337 ? 26.076 45.861 24.113 1.00 17.52 ? 349 GLN A CD 1 ATOM 5225 O OE1 . GLN A 1 337 ? 25.375 46.468 24.927 1.00 18.03 ? 349 GLN A OE1 1 ATOM 5226 N NE2 . GLN A 1 337 ? 26.113 44.529 24.061 1.00 18.62 ? 349 GLN A NE2 1 ATOM 5227 H H . GLN A 1 337 ? 30.052 48.541 24.779 1.00 21.01 ? 349 GLN A H 1 ATOM 5228 H HA . GLN A 1 337 ? 28.608 46.299 25.272 1.00 18.74 ? 349 GLN A HA 1 ATOM 5229 H HB2 . GLN A 1 337 ? 27.415 48.135 24.394 1.00 18.97 ? 349 GLN A HB2 1 ATOM 5230 H HB3 . GLN A 1 337 ? 28.346 48.101 23.109 1.00 18.97 ? 349 GLN A HB3 1 ATOM 5231 H HG2 . GLN A 1 337 ? 26.399 47.099 22.524 1.00 19.28 ? 349 GLN A HG2 1 ATOM 5232 H HG3 . GLN A 1 337 ? 27.481 45.942 22.637 1.00 19.28 ? 349 GLN A HG3 1 ATOM 5233 H HE21 . GLN A 1 337 ? 26.624 44.135 23.492 1.00 22.35 ? 349 GLN A HE21 1 ATOM 5234 H HE22 . GLN A 1 337 ? 25.626 44.064 24.596 1.00 22.35 ? 349 GLN A HE22 1 ATOM 5235 N N . TYR A 1 338 ? 29.830 44.722 23.867 1.00 18.75 ? 350 TYR A N 1 ATOM 5236 C CA . TYR A 1 338 ? 30.459 43.753 22.969 1.00 18.88 ? 350 TYR A CA 1 ATOM 5237 C C . TYR A 1 338 ? 29.392 43.051 22.131 1.00 24.30 ? 350 TYR A C 1 ATOM 5238 O O . TYR A 1 338 ? 28.216 42.976 22.510 1.00 19.30 ? 350 TYR A O 1 ATOM 5239 C CB . TYR A 1 338 ? 31.250 42.715 23.764 1.00 20.52 ? 350 TYR A CB 1 ATOM 5240 C CG . TYR A 1 338 ? 32.361 43.312 24.583 1.00 18.18 ? 350 TYR A CG 1 ATOM 5241 C CD1 . TYR A 1 338 ? 33.610 43.549 24.016 1.00 24.38 ? 350 TYR A CD1 1 ATOM 5242 C CD2 . TYR A 1 338 ? 32.165 43.619 25.929 1.00 21.14 ? 350 TYR A CD2 1 ATOM 5243 C CE1 . TYR A 1 338 ? 34.632 44.097 24.758 1.00 26.08 ? 350 TYR A CE1 1 ATOM 5244 C CE2 . TYR A 1 338 ? 33.171 44.167 26.682 1.00 23.16 ? 350 TYR A CE2 1 ATOM 5245 C CZ . TYR A 1 338 ? 34.408 44.401 26.090 1.00 29.01 ? 350 TYR A CZ 1 ATOM 5246 O OH . TYR A 1 338 ? 35.441 44.948 26.811 1.00 28.43 ? 350 TYR A OH 1 ATOM 5247 H H . TYR A 1 338 ? 29.425 44.352 24.531 1.00 22.50 ? 350 TYR A H 1 ATOM 5248 H HA . TYR A 1 338 ? 31.068 44.213 22.370 1.00 22.65 ? 350 TYR A HA 1 ATOM 5249 H HB2 . TYR A 1 338 ? 30.647 42.257 24.370 1.00 24.62 ? 350 TYR A HB2 1 ATOM 5250 H HB3 . TYR A 1 338 ? 31.644 42.079 23.147 1.00 24.62 ? 350 TYR A HB3 1 ATOM 5251 H HD1 . TYR A 1 338 ? 33.752 43.345 23.119 1.00 29.25 ? 350 TYR A HD1 1 ATOM 5252 H HD2 . TYR A 1 338 ? 31.334 43.464 26.318 1.00 25.37 ? 350 TYR A HD2 1 ATOM 5253 H HE1 . TYR A 1 338 ? 35.462 44.258 24.371 1.00 31.29 ? 350 TYR A HE1 1 ATOM 5254 H HE2 . TYR A 1 338 ? 33.031 44.375 27.577 1.00 27.79 ? 350 TYR A HE2 1 ATOM 5255 H HH . TYR A 1 338 ? 36.118 45.033 26.322 1.00 34.11 ? 350 TYR A HH 1 ATOM 5256 N N . TYR A 1 339 ? 29.798 42.512 20.984 1.00 19.27 ? 351 TYR A N 1 ATOM 5257 C CA . TYR A 1 339 ? 28.835 41.818 20.138 1.00 17.57 ? 351 TYR A CA 1 ATOM 5258 C C . TYR A 1 339 ? 29.518 40.753 19.295 1.00 21.30 ? 351 TYR A C 1 ATOM 5259 O O . TYR A 1 339 ? 30.749 40.701 19.166 1.00 21.22 ? 351 TYR A O 1 ATOM 5260 C CB . TYR A 1 339 ? 28.066 42.789 19.224 1.00 17.83 ? 351 TYR A CB 1 ATOM 5261 C CG . TYR A 1 339 ? 28.789 43.253 17.967 1.00 21.29 ? 351 TYR A CG 1 ATOM 5262 C CD1 . TYR A 1 339 ? 29.924 44.059 18.039 1.00 21.17 ? 351 TYR A CD1 1 ATOM 5263 C CD2 . TYR A 1 339 ? 28.314 42.906 16.722 1.00 21.41 ? 351 TYR A CD2 1 ATOM 5264 C CE1 . TYR A 1 339 ? 30.580 44.480 16.900 1.00 23.57 ? 351 TYR A CE1 1 ATOM 5265 C CE2 . TYR A 1 339 ? 28.971 43.348 15.556 1.00 23.25 ? 351 TYR A CE2 1 ATOM 5266 C CZ . TYR A 1 339 ? 30.095 44.130 15.668 1.00 24.50 ? 351 TYR A CZ 1 ATOM 5267 O OH . TYR A 1 339 ? 30.762 44.576 14.540 1.00 28.17 ? 351 TYR A OH 1 ATOM 5268 H H . TYR A 1 339 ? 30.602 42.532 20.681 1.00 23.13 ? 351 TYR A H 1 ATOM 5269 H HA . TYR A 1 339 ? 28.187 41.373 20.706 1.00 21.09 ? 351 TYR A HA 1 ATOM 5270 H HB2 . TYR A 1 339 ? 27.247 42.354 18.941 1.00 21.40 ? 351 TYR A HB2 1 ATOM 5271 H HB3 . TYR A 1 339 ? 27.848 43.582 19.738 1.00 21.40 ? 351 TYR A HB3 1 ATOM 5272 H HD1 . TYR A 1 339 ? 30.259 44.301 18.872 1.00 25.40 ? 351 TYR A HD1 1 ATOM 5273 H HD2 . TYR A 1 339 ? 27.552 42.377 16.649 1.00 25.69 ? 351 TYR A HD2 1 ATOM 5274 H HE1 . TYR A 1 339 ? 31.337 45.016 16.969 1.00 28.29 ? 351 TYR A HE1 1 ATOM 5275 H HE2 . TYR A 1 339 ? 28.649 43.107 14.717 1.00 27.90 ? 351 TYR A HE2 1 ATOM 5276 H HH . TYR A 1 339 ? 31.427 45.039 14.763 1.00 33.81 ? 351 TYR A HH 1 ATOM 5277 N N . LEU A 1 340 ? 28.679 39.891 18.738 1.00 19.81 ? 352 LEU A N 1 ATOM 5278 C CA . LEU A 1 340 ? 29.103 38.910 17.746 1.00 17.99 ? 352 LEU A CA 1 ATOM 5279 C C . LEU A 1 340 ? 28.467 39.260 16.415 1.00 24.69 ? 352 LEU A C 1 ATOM 5280 O O . LEU A 1 340 ? 27.249 39.402 16.319 1.00 22.17 ? 352 LEU A O 1 ATOM 5281 C CB . LEU A 1 340 ? 28.695 37.510 18.163 1.00 21.31 ? 352 LEU A CB 1 ATOM 5282 C CG . LEU A 1 340 ? 29.162 36.413 17.180 1.00 21.23 ? 352 LEU A CG 1 ATOM 5283 C CD1 . LEU A 1 340 ? 30.664 36.331 17.260 1.00 23.75 ? 352 LEU A CD1 1 ATOM 5284 C CD2 . LEU A 1 340 ? 28.553 35.099 17.517 1.00 21.05 ? 352 LEU A CD2 1 ATOM 5285 H H . LEU A 1 340 ? 27.840 39.853 18.922 1.00 23.77 ? 352 LEU A H 1 ATOM 5286 H HA . LEU A 1 340 ? 30.067 38.938 17.648 1.00 21.59 ? 352 LEU A HA 1 ATOM 5287 H HB2 . LEU A 1 340 ? 29.082 37.316 19.031 1.00 25.57 ? 352 LEU A HB2 1 ATOM 5288 H HB3 . LEU A 1 340 ? 27.727 37.468 18.216 1.00 25.57 ? 352 LEU A HB3 1 ATOM 5289 H HG . LEU A 1 340 ? 28.910 36.652 16.275 1.00 25.47 ? 352 LEU A HG 1 ATOM 5290 H HD11 . LEU A 1 340 ? 30.976 35.645 16.648 1.00 28.50 ? 352 LEU A HD11 1 ATOM 5291 H HD12 . LEU A 1 340 ? 31.040 37.190 17.014 1.00 28.50 ? 352 LEU A HD12 1 ATOM 5292 H HD13 . LEU A 1 340 ? 30.920 36.105 18.168 1.00 28.50 ? 352 LEU A HD13 1 ATOM 5293 H HD21 . LEU A 1 340 ? 28.866 34.435 16.883 1.00 25.26 ? 352 LEU A HD21 1 ATOM 5294 H HD22 . LEU A 1 340 ? 28.818 34.850 18.416 1.00 25.26 ? 352 LEU A HD22 1 ATOM 5295 H HD23 . LEU A 1 340 ? 27.588 35.177 17.465 1.00 25.26 ? 352 LEU A HD23 1 ATOM 5296 N N . ASN A 1 341 ? 29.283 39.406 15.384 1.00 21.81 ? 353 ASN A N 1 ATOM 5297 C CA . ASN A 1 341 ? 28.731 39.531 14.043 1.00 20.47 ? 353 ASN A CA 1 ATOM 5298 C C . ASN A 1 341 ? 28.349 38.136 13.593 1.00 21.90 ? 353 ASN A C 1 ATOM 5299 O O . ASN A 1 341 ? 29.204 37.331 13.199 1.00 25.10 ? 353 ASN A O 1 ATOM 5300 C CB . ASN A 1 341 ? 29.742 40.166 13.106 1.00 24.99 ? 353 ASN A CB 1 ATOM 5301 C CG . ASN A 1 341 ? 29.177 40.375 11.719 1.00 23.61 ? 353 ASN A CG 1 ATOM 5302 O OD1 . ASN A 1 341 ? 28.311 39.626 11.263 1.00 22.99 ? 353 ASN A OD1 1 ATOM 5303 N ND2 . ASN A 1 341 ? 29.645 41.400 11.068 1.00 25.55 ? 353 ASN A ND2 1 ATOM 5304 H H . ASN A 1 341 ? 30.141 39.436 15.430 1.00 26.17 ? 353 ASN A H 1 ATOM 5305 H HA . ASN A 1 341 ? 27.934 40.082 14.065 1.00 24.56 ? 353 ASN A HA 1 ATOM 5306 H HB2 . ASN A 1 341 ? 30.003 41.031 13.459 1.00 29.99 ? 353 ASN A HB2 1 ATOM 5307 H HB3 . ASN A 1 341 ? 30.516 39.587 13.033 1.00 29.99 ? 353 ASN A HB3 1 ATOM 5308 H HD21 . ASN A 1 341 ? 30.241 41.905 11.427 1.00 30.66 ? 353 ASN A HD21 1 ATOM 5309 N N . LEU A 1 342 ? 27.058 37.832 13.676 1.00 19.92 ? 354 LEU A N 1 ATOM 5310 C CA . LEU A 1 342 ? 26.615 36.457 13.514 1.00 20.38 ? 354 LEU A CA 1 ATOM 5311 C C . LEU A 1 342 ? 26.847 35.965 12.087 1.00 21.98 ? 354 LEU A C 1 ATOM 5312 O O . LEU A 1 342 ? 27.266 34.819 11.893 1.00 25.65 ? 354 LEU A O 1 ATOM 5313 C CB . LEU A 1 342 ? 25.129 36.324 13.889 1.00 22.02 ? 354 LEU A CB 1 ATOM 5314 C CG . LEU A 1 342 ? 24.481 34.943 13.796 1.00 23.37 ? 354 LEU A CG 1 ATOM 5315 C CD1 . LEU A 1 342 ? 25.181 33.933 14.655 1.00 26.16 ? 354 LEU A CD1 1 ATOM 5316 C CD2 . LEU A 1 342 ? 22.985 35.003 14.163 1.00 26.98 ? 354 LEU A CD2 1 ATOM 5317 H H . LEU A 1 342 ? 26.427 38.397 13.824 1.00 23.90 ? 354 LEU A H 1 ATOM 5318 H HA . LEU A 1 342 ? 27.126 35.890 14.112 1.00 24.45 ? 354 LEU A HA 1 ATOM 5319 H HB2 . LEU A 1 342 ? 25.027 36.622 14.807 1.00 26.42 ? 354 LEU A HB2 1 ATOM 5320 H HB3 . LEU A 1 342 ? 24.623 36.913 13.308 1.00 26.42 ? 354 LEU A HB3 1 ATOM 5321 H HG . LEU A 1 342 ? 24.543 34.637 12.878 1.00 28.05 ? 354 LEU A HG 1 ATOM 5322 H HD11 . LEU A 1 342 ? 24.735 33.077 14.562 1.00 31.39 ? 354 LEU A HD11 1 ATOM 5323 H HD12 . LEU A 1 342 ? 26.104 33.859 14.365 1.00 31.39 ? 354 LEU A HD12 1 ATOM 5324 H HD13 . LEU A 1 342 ? 25.146 34.226 15.579 1.00 31.39 ? 354 LEU A HD13 1 ATOM 5325 H HD21 . LEU A 1 342 ? 22.607 34.112 14.093 1.00 32.38 ? 354 LEU A HD21 1 ATOM 5326 H HD22 . LEU A 1 342 ? 22.896 35.330 15.072 1.00 32.38 ? 354 LEU A HD22 1 ATOM 5327 H HD23 . LEU A 1 342 ? 22.533 35.603 13.549 1.00 32.38 ? 354 LEU A HD23 1 ATOM 5328 N N . THR A 1 343 ? 26.577 36.797 11.077 1.00 23.48 ? 355 THR A N 1 ATOM 5329 C CA A THR A 1 343 ? 26.791 36.338 9.700 0.52 27.14 ? 355 THR A CA 1 ATOM 5330 C CA B THR A 1 343 ? 26.791 36.351 9.697 0.48 27.16 ? 355 THR A CA 1 ATOM 5331 C C . THR A 1 343 ? 28.265 36.051 9.443 1.00 31.40 ? 355 THR A C 1 ATOM 5332 O O . THR A 1 343 ? 28.608 35.023 8.842 1.00 27.35 ? 355 THR A O 1 ATOM 5333 C CB A THR A 1 343 ? 26.264 37.356 8.688 0.52 34.91 ? 355 THR A CB 1 ATOM 5334 C CB B THR A 1 343 ? 26.279 37.412 8.720 0.48 34.85 ? 355 THR A CB 1 ATOM 5335 O OG1 A THR A 1 343 ? 26.974 38.587 8.811 0.52 31.78 ? 355 THR A OG1 1 ATOM 5336 O OG1 B THR A 1 343 ? 24.880 37.616 8.937 0.48 34.23 ? 355 THR A OG1 1 ATOM 5337 C CG2 A THR A 1 343 ? 24.784 37.586 8.892 0.52 34.29 ? 355 THR A CG2 1 ATOM 5338 C CG2 B THR A 1 343 ? 26.489 36.980 7.273 0.48 33.92 ? 355 THR A CG2 1 ATOM 5339 H H . THR A 1 343 ? 26.280 37.600 11.151 1.00 28.17 ? 355 THR A H 1 ATOM 5340 H HA . THR A 1 343 ? 26.295 35.523 9.558 1.00 32.59 ? 355 THR A HA 1 ATOM 5341 H HB A THR A 1 343 ? 26.392 37.006 7.792 0.52 41.89 ? 355 THR A HB 1 ATOM 5342 H HB B THR A 1 343 ? 26.755 38.244 8.866 0.48 41.82 ? 355 THR A HB 1 ATOM 5343 H HG1 A THR A 1 343 ? 26.876 38.899 9.585 0.52 38.13 ? 355 THR A HG1 1 ATOM 5344 H HG1 B THR A 1 343 ? 24.747 37.876 9.724 0.48 41.08 ? 355 THR A HG1 1 ATOM 5345 H HG21 A THR A 1 343 ? 24.457 38.232 8.247 0.52 41.15 ? 355 THR A HG21 1 ATOM 5346 H HG21 B THR A 1 343 ? 26.158 37.666 6.672 0.48 40.70 ? 355 THR A HG21 1 ATOM 5347 H HG22 A THR A 1 343 ? 24.300 36.753 8.777 0.52 41.15 ? 355 THR A HG22 1 ATOM 5348 H HG22 B THR A 1 343 ? 27.434 36.841 7.103 0.48 40.70 ? 355 THR A HG22 1 ATOM 5349 H HG23 A THR A 1 343 ? 24.622 37.924 9.787 0.52 41.15 ? 355 THR A HG23 1 ATOM 5350 H HG23 B THR A 1 343 ? 26.013 36.153 7.102 0.48 40.70 ? 355 THR A HG23 1 ATOM 5351 N N . GLU A 1 344 ? 29.155 36.928 9.908 1.00 25.31 ? 356 GLU A N 1 ATOM 5352 C CA . GLU A 1 344 ? 30.590 36.679 9.745 1.00 30.80 ? 356 GLU A CA 1 ATOM 5353 C C . GLU A 1 344 ? 31.014 35.393 10.450 1.00 30.10 ? 356 GLU A C 1 ATOM 5354 O O . GLU A 1 344 ? 31.751 34.577 9.885 1.00 30.06 ? 356 GLU A O 1 ATOM 5355 C CB . GLU A 1 344 ? 31.379 37.869 10.274 1.00 26.97 ? 356 GLU A CB 1 ATOM 5356 C CG . GLU A 1 344 ? 32.889 37.672 10.338 1.00 36.67 ? 356 GLU A CG 1 ATOM 5357 C CD . GLU A 1 344 ? 33.589 38.783 11.121 1.00 44.38 ? 356 GLU A CD 1 ATOM 5358 O OE1 . GLU A 1 344 ? 32.899 39.714 11.586 1.00 41.07 ? 356 GLU A OE1 1 ATOM 5359 O OE2 . GLU A 1 344 ? 34.825 38.720 11.289 1.00 49.53 ? 356 GLU A OE2 1 ATOM 5360 H H . GLU A 1 344 ? 28.961 37.662 10.313 1.00 30.38 ? 356 GLU A H 1 ATOM 5361 H HA . GLU A 1 344 ? 30.789 36.583 8.801 1.00 36.96 ? 356 GLU A HA 1 ATOM 5362 H HB2 . GLU A 1 344 ? 31.208 38.631 9.699 1.00 32.37 ? 356 GLU A HB2 1 ATOM 5363 H HB3 . GLU A 1 344 ? 31.073 38.066 11.173 1.00 32.37 ? 356 GLU A HB3 1 ATOM 5364 H HG2 . GLU A 1 344 ? 33.081 36.828 10.775 1.00 44.00 ? 356 GLU A HG2 1 ATOM 5365 H HG3 . GLU A 1 344 ? 33.247 37.669 9.436 1.00 44.00 ? 356 GLU A HG3 1 ATOM 5366 N N . ALA A 1 345 ? 30.550 35.190 11.686 1.00 22.67 ? 357 ALA A N 1 ATOM 5367 C CA . ALA A 1 345 ? 30.919 34.006 12.461 1.00 24.80 ? 357 ALA A CA 1 ATOM 5368 C C . ALA A 1 345 ? 30.438 32.730 11.779 1.00 30.57 ? 357 ALA A C 1 ATOM 5369 O O . ALA A 1 345 ? 31.154 31.721 11.753 1.00 30.05 ? 357 ALA A O 1 ATOM 5370 C CB . ALA A 1 345 ? 30.347 34.078 13.883 1.00 23.63 ? 357 ALA A CB 1 ATOM 5371 H H . ALA A 1 345 ? 30.019 35.726 12.098 1.00 27.21 ? 357 ALA A H 1 ATOM 5372 H HA . ALA A 1 345 ? 31.886 33.962 12.529 1.00 29.76 ? 357 ALA A HA 1 ATOM 5373 H HB1 . ALA A 1 345 ? 30.609 33.280 14.369 1.00 28.36 ? 357 ALA A HB1 1 ATOM 5374 H HB2 . ALA A 1 345 ? 30.700 34.866 14.325 1.00 28.36 ? 357 ALA A HB2 1 ATOM 5375 H HB3 . ALA A 1 345 ? 29.380 34.132 13.831 1.00 28.36 ? 357 ALA A HB3 1 ATOM 5376 N N . ASN A 1 346 ? 29.213 32.746 11.247 1.00 22.66 ? 358 ASN A N 1 ATOM 5377 C CA . ASN A 1 346 ? 28.651 31.559 10.611 1.00 25.86 ? 358 ASN A CA 1 ATOM 5378 C C . ASN A 1 346 ? 29.371 31.220 9.310 1.00 25.03 ? 358 ASN A C 1 ATOM 5379 O O . ASN A 1 346 ? 29.502 30.038 8.975 1.00 27.48 ? 358 ASN A O 1 ATOM 5380 C CB . ASN A 1 346 ? 27.152 31.754 10.334 1.00 25.21 ? 358 ASN A CB 1 ATOM 5381 C CG . ASN A 1 346 ? 26.288 31.453 11.556 1.00 25.86 ? 358 ASN A CG 1 ATOM 5382 O OD1 . ASN A 1 346 ? 26.699 30.752 12.468 1.00 24.86 ? 358 ASN A OD1 1 ATOM 5383 N ND2 . ASN A 1 346 ? 25.057 31.951 11.543 1.00 25.36 ? 358 ASN A ND2 1 ATOM 5384 H H . ASN A 1 346 ? 28.691 33.430 11.244 1.00 27.19 ? 358 ASN A H 1 ATOM 5385 H HA . ASN A 1 346 ? 28.748 30.804 11.212 1.00 31.03 ? 358 ASN A HA 1 ATOM 5386 H HB2 . ASN A 1 346 ? 26.995 32.675 10.074 1.00 30.26 ? 358 ASN A HB2 1 ATOM 5387 H HB3 . ASN A 1 346 ? 26.882 31.156 9.620 1.00 30.26 ? 358 ASN A HB3 1 ATOM 5388 H HD21 . ASN A 1 346 ? 24.529 31.810 12.207 1.00 30.43 ? 358 ASN A HD21 1 ATOM 5389 H HD22 . ASN A 1 346 ? 24.787 32.413 10.870 1.00 30.43 ? 358 ASN A HD22 1 ATOM 5390 N N . LEU A 1 347 ? 29.825 32.227 8.571 1.00 27.98 ? 359 LEU A N 1 ATOM 5391 C CA . LEU A 1 347 ? 30.408 31.978 7.245 1.00 27.71 ? 359 LEU A CA 1 ATOM 5392 C C . LEU A 1 347 ? 31.725 31.237 7.359 1.00 32.26 ? 359 LEU A C 1 ATOM 5393 O O . LEU A 1 347 ? 31.996 30.322 6.570 1.00 30.08 ? 359 LEU A O 1 ATOM 5394 C CB . LEU A 1 347 ? 30.626 33.290 6.512 1.00 24.97 ? 359 LEU A CB 1 ATOM 5395 C CG . LEU A 1 347 ? 31.428 33.212 5.196 1.00 31.84 ? 359 LEU A CG 1 ATOM 5396 C CD1 . LEU A 1 347 ? 30.587 32.515 4.168 1.00 37.69 ? 359 LEU A CD1 1 ATOM 5397 C CD2 . LEU A 1 347 ? 31.808 34.596 4.711 1.00 44.80 ? 359 LEU A CD2 1 ATOM 5398 H H . LEU A 1 347 ? 29.811 33.054 8.805 1.00 33.58 ? 359 LEU A H 1 ATOM 5399 H HA . LEU A 1 347 ? 29.796 31.435 6.723 1.00 33.25 ? 359 LEU A HA 1 ATOM 5400 H HB2 . LEU A 1 347 ? 29.758 33.667 6.299 1.00 29.96 ? 359 LEU A HB2 1 ATOM 5401 H HB3 . LEU A 1 347 ? 31.102 33.893 7.105 1.00 29.96 ? 359 LEU A HB3 1 ATOM 5402 H HG . LEU A 1 347 ? 32.239 32.698 5.336 1.00 38.21 ? 359 LEU A HG 1 ATOM 5403 H HD11 . LEU A 1 347 ? 31.085 32.462 3.337 1.00 45.23 ? 359 LEU A HD11 1 ATOM 5404 H HD12 . LEU A 1 347 ? 30.377 31.623 4.485 1.00 45.23 ? 359 LEU A HD12 1 ATOM 5405 H HD13 . LEU A 1 347 ? 29.770 33.020 4.034 1.00 45.23 ? 359 LEU A HD13 1 ATOM 5406 H HD21 . LEU A 1 347 ? 32.310 34.514 3.885 1.00 53.76 ? 359 LEU A HD21 1 ATOM 5407 H HD22 . LEU A 1 347 ? 31.000 35.110 4.559 1.00 53.76 ? 359 LEU A HD22 1 ATOM 5408 H HD23 . LEU A 1 347 ? 32.353 35.028 5.388 1.00 53.76 ? 359 LEU A HD23 1 ATOM 5409 N N . LYS A 1 348 ? 32.579 31.653 8.297 1.00 28.66 ? 360 LYS A N 1 ATOM 5410 C CA . LYS A 1 348 ? 33.873 31.008 8.511 1.00 33.51 ? 360 LYS A CA 1 ATOM 5411 C C . LYS A 1 348 ? 33.837 29.971 9.625 1.00 30.21 ? 360 LYS A C 1 ATOM 5412 O O . LYS A 1 348 ? 34.751 29.145 9.714 1.00 30.34 ? 360 LYS A O 1 ATOM 5413 C CB . LYS A 1 348 ? 34.950 32.061 8.820 1.00 32.17 ? 360 LYS A CB 1 ATOM 5414 C CG . LYS A 1 348 ? 34.807 32.678 10.182 1.00 29.25 ? 360 LYS A CG 1 ATOM 5415 C CD . LYS A 1 348 ? 35.981 33.585 10.499 1.00 28.91 ? 360 LYS A CD 1 ATOM 5416 C CE . LYS A 1 348 ? 36.016 34.797 9.642 1.00 31.67 ? 360 LYS A CE 1 ATOM 5417 N NZ . LYS A 1 348 ? 37.159 35.687 10.019 1.00 36.33 ? 360 LYS A NZ 1 ATOM 5418 H H . LYS A 1 348 ? 32.428 32.313 8.827 1.00 34.39 ? 360 LYS A H 1 ATOM 5419 H HA . LYS A 1 348 ? 34.131 30.553 7.694 1.00 40.21 ? 360 LYS A HA 1 ATOM 5420 H HB2 . LYS A 1 348 ? 35.823 31.640 8.774 1.00 38.60 ? 360 LYS A HB2 1 ATOM 5421 H HB3 . LYS A 1 348 ? 34.892 32.772 8.163 1.00 38.60 ? 360 LYS A HB3 1 ATOM 5422 H HG2 . LYS A 1 348 ? 33.996 33.208 10.211 1.00 35.10 ? 360 LYS A HG2 1 ATOM 5423 H HG3 . LYS A 1 348 ? 34.775 31.976 10.851 1.00 35.10 ? 360 LYS A HG3 1 ATOM 5424 H HD2 . LYS A 1 348 ? 35.918 33.873 11.423 1.00 34.69 ? 360 LYS A HD2 1 ATOM 5425 H HD3 . LYS A 1 348 ? 36.807 33.095 10.359 1.00 34.69 ? 360 LYS A HD3 1 ATOM 5426 H HE2 . LYS A 1 348 ? 36.127 34.533 8.715 1.00 38.00 ? 360 LYS A HE2 1 ATOM 5427 H HE3 . LYS A 1 348 ? 35.191 35.295 9.755 1.00 38.00 ? 360 LYS A HE3 1 ATOM 5428 H HZ1 . LYS A 1 348 ? 37.168 36.408 9.498 1.00 43.59 ? 360 LYS A HZ1 1 ATOM 5429 H HZ2 . LYS A 1 348 ? 37.078 35.944 10.867 1.00 43.59 ? 360 LYS A HZ2 1 ATOM 5430 H HZ3 . LYS A 1 348 ? 37.929 35.251 9.922 1.00 43.59 ? 360 LYS A HZ3 1 ATOM 5431 N N . GLY A 1 349 ? 32.792 29.964 10.452 1.00 26.65 ? 361 GLY A N 1 ATOM 5432 C CA . GLY A 1 349 ? 32.651 28.913 11.441 1.00 24.23 ? 361 GLY A CA 1 ATOM 5433 C C . GLY A 1 349 ? 33.414 29.150 12.720 1.00 26.35 ? 361 GLY A C 1 ATOM 5434 O O . GLY A 1 349 ? 33.644 28.205 13.482 1.00 30.82 ? 361 GLY A O 1 ATOM 5435 H H . GLY A 1 349 ? 32.163 30.549 10.457 1.00 31.98 ? 361 GLY A H 1 ATOM 5436 H HA2 . GLY A 1 349 ? 31.713 28.814 11.665 1.00 29.07 ? 361 GLY A HA2 1 ATOM 5437 H HA3 . GLY A 1 349 ? 32.960 28.076 11.059 1.00 29.07 ? 361 GLY A HA3 1 ATOM 5438 N N . GLU A 1 350 ? 33.819 30.388 12.973 1.00 25.38 ? 362 GLU A N 1 ATOM 5439 C CA . GLU A 1 350 ? 34.578 30.746 14.147 1.00 27.94 ? 362 GLU A CA 1 ATOM 5440 C C . GLU A 1 350 ? 34.073 32.085 14.674 1.00 30.64 ? 362 GLU A C 1 ATOM 5441 O O . GLU A 1 350 ? 33.894 33.033 13.903 1.00 33.00 ? 362 GLU A O 1 ATOM 5442 C CB . GLU A 1 350 ? 36.066 30.841 13.795 1.00 34.20 ? 362 GLU A CB 1 ATOM 5443 C CG . GLU A 1 350 ? 36.956 31.224 14.936 1.00 43.86 ? 362 GLU A CG 1 ATOM 5444 C CD . GLU A 1 350 ? 38.421 31.157 14.523 1.00 44.28 ? 362 GLU A CD 1 ATOM 5445 O OE1 . GLU A 1 350 ? 38.874 30.030 14.244 1.00 31.99 ? 362 GLU A OE1 1 ATOM 5446 O OE2 . GLU A 1 350 ? 39.087 32.218 14.433 1.00 31.33 ? 362 GLU A OE2 1 ATOM 5447 H H . GLU A 1 350 ? 33.657 31.056 12.456 1.00 30.46 ? 362 GLU A H 1 ATOM 5448 H HA . GLU A 1 350 ? 34.460 30.073 14.836 1.00 33.53 ? 362 GLU A HA 1 ATOM 5449 H HB2 . GLU A 1 350 ? 36.363 29.978 13.469 1.00 41.05 ? 362 GLU A HB2 1 ATOM 5450 H HB3 . GLU A 1 350 ? 36.178 31.508 13.100 1.00 41.05 ? 362 GLU A HB3 1 ATOM 5451 H HG2 . GLU A 1 350 ? 36.756 32.133 15.211 1.00 52.63 ? 362 GLU A HG2 1 ATOM 5452 H HG3 . GLU A 1 350 ? 36.817 30.610 15.674 1.00 52.63 ? 362 GLU A HG3 1 ATOM 5453 N N . SER A 1 351 ? 33.887 32.180 15.977 1.00 27.99 ? 363 SER A N 1 ATOM 5454 C CA . SER A 1 351 ? 33.354 33.410 16.549 1.00 37.92 ? 363 SER A CA 1 ATOM 5455 C C . SER A 1 351 ? 34.470 34.415 16.826 1.00 37.56 ? 363 SER A C 1 ATOM 5456 O O . SER A 1 351 ? 35.630 34.054 17.050 1.00 40.64 ? 363 SER A O 1 ATOM 5457 C CB . SER A 1 351 ? 32.574 33.112 17.831 1.00 35.33 ? 363 SER A CB 1 ATOM 5458 O OG . SER A 1 351 ? 33.450 32.792 18.887 1.00 36.29 ? 363 SER A OG 1 ATOM 5459 H H . SER A 1 351 ? 34.058 31.560 16.548 1.00 33.58 ? 363 SER A H 1 ATOM 5460 H HA . SER A 1 351 ? 32.741 33.812 15.913 1.00 45.50 ? 363 SER A HA 1 ATOM 5461 H HB2 . SER A 1 351 ? 32.058 33.896 18.076 1.00 42.39 ? 363 SER A HB2 1 ATOM 5462 H HB3 . SER A 1 351 ? 31.982 32.361 17.673 1.00 42.39 ? 363 SER A HB3 1 ATOM 5463 H HG . SER A 1 351 ? 33.904 32.115 18.688 1.00 43.55 ? 363 SER A HG 1 ATOM 5464 N N . ASN A 1 352 ? 34.116 35.697 16.749 1.00 29.10 ? 364 ASN A N 1 ATOM 5465 C CA . ASN A 1 352 ? 35.001 36.789 17.090 1.00 30.75 ? 364 ASN A CA 1 ATOM 5466 C C . ASN A 1 352 ? 34.179 37.833 17.866 1.00 23.50 ? 364 ASN A C 1 ATOM 5467 O O . ASN A 1 352 ? 33.863 38.910 17.356 1.00 26.58 ? 364 ASN A O 1 ATOM 5468 C CB . ASN A 1 352 ? 35.644 37.406 15.843 1.00 39.03 ? 364 ASN A CB 1 ATOM 5469 C CG . ASN A 1 352 ? 36.594 38.549 16.180 1.00 43.38 ? 364 ASN A CG 1 ATOM 5470 O OD1 . ASN A 1 352 ? 37.104 38.629 17.293 1.00 42.90 ? 364 ASN A OD1 1 ATOM 5471 N ND2 . ASN A 1 352 ? 36.823 39.443 15.220 1.00 53.83 ? 364 ASN A ND2 1 ATOM 5472 H H . ASN A 1 352 ? 33.338 35.960 16.492 1.00 34.92 ? 364 ASN A H 1 ATOM 5473 H HA . ASN A 1 352 ? 35.708 36.463 17.669 1.00 36.90 ? 364 ASN A HA 1 ATOM 5474 H HB2 . ASN A 1 352 ? 36.150 36.723 15.376 1.00 46.84 ? 364 ASN A HB2 1 ATOM 5475 H HB3 . ASN A 1 352 ? 34.946 37.755 15.266 1.00 46.84 ? 364 ASN A HB3 1 ATOM 5476 H HD21 . ASN A 1 352 ? 37.353 40.105 15.366 1.00 64.59 ? 364 ASN A HD21 1 ATOM 5477 H HD22 . ASN A 1 352 ? 36.442 39.358 14.454 1.00 64.59 ? 364 ASN A HD22 1 ATOM 5478 N N . TRP A 1 353 ? 33.815 37.508 19.100 1.00 25.43 ? 365 TRP A N 1 ATOM 5479 C CA . TRP A 1 353 ? 33.195 38.515 19.970 1.00 21.60 ? 365 TRP A CA 1 ATOM 5480 C C . TRP A 1 353 ? 34.112 39.713 20.086 1.00 25.52 ? 365 TRP A C 1 ATOM 5481 O O . TRP A 1 353 ? 35.316 39.578 20.326 1.00 25.75 ? 365 TRP A O 1 ATOM 5482 C CB . TRP A 1 353 ? 32.898 37.926 21.349 1.00 20.74 ? 365 TRP A CB 1 ATOM 5483 C CG . TRP A 1 353 ? 31.656 37.037 21.370 1.00 25.89 ? 365 TRP A CG 1 ATOM 5484 C CD1 . TRP A 1 353 ? 31.588 35.706 21.085 1.00 23.55 ? 365 TRP A CD1 1 ATOM 5485 C CD2 . TRP A 1 353 ? 30.322 37.437 21.701 1.00 22.29 ? 365 TRP A CD2 1 ATOM 5486 N NE1 . TRP A 1 353 ? 30.296 35.256 21.191 1.00 25.69 ? 365 TRP A NE1 1 ATOM 5487 C CE2 . TRP A 1 353 ? 29.497 36.300 21.569 1.00 22.87 ? 365 TRP A CE2 1 ATOM 5488 C CE3 . TRP A 1 353 ? 29.745 38.646 22.076 1.00 22.68 ? 365 TRP A CE3 1 ATOM 5489 C CZ2 . TRP A 1 353 ? 28.124 36.338 21.807 1.00 21.19 ? 365 TRP A CZ2 1 ATOM 5490 C CZ3 . TRP A 1 353 ? 28.369 38.680 22.316 1.00 20.21 ? 365 TRP A CZ3 1 ATOM 5491 C CH2 . TRP A 1 353 ? 27.588 37.541 22.182 1.00 22.71 ? 365 TRP A CH2 1 ATOM 5492 H H . TRP A 1 353 ? 33.911 36.731 19.457 1.00 30.51 ? 365 TRP A H 1 ATOM 5493 H HA . TRP A 1 353 ? 32.358 38.808 19.576 1.00 25.92 ? 365 TRP A HA 1 ATOM 5494 H HB2 . TRP A 1 353 ? 33.654 37.388 21.631 1.00 24.89 ? 365 TRP A HB2 1 ATOM 5495 H HB3 . TRP A 1 353 ? 32.756 38.652 21.977 1.00 24.89 ? 365 TRP A HB3 1 ATOM 5496 H HD1 . TRP A 1 353 ? 32.312 35.182 20.830 1.00 28.27 ? 365 TRP A HD1 1 ATOM 5497 H HE1 . TRP A 1 353 ? 30.034 34.449 21.051 1.00 30.83 ? 365 TRP A HE1 1 ATOM 5498 H HE3 . TRP A 1 353 ? 30.261 39.415 22.159 1.00 27.21 ? 365 TRP A HE3 1 ATOM 5499 H HZ2 . TRP A 1 353 ? 27.598 35.576 21.728 1.00 25.42 ? 365 TRP A HZ2 1 ATOM 5500 H HZ3 . TRP A 1 353 ? 27.969 39.481 22.567 1.00 24.25 ? 365 TRP A HZ3 1 ATOM 5501 H HH2 . TRP A 1 353 ? 26.675 37.595 22.353 1.00 27.25 ? 365 TRP A HH2 1 ATOM 5502 N N . THR A 1 354 ? 33.565 40.895 19.880 1.00 20.98 ? 366 THR A N 1 ATOM 5503 C CA . THR A 1 354 ? 34.422 42.049 19.751 1.00 25.08 ? 366 THR A CA 1 ATOM 5504 C C . THR A 1 354 ? 33.696 43.287 20.260 1.00 26.84 ? 366 THR A C 1 ATOM 5505 O O . THR A 1 354 ? 32.479 43.281 20.512 1.00 22.86 ? 366 THR A O 1 ATOM 5506 C CB . THR A 1 354 ? 34.904 42.192 18.294 1.00 27.95 ? 366 THR A CB 1 ATOM 5507 O OG1 . THR A 1 354 ? 35.974 43.133 18.238 1.00 31.87 ? 366 THR A OG1 1 ATOM 5508 C CG2 . THR A 1 354 ? 33.790 42.666 17.381 1.00 29.04 ? 366 THR A CG2 1 ATOM 5509 H H . THR A 1 354 ? 32.723 41.053 19.812 1.00 25.18 ? 366 THR A H 1 ATOM 5510 H HA . THR A 1 354 ? 35.205 41.917 20.308 1.00 30.09 ? 366 THR A HA 1 ATOM 5511 H HB . THR A 1 354 ? 35.216 41.332 17.973 1.00 33.54 ? 366 THR A HB 1 ATOM 5512 H HG1 . THR A 1 354 ? 36.613 42.871 18.716 1.00 38.25 ? 366 THR A HG1 1 ATOM 5513 H HG21 . THR A 1 354 ? 34.119 42.748 16.472 1.00 34.85 ? 366 THR A HG21 1 ATOM 5514 H HG22 . THR A 1 354 ? 33.057 42.031 17.395 1.00 34.85 ? 366 THR A HG22 1 ATOM 5515 H HG23 . THR A 1 354 ? 33.464 43.530 17.677 1.00 34.85 ? 366 THR A HG23 1 ATOM 5516 N N . LEU A 1 355 ? 34.486 44.331 20.478 1.00 22.50 ? 367 LEU A N 1 ATOM 5517 C CA . LEU A 1 355 ? 33.962 45.598 20.966 1.00 23.40 ? 367 LEU A CA 1 ATOM 5518 C C . LEU A 1 355 ? 33.035 46.217 19.943 1.00 26.16 ? 367 LEU A C 1 ATOM 5519 O O . LEU A 1 355 ? 33.401 46.379 18.776 1.00 25.89 ? 367 LEU A O 1 ATOM 5520 C CB . LEU A 1 355 ? 35.104 46.566 21.264 1.00 26.09 ? 367 LEU A CB 1 ATOM 5521 C CG . LEU A 1 355 ? 34.719 48.017 21.595 1.00 30.98 ? 367 LEU A CG 1 ATOM 5522 C CD1 . LEU A 1 355 ? 34.029 48.024 22.894 1.00 26.16 ? 367 LEU A CD1 1 ATOM 5523 C CD2 . LEU A 1 355 ? 35.935 48.900 21.646 1.00 40.25 ? 367 LEU A CD2 1 ATOM 5524 H H . LEU A 1 355 ? 35.337 44.330 20.350 1.00 27.00 ? 367 LEU A H 1 ATOM 5525 H HA . LEU A 1 355 ? 33.462 45.449 21.784 1.00 28.08 ? 367 LEU A HA 1 ATOM 5526 H HB2 . LEU A 1 355 ? 35.601 46.222 22.023 1.00 31.31 ? 367 LEU A HB2 1 ATOM 5527 H HB3 . LEU A 1 355 ? 35.686 46.594 20.489 1.00 31.31 ? 367 LEU A HB3 1 ATOM 5528 H HG . LEU A 1 355 ? 34.114 48.358 20.919 1.00 37.17 ? 367 LEU A HG 1 ATOM 5529 H HD11 . LEU A 1 355 ? 33.780 48.936 23.114 1.00 31.39 ? 367 LEU A HD11 1 ATOM 5530 H HD12 . LEU A 1 355 ? 33.235 47.470 22.831 1.00 31.39 ? 367 LEU A HD12 1 ATOM 5531 H HD13 . LEU A 1 355 ? 34.627 47.671 23.571 1.00 31.39 ? 367 LEU A HD13 1 ATOM 5532 H HD21 . LEU A 1 355 ? 35.659 49.806 21.856 1.00 48.30 ? 367 LEU A HD21 1 ATOM 5533 H HD22 . LEU A 1 355 ? 36.537 48.570 22.331 1.00 48.30 ? 367 LEU A HD22 1 ATOM 5534 H HD23 . LEU A 1 355 ? 36.375 48.880 20.781 1.00 48.30 ? 367 LEU A HD23 1 ATOM 5535 N N . GLU A 1 356 ? 31.827 46.575 20.379 1.00 21.28 ? 368 GLU A N 1 ATOM 5536 C CA . GLU A 1 356 ? 30.967 47.388 19.528 1.00 19.40 ? 368 GLU A CA 1 ATOM 5537 C C . GLU A 1 356 ? 31.229 48.864 19.782 1.00 24.14 ? 368 GLU A C 1 ATOM 5538 O O . GLU A 1 356 ? 31.565 49.608 18.856 1.00 22.93 ? 368 GLU A O 1 ATOM 5539 C CB . GLU A 1 356 ? 29.476 47.055 19.745 1.00 18.42 ? 368 GLU A CB 1 ATOM 5540 C CG . GLU A 1 356 ? 28.611 47.627 18.627 1.00 18.51 ? 368 GLU A CG 1 ATOM 5541 C CD . GLU A 1 356 ? 27.138 47.611 18.927 1.00 21.04 ? 368 GLU A CD 1 ATOM 5542 O OE1 . GLU A 1 356 ? 26.796 47.521 20.127 1.00 18.22 ? 368 GLU A OE1 1 ATOM 5543 O OE2 . GLU A 1 356 ? 26.339 47.709 17.983 1.00 20.72 ? 368 GLU A OE2 1 ATOM 5544 H H . GLU A 1 356 ? 31.492 46.366 21.142 1.00 25.53 ? 368 GLU A H 1 ATOM 5545 H HA . GLU A 1 356 ? 31.180 47.204 18.600 1.00 23.28 ? 368 GLU A HA 1 ATOM 5546 H HB2 . GLU A 1 356 ? 29.361 46.092 19.756 1.00 22.10 ? 368 GLU A HB2 1 ATOM 5547 H HB3 . GLU A 1 356 ? 29.181 47.439 20.585 1.00 22.10 ? 368 GLU A HB3 1 ATOM 5548 H HG2 . GLU A 1 356 ? 28.871 48.549 18.472 1.00 22.22 ? 368 GLU A HG2 1 ATOM 5549 H HG3 . GLU A 1 356 ? 28.755 47.105 17.823 1.00 22.22 ? 368 GLU A HG3 1 ATOM 5550 N N . TYR A 1 357 ? 31.102 49.301 21.032 1.00 19.53 ? 369 TYR A N 1 ATOM 5551 C CA . TYR A 1 357 ? 31.412 50.689 21.361 1.00 20.21 ? 369 TYR A CA 1 ATOM 5552 C C . TYR A 1 357 ? 31.568 50.836 22.861 1.00 18.90 ? 369 TYR A C 1 ATOM 5553 O O . TYR A 1 357 ? 31.099 50.000 23.635 1.00 18.53 ? 369 TYR A O 1 ATOM 5554 C CB . TYR A 1 357 ? 30.329 51.650 20.873 1.00 24.21 ? 369 TYR A CB 1 ATOM 5555 C CG . TYR A 1 357 ? 29.003 51.528 21.589 1.00 21.00 ? 369 TYR A CG 1 ATOM 5556 C CD1 . TYR A 1 357 ? 28.087 50.569 21.234 1.00 19.04 ? 369 TYR A CD1 1 ATOM 5557 C CD2 . TYR A 1 357 ? 28.653 52.421 22.604 1.00 21.01 ? 369 TYR A CD2 1 ATOM 5558 C CE1 . TYR A 1 357 ? 26.843 50.466 21.881 1.00 17.53 ? 369 TYR A CE1 1 ATOM 5559 C CE2 . TYR A 1 357 ? 27.437 52.334 23.250 1.00 23.57 ? 369 TYR A CE2 1 ATOM 5560 C CZ . TYR A 1 357 ? 26.532 51.355 22.891 1.00 22.20 ? 369 TYR A CZ 1 ATOM 5561 O OH . TYR A 1 357 ? 25.323 51.292 23.573 1.00 19.65 ? 369 TYR A OH 1 ATOM 5562 H H . TYR A 1 357 ? 30.842 48.822 21.698 1.00 23.44 ? 369 TYR A H 1 ATOM 5563 H HA . TYR A 1 357 ? 32.250 50.938 20.942 1.00 24.25 ? 369 TYR A HA 1 ATOM 5564 H HB2 . TYR A 1 357 ? 30.644 52.559 20.994 1.00 29.05 ? 369 TYR A HB2 1 ATOM 5565 H HB3 . TYR A 1 357 ? 30.170 51.483 19.930 1.00 29.05 ? 369 TYR A HB3 1 ATOM 5566 H HD1 . TYR A 1 357 ? 28.297 49.970 20.554 1.00 22.85 ? 369 TYR A HD1 1 ATOM 5567 H HD2 . TYR A 1 357 ? 29.255 53.083 22.855 1.00 25.22 ? 369 TYR A HD2 1 ATOM 5568 H HE1 . TYR A 1 357 ? 26.239 49.802 21.636 1.00 21.04 ? 369 TYR A HE1 1 ATOM 5569 H HE2 . TYR A 1 357 ? 27.229 52.931 23.932 1.00 28.28 ? 369 TYR A HE2 1 ATOM 5570 H HH . TYR A 1 357 ? 24.857 50.660 23.275 1.00 23.57 ? 369 TYR A HH 1 ATOM 5571 N N . VAL A 1 358 ? 32.256 51.915 23.239 1.00 22.24 ? 370 VAL A N 1 ATOM 5572 C CA . VAL A 1 358 ? 32.342 52.426 24.605 1.00 20.74 ? 370 VAL A CA 1 ATOM 5573 C C . VAL A 1 358 ? 31.434 53.638 24.648 1.00 19.78 ? 370 VAL A C 1 ATOM 5574 O O . VAL A 1 358 ? 31.617 54.568 23.862 1.00 20.04 ? 370 VAL A O 1 ATOM 5575 C CB . VAL A 1 358 ? 33.790 52.815 24.978 1.00 22.96 ? 370 VAL A CB 1 ATOM 5576 C CG1 . VAL A 1 358 ? 33.873 53.346 26.416 1.00 22.37 ? 370 VAL A CG1 1 ATOM 5577 C CG2 . VAL A 1 358 ? 34.724 51.634 24.783 1.00 23.44 ? 370 VAL A CG2 1 ATOM 5578 H H . VAL A 1 358 ? 32.707 52.393 22.685 1.00 26.68 ? 370 VAL A H 1 ATOM 5579 H HA . VAL A 1 358 ? 32.017 51.762 25.233 1.00 24.88 ? 370 VAL A HA 1 ATOM 5580 H HB . VAL A 1 358 ? 34.084 53.524 24.385 1.00 27.55 ? 370 VAL A HB 1 ATOM 5581 H HG11 . VAL A 1 358 ? 34.794 53.579 26.614 1.00 26.84 ? 370 VAL A HG11 1 ATOM 5582 H HG12 . VAL A 1 358 ? 33.309 54.131 26.496 1.00 26.84 ? 370 VAL A HG12 1 ATOM 5583 H HG13 . VAL A 1 358 ? 33.569 52.656 27.026 1.00 26.84 ? 370 VAL A HG13 1 ATOM 5584 H HG21 . VAL A 1 358 ? 35.625 51.902 25.023 1.00 28.13 ? 370 VAL A HG21 1 ATOM 5585 H HG22 . VAL A 1 358 ? 34.433 50.904 25.352 1.00 28.13 ? 370 VAL A HG22 1 ATOM 5586 H HG23 . VAL A 1 358 ? 34.696 51.360 23.853 1.00 28.13 ? 370 VAL A HG23 1 ATOM 5587 N N . LEU A 1 359 ? 30.469 53.654 25.577 1.00 19.98 ? 371 LEU A N 1 ATOM 5588 C CA . LEU A 1 359 ? 29.464 54.714 25.554 1.00 20.13 ? 371 LEU A CA 1 ATOM 5589 C C . LEU A 1 359 ? 30.087 56.119 25.599 1.00 21.07 ? 371 LEU A C 1 ATOM 5590 O O . LEU A 1 359 ? 29.712 56.990 24.815 1.00 20.75 ? 371 LEU A O 1 ATOM 5591 C CB . LEU A 1 359 ? 28.482 54.505 26.704 1.00 19.30 ? 371 LEU A CB 1 ATOM 5592 C CG . LEU A 1 359 ? 27.127 55.231 26.641 1.00 18.97 ? 371 LEU A CG 1 ATOM 5593 C CD1 . LEU A 1 359 ? 26.108 54.508 27.511 1.00 23.56 ? 371 LEU A CD1 1 ATOM 5594 C CD2 . LEU A 1 359 ? 27.185 56.691 27.045 1.00 19.30 ? 371 LEU A CD2 1 ATOM 5595 H H . LEU A 1 359 ? 30.378 53.080 26.211 1.00 23.98 ? 371 LEU A H 1 ATOM 5596 H HA . LEU A 1 359 ? 28.963 54.644 24.726 1.00 24.16 ? 371 LEU A HA 1 ATOM 5597 H HB2 . LEU A 1 359 ? 28.291 53.556 26.764 1.00 23.16 ? 371 LEU A HB2 1 ATOM 5598 H HB3 . LEU A 1 359 ? 28.918 54.792 27.522 1.00 23.16 ? 371 LEU A HB3 1 ATOM 5599 H HG . LEU A 1 359 ? 26.804 55.196 25.727 1.00 22.76 ? 371 LEU A HG 1 ATOM 5600 H HD11 . LEU A 1 359 ? 25.260 54.978 27.460 1.00 28.27 ? 371 LEU A HD11 1 ATOM 5601 H HD12 . LEU A 1 359 ? 26.003 53.600 27.187 1.00 28.27 ? 371 LEU A HD12 1 ATOM 5602 H HD13 . LEU A 1 359 ? 26.426 54.498 28.427 1.00 28.27 ? 371 LEU A HD13 1 ATOM 5603 H HD21 . LEU A 1 359 ? 26.296 57.072 26.978 1.00 23.16 ? 371 LEU A HD21 1 ATOM 5604 H HD22 . LEU A 1 359 ? 27.504 56.753 27.959 1.00 23.16 ? 371 LEU A HD22 1 ATOM 5605 H HD23 . LEU A 1 359 ? 27.792 57.159 26.450 1.00 23.16 ? 371 LEU A HD23 1 ATOM 5606 N N . THR A 1 360 ? 31.002 56.388 26.540 1.00 20.96 ? 372 THR A N 1 ATOM 5607 C CA . THR A 1 360 ? 31.526 57.759 26.637 1.00 22.15 ? 372 THR A CA 1 ATOM 5608 C C . THR A 1 360 ? 32.215 58.202 25.347 1.00 22.18 ? 372 THR A C 1 ATOM 5609 O O . THR A 1 360 ? 32.121 59.373 24.952 1.00 25.09 ? 372 THR A O 1 ATOM 5610 C CB . THR A 1 360 ? 32.519 57.906 27.795 1.00 20.97 ? 372 THR A CB 1 ATOM 5611 O OG1 . THR A 1 360 ? 33.572 56.949 27.645 1.00 24.42 ? 372 THR A OG1 1 ATOM 5612 C CG2 . THR A 1 360 ? 31.814 57.752 29.123 1.00 23.55 ? 372 THR A CG2 1 ATOM 5613 H H . THR A 1 360 ? 31.322 55.826 27.107 1.00 25.15 ? 372 THR A H 1 ATOM 5614 H HA . THR A 1 360 ? 30.787 58.365 26.802 1.00 26.58 ? 372 THR A HA 1 ATOM 5615 H HB . THR A 1 360 ? 32.902 58.797 27.766 1.00 25.17 ? 372 THR A HB 1 ATOM 5616 H HG1 . THR A 1 360 ? 34.121 57.024 28.277 1.00 29.31 ? 372 THR A HG1 1 ATOM 5617 H HG21 . THR A 1 360 ? 32.450 57.846 29.849 1.00 28.26 ? 372 THR A HG21 1 ATOM 5618 H HG22 . THR A 1 360 ? 31.128 58.432 29.215 1.00 28.26 ? 372 THR A HG22 1 ATOM 5619 H HG23 . THR A 1 360 ? 31.400 56.876 29.179 1.00 28.26 ? 372 THR A HG23 1 ATOM 5620 N N . GLN A 1 361 ? 32.892 57.271 24.679 1.00 22.46 ? 373 GLN A N 1 ATOM 5621 C CA . GLN A 1 361 ? 33.627 57.570 23.449 1.00 24.21 ? 373 GLN A CA 1 ATOM 5622 C C . GLN A 1 361 ? 32.678 57.746 22.279 1.00 28.90 ? 373 GLN A C 1 ATOM 5623 O O . GLN A 1 361 ? 32.831 58.677 21.474 1.00 27.66 ? 373 GLN A O 1 ATOM 5624 C CB . GLN A 1 361 ? 34.616 56.442 23.154 1.00 26.91 ? 373 GLN A CB 1 ATOM 5625 C CG . GLN A 1 361 ? 35.716 56.258 24.163 1.00 46.13 ? 373 GLN A CG 1 ATOM 5626 C CD . GLN A 1 361 ? 36.593 55.043 23.843 1.00 66.91 ? 373 GLN A CD 1 ATOM 5627 O OE1 . GLN A 1 361 ? 36.433 54.396 22.800 1.00 56.77 ? 373 GLN A OE1 1 ATOM 5628 N NE2 . GLN A 1 361 ? 37.513 54.723 24.748 1.00 57.73 ? 373 GLN A NE2 1 ATOM 5629 H H . GLN A 1 361 ? 32.941 56.446 24.919 1.00 26.96 ? 373 GLN A H 1 ATOM 5630 H HA . GLN A 1 361 ? 34.127 58.394 23.565 1.00 29.05 ? 373 GLN A HA 1 ATOM 5631 H HB2 . GLN A 1 361 ? 34.123 55.608 23.107 1.00 32.29 ? 373 GLN A HB2 1 ATOM 5632 H HB3 . GLN A 1 361 ? 35.034 56.619 22.297 1.00 32.29 ? 373 GLN A HB3 1 ATOM 5633 H HG2 . GLN A 1 361 ? 36.281 57.046 24.165 1.00 55.36 ? 373 GLN A HG2 1 ATOM 5634 H HG3 . GLN A 1 361 ? 35.324 56.125 25.040 1.00 55.36 ? 373 GLN A HG3 1 ATOM 5635 H HE21 . GLN A 1 361 ? 37.590 55.190 25.467 1.00 69.28 ? 373 GLN A HE21 1 ATOM 5636 H HE22 . GLN A 1 361 ? 38.031 54.049 24.616 1.00 69.28 ? 373 GLN A HE22 1 ATOM 5637 N N . ALA A 1 362 ? 31.679 56.863 22.171 1.00 22.36 ? 374 ALA A N 1 ATOM 5638 C CA . ALA A 1 362 ? 30.754 56.927 21.051 1.00 23.66 ? 374 ALA A CA 1 ATOM 5639 C C . ALA A 1 362 ? 29.986 58.240 21.052 1.00 25.37 ? 374 ALA A C 1 ATOM 5640 O O . ALA A 1 362 ? 29.718 58.818 19.986 1.00 26.52 ? 374 ALA A O 1 ATOM 5641 C CB . ALA A 1 362 ? 29.777 55.742 21.103 1.00 24.87 ? 374 ALA A CB 1 ATOM 5642 H H . ALA A 1 362 ? 31.522 56.228 22.729 1.00 26.83 ? 374 ALA A H 1 ATOM 5643 H HA . ALA A 1 362 ? 31.254 56.871 20.221 1.00 28.39 ? 374 ALA A HA 1 ATOM 5644 H HB1 . ALA A 1 362 ? 29.169 55.801 20.349 1.00 29.84 ? 374 ALA A HB1 1 ATOM 5645 H HB2 . ALA A 1 362 ? 30.282 54.915 21.057 1.00 29.84 ? 374 ALA A HB2 1 ATOM 5646 H HB3 . ALA A 1 362 ? 29.279 55.780 21.934 1.00 29.84 ? 374 ALA A HB3 1 ATOM 5647 N N . TYR A 1 363 ? 29.582 58.706 22.233 1.00 19.62 ? 375 TYR A N 1 ATOM 5648 C CA . TYR A 1 363 ? 28.667 59.826 22.340 1.00 21.54 ? 375 TYR A CA 1 ATOM 5649 C C . TYR A 1 363 ? 29.310 61.086 22.906 1.00 23.22 ? 375 TYR A C 1 ATOM 5650 O O . TYR A 1 363 ? 28.620 62.104 23.059 1.00 25.04 ? 375 TYR A O 1 ATOM 5651 C CB . TYR A 1 363 ? 27.462 59.417 23.200 1.00 22.06 ? 375 TYR A CB 1 ATOM 5652 C CG . TYR A 1 363 ? 26.628 58.316 22.561 1.00 19.29 ? 375 TYR A CG 1 ATOM 5653 C CD1 . TYR A 1 363 ? 25.987 58.511 21.340 1.00 21.40 ? 375 TYR A CD1 1 ATOM 5654 C CD2 . TYR A 1 363 ? 26.457 57.085 23.201 1.00 21.50 ? 375 TYR A CD2 1 ATOM 5655 C CE1 . TYR A 1 363 ? 25.209 57.528 20.765 1.00 19.69 ? 375 TYR A CE1 1 ATOM 5656 C CE2 . TYR A 1 363 ? 25.672 56.098 22.634 1.00 22.79 ? 375 TYR A CE2 1 ATOM 5657 C CZ . TYR A 1 363 ? 25.058 56.326 21.405 1.00 21.28 ? 375 TYR A CZ 1 ATOM 5658 O OH . TYR A 1 363 ? 24.280 55.352 20.856 1.00 22.34 ? 375 TYR A OH 1 ATOM 5659 H H . TYR A 1 363 ? 29.831 58.385 22.990 1.00 23.54 ? 375 TYR A H 1 ATOM 5660 H HA . TYR A 1 363 ? 28.336 60.040 21.454 1.00 25.85 ? 375 TYR A HA 1 ATOM 5661 H HB2 . TYR A 1 363 ? 27.780 59.092 24.056 1.00 26.47 ? 375 TYR A HB2 1 ATOM 5662 H HB3 . TYR A 1 363 ? 26.889 60.189 23.330 1.00 26.47 ? 375 TYR A HB3 1 ATOM 5663 H HD1 . TYR A 1 363 ? 26.085 59.326 20.901 1.00 25.68 ? 375 TYR A HD1 1 ATOM 5664 H HD2 . TYR A 1 363 ? 26.866 56.933 24.022 1.00 25.80 ? 375 TYR A HD2 1 ATOM 5665 H HE1 . TYR A 1 363 ? 24.791 57.679 19.948 1.00 23.63 ? 375 TYR A HE1 1 ATOM 5666 H HE2 . TYR A 1 363 ? 25.566 55.280 23.065 1.00 27.34 ? 375 TYR A HE2 1 ATOM 5667 H HH . TYR A 1 363 ? 24.277 54.673 21.351 1.00 26.80 ? 375 TYR A HH 1 ATOM 5668 N N . SER A 1 364 ? 30.597 61.042 23.249 1.00 25.94 ? 376 SER A N 1 ATOM 5669 C CA . SER A 1 364 ? 31.307 62.204 23.792 1.00 28.64 ? 376 SER A CA 1 ATOM 5670 C C . SER A 1 364 ? 30.617 62.751 25.038 1.00 29.90 ? 376 SER A C 1 ATOM 5671 O O . SER A 1 364 ? 30.309 63.940 25.134 1.00 31.96 ? 376 SER A O 1 ATOM 5672 C CB . SER A 1 364 ? 31.443 63.295 22.727 1.00 32.17 ? 376 SER A CB 1 ATOM 5673 O OG . SER A 1 364 ? 32.060 62.763 21.584 1.00 33.29 ? 376 SER A OG 1 ATOM 5674 H H . SER A 1 364 ? 31.089 60.340 23.175 1.00 31.12 ? 376 SER A H 1 ATOM 5675 H HA . SER A 1 364 ? 32.202 61.929 24.048 1.00 34.37 ? 376 SER A HA 1 ATOM 5676 H HB2 . SER A 1 364 ? 30.561 63.623 22.490 1.00 38.60 ? 376 SER A HB2 1 ATOM 5677 H HB3 . SER A 1 364 ? 31.987 64.018 23.077 1.00 38.60 ? 376 SER A HB3 1 ATOM 5678 H HG . SER A 1 364 ? 32.824 62.472 21.779 1.00 39.95 ? 376 SER A HG 1 ATOM 5679 N N . VAL A 1 365 ? 30.346 61.861 25.996 1.00 27.42 ? 377 VAL A N 1 ATOM 5680 C CA . VAL A 1 365 ? 29.817 62.263 27.286 1.00 25.40 ? 377 VAL A CA 1 ATOM 5681 C C . VAL A 1 365 ? 30.834 61.879 28.353 1.00 26.03 ? 377 VAL A C 1 ATOM 5682 O O . VAL A 1 365 ? 31.664 60.986 28.166 1.00 27.85 ? 377 VAL A O 1 ATOM 5683 C CB . VAL A 1 365 ? 28.433 61.636 27.596 1.00 27.77 ? 377 VAL A CB 1 ATOM 5684 C CG1 . VAL A 1 365 ? 27.399 62.074 26.556 1.00 32.50 ? 377 VAL A CG1 1 ATOM 5685 C CG2 . VAL A 1 365 ? 28.507 60.121 27.628 1.00 29.64 ? 377 VAL A CG2 1 ATOM 5686 H H . VAL A 1 365 ? 30.464 61.013 25.916 1.00 32.90 ? 377 VAL A H 1 ATOM 5687 H HA . VAL A 1 365 ? 29.718 63.228 27.300 1.00 30.48 ? 377 VAL A HA 1 ATOM 5688 H HB . VAL A 1 365 ? 28.134 61.942 28.466 1.00 33.33 ? 377 VAL A HB 1 ATOM 5689 H HG11 . VAL A 1 365 ? 26.545 61.669 26.771 1.00 39.00 ? 377 VAL A HG11 1 ATOM 5690 H HG12 . VAL A 1 365 ? 27.323 63.040 26.575 1.00 39.00 ? 377 VAL A HG12 1 ATOM 5691 H HG13 . VAL A 1 365 ? 27.692 61.782 25.678 1.00 39.00 ? 377 VAL A HG13 1 ATOM 5692 H HG21 . VAL A 1 365 ? 27.626 59.766 27.824 1.00 35.57 ? 377 VAL A HG21 1 ATOM 5693 H HG22 . VAL A 1 365 ? 28.808 59.801 26.763 1.00 35.57 ? 377 VAL A HG22 1 ATOM 5694 H HG23 . VAL A 1 365 ? 29.134 59.850 28.317 1.00 35.57 ? 377 VAL A HG23 1 ATOM 5695 N N . ALA A 1 366 ? 30.731 62.557 29.502 1.00 27.85 ? 378 ALA A N 1 ATOM 5696 C CA . ALA A 1 366 ? 31.726 62.429 30.569 1.00 26.67 ? 378 ALA A CA 1 ATOM 5697 C C . ALA A 1 366 ? 31.550 61.155 31.389 1.00 28.89 ? 378 ALA A C 1 ATOM 5698 O O . ALA A 1 366 ? 32.528 60.578 31.875 1.00 25.34 ? 378 ALA A O 1 ATOM 5699 C CB . ALA A 1 366 ? 31.638 63.636 31.505 1.00 34.28 ? 378 ALA A CB 1 ATOM 5700 H H . ALA A 1 366 ? 30.090 63.100 29.687 1.00 33.42 ? 378 ALA A H 1 ATOM 5701 H HA . ALA A 1 366 ? 32.613 62.415 30.177 1.00 32.01 ? 378 ALA A HA 1 ATOM 5702 H HB1 . ALA A 1 366 ? 32.301 63.540 32.206 1.00 41.14 ? 378 ALA A HB1 1 ATOM 5703 H HB2 . ALA A 1 366 ? 31.810 64.443 30.995 1.00 41.14 ? 378 ALA A HB2 1 ATOM 5704 H HB3 . ALA A 1 366 ? 30.749 63.671 31.891 1.00 41.14 ? 378 ALA A HB3 1 ATOM 5705 N N . ASP A 1 367 ? 30.315 60.736 31.593 1.00 21.56 ? 379 ASP A N 1 ATOM 5706 C CA . ASP A 1 367 ? 29.993 59.607 32.449 1.00 22.51 ? 379 ASP A CA 1 ATOM 5707 C C . ASP A 1 367 ? 28.527 59.274 32.187 1.00 19.49 ? 379 ASP A C 1 ATOM 5708 O O . ASP A 1 367 ? 27.932 59.762 31.215 1.00 22.40 ? 379 ASP A O 1 ATOM 5709 C CB . ASP A 1 367 ? 30.292 59.913 33.923 1.00 24.92 ? 379 ASP A CB 1 ATOM 5710 C CG . ASP A 1 367 ? 29.539 61.134 34.441 1.00 38.40 ? 379 ASP A CG 1 ATOM 5711 O OD1 . ASP A 1 367 ? 28.355 61.335 34.076 1.00 26.52 ? 379 ASP A OD1 1 ATOM 5712 O OD2 . ASP A 1 367 ? 30.132 61.894 35.236 1.00 38.33 ? 379 ASP A OD2 1 ATOM 5713 H H . ASP A 1 367 ? 29.623 61.101 31.236 1.00 25.87 ? 379 ASP A H 1 ATOM 5714 H HA . ASP A 1 367 ? 30.529 58.843 32.185 1.00 27.01 ? 379 ASP A HA 1 ATOM 5715 H HB2 . ASP A 1 367 ? 30.033 59.150 34.463 1.00 29.91 ? 379 ASP A HB2 1 ATOM 5716 H HB3 . ASP A 1 367 ? 31.242 60.082 34.023 1.00 29.91 ? 379 ASP A HB3 1 ATOM 5717 N N . LEU A 1 368 ? 27.961 58.434 33.044 1.00 22.03 ? 380 LEU A N 1 ATOM 5718 C CA . LEU A 1 368 ? 26.617 57.901 32.847 1.00 19.29 ? 380 LEU A CA 1 ATOM 5719 C C . LEU A 1 368 ? 25.608 58.497 33.828 1.00 20.97 ? 380 LEU A C 1 ATOM 5720 O O . LEU A 1 368 ? 24.519 57.948 34.024 1.00 20.39 ? 380 LEU A O 1 ATOM 5721 C CB . LEU A 1 368 ? 26.648 56.385 32.959 1.00 21.43 ? 380 LEU A CB 1 ATOM 5722 C CG . LEU A 1 368 ? 26.946 55.624 31.671 1.00 21.21 ? 380 LEU A CG 1 ATOM 5723 C CD1 . LEU A 1 368 ? 28.057 56.168 30.855 1.00 25.95 ? 380 LEU A CD1 1 ATOM 5724 C CD2 . LEU A 1 368 ? 27.134 54.138 31.954 1.00 19.91 ? 380 LEU A CD2 1 ATOM 5725 H H . LEU A 1 368 ? 28.342 58.151 33.762 1.00 26.44 ? 380 LEU A H 1 ATOM 5726 H HA . LEU A 1 368 ? 26.323 58.125 31.951 1.00 23.15 ? 380 LEU A HA 1 ATOM 5727 H HB2 . LEU A 1 368 ? 27.331 56.141 33.603 1.00 25.72 ? 380 LEU A HB2 1 ATOM 5728 H HB3 . LEU A 1 368 ? 25.782 56.086 33.278 1.00 25.72 ? 380 LEU A HB3 1 ATOM 5729 H HG . LEU A 1 368 ? 26.153 55.691 31.116 1.00 25.45 ? 380 LEU A HG 1 ATOM 5730 H HD11 . LEU A 1 368 ? 28.166 55.618 30.064 1.00 31.13 ? 380 LEU A HD11 1 ATOM 5731 H HD12 . LEU A 1 368 ? 27.843 57.079 30.599 1.00 31.13 ? 380 LEU A HD12 1 ATOM 5732 H HD13 . LEU A 1 368 ? 28.871 56.155 31.382 1.00 31.13 ? 380 LEU A HD13 1 ATOM 5733 H HD21 . LEU A 1 368 ? 27.321 53.679 31.120 1.00 23.89 ? 380 LEU A HD21 1 ATOM 5734 H HD22 . LEU A 1 368 ? 27.876 54.026 32.568 1.00 23.89 ? 380 LEU A HD22 1 ATOM 5735 H HD23 . LEU A 1 368 ? 26.320 53.787 32.349 1.00 23.89 ? 380 LEU A HD23 1 ATOM 5736 N N . GLN A 1 369 ? 25.947 59.621 34.440 1.00 26.15 ? 381 GLN A N 1 ATOM 5737 C CA . GLN A 1 369 ? 25.030 60.233 35.358 1.00 25.62 ? 381 GLN A CA 1 ATOM 5738 C C . GLN A 1 369 ? 23.810 60.776 34.609 1.00 19.86 ? 381 GLN A C 1 ATOM 5739 O O . GLN A 1 369 ? 23.889 61.110 33.414 1.00 21.54 ? 381 GLN A O 1 ATOM 5740 C CB . GLN A 1 369 ? 25.718 61.346 36.139 1.00 30.07 ? 381 GLN A CB 1 ATOM 5741 C CG . GLN A 1 369 ? 26.752 60.792 37.117 1.00 31.62 ? 381 GLN A CG 1 ATOM 5742 C CD . GLN A 1 369 ? 27.285 61.861 38.035 1.00 48.94 ? 381 GLN A CD 1 ATOM 5743 O OE1 . GLN A 1 369 ? 26.635 62.221 39.011 1.00 50.68 ? 381 GLN A OE1 1 ATOM 5744 N NE2 . GLN A 1 369 ? 28.474 62.376 37.729 1.00 43.98 ? 381 GLN A NE2 1 ATOM 5745 H H . GLN A 1 369 ? 26.692 60.038 34.337 1.00 31.38 ? 381 GLN A H 1 ATOM 5746 H HA . GLN A 1 369 ? 24.722 59.565 35.991 1.00 30.75 ? 381 GLN A HA 1 ATOM 5747 H HB2 . GLN A 1 369 ? 26.173 61.937 35.520 1.00 36.09 ? 381 GLN A HB2 1 ATOM 5748 H HB3 . GLN A 1 369 ? 25.054 61.838 36.647 1.00 36.09 ? 381 GLN A HB3 1 ATOM 5749 H HG2 . GLN A 1 369 ? 26.340 60.104 37.662 1.00 37.94 ? 381 GLN A HG2 1 ATOM 5750 H HG3 . GLN A 1 369 ? 27.497 60.423 36.618 1.00 37.94 ? 381 GLN A HG3 1 ATOM 5751 H HE21 . GLN A 1 369 ? 28.898 62.096 37.035 1.00 52.78 ? 381 GLN A HE21 1 ATOM 5752 H HE22 . GLN A 1 369 ? 28.817 62.989 38.225 1.00 52.78 ? 381 GLN A HE22 1 ATOM 5753 N N . PRO A 1 370 ? 22.672 60.862 35.298 1.00 21.13 ? 382 PRO A N 1 ATOM 5754 C CA . PRO A 1 370 ? 21.428 61.301 34.635 1.00 22.41 ? 382 PRO A CA 1 ATOM 5755 C C . PRO A 1 370 ? 21.567 62.611 33.882 1.00 23.54 ? 382 PRO A C 1 ATOM 5756 O O . PRO A 1 370 ? 21.085 62.738 32.741 1.00 22.86 ? 382 PRO A O 1 ATOM 5757 C CB . PRO A 1 370 ? 20.431 61.378 35.805 1.00 21.54 ? 382 PRO A CB 1 ATOM 5758 C CG . PRO A 1 370 ? 20.926 60.381 36.801 1.00 21.02 ? 382 PRO A CG 1 ATOM 5759 C CD . PRO A 1 370 ? 22.437 60.357 36.659 1.00 22.62 ? 382 PRO A CD 1 ATOM 5760 H HA . PRO A 1 370 ? 21.129 60.617 34.015 1.00 26.89 ? 382 PRO A HA 1 ATOM 5761 H HB2 . PRO A 1 370 ? 20.437 62.271 36.181 1.00 25.85 ? 382 PRO A HB2 1 ATOM 5762 H HB3 . PRO A 1 370 ? 19.543 61.141 35.494 1.00 25.85 ? 382 PRO A HB3 1 ATOM 5763 H HG2 . PRO A 1 370 ? 20.672 60.663 37.693 1.00 25.22 ? 382 PRO A HG2 1 ATOM 5764 H HG3 . PRO A 1 370 ? 20.551 59.510 36.600 1.00 25.22 ? 382 PRO A HG3 1 ATOM 5765 H HD2 . PRO A 1 370 ? 22.846 60.945 37.312 1.00 27.15 ? 382 PRO A HD2 1 ATOM 5766 H HD3 . PRO A 1 370 ? 22.768 59.449 36.743 1.00 27.15 ? 382 PRO A HD3 1 ATOM 5767 N N . LYS A 1 371 ? 22.287 63.581 34.449 1.00 27.09 ? 383 LYS A N 1 ATOM 5768 C CA . LYS A 1 371 ? 22.432 64.857 33.750 1.00 24.12 ? 383 LYS A CA 1 ATOM 5769 C C . LYS A 1 371 ? 23.270 64.712 32.485 1.00 21.31 ? 383 LYS A C 1 ATOM 5770 O O . LYS A 1 371 ? 22.988 65.367 31.468 1.00 25.14 ? 383 LYS A O 1 ATOM 5771 C CB . LYS A 1 371 ? 23.031 65.916 34.696 1.00 31.43 ? 383 LYS A CB 1 ATOM 5772 C CG . LYS A 1 371 ? 21.950 66.499 35.603 1.00 56.57 ? 383 LYS A CG 1 ATOM 5773 C CD . LYS A 1 371 ? 22.472 67.356 36.735 1.00 70.75 ? 383 LYS A CD 1 ATOM 5774 C CE . LYS A 1 371 ? 21.372 67.572 37.786 1.00 61.84 ? 383 LYS A CE 1 ATOM 5775 N NZ . LYS A 1 371 ? 21.887 68.237 39.022 1.00 79.96 ? 383 LYS A NZ 1 ATOM 5776 H H . LYS A 1 371 ? 22.687 63.530 35.208 1.00 32.51 ? 383 LYS A H 1 ATOM 5777 H HA . LYS A 1 371 ? 21.551 65.165 33.484 1.00 28.94 ? 383 LYS A HA 1 ATOM 5778 H HB2 . LYS A 1 371 ? 23.710 65.504 35.253 1.00 37.71 ? 383 LYS A HB2 1 ATOM 5779 H HB3 . LYS A 1 371 ? 23.414 66.637 34.172 1.00 37.71 ? 383 LYS A HB3 1 ATOM 5780 H HG2 . LYS A 1 371 ? 21.358 67.049 35.066 1.00 67.89 ? 383 LYS A HG2 1 ATOM 5781 H HG3 . LYS A 1 371 ? 21.447 65.768 35.996 1.00 67.89 ? 383 LYS A HG3 1 ATOM 5782 H HD2 . LYS A 1 371 ? 23.222 66.911 37.160 1.00 84.90 ? 383 LYS A HD2 1 ATOM 5783 H HD3 . LYS A 1 371 ? 22.742 68.222 36.389 1.00 84.90 ? 383 LYS A HD3 1 ATOM 5784 H HE2 . LYS A 1 371 ? 20.678 68.135 37.408 1.00 74.20 ? 383 LYS A HE2 1 ATOM 5785 H HE3 . LYS A 1 371 ? 21.002 66.712 38.038 1.00 74.20 ? 383 LYS A HE3 1 ATOM 5786 H HZ1 . LYS A 1 371 ? 21.225 68.346 39.607 1.00 95.95 ? 383 LYS A HZ1 1 ATOM 5787 H HZ2 . LYS A 1 371 ? 22.523 67.737 39.393 1.00 95.95 ? 383 LYS A HZ2 1 ATOM 5788 H HZ3 . LYS A 1 371 ? 22.228 69.034 38.819 1.00 95.95 ? 383 LYS A HZ3 1 ATOM 5789 N N . SER A 1 372 ? 24.288 63.852 32.510 1.00 23.19 ? 384 SER A N 1 ATOM 5790 C CA . SER A 1 372 ? 25.113 63.667 31.318 1.00 27.25 ? 384 SER A CA 1 ATOM 5791 C C . SER A 1 372 ? 24.330 63.001 30.200 1.00 26.52 ? 384 SER A C 1 ATOM 5792 O O . SER A 1 372 ? 24.421 63.413 29.039 1.00 24.69 ? 384 SER A O 1 ATOM 5793 C CB . SER A 1 372 ? 26.353 62.843 31.647 1.00 26.49 ? 384 SER A CB 1 ATOM 5794 O OG . SER A 1 372 ? 26.974 63.327 32.818 1.00 32.60 ? 384 SER A OG 1 ATOM 5795 H H . SER A 1 372 ? 24.516 63.373 33.187 1.00 27.83 ? 384 SER A H 1 ATOM 5796 H HA . SER A 1 372 ? 25.407 64.536 31.001 1.00 32.70 ? 384 SER A HA 1 ATOM 5797 H HB2 . SER A 1 372 ? 26.091 61.920 31.786 1.00 31.79 ? 384 SER A HB2 1 ATOM 5798 H HB3 . SER A 1 372 ? 26.979 62.904 30.909 1.00 31.79 ? 384 SER A HB3 1 ATOM 5799 H HG . SER A 1 372 ? 27.655 62.868 32.992 1.00 39.12 ? 384 SER A HG 1 ATOM 5800 N N . LEU A 1 373 ? 23.523 61.992 30.532 1.00 22.55 ? 385 LEU A N 1 ATOM 5801 C CA . LEU A 1 373 ? 22.762 61.324 29.489 1.00 20.01 ? 385 LEU A CA 1 ATOM 5802 C C . LEU A 1 373 ? 21.600 62.180 29.019 1.00 21.28 ? 385 LEU A C 1 ATOM 5803 O O . LEU A 1 373 ? 21.253 62.158 27.829 1.00 21.89 ? 385 LEU A O 1 ATOM 5804 C CB . LEU A 1 373 ? 22.273 59.970 30.000 1.00 21.24 ? 385 LEU A CB 1 ATOM 5805 C CG . LEU A 1 373 ? 23.385 58.999 30.360 1.00 24.71 ? 385 LEU A CG 1 ATOM 5806 C CD1 . LEU A 1 373 ? 22.773 57.679 30.774 1.00 25.29 ? 385 LEU A CD1 1 ATOM 5807 C CD2 . LEU A 1 373 ? 24.348 58.783 29.215 1.00 23.80 ? 385 LEU A CD2 1 ATOM 5808 H H . LEU A 1 373 ? 23.404 61.687 31.327 1.00 27.06 ? 385 LEU A H 1 ATOM 5809 H HA . LEU A 1 373 ? 23.342 61.164 28.728 1.00 24.01 ? 385 LEU A HA 1 ATOM 5810 H HB2 . LEU A 1 373 ? 21.738 60.113 30.797 1.00 25.48 ? 385 LEU A HB2 1 ATOM 5811 H HB3 . LEU A 1 373 ? 21.730 59.554 29.312 1.00 25.48 ? 385 LEU A HB3 1 ATOM 5812 H HG . LEU A 1 373 ? 23.884 59.351 31.114 1.00 29.65 ? 385 LEU A HG 1 ATOM 5813 H HD11 . LEU A 1 373 ? 23.484 57.060 31.003 1.00 30.34 ? 385 LEU A HD11 1 ATOM 5814 H HD12 . LEU A 1 373 ? 22.200 57.825 31.542 1.00 30.34 ? 385 LEU A HD12 1 ATOM 5815 H HD13 . LEU A 1 373 ? 22.253 57.327 30.034 1.00 30.34 ? 385 LEU A HD13 1 ATOM 5816 H HD21 . LEU A 1 373 ? 25.036 58.158 29.495 1.00 28.55 ? 385 LEU A HD21 1 ATOM 5817 H HD22 . LEU A 1 373 ? 23.861 58.422 28.457 1.00 28.55 ? 385 LEU A HD22 1 ATOM 5818 H HD23 . LEU A 1 373 ? 24.750 59.633 28.976 1.00 28.55 ? 385 LEU A HD23 1 ATOM 5819 N N . TYR A 1 374 ? 21.017 62.967 29.926 1.00 24.25 ? 386 TYR A N 1 ATOM 5820 C CA . TYR A 1 374 ? 19.937 63.865 29.535 1.00 23.41 ? 386 TYR A CA 1 ATOM 5821 C C . TYR A 1 374 ? 20.412 64.816 28.452 1.00 27.36 ? 386 TYR A C 1 ATOM 5822 O O . TYR A 1 374 ? 19.750 64.992 27.418 1.00 26.93 ? 386 TYR A O 1 ATOM 5823 C CB . TYR A 1 374 ? 19.424 64.622 30.765 1.00 22.26 ? 386 TYR A CB 1 ATOM 5824 C CG . TYR A 1 374 ? 18.171 65.415 30.486 1.00 29.33 ? 386 TYR A CG 1 ATOM 5825 C CD1 . TYR A 1 374 ? 16.921 64.809 30.530 1.00 39.63 ? 386 TYR A CD1 1 ATOM 5826 C CD2 . TYR A 1 374 ? 18.241 66.763 30.174 1.00 35.09 ? 386 TYR A CD2 1 ATOM 5827 C CE1 . TYR A 1 374 ? 15.767 65.530 30.282 1.00 44.81 ? 386 TYR A CE1 1 ATOM 5828 C CE2 . TYR A 1 374 ? 17.092 67.494 29.919 1.00 35.86 ? 386 TYR A CE2 1 ATOM 5829 C CZ . TYR A 1 374 ? 15.865 66.874 29.970 1.00 45.50 ? 386 TYR A CZ 1 ATOM 5830 O OH . TYR A 1 374 ? 14.726 67.597 29.713 1.00 56.17 ? 386 TYR A OH 1 ATOM 5831 H H . TYR A 1 374 ? 21.225 62.998 30.760 1.00 29.11 ? 386 TYR A H 1 ATOM 5832 H HA . TYR A 1 374 ? 19.204 63.342 29.175 1.00 28.10 ? 386 TYR A HA 1 ATOM 5833 H HB2 . TYR A 1 374 ? 19.224 63.984 31.468 1.00 26.72 ? 386 TYR A HB2 1 ATOM 5834 H HB3 . TYR A 1 374 ? 20.110 65.240 31.064 1.00 26.72 ? 386 TYR A HB3 1 ATOM 5835 H HD1 . TYR A 1 374 ? 16.858 63.905 30.740 1.00 47.56 ? 386 TYR A HD1 1 ATOM 5836 H HD2 . TYR A 1 374 ? 19.069 67.184 30.139 1.00 42.10 ? 386 TYR A HD2 1 ATOM 5837 H HE1 . TYR A 1 374 ? 14.936 65.114 30.313 1.00 53.78 ? 386 TYR A HE1 1 ATOM 5838 H HE2 . TYR A 1 374 ? 17.150 68.398 29.710 1.00 43.04 ? 386 TYR A HE2 1 ATOM 5839 H HH . TYR A 1 374 ? 14.050 67.102 29.780 1.00 67.41 ? 386 TYR A HH 1 ATOM 5840 N N . ALA A 1 375 ? 21.603 65.376 28.632 1.00 25.45 ? 387 ALA A N 1 ATOM 5841 C CA . ALA A 1 375 ? 22.140 66.281 27.631 1.00 28.08 ? 387 ALA A CA 1 ATOM 5842 C C . ALA A 1 375 ? 22.382 65.556 26.318 1.00 28.52 ? 387 ALA A C 1 ATOM 5843 O O . ALA A 1 375 ? 22.194 66.131 25.240 1.00 28.28 ? 387 ALA A O 1 ATOM 5844 C CB . ALA A 1 375 ? 23.427 66.922 28.139 1.00 27.96 ? 387 ALA A CB 1 ATOM 5845 H H . ALA A 1 375 ? 22.112 65.249 29.314 1.00 30.55 ? 387 ALA A H 1 ATOM 5846 H HA . ALA A 1 375 ? 21.497 66.989 27.469 1.00 33.70 ? 387 ALA A HA 1 ATOM 5847 H HB1 . ALA A 1 375 ? 23.770 67.522 27.458 1.00 33.55 ? 387 ALA A HB1 1 ATOM 5848 H HB2 . ALA A 1 375 ? 23.235 67.417 28.951 1.00 33.55 ? 387 ALA A HB2 1 ATOM 5849 H HB3 . ALA A 1 375 ? 24.076 66.224 28.323 1.00 33.55 ? 387 ALA A HB3 1 ATOM 5850 N N . LEU A 1 376 ? 22.819 64.298 26.382 1.00 25.97 ? 388 LEU A N 1 ATOM 5851 C CA . LEU A 1 376 ? 23.001 63.525 25.158 1.00 23.06 ? 388 LEU A CA 1 ATOM 5852 C C . LEU A 1 376 ? 21.681 63.327 24.424 1.00 25.37 ? 388 LEU A C 1 ATOM 5853 O O . LEU A 1 376 ? 21.599 63.495 23.204 1.00 24.41 ? 388 LEU A O 1 ATOM 5854 C CB . LEU A 1 376 ? 23.642 62.169 25.468 1.00 24.61 ? 388 LEU A CB 1 ATOM 5855 C CG . LEU A 1 376 ? 23.667 61.189 24.290 1.00 23.54 ? 388 LEU A CG 1 ATOM 5856 C CD1 . LEU A 1 376 ? 24.558 61.748 23.141 1.00 21.50 ? 388 LEU A CD1 1 ATOM 5857 C CD2 . LEU A 1 376 ? 24.108 59.812 24.724 1.00 24.96 ? 388 LEU A CD2 1 ATOM 5858 H H . LEU A 1 376 ? 23.013 63.878 27.107 1.00 31.16 ? 388 LEU A H 1 ATOM 5859 H HA . LEU A 1 376 ? 23.599 64.009 24.567 1.00 27.67 ? 388 LEU A HA 1 ATOM 5860 H HB2 . LEU A 1 376 ? 24.559 62.317 25.746 1.00 29.53 ? 388 LEU A HB2 1 ATOM 5861 H HB3 . LEU A 1 376 ? 23.145 61.749 26.188 1.00 29.53 ? 388 LEU A HB3 1 ATOM 5862 H HG . LEU A 1 376 ? 22.765 61.108 23.942 1.00 28.25 ? 388 LEU A HG 1 ATOM 5863 H HD11 . LEU A 1 376 ? 24.561 61.114 22.407 1.00 25.80 ? 388 LEU A HD11 1 ATOM 5864 H HD12 . LEU A 1 376 ? 24.194 62.597 22.844 1.00 25.80 ? 388 LEU A HD12 1 ATOM 5865 H HD13 . LEU A 1 376 ? 25.461 61.873 23.474 1.00 25.80 ? 388 LEU A HD13 1 ATOM 5866 H HD21 . LEU A 1 376 ? 24.110 59.224 23.952 1.00 29.95 ? 388 LEU A HD21 1 ATOM 5867 H HD22 . LEU A 1 376 ? 25.000 59.870 25.099 1.00 29.95 ? 388 LEU A HD22 1 ATOM 5868 H HD23 . LEU A 1 376 ? 23.488 59.479 25.392 1.00 29.95 ? 388 LEU A HD23 1 ATOM 5869 N N . VAL A 1 377 ? 20.636 62.916 25.136 1.00 21.50 ? 389 VAL A N 1 ATOM 5870 C CA A VAL A 1 377 ? 19.394 62.612 24.436 0.50 25.93 ? 389 VAL A CA 1 ATOM 5871 C CA B VAL A 1 377 ? 19.405 62.607 24.426 0.50 25.94 ? 389 VAL A CA 1 ATOM 5872 C C . VAL A 1 377 ? 18.735 63.881 23.920 1.00 28.60 ? 389 VAL A C 1 ATOM 5873 O O . VAL A 1 377 ? 18.016 63.853 22.908 1.00 28.91 ? 389 VAL A O 1 ATOM 5874 C CB A VAL A 1 377 ? 18.449 61.819 25.350 0.50 27.23 ? 389 VAL A CB 1 ATOM 5875 C CB B VAL A 1 377 ? 18.507 61.745 25.326 0.50 27.21 ? 389 VAL A CB 1 ATOM 5876 C CG1 A VAL A 1 377 ? 17.165 61.482 24.592 0.50 30.72 ? 389 VAL A CG1 1 ATOM 5877 C CG1 B VAL A 1 377 ? 19.188 60.398 25.543 0.50 27.86 ? 389 VAL A CG1 1 ATOM 5878 C CG2 A VAL A 1 377 ? 19.146 60.561 25.843 0.50 28.76 ? 389 VAL A CG2 1 ATOM 5879 C CG2 B VAL A 1 377 ? 18.264 62.407 26.639 0.50 29.09 ? 389 VAL A CG2 1 ATOM 5880 H HA . VAL A 1 377 ? 19.614 62.064 23.659 1.00 31.12 ? 389 VAL A HA 1 ATOM 5881 H HB A VAL A 1 377 ? 18.216 62.361 26.120 0.50 32.68 ? 389 VAL A HB 1 ATOM 5882 H HB B VAL A 1 377 ? 17.654 61.596 24.889 0.50 32.66 ? 389 VAL A HB 1 ATOM 5883 H HG11 A VAL A 1 377 ? 16.575 60.982 25.177 0.50 36.86 ? 389 VAL A HG11 1 ATOM 5884 H HG11 B VAL A 1 377 ? 18.625 59.849 26.111 0.50 33.44 ? 389 VAL A HG11 1 ATOM 5885 H HG12 A VAL A 1 377 ? 16.736 62.307 24.316 0.50 36.86 ? 389 VAL A HG12 1 ATOM 5886 H HG12 B VAL A 1 377 ? 19.314 59.966 24.684 0.50 33.44 ? 389 VAL A HG12 1 ATOM 5887 H HG13 A VAL A 1 377 ? 17.389 60.950 23.813 0.50 36.86 ? 389 VAL A HG13 1 ATOM 5888 H HG13 B VAL A 1 377 ? 20.047 60.544 25.970 0.50 33.44 ? 389 VAL A HG13 1 ATOM 5889 H HG21 A VAL A 1 377 ? 18.540 60.069 26.418 0.50 34.51 ? 389 VAL A HG21 1 ATOM 5890 H HG21 B VAL A 1 377 ? 17.695 61.836 27.179 0.50 34.90 ? 389 VAL A HG21 1 ATOM 5891 H HG22 A VAL A 1 377 ? 19.392 60.017 25.078 0.50 34.51 ? 389 VAL A HG22 1 ATOM 5892 H HG22 B VAL A 1 377 ? 19.114 62.544 27.085 0.50 34.90 ? 389 VAL A HG22 1 ATOM 5893 H HG23 A VAL A 1 377 ? 19.941 60.814 26.338 0.50 34.51 ? 389 VAL A HG23 1 ATOM 5894 H HG23 B VAL A 1 377 ? 17.828 63.260 26.486 0.50 34.90 ? 389 VAL A HG23 1 ATOM 5895 N N . GLN A 1 378 ? 18.975 65.021 24.567 1.00 32.25 ? 390 GLN A N 1 ATOM 5896 C CA A GLN A 1 378 ? 18.533 66.287 23.984 0.48 36.67 ? 390 GLN A CA 1 ATOM 5897 C CA B GLN A 1 378 ? 18.534 66.287 23.983 0.52 36.67 ? 390 GLN A CA 1 ATOM 5898 C C . GLN A 1 378 ? 19.174 66.523 22.622 1.00 33.10 ? 390 GLN A C 1 ATOM 5899 O O . GLN A 1 378 ? 18.548 67.112 21.738 1.00 36.21 ? 390 GLN A O 1 ATOM 5900 C CB A GLN A 1 378 ? 18.851 67.451 24.925 0.48 38.86 ? 390 GLN A CB 1 ATOM 5901 C CB B GLN A 1 378 ? 18.866 67.455 24.912 0.52 38.86 ? 390 GLN A CB 1 ATOM 5902 C CG A GLN A 1 378 ? 17.804 67.679 26.006 0.48 43.39 ? 390 GLN A CG 1 ATOM 5903 C CG B GLN A 1 378 ? 18.003 67.543 26.146 0.52 42.94 ? 390 GLN A CG 1 ATOM 5904 C CD A GLN A 1 378 ? 16.476 68.174 25.451 0.48 44.71 ? 390 GLN A CD 1 ATOM 5905 C CD B GLN A 1 378 ? 18.399 68.711 27.016 0.52 45.49 ? 390 GLN A CD 1 ATOM 5906 O OE1 A GLN A 1 378 ? 15.414 67.777 25.922 0.48 46.85 ? 390 GLN A OE1 1 ATOM 5907 O OE1 B GLN A 1 378 ? 19.577 68.886 27.342 0.52 45.83 ? 390 GLN A OE1 1 ATOM 5908 N NE2 A GLN A 1 378 ? 16.533 69.062 24.456 0.48 49.44 ? 390 GLN A NE2 1 ATOM 5909 N NE2 B GLN A 1 378 ? 17.422 69.532 27.382 0.52 43.92 ? 390 GLN A NE2 1 ATOM 5910 H H . GLN A 1 378 ? 19.379 65.095 25.322 1.00 38.70 ? 390 GLN A H 1 ATOM 5911 H HA . GLN A 1 378 ? 17.572 66.260 23.861 1.00 44.01 ? 390 GLN A HA 1 ATOM 5912 H HB2 A GLN A 1 378 ? 19.697 67.274 25.366 0.48 46.63 ? 390 GLN A HB2 1 ATOM 5913 H HB2 B GLN A 1 378 ? 19.787 67.366 25.203 0.52 46.63 ? 390 GLN A HB2 1 ATOM 5914 H HB3 A GLN A 1 378 ? 18.919 68.266 24.402 0.48 46.63 ? 390 GLN A HB3 1 ATOM 5915 H HB3 B GLN A 1 378 ? 18.758 68.283 24.418 0.52 46.63 ? 390 GLN A HB3 1 ATOM 5916 H HG2 A GLN A 1 378 ? 17.641 66.843 26.469 0.48 52.06 ? 390 GLN A HG2 1 ATOM 5917 H HG2 B GLN A 1 378 ? 17.077 67.660 25.881 0.52 51.52 ? 390 GLN A HG2 1 ATOM 5918 H HG3 A GLN A 1 378 ? 18.134 68.345 26.629 0.48 52.06 ? 390 GLN A HG3 1 ATOM 5919 H HG3 B GLN A 1 378 ? 18.103 66.730 26.665 0.52 51.52 ? 390 GLN A HG3 1 ATOM 5920 H HE21 A GLN A 1 378 ? 17.296 69.327 24.160 0.48 59.33 ? 390 GLN A HE21 1 ATOM 5921 H HE21 B GLN A 1 378 ? 16.616 69.383 27.124 0.52 52.71 ? 390 GLN A HE21 1 ATOM 5922 H HE22 A GLN A 1 378 ? 15.808 69.369 24.112 0.48 59.33 ? 390 GLN A HE22 1 ATOM 5923 H HE22 B GLN A 1 378 ? 17.597 70.213 27.878 0.52 52.71 ? 390 GLN A HE22 1 ATOM 5924 N N . GLN A 1 379 ? 20.427 66.095 22.438 1.00 30.78 ? 391 GLN A N 1 ATOM 5925 C CA . GLN A 1 379 ? 21.039 66.181 21.115 1.00 29.03 ? 391 GLN A CA 1 ATOM 5926 C C . GLN A 1 379 ? 20.298 65.296 20.117 1.00 33.71 ? 391 GLN A C 1 ATOM 5927 O O . GLN A 1 379 ? 20.105 65.681 18.958 1.00 29.76 ? 391 GLN A O 1 ATOM 5928 C CB . GLN A 1 379 ? 22.518 65.777 21.152 1.00 33.24 ? 391 GLN A CB 1 ATOM 5929 C CG . GLN A 1 379 ? 23.384 66.577 22.099 1.00 34.77 ? 391 GLN A CG 1 ATOM 5930 C CD . GLN A 1 379 ? 24.782 65.986 22.226 1.00 44.85 ? 391 GLN A CD 1 ATOM 5931 O OE1 . GLN A 1 379 ? 25.393 65.614 21.234 1.00 42.41 ? 391 GLN A OE1 1 ATOM 5932 N NE2 . GLN A 1 379 ? 25.278 65.876 23.454 1.00 55.58 ? 391 GLN A NE2 1 ATOM 5933 H H . GLN A 1 379 ? 20.931 65.759 23.048 1.00 36.93 ? 391 GLN A H 1 ATOM 5934 H HA . GLN A 1 379 ? 20.986 67.097 20.801 1.00 34.84 ? 391 GLN A HA 1 ATOM 5935 H HB2 . GLN A 1 379 ? 22.575 64.846 21.420 1.00 39.89 ? 391 GLN A HB2 1 ATOM 5936 H HB3 . GLN A 1 379 ? 22.887 65.881 20.261 1.00 39.89 ? 391 GLN A HB3 1 ATOM 5937 H HG2 . GLN A 1 379 ? 23.468 67.484 21.766 1.00 41.72 ? 391 GLN A HG2 1 ATOM 5938 H HG3 . GLN A 1 379 ? 22.976 66.580 22.979 1.00 41.72 ? 391 GLN A HG3 1 ATOM 5939 H HE21 . GLN A 1 379 ? 24.813 66.133 24.130 1.00 66.69 ? 391 GLN A HE21 1 ATOM 5940 H HE22 . GLN A 1 379 ? 26.064 65.548 23.573 1.00 66.69 ? 391 GLN A HE22 1 ATOM 5941 N N . PHE A 1 380 ? 19.888 64.097 20.547 1.00 28.83 ? 392 PHE A N 1 ATOM 5942 C CA . PHE A 1 380 ? 19.210 63.168 19.642 1.00 24.87 ? 392 PHE A CA 1 ATOM 5943 C C . PHE A 1 380 ? 18.043 63.847 18.953 1.00 29.04 ? 392 PHE A C 1 ATOM 5944 O O . PHE A 1 380 ? 17.736 63.561 17.788 1.00 27.17 ? 392 PHE A O 1 ATOM 5945 C CB . PHE A 1 380 ? 18.668 61.939 20.392 1.00 23.45 ? 392 PHE A CB 1 ATOM 5946 C CG . PHE A 1 380 ? 19.697 60.954 20.850 1.00 24.82 ? 392 PHE A CG 1 ATOM 5947 C CD1 . PHE A 1 380 ? 21.034 61.089 20.572 1.00 24.82 ? 392 PHE A CD1 1 ATOM 5948 C CD2 . PHE A 1 380 ? 19.288 59.847 21.574 1.00 21.46 ? 392 PHE A CD2 1 ATOM 5949 C CE1 . PHE A 1 380 ? 21.931 60.154 21.007 1.00 25.95 ? 392 PHE A CE1 1 ATOM 5950 C CE2 . PHE A 1 380 ? 20.206 58.906 22.027 1.00 20.61 ? 392 PHE A CE2 1 ATOM 5951 C CZ . PHE A 1 380 ? 21.504 59.059 21.752 1.00 20.35 ? 392 PHE A CZ 1 ATOM 5952 H H . PHE A 1 380 ? 19.989 63.803 21.349 1.00 34.60 ? 392 PHE A H 1 ATOM 5953 H HA . PHE A 1 380 ? 19.834 62.865 18.964 1.00 29.85 ? 392 PHE A HA 1 ATOM 5954 H HB2 . PHE A 1 380 ? 18.190 62.246 21.178 1.00 28.14 ? 392 PHE A HB2 1 ATOM 5955 H HB3 . PHE A 1 380 ? 18.056 61.468 19.805 1.00 28.14 ? 392 PHE A HB3 1 ATOM 5956 H HD1 . PHE A 1 380 ? 21.332 61.821 20.082 1.00 29.78 ? 392 PHE A HD1 1 ATOM 5957 H HD2 . PHE A 1 380 ? 18.387 59.740 21.776 1.00 25.76 ? 392 PHE A HD2 1 ATOM 5958 H HE1 . PHE A 1 380 ? 22.835 60.260 20.819 1.00 31.14 ? 392 PHE A HE1 1 ATOM 5959 H HE2 . PHE A 1 380 ? 19.917 58.170 22.516 1.00 24.74 ? 392 PHE A HE2 1 ATOM 5960 H HZ . PHE A 1 380 ? 22.120 58.426 22.043 1.00 24.42 ? 392 PHE A HZ 1 ATOM 5961 N N . ALA A 1 381 ? 17.351 64.717 19.684 1.00 25.65 ? 393 ALA A N 1 ATOM 5962 C CA . ALA A 1 381 ? 16.128 65.334 19.202 1.00 32.91 ? 393 ALA A CA 1 ATOM 5963 C C . ALA A 1 381 ? 16.369 66.327 18.083 1.00 32.14 ? 393 ALA A C 1 ATOM 5964 O O . ALA A 1 381 ? 15.403 66.720 17.427 1.00 35.68 ? 393 ALA A O 1 ATOM 5965 C CB . ALA A 1 381 ? 15.414 66.026 20.358 1.00 38.75 ? 393 ALA A CB 1 ATOM 5966 H H . ALA A 1 381 ? 17.577 64.967 20.476 1.00 30.78 ? 393 ALA A H 1 ATOM 5967 H HA . ALA A 1 381 ? 15.541 64.641 18.862 1.00 39.49 ? 393 ALA A HA 1 ATOM 5968 H HB1 . ALA A 1 381 ? 14.599 66.435 20.026 1.00 46.50 ? 393 ALA A HB1 1 ATOM 5969 H HB2 . ALA A 1 381 ? 15.200 65.367 21.037 1.00 46.50 ? 393 ALA A HB2 1 ATOM 5970 H HB3 . ALA A 1 381 ? 15.998 66.706 20.728 1.00 46.50 ? 393 ALA A HB3 1 ATOM 5971 N N . THR A 1 382 ? 17.613 66.737 17.839 1.00 29.56 ? 394 THR A N 1 ATOM 5972 C CA . THR A 1 382 ? 17.853 67.715 16.787 1.00 34.97 ? 394 THR A CA 1 ATOM 5973 C C . THR A 1 382 ? 17.726 67.072 15.418 1.00 36.91 ? 394 THR A C 1 ATOM 5974 O O . THR A 1 382 ? 18.011 65.889 15.219 1.00 29.73 ? 394 THR A O 1 ATOM 5975 C CB . THR A 1 382 ? 19.236 68.385 16.934 1.00 35.56 ? 394 THR A CB 1 ATOM 5976 O OG1 . THR A 1 382 ? 20.287 67.458 16.659 1.00 47.55 ? 394 THR A OG1 1 ATOM 5977 C CG2 . THR A 1 382 ? 19.414 68.943 18.351 1.00 35.43 ? 394 THR A CG2 1 ATOM 5978 H H . THR A 1 382 ? 18.316 66.471 18.256 1.00 35.47 ? 394 THR A H 1 ATOM 5979 H HA . THR A 1 382 ? 17.181 68.411 16.851 1.00 41.96 ? 394 THR A HA 1 ATOM 5980 H HB . THR A 1 382 ? 19.297 69.125 16.311 1.00 42.68 ? 394 THR A HB 1 ATOM 5981 H HG1 . THR A 1 382 ? 20.247 66.811 17.194 1.00 57.06 ? 394 THR A HG1 1 ATOM 5982 H HG21 . THR A 1 382 ? 20.285 69.361 18.435 1.00 42.51 ? 394 THR A HG21 1 ATOM 5983 H HG22 . THR A 1 382 ? 18.727 69.603 18.536 1.00 42.51 ? 394 THR A HG22 1 ATOM 5984 H HG23 . THR A 1 382 ? 19.345 68.226 19.001 1.00 42.51 ? 394 THR A HG23 1 ATOM 5985 N N . LYS A 1 383 ? 17.288 67.876 14.461 1.00 40.26 ? 395 LYS A N 1 ATOM 5986 C CA . LYS A 1 383 ? 17.069 67.375 13.114 1.00 34.78 ? 395 LYS A CA 1 ATOM 5987 C C . LYS A 1 383 ? 18.346 66.778 12.541 1.00 37.69 ? 395 LYS A C 1 ATOM 5988 O O . LYS A 1 383 ? 19.412 67.395 12.593 1.00 39.27 ? 395 LYS A O 1 ATOM 5989 C CB . LYS A 1 383 ? 16.570 68.516 12.226 1.00 47.21 ? 395 LYS A CB 1 ATOM 5990 C CG . LYS A 1 383 ? 16.209 68.094 10.828 1.00 60.30 ? 395 LYS A CG 1 ATOM 5991 C CD . LYS A 1 383 ? 15.744 69.282 9.994 1.00 67.59 ? 395 LYS A CD 1 ATOM 5992 C CE . LYS A 1 383 ? 15.495 68.867 8.554 1.00 72.60 ? 395 LYS A CE 1 ATOM 5993 N NZ . LYS A 1 383 ? 14.568 67.699 8.475 1.00 65.72 ? 395 LYS A NZ 1 ATOM 5994 H H . LYS A 1 383 ? 17.111 68.711 14.564 1.00 48.31 ? 395 LYS A H 1 ATOM 5995 H HA . LYS A 1 383 ? 16.389 66.683 13.135 1.00 41.74 ? 395 LYS A HA 1 ATOM 5996 H HB2 . LYS A 1 383 ? 15.778 68.903 12.631 1.00 56.65 ? 395 LYS A HB2 1 ATOM 5997 H HB3 . LYS A 1 383 ? 17.267 69.188 12.161 1.00 56.65 ? 395 LYS A HB3 1 ATOM 5998 H HG2 . LYS A 1 383 ? 16.988 67.707 10.399 1.00 72.36 ? 395 LYS A HG2 1 ATOM 5999 H HG3 . LYS A 1 383 ? 15.488 67.447 10.865 1.00 72.36 ? 395 LYS A HG3 1 ATOM 6000 H HD2 . LYS A 1 383 ? 14.916 69.629 10.361 1.00 81.11 ? 395 LYS A HD2 1 ATOM 6001 H HD3 . LYS A 1 383 ? 16.430 69.969 10.001 1.00 81.11 ? 395 LYS A HD3 1 ATOM 6002 H HE2 . LYS A 1 383 ? 15.094 69.606 8.072 1.00 87.12 ? 395 LYS A HE2 1 ATOM 6003 H HE3 . LYS A 1 383 ? 16.337 68.615 8.143 1.00 87.12 ? 395 LYS A HE3 1 ATOM 6004 H HZ1 . LYS A 1 383 ? 14.436 67.472 7.624 1.00 78.87 ? 395 LYS A HZ1 1 ATOM 6005 H HZ2 . LYS A 1 383 ? 14.917 67.004 8.908 1.00 78.87 ? 395 LYS A HZ2 1 ATOM 6006 H HZ3 . LYS A 1 383 ? 13.785 67.907 8.843 1.00 78.87 ? 395 LYS A HZ3 1 ATOM 6007 N N . ASP A 1 384 ? 18.234 65.559 12.007 1.00 36.43 ? 396 ASP A N 1 ATOM 6008 C CA . ASP A 1 384 ? 19.347 64.841 11.376 1.00 40.66 ? 396 ASP A CA 1 ATOM 6009 C C . ASP A 1 384 ? 20.514 64.585 12.340 1.00 32.38 ? 396 ASP A C 1 ATOM 6010 O O . ASP A 1 384 ? 21.660 64.392 11.921 1.00 32.84 ? 396 ASP A O 1 ATOM 6011 C CB . ASP A 1 384 ? 19.816 65.583 10.122 1.00 48.17 ? 396 ASP A CB 1 ATOM 6012 C CG . ASP A 1 384 ? 18.731 65.648 9.059 1.00 56.89 ? 396 ASP A CG 1 ATOM 6013 O OD1 . ASP A 1 384 ? 17.961 64.662 8.933 1.00 51.72 ? 396 ASP A OD1 1 ATOM 6014 O OD2 . ASP A 1 384 ? 18.632 66.681 8.366 1.00 60.64 ? 396 ASP A OD2 1 ATOM 6015 H H . ASP A 1 384 ? 17.499 65.114 11.998 1.00 43.71 ? 396 ASP A H 1 ATOM 6016 H HA . ASP A 1 384 ? 19.020 63.974 11.089 1.00 48.79 ? 396 ASP A HA 1 ATOM 6017 H HB2 . ASP A 1 384 ? 20.059 66.491 10.362 1.00 57.80 ? 396 ASP A HB2 1 ATOM 6018 H HB3 . ASP A 1 384 ? 20.581 65.120 9.746 1.00 57.80 ? 396 ASP A HB3 1 ATOM 6019 N N . SER A 1 385 ? 20.223 64.530 13.635 1.00 30.84 ? 397 SER A N 1 ATOM 6020 C CA . SER A 1 385 ? 21.242 64.235 14.638 1.00 24.09 ? 397 SER A CA 1 ATOM 6021 C C . SER A 1 385 ? 22.100 63.044 14.242 1.00 27.43 ? 397 SER A C 1 ATOM 6022 O O . SER A 1 385 ? 21.613 61.917 14.106 1.00 24.37 ? 397 SER A O 1 ATOM 6023 C CB . SER A 1 385 ? 20.560 63.965 15.989 1.00 27.75 ? 397 SER A CB 1 ATOM 6024 O OG . SER A 1 385 ? 21.514 63.453 16.901 1.00 27.51 ? 397 SER A OG 1 ATOM 6025 H H . SER A 1 385 ? 19.438 64.660 13.961 1.00 37.01 ? 397 SER A H 1 ATOM 6026 H HA . SER A 1 385 ? 21.822 65.006 14.740 1.00 28.91 ? 397 SER A HA 1 ATOM 6027 H HB2 . SER A 1 385 ? 20.197 64.795 16.337 1.00 33.30 ? 397 SER A HB2 1 ATOM 6028 H HB3 . SER A 1 385 ? 19.852 63.313 15.866 1.00 33.30 ? 397 SER A HB3 1 ATOM 6029 H HG . SER A 1 385 ? 22.135 64.009 17.010 1.00 33.02 ? 397 SER A HG 1 ATOM 6030 N N . LYS A 1 386 ? 23.401 63.272 14.112 1.00 28.88 ? 398 LYS A N 1 ATOM 6031 C CA . LYS A 1 386 ? 24.303 62.150 13.880 1.00 30.12 ? 398 LYS A CA 1 ATOM 6032 C C . LYS A 1 386 ? 24.429 61.271 15.123 1.00 24.44 ? 398 LYS A C 1 ATOM 6033 O O . LYS A 1 386 ? 24.725 60.078 15.005 1.00 26.13 ? 398 LYS A O 1 ATOM 6034 C CB . LYS A 1 386 ? 25.678 62.658 13.442 1.00 40.53 ? 398 LYS A CB 1 ATOM 6035 C CG . LYS A 1 386 ? 25.657 63.362 12.090 1.00 45.80 ? 398 LYS A CG 1 ATOM 6036 C CD . LYS A 1 386 ? 26.994 64.001 11.768 1.00 60.47 ? 398 LYS A CD 1 ATOM 6037 C CE . LYS A 1 386 ? 26.952 64.678 10.405 1.00 68.13 ? 398 LYS A CE 1 ATOM 6038 N NZ . LYS A 1 386 ? 28.203 65.436 10.126 1.00 94.04 ? 398 LYS A NZ 1 ATOM 6039 H H . LYS A 1 386 ? 23.779 64.044 14.152 1.00 34.66 ? 398 LYS A H 1 ATOM 6040 H HA . LYS A 1 386 ? 23.945 61.603 13.163 1.00 36.15 ? 398 LYS A HA 1 ATOM 6041 H HB2 . LYS A 1 386 ? 26.004 63.290 14.102 1.00 48.63 ? 398 LYS A HB2 1 ATOM 6042 H HB3 . LYS A 1 386 ? 26.286 61.905 13.377 1.00 48.63 ? 398 LYS A HB3 1 ATOM 6043 H HG2 . LYS A 1 386 ? 25.456 62.715 11.397 1.00 54.96 ? 398 LYS A HG2 1 ATOM 6044 H HG3 . LYS A 1 386 ? 24.983 64.060 12.104 1.00 54.96 ? 398 LYS A HG3 1 ATOM 6045 H HD2 . LYS A 1 386 ? 27.200 64.672 12.438 1.00 72.56 ? 398 LYS A HD2 1 ATOM 6046 H HD3 . LYS A 1 386 ? 27.682 63.318 11.751 1.00 72.56 ? 398 LYS A HD3 1 ATOM 6047 H HE2 . LYS A 1 386 ? 26.847 64.003 9.717 1.00 81.75 ? 398 LYS A HE2 1 ATOM 6048 H HE3 . LYS A 1 386 ? 26.209 65.300 10.380 1.00 81.75 ? 398 LYS A HE3 1 ATOM 6049 H HZ1 . LYS A 1 386 ? 28.152 65.821 9.325 1.00 112.85 ? 398 LYS A HZ1 1 ATOM 6050 H HZ2 . LYS A 1 386 ? 28.320 66.067 10.743 1.00 112.85 ? 398 LYS A HZ2 1 ATOM 6051 H HZ3 . LYS A 1 386 ? 28.902 64.885 10.139 1.00 112.85 ? 398 LYS A HZ3 1 ATOM 6052 N N . GLN A 1 387 ? 24.255 61.846 16.309 1.00 24.60 ? 399 GLN A N 1 ATOM 6053 C CA . GLN A 1 387 ? 24.270 61.037 17.525 1.00 25.38 ? 399 GLN A CA 1 ATOM 6054 C C . GLN A 1 387 ? 23.104 60.055 17.526 1.00 22.28 ? 399 GLN A C 1 ATOM 6055 O O . GLN A 1 387 ? 23.277 58.877 17.866 1.00 21.19 ? 399 GLN A O 1 ATOM 6056 C CB . GLN A 1 387 ? 24.209 61.936 18.745 1.00 24.64 ? 399 GLN A CB 1 ATOM 6057 C CG . GLN A 1 387 ? 25.371 62.929 18.882 1.00 31.45 ? 399 GLN A CG 1 ATOM 6058 C CD . GLN A 1 387 ? 26.504 62.368 19.690 1.00 33.55 ? 399 GLN A CD 1 ATOM 6059 O OE1 . GLN A 1 387 ? 27.109 61.364 19.312 1.00 35.17 ? 399 GLN A OE1 1 ATOM 6060 N NE2 . GLN A 1 387 ? 26.789 62.999 20.832 1.00 36.81 ? 399 GLN A NE2 1 ATOM 6061 H H . GLN A 1 387 ? 24.128 62.687 16.436 1.00 29.52 ? 399 GLN A H 1 ATOM 6062 H HA . GLN A 1 387 ? 25.096 60.530 17.562 1.00 30.46 ? 399 GLN A HA 1 ATOM 6063 H HB2 . GLN A 1 387 ? 23.387 62.450 18.708 1.00 29.57 ? 399 GLN A HB2 1 ATOM 6064 H HB3 . GLN A 1 387 ? 24.207 61.378 19.539 1.00 29.57 ? 399 GLN A HB3 1 ATOM 6065 H HG2 . GLN A 1 387 ? 25.709 63.146 17.999 1.00 37.74 ? 399 GLN A HG2 1 ATOM 6066 H HG3 . GLN A 1 387 ? 25.052 63.732 19.324 1.00 37.74 ? 399 GLN A HG3 1 ATOM 6067 H HE21 . GLN A 1 387 ? 26.332 63.688 21.069 1.00 44.17 ? 399 GLN A HE21 1 ATOM 6068 H HE22 . GLN A 1 387 ? 27.429 62.716 21.331 1.00 44.17 ? 399 GLN A HE22 1 ATOM 6069 N N . PHE A 1 388 ? 21.909 60.522 17.138 1.00 21.46 ? 400 PHE A N 1 ATOM 6070 C CA . PHE A 1 388 ? 20.762 59.613 17.101 1.00 20.49 ? 400 PHE A CA 1 ATOM 6071 C C . PHE A 1 388 ? 20.942 58.538 16.040 1.00 19.65 ? 400 PHE A C 1 ATOM 6072 O O . PHE A 1 388 ? 20.589 57.374 16.257 1.00 20.41 ? 400 PHE A O 1 ATOM 6073 C CB . PHE A 1 388 ? 19.442 60.349 16.860 1.00 22.36 ? 400 PHE A CB 1 ATOM 6074 C CG . PHE A 1 388 ? 18.285 59.400 16.819 1.00 22.64 ? 400 PHE A CG 1 ATOM 6075 C CD1 . PHE A 1 388 ? 17.852 58.798 17.980 1.00 22.00 ? 400 PHE A CD1 1 ATOM 6076 C CD2 . PHE A 1 388 ? 17.732 59.003 15.624 1.00 20.64 ? 400 PHE A CD2 1 ATOM 6077 C CE1 . PHE A 1 388 ? 16.835 57.854 17.956 1.00 20.58 ? 400 PHE A CE1 1 ATOM 6078 C CE2 . PHE A 1 388 ? 16.706 58.075 15.595 1.00 24.26 ? 400 PHE A CE2 1 ATOM 6079 C CZ . PHE A 1 388 ? 16.268 57.509 16.773 1.00 21.38 ? 400 PHE A CZ 1 ATOM 6080 H H . PHE A 1 388 ? 21.743 61.332 16.901 1.00 25.76 ? 400 PHE A H 1 ATOM 6081 H HA . PHE A 1 388 ? 20.695 59.168 17.960 1.00 24.59 ? 400 PHE A HA 1 ATOM 6082 H HB2 . PHE A 1 388 ? 19.291 60.981 17.580 1.00 26.83 ? 400 PHE A HB2 1 ATOM 6083 H HB3 . PHE A 1 388 ? 19.485 60.812 16.009 1.00 26.83 ? 400 PHE A HB3 1 ATOM 6084 H HD1 . PHE A 1 388 ? 18.240 59.033 18.792 1.00 26.40 ? 400 PHE A HD1 1 ATOM 6085 H HD2 . PHE A 1 388 ? 18.028 59.387 14.830 1.00 24.77 ? 400 PHE A HD2 1 ATOM 6086 H HE1 . PHE A 1 388 ? 16.530 57.476 18.749 1.00 24.70 ? 400 PHE A HE1 1 ATOM 6087 H HE2 . PHE A 1 388 ? 16.317 57.832 14.785 1.00 29.11 ? 400 PHE A HE2 1 ATOM 6088 H HZ . PHE A 1 388 ? 15.577 56.887 16.757 1.00 25.66 ? 400 PHE A HZ 1 ATOM 6089 N N . LEU A 1 389 ? 21.488 58.890 14.875 1.00 23.44 ? 401 LEU A N 1 ATOM 6090 C CA . LEU A 1 389 ? 21.725 57.876 13.855 1.00 20.52 ? 401 LEU A CA 1 ATOM 6091 C C . LEU A 1 389 ? 22.625 56.773 14.376 1.00 18.67 ? 401 LEU A C 1 ATOM 6092 O O . LEU A 1 389 ? 22.407 55.584 14.092 1.00 21.81 ? 401 LEU A O 1 ATOM 6093 C CB . LEU A 1 389 ? 22.340 58.526 12.599 1.00 27.67 ? 401 LEU A CB 1 ATOM 6094 C CG . LEU A 1 389 ? 21.392 59.521 11.926 1.00 35.68 ? 401 LEU A CG 1 ATOM 6095 C CD1 . LEU A 1 389 ? 22.135 60.321 10.864 1.00 40.66 ? 401 LEU A CD1 1 ATOM 6096 C CD2 . LEU A 1 389 ? 20.179 58.795 11.315 1.00 40.03 ? 401 LEU A CD2 1 ATOM 6097 H H . LEU A 1 389 ? 21.724 59.688 14.657 1.00 28.13 ? 401 LEU A H 1 ATOM 6098 H HA . LEU A 1 389 ? 20.878 57.478 13.603 1.00 24.62 ? 401 LEU A HA 1 ATOM 6099 H HB2 . LEU A 1 389 ? 23.146 59.002 12.852 1.00 33.20 ? 401 LEU A HB2 1 ATOM 6100 H HB3 . LEU A 1 389 ? 22.552 57.831 11.956 1.00 33.20 ? 401 LEU A HB3 1 ATOM 6101 H HG . LEU A 1 389 ? 21.062 60.144 12.594 1.00 42.82 ? 401 LEU A HG 1 ATOM 6102 H HD11 . LEU A 1 389 ? 21.518 60.945 10.451 1.00 48.79 ? 401 LEU A HD11 1 ATOM 6103 H HD12 . LEU A 1 389 ? 22.863 60.805 11.285 1.00 48.79 ? 401 LEU A HD12 1 ATOM 6104 H HD13 . LEU A 1 389 ? 22.485 59.710 10.197 1.00 48.79 ? 401 LEU A HD13 1 ATOM 6105 H HD21 . LEU A 1 389 ? 19.598 59.449 10.896 1.00 48.04 ? 401 LEU A HD21 1 ATOM 6106 H HD22 . LEU A 1 389 ? 20.493 58.160 10.652 1.00 48.04 ? 401 LEU A HD22 1 ATOM 6107 H HD23 . LEU A 1 389 ? 19.702 58.329 12.019 1.00 48.04 ? 401 LEU A HD23 1 ATOM 6108 N N . LYS A 1 390 ? 23.665 57.147 15.123 1.00 21.21 ? 402 LYS A N 1 ATOM 6109 C CA . LYS A 1 390 ? 24.542 56.157 15.720 1.00 20.34 ? 402 LYS A CA 1 ATOM 6110 C C . LYS A 1 390 ? 23.785 55.298 16.728 1.00 19.10 ? 402 LYS A C 1 ATOM 6111 O O . LYS A 1 390 ? 23.889 54.066 16.720 1.00 20.11 ? 402 LYS A O 1 ATOM 6112 C CB . LYS A 1 390 ? 25.717 56.867 16.381 1.00 24.07 ? 402 LYS A CB 1 ATOM 6113 C CG . LYS A 1 390 ? 26.639 55.937 17.112 1.00 26.94 ? 402 LYS A CG 1 ATOM 6114 C CD . LYS A 1 390 ? 27.811 56.705 17.739 1.00 32.13 ? 402 LYS A CD 1 ATOM 6115 C CE . LYS A 1 390 ? 28.703 57.309 16.672 1.00 33.56 ? 402 LYS A CE 1 ATOM 6116 N NZ . LYS A 1 390 ? 29.937 57.916 17.267 1.00 33.90 ? 402 LYS A NZ 1 ATOM 6117 H H . LYS A 1 390 ? 23.877 57.963 15.295 1.00 25.45 ? 402 LYS A H 1 ATOM 6118 H HA . LYS A 1 390 ? 24.889 55.576 15.026 1.00 24.41 ? 402 LYS A HA 1 ATOM 6119 H HB2 . LYS A 1 390 ? 26.234 57.321 15.697 1.00 28.89 ? 402 LYS A HB2 1 ATOM 6120 H HB3 . LYS A 1 390 ? 25.376 57.511 17.020 1.00 28.89 ? 402 LYS A HB3 1 ATOM 6121 H HG2 . LYS A 1 390 ? 26.151 55.492 17.822 1.00 32.33 ? 402 LYS A HG2 1 ATOM 6122 H HG3 . LYS A 1 390 ? 26.999 55.285 16.490 1.00 32.33 ? 402 LYS A HG3 1 ATOM 6123 H HD2 . LYS A 1 390 ? 27.465 57.424 18.291 1.00 38.56 ? 402 LYS A HD2 1 ATOM 6124 H HD3 . LYS A 1 390 ? 28.344 56.097 18.274 1.00 38.56 ? 402 LYS A HD3 1 ATOM 6125 H HE2 . LYS A 1 390 ? 28.975 56.615 16.051 1.00 40.28 ? 402 LYS A HE2 1 ATOM 6126 H HE3 . LYS A 1 390 ? 28.217 58.006 16.204 1.00 40.28 ? 402 LYS A HE3 1 ATOM 6127 H HZ1 . LYS A 1 390 ? 30.445 58.264 16.625 1.00 40.68 ? 402 LYS A HZ1 1 ATOM 6128 H HZ2 . LYS A 1 390 ? 29.713 58.560 17.839 1.00 40.68 ? 402 LYS A HZ2 1 ATOM 6129 H HZ3 . LYS A 1 390 ? 30.403 57.294 17.700 1.00 40.68 ? 402 LYS A HZ3 1 ATOM 6130 N N . TYR A 1 391 ? 22.984 55.942 17.565 1.00 17.76 ? 403 TYR A N 1 ATOM 6131 C CA . TYR A 1 391 ? 22.175 55.230 18.550 1.00 20.49 ? 403 TYR A CA 1 ATOM 6132 C C . TYR A 1 391 ? 21.232 54.238 17.886 1.00 16.76 ? 403 TYR A C 1 ATOM 6133 O O . TYR A 1 391 ? 21.070 53.113 18.361 1.00 16.87 ? 403 TYR A O 1 ATOM 6134 C CB . TYR A 1 391 ? 21.399 56.261 19.364 1.00 20.34 ? 403 TYR A CB 1 ATOM 6135 C CG . TYR A 1 391 ? 20.433 55.673 20.383 1.00 17.02 ? 403 TYR A CG 1 ATOM 6136 C CD1 . TYR A 1 391 ? 20.859 55.427 21.675 1.00 15.73 ? 403 TYR A CD1 1 ATOM 6137 C CD2 . TYR A 1 391 ? 19.122 55.368 20.048 1.00 17.77 ? 403 TYR A CD2 1 ATOM 6138 C CE1 . TYR A 1 391 ? 20.001 54.901 22.619 1.00 15.43 ? 403 TYR A CE1 1 ATOM 6139 C CE2 . TYR A 1 391 ? 18.235 54.831 20.996 1.00 14.88 ? 403 TYR A CE2 1 ATOM 6140 C CZ . TYR A 1 391 ? 18.700 54.592 22.274 1.00 15.41 ? 403 TYR A CZ 1 ATOM 6141 O OH . TYR A 1 391 ? 17.859 54.100 23.234 1.00 16.28 ? 403 TYR A OH 1 ATOM 6142 H H . TYR A 1 391 ? 22.888 56.796 17.585 1.00 21.32 ? 403 TYR A H 1 ATOM 6143 H HA . TYR A 1 391 ? 22.758 54.741 19.151 1.00 24.59 ? 403 TYR A HA 1 ATOM 6144 H HB2 . TYR A 1 391 ? 22.032 56.815 19.846 1.00 24.40 ? 403 TYR A HB2 1 ATOM 6145 H HB3 . TYR A 1 391 ? 20.883 56.812 18.755 1.00 24.40 ? 403 TYR A HB3 1 ATOM 6146 H HD1 . TYR A 1 391 ? 21.735 55.627 21.913 1.00 18.88 ? 403 TYR A HD1 1 ATOM 6147 H HD2 . TYR A 1 391 ? 18.823 55.528 19.182 1.00 21.32 ? 403 TYR A HD2 1 ATOM 6148 H HE1 . TYR A 1 391 ? 20.301 54.746 23.485 1.00 18.51 ? 403 TYR A HE1 1 ATOM 6149 H HE2 . TYR A 1 391 ? 17.356 54.633 20.766 1.00 17.86 ? 403 TYR A HE2 1 ATOM 6150 H HH . TYR A 1 391 ? 17.101 53.952 22.903 1.00 19.53 ? 403 TYR A HH 1 ATOM 6151 N N . TYR A 1 392 ? 20.576 54.640 16.789 1.00 17.44 ? 404 TYR A N 1 ATOM 6152 C CA . TYR A 1 392 ? 19.662 53.725 16.108 1.00 17.55 ? 404 TYR A CA 1 ATOM 6153 C C . TYR A 1 392 ? 20.422 52.530 15.502 1.00 17.57 ? 404 TYR A C 1 ATOM 6154 O O . TYR A 1 392 ? 19.907 51.407 15.467 1.00 18.43 ? 404 TYR A O 1 ATOM 6155 C CB . TYR A 1 392 ? 18.860 54.493 15.053 1.00 18.44 ? 404 TYR A CB 1 ATOM 6156 C CG . TYR A 1 392 ? 17.725 53.686 14.506 1.00 21.91 ? 404 TYR A CG 1 ATOM 6157 C CD1 . TYR A 1 392 ? 16.638 53.356 15.306 1.00 23.08 ? 404 TYR A CD1 1 ATOM 6158 C CD2 . TYR A 1 392 ? 17.746 53.209 13.204 1.00 23.22 ? 404 TYR A CD2 1 ATOM 6159 C CE1 . TYR A 1 392 ? 15.597 52.572 14.815 1.00 21.44 ? 404 TYR A CE1 1 ATOM 6160 C CE2 . TYR A 1 392 ? 16.700 52.423 12.716 1.00 20.22 ? 404 TYR A CE2 1 ATOM 6161 C CZ . TYR A 1 392 ? 15.632 52.124 13.524 1.00 26.28 ? 404 TYR A CZ 1 ATOM 6162 O OH . TYR A 1 392 ? 14.595 51.348 13.069 1.00 27.59 ? 404 TYR A OH 1 ATOM 6163 H H . TYR A 1 392 ? 20.642 55.419 16.430 1.00 20.92 ? 404 TYR A H 1 ATOM 6164 H HA . TYR A 1 392 ? 19.033 53.374 16.757 1.00 21.06 ? 404 TYR A HA 1 ATOM 6165 H HB2 . TYR A 1 392 ? 18.493 55.296 15.455 1.00 22.13 ? 404 TYR A HB2 1 ATOM 6166 H HB3 . TYR A 1 392 ? 19.446 54.727 14.316 1.00 22.13 ? 404 TYR A HB3 1 ATOM 6167 H HD1 . TYR A 1 392 ? 16.608 53.657 16.185 1.00 27.69 ? 404 TYR A HD1 1 ATOM 6168 H HD2 . TYR A 1 392 ? 18.469 53.408 12.653 1.00 27.86 ? 404 TYR A HD2 1 ATOM 6169 H HE1 . TYR A 1 392 ? 14.873 52.365 15.361 1.00 25.73 ? 404 TYR A HE1 1 ATOM 6170 H HE2 . TYR A 1 392 ? 16.721 52.113 11.839 1.00 24.27 ? 404 TYR A HE2 1 ATOM 6171 H HH . TYR A 1 392 ? 14.727 51.134 12.267 1.00 33.11 ? 404 TYR A HH 1 ATOM 6172 N N . HIS A 1 393 ? 21.656 52.735 15.040 1.00 18.69 ? 405 HIS A N 1 ATOM 6173 C CA A HIS A 1 393 ? 22.444 51.609 14.556 0.49 20.46 ? 405 HIS A CA 1 ATOM 6174 C CA B HIS A 1 393 ? 22.473 51.622 14.560 0.51 20.45 ? 405 HIS A CA 1 ATOM 6175 C C . HIS A 1 393 ? 22.809 50.652 15.693 1.00 17.13 ? 405 HIS A C 1 ATOM 6176 O O . HIS A 1 393 ? 22.759 49.432 15.517 1.00 18.53 ? 405 HIS A O 1 ATOM 6177 C CB A HIS A 1 393 ? 23.669 52.129 13.807 0.49 23.17 ? 405 HIS A CB 1 ATOM 6178 C CB B HIS A 1 393 ? 23.752 52.194 13.929 0.51 22.97 ? 405 HIS A CB 1 ATOM 6179 C CG A HIS A 1 393 ? 23.326 52.695 12.459 0.49 29.90 ? 405 HIS A CG 1 ATOM 6180 C CG B HIS A 1 393 ? 24.626 51.188 13.244 0.51 28.13 ? 405 HIS A CG 1 ATOM 6181 N ND1 A HIS A 1 393 ? 24.161 53.548 11.769 0.49 40.95 ? 405 HIS A ND1 1 ATOM 6182 N ND1 B HIS A 1 393 ? 26.001 51.294 13.229 0.51 32.48 ? 405 HIS A ND1 1 ATOM 6183 C CD2 A HIS A 1 393 ? 22.228 52.532 11.679 0.49 31.76 ? 405 HIS A CD2 1 ATOM 6184 C CD2 B HIS A 1 393 ? 24.326 50.085 12.518 0.51 28.78 ? 405 HIS A CD2 1 ATOM 6185 C CE1 A HIS A 1 393 ? 23.596 53.882 10.622 0.49 32.82 ? 405 HIS A CE1 1 ATOM 6186 C CE1 B HIS A 1 393 ? 26.510 50.288 12.540 0.51 28.88 ? 405 HIS A CE1 1 ATOM 6187 N NE2 A HIS A 1 393 ? 22.417 53.289 10.549 0.49 37.12 ? 405 HIS A NE2 1 ATOM 6188 N NE2 B HIS A 1 393 ? 25.515 49.542 12.095 0.51 31.78 ? 405 HIS A NE2 1 ATOM 6189 H H . HIS A 1 393 ? 22.047 53.500 14.995 1.00 22.43 ? 405 HIS A H 1 ATOM 6190 H HA . HIS A 1 393 ? 21.946 51.123 13.898 1.00 24.54 ? 405 HIS A HA 1 ATOM 6191 H HB2 A HIS A 1 393 ? 24.084 52.832 14.331 0.49 27.81 ? 405 HIS A HB2 1 ATOM 6192 H HB2 B HIS A 1 393 ? 23.500 52.860 13.270 0.51 27.57 ? 405 HIS A HB2 1 ATOM 6193 H HB3 A HIS A 1 393 ? 24.294 51.399 13.677 0.49 27.81 ? 405 HIS A HB3 1 ATOM 6194 H HB3 B HIS A 1 393 ? 24.280 52.612 14.628 0.51 27.57 ? 405 HIS A HB3 1 ATOM 6195 H HD1 A HIS A 1 393 ? 24.932 53.817 12.041 0.49 49.14 ? 405 HIS A HD1 1 ATOM 6196 H HD2 A HIS A 1 393 ? 21.481 52.014 11.878 0.49 38.11 ? 405 HIS A HD2 1 ATOM 6197 H HD2 B HIS A 1 393 ? 23.475 49.754 12.343 0.51 34.53 ? 405 HIS A HD2 1 ATOM 6198 H HE1 A HIS A 1 393 ? 23.961 54.448 9.981 0.49 39.38 ? 405 HIS A HE1 1 ATOM 6199 H HE1 B HIS A 1 393 ? 27.415 50.133 12.391 0.51 34.65 ? 405 HIS A HE1 1 ATOM 6200 H HE2 B HIS A 1 393 ? 25.599 48.828 11.623 0.51 38.13 ? 405 HIS A HE2 1 ATOM 6201 N N . TYR A 1 394 ? 23.119 51.181 16.867 1.00 18.17 ? 406 TYR A N 1 ATOM 6202 C CA . TYR A 1 394 ? 23.473 50.372 18.026 1.00 16.88 ? 406 TYR A CA 1 ATOM 6203 C C . TYR A 1 394 ? 22.250 49.721 18.663 1.00 16.73 ? 406 TYR A C 1 ATOM 6204 O O . TYR A 1 394 ? 22.380 48.689 19.328 1.00 16.61 ? 406 TYR A O 1 ATOM 6205 C CB . TYR A 1 394 ? 24.209 51.244 19.054 1.00 17.22 ? 406 TYR A CB 1 ATOM 6206 C CG . TYR A 1 394 ? 25.611 51.697 18.638 1.00 18.09 ? 406 TYR A CG 1 ATOM 6207 C CD1 . TYR A 1 394 ? 26.352 50.995 17.678 1.00 23.00 ? 406 TYR A CD1 1 ATOM 6208 C CD2 . TYR A 1 394 ? 26.206 52.785 19.241 1.00 21.59 ? 406 TYR A CD2 1 ATOM 6209 C CE1 . TYR A 1 394 ? 27.645 51.419 17.315 1.00 27.60 ? 406 TYR A CE1 1 ATOM 6210 C CE2 . TYR A 1 394 ? 27.499 53.200 18.886 1.00 21.33 ? 406 TYR A CE2 1 ATOM 6211 C CZ . TYR A 1 394 ? 28.197 52.514 17.941 1.00 25.46 ? 406 TYR A CZ 1 ATOM 6212 O OH . TYR A 1 394 ? 29.469 52.962 17.639 1.00 29.92 ? 406 TYR A OH 1 ATOM 6213 H H . TYR A 1 394 ? 23.133 52.027 17.023 1.00 21.80 ? 406 TYR A H 1 ATOM 6214 H HA . TYR A 1 394 ? 24.076 49.666 17.745 1.00 20.26 ? 406 TYR A HA 1 ATOM 6215 H HB2 . TYR A 1 394 ? 23.680 52.041 19.216 1.00 20.67 ? 406 TYR A HB2 1 ATOM 6216 H HB3 . TYR A 1 394 ? 24.297 50.740 19.878 1.00 20.67 ? 406 TYR A HB3 1 ATOM 6217 H HD1 . TYR A 1 394 ? 25.976 50.255 17.258 1.00 27.60 ? 406 TYR A HD1 1 ATOM 6218 H HD2 . TYR A 1 394 ? 25.737 53.259 19.889 1.00 25.90 ? 406 TYR A HD2 1 ATOM 6219 H HE1 . TYR A 1 394 ? 28.130 50.951 16.674 1.00 33.12 ? 406 TYR A HE1 1 ATOM 6220 H HE2 . TYR A 1 394 ? 27.880 53.940 19.301 1.00 25.59 ? 406 TYR A HE2 1 ATOM 6221 H HH . TYR A 1 394 ? 29.812 52.475 17.047 1.00 35.91 ? 406 TYR A HH 1 ATOM 6222 N N . TYR A 1 395 ? 21.064 50.280 18.428 1.00 14.12 ? 407 TYR A N 1 ATOM 6223 C CA . TYR A 1 395 ? 19.828 49.716 18.979 1.00 15.78 ? 407 TYR A CA 1 ATOM 6224 C C . TYR A 1 395 ? 19.649 48.259 18.550 1.00 16.20 ? 407 TYR A C 1 ATOM 6225 O O . TYR A 1 395 ? 19.282 47.404 19.361 1.00 15.36 ? 407 TYR A O 1 ATOM 6226 C CB . TYR A 1 395 ? 18.666 50.625 18.539 1.00 17.50 ? 407 TYR A CB 1 ATOM 6227 C CG . TYR A 1 395 ? 17.271 50.127 18.796 1.00 15.63 ? 407 TYR A CG 1 ATOM 6228 C CD1 . TYR A 1 395 ? 16.728 50.137 20.085 1.00 14.23 ? 407 TYR A CD1 1 ATOM 6229 C CD2 . TYR A 1 395 ? 16.449 49.707 17.752 1.00 19.00 ? 407 TYR A CD2 1 ATOM 6230 C CE1 . TYR A 1 395 ? 15.420 49.699 20.322 1.00 13.90 ? 407 TYR A CE1 1 ATOM 6231 C CE2 . TYR A 1 395 ? 15.141 49.264 17.989 1.00 17.23 ? 407 TYR A CE2 1 ATOM 6232 C CZ . TYR A 1 395 ? 14.634 49.270 19.265 1.00 15.01 ? 407 TYR A CZ 1 ATOM 6233 O OH . TYR A 1 395 ? 13.353 48.828 19.476 1.00 17.41 ? 407 TYR A OH 1 ATOM 6234 H H . TYR A 1 395 ? 20.946 50.987 17.953 1.00 16.94 ? 407 TYR A H 1 ATOM 6235 H HA . TYR A 1 395 ? 19.875 49.738 19.948 1.00 18.94 ? 407 TYR A HA 1 ATOM 6236 H HB2 . TYR A 1 395 ? 18.756 51.473 19.001 1.00 21.00 ? 407 TYR A HB2 1 ATOM 6237 H HB3 . TYR A 1 395 ? 18.744 50.773 17.583 1.00 21.00 ? 407 TYR A HB3 1 ATOM 6238 H HD1 . TYR A 1 395 ? 17.250 50.424 20.799 1.00 17.07 ? 407 TYR A HD1 1 ATOM 6239 H HD2 . TYR A 1 395 ? 16.782 49.699 16.884 1.00 22.80 ? 407 TYR A HD2 1 ATOM 6240 H HE1 . TYR A 1 395 ? 15.079 49.698 21.187 1.00 16.68 ? 407 TYR A HE1 1 ATOM 6241 H HE2 . TYR A 1 395 ? 14.613 48.975 17.280 1.00 20.67 ? 407 TYR A HE2 1 ATOM 6242 H HH . TYR A 1 395 ? 13.166 48.868 20.295 1.00 20.90 ? 407 TYR A HH 1 ATOM 6243 N N . PHE A 1 396 ? 20.033 47.933 17.308 1.00 15.95 ? 408 PHE A N 1 ATOM 6244 C CA . PHE A 1 396 ? 20.010 46.571 16.779 1.00 16.24 ? 408 PHE A CA 1 ATOM 6245 C C . PHE A 1 396 ? 21.376 45.881 16.895 1.00 19.08 ? 408 PHE A C 1 ATOM 6246 O O . PHE A 1 396 ? 21.609 44.860 16.240 1.00 19.07 ? 408 PHE A O 1 ATOM 6247 C CB . PHE A 1 396 ? 19.588 46.560 15.298 1.00 17.31 ? 408 PHE A CB 1 ATOM 6248 C CG . PHE A 1 396 ? 18.209 47.141 15.020 1.00 18.20 ? 408 PHE A CG 1 ATOM 6249 C CD1 . PHE A 1 396 ? 17.075 46.463 15.398 1.00 15.22 ? 408 PHE A CD1 1 ATOM 6250 C CD2 . PHE A 1 396 ? 18.072 48.340 14.358 1.00 21.54 ? 408 PHE A CD2 1 ATOM 6251 C CE1 . PHE A 1 396 ? 15.795 46.971 15.122 1.00 19.63 ? 408 PHE A CE1 1 ATOM 6252 C CE2 . PHE A 1 396 ? 16.822 48.859 14.088 1.00 25.71 ? 408 PHE A CE2 1 ATOM 6253 C CZ . PHE A 1 396 ? 15.689 48.182 14.472 1.00 18.41 ? 408 PHE A CZ 1 ATOM 6254 H H . PHE A 1 396 ? 20.321 48.509 16.738 1.00 19.14 ? 408 PHE A H 1 ATOM 6255 H HA . PHE A 1 396 ? 19.365 46.048 17.279 1.00 19.48 ? 408 PHE A HA 1 ATOM 6256 H HB2 . PHE A 1 396 ? 20.232 47.078 14.790 1.00 20.77 ? 408 PHE A HB2 1 ATOM 6257 H HB3 . PHE A 1 396 ? 19.588 45.642 14.984 1.00 20.77 ? 408 PHE A HB3 1 ATOM 6258 H HD1 . PHE A 1 396 ? 17.157 45.646 15.836 1.00 18.27 ? 408 PHE A HD1 1 ATOM 6259 H HD2 . PHE A 1 396 ? 18.831 48.808 14.093 1.00 25.85 ? 408 PHE A HD2 1 ATOM 6260 H HE1 . PHE A 1 396 ? 15.033 46.508 15.390 1.00 23.56 ? 408 PHE A HE1 1 ATOM 6261 H HE2 . PHE A 1 396 ? 16.746 49.673 13.645 1.00 30.85 ? 408 PHE A HE2 1 ATOM 6262 H HZ . PHE A 1 396 ? 14.850 48.538 14.286 1.00 22.09 ? 408 PHE A HZ 1 ATOM 6263 N N . VAL A 1 397 ? 22.273 46.432 17.694 1.00 16.68 ? 409 VAL A N 1 ATOM 6264 C CA . VAL A 1 397 ? 23.616 45.900 17.896 1.00 16.55 ? 409 VAL A CA 1 ATOM 6265 C C . VAL A 1 397 ? 24.297 45.758 16.531 1.00 17.70 ? 409 VAL A C 1 ATOM 6266 O O . VAL A 1 397 ? 24.894 44.722 16.221 1.00 17.50 ? 409 VAL A O 1 ATOM 6267 C CB . VAL A 1 397 ? 23.593 44.571 18.663 1.00 15.24 ? 409 VAL A CB 1 ATOM 6268 C CG1 . VAL A 1 397 ? 24.989 44.270 19.263 1.00 17.89 ? 409 VAL A CG1 1 ATOM 6269 C CG2 . VAL A 1 397 ? 22.562 44.640 19.811 1.00 17.86 ? 409 VAL A CG2 1 ATOM 6270 H H . VAL A 1 397 ? 22.122 47.145 18.151 1.00 20.02 ? 409 VAL A H 1 ATOM 6271 H HA . VAL A 1 397 ? 24.129 46.535 18.419 1.00 19.86 ? 409 VAL A HA 1 ATOM 6272 H HB . VAL A 1 397 ? 23.347 43.849 18.064 1.00 18.29 ? 409 VAL A HB 1 ATOM 6273 H HG11 . VAL A 1 397 ? 24.951 43.428 19.742 1.00 21.46 ? 409 VAL A HG11 1 ATOM 6274 H HG12 . VAL A 1 397 ? 25.636 44.213 18.543 1.00 21.46 ? 409 VAL A HG12 1 ATOM 6275 H HG13 . VAL A 1 397 ? 25.231 44.987 19.870 1.00 21.46 ? 409 VAL A HG13 1 ATOM 6276 H HG21 . VAL A 1 397 ? 22.560 43.794 20.285 1.00 21.43 ? 409 VAL A HG21 1 ATOM 6277 H HG22 . VAL A 1 397 ? 22.810 45.357 20.415 1.00 21.43 ? 409 VAL A HG22 1 ATOM 6278 H HG23 . VAL A 1 397 ? 21.683 44.812 19.437 1.00 21.43 ? 409 VAL A HG23 1 ATOM 6279 N N . SER A 1 398 ? 24.205 46.810 15.728 1.00 18.52 ? 410 SER A N 1 ATOM 6280 C CA . SER A 1 398 ? 24.920 46.920 14.450 1.00 19.86 ? 410 SER A CA 1 ATOM 6281 C C . SER A 1 398 ? 24.498 45.845 13.446 1.00 26.99 ? 410 SER A C 1 ATOM 6282 O O . SER A 1 398 ? 25.232 45.547 12.489 1.00 23.91 ? 410 SER A O 1 ATOM 6283 C CB . SER A 1 398 ? 26.436 46.891 14.689 1.00 21.18 ? 410 SER A CB 1 ATOM 6284 O OG . SER A 1 398 ? 26.866 48.057 15.343 1.00 20.68 ? 410 SER A OG 1 ATOM 6285 H H . SER A 1 398 ? 23.721 47.498 15.904 1.00 22.23 ? 410 SER A H 1 ATOM 6286 H HA . SER A 1 398 ? 24.707 47.780 14.057 1.00 23.83 ? 410 SER A HA 1 ATOM 6287 H HB2 . SER A 1 398 ? 26.654 46.122 15.239 1.00 25.41 ? 410 SER A HB2 1 ATOM 6288 H HB3 . SER A 1 398 ? 26.888 46.825 13.833 1.00 25.41 ? 410 SER A HB3 1 ATOM 6289 H HG . SER A 1 398 ? 26.482 48.127 16.087 1.00 24.81 ? 410 SER A HG 1 ATOM 6290 N N . TYR A 1 399 ? 23.285 45.303 13.591 1.00 20.70 ? 411 TYR A N 1 ATOM 6291 C CA . TYR A 1 399 ? 22.782 44.303 12.654 1.00 23.83 ? 411 TYR A CA 1 ATOM 6292 C C . TYR A 1 399 ? 22.733 44.826 11.231 1.00 25.65 ? 411 TYR A C 1 ATOM 6293 O O . TYR A 1 399 ? 23.027 44.084 10.286 1.00 26.26 ? 411 TYR A O 1 ATOM 6294 C CB . TYR A 1 399 ? 21.387 43.853 13.062 1.00 19.84 ? 411 TYR A CB 1 ATOM 6295 C CG . TYR A 1 399 ? 20.802 42.809 12.157 1.00 19.09 ? 411 TYR A CG 1 ATOM 6296 C CD1 . TYR A 1 399 ? 21.296 41.514 12.147 1.00 26.01 ? 411 TYR A CD1 1 ATOM 6297 C CD2 . TYR A 1 399 ? 19.736 43.123 11.328 1.00 26.07 ? 411 TYR A CD2 1 ATOM 6298 C CE1 . TYR A 1 399 ? 20.770 40.558 11.300 1.00 28.14 ? 411 TYR A CE1 1 ATOM 6299 C CE2 . TYR A 1 399 ? 19.202 42.186 10.489 1.00 23.26 ? 411 TYR A CE2 1 ATOM 6300 C CZ . TYR A 1 399 ? 19.728 40.903 10.479 1.00 30.91 ? 411 TYR A CZ 1 ATOM 6301 O OH . TYR A 1 399 ? 19.191 39.964 9.647 1.00 28.87 ? 411 TYR A OH 1 ATOM 6302 H H . TYR A 1 399 ? 22.737 45.500 14.223 1.00 24.84 ? 411 TYR A H 1 ATOM 6303 H HA . TYR A 1 399 ? 23.367 43.529 12.671 1.00 28.59 ? 411 TYR A HA 1 ATOM 6304 H HB2 . TYR A 1 399 ? 21.428 43.481 13.957 1.00 23.81 ? 411 TYR A HB2 1 ATOM 6305 H HB3 . TYR A 1 399 ? 20.795 44.622 13.051 1.00 23.81 ? 411 TYR A HB3 1 ATOM 6306 H HD1 . TYR A 1 399 ? 22.013 41.293 12.697 1.00 31.21 ? 411 TYR A HD1 1 ATOM 6307 H HD2 . TYR A 1 399 ? 19.396 43.988 11.327 1.00 31.28 ? 411 TYR A HD2 1 ATOM 6308 H HE1 . TYR A 1 399 ? 21.112 39.693 11.292 1.00 33.77 ? 411 TYR A HE1 1 ATOM 6309 H HE2 . TYR A 1 399 ? 18.493 42.407 9.928 1.00 27.91 ? 411 TYR A HE2 1 ATOM 6310 H HH . TYR A 1 399 ? 18.564 40.300 9.200 1.00 34.64 ? 411 TYR A HH 1 ATOM 6311 N N . ASP A 1 400 ? 22.304 46.075 11.052 1.00 22.41 ? 412 ASP A N 1 ATOM 6312 C CA . ASP A 1 400 ? 21.992 46.599 9.724 1.00 24.70 ? 412 ASP A CA 1 ATOM 6313 C C . ASP A 1 400 ? 22.402 48.068 9.658 1.00 31.20 ? 412 ASP A C 1 ATOM 6314 O O . ASP A 1 400 ? 21.656 48.952 10.086 1.00 31.16 ? 412 ASP A O 1 ATOM 6315 C CB . ASP A 1 400 ? 20.518 46.421 9.424 1.00 29.91 ? 412 ASP A CB 1 ATOM 6316 C CG . ASP A 1 400 ? 20.166 46.816 8.011 1.00 40.55 ? 412 ASP A CG 1 ATOM 6317 O OD1 . ASP A 1 400 ? 21.101 47.092 7.233 1.00 31.08 ? 412 ASP A OD1 1 ATOM 6318 O OD2 . ASP A 1 400 ? 18.964 46.843 7.692 1.00 44.42 ? 412 ASP A OD2 1 ATOM 6319 H H . ASP A 1 400 ? 22.186 46.642 11.688 1.00 26.90 ? 412 ASP A H 1 ATOM 6320 H HA . ASP A 1 400 ? 22.500 46.110 9.058 1.00 29.64 ? 412 ASP A HA 1 ATOM 6321 H HB2 . ASP A 1 400 ? 20.280 45.488 9.544 1.00 35.89 ? 412 ASP A HB2 1 ATOM 6322 H HB3 . ASP A 1 400 ? 20.002 46.976 10.030 1.00 35.89 ? 412 ASP A HB3 1 ATOM 6323 N N . SER A 1 401 ? 23.577 48.333 9.083 1.00 33.05 ? 413 SER A N 1 ATOM 6324 C CA . SER A 1 401 ? 24.042 49.712 8.958 1.00 34.44 ? 413 SER A CA 1 ATOM 6325 C C . SER A 1 401 ? 23.138 50.557 8.070 1.00 39.24 ? 413 SER A C 1 ATOM 6326 O O . SER A 1 401 ? 23.167 51.789 8.167 1.00 55.36 ? 413 SER A O 1 ATOM 6327 C CB . SER A 1 401 ? 25.456 49.748 8.394 1.00 44.41 ? 413 SER A CB 1 ATOM 6328 O OG . SER A 1 401 ? 25.481 49.156 7.111 1.00 54.28 ? 413 SER A OG 1 ATOM 6329 H H . SER A 1 401 ? 24.114 47.742 8.764 1.00 39.66 ? 413 SER A H 1 ATOM 6330 H HA . SER A 1 401 ? 24.060 50.119 9.838 1.00 41.32 ? 413 SER A HA 1 ATOM 6331 H HB2 . SER A 1 401 ? 25.748 50.671 8.324 1.00 53.29 ? 413 SER A HB2 1 ATOM 6332 H HB3 . SER A 1 401 ? 26.047 49.255 8.984 1.00 53.29 ? 413 SER A HB3 1 ATOM 6333 H HG . SER A 1 401 ? 26.262 49.176 6.800 1.00 65.13 ? 413 SER A HG 1 ATOM 6334 N N . SER A 1 402 ? 22.334 49.939 7.217 1.00 37.19 ? 414 SER A N 1 ATOM 6335 C CA . SER A 1 402 ? 21.467 50.698 6.334 1.00 43.68 ? 414 SER A CA 1 ATOM 6336 C C . SER A 1 402 ? 20.076 50.901 6.914 1.00 47.98 ? 414 SER A C 1 ATOM 6337 O O . SER A 1 402 ? 19.235 51.517 6.257 1.00 42.32 ? 414 SER A O 1 ATOM 6338 C CB . SER A 1 402 ? 21.364 50.003 4.974 1.00 43.51 ? 414 SER A CB 1 ATOM 6339 O OG . SER A 1 402 ? 20.464 48.906 5.035 1.00 52.43 ? 414 SER A OG 1 ATOM 6340 H H . SER A 1 402 ? 22.271 49.085 7.131 1.00 44.63 ? 414 SER A H 1 ATOM 6341 H HA . SER A 1 402 ? 21.859 51.574 6.190 1.00 52.42 ? 414 SER A HA 1 ATOM 6342 H HB2 . SER A 1 402 ? 21.041 50.639 4.317 1.00 52.22 ? 414 SER A HB2 1 ATOM 6343 H HB3 . SER A 1 402 ? 22.241 49.678 4.718 1.00 52.22 ? 414 SER A HB3 1 ATOM 6344 H HG . SER A 1 402 ? 20.732 48.346 5.601 1.00 62.91 ? 414 SER A HG 1 ATOM 6345 N N . ALA A 1 403 ? 19.803 50.411 8.122 1.00 46.58 ? 415 ALA A N 1 ATOM 6346 C CA . ALA A 1 403 ? 18.481 50.614 8.701 1.00 39.59 ? 415 ALA A CA 1 ATOM 6347 C C . ALA A 1 403 ? 18.237 52.104 8.921 1.00 29.82 ? 415 ALA A C 1 ATOM 6348 O O . ALA A 1 403 ? 19.120 52.844 9.370 1.00 35.64 ? 415 ALA A O 1 ATOM 6349 C CB . ALA A 1 403 ? 18.346 49.850 10.021 1.00 37.60 ? 415 ALA A CB 1 ATOM 6350 H H . ALA A 1 403 ? 20.352 49.969 8.614 1.00 55.90 ? 415 ALA A H 1 ATOM 6351 H HA . ALA A 1 403 ? 17.808 50.282 8.087 1.00 47.50 ? 415 ALA A HA 1 ATOM 6352 H HB1 . ALA A 1 403 ? 17.460 50.002 10.384 1.00 45.12 ? 415 ALA A HB1 1 ATOM 6353 H HB2 . ALA A 1 403 ? 18.478 48.904 9.853 1.00 45.12 ? 415 ALA A HB2 1 ATOM 6354 H HB3 . ALA A 1 403 ? 19.018 50.173 10.642 1.00 45.12 ? 415 ALA A HB3 1 ATOM 6355 N N . THR A 1 404 ? 17.028 52.537 8.609 1.00 36.90 ? 416 THR A N 1 ATOM 6356 C CA . THR A 1 404 ? 16.655 53.940 8.680 1.00 35.40 ? 416 THR A CA 1 ATOM 6357 C C . THR A 1 404 ? 15.466 54.099 9.608 1.00 29.53 ? 416 THR A C 1 ATOM 6358 O O . THR A 1 404 ? 14.647 53.188 9.764 1.00 30.74 ? 416 THR A O 1 ATOM 6359 C CB . THR A 1 404 ? 16.284 54.499 7.302 1.00 34.73 ? 416 THR A CB 1 ATOM 6360 O OG1 . THR A 1 404 ? 15.214 53.714 6.758 1.00 40.11 ? 416 THR A OG1 1 ATOM 6361 C CG2 . THR A 1 404 ? 17.464 54.444 6.379 1.00 41.66 ? 416 THR A CG2 1 ATOM 6362 H H . THR A 1 404 ? 16.389 52.025 8.347 1.00 44.28 ? 416 THR A H 1 ATOM 6363 H HA . THR A 1 404 ? 17.396 54.456 9.034 1.00 42.48 ? 416 THR A HA 1 ATOM 6364 H HB . THR A 1 404 ? 16.000 55.422 7.389 1.00 41.68 ? 416 THR A HB 1 ATOM 6365 H HG1 . THR A 1 404 ? 14.998 54.007 6.001 1.00 48.13 ? 416 THR A HG1 1 ATOM 6366 H HG21 . THR A 1 404 ? 17.222 54.799 5.509 1.00 50.00 ? 416 THR A HG21 1 ATOM 6367 H HG22 . THR A 1 404 ? 18.194 54.971 6.742 1.00 50.00 ? 416 THR A HG22 1 ATOM 6368 H HG23 . THR A 1 404 ? 17.760 53.526 6.273 1.00 50.00 ? 416 THR A HG23 1 ATOM 6369 N N . CYS A 1 405 ? 15.370 55.284 10.199 1.00 28.27 ? 417 CYS A N 1 ATOM 6370 C CA . CYS A 1 405 ? 14.348 55.605 11.189 1.00 28.20 ? 417 CYS A CA 1 ATOM 6371 C C . CYS A 1 405 ? 13.693 56.900 10.725 1.00 30.92 ? 417 CYS A C 1 ATOM 6372 O O . CYS A 1 405 ? 14.286 57.973 10.861 1.00 31.04 ? 417 CYS A O 1 ATOM 6373 C CB . CYS A 1 405 ? 15.002 55.735 12.564 1.00 27.63 ? 417 CYS A CB 1 ATOM 6374 S SG . CYS A 1 405 ? 13.928 56.006 13.983 1.00 27.80 ? 417 CYS A SG 1 ATOM 6375 H H . CYS A 1 405 ? 15.903 55.939 10.038 1.00 33.92 ? 417 CYS A H 1 ATOM 6376 H HA . CYS A 1 405 ? 13.680 54.902 11.219 1.00 33.84 ? 417 CYS A HA 1 ATOM 6377 H HB2 . CYS A 1 405 ? 15.499 54.920 12.737 1.00 33.16 ? 417 CYS A HB2 1 ATOM 6378 H HB3 . CYS A 1 405 ? 15.620 56.482 12.531 1.00 33.16 ? 417 CYS A HB3 1 ATOM 6379 N N . ASP A 1 406 ? 12.479 56.813 10.182 1.00 23.90 ? 418 ASP A N 1 ATOM 6380 C CA . ASP A 1 406 ? 11.825 57.998 9.638 1.00 25.89 ? 418 ASP A CA 1 ATOM 6381 C C . ASP A 1 406 ? 11.293 58.874 10.774 1.00 28.63 ? 418 ASP A C 1 ATOM 6382 O O . ASP A 1 406 ? 11.543 58.629 11.961 1.00 23.00 ? 418 ASP A O 1 ATOM 6383 C CB . ASP A 1 406 ? 10.752 57.592 8.621 1.00 30.32 ? 418 ASP A CB 1 ATOM 6384 C CG . ASP A 1 406 ? 9.557 56.847 9.222 1.00 35.28 ? 418 ASP A CG 1 ATOM 6385 O OD1 . ASP A 1 406 ? 9.375 56.802 10.456 1.00 25.27 ? 418 ASP A OD1 1 ATOM 6386 O OD2 . ASP A 1 406 ? 8.749 56.314 8.416 1.00 34.25 ? 418 ASP A OD2 1 ATOM 6387 H H . ASP A 1 406 ? 12.020 56.089 10.117 1.00 28.68 ? 418 ASP A H 1 ATOM 6388 H HA . ASP A 1 406 ? 12.490 58.520 9.161 1.00 31.06 ? 418 ASP A HA 1 ATOM 6389 H HB2 . ASP A 1 406 ? 10.414 58.393 8.191 1.00 36.38 ? 418 ASP A HB2 1 ATOM 6390 H HB3 . ASP A 1 406 ? 11.157 57.012 7.958 1.00 36.38 ? 418 ASP A HB3 1 ATOM 6391 N N . GLN A 1 407 ? 10.557 59.929 10.420 1.00 24.66 ? 419 GLN A N 1 ATOM 6392 C CA . GLN A 1 407 ? 10.186 60.924 11.417 1.00 24.33 ? 419 GLN A CA 1 ATOM 6393 C C . GLN A 1 407 ? 9.345 60.295 12.521 1.00 22.18 ? 419 GLN A C 1 ATOM 6394 O O . GLN A 1 407 ? 9.596 60.516 13.712 1.00 23.93 ? 419 GLN A O 1 ATOM 6395 C CB . GLN A 1 407 ? 9.418 62.074 10.759 1.00 31.95 ? 419 GLN A CB 1 ATOM 6396 C CG . GLN A 1 407 ? 9.099 63.198 11.712 1.00 39.39 ? 419 GLN A CG 1 ATOM 6397 C CD . GLN A 1 407 ? 8.259 64.296 11.063 1.00 67.60 ? 419 GLN A CD 1 ATOM 6398 O OE1 . GLN A 1 407 ? 8.570 64.774 9.970 1.00 59.28 ? 419 GLN A OE1 1 ATOM 6399 N NE2 . GLN A 1 407 ? 7.185 64.690 11.734 1.00 69.23 ? 419 GLN A NE2 1 ATOM 6400 H H . GLN A 1 407 ? 10.266 60.086 9.626 1.00 29.59 ? 419 GLN A H 1 ATOM 6401 H HA . GLN A 1 407 ? 10.990 61.288 11.819 1.00 29.20 ? 419 GLN A HA 1 ATOM 6402 H HB2 . GLN A 1 407 ? 9.954 62.437 10.037 1.00 38.34 ? 419 GLN A HB2 1 ATOM 6403 H HB3 . GLN A 1 407 ? 8.580 61.733 10.409 1.00 38.34 ? 419 GLN A HB3 1 ATOM 6404 H HG2 . GLN A 1 407 ? 8.601 62.843 12.464 1.00 47.26 ? 419 GLN A HG2 1 ATOM 6405 H HG3 . GLN A 1 407 ? 9.928 63.596 12.020 1.00 47.26 ? 419 GLN A HG3 1 ATOM 6406 H HE21 . GLN A 1 407 ? 6.995 64.329 12.491 1.00 83.08 ? 419 GLN A HE21 1 ATOM 6407 H HE22 . GLN A 1 407 ? 6.678 65.305 11.412 1.00 83.08 ? 419 GLN A HE22 1 ATOM 6408 N N . HIS A 1 408 ? 8.362 59.481 12.139 1.00 23.07 ? 420 HIS A N 1 ATOM 6409 C CA . HIS A 1 408 ? 7.485 58.846 13.126 1.00 23.74 ? 420 HIS A CA 1 ATOM 6410 C C . HIS A 1 408 ? 8.280 57.885 14.013 1.00 20.43 ? 420 HIS A C 1 ATOM 6411 O O . HIS A 1 408 ? 8.118 57.872 15.244 1.00 21.46 ? 420 HIS A O 1 ATOM 6412 C CB . HIS A 1 408 ? 6.363 58.119 12.392 1.00 23.19 ? 420 HIS A CB 1 ATOM 6413 C CG . HIS A 1 408 ? 5.320 57.515 13.282 1.00 25.06 ? 420 HIS A CG 1 ATOM 6414 N ND1 . HIS A 1 408 ? 5.399 56.216 13.729 1.00 28.29 ? 420 HIS A ND1 1 ATOM 6415 C CD2 . HIS A 1 408 ? 4.144 58.003 13.748 1.00 29.71 ? 420 HIS A CD2 1 ATOM 6416 C CE1 . HIS A 1 408 ? 4.330 55.932 14.453 1.00 25.60 ? 420 HIS A CE1 1 ATOM 6417 N NE2 . HIS A 1 408 ? 3.553 57.001 14.482 1.00 27.67 ? 420 HIS A NE2 1 ATOM 6418 H H . HIS A 1 408 ? 8.182 59.280 11.323 1.00 27.68 ? 420 HIS A H 1 ATOM 6419 H HA . HIS A 1 408 ? 7.089 59.528 13.691 1.00 28.49 ? 420 HIS A HA 1 ATOM 6420 H HB2 . HIS A 1 408 ? 5.919 58.749 11.804 1.00 27.82 ? 420 HIS A HB2 1 ATOM 6421 H HB3 . HIS A 1 408 ? 6.752 57.402 11.867 1.00 27.82 ? 420 HIS A HB3 1 ATOM 6422 H HD1 . HIS A 1 408 ? 6.046 55.673 13.564 1.00 33.95 ? 420 HIS A HD1 1 ATOM 6423 H HD2 . HIS A 1 408 ? 3.806 58.857 13.607 1.00 35.66 ? 420 HIS A HD2 1 ATOM 6424 H HE1 . HIS A 1 408 ? 4.159 55.122 14.877 1.00 30.71 ? 420 HIS A HE1 1 ATOM 6425 N N . CYS A 1 409 ? 9.107 57.048 13.385 1.00 19.03 ? 421 CYS A N 1 ATOM 6426 C CA A CYS A 1 409 ? 9.973 56.118 14.119 0.50 21.09 ? 421 CYS A CA 1 ATOM 6427 C CA B CYS A 1 409 ? 9.953 56.118 14.125 0.50 21.11 ? 421 CYS A CA 1 ATOM 6428 C C . CYS A 1 409 ? 10.819 56.854 15.149 1.00 23.25 ? 421 CYS A C 1 ATOM 6429 O O . CYS A 1 409 ? 10.949 56.417 16.306 1.00 19.42 ? 421 CYS A O 1 ATOM 6430 C CB A CYS A 1 409 ? 10.895 55.361 13.153 0.50 21.69 ? 421 CYS A CB 1 ATOM 6431 C CB B CYS A 1 409 ? 10.804 55.331 13.132 0.50 21.60 ? 421 CYS A CB 1 ATOM 6432 S SG A CYS A 1 409 ? 12.413 54.593 13.935 0.50 21.24 ? 421 CYS A SG 1 ATOM 6433 S SG B CYS A 1 409 ? 11.638 53.902 13.810 0.50 24.97 ? 421 CYS A SG 1 ATOM 6434 H H . CYS A 1 409 ? 9.191 56.999 12.531 1.00 22.84 ? 421 CYS A H 1 ATOM 6435 H HA . CYS A 1 409 ? 9.406 55.479 14.594 1.00 25.33 ? 421 CYS A HA 1 ATOM 6436 H HB2 A CYS A 1 409 ? 10.386 54.646 12.739 0.50 26.03 ? 421 CYS A HB2 1 ATOM 6437 H HB2 B CYS A 1 409 ? 10.231 55.021 12.414 0.50 25.92 ? 421 CYS A HB2 1 ATOM 6438 H HB3 A CYS A 1 409 ? 11.199 55.979 12.470 0.50 26.03 ? 421 CYS A HB3 1 ATOM 6439 H HB3 B CYS A 1 409 ? 11.483 55.923 12.773 0.50 25.92 ? 421 CYS A HB3 1 ATOM 6440 H HG B CYS A 1 409 ? 12.372 54.258 14.690 0.50 29.97 ? 421 CYS A HG 1 ATOM 6441 N N . LYS A 1 410 ? 11.415 57.970 14.747 1.00 21.93 ? 422 LYS A N 1 ATOM 6442 C CA . LYS A 1 410 ? 12.328 58.685 15.627 1.00 21.56 ? 422 LYS A CA 1 ATOM 6443 C C . LYS A 1 410 ? 11.584 59.360 16.761 1.00 18.32 ? 422 LYS A C 1 ATOM 6444 O O . LYS A 1 410 ? 12.066 59.376 17.904 1.00 19.10 ? 422 LYS A O 1 ATOM 6445 C CB . LYS A 1 410 ? 13.126 59.707 14.823 1.00 22.01 ? 422 LYS A CB 1 ATOM 6446 C CG . LYS A 1 410 ? 14.069 60.506 15.691 1.00 22.20 ? 422 LYS A CG 1 ATOM 6447 C CD . LYS A 1 410 ? 14.932 61.502 14.932 1.00 24.78 ? 422 LYS A CD 1 ATOM 6448 C CE . LYS A 1 410 ? 15.751 62.311 15.894 1.00 28.65 ? 422 LYS A CE 1 ATOM 6449 N NZ . LYS A 1 410 ? 16.604 63.332 15.214 1.00 28.88 ? 422 LYS A NZ 1 ATOM 6450 H H . LYS A 1 410 ? 11.308 58.332 13.974 1.00 26.32 ? 422 LYS A H 1 ATOM 6451 H HA . LYS A 1 410 ? 12.954 58.052 16.013 1.00 25.88 ? 422 LYS A HA 1 ATOM 6452 H HB2 . LYS A 1 410 ? 13.652 59.244 14.153 1.00 26.41 ? 422 LYS A HB2 1 ATOM 6453 H HB3 . LYS A 1 410 ? 12.512 60.326 14.397 1.00 26.41 ? 422 LYS A HB3 1 ATOM 6454 H HG2 . LYS A 1 410 ? 13.547 61.003 16.340 1.00 26.64 ? 422 LYS A HG2 1 ATOM 6455 H HG3 . LYS A 1 410 ? 14.663 59.892 16.150 1.00 26.64 ? 422 LYS A HG3 1 ATOM 6456 H HD2 . LYS A 1 410 ? 15.533 61.026 14.339 1.00 29.74 ? 422 LYS A HD2 1 ATOM 6457 H HD3 . LYS A 1 410 ? 14.364 62.106 14.428 1.00 29.74 ? 422 LYS A HD3 1 ATOM 6458 H HE2 . LYS A 1 410 ? 15.156 62.775 16.504 1.00 34.38 ? 422 LYS A HE2 1 ATOM 6459 H HE3 . LYS A 1 410 ? 16.335 61.715 16.390 1.00 34.38 ? 422 LYS A HE3 1 ATOM 6460 H HZ1 . LYS A 1 410 ? 17.073 63.788 15.817 1.00 34.65 ? 422 LYS A HZ1 1 ATOM 6461 H HZ2 . LYS A 1 410 ? 17.168 62.932 14.652 1.00 34.65 ? 422 LYS A HZ2 1 ATOM 6462 H HZ3 . LYS A 1 410 ? 16.093 63.899 14.756 1.00 34.65 ? 422 LYS A HZ3 1 ATOM 6463 N N . THR A 1 411 ? 10.404 59.935 16.480 1.00 20.15 ? 423 THR A N 1 ATOM 6464 C CA . THR A 1 411 ? 9.606 60.497 17.562 1.00 20.96 ? 423 THR A CA 1 ATOM 6465 C C . THR A 1 411 ? 9.315 59.447 18.610 1.00 20.75 ? 423 THR A C 1 ATOM 6466 O O . THR A 1 411 ? 9.431 59.713 19.811 1.00 18.45 ? 423 THR A O 1 ATOM 6467 C CB . THR A 1 411 ? 8.304 61.085 17.018 1.00 22.74 ? 423 THR A CB 1 ATOM 6468 O OG1 . THR A 1 411 ? 8.646 62.216 16.217 1.00 30.37 ? 423 THR A OG1 1 ATOM 6469 C CG2 . THR A 1 411 ? 7.367 61.521 18.136 1.00 22.45 ? 423 THR A CG2 1 ATOM 6470 H H . THR A 1 411 ? 10.059 60.008 15.695 1.00 24.18 ? 423 THR A H 1 ATOM 6471 H HA . THR A 1 411 ? 10.105 61.212 17.985 1.00 25.15 ? 423 THR A HA 1 ATOM 6472 H HB . THR A 1 411 ? 7.850 60.424 16.472 1.00 27.29 ? 423 THR A HB 1 ATOM 6473 H HG1 . THR A 1 411 ? 7.951 62.566 15.901 1.00 36.45 ? 423 THR A HG1 1 ATOM 6474 H HG21 . THR A 1 411 ? 6.552 61.890 17.761 1.00 26.94 ? 423 THR A HG21 1 ATOM 6475 H HG22 . THR A 1 411 ? 7.141 60.761 18.695 1.00 26.94 ? 423 THR A HG22 1 ATOM 6476 H HG23 . THR A 1 411 ? 7.796 62.198 18.683 1.00 26.94 ? 423 THR A HG23 1 ATOM 6477 N N . LEU A 1 412 ? 8.928 58.249 18.174 1.00 17.54 ? 424 LEU A N 1 ATOM 6478 C CA . LEU A 1 412 ? 8.644 57.186 19.132 1.00 18.02 ? 424 LEU A CA 1 ATOM 6479 C C . LEU A 1 412 ? 9.886 56.838 19.950 1.00 18.50 ? 424 LEU A C 1 ATOM 6480 O O . LEU A 1 412 ? 9.795 56.615 21.163 1.00 17.78 ? 424 LEU A O 1 ATOM 6481 C CB . LEU A 1 412 ? 8.115 55.947 18.422 1.00 19.14 ? 424 LEU A CB 1 ATOM 6482 C CG . LEU A 1 412 ? 6.584 55.854 18.265 1.00 19.87 ? 424 LEU A CG 1 ATOM 6483 C CD1 . LEU A 1 412 ? 5.960 57.140 17.780 1.00 28.55 ? 424 LEU A CD1 1 ATOM 6484 C CD2 . LEU A 1 412 ? 6.224 54.722 17.359 1.00 20.20 ? 424 LEU A CD2 1 ATOM 6485 H H . LEU A 1 412 ? 8.825 58.030 17.349 1.00 21.05 ? 424 LEU A H 1 ATOM 6486 H HA . LEU A 1 412 ? 7.959 57.493 19.747 1.00 21.63 ? 424 LEU A HA 1 ATOM 6487 H HB2 . LEU A 1 412 ? 8.499 55.919 17.532 1.00 22.97 ? 424 LEU A HB2 1 ATOM 6488 H HB3 . LEU A 1 412 ? 8.401 55.165 18.920 1.00 22.97 ? 424 LEU A HB3 1 ATOM 6489 H HG . LEU A 1 412 ? 6.201 55.660 19.134 1.00 23.84 ? 424 LEU A HG 1 ATOM 6490 H HD11 . LEU A 1 412 ? 5.001 57.016 17.703 1.00 34.26 ? 424 LEU A HD11 1 ATOM 6491 H HD12 . LEU A 1 412 ? 6.152 57.844 18.419 1.00 34.26 ? 424 LEU A HD12 1 ATOM 6492 H HD13 . LEU A 1 412 ? 6.336 57.366 16.915 1.00 34.26 ? 424 LEU A HD13 1 ATOM 6493 H HD21 . LEU A 1 412 ? 5.259 54.682 17.274 1.00 24.24 ? 424 LEU A HD21 1 ATOM 6494 H HD22 . LEU A 1 412 ? 6.628 54.873 16.490 1.00 24.24 ? 424 LEU A HD22 1 ATOM 6495 H HD23 . LEU A 1 412 ? 6.558 53.895 17.740 1.00 24.24 ? 424 LEU A HD23 1 ATOM 6496 N N . GLN A 1 413 ? 11.038 56.720 19.292 1.00 16.33 ? 425 GLN A N 1 ATOM 6497 C CA . GLN A 1 413 ? 12.275 56.404 20.015 1.00 17.89 ? 425 GLN A CA 1 ATOM 6498 C C . GLN A 1 413 ? 12.613 57.482 21.023 1.00 18.94 ? 425 GLN A C 1 ATOM 6499 O O . GLN A 1 413 ? 12.830 57.204 22.210 1.00 16.93 ? 425 GLN A O 1 ATOM 6500 C CB . GLN A 1 413 ? 13.417 56.244 19.027 1.00 16.50 ? 425 GLN A CB 1 ATOM 6501 C CG . GLN A 1 413 ? 13.464 54.920 18.322 1.00 20.79 ? 425 GLN A CG 1 ATOM 6502 C CD . GLN A 1 413 ? 14.207 53.874 19.132 1.00 20.25 ? 425 GLN A CD 1 ATOM 6503 O OE1 . GLN A 1 413 ? 14.820 54.184 20.156 1.00 21.82 ? 425 GLN A OE1 1 ATOM 6504 N NE2 . GLN A 1 413 ? 14.137 52.634 18.687 1.00 21.23 ? 425 GLN A NE2 1 ATOM 6505 H H . GLN A 1 413 ? 11.133 56.816 18.442 1.00 19.59 ? 425 GLN A H 1 ATOM 6506 H HA . GLN A 1 413 ? 12.163 55.566 20.491 1.00 21.47 ? 425 GLN A HA 1 ATOM 6507 H HB2 . GLN A 1 413 ? 13.337 56.933 18.349 1.00 19.80 ? 425 GLN A HB2 1 ATOM 6508 H HB3 . GLN A 1 413 ? 14.255 56.351 19.503 1.00 19.80 ? 425 GLN A HB3 1 ATOM 6509 H HG2 . GLN A 1 413 ? 12.558 54.604 18.177 1.00 24.95 ? 425 GLN A HG2 1 ATOM 6510 H HG3 . GLN A 1 413 ? 13.921 55.027 17.473 1.00 24.95 ? 425 GLN A HG3 1 ATOM 6511 H HE21 . GLN A 1 413 ? 13.688 52.457 17.975 1.00 25.47 ? 425 GLN A HE21 1 ATOM 6512 H HE22 . GLN A 1 413 ? 14.540 52.002 19.109 1.00 25.47 ? 425 GLN A HE22 1 ATOM 6513 N N . VAL A 1 414 ? 12.686 58.734 20.573 1.00 19.15 ? 426 VAL A N 1 ATOM 6514 C CA . VAL A 1 414 ? 13.152 59.791 21.459 1.00 15.16 ? 426 VAL A CA 1 ATOM 6515 C C . VAL A 1 414 ? 12.161 60.020 22.589 1.00 17.13 ? 426 VAL A C 1 ATOM 6516 O O . VAL A 1 414 ? 12.551 60.284 23.736 1.00 17.82 ? 426 VAL A O 1 ATOM 6517 C CB . VAL A 1 414 ? 13.409 61.080 20.653 1.00 19.70 ? 426 VAL A CB 1 ATOM 6518 C CG1 . VAL A 1 414 ? 13.802 62.214 21.606 1.00 28.92 ? 426 VAL A CG1 1 ATOM 6519 C CG2 . VAL A 1 414 ? 14.526 60.826 19.682 1.00 22.01 ? 426 VAL A CG2 1 ATOM 6520 H H . VAL A 1 414 ? 12.477 58.990 19.779 1.00 22.97 ? 426 VAL A H 1 ATOM 6521 H HA . VAL A 1 414 ? 13.994 59.517 21.856 1.00 18.20 ? 426 VAL A HA 1 ATOM 6522 H HB . VAL A 1 414 ? 12.611 61.335 20.163 1.00 23.64 ? 426 VAL A HB 1 ATOM 6523 H HG11 . VAL A 1 414 ? 13.961 63.019 21.089 1.00 34.70 ? 426 VAL A HG11 1 ATOM 6524 H HG12 . VAL A 1 414 ? 13.078 62.362 22.235 1.00 34.70 ? 426 VAL A HG12 1 ATOM 6525 H HG13 . VAL A 1 414 ? 14.608 61.961 22.082 1.00 34.70 ? 426 VAL A HG13 1 ATOM 6526 H HG21 . VAL A 1 414 ? 14.692 61.635 19.173 1.00 26.41 ? 426 VAL A HG21 1 ATOM 6527 H HG22 . VAL A 1 414 ? 15.323 60.577 20.176 1.00 26.41 ? 426 VAL A HG22 1 ATOM 6528 H HG23 . VAL A 1 414 ? 14.268 60.106 19.086 1.00 26.41 ? 426 VAL A HG23 1 ATOM 6529 N N . CYS A 1 415 ? 10.866 59.921 22.302 1.00 19.09 ? 427 CYS A N 1 ATOM 6530 C CA A CYS A 1 415 ? 9.885 60.127 23.365 0.64 19.61 ? 427 CYS A CA 1 ATOM 6531 C CA B CYS A 1 415 ? 9.871 60.108 23.344 0.36 19.59 ? 427 CYS A CA 1 ATOM 6532 C C . CYS A 1 415 ? 10.014 59.058 24.439 1.00 19.48 ? 427 CYS A C 1 ATOM 6533 O O . CYS A 1 415 ? 9.874 59.360 25.629 1.00 18.90 ? 427 CYS A O 1 ATOM 6534 C CB A CYS A 1 415 ? 8.460 60.177 22.825 0.64 19.81 ? 427 CYS A CB 1 ATOM 6535 C CB B CYS A 1 415 ? 8.492 60.036 22.706 0.36 19.70 ? 427 CYS A CB 1 ATOM 6536 S SG A CYS A 1 415 ? 8.059 61.822 22.032 0.64 21.91 ? 427 CYS A SG 1 ATOM 6537 S SG B CYS A 1 415 ? 7.189 60.399 23.776 0.36 23.17 ? 427 CYS A SG 1 ATOM 6538 H H . CYS A 1 415 ? 10.536 59.746 21.527 1.00 22.91 ? 427 CYS A H 1 ATOM 6539 H HA . CYS A 1 415 ? 10.024 60.985 23.764 1.00 23.51 ? 427 CYS A HA 1 ATOM 6540 H HB2 A CYS A 1 415 ? 8.350 59.485 22.155 0.64 23.77 ? 427 CYS A HB2 1 ATOM 6541 H HB2 B CYS A 1 415 ? 8.456 60.669 21.973 0.36 23.64 ? 427 CYS A HB2 1 ATOM 6542 H HB3 A CYS A 1 415 ? 7.839 60.036 23.556 0.64 23.77 ? 427 CYS A HB3 1 ATOM 6543 H HB3 B CYS A 1 415 ? 8.354 59.137 22.369 0.36 23.64 ? 427 CYS A HB3 1 ATOM 6544 H HG B CYS A 1 415 ? 7.199 59.617 24.686 0.36 27.80 ? 427 CYS A HG 1 ATOM 6545 N N . ALA A 1 416 ? 10.290 57.806 24.049 1.00 14.65 ? 428 ALA A N 1 ATOM 6546 C CA . ALA A 1 416 ? 10.417 56.743 25.041 1.00 14.04 ? 428 ALA A CA 1 ATOM 6547 C C . ALA A 1 416 ? 11.711 56.861 25.834 1.00 17.63 ? 428 ALA A C 1 ATOM 6548 O O . ALA A 1 416 ? 11.771 56.449 27.001 1.00 16.17 ? 428 ALA A O 1 ATOM 6549 C CB . ALA A 1 416 ? 10.336 55.375 24.352 1.00 13.39 ? 428 ALA A CB 1 ATOM 6550 H H . ALA A 1 416 ? 10.405 57.556 23.235 1.00 17.57 ? 428 ALA A H 1 ATOM 6551 H HA . ALA A 1 416 ? 9.677 56.806 25.666 1.00 16.84 ? 428 ALA A HA 1 ATOM 6552 H HB1 . ALA A 1 416 ? 10.422 54.679 25.023 1.00 16.07 ? 428 ALA A HB1 1 ATOM 6553 H HB2 . ALA A 1 416 ? 9.480 55.298 23.903 1.00 16.07 ? 428 ALA A HB2 1 ATOM 6554 H HB3 . ALA A 1 416 ? 11.057 55.304 23.707 1.00 16.07 ? 428 ALA A HB3 1 ATOM 6555 N N . ILE A 1 417 ? 12.765 57.400 25.225 1.00 16.98 ? 429 ILE A N 1 ATOM 6556 C CA . ILE A 1 417 ? 14.027 57.522 25.948 1.00 15.61 ? 429 ILE A CA 1 ATOM 6557 C C . ILE A 1 417 ? 13.866 58.476 27.107 1.00 20.01 ? 429 ILE A C 1 ATOM 6558 O O . ILE A 1 417 ? 14.333 58.225 28.225 1.00 17.43 ? 429 ILE A O 1 ATOM 6559 C CB . ILE A 1 417 ? 15.143 57.989 24.988 1.00 18.26 ? 429 ILE A CB 1 ATOM 6560 C CG1 . ILE A 1 417 ? 15.463 56.907 23.958 1.00 18.06 ? 429 ILE A CG1 1 ATOM 6561 C CG2 . ILE A 1 417 ? 16.365 58.356 25.802 1.00 21.76 ? 429 ILE A CG2 1 ATOM 6562 C CD1 . ILE A 1 417 ? 16.250 57.380 22.731 1.00 19.98 ? 429 ILE A CD1 1 ATOM 6563 H H . ILE A 1 417 ? 12.777 57.694 24.417 1.00 20.37 ? 429 ILE A H 1 ATOM 6564 H HA . ILE A 1 417 ? 14.277 56.654 26.302 1.00 18.73 ? 429 ILE A HA 1 ATOM 6565 H HB . ILE A 1 417 ? 14.835 58.781 24.519 1.00 21.91 ? 429 ILE A HB 1 ATOM 6566 H HG12 . ILE A 1 417 ? 15.988 56.217 24.392 1.00 21.67 ? 429 ILE A HG12 1 ATOM 6567 H HG13 . ILE A 1 417 ? 14.628 56.529 23.641 1.00 21.67 ? 429 ILE A HG13 1 ATOM 6568 H HG21 . ILE A 1 417 ? 17.068 58.650 25.201 1.00 26.12 ? 429 ILE A HG21 1 ATOM 6569 H HG22 . ILE A 1 417 ? 16.133 59.071 26.415 1.00 26.12 ? 429 ILE A HG22 1 ATOM 6570 H HG23 . ILE A 1 417 ? 16.659 57.576 26.298 1.00 26.12 ? 429 ILE A HG23 1 ATOM 6571 H HD11 . ILE A 1 417 ? 16.401 56.624 22.143 1.00 23.98 ? 429 ILE A HD11 1 ATOM 6572 H HD12 . ILE A 1 417 ? 15.735 58.061 22.269 1.00 23.98 ? 429 ILE A HD12 1 ATOM 6573 H HD13 . ILE A 1 417 ? 17.099 57.748 23.022 1.00 23.98 ? 429 ILE A HD13 1 ATOM 6574 N N . MET A 1 418 ? 13.148 59.562 26.869 1.00 19.95 ? 430 MET A N 1 ATOM 6575 C CA A MET A 1 418 ? 13.116 60.689 27.786 0.61 20.48 ? 430 MET A CA 1 ATOM 6576 C CA B MET A 1 418 ? 13.113 60.687 27.788 0.39 20.56 ? 430 MET A CA 1 ATOM 6577 C C . MET A 1 418 ? 11.907 60.706 28.718 1.00 23.66 ? 430 MET A C 1 ATOM 6578 O O . MET A 1 418 ? 11.973 61.346 29.766 1.00 21.56 ? 430 MET A O 1 ATOM 6579 C CB A MET A 1 418 ? 13.157 62.002 26.974 0.61 23.37 ? 430 MET A CB 1 ATOM 6580 C CB B MET A 1 418 ? 13.147 61.986 26.973 0.39 23.48 ? 430 MET A CB 1 ATOM 6581 C CG A MET A 1 418 ? 14.457 62.193 26.204 0.61 35.23 ? 430 MET A CG 1 ATOM 6582 C CG B MET A 1 418 ? 14.529 62.295 26.486 0.39 34.97 ? 430 MET A CG 1 ATOM 6583 S SD A MET A 1 418 ? 14.572 63.728 25.246 0.61 42.01 ? 430 MET A SD 1 ATOM 6584 S SD B MET A 1 418 ? 15.466 63.056 27.806 0.39 42.46 ? 430 MET A SD 1 ATOM 6585 C CE A MET A 1 418 ? 14.158 64.944 26.504 0.61 44.89 ? 430 MET A CE 1 ATOM 6586 C CE B MET A 1 418 ? 15.491 64.735 27.150 0.39 41.41 ? 430 MET A CE 1 ATOM 6587 H H . MET A 1 418 ? 12.663 59.672 26.168 1.00 23.94 ? 430 MET A H 1 ATOM 6588 H HA . MET A 1 418 ? 13.917 60.662 28.331 1.00 24.67 ? 430 MET A HA 1 ATOM 6589 H HB2 A MET A 1 418 ? 12.428 61.998 26.334 0.61 28.04 ? 430 MET A HB2 1 ATOM 6590 H HB2 B MET A 1 418 ? 12.567 61.895 26.202 0.39 28.17 ? 430 MET A HB2 1 ATOM 6591 H HB3 A MET A 1 418 ? 13.058 62.751 27.583 0.61 28.04 ? 430 MET A HB3 1 ATOM 6592 H HB3 B MET A 1 418 ? 12.851 62.721 27.532 0.39 28.17 ? 430 MET A HB3 1 ATOM 6593 H HG2 A MET A 1 418 ? 15.192 62.189 26.836 0.61 42.27 ? 430 MET A HG2 1 ATOM 6594 H HG2 B MET A 1 418 ? 14.974 61.475 26.222 0.39 41.96 ? 430 MET A HG2 1 ATOM 6595 H HG3 A MET A 1 418 ? 14.558 61.454 25.584 0.61 42.27 ? 430 MET A HG3 1 ATOM 6596 H HG3 B MET A 1 418 ? 14.482 62.914 25.741 0.39 41.96 ? 430 MET A HG3 1 ATOM 6597 H HE1 A MET A 1 418 ? 13.267 64.759 26.840 0.61 53.87 ? 430 MET A HE1 1 ATOM 6598 H HE1 B MET A 1 418 ? 15.929 64.728 26.284 0.39 49.69 ? 430 MET A HE1 1 ATOM 6599 H HE2 A MET A 1 418 ? 14.803 64.884 27.225 0.61 53.87 ? 430 MET A HE2 1 ATOM 6600 H HE2 B MET A 1 418 ? 14.578 65.050 27.057 0.39 49.69 ? 430 MET A HE2 1 ATOM 6601 H HE3 A MET A 1 418 ? 14.185 65.829 26.108 0.61 53.87 ? 430 MET A HE3 1 ATOM 6602 H HE3 B MET A 1 418 ? 15.978 65.306 27.764 0.39 49.69 ? 430 MET A HE3 1 ATOM 6603 N N . ASN A 1 419 ? 10.823 60.008 28.391 1.00 16.62 ? 431 ASN A N 1 ATOM 6604 C CA . ASN A 1 419 ? 9.566 60.160 29.128 1.00 17.51 ? 431 ASN A CA 1 ATOM 6605 C C . ASN A 1 419 ? 9.046 58.795 29.564 1.00 18.56 ? 431 ASN A C 1 ATOM 6606 O O . ASN A 1 419 ? 8.442 58.079 28.757 1.00 15.63 ? 431 ASN A O 1 ATOM 6607 C CB . ASN A 1 419 ? 8.568 60.874 28.255 1.00 19.16 ? 431 ASN A CB 1 ATOM 6608 C CG . ASN A 1 419 ? 9.098 62.217 27.780 1.00 21.17 ? 431 ASN A CG 1 ATOM 6609 O OD1 . ASN A 1 419 ? 9.148 63.163 28.541 1.00 22.28 ? 431 ASN A OD1 1 ATOM 6610 N ND2 . ASN A 1 419 ? 9.515 62.280 26.545 1.00 21.72 ? 431 ASN A ND2 1 ATOM 6611 H H . ASN A 1 419 ? 10.787 59.440 27.747 1.00 19.94 ? 431 ASN A H 1 ATOM 6612 H HA . ASN A 1 419 ? 9.720 60.697 29.921 1.00 21.01 ? 431 ASN A HA 1 ATOM 6613 H HB2 . ASN A 1 419 ? 8.378 60.329 27.475 1.00 23.00 ? 431 ASN A HB2 1 ATOM 6614 H HB3 . ASN A 1 419 ? 7.755 61.030 28.761 1.00 23.00 ? 431 ASN A HB3 1 ATOM 6615 H HD21 . ASN A 1 419 ? 9.823 63.019 26.232 1.00 26.07 ? 431 ASN A HD21 1 ATOM 6616 H HD22 . ASN A 1 419 ? 9.480 61.582 26.043 1.00 26.07 ? 431 ASN A HD22 1 ATOM 6617 N N . LEU A 1 420 ? 9.242 58.444 30.844 1.00 14.52 ? 432 LEU A N 1 ATOM 6618 C CA . LEU A 1 420 ? 8.931 57.090 31.266 1.00 14.46 ? 432 LEU A CA 1 ATOM 6619 C C . LEU A 1 420 ? 7.513 56.940 31.771 1.00 16.33 ? 432 LEU A C 1 ATOM 6620 O O . LEU A 1 420 ? 7.016 55.815 31.829 1.00 15.55 ? 432 LEU A O 1 ATOM 6621 C CB . LEU A 1 420 ? 9.921 56.627 32.354 1.00 14.24 ? 432 LEU A CB 1 ATOM 6622 C CG . LEU A 1 420 ? 11.244 56.090 31.765 1.00 18.59 ? 432 LEU A CG 1 ATOM 6623 C CD1 . LEU A 1 420 ? 11.984 57.124 30.950 1.00 20.01 ? 432 LEU A CD1 1 ATOM 6624 C CD2 . LEU A 1 420 ? 12.152 55.604 32.863 1.00 16.28 ? 432 LEU A CD2 1 ATOM 6625 H H . LEU A 1 420 ? 9.545 58.960 31.462 1.00 17.42 ? 432 LEU A H 1 ATOM 6626 H HA . LEU A 1 420 ? 9.035 56.498 30.504 1.00 17.35 ? 432 LEU A HA 1 ATOM 6627 H HB2 . LEU A 1 420 ? 10.131 57.378 32.931 1.00 17.09 ? 432 LEU A HB2 1 ATOM 6628 H HB3 . LEU A 1 420 ? 9.511 55.915 32.872 1.00 17.09 ? 432 LEU A HB3 1 ATOM 6629 H HG . LEU A 1 420 ? 11.048 55.337 31.186 1.00 22.31 ? 432 LEU A HG 1 ATOM 6630 H HD11 . LEU A 1 420 ? 12.802 56.730 30.608 1.00 24.01 ? 432 LEU A HD11 1 ATOM 6631 H HD12 . LEU A 1 420 ? 11.420 57.407 30.213 1.00 24.01 ? 432 LEU A HD12 1 ATOM 6632 H HD13 . LEU A 1 420 ? 12.193 57.882 31.517 1.00 24.01 ? 432 LEU A HD13 1 ATOM 6633 H HD21 . LEU A 1 420 ? 12.974 55.273 32.468 1.00 19.54 ? 432 LEU A HD21 1 ATOM 6634 H HD22 . LEU A 1 420 ? 12.346 56.343 33.461 1.00 19.54 ? 432 LEU A HD22 1 ATOM 6635 H HD23 . LEU A 1 420 ? 11.707 54.892 33.348 1.00 19.54 ? 432 LEU A HD23 1 ATOM 6636 N N . ASP A 1 421 ? 6.874 58.029 32.190 1.00 16.32 ? 433 ASP A N 1 ATOM 6637 C CA . ASP A 1 421 ? 5.522 58.036 32.725 1.00 20.37 ? 433 ASP A CA 1 ATOM 6638 C C . ASP A 1 421 ? 4.529 58.565 31.679 1.00 18.62 ? 433 ASP A C 1 ATOM 6639 O O . ASP A 1 421 ? 4.890 59.273 30.732 1.00 18.99 ? 433 ASP A O 1 ATOM 6640 C CB . ASP A 1 421 ? 5.489 58.910 33.984 1.00 21.46 ? 433 ASP A CB 1 ATOM 6641 C CG . ASP A 1 421 ? 5.742 60.371 33.654 1.00 24.49 ? 433 ASP A CG 1 ATOM 6642 O OD1 . ASP A 1 421 ? 6.924 60.764 33.419 1.00 22.88 ? 433 ASP A OD1 1 ATOM 6643 O OD2 . ASP A 1 421 ? 4.741 61.124 33.575 1.00 22.81 ? 433 ASP A OD2 1 ATOM 6644 H H . ASP A 1 421 ? 7.226 58.813 32.171 1.00 19.58 ? 433 ASP A H 1 ATOM 6645 H HA . ASP A 1 421 ? 5.263 57.133 32.968 1.00 24.45 ? 433 ASP A HA 1 ATOM 6646 H HB2 . ASP A 1 421 ? 4.616 58.839 34.401 1.00 25.75 ? 433 ASP A HB2 1 ATOM 6647 H HB3 . ASP A 1 421 ? 6.180 58.613 34.598 1.00 25.75 ? 433 ASP A HB3 1 ATOM 6648 N N . SER A 1 422 ? 3.252 58.243 31.890 1.00 18.99 ? 434 SER A N 1 ATOM 6649 C CA A SER A 1 422 ? 2.256 58.499 30.852 0.57 20.07 ? 434 SER A CA 1 ATOM 6650 C CA B SER A 1 422 ? 2.241 58.502 30.864 0.43 20.11 ? 434 SER A CA 1 ATOM 6651 C C . SER A 1 422 ? 2.079 59.993 30.592 1.00 20.88 ? 434 SER A C 1 ATOM 6652 O O . SER A 1 422 ? 1.964 60.408 29.442 1.00 17.86 ? 434 SER A O 1 ATOM 6653 C CB A SER A 1 422 ? 0.925 57.848 31.224 0.57 21.96 ? 434 SER A CB 1 ATOM 6654 C CB B SER A 1 422 ? 0.898 57.898 31.287 0.43 21.96 ? 434 SER A CB 1 ATOM 6655 O OG A SER A 1 422 ? 0.404 58.405 32.392 0.57 20.76 ? 434 SER A OG 1 ATOM 6656 O OG B SER A 1 422 ? -0.136 58.212 30.360 0.43 20.14 ? 434 SER A OG 1 ATOM 6657 H H A SER A 1 422 ? 2.943 57.883 32.608 0.57 22.79 ? 434 SER A H 1 ATOM 6658 H H B SER A 1 422 ? 2.949 57.878 32.608 0.43 22.79 ? 434 SER A H 1 ATOM 6659 H HA . SER A 1 422 ? 2.537 58.083 30.031 1.00 24.13 ? 434 SER A HA 1 ATOM 6660 H HB2 A SER A 1 422 ? 0.294 57.987 30.500 0.57 26.35 ? 434 SER A HB2 1 ATOM 6661 H HB2 B SER A 1 422 ? 0.990 56.934 31.339 0.43 26.36 ? 434 SER A HB2 1 ATOM 6662 H HB3 A SER A 1 422 ? 1.066 56.899 31.363 0.57 26.35 ? 434 SER A HB3 1 ATOM 6663 H HB3 B SER A 1 422 ? 0.655 58.252 32.157 0.43 26.36 ? 434 SER A HB3 1 ATOM 6664 H HG A SER A 1 422 ? 0.941 58.292 33.028 0.57 24.91 ? 434 SER A HG 1 ATOM 6665 H HG B SER A 1 422 ? -0.230 59.045 30.306 0.43 24.17 ? 434 SER A HG 1 ATOM 6666 N N . MET A 1 423 ? 2.033 60.813 31.638 1.00 21.24 ? 435 MET A N 1 ATOM 6667 C CA A MET A 1 423 ? 1.809 62.242 31.427 0.55 24.81 ? 435 MET A CA 1 ATOM 6668 C CA B MET A 1 423 ? 1.810 62.243 31.430 0.45 24.84 ? 435 MET A CA 1 ATOM 6669 C C . MET A 1 423 ? 2.916 62.848 30.577 1.00 23.24 ? 435 MET A C 1 ATOM 6670 O O . MET A 1 423 ? 2.648 63.573 29.608 1.00 19.69 ? 435 MET A O 1 ATOM 6671 C CB A MET A 1 423 ? 1.706 62.965 32.769 0.55 26.93 ? 435 MET A CB 1 ATOM 6672 C CB B MET A 1 423 ? 1.715 62.958 32.780 0.45 27.00 ? 435 MET A CB 1 ATOM 6673 C CG A MET A 1 423 ? 1.634 64.478 32.644 0.55 33.19 ? 435 MET A CG 1 ATOM 6674 C CG B MET A 1 423 ? 0.442 62.650 33.558 0.45 34.79 ? 435 MET A CG 1 ATOM 6675 S SD A MET A 1 423 ? 1.018 65.257 34.150 0.55 53.60 ? 435 MET A SD 1 ATOM 6676 S SD B MET A 1 423 ? -1.063 63.237 32.746 0.45 52.52 ? 435 MET A SD 1 ATOM 6677 C CE A MET A 1 423 ? -0.695 64.756 34.123 0.55 39.18 ? 435 MET A CE 1 ATOM 6678 C CE B MET A 1 423 ? -0.700 64.981 32.580 0.45 33.91 ? 435 MET A CE 1 ATOM 6679 H H . MET A 1 423 ? 2.124 60.581 32.461 1.00 25.49 ? 435 MET A H 1 ATOM 6680 H HA . MET A 1 423 ? 0.964 62.361 30.968 1.00 29.81 ? 435 MET A HA 1 ATOM 6681 H HB2 A MET A 1 423 ? 0.903 62.667 33.224 0.55 32.32 ? 435 MET A HB2 1 ATOM 6682 H HB2 B MET A 1 423 ? 2.469 62.690 33.328 0.45 32.40 ? 435 MET A HB2 1 ATOM 6683 H HB3 A MET A 1 423 ? 2.486 62.748 33.303 0.55 32.32 ? 435 MET A HB3 1 ATOM 6684 H HB3 B MET A 1 423 ? 1.744 63.915 32.627 0.45 32.40 ? 435 MET A HB3 1 ATOM 6685 H HG2 A MET A 1 423 ? 2.523 64.825 32.467 0.55 39.83 ? 435 MET A HG2 1 ATOM 6686 H HG2 B MET A 1 423 ? 0.366 61.689 33.667 0.45 41.75 ? 435 MET A HG2 1 ATOM 6687 H HG3 A MET A 1 423 ? 1.035 64.709 31.917 0.55 39.83 ? 435 MET A HG3 1 ATOM 6688 H HG3 B MET A 1 423 ? 0.496 63.076 34.428 0.45 41.75 ? 435 MET A HG3 1 ATOM 6689 H HE1 A MET A 1 423 ? -1.143 65.122 34.901 0.55 47.02 ? 435 MET A HE1 1 ATOM 6690 H HE1 B MET A 1 423 ? -1.449 65.419 32.147 0.45 40.69 ? 435 MET A HE1 1 ATOM 6691 H HE2 A MET A 1 423 ? -1.109 65.093 33.313 0.55 47.02 ? 435 MET A HE2 1 ATOM 6692 H HE2 B MET A 1 423 ? -0.559 65.359 33.462 0.45 40.69 ? 435 MET A HE2 1 ATOM 6693 H HE3 A MET A 1 423 ? -0.740 63.787 34.139 0.55 47.02 ? 435 MET A HE3 1 ATOM 6694 H HE3 B MET A 1 423 ? 0.101 65.086 32.042 0.45 40.69 ? 435 MET A HE3 1 ATOM 6695 N N . SER A 1 424 ? 4.177 62.549 30.908 1.00 18.33 ? 436 SER A N 1 ATOM 6696 C CA A SER A 1 424 ? 5.263 63.152 30.151 0.56 19.45 ? 436 SER A CA 1 ATOM 6697 C CA B SER A 1 424 ? 5.276 63.137 30.156 0.44 19.50 ? 436 SER A CA 1 ATOM 6698 C C . SER A 1 424 ? 5.342 62.554 28.754 1.00 16.82 ? 436 SER A C 1 ATOM 6699 O O . SER A 1 424 ? 5.654 63.266 27.795 1.00 17.28 ? 436 SER A O 1 ATOM 6700 C CB A SER A 1 424 ? 6.590 63.005 30.895 0.56 21.43 ? 436 SER A CB 1 ATOM 6701 C CB B SER A 1 424 ? 6.604 62.905 30.887 0.44 21.40 ? 436 SER A CB 1 ATOM 6702 O OG A SER A 1 424 ? 6.932 61.660 31.055 0.56 20.99 ? 436 SER A OG 1 ATOM 6703 O OG B SER A 1 424 ? 6.504 63.213 32.266 0.44 25.37 ? 436 SER A OG 1 ATOM 6704 H H . SER A 1 424 ? 4.422 62.022 31.543 1.00 22.00 ? 436 SER A H 1 ATOM 6705 H HA . SER A 1 424 ? 5.109 64.097 30.067 1.00 23.39 ? 436 SER A HA 1 ATOM 6706 H HB2 A SER A 1 424 ? 7.287 63.448 30.386 0.56 25.72 ? 436 SER A HB2 1 ATOM 6707 H HB2 B SER A 1 424 ? 6.855 61.973 30.792 0.44 25.68 ? 436 SER A HB2 1 ATOM 6708 H HB3 A SER A 1 424 ? 6.508 63.415 31.770 0.56 25.72 ? 436 SER A HB3 1 ATOM 6709 H HB3 B SER A 1 424 ? 7.283 63.471 30.488 0.44 25.68 ? 436 SER A HB3 1 ATOM 6710 H HG A SER A 1 424 ? 7.662 61.596 31.464 0.56 25.19 ? 436 SER A HG 1 ATOM 6711 H HG B SER A 1 424 ? 7.242 63.079 32.644 0.44 30.44 ? 436 SER A HG 1 ATOM 6712 N N . TYR A 1 425 ? 5.072 61.245 28.621 1.00 15.84 ? 437 TYR A N 1 ATOM 6713 C CA . TYR A 1 425 ? 5.160 60.599 27.317 1.00 14.33 ? 437 TYR A CA 1 ATOM 6714 C C . TYR A 1 425 ? 4.111 61.168 26.372 1.00 14.87 ? 437 TYR A C 1 ATOM 6715 O O . TYR A 1 425 ? 4.420 61.514 25.229 1.00 20.02 ? 437 TYR A O 1 ATOM 6716 C CB . TYR A 1 425 ? 5.027 59.069 27.458 1.00 16.54 ? 437 TYR A CB 1 ATOM 6717 C CG . TYR A 1 425 ? 5.110 58.336 26.146 1.00 17.53 ? 437 TYR A CG 1 ATOM 6718 C CD1 . TYR A 1 425 ? 3.992 58.218 25.345 1.00 19.20 ? 437 TYR A CD1 1 ATOM 6719 C CD2 . TYR A 1 425 ? 6.290 57.761 25.699 1.00 17.97 ? 437 TYR A CD2 1 ATOM 6720 C CE1 . TYR A 1 425 ? 4.053 57.619 24.152 1.00 16.70 ? 437 TYR A CE1 1 ATOM 6721 C CE2 . TYR A 1 425 ? 6.353 57.143 24.473 1.00 15.27 ? 437 TYR A CE2 1 ATOM 6722 C CZ . TYR A 1 425 ? 5.218 57.048 23.721 1.00 16.02 ? 437 TYR A CZ 1 ATOM 6723 O OH . TYR A 1 425 ? 5.238 56.434 22.507 1.00 17.44 ? 437 TYR A OH 1 ATOM 6724 H H . TYR A 1 425 ? 4.839 60.723 29.264 1.00 19.01 ? 437 TYR A H 1 ATOM 6725 H HA . TYR A 1 425 ? 6.032 60.785 26.936 1.00 17.20 ? 437 TYR A HA 1 ATOM 6726 H HB2 . TYR A 1 425 ? 5.743 58.743 28.026 1.00 19.85 ? 437 TYR A HB2 1 ATOM 6727 H HB3 . TYR A 1 425 ? 4.168 58.864 27.860 1.00 19.85 ? 437 TYR A HB3 1 ATOM 6728 H HD1 . TYR A 1 425 ? 3.193 58.605 25.620 1.00 23.05 ? 437 TYR A HD1 1 ATOM 6729 H HD2 . TYR A 1 425 ? 7.060 57.834 26.216 1.00 21.57 ? 437 TYR A HD2 1 ATOM 6730 H HE1 . TYR A 1 425 ? 3.286 57.551 23.631 1.00 20.05 ? 437 TYR A HE1 1 ATOM 6731 H HE2 . TYR A 1 425 ? 7.147 56.757 24.179 1.00 18.33 ? 437 TYR A HE2 1 ATOM 6732 H HH . TYR A 1 425 ? 6.004 56.124 22.355 1.00 20.93 ? 437 TYR A HH 1 ATOM 6733 N N . ASP A 1 426 ? 2.861 61.248 26.833 1.00 17.17 ? 438 ASP A N 1 ATOM 6734 C CA . ASP A 1 426 ? 1.789 61.755 25.979 1.00 19.06 ? 438 ASP A CA 1 ATOM 6735 C C . ASP A 1 426 ? 2.019 63.221 25.623 1.00 21.22 ? 438 ASP A C 1 ATOM 6736 O O . ASP A 1 426 ? 1.718 63.648 24.504 1.00 20.91 ? 438 ASP A O 1 ATOM 6737 C CB . ASP A 1 426 ? 0.443 61.533 26.668 1.00 20.70 ? 438 ASP A CB 1 ATOM 6738 C CG . ASP A 1 426 ? -0.004 60.065 26.585 1.00 23.76 ? 438 ASP A CG 1 ATOM 6739 O OD1 . ASP A 1 426 ? 0.673 59.256 25.896 1.00 27.34 ? 438 ASP A OD1 1 ATOM 6740 O OD2 . ASP A 1 426 ? -0.998 59.710 27.223 1.00 29.33 ? 438 ASP A OD2 1 ATOM 6741 H H . ASP A 1 426 ? 2.612 61.018 27.623 1.00 20.60 ? 438 ASP A H 1 ATOM 6742 H HA . ASP A 1 426 ? 1.783 61.249 25.152 1.00 22.88 ? 438 ASP A HA 1 ATOM 6743 H HB2 . ASP A 1 426 ? 0.521 61.773 27.605 1.00 24.84 ? 438 ASP A HB2 1 ATOM 6744 H HB3 . ASP A 1 426 ? -0.231 62.080 26.237 1.00 24.84 ? 438 ASP A HB3 1 ATOM 6745 N N . ASP A 1 427 ? 2.570 64.003 26.547 1.00 19.98 ? 439 ASP A N 1 ATOM 6746 C CA A ASP A 1 427 ? 2.909 65.385 26.218 0.35 24.51 ? 439 ASP A CA 1 ATOM 6747 C CA B ASP A 1 427 ? 2.911 65.386 26.217 0.65 24.43 ? 439 ASP A CA 1 ATOM 6748 C C . ASP A 1 427 ? 3.983 65.444 25.140 1.00 26.71 ? 439 ASP A C 1 ATOM 6749 O O . ASP A 1 427 ? 3.937 66.301 24.257 1.00 23.28 ? 439 ASP A O 1 ATOM 6750 C CB A ASP A 1 427 ? 3.361 66.131 27.473 0.35 25.08 ? 439 ASP A CB 1 ATOM 6751 C CB B ASP A 1 427 ? 3.380 66.142 27.460 0.65 25.06 ? 439 ASP A CB 1 ATOM 6752 C CG A ASP A 1 427 ? 2.195 66.565 28.343 0.35 27.64 ? 439 ASP A CG 1 ATOM 6753 C CG B ASP A 1 427 ? 3.769 67.579 27.146 0.65 29.12 ? 439 ASP A CG 1 ATOM 6754 O OD1 A ASP A 1 427 ? 1.118 66.893 27.793 0.35 33.71 ? 439 ASP A OD1 1 ATOM 6755 O OD1 B ASP A 1 427 ? 2.856 68.405 26.965 0.65 27.03 ? 439 ASP A OD1 1 ATOM 6756 O OD2 A ASP A 1 427 ? 2.356 66.590 29.581 0.35 36.11 ? 439 ASP A OD2 1 ATOM 6757 O OD2 B ASP A 1 427 ? 4.982 67.864 27.048 0.65 32.62 ? 439 ASP A OD2 1 ATOM 6758 H H . ASP A 1 427 ? 2.756 63.771 27.354 1.00 23.98 ? 439 ASP A H 1 ATOM 6759 H HA . ASP A 1 427 ? 2.119 65.830 25.876 1.00 29.32 ? 439 ASP A HA 1 ATOM 6760 H HB2 A ASP A 1 427 ? 3.930 65.548 28.000 0.35 30.10 ? 439 ASP A HB2 1 ATOM 6761 H HB2 B ASP A 1 427 ? 2.661 66.160 28.111 0.65 30.08 ? 439 ASP A HB2 1 ATOM 6762 H HB3 A ASP A 1 427 ? 3.852 66.925 27.209 0.35 30.10 ? 439 ASP A HB3 1 ATOM 6763 H HB3 B ASP A 1 427 ? 4.156 65.694 27.831 0.65 30.08 ? 439 ASP A HB3 1 ATOM 6764 N N . CYS A 1 428 ? 4.953 64.528 25.184 1.00 22.90 ? 440 CYS A N 1 ATOM 6765 C CA . CYS A 1 428 ? 5.979 64.492 24.151 1.00 20.84 ? 440 CYS A CA 1 ATOM 6766 C C . CYS A 1 428 ? 5.378 64.171 22.790 1.00 22.56 ? 440 CYS A C 1 ATOM 6767 O O . CYS A 1 428 ? 5.756 64.772 21.770 1.00 25.66 ? 440 CYS A O 1 ATOM 6768 C CB . CYS A 1 428 ? 7.046 63.463 24.540 1.00 25.36 ? 440 CYS A CB 1 ATOM 6769 S SG . CYS A 1 428 ? 8.459 63.336 23.409 1.00 25.54 ? 440 CYS A SG 1 ATOM 6770 H H . CYS A 1 428 ? 5.036 63.928 25.794 1.00 27.48 ? 440 CYS A H 1 ATOM 6771 H HA . CYS A 1 428 ? 6.405 65.361 24.095 1.00 25.01 ? 440 CYS A HA 1 ATOM 6772 H HB2 . CYS A 1 428 ? 7.393 63.697 25.415 1.00 30.43 ? 440 CYS A HB2 1 ATOM 6773 H HB3 . CYS A 1 428 ? 6.627 62.588 24.582 1.00 30.43 ? 440 CYS A HB3 1 ATOM 6774 N N . LEU A 1 429 ? 4.446 63.218 22.740 1.00 20.97 ? 441 LEU A N 1 ATOM 6775 C CA . LEU A 1 429 ? 3.754 62.949 21.489 1.00 22.87 ? 441 LEU A CA 1 ATOM 6776 C C . LEU A 1 429 ? 3.010 64.184 21.009 1.00 25.58 ? 441 LEU A C 1 ATOM 6777 O O . LEU A 1 429 ? 3.031 64.512 19.818 1.00 27.50 ? 441 LEU A O 1 ATOM 6778 C CB . LEU A 1 429 ? 2.755 61.799 21.647 1.00 24.05 ? 441 LEU A CB 1 ATOM 6779 C CG . LEU A 1 429 ? 3.270 60.369 21.752 1.00 23.63 ? 441 LEU A CG 1 ATOM 6780 C CD1 . LEU A 1 429 ? 2.084 59.412 21.686 1.00 30.37 ? 441 LEU A CD1 1 ATOM 6781 C CD2 . LEU A 1 429 ? 4.265 60.027 20.667 1.00 28.15 ? 441 LEU A CD2 1 ATOM 6782 H H . LEU A 1 429 ? 4.204 62.725 23.402 1.00 25.16 ? 441 LEU A H 1 ATOM 6783 H HA . LEU A 1 429 ? 4.402 62.700 20.811 1.00 27.45 ? 441 LEU A HA 1 ATOM 6784 H HB2 . LEU A 1 429 ? 2.240 61.967 22.451 1.00 28.86 ? 441 LEU A HB2 1 ATOM 6785 H HB3 . LEU A 1 429 ? 2.158 61.823 20.883 1.00 28.86 ? 441 LEU A HB3 1 ATOM 6786 H HG . LEU A 1 429 ? 3.706 60.251 22.610 1.00 28.36 ? 441 LEU A HG 1 ATOM 6787 H HD11 . LEU A 1 429 ? 2.411 58.501 21.752 1.00 36.44 ? 441 LEU A HD11 1 ATOM 6788 H HD12 . LEU A 1 429 ? 1.483 59.604 22.423 1.00 36.44 ? 441 LEU A HD12 1 ATOM 6789 H HD13 . LEU A 1 429 ? 1.624 59.538 20.841 1.00 36.44 ? 441 LEU A HD13 1 ATOM 6790 H HD21 . LEU A 1 429 ? 4.557 59.109 20.784 1.00 33.78 ? 441 LEU A HD21 1 ATOM 6791 H HD22 . LEU A 1 429 ? 3.838 60.131 19.802 1.00 33.78 ? 441 LEU A HD22 1 ATOM 6792 H HD23 . LEU A 1 429 ? 5.025 60.627 20.735 1.00 33.78 ? 441 LEU A HD23 1 ATOM 6793 N N . LYS A 1 430 ? 2.283 64.830 21.908 1.00 24.03 ? 442 LYS A N 1 ATOM 6794 C CA . LYS A 1 430 ? 1.544 66.033 21.525 1.00 30.13 ? 442 LYS A CA 1 ATOM 6795 C C . LYS A 1 430 ? 2.455 67.040 20.852 1.00 34.88 ? 442 LYS A C 1 ATOM 6796 O O . LYS A 1 430 ? 2.093 67.640 19.834 1.00 34.28 ? 442 LYS A O 1 ATOM 6797 C CB . LYS A 1 430 ? 0.905 66.686 22.732 1.00 29.66 ? 442 LYS A CB 1 ATOM 6798 C CG . LYS A 1 430 ? -0.311 65.994 23.257 1.00 35.86 ? 442 LYS A CG 1 ATOM 6799 C CD . LYS A 1 430 ? -0.844 66.696 24.503 1.00 55.29 ? 442 LYS A CD 1 ATOM 6800 C CE . LYS A 1 430 ? -1.429 68.079 24.188 1.00 47.86 ? 442 LYS A CE 1 ATOM 6801 N NZ . LYS A 1 430 ? -2.718 68.016 23.398 1.00 44.95 ? 442 LYS A NZ 1 ATOM 6802 H H . LYS A 1 430 ? 2.199 64.602 22.733 1.00 28.84 ? 442 LYS A H 1 ATOM 6803 H HA . LYS A 1 430 ? 0.841 65.793 20.901 1.00 36.16 ? 442 LYS A HA 1 ATOM 6804 H HB2 . LYS A 1 430 ? 1.558 66.713 23.449 1.00 35.60 ? 442 LYS A HB2 1 ATOM 6805 H HB3 . LYS A 1 430 ? 0.647 67.590 22.493 1.00 35.60 ? 442 LYS A HB3 1 ATOM 6806 H HG2 . LYS A 1 430 ? -1.006 66.004 22.579 1.00 43.03 ? 442 LYS A HG2 1 ATOM 6807 H HG3 . LYS A 1 430 ? -0.085 65.081 23.494 1.00 43.03 ? 442 LYS A HG3 1 ATOM 6808 H HD2 . LYS A 1 430 ? -1.546 66.154 24.896 1.00 66.35 ? 442 LYS A HD2 1 ATOM 6809 H HD3 . LYS A 1 430 ? -0.119 66.812 25.136 1.00 66.35 ? 442 LYS A HD3 1 ATOM 6810 H HE2 . LYS A 1 430 ? -1.612 68.541 25.021 1.00 57.43 ? 442 LYS A HE2 1 ATOM 6811 H HE3 . LYS A 1 430 ? -0.784 68.582 23.666 1.00 57.43 ? 442 LYS A HE3 1 ATOM 6812 H HZ1 . LYS A 1 430 ? -3.019 68.838 23.239 1.00 53.94 ? 442 LYS A HZ1 1 ATOM 6813 H HZ2 . LYS A 1 430 ? -2.579 67.604 22.621 1.00 53.94 ? 442 LYS A HZ2 1 ATOM 6814 H HZ3 . LYS A 1 430 ? -3.334 67.566 23.857 1.00 53.94 ? 442 LYS A HZ3 1 ATOM 6815 N N . GLN A 1 431 ? 3.649 67.226 21.399 1.00 29.97 ? 443 GLN A N 1 ATOM 6816 C CA . GLN A 1 431 ? 4.551 68.230 20.870 1.00 30.61 ? 443 GLN A CA 1 ATOM 6817 C C . GLN A 1 431 ? 5.245 67.803 19.589 1.00 34.64 ? 443 GLN A C 1 ATOM 6818 O O . GLN A 1 431 ? 5.590 68.665 18.785 1.00 34.68 ? 443 GLN A O 1 ATOM 6819 C CB . GLN A 1 431 ? 5.611 68.584 21.898 1.00 34.50 ? 443 GLN A CB 1 ATOM 6820 C CG . GLN A 1 431 ? 5.089 69.227 23.156 1.00 40.18 ? 443 GLN A CG 1 ATOM 6821 C CD . GLN A 1 431 ? 6.219 69.590 24.087 1.00 59.70 ? 443 GLN A CD 1 ATOM 6822 O OE1 . GLN A 1 431 ? 7.155 70.293 23.696 1.00 74.94 ? 443 GLN A OE1 1 ATOM 6823 N NE2 . GLN A 1 431 ? 6.161 69.090 25.317 1.00 60.13 ? 443 GLN A NE2 1 ATOM 6824 H H . GLN A 1 431 ? 3.956 66.787 22.072 1.00 35.97 ? 443 GLN A H 1 ATOM 6825 H HA . GLN A 1 431 ? 4.044 69.035 20.677 1.00 36.73 ? 443 GLN A HA 1 ATOM 6826 H HB2 . GLN A 1 431 ? 6.074 67.771 22.155 1.00 41.39 ? 443 GLN A HB2 1 ATOM 6827 H HB3 . GLN A 1 431 ? 6.240 69.202 21.493 1.00 41.39 ? 443 GLN A HB3 1 ATOM 6828 H HG2 . GLN A 1 431 ? 4.609 70.038 22.928 1.00 48.22 ? 443 GLN A HG2 1 ATOM 6829 H HG3 . GLN A 1 431 ? 4.503 68.605 23.616 1.00 48.22 ? 443 GLN A HG3 1 ATOM 6830 H HE21 . GLN A 1 431 ? 5.501 68.588 25.546 1.00 72.15 ? 443 GLN A HE21 1 ATOM 6831 H HE22 . GLN A 1 431 ? 6.782 69.269 25.884 1.00 72.15 ? 443 GLN A HE22 1 ATOM 6832 N N . HIS A 1 432 ? 5.477 66.504 19.368 1.00 28.63 ? 444 HIS A N 1 ATOM 6833 C CA . HIS A 1 432 ? 6.421 66.095 18.343 1.00 27.71 ? 444 HIS A CA 1 ATOM 6834 C C . HIS A 1 432 ? 5.868 65.156 17.299 1.00 29.12 ? 444 HIS A C 1 ATOM 6835 O O . HIS A 1 432 ? 6.581 64.871 16.332 1.00 38.85 ? 444 HIS A O 1 ATOM 6836 C CB . HIS A 1 432 ? 7.657 65.449 18.989 1.00 33.77 ? 444 HIS A CB 1 ATOM 6837 C CG . HIS A 1 432 ? 8.364 66.368 19.919 1.00 34.92 ? 444 HIS A CG 1 ATOM 6838 N ND1 . HIS A 1 432 ? 9.024 67.494 19.475 1.00 43.56 ? 444 HIS A ND1 1 ATOM 6839 C CD2 . HIS A 1 432 ? 8.463 66.378 21.269 1.00 37.06 ? 444 HIS A CD2 1 ATOM 6840 C CE1 . HIS A 1 432 ? 9.525 68.141 20.512 1.00 44.91 ? 444 HIS A CE1 1 ATOM 6841 N NE2 . HIS A 1 432 ? 9.198 67.486 21.611 1.00 42.31 ? 444 HIS A NE2 1 ATOM 6842 H H . HIS A 1 432 ? 5.105 65.856 19.794 1.00 34.35 ? 444 HIS A H 1 ATOM 6843 H HA . HIS A 1 432 ? 6.723 66.891 17.879 1.00 33.25 ? 444 HIS A HA 1 ATOM 6844 H HB2 . HIS A 1 432 ? 7.380 64.667 19.492 1.00 40.52 ? 444 HIS A HB2 1 ATOM 6845 H HB3 . HIS A 1 432 ? 8.280 65.190 18.291 1.00 40.52 ? 444 HIS A HB3 1 ATOM 6846 H HD2 . HIS A 1 432 ? 8.110 65.746 21.853 1.00 44.47 ? 444 HIS A HD2 1 ATOM 6847 H HE1 . HIS A 1 432 ? 10.024 68.925 20.474 1.00 53.90 ? 444 HIS A HE1 1 ATOM 6848 H HE2 . HIS A 1 432 ? 9.416 67.714 22.411 1.00 50.78 ? 444 HIS A HE2 1 ATOM 6849 N N . LEU A 1 433 ? 4.639 64.674 17.436 1.00 31.81 ? 445 LEU A N 1 ATOM 6850 C CA . LEU A 1 433 ? 4.091 63.809 16.394 1.00 37.09 ? 445 LEU A CA 1 ATOM 6851 C C . LEU A 1 433 ? 3.994 64.572 15.065 1.00 50.23 ? 445 LEU A C 1 ATOM 6852 O O . LEU A 1 433 ? 3.778 65.793 15.057 1.00 50.03 ? 445 LEU A O 1 ATOM 6853 C CB . LEU A 1 433 ? 2.720 63.277 16.780 1.00 37.94 ? 445 LEU A CB 1 ATOM 6854 C CG . LEU A 1 433 ? 2.650 61.879 17.368 1.00 35.61 ? 445 LEU A CG 1 ATOM 6855 C CD1 . LEU A 1 433 ? 1.190 61.549 17.746 1.00 37.80 ? 445 LEU A CD1 1 ATOM 6856 C CD2 . LEU A 1 433 ? 3.203 60.811 16.428 1.00 36.21 ? 445 LEU A CD2 1 ATOM 6857 H H . LEU A 1 433 ? 4.114 64.824 18.100 1.00 38.18 ? 445 LEU A H 1 ATOM 6858 H HA . LEU A 1 433 ? 4.683 63.052 16.265 1.00 44.51 ? 445 LEU A HA 1 ATOM 6859 H HB2 . LEU A 1 433 ? 2.337 63.880 17.436 1.00 45.53 ? 445 LEU A HB2 1 ATOM 6860 H HB3 . LEU A 1 433 ? 2.163 63.278 15.985 1.00 45.53 ? 445 LEU A HB3 1 ATOM 6861 H HG . LEU A 1 433 ? 3.178 61.858 18.182 1.00 42.73 ? 445 LEU A HG 1 ATOM 6862 H HD11 . LEU A 1 433 ? 1.156 60.655 18.121 1.00 45.35 ? 445 LEU A HD11 1 ATOM 6863 H HD12 . LEU A 1 433 ? 0.879 62.194 18.400 1.00 45.35 ? 445 LEU A HD12 1 ATOM 6864 H HD13 . LEU A 1 433 ? 0.640 61.595 16.948 1.00 45.35 ? 445 LEU A HD13 1 ATOM 6865 H HD21 . LEU A 1 433 ? 3.131 59.945 16.858 1.00 43.45 ? 445 LEU A HD21 1 ATOM 6866 H HD22 . LEU A 1 433 ? 2.686 60.817 15.606 1.00 43.45 ? 445 LEU A HD22 1 ATOM 6867 H HD23 . LEU A 1 433 ? 4.132 61.010 16.236 1.00 43.45 ? 445 LEU A HD23 1 HETATM 6868 ZN ZN . ZN B 2 . ? 13.828 37.443 25.858 1.00 20.26 ? 501 ZN A ZN 1 HETATM 6869 ZN ZN . ZN C 2 . ? 11.146 38.532 28.142 1.00 20.11 ? 502 ZN A ZN 1 HETATM 6870 C C1 . NAG D 3 . ? 10.737 26.031 3.246 1.00 56.18 ? 503 NAG A C1 1 HETATM 6871 C C2 . NAG D 3 . ? 9.309 26.318 2.772 1.00 55.30 ? 503 NAG A C2 1 HETATM 6872 C C3 . NAG D 3 . ? 8.862 25.302 1.724 1.00 64.21 ? 503 NAG A C3 1 HETATM 6873 C C4 . NAG D 3 . ? 9.894 25.180 0.615 1.00 70.66 ? 503 NAG A C4 1 HETATM 6874 C C5 . NAG D 3 . ? 11.266 24.887 1.217 1.00 69.76 ? 503 NAG A C5 1 HETATM 6875 C C6 . NAG D 3 . ? 12.374 24.925 0.202 1.00 64.56 ? 503 NAG A C6 1 HETATM 6876 C C7 . NAG D 3 . ? 7.960 27.438 4.472 1.00 37.01 ? 503 NAG A C7 1 HETATM 6877 C C8 . NAG D 3 . ? 7.013 27.267 5.613 1.00 44.00 ? 503 NAG A C8 1 HETATM 6878 N N2 . NAG D 3 . ? 8.390 26.315 3.896 1.00 42.11 ? 503 NAG A N2 1 HETATM 6879 O O3 . NAG D 3 . ? 7.630 25.727 1.151 1.00 64.76 ? 503 NAG A O3 1 HETATM 6880 O O4 . NAG D 3 . ? 9.472 24.149 -0.267 1.00 85.03 ? 503 NAG A O4 1 HETATM 6881 O O5 . NAG D 3 . ? 11.585 25.925 2.151 1.00 61.17 ? 503 NAG A O5 1 HETATM 6882 O O6 . NAG D 3 . ? 12.454 26.244 -0.341 1.00 72.18 ? 503 NAG A O6 1 HETATM 6883 O O7 . NAG D 3 . ? 8.332 28.544 4.091 1.00 42.10 ? 503 NAG A O7 1 HETATM 6884 H H1 . NAG D 3 . ? 10.748 25.192 3.745 1.00 67.42 ? 503 NAG A H1 1 HETATM 6885 H H2 . NAG D 3 . ? 9.294 27.203 2.360 1.00 66.37 ? 503 NAG A H2 1 HETATM 6886 H H3 . NAG D 3 . ? 8.739 24.432 2.149 1.00 77.05 ? 503 NAG A H3 1 HETATM 6887 H H4 . NAG D 3 . ? 9.936 26.023 0.124 1.00 84.79 ? 503 NAG A H4 1 HETATM 6888 H H5 . NAG D 3 . ? 11.256 24.022 1.669 1.00 83.71 ? 503 NAG A H5 1 HETATM 6889 H H61 . NAG D 3 . ? 13.220 24.696 0.632 1.00 77.48 ? 503 NAG A H61 1 HETATM 6890 H H62 . NAG D 3 . ? 12.186 24.287 -0.512 1.00 77.48 ? 503 NAG A H62 1 HETATM 6891 H H81 . NAG D 3 . ? 6.762 28.143 5.962 1.00 52.80 ? 503 NAG A H81 1 HETATM 6892 H H82 . NAG D 3 . ? 7.444 26.747 6.318 1.00 52.80 ? 503 NAG A H82 1 HETATM 6893 H H83 . NAG D 3 . ? 6.215 26.798 5.305 1.00 52.80 ? 503 NAG A H83 1 HETATM 6894 H HN2 . NAG D 3 . ? 8.086 25.515 4.212 1.00 50.53 ? 503 NAG A HN2 1 HETATM 6895 H HO3 . NAG D 3 . ? 6.971 25.589 1.730 1.00 77.72 ? 503 NAG A HO3 1 HETATM 6896 C C1 . FUC E 4 . ? 13.078 26.226 -1.620 1.00 81.45 ? 504 FUC A C1 1 HETATM 6897 C C2 . FUC E 4 . ? 12.384 27.362 -2.492 1.00 86.21 ? 504 FUC A C2 1 HETATM 6898 C C3 . FUC E 4 . ? 13.050 28.740 -2.411 1.00 90.02 ? 504 FUC A C3 1 HETATM 6899 C C4 . FUC E 4 . ? 14.581 28.618 -2.366 1.00 105.33 ? 504 FUC A C4 1 HETATM 6900 C C5 . FUC E 4 . ? 14.959 27.701 -1.205 1.00 98.46 ? 504 FUC A C5 1 HETATM 6901 C C6 . FUC E 4 . ? 16.456 27.526 -1.000 1.00 75.36 ? 504 FUC A C6 1 HETATM 6902 O O2 . FUC E 4 . ? 11.003 27.497 -2.171 1.00 95.72 ? 504 FUC A O2 1 HETATM 6903 O O3 . FUC E 4 . ? 12.682 29.467 -3.588 1.00 88.89 ? 504 FUC A O3 1 HETATM 6904 O O4 . FUC E 4 . ? 15.080 28.103 -3.588 1.00 100.88 ? 504 FUC A O4 1 HETATM 6905 O O5 . FUC E 4 . ? 14.466 26.377 -1.435 1.00 97.77 ? 504 FUC A O5 1 HETATM 6906 H H1 . FUC E 4 . ? 12.948 25.241 -2.085 1.00 97.74 ? 504 FUC A H1 1 HETATM 6907 H H2 . FUC E 4 . ? 12.425 27.039 -3.536 1.00 103.45 ? 504 FUC A H2 1 HETATM 6908 H H3 . FUC E 4 . ? 12.698 29.262 -1.508 1.00 108.02 ? 504 FUC A H3 1 HETATM 6909 H H4 . FUC E 4 . ? 15.012 29.614 -2.160 1.00 126.39 ? 504 FUC A H4 1 HETATM 6910 H H5 . FUC E 4 . ? 14.486 28.105 -0.298 1.00 118.16 ? 504 FUC A H5 1 HETATM 6911 H H61 . FUC E 4 . ? 16.644 26.850 -0.161 1.00 90.44 ? 504 FUC A H61 1 HETATM 6912 H H62 . FUC E 4 . ? 16.919 28.493 -0.796 1.00 90.44 ? 504 FUC A H62 1 HETATM 6913 H H63 . FUC E 4 . ? 16.915 27.101 -1.899 1.00 90.44 ? 504 FUC A H63 1 HETATM 6914 H HO2 . FUC E 4 . ? 10.976 27.812 -1.254 1.00 114.87 ? 504 FUC A HO2 1 HETATM 6915 H HO3 . FUC E 4 . ? 13.011 30.369 -3.456 1.00 106.67 ? 504 FUC A HO3 1 HETATM 6916 H HO4 . FUC E 4 . ? 14.675 27.226 -3.675 1.00 121.05 ? 504 FUC A HO4 1 HETATM 6917 C C1 . NAG F 3 . ? 9.799 24.439 -1.660 1.00 97.32 ? 505 NAG A C1 1 HETATM 6918 C C2 . NAG F 3 . ? 9.194 23.292 -2.379 1.00 98.85 ? 505 NAG A C2 1 HETATM 6919 C C3 . NAG F 3 . ? 9.777 23.252 -3.768 1.00 95.58 ? 505 NAG A C3 1 HETATM 6920 C C4 . NAG F 3 . ? 9.551 24.589 -4.476 1.00 104.57 ? 505 NAG A C4 1 HETATM 6921 C C5 . NAG F 3 . ? 9.163 25.807 -3.590 1.00 101.25 ? 505 NAG A C5 1 HETATM 6922 C C6 . NAG F 3 . ? 7.755 26.283 -3.854 1.00 96.99 ? 505 NAG A C6 1 HETATM 6923 C C7 . NAG F 3 . ? 10.620 21.499 -1.454 1.00 84.77 ? 505 NAG A C7 1 HETATM 6924 C C8 . NAG F 3 . ? 10.633 20.239 -0.644 1.00 66.01 ? 505 NAG A C8 1 HETATM 6925 N N2 . NAG F 3 . ? 9.417 22.046 -1.658 1.00 84.16 ? 505 NAG A N2 1 HETATM 6926 O O3 . NAG F 3 . ? 9.172 22.198 -4.510 1.00 99.73 ? 505 NAG A O3 1 HETATM 6927 O O4 . NAG F 3 . ? 10.722 24.939 -5.208 1.00 97.87 ? 505 NAG A O4 1 HETATM 6928 O O5 . NAG F 3 . ? 9.247 25.637 -2.155 1.00 94.79 ? 505 NAG A O5 1 HETATM 6929 O O6 . NAG F 3 . ? 6.818 25.501 -3.126 1.00 84.16 ? 505 NAG A O6 1 HETATM 6930 O O7 . NAG F 3 . ? 11.647 21.993 -1.909 1.00 81.25 ? 505 NAG A O7 1 HETATM 6931 H H1 . NAG F 3 . ? 10.767 24.439 -1.786 1.00 116.79 ? 505 NAG A H1 1 HETATM 6932 H H2 . NAG F 3 . ? 8.233 23.445 -2.455 1.00 118.62 ? 505 NAG A H2 1 HETATM 6933 H H3 . NAG F 3 . ? 10.737 23.085 -3.704 1.00 114.69 ? 505 NAG A H3 1 HETATM 6934 H H4 . NAG F 3 . ? 8.830 24.457 -5.121 1.00 125.49 ? 505 NAG A H4 1 HETATM 6935 H H5 . NAG F 3 . ? 9.765 26.537 -3.829 1.00 121.50 ? 505 NAG A H5 1 HETATM 6936 H H61 . NAG F 3 . ? 7.564 26.207 -4.809 1.00 116.38 ? 505 NAG A H61 1 HETATM 6937 H H62 . NAG F 3 . ? 7.674 27.217 -3.583 1.00 116.38 ? 505 NAG A H62 1 HETATM 6938 H H81 . NAG F 3 . ? 11.551 19.921 -0.552 1.00 79.22 ? 505 NAG A H81 1 HETATM 6939 H H82 . NAG F 3 . ? 10.096 19.559 -1.092 1.00 79.22 ? 505 NAG A H82 1 HETATM 6940 H H83 . NAG F 3 . ? 10.260 20.418 0.241 1.00 79.22 ? 505 NAG A H83 1 HETATM 6941 H HN2 . NAG F 3 . ? 8.694 21.639 -1.280 1.00 101.00 ? 505 NAG A HN2 1 HETATM 6942 H HO3 . NAG F 3 . ? 9.168 21.456 -4.022 1.00 119.67 ? 505 NAG A HO3 1 HETATM 6943 H HO4 . NAG F 3 . ? 10.529 25.590 -5.781 1.00 117.44 ? 505 NAG A HO4 1 HETATM 6944 H HO6 . NAG F 3 . ? 6.883 24.652 -3.377 1.00 100.99 ? 505 NAG A HO6 1 HETATM 6945 C C1 . NAG G 3 . ? 23.728 22.141 28.647 1.00 42.20 ? 506 NAG A C1 1 HETATM 6946 C C2 . NAG G 3 . ? 24.676 21.056 29.183 1.00 42.04 ? 506 NAG A C2 1 HETATM 6947 C C3 . NAG G 3 . ? 25.700 20.651 28.133 1.00 44.43 ? 506 NAG A C3 1 HETATM 6948 C C4 . NAG G 3 . ? 25.044 20.325 26.804 1.00 49.68 ? 506 NAG A C4 1 HETATM 6949 C C5 . NAG G 3 . ? 24.133 21.473 26.369 1.00 48.58 ? 506 NAG A C5 1 HETATM 6950 C C6 . NAG G 3 . ? 23.358 21.191 25.099 1.00 49.14 ? 506 NAG A C6 1 HETATM 6951 C C7 . NAG G 3 . ? 24.950 21.270 31.609 1.00 28.35 ? 506 NAG A C7 1 HETATM 6952 C C8 . NAG G 3 . ? 25.781 21.853 32.709 1.00 41.50 ? 506 NAG A C8 1 HETATM 6953 N N2 . NAG G 3 . ? 25.364 21.529 30.369 1.00 34.12 ? 506 NAG A N2 1 HETATM 6954 O O3 . NAG G 3 . ? 26.380 19.496 28.611 1.00 51.17 ? 506 NAG A O3 1 HETATM 6955 O O4 . NAG G 3 . ? 26.085 20.077 25.861 1.00 72.62 ? 506 NAG A O4 1 HETATM 6956 O O5 . NAG G 3 . ? 23.162 21.721 27.398 1.00 37.46 ? 506 NAG A O5 1 HETATM 6957 O O6 . NAG G 3 . ? 22.315 20.247 25.295 1.00 58.61 ? 506 NAG A O6 1 HETATM 6958 O O7 . NAG G 3 . ? 23.933 20.624 31.834 1.00 39.99 ? 506 NAG A O7 1 HETATM 6959 H H1 . NAG G 3 . ? 24.228 22.968 28.512 1.00 50.63 ? 506 NAG A H1 1 HETATM 6960 H H2 . NAG G 3 . ? 24.148 20.269 29.416 1.00 50.45 ? 506 NAG A H2 1 HETATM 6961 H H3 . NAG G 3 . ? 26.342 21.376 28.009 1.00 53.32 ? 506 NAG A H3 1 HETATM 6962 H H4 . NAG G 3 . ? 24.509 19.516 26.905 1.00 59.62 ? 506 NAG A H4 1 HETATM 6963 H H5 . NAG G 3 . ? 24.672 22.275 26.241 1.00 58.29 ? 506 NAG A H5 1 HETATM 6964 H H61 . NAG G 3 . ? 22.970 22.026 24.775 1.00 58.97 ? 506 NAG A H61 1 HETATM 6965 H H62 . NAG G 3 . ? 23.973 20.846 24.425 1.00 58.97 ? 506 NAG A H62 1 HETATM 6966 H H81 . NAG G 3 . ? 26.691 21.506 32.648 1.00 49.80 ? 506 NAG A H81 1 HETATM 6967 H H82 . NAG G 3 . ? 25.796 22.825 32.625 1.00 49.80 ? 506 NAG A H82 1 HETATM 6968 H H83 . NAG G 3 . ? 25.397 21.606 33.572 1.00 49.80 ? 506 NAG A H83 1 HETATM 6969 H HN2 . NAG G 3 . ? 26.123 22.023 30.261 1.00 40.94 ? 506 NAG A HN2 1 HETATM 6970 H HO3 . NAG G 3 . ? 26.741 19.671 29.403 1.00 61.40 ? 506 NAG A HO3 1 HETATM 6971 C C1 . NAG H 3 . ? 25.631 18.888 25.132 1.00 90.72 ? 507 NAG A C1 1 HETATM 6972 C C2 . NAG H 3 . ? 26.496 18.617 23.934 1.00 90.29 ? 507 NAG A C2 1 HETATM 6973 C C3 . NAG H 3 . ? 25.762 17.609 23.076 1.00 101.77 ? 507 NAG A C3 1 HETATM 6974 C C4 . NAG H 3 . ? 25.499 16.340 23.891 1.00 108.31 ? 507 NAG A C4 1 HETATM 6975 C C5 . NAG H 3 . ? 25.068 16.573 25.365 1.00 99.45 ? 507 NAG A C5 1 HETATM 6976 C C6 . NAG H 3 . ? 25.436 15.404 26.249 1.00 93.09 ? 507 NAG A C6 1 HETATM 6977 C C7 . NAG H 3 . ? 26.016 20.521 22.421 1.00 57.75 ? 507 NAG A C7 1 HETATM 6978 C C8 . NAG H 3 . ? 26.605 21.713 21.735 1.00 55.65 ? 507 NAG A C8 1 HETATM 6979 N N2 . NAG H 3 . ? 26.855 19.818 23.190 1.00 62.78 ? 507 NAG A N2 1 HETATM 6980 O O3 . NAG H 3 . ? 26.486 17.316 21.884 1.00 91.38 ? 507 NAG A O3 1 HETATM 6981 O O4 . NAG H 3 . ? 24.445 15.613 23.271 1.00 106.81 ? 507 NAG A O4 1 HETATM 6982 O O5 . NAG H 3 . ? 25.658 17.733 25.986 1.00 102.97 ? 507 NAG A O5 1 HETATM 6983 O O6 . NAG H 3 . ? 24.543 15.274 27.345 1.00 99.24 ? 507 NAG A O6 1 HETATM 6984 O O7 . NAG H 3 . ? 24.839 20.207 22.286 1.00 61.09 ? 507 NAG A O7 1 HETATM 6985 H H1 . NAG H 3 . ? 24.715 19.034 24.830 1.00 108.86 ? 507 NAG A H1 1 HETATM 6986 H H2 . NAG H 3 . ? 27.319 18.196 24.247 1.00 108.35 ? 507 NAG A H2 1 HETATM 6987 H H3 . NAG H 3 . ? 24.901 17.994 22.824 1.00 122.12 ? 507 NAG A H3 1 HETATM 6988 H H4 . NAG H 3 . ? 26.306 15.790 23.884 1.00 129.98 ? 507 NAG A H4 1 HETATM 6989 H H5 . NAG H 3 . ? 24.097 16.677 25.384 1.00 119.34 ? 507 NAG A H5 1 HETATM 6990 H H61 . NAG H 3 . ? 26.341 15.535 26.589 1.00 111.71 ? 507 NAG A H61 1 HETATM 6991 H H62 . NAG H 3 . ? 25.410 14.584 25.719 1.00 111.71 ? 507 NAG A H62 1 HETATM 6992 H H81 . NAG H 3 . ? 26.949 22.336 22.403 1.00 66.78 ? 507 NAG A H81 1 HETATM 6993 H H82 . NAG H 3 . ? 25.917 22.155 21.202 1.00 66.78 ? 507 NAG A H82 1 HETATM 6994 H H83 . NAG H 3 . ? 27.333 21.426 21.152 1.00 66.78 ? 507 NAG A H83 1 HETATM 6995 H HN2 . NAG H 3 . ? 27.720 20.104 23.241 1.00 75.34 ? 507 NAG A HN2 1 HETATM 6996 H HO3 . NAG H 3 . ? 25.935 17.344 21.188 1.00 109.66 ? 507 NAG A HO3 1 HETATM 6997 H HO4 . NAG H 3 . ? 23.663 15.919 23.562 1.00 128.17 ? 507 NAG A HO4 1 HETATM 6998 H HO6 . NAG H 3 . ? 24.851 15.741 28.035 1.00 119.09 ? 507 NAG A HO6 1 HETATM 6999 C C1 . BMA I 5 . ? 28.898 45.173 0.092 1.00 88.08 ? 508 BMA A C1 1 HETATM 7000 C C2 . BMA I 5 . ? 29.756 45.361 -1.138 1.00 78.39 ? 508 BMA A C2 1 HETATM 7001 C C3 . BMA I 5 . ? 29.150 46.423 -2.038 1.00 89.16 ? 508 BMA A C3 1 HETATM 7002 C C4 . BMA I 5 . ? 27.609 46.214 -2.266 1.00 83.86 ? 508 BMA A C4 1 HETATM 7003 C C5 . BMA I 5 . ? 26.847 45.765 -0.982 1.00 78.15 ? 508 BMA A C5 1 HETATM 7004 C C6 . BMA I 5 . ? 25.471 45.160 -1.284 1.00 72.98 ? 508 BMA A C6 1 HETATM 7005 O O2 . BMA I 5 . ? 29.794 44.137 -1.890 1.00 67.71 ? 508 BMA A O2 1 HETATM 7006 O O3 . BMA I 5 . ? 29.845 46.406 -3.290 1.00 103.03 ? 508 BMA A O3 1 HETATM 7007 O O4 . BMA I 5 . ? 27.038 47.425 -2.719 1.00 82.73 ? 508 BMA A O4 1 HETATM 7008 O O5 . BMA I 5 . ? 27.603 44.760 -0.290 1.00 92.42 ? 508 BMA A O5 1 HETATM 7009 O O6 . BMA I 5 . ? 24.609 45.466 -0.177 1.00 102.09 ? 508 BMA A O6 1 HETATM 7010 H H1 . BMA I 5 . ? 28.838 46.121 0.660 1.00 105.69 ? 508 BMA A H1 1 HETATM 7011 H H2 . BMA I 5 . ? 30.769 45.659 -0.825 1.00 94.06 ? 508 BMA A H2 1 HETATM 7012 H H3 . BMA I 5 . ? 29.306 47.419 -1.604 1.00 106.99 ? 508 BMA A H3 1 HETATM 7013 H H4 . BMA I 5 . ? 27.486 45.418 -3.018 1.00 100.63 ? 508 BMA A H4 1 HETATM 7014 H H5 . BMA I 5 . ? 26.698 46.637 -0.324 1.00 93.78 ? 508 BMA A H5 1 HETATM 7015 H H61 . BMA I 5 . ? 25.587 44.075 -1.426 1.00 87.57 ? 508 BMA A H61 1 HETATM 7016 H H62 . BMA I 5 . ? 25.111 45.599 -2.224 1.00 87.57 ? 508 BMA A H62 1 HETATM 7017 H HO2 . BMA I 5 . ? 29.756 44.396 -2.824 1.00 81.25 ? 508 BMA A HO2 1 HETATM 7018 H HO4 . BMA I 5 . ? 26.152 47.455 -2.325 1.00 99.28 ? 508 BMA A HO4 1 HETATM 7019 C C1 . MAN J 6 . ? 30.456 47.650 -3.731 1.00 101.29 ? 509 MAN A C1 1 HETATM 7020 C C2 . MAN J 6 . ? 31.592 47.229 -4.719 1.00 97.87 ? 509 MAN A C2 1 HETATM 7021 C C3 . MAN J 6 . ? 32.742 46.580 -3.941 1.00 103.48 ? 509 MAN A C3 1 HETATM 7022 C C4 . MAN J 6 . ? 33.291 47.521 -2.855 1.00 103.67 ? 509 MAN A C4 1 HETATM 7023 C C5 . MAN J 6 . ? 32.185 48.134 -1.953 1.00 100.60 ? 509 MAN A C5 1 HETATM 7024 C C6 . MAN J 6 . ? 32.671 49.426 -1.293 1.00 94.32 ? 509 MAN A C6 1 HETATM 7025 O O2 . MAN J 6 . ? 32.135 48.364 -5.402 1.00 83.89 ? 509 MAN A O2 1 HETATM 7026 O O3 . MAN J 6 . ? 33.812 46.158 -4.815 1.00 76.15 ? 509 MAN A O3 1 HETATM 7027 O O4 . MAN J 6 . ? 34.185 46.786 -2.016 1.00 88.03 ? 509 MAN A O4 1 HETATM 7028 O O5 . MAN J 6 . ? 30.960 48.495 -2.675 1.00 99.27 ? 509 MAN A O5 1 HETATM 7029 O O6 . MAN J 6 . ? 31.765 49.775 -0.250 1.00 87.72 ? 509 MAN A O6 1 HETATM 7030 H H1 . MAN J 6 . ? 29.712 48.274 -4.251 1.00 121.55 ? 509 MAN A H1 1 HETATM 7031 H H2 . MAN J 6 . ? 31.180 46.507 -5.436 1.00 117.45 ? 509 MAN A H2 1 HETATM 7032 H H3 . MAN J 6 . ? 32.369 45.675 -3.450 1.00 124.17 ? 509 MAN A H3 1 HETATM 7033 H H4 . MAN J 6 . ? 33.819 48.351 -3.355 1.00 124.40 ? 509 MAN A H4 1 HETATM 7034 H H5 . MAN J 6 . ? 31.944 47.417 -1.157 1.00 120.73 ? 509 MAN A H5 1 HETATM 7035 H H61 . MAN J 6 . ? 32.723 50.212 -2.062 1.00 113.18 ? 509 MAN A H61 1 HETATM 7036 H H62 . MAN J 6 . ? 33.685 49.247 -0.913 1.00 113.18 ? 509 MAN A H62 1 HETATM 7037 H HO2 . MAN J 6 . ? 32.615 48.062 -6.182 1.00 100.67 ? 509 MAN A HO2 1 HETATM 7038 H HO3 . MAN J 6 . ? 34.517 45.846 -4.225 1.00 91.38 ? 509 MAN A HO3 1 HETATM 7039 H HO4 . MAN J 6 . ? 34.505 47.427 -1.362 1.00 105.64 ? 509 MAN A HO4 1 HETATM 7040 H HO6 . MAN J 6 . ? 30.873 49.568 -0.558 1.00 105.26 ? 509 MAN A HO6 1 HETATM 7041 C C1 . MAN K 6 . ? 23.643 44.435 0.224 1.00 102.62 ? 510 MAN A C1 1 HETATM 7042 C C2 . MAN K 6 . ? 24.417 43.267 1.026 1.00 101.19 ? 510 MAN A C2 1 HETATM 7043 C C3 . MAN K 6 . ? 24.704 41.992 0.192 1.00 100.71 ? 510 MAN A C3 1 HETATM 7044 C C4 . MAN K 6 . ? 23.538 41.611 -0.711 1.00 102.38 ? 510 MAN A C4 1 HETATM 7045 C C5 . MAN K 6 . ? 23.187 42.769 -1.654 1.00 113.72 ? 510 MAN A C5 1 HETATM 7046 C C6 . MAN K 6 . ? 21.985 42.449 -2.533 1.00 111.10 ? 510 MAN A C6 1 HETATM 7047 O O2 . MAN K 6 . ? 23.633 42.833 2.149 1.00 89.74 ? 510 MAN A O2 1 HETATM 7048 O O3 . MAN K 6 . ? 25.044 40.870 1.028 1.00 79.04 ? 510 MAN A O3 1 HETATM 7049 O O4 . MAN K 6 . ? 23.920 40.480 -1.491 1.00 91.22 ? 510 MAN A O4 1 HETATM 7050 O O5 . MAN K 6 . ? 22.831 43.967 -0.910 1.00 108.05 ? 510 MAN A O5 1 HETATM 7051 O O6 . MAN K 6 . ? 22.450 41.849 -3.747 1.00 111.14 ? 510 MAN A O6 1 HETATM 7052 H H1 . MAN K 6 . ? 22.898 44.894 0.892 1.00 123.14 ? 510 MAN A H1 1 HETATM 7053 H H2 . MAN K 6 . ? 25.371 43.680 1.376 1.00 121.43 ? 510 MAN A H2 1 HETATM 7054 H H3 . MAN K 6 . ? 25.576 42.178 -0.442 1.00 120.85 ? 510 MAN A H3 1 HETATM 7055 H H4 . MAN K 6 . ? 22.659 41.389 -0.083 1.00 122.86 ? 510 MAN A H4 1 HETATM 7056 H H5 . MAN K 6 . ? 24.046 42.974 -2.306 1.00 136.47 ? 510 MAN A H5 1 HETATM 7057 H H61 . MAN K 6 . ? 21.437 43.384 -2.730 1.00 133.32 ? 510 MAN A H61 1 HETATM 7058 H H62 . MAN K 6 . ? 21.326 41.776 -1.969 1.00 133.32 ? 510 MAN A H62 1 HETATM 7059 H HO2 . MAN K 6 . ? 24.002 43.214 2.955 1.00 107.69 ? 510 MAN A HO2 1 HETATM 7060 H HO3 . MAN K 6 . ? 25.975 40.677 0.832 1.00 94.85 ? 510 MAN A HO3 1 HETATM 7061 H HO4 . MAN K 6 . ? 23.143 40.271 -2.034 1.00 109.47 ? 510 MAN A HO4 1 HETATM 7062 H HO6 . MAN K 6 . ? 21.689 41.442 -4.181 1.00 133.37 ? 510 MAN A HO6 1 HETATM 7063 C C1 . NAG L 3 . ? 29.170 41.706 9.768 1.00 35.08 ? 511 NAG A C1 1 HETATM 7064 C C2 . NAG L 3 . ? 29.331 43.151 9.343 1.00 37.60 ? 511 NAG A C2 1 HETATM 7065 C C3 . NAG L 3 . ? 28.645 43.360 7.986 1.00 42.92 ? 511 NAG A C3 1 HETATM 7066 C C4 . NAG L 3 . ? 29.083 42.296 6.974 1.00 35.39 ? 511 NAG A C4 1 HETATM 7067 C C5 . NAG L 3 . ? 29.025 40.889 7.578 1.00 39.57 ? 511 NAG A C5 1 HETATM 7068 C C6 . NAG L 3 . ? 29.615 39.808 6.698 1.00 40.08 ? 511 NAG A C6 1 HETATM 7069 C C7 . NAG L 3 . ? 29.426 45.106 10.865 1.00 35.04 ? 511 NAG A C7 1 HETATM 7070 C C8 . NAG L 3 . ? 28.671 45.910 11.884 1.00 32.64 ? 511 NAG A C8 1 HETATM 7071 N N2 . NAG L 3 . ? 28.776 44.051 10.350 1.00 33.33 ? 511 NAG A N2 1 HETATM 7072 O O3 . NAG L 3 . ? 28.942 44.669 7.514 1.00 35.68 ? 511 NAG A O3 1 HETATM 7073 O O4 . NAG L 3 . ? 28.183 42.290 5.873 1.00 43.08 ? 511 NAG A O4 1 HETATM 7074 O O5 . NAG L 3 . ? 29.762 40.859 8.802 1.00 34.08 ? 511 NAG A O5 1 HETATM 7075 O O6 . NAG L 3 . ? 30.957 40.119 6.351 1.00 65.30 ? 511 NAG A O6 1 HETATM 7076 O O7 . NAG L 3 . ? 30.565 45.403 10.525 1.00 33.36 ? 511 NAG A O7 1 HETATM 7077 H H1 . NAG L 3 . ? 28.220 41.496 9.842 1.00 42.09 ? 511 NAG A H1 1 HETATM 7078 H H2 . NAG L 3 . ? 30.283 43.341 9.239 1.00 45.13 ? 511 NAG A H2 1 HETATM 7079 H H3 . NAG L 3 . ? 27.679 43.288 8.113 1.00 51.51 ? 511 NAG A H3 1 HETATM 7080 H H4 . NAG L 3 . ? 29.988 42.487 6.663 1.00 42.47 ? 511 NAG A H4 1 HETATM 7081 H H5 . NAG L 3 . ? 28.093 40.667 7.766 1.00 47.48 ? 511 NAG A H5 1 HETATM 7082 H H61 . NAG L 3 . ? 29.596 38.958 7.177 1.00 48.10 ? 511 NAG A H61 1 HETATM 7083 H H62 . NAG L 3 . ? 29.083 39.730 5.884 1.00 48.10 ? 511 NAG A H62 1 HETATM 7084 H H81 . NAG L 3 . ? 28.438 45.340 12.640 1.00 39.16 ? 511 NAG A H81 1 HETATM 7085 H H82 . NAG L 3 . ? 27.857 46.265 11.479 1.00 39.16 ? 511 NAG A H82 1 HETATM 7086 H H83 . NAG L 3 . ? 29.229 46.649 12.193 1.00 39.16 ? 511 NAG A H83 1 HETATM 7087 H HN2 . NAG L 3 . ? 27.928 43.889 10.645 1.00 40.00 ? 511 NAG A HN2 1 HETATM 7088 H HO3 . NAG L 3 . ? 28.290 44.946 6.979 1.00 42.82 ? 511 NAG A HO3 1 HETATM 7089 H HO6 . NAG L 3 . ? 31.271 39.500 5.798 1.00 78.36 ? 511 NAG A HO6 1 HETATM 7090 C C1 . NAG M 3 . ? 28.831 42.534 4.621 1.00 52.82 ? 512 NAG A C1 1 HETATM 7091 C C2 . NAG M 3 . ? 27.896 42.084 3.484 1.00 46.37 ? 512 NAG A C2 1 HETATM 7092 C C3 . NAG M 3 . ? 28.496 42.439 2.131 1.00 61.09 ? 512 NAG A C3 1 HETATM 7093 C C4 . NAG M 3 . ? 28.879 43.910 2.082 1.00 66.20 ? 512 NAG A C4 1 HETATM 7094 C C5 . NAG M 3 . ? 29.781 44.250 3.263 1.00 63.44 ? 512 NAG A C5 1 HETATM 7095 C C6 . NAG M 3 . ? 30.127 45.718 3.340 1.00 72.67 ? 512 NAG A C6 1 HETATM 7096 C C7 . NAG M 3 . ? 26.489 40.131 3.986 1.00 52.48 ? 512 NAG A C7 1 HETATM 7097 C C8 . NAG M 3 . ? 26.408 38.633 3.983 1.00 48.17 ? 512 NAG A C8 1 HETATM 7098 N N2 . NAG M 3 . ? 27.640 40.655 3.553 1.00 43.42 ? 512 NAG A N2 1 HETATM 7099 O O3 . NAG M 3 . ? 27.548 42.132 1.114 1.00 65.03 ? 512 NAG A O3 1 HETATM 7100 O O4 . NAG M 3 . ? 29.581 44.175 0.875 1.00 81.40 ? 512 NAG A O4 1 HETATM 7101 O O5 . NAG M 3 . ? 29.116 43.914 4.489 1.00 53.93 ? 512 NAG A O5 1 HETATM 7102 O O6 . NAG M 3 . ? 29.101 46.458 3.989 1.00 78.26 ? 512 NAG A O6 1 HETATM 7103 O O7 . NAG M 3 . ? 25.558 40.834 4.367 1.00 46.49 ? 512 NAG A O7 1 HETATM 7104 H H1 . NAG M 3 . ? 29.663 42.026 4.577 1.00 63.39 ? 512 NAG A H1 1 HETATM 7105 H H2 . NAG M 3 . ? 27.048 42.559 3.576 1.00 55.64 ? 512 NAG A H2 1 HETATM 7106 H H3 . NAG M 3 . ? 29.297 41.899 1.989 1.00 73.31 ? 512 NAG A H3 1 HETATM 7107 H H4 . NAG M 3 . ? 28.073 44.459 2.118 1.00 79.45 ? 512 NAG A H4 1 HETATM 7108 H H5 . NAG M 3 . ? 30.605 43.731 3.194 1.00 76.13 ? 512 NAG A H5 1 HETATM 7109 H H61 . NAG M 3 . ? 30.248 46.066 2.437 1.00 87.21 ? 512 NAG A H61 1 HETATM 7110 H H62 . NAG M 3 . ? 30.960 45.824 3.838 1.00 87.21 ? 512 NAG A H62 1 HETATM 7111 H H81 . NAG M 3 . ? 26.531 38.303 3.073 1.00 57.80 ? 512 NAG A H81 1 HETATM 7112 H H82 . NAG M 3 . ? 27.106 38.269 4.559 1.00 57.80 ? 512 NAG A H82 1 HETATM 7113 H H83 . NAG M 3 . ? 25.533 38.355 4.315 1.00 57.80 ? 512 NAG A H83 1 HETATM 7114 H HN2 . NAG M 3 . ? 28.298 40.085 3.281 1.00 52.10 ? 512 NAG A HN2 1 HETATM 7115 H HO3 . NAG M 3 . ? 27.391 42.858 0.628 1.00 78.03 ? 512 NAG A HO3 1 HETATM 7116 H HO6 . NAG M 3 . ? 28.312 46.096 3.802 1.00 93.91 ? 512 NAG A HO6 1 HETATM 7117 C C1 . FUC N 4 . ? 14.443 53.745 61.147 1.00 86.99 ? 513 FUC A C1 1 HETATM 7118 C C2 . FUC N 4 . ? 13.895 52.590 62.055 1.00 94.91 ? 513 FUC A C2 1 HETATM 7119 C C3 . FUC N 4 . ? 13.404 51.377 61.248 1.00 105.06 ? 513 FUC A C3 1 HETATM 7120 C C4 . FUC N 4 . ? 14.522 50.830 60.303 1.00 99.18 ? 513 FUC A C4 1 HETATM 7121 C C5 . FUC N 4 . ? 15.556 51.901 59.905 1.00 88.95 ? 513 FUC A C5 1 HETATM 7122 C C6 . FUC N 4 . ? 16.881 51.828 60.729 1.00 70.78 ? 513 FUC A C6 1 HETATM 7123 O O2 . FUC N 4 . ? 12.902 53.054 62.979 1.00 81.96 ? 513 FUC A O2 1 HETATM 7124 O O3 . FUC N 4 . ? 13.080 50.341 62.190 1.00 100.33 ? 513 FUC A O3 1 HETATM 7125 O O4 . FUC N 4 . ? 15.183 49.743 60.919 1.00 116.70 ? 513 FUC A O4 1 HETATM 7126 O O5 . FUC N 4 . ? 15.012 53.259 59.948 1.00 76.58 ? 513 FUC A O5 1 HETATM 7127 H H1 . FUC N 4 . ? 15.245 54.297 61.653 1.00 104.39 ? 513 FUC A H1 1 HETATM 7128 H H2 . FUC N 4 . ? 14.734 52.247 62.669 1.00 113.89 ? 513 FUC A H2 1 HETATM 7129 H H3 . FUC N 4 . ? 12.521 51.661 60.655 1.00 126.07 ? 513 FUC A H3 1 HETATM 7130 H H4 . FUC N 4 . ? 14.040 50.491 59.370 1.00 119.01 ? 513 FUC A H4 1 HETATM 7131 H H5 . FUC N 4 . ? 15.791 51.692 58.851 1.00 106.74 ? 513 FUC A H5 1 HETATM 7132 H H61 . FUC N 4 . ? 17.568 52.616 60.408 1.00 84.94 ? 513 FUC A H61 1 HETATM 7133 H H62 . FUC N 4 . ? 17.355 50.855 60.585 1.00 84.94 ? 513 FUC A H62 1 HETATM 7134 H H63 . FUC N 4 . ? 16.672 51.960 61.796 1.00 84.94 ? 513 FUC A H63 1 HETATM 7135 H HO2 . FUC N 4 . ? 12.776 53.995 62.777 1.00 98.35 ? 513 FUC A HO2 1 HETATM 7136 H HO3 . FUC N 4 . ? 13.451 49.524 61.821 1.00 120.40 ? 513 FUC A HO3 1 HETATM 7137 H HO4 . FUC N 4 . ? 15.748 49.367 60.226 1.00 140.04 ? 513 FUC A HO4 1 HETATM 7138 C C1 . NAG O 3 . ? 11.924 54.639 56.852 1.00 75.42 ? 514 NAG A C1 1 HETATM 7139 C C2 . NAG O 3 . ? 10.460 54.562 57.305 1.00 76.62 ? 514 NAG A C2 1 HETATM 7140 C C3 . NAG O 3 . ? 10.158 55.617 58.372 1.00 92.93 ? 514 NAG A C3 1 HETATM 7141 C C4 . NAG O 3 . ? 11.230 55.637 59.452 1.00 99.68 ? 514 NAG A C4 1 HETATM 7142 C C5 . NAG O 3 . ? 12.616 55.659 58.817 1.00 92.20 ? 514 NAG A C5 1 HETATM 7143 C C6 . NAG O 3 . ? 13.721 55.554 59.834 1.00 85.66 ? 514 NAG A C6 1 HETATM 7144 C C7 . NAG O 3 . ? 8.685 53.843 55.772 1.00 78.24 ? 514 NAG A C7 1 HETATM 7145 C C8 . NAG O 3 . ? 7.885 54.200 54.553 1.00 74.88 ? 514 NAG A C8 1 HETATM 7146 N N2 . NAG O 3 . ? 9.589 54.745 56.158 1.00 72.16 ? 514 NAG A N2 1 HETATM 7147 O O3 . NAG O 3 . ? 8.898 55.322 58.964 1.00 86.87 ? 514 NAG A O3 1 HETATM 7148 O O4 . NAG O 3 . ? 11.086 56.799 60.265 1.00 104.58 ? 514 NAG A O4 1 HETATM 7149 O O5 . NAG O 3 . ? 12.758 54.531 57.946 1.00 75.48 ? 514 NAG A O5 1 HETATM 7150 O O6 . NAG O 3 . ? 13.348 54.631 60.847 1.00 92.47 ? 514 NAG A O6 1 HETATM 7151 O O7 . NAG O 3 . ? 8.519 52.788 56.381 1.00 79.37 ? 514 NAG A O7 1 HETATM 7152 H H1 . NAG O 3 . ? 12.081 55.496 56.412 1.00 90.50 ? 514 NAG A H1 1 HETATM 7153 H H2 . NAG O 3 . ? 10.298 53.679 57.689 1.00 91.95 ? 514 NAG A H2 1 HETATM 7154 H H3 . NAG O 3 . ? 10.114 56.495 57.949 1.00 111.52 ? 514 NAG A H3 1 HETATM 7155 H H4 . NAG O 3 . ? 11.143 54.840 60.009 1.00 119.62 ? 514 NAG A H4 1 HETATM 7156 H H5 . NAG O 3 . ? 12.724 56.481 58.303 1.00 110.64 ? 514 NAG A H5 1 HETATM 7157 H H61 . NAG O 3 . ? 13.878 56.430 60.234 1.00 102.79 ? 514 NAG A H61 1 HETATM 7158 H H62 . NAG O 3 . ? 14.536 55.245 59.397 1.00 102.79 ? 514 NAG A H62 1 HETATM 7159 H H81 . NAG O 3 . ? 7.256 53.481 54.354 1.00 89.85 ? 514 NAG A H81 1 HETATM 7160 H H82 . NAG O 3 . ? 8.487 54.325 53.795 1.00 89.85 ? 514 NAG A H82 1 HETATM 7161 H H83 . NAG O 3 . ? 7.393 55.027 54.717 1.00 89.85 ? 514 NAG A H83 1 HETATM 7162 H HN2 . NAG O 3 . ? 9.674 55.509 55.667 1.00 86.59 ? 514 NAG A HN2 1 HETATM 7163 H HO3 . NAG O 3 . ? 8.564 54.585 58.598 1.00 104.24 ? 514 NAG A HO3 1 HETATM 7164 C C1 . NAG P 3 . ? 10.244 56.620 61.425 1.00 102.80 ? 515 NAG A C1 1 HETATM 7165 C C2 . NAG P 3 . ? 10.817 57.465 62.559 1.00 113.18 ? 515 NAG A C2 1 HETATM 7166 C C3 . NAG P 3 . ? 9.943 57.336 63.804 1.00 121.12 ? 515 NAG A C3 1 HETATM 7167 C C4 . NAG P 3 . ? 8.497 57.685 63.474 1.00 121.83 ? 515 NAG A C4 1 HETATM 7168 C C5 . NAG P 3 . ? 8.000 56.870 62.279 1.00 123.00 ? 515 NAG A C5 1 HETATM 7169 C C6 . NAG P 3 . ? 6.633 57.309 61.798 1.00 109.64 ? 515 NAG A C6 1 HETATM 7170 C C7 . NAG P 3 . ? 13.239 57.888 62.610 1.00 95.85 ? 515 NAG A C7 1 HETATM 7171 C C8 . NAG P 3 . ? 14.584 57.339 62.983 1.00 75.41 ? 515 NAG A C8 1 HETATM 7172 N N2 . NAG P 3 . ? 12.192 57.090 62.855 1.00 101.29 ? 515 NAG A N2 1 HETATM 7173 O O3 . NAG P 3 . ? 10.432 58.205 64.821 1.00 98.52 ? 515 NAG A O3 1 HETATM 7174 O O4 . NAG P 3 . ? 7.670 57.420 64.603 1.00 112.73 ? 515 NAG A O4 1 HETATM 7175 O O5 . NAG P 3 . ? 8.895 57.020 61.165 1.00 118.70 ? 515 NAG A O5 1 HETATM 7176 O O6 . NAG P 3 . ? 6.011 56.319 60.989 1.00 103.21 ? 515 NAG A O6 1 HETATM 7177 O O7 . NAG P 3 . ? 13.107 59.001 62.106 1.00 77.65 ? 515 NAG A O7 1 HETATM 7178 H H1 . NAG P 3 . ? 10.254 55.681 61.690 1.00 123.37 ? 515 NAG A H1 1 HETATM 7179 H H2 . NAG P 3 . ? 10.805 58.399 62.278 1.00 135.81 ? 515 NAG A H2 1 HETATM 7180 H H3 . NAG P 3 . ? 9.982 56.416 64.126 1.00 145.35 ? 515 NAG A H3 1 HETATM 7181 H H4 . NAG P 3 . ? 8.441 58.635 63.256 1.00 146.20 ? 515 NAG A H4 1 HETATM 7182 H H5 . NAG P 3 . ? 7.960 55.928 62.532 1.00 147.60 ? 515 NAG A H5 1 HETATM 7183 H H61 . NAG P 3 . ? 6.729 58.130 61.278 1.00 131.57 ? 515 NAG A H61 1 HETATM 7184 H H62 . NAG P 3 . ? 6.067 57.488 62.572 1.00 131.57 ? 515 NAG A H62 1 HETATM 7185 H H81 . NAG P 3 . ? 14.604 57.151 63.941 1.00 90.50 ? 515 NAG A H81 1 HETATM 7186 H H82 . NAG P 3 . ? 15.274 57.994 62.765 1.00 90.50 ? 515 NAG A H82 1 HETATM 7187 H H83 . NAG P 3 . ? 14.748 56.515 62.487 1.00 90.50 ? 515 NAG A H83 1 HETATM 7188 H HN2 . NAG P 3 . ? 12.347 56.274 63.232 1.00 121.55 ? 515 NAG A HN2 1 HETATM 7189 H HO3 . NAG P 3 . ? 9.755 58.658 65.174 1.00 118.22 ? 515 NAG A HO3 1 HETATM 7190 H HO4 . NAG P 3 . ? 7.412 58.187 64.968 1.00 135.28 ? 515 NAG A HO4 1 HETATM 7191 H HO6 . NAG P 3 . ? 5.129 56.396 61.054 1.00 123.85 ? 515 NAG A HO6 1 HETATM 7192 C C1 . GOL Q 7 . ? 10.373 33.954 17.326 1.00 32.43 ? 516 GOL A C1 1 HETATM 7193 O O1 . GOL Q 7 . ? 9.643 33.229 16.373 1.00 51.04 ? 516 GOL A O1 1 HETATM 7194 C C2 . GOL Q 7 . ? 9.453 34.893 18.090 1.00 47.78 ? 516 GOL A C2 1 HETATM 7195 O O2 . GOL Q 7 . ? 8.551 34.143 18.899 1.00 43.39 ? 516 GOL A O2 1 HETATM 7196 C C3 . GOL Q 7 . ? 10.297 35.828 18.955 1.00 40.48 ? 516 GOL A C3 1 HETATM 7197 O O3 . GOL Q 7 . ? 9.424 36.636 19.729 1.00 61.51 ? 516 GOL A O3 1 HETATM 7198 H H11 . GOL Q 7 . ? 10.853 33.265 18.021 1.00 38.92 ? 516 GOL A H11 1 HETATM 7199 H H12 . GOL Q 7 . ? 11.153 34.530 16.828 1.00 38.92 ? 516 GOL A H12 1 HETATM 7200 H HO1 . GOL Q 7 . ? 10.254 32.676 15.843 1.00 61.25 ? 516 GOL A HO1 1 HETATM 7201 H H2 . GOL Q 7 . ? 8.893 35.492 17.372 1.00 57.34 ? 516 GOL A H2 1 HETATM 7202 H HO2 . GOL Q 7 . ? 9.059 33.617 19.553 1.00 52.07 ? 516 GOL A HO2 1 HETATM 7203 H H31 . GOL Q 7 . ? 10.945 35.246 19.610 1.00 48.58 ? 516 GOL A H31 1 HETATM 7204 H H32 . GOL Q 7 . ? 10.923 36.457 18.322 1.00 48.58 ? 516 GOL A H32 1 HETATM 7205 H HO3 . GOL Q 7 . ? 8.746 36.070 20.153 1.00 73.81 ? 516 GOL A HO3 1 HETATM 7206 C C1 . GOL R 7 . ? 36.779 38.439 35.929 1.00 65.22 ? 517 GOL A C1 1 HETATM 7207 O O1 . GOL R 7 . ? 36.342 38.088 37.220 1.00 58.59 ? 517 GOL A O1 1 HETATM 7208 C C2 . GOL R 7 . ? 35.704 38.071 34.908 1.00 55.98 ? 517 GOL A C2 1 HETATM 7209 O O2 . GOL R 7 . ? 35.579 39.100 33.917 1.00 32.43 ? 517 GOL A O2 1 HETATM 7210 C C3 . GOL R 7 . ? 36.041 36.696 34.314 1.00 52.22 ? 517 GOL A C3 1 HETATM 7211 O O3 . GOL R 7 . ? 36.573 36.829 33.015 1.00 68.08 ? 517 GOL A O3 1 HETATM 7212 H H11 . GOL R 7 . ? 36.977 39.510 35.885 1.00 78.27 ? 517 GOL A H11 1 HETATM 7213 H H12 . GOL R 7 . ? 37.704 37.912 35.696 1.00 78.27 ? 517 GOL A H12 1 HETATM 7214 H HO1 . GOL R 7 . ? 37.058 38.264 37.866 1.00 70.30 ? 517 GOL A HO1 1 HETATM 7215 H H2 . GOL R 7 . ? 34.758 37.979 35.441 1.00 67.17 ? 517 GOL A H2 1 HETATM 7216 H HO2 . GOL R 7 . ? 36.420 39.179 33.420 1.00 38.91 ? 517 GOL A HO2 1 HETATM 7217 H H31 . GOL R 7 . ? 36.764 36.191 34.954 1.00 62.67 ? 517 GOL A H31 1 HETATM 7218 H H32 . GOL R 7 . ? 35.140 36.085 34.278 1.00 62.67 ? 517 GOL A H32 1 HETATM 7219 H HO3 . GOL R 7 . ? 35.852 36.747 32.356 1.00 81.70 ? 517 GOL A HO3 1 HETATM 7220 C C1 . GOL S 7 . ? -4.048 46.748 38.420 1.00 59.21 ? 518 GOL A C1 1 HETATM 7221 O O1 . GOL S 7 . ? -4.041 45.555 39.164 1.00 75.53 ? 518 GOL A O1 1 HETATM 7222 C C2 . GOL S 7 . ? -5.296 47.566 38.747 1.00 59.81 ? 518 GOL A C2 1 HETATM 7223 O O2 . GOL S 7 . ? -6.415 47.045 38.063 1.00 78.82 ? 518 GOL A O2 1 HETATM 7224 C C3 . GOL S 7 . ? -5.595 47.554 40.245 1.00 53.49 ? 518 GOL A C3 1 HETATM 7225 O O3 . GOL S 7 . ? -6.917 48.003 40.448 1.00 67.89 ? 518 GOL A O3 1 HETATM 7226 H H11 . GOL S 7 . ? -3.157 47.331 38.654 1.00 71.05 ? 518 GOL A H11 1 HETATM 7227 H H12 . GOL S 7 . ? -4.031 46.517 37.355 1.00 71.05 ? 518 GOL A H12 1 HETATM 7228 H HO1 . GOL S 7 . ? -3.271 45.009 38.898 1.00 90.63 ? 518 GOL A HO1 1 HETATM 7229 H H2 . GOL S 7 . ? -5.125 48.597 38.437 1.00 71.77 ? 518 GOL A H2 1 HETATM 7230 H HO2 . GOL S 7 . ? -6.590 46.132 38.371 1.00 94.59 ? 518 GOL A HO2 1 HETATM 7231 H H31 . GOL S 7 . ? -5.481 46.543 40.638 1.00 64.19 ? 518 GOL A H31 1 HETATM 7232 H H32 . GOL S 7 . ? -4.896 48.206 40.768 1.00 64.19 ? 518 GOL A H32 1 HETATM 7233 H HO3 . GOL S 7 . ? -7.505 47.607 39.771 1.00 81.46 ? 518 GOL A HO3 1 HETATM 7234 C C1 . GOL T 7 . ? 37.859 48.799 28.845 1.00 63.56 ? 519 GOL A C1 1 HETATM 7235 O O1 . GOL T 7 . ? 37.200 47.586 29.131 1.00 65.56 ? 519 GOL A O1 1 HETATM 7236 C C2 . GOL T 7 . ? 37.250 49.427 27.595 1.00 73.87 ? 519 GOL A C2 1 HETATM 7237 O O2 . GOL T 7 . ? 37.315 50.836 27.719 1.00 70.25 ? 519 GOL A O2 1 HETATM 7238 C C3 . GOL T 7 . ? 37.945 48.903 26.334 1.00 60.03 ? 519 GOL A C3 1 HETATM 7239 O O3 . GOL T 7 . ? 38.057 49.929 25.367 1.00 70.45 ? 519 GOL A O3 1 HETATM 7240 H H11 . GOL T 7 . ? 37.756 49.482 29.688 1.00 76.27 ? 519 GOL A H11 1 HETATM 7241 H H12 . GOL T 7 . ? 38.921 48.614 28.684 1.00 76.27 ? 519 GOL A H12 1 HETATM 7242 H H2 . GOL T 7 . ? 36.204 49.125 27.547 1.00 88.64 ? 519 GOL A H2 1 HETATM 7243 H HO2 . GOL T 7 . ? 38.253 51.118 27.746 1.00 84.30 ? 519 GOL A HO2 1 HETATM 7244 H H31 . GOL T 7 . ? 38.938 48.534 26.592 1.00 72.03 ? 519 GOL A H31 1 HETATM 7245 H H32 . GOL T 7 . ? 37.374 48.072 25.921 1.00 72.03 ? 519 GOL A H32 1 HETATM 7246 H HO3 . GOL T 7 . ? 38.683 49.651 24.667 1.00 84.54 ? 519 GOL A HO3 1 HETATM 7247 P PB . AP2 U 8 . ? 10.971 37.992 25.429 1.00 27.03 ? 520 AP2 A PB 1 HETATM 7248 O O1B . AP2 U 8 . ? 11.569 36.809 24.718 1.00 26.38 ? 520 AP2 A O1B 1 HETATM 7249 O O2B . AP2 U 8 . ? 9.977 37.692 26.504 1.00 19.77 -1 520 AP2 A O2B 1 HETATM 7250 O O3B . AP2 U 8 . ? 12.189 38.752 26.092 1.00 20.73 -1 520 AP2 A O3B 1 HETATM 7251 C C3A . AP2 U 8 . ? 10.245 39.217 24.282 1.00 27.00 ? 520 AP2 A C3A 1 HETATM 7252 P PA . AP2 U 8 . ? 9.100 38.274 23.179 1.00 56.76 ? 520 AP2 A PA 1 HETATM 7253 O O1A . AP2 U 8 . ? 9.901 37.791 21.980 1.00 55.09 -1 520 AP2 A O1A 1 HETATM 7254 O O2A . AP2 U 8 . ? 8.631 37.107 24.033 1.00 33.54 ? 520 AP2 A O2A 1 HETATM 7255 O "O5'" . AP2 U 8 . ? 7.933 39.281 22.595 1.00 68.74 ? 520 AP2 A "O5'" 1 HETATM 7256 C "C5'" . AP2 U 8 . ? 6.923 39.880 23.353 1.00 60.27 ? 520 AP2 A "C5'" 1 HETATM 7257 C "C4'" . AP2 U 8 . ? 5.869 40.383 22.387 1.00 66.72 ? 520 AP2 A "C4'" 1 HETATM 7258 O "O4'" . AP2 U 8 . ? 6.142 41.559 21.921 1.00 63.63 ? 520 AP2 A "O4'" 1 HETATM 7259 C "C3'" . AP2 U 8 . ? 5.781 39.373 21.049 1.00 75.06 ? 520 AP2 A "C3'" 1 HETATM 7260 O "O3'" . AP2 U 8 . ? 4.401 39.301 20.592 1.00 80.26 ? 520 AP2 A "O3'" 1 HETATM 7261 C "C2'" . AP2 U 8 . ? 6.534 39.875 20.143 1.00 80.87 ? 520 AP2 A "C2'" 1 HETATM 7262 O "O2'" . AP2 U 8 . ? 5.984 39.580 18.778 1.00 71.79 ? 520 AP2 A "O2'" 1 HETATM 7263 C "C1'" . AP2 U 8 . ? 6.516 41.430 20.398 1.00 74.33 ? 520 AP2 A "C1'" 1 HETATM 7264 N N9 . AP2 U 8 . ? 7.673 42.048 20.180 1.00 65.33 ? 520 AP2 A N9 1 HETATM 7265 C C8 . AP2 U 8 . ? 8.704 41.987 21.010 1.00 69.10 ? 520 AP2 A C8 1 HETATM 7266 N N7 . AP2 U 8 . ? 9.705 42.727 20.559 1.00 59.73 ? 520 AP2 A N7 1 HETATM 7267 C C5 . AP2 U 8 . ? 9.338 43.302 19.406 1.00 53.65 ? 520 AP2 A C5 1 HETATM 7268 C C6 . AP2 U 8 . ? 9.976 44.181 18.497 1.00 58.21 ? 520 AP2 A C6 1 HETATM 7269 N N6 . AP2 U 8 . ? 11.337 44.634 18.790 1.00 29.26 ? 520 AP2 A N6 1 HETATM 7270 N N1 . AP2 U 8 . ? 9.318 44.591 17.409 1.00 35.95 ? 520 AP2 A N1 1 HETATM 7271 C C2 . AP2 U 8 . ? 8.067 44.162 17.194 1.00 41.96 ? 520 AP2 A C2 1 HETATM 7272 N N3 . AP2 U 8 . ? 7.454 43.334 18.040 1.00 53.42 ? 520 AP2 A N3 1 HETATM 7273 C C4 . AP2 U 8 . ? 8.047 42.879 19.163 1.00 48.59 ? 520 AP2 A C4 1 HETATM 7274 H H3A1 . AP2 U 8 . ? 9.751 39.887 24.779 1.00 32.40 ? 520 AP2 A H3A1 1 HETATM 7275 H H3A2 . AP2 U 8 . ? 10.944 39.636 23.756 1.00 32.40 ? 520 AP2 A H3A2 1 HETATM 7276 H "H5'1" . AP2 U 8 . ? 7.287 40.620 23.864 1.00 72.33 ? 520 AP2 A "H5'1" 1 HETATM 7277 H "H5'2" . AP2 U 8 . ? 6.532 39.226 23.953 1.00 72.33 ? 520 AP2 A "H5'2" 1 HETATM 7278 H "H4'" . AP2 U 8 . ? 5.033 40.405 22.814 1.00 80.06 ? 520 AP2 A "H4'" 1 HETATM 7279 H "H3'" . AP2 U 8 . ? 6.090 38.517 21.278 1.00 90.07 ? 520 AP2 A "H3'" 1 HETATM 7280 H "HO3'" . AP2 U 8 . ? 4.256 38.537 20.248 1.00 96.31 ? 520 AP2 A "HO3'" 1 HETATM 7281 H "H2'" . AP2 U 8 . ? 7.408 39.543 20.226 1.00 97.04 ? 520 AP2 A "H2'" 1 HETATM 7282 H "HO2'" . AP2 U 8 . ? 5.155 39.767 18.761 1.00 86.15 ? 520 AP2 A "HO2'" 1 HETATM 7283 H "H1'" . AP2 U 8 . ? 5.842 41.824 19.876 1.00 89.20 ? 520 AP2 A "H1'" 1 HETATM 7284 H H8 . AP2 U 8 . ? 8.722 41.494 21.797 1.00 82.92 ? 520 AP2 A H8 1 HETATM 7285 H HN61 . AP2 U 8 . ? 11.739 44.361 19.509 1.00 35.12 ? 520 AP2 A HN61 1 HETATM 7286 H HN62 . AP2 U 8 . ? 11.741 45.175 18.245 1.00 35.12 ? 520 AP2 A HN62 1 HETATM 7287 H H2 . AP2 U 8 . ? 7.615 44.448 16.434 1.00 50.35 ? 520 AP2 A H2 1 HETATM 7288 O O . HOH V 9 . ? 18.585 22.749 3.190 1.00 49.20 ? 601 HOH A O 1 HETATM 7289 O O . HOH V 9 . ? 7.050 71.139 34.153 1.00 41.32 ? 602 HOH A O 1 HETATM 7290 O O . HOH V 9 . ? 9.723 69.043 39.505 1.00 30.95 ? 603 HOH A O 1 HETATM 7291 O O . HOH V 9 . ? 7.702 26.241 47.017 1.00 47.49 ? 604 HOH A O 1 HETATM 7292 O O . HOH V 9 . ? 21.131 54.953 11.704 1.00 39.18 ? 605 HOH A O 1 HETATM 7293 O O . HOH V 9 . ? 30.687 60.389 42.401 1.00 48.65 ? 606 HOH A O 1 HETATM 7294 O O . HOH V 9 . ? 38.334 46.564 37.474 1.00 42.71 ? 607 HOH A O 1 HETATM 7295 O O . HOH V 9 . ? 5.275 56.165 45.690 1.00 37.99 ? 608 HOH A O 1 HETATM 7296 O O . HOH V 9 . ? 11.171 29.483 3.101 1.00 45.68 ? 609 HOH A O 1 HETATM 7297 O O . HOH V 9 . ? 21.970 24.636 45.920 1.00 52.00 ? 610 HOH A O 1 HETATM 7298 O O . HOH V 9 . ? 6.260 37.791 25.956 1.00 41.20 ? 611 HOH A O 1 HETATM 7299 O O . HOH V 9 . ? 13.141 70.957 32.528 1.00 52.98 ? 612 HOH A O 1 HETATM 7300 O O . HOH V 9 . ? 16.915 40.106 8.575 1.00 49.29 ? 613 HOH A O 1 HETATM 7301 O O . HOH V 9 . ? 10.622 38.323 6.762 1.00 57.25 ? 614 HOH A O 1 HETATM 7302 O O . HOH V 9 . ? 22.448 21.233 33.780 1.00 36.00 ? 615 HOH A O 1 HETATM 7303 O O . HOH V 9 . ? 20.405 33.844 9.883 1.00 28.77 ? 616 HOH A O 1 HETATM 7304 O O . HOH V 9 . ? 24.380 47.766 20.883 1.00 17.24 ? 617 HOH A O 1 HETATM 7305 O O . HOH V 9 . ? 5.628 52.616 48.303 1.00 35.97 ? 618 HOH A O 1 HETATM 7306 O O . HOH V 9 . ? 14.263 62.369 30.794 1.00 27.82 ? 619 HOH A O 1 HETATM 7307 O O . HOH V 9 . ? 12.260 31.762 6.116 1.00 48.22 ? 620 HOH A O 1 HETATM 7308 O O . HOH V 9 . ? 27.667 24.800 40.899 1.00 47.70 ? 621 HOH A O 1 HETATM 7309 O O . HOH V 9 . ? 11.494 32.898 14.630 1.00 24.79 ? 622 HOH A O 1 HETATM 7310 O O . HOH V 9 . ? 3.771 44.088 43.498 1.00 22.25 ? 623 HOH A O 1 HETATM 7311 O O . HOH V 9 . ? 21.607 57.235 58.314 1.00 56.17 ? 624 HOH A O 1 HETATM 7312 O O . HOH V 9 . ? 26.087 47.580 10.510 1.00 41.04 ? 625 HOH A O 1 HETATM 7313 O O . HOH V 9 . ? 29.177 49.047 14.733 1.00 30.26 ? 626 HOH A O 1 HETATM 7314 O O . HOH V 9 . ? 21.448 58.357 42.459 1.00 41.26 ? 627 HOH A O 1 HETATM 7315 O O . HOH V 9 . ? 13.798 69.940 30.320 1.00 51.60 ? 628 HOH A O 1 HETATM 7316 O O . HOH V 9 . ? 31.509 44.915 7.225 1.00 55.75 ? 629 HOH A O 1 HETATM 7317 O O . HOH V 9 . ? 26.106 24.759 16.862 1.00 35.91 ? 630 HOH A O 1 HETATM 7318 O O . HOH V 9 . ? 15.874 29.158 4.043 1.00 49.79 ? 631 HOH A O 1 HETATM 7319 O O . HOH V 9 . ? 15.649 72.066 34.465 1.00 32.56 ? 632 HOH A O 1 HETATM 7320 O O . HOH V 9 . ? 5.341 44.504 21.523 1.00 51.91 ? 633 HOH A O 1 HETATM 7321 O O . HOH V 9 . ? 18.005 47.756 5.440 1.00 57.98 ? 634 HOH A O 1 HETATM 7322 O O . HOH V 9 . ? 7.790 67.766 40.800 1.00 35.17 ? 635 HOH A O 1 HETATM 7323 O O . HOH V 9 . ? -4.694 51.310 43.825 1.00 41.12 ? 636 HOH A O 1 HETATM 7324 O O . HOH V 9 . ? 18.778 39.933 51.500 1.00 34.24 ? 637 HOH A O 1 HETATM 7325 O O . HOH V 9 . ? 16.336 17.509 6.847 1.00 48.23 ? 638 HOH A O 1 HETATM 7326 O O . HOH V 9 . ? 34.288 60.823 21.853 1.00 35.67 ? 639 HOH A O 1 HETATM 7327 O O . HOH V 9 . ? 8.541 60.837 35.667 1.00 25.82 ? 640 HOH A O 1 HETATM 7328 O O . HOH V 9 . ? 23.951 42.158 27.947 1.00 38.46 ? 641 HOH A O 1 HETATM 7329 O O . HOH V 9 . ? 37.858 44.819 25.801 1.00 37.79 ? 642 HOH A O 1 HETATM 7330 O O . HOH V 9 . ? 8.969 19.773 5.739 1.00 52.67 ? 643 HOH A O 1 HETATM 7331 O O . HOH V 9 . ? 40.193 37.114 31.035 1.00 37.62 ? 644 HOH A O 1 HETATM 7332 O O . HOH V 9 . ? 6.480 29.203 25.599 1.00 27.16 ? 645 HOH A O 1 HETATM 7333 O O . HOH V 9 . ? 12.373 40.323 36.603 1.00 16.59 ? 646 HOH A O 1 HETATM 7334 O O . HOH V 9 . ? 1.827 27.788 38.409 1.00 34.20 ? 647 HOH A O 1 HETATM 7335 O O . HOH V 9 . ? 0.124 55.758 28.132 1.00 35.86 ? 648 HOH A O 1 HETATM 7336 O O . HOH V 9 . ? 16.330 38.628 19.553 1.00 19.41 ? 649 HOH A O 1 HETATM 7337 O O . HOH V 9 . ? 7.561 55.308 21.982 1.00 16.13 ? 650 HOH A O 1 HETATM 7338 O O . HOH V 9 . ? 17.459 69.471 21.300 1.00 49.07 ? 651 HOH A O 1 HETATM 7339 O O . HOH V 9 . ? 12.428 36.743 7.870 1.00 49.44 ? 652 HOH A O 1 HETATM 7340 O O . HOH V 9 . ? 14.239 25.730 47.446 1.00 42.15 ? 653 HOH A O 1 HETATM 7341 O O . HOH V 9 . ? 35.262 26.727 10.641 1.00 40.26 ? 654 HOH A O 1 HETATM 7342 O O . HOH V 9 . ? 0.987 48.595 21.186 1.00 33.32 ? 655 HOH A O 1 HETATM 7343 O O . HOH V 9 . ? 25.274 56.060 38.618 1.00 19.78 ? 656 HOH A O 1 HETATM 7344 O O . HOH V 9 . ? 33.996 48.970 45.286 1.00 30.11 ? 657 HOH A O 1 HETATM 7345 O O . HOH V 9 . ? 32.234 39.601 15.384 1.00 28.66 ? 658 HOH A O 1 HETATM 7346 O O . HOH V 9 . ? 35.711 45.832 17.597 1.00 40.13 ? 659 HOH A O 1 HETATM 7347 O O . HOH V 9 . ? 7.182 54.290 13.358 1.00 37.28 ? 660 HOH A O 1 HETATM 7348 O O . HOH V 9 . ? 31.532 48.986 16.278 1.00 46.91 ? 661 HOH A O 1 HETATM 7349 O O . HOH V 9 . ? 1.302 44.594 50.053 1.00 42.83 ? 662 HOH A O 1 HETATM 7350 O O . HOH V 9 . ? 9.606 55.563 28.258 1.00 15.69 ? 663 HOH A O 1 HETATM 7351 O O . HOH V 9 . ? 28.358 60.363 17.191 1.00 51.71 ? 664 HOH A O 1 HETATM 7352 O O . HOH V 9 . ? 4.912 37.643 33.111 1.00 20.16 ? 665 HOH A O 1 HETATM 7353 O O . HOH V 9 . ? -3.776 35.118 41.144 1.00 37.16 ? 666 HOH A O 1 HETATM 7354 O O . HOH V 9 . ? 7.064 49.574 31.443 1.00 36.51 ? 667 HOH A O 1 HETATM 7355 O O . HOH V 9 . ? -1.699 52.883 26.149 1.00 52.55 ? 668 HOH A O 1 HETATM 7356 O O . HOH V 9 . ? 14.525 48.560 24.074 1.00 16.91 ? 669 HOH A O 1 HETATM 7357 O O . HOH V 9 . ? 16.682 58.779 11.722 1.00 36.34 ? 670 HOH A O 1 HETATM 7358 O O . HOH V 9 . ? 5.984 26.315 36.052 1.00 27.80 ? 671 HOH A O 1 HETATM 7359 O O . HOH V 9 . ? 35.863 54.574 33.354 1.00 40.25 ? 672 HOH A O 1 HETATM 7360 O O . HOH V 9 . ? 30.888 39.962 45.086 1.00 24.85 ? 673 HOH A O 1 HETATM 7361 O O . HOH V 9 . ? 6.916 34.616 20.969 1.00 52.89 ? 674 HOH A O 1 HETATM 7362 O O . HOH V 9 . ? 22.692 56.193 50.186 1.00 42.72 ? 675 HOH A O 1 HETATM 7363 O O . HOH V 9 . ? -6.882 38.168 39.463 1.00 45.16 ? 676 HOH A O 1 HETATM 7364 O O . HOH V 9 . ? 3.424 20.481 29.049 1.00 39.21 ? 677 HOH A O 1 HETATM 7365 O O . HOH V 9 . ? 2.063 60.036 34.612 1.00 24.09 ? 678 HOH A O 1 HETATM 7366 O O . HOH V 9 . ? 33.435 58.188 32.788 1.00 27.01 ? 679 HOH A O 1 HETATM 7367 O O . HOH V 9 . ? 10.363 53.774 16.910 1.00 19.31 ? 680 HOH A O 1 HETATM 7368 O O . HOH V 9 . ? 25.607 47.314 52.922 1.00 44.75 ? 681 HOH A O 1 HETATM 7369 O O . HOH V 9 . ? 0.771 58.460 37.885 1.00 43.17 ? 682 HOH A O 1 HETATM 7370 O O . HOH V 9 . ? 28.961 30.434 47.889 1.00 34.76 ? 683 HOH A O 1 HETATM 7371 O O . HOH V 9 . ? 33.667 29.207 22.451 1.00 47.28 ? 684 HOH A O 1 HETATM 7372 O O . HOH V 9 . ? 27.720 64.561 23.673 1.00 38.54 ? 685 HOH A O 1 HETATM 7373 O O . HOH V 9 . ? 23.744 25.614 41.656 1.00 44.32 ? 686 HOH A O 1 HETATM 7374 O O . HOH V 9 . ? 34.224 33.287 22.436 1.00 27.48 ? 687 HOH A O 1 HETATM 7375 O O . HOH V 9 . ? 32.299 46.760 14.870 1.00 45.64 ? 688 HOH A O 1 HETATM 7376 O O . HOH V 9 . ? 34.124 35.572 13.037 1.00 36.37 ? 689 HOH A O 1 HETATM 7377 O O . HOH V 9 . ? 6.840 24.069 8.301 1.00 41.22 ? 690 HOH A O 1 HETATM 7378 O O . HOH V 9 . ? 15.446 43.540 51.096 1.00 28.32 ? 691 HOH A O 1 HETATM 7379 O O . HOH V 9 . ? 13.627 38.176 39.654 1.00 24.09 ? 692 HOH A O 1 HETATM 7380 O O . HOH V 9 . ? 24.314 65.806 14.008 1.00 42.31 ? 693 HOH A O 1 HETATM 7381 O O . HOH V 9 . ? 31.947 25.970 39.965 1.00 45.04 ? 694 HOH A O 1 HETATM 7382 O O . HOH V 9 . ? 4.363 37.089 25.884 1.00 36.79 ? 695 HOH A O 1 HETATM 7383 O O . HOH V 9 . ? 2.605 54.491 32.232 1.00 20.21 ? 696 HOH A O 1 HETATM 7384 O O . HOH V 9 . ? 11.243 22.910 42.651 1.00 45.34 ? 697 HOH A O 1 HETATM 7385 O O . HOH V 9 . ? 6.904 62.999 14.306 1.00 39.52 ? 698 HOH A O 1 HETATM 7386 O O . HOH V 9 . ? 9.342 20.226 22.936 1.00 38.18 ? 699 HOH A O 1 HETATM 7387 O O . HOH V 9 . ? 4.423 35.650 47.654 1.00 33.10 ? 700 HOH A O 1 HETATM 7388 O O . HOH V 9 . ? 31.669 43.103 12.461 1.00 33.10 ? 701 HOH A O 1 HETATM 7389 O O . HOH V 9 . ? 15.430 53.017 22.520 1.00 17.32 ? 702 HOH A O 1 HETATM 7390 O O . HOH V 9 . ? 41.537 29.553 14.149 1.00 31.17 ? 703 HOH A O 1 HETATM 7391 O O . HOH V 9 . ? 36.601 31.934 35.430 1.00 49.21 ? 704 HOH A O 1 HETATM 7392 O O . HOH V 9 . ? 21.504 57.679 52.092 1.00 47.55 ? 705 HOH A O 1 HETATM 7393 O O . HOH V 9 . ? 1.979 26.082 35.969 1.00 36.29 ? 706 HOH A O 1 HETATM 7394 O O . HOH V 9 . ? 19.904 31.473 16.587 1.00 21.27 ? 707 HOH A O 1 HETATM 7395 O O . HOH V 9 . ? 1.028 48.196 27.987 1.00 25.66 ? 708 HOH A O 1 HETATM 7396 O O . HOH V 9 . ? 19.860 54.572 37.921 1.00 25.28 ? 709 HOH A O 1 HETATM 7397 O O . HOH V 9 . ? 13.711 19.574 35.604 1.00 36.88 ? 710 HOH A O 1 HETATM 7398 O O . HOH V 9 . ? 10.625 42.194 23.571 1.00 30.60 ? 711 HOH A O 1 HETATM 7399 O O . HOH V 9 . ? 21.797 67.696 13.858 1.00 57.64 ? 712 HOH A O 1 HETATM 7400 O O . HOH V 9 . ? 12.163 52.584 26.275 1.00 17.27 ? 713 HOH A O 1 HETATM 7401 O O . HOH V 9 . ? 12.064 45.197 21.565 1.00 20.32 ? 714 HOH A O 1 HETATM 7402 O O . HOH V 9 . ? 13.782 66.444 40.260 0.50 32.37 ? 715 HOH A O 1 HETATM 7403 O O . HOH V 9 . ? -1.528 35.639 28.488 1.00 35.31 ? 716 HOH A O 1 HETATM 7404 O O . HOH V 9 . ? 19.672 47.925 54.212 1.00 30.21 ? 717 HOH A O 1 HETATM 7405 O O . HOH V 9 . ? 24.869 39.315 11.647 1.00 23.61 ? 718 HOH A O 1 HETATM 7406 O O . HOH V 9 . ? -3.162 44.187 36.983 1.00 30.81 ? 719 HOH A O 1 HETATM 7407 O O . HOH V 9 . ? 1.194 34.416 27.612 1.00 28.72 ? 720 HOH A O 1 HETATM 7408 O O . HOH V 9 . ? 4.695 60.632 45.441 1.00 37.89 ? 721 HOH A O 1 HETATM 7409 O O . HOH V 9 . ? 9.325 30.015 6.155 1.00 33.37 ? 722 HOH A O 1 HETATM 7410 O O . HOH V 9 . ? 7.892 24.673 17.532 1.00 33.96 ? 723 HOH A O 1 HETATM 7411 O O . HOH V 9 . ? 0.973 30.162 37.000 1.00 33.21 ? 724 HOH A O 1 HETATM 7412 O O . HOH V 9 . ? 36.238 55.822 44.346 1.00 44.62 ? 725 HOH A O 1 HETATM 7413 O O . HOH V 9 . ? 26.160 58.998 12.952 1.00 33.56 ? 726 HOH A O 1 HETATM 7414 O O . HOH V 9 . ? 1.161 31.523 28.576 1.00 25.83 ? 727 HOH A O 1 HETATM 7415 O O . HOH V 9 . ? 16.940 32.542 33.475 1.00 24.51 ? 728 HOH A O 1 HETATM 7416 O O . HOH V 9 . ? 22.204 68.854 25.062 1.00 44.65 ? 729 HOH A O 1 HETATM 7417 O O . HOH V 9 . ? 17.230 42.019 26.056 1.00 16.04 ? 730 HOH A O 1 HETATM 7418 O O . HOH V 9 . ? 14.587 50.101 10.638 1.00 42.93 ? 731 HOH A O 1 HETATM 7419 O O . HOH V 9 . ? 7.824 54.611 10.967 1.00 44.22 ? 732 HOH A O 1 HETATM 7420 O O . HOH V 9 . ? 28.771 44.038 51.069 1.00 38.98 ? 733 HOH A O 1 HETATM 7421 O O . HOH V 9 . ? 6.072 37.601 48.226 1.00 31.61 ? 734 HOH A O 1 HETATM 7422 O O . HOH V 9 . ? 11.772 41.672 19.105 1.00 46.82 ? 735 HOH A O 1 HETATM 7423 O O . HOH V 9 . ? 0.000 51.435 20.130 0.50 24.03 ? 736 HOH A O 1 HETATM 7424 O O . HOH V 9 . ? 23.400 65.418 17.195 1.00 45.58 ? 737 HOH A O 1 HETATM 7425 O O . HOH V 9 . ? 31.260 42.163 52.209 1.00 42.18 ? 738 HOH A O 1 HETATM 7426 O O . HOH V 9 . ? 12.780 47.860 21.977 1.00 16.95 ? 739 HOH A O 1 HETATM 7427 O O . HOH V 9 . ? 23.614 53.227 22.459 1.00 21.09 ? 740 HOH A O 1 HETATM 7428 O O . HOH V 9 . ? 3.447 46.214 26.500 1.00 40.02 ? 741 HOH A O 1 HETATM 7429 O O . HOH V 9 . ? 2.928 44.640 29.361 1.00 20.45 ? 742 HOH A O 1 HETATM 7430 O O . HOH V 9 . ? -0.634 40.703 48.592 1.00 47.52 ? 743 HOH A O 1 HETATM 7431 O O . HOH V 9 . ? 0.308 36.495 47.355 1.00 34.84 ? 744 HOH A O 1 HETATM 7432 O O . HOH V 9 . ? 29.743 24.197 39.518 1.00 50.67 ? 745 HOH A O 1 HETATM 7433 O O . HOH V 9 . ? 11.615 40.877 21.259 1.00 48.91 ? 746 HOH A O 1 HETATM 7434 O O . HOH V 9 . ? 16.358 31.030 53.393 1.00 37.92 ? 747 HOH A O 1 HETATM 7435 O O . HOH V 9 . ? 26.495 65.122 28.434 1.00 29.39 ? 748 HOH A O 1 HETATM 7436 O O . HOH V 9 . ? 19.219 61.957 40.960 1.00 34.62 ? 749 HOH A O 1 HETATM 7437 O O . HOH V 9 . ? 18.220 34.670 35.029 1.00 24.82 ? 750 HOH A O 1 HETATM 7438 O O . HOH V 9 . ? -5.832 44.441 36.117 1.00 47.88 ? 751 HOH A O 1 HETATM 7439 O O . HOH V 9 . ? 5.297 53.140 23.394 1.00 16.15 ? 752 HOH A O 1 HETATM 7440 O O . HOH V 9 . ? 15.249 21.005 15.469 1.00 35.65 ? 753 HOH A O 1 HETATM 7441 O O . HOH V 9 . ? 7.306 31.923 22.953 1.00 31.95 ? 754 HOH A O 1 HETATM 7442 O O . HOH V 9 . ? 7.309 34.098 15.179 1.00 45.74 ? 755 HOH A O 1 HETATM 7443 O O . HOH V 9 . ? 8.997 29.916 26.381 1.00 24.57 ? 756 HOH A O 1 HETATM 7444 O O . HOH V 9 . ? 30.869 59.177 14.990 1.00 61.14 ? 757 HOH A O 1 HETATM 7445 O O . HOH V 9 . ? 5.086 63.632 34.690 1.00 30.53 ? 758 HOH A O 1 HETATM 7446 O O . HOH V 9 . ? 12.642 54.569 7.312 1.00 45.41 ? 759 HOH A O 1 HETATM 7447 O O . HOH V 9 . ? 30.708 51.269 15.829 1.00 49.32 ? 760 HOH A O 1 HETATM 7448 O O . HOH V 9 . ? 28.230 27.970 7.639 1.00 39.76 ? 761 HOH A O 1 HETATM 7449 O O . HOH V 9 . ? 23.868 20.942 13.977 1.00 54.61 ? 762 HOH A O 1 HETATM 7450 O O . HOH V 9 . ? 33.199 50.182 50.042 1.00 46.37 ? 763 HOH A O 1 HETATM 7451 O O . HOH V 9 . ? 1.977 27.920 46.529 1.00 34.03 ? 764 HOH A O 1 HETATM 7452 O O . HOH V 9 . ? 10.846 22.482 3.817 1.00 52.27 ? 765 HOH A O 1 HETATM 7453 O O . HOH V 9 . ? 17.674 21.751 38.936 1.00 40.06 ? 766 HOH A O 1 HETATM 7454 O O . HOH V 9 . ? 38.357 27.893 12.550 1.00 35.92 ? 767 HOH A O 1 HETATM 7455 O O . HOH V 9 . ? 6.589 35.261 23.675 1.00 41.03 ? 768 HOH A O 1 HETATM 7456 O O . HOH V 9 . ? 13.999 60.734 10.814 1.00 41.91 ? 769 HOH A O 1 HETATM 7457 O O . HOH V 9 . ? 20.031 20.877 32.845 1.00 36.69 ? 770 HOH A O 1 HETATM 7458 O O . HOH V 9 . ? 18.808 34.075 30.162 1.00 22.03 ? 771 HOH A O 1 HETATM 7459 O O . HOH V 9 . ? 7.035 44.769 27.458 1.00 31.01 ? 772 HOH A O 1 HETATM 7460 O O . HOH V 9 . ? 15.658 39.489 49.773 1.00 22.75 ? 773 HOH A O 1 HETATM 7461 O O . HOH V 9 . ? 33.288 41.348 13.803 1.00 35.94 ? 774 HOH A O 1 HETATM 7462 O O . HOH V 9 . ? 35.831 53.079 29.504 1.00 37.05 ? 775 HOH A O 1 HETATM 7463 O O . HOH V 9 . ? 54.485 48.141 62.723 1.00 53.17 ? 776 HOH A O 1 HETATM 7464 O O . HOH V 9 . ? 10.301 31.507 51.697 1.00 29.19 ? 777 HOH A O 1 HETATM 7465 O O . HOH V 9 . ? 7.082 65.656 27.805 1.00 30.86 ? 778 HOH A O 1 HETATM 7466 O O . HOH V 9 . ? 14.487 40.500 17.474 1.00 30.20 ? 779 HOH A O 1 HETATM 7467 O O . HOH V 9 . ? 31.893 26.083 13.918 1.00 48.01 ? 780 HOH A O 1 HETATM 7468 O O . HOH V 9 . ? 23.230 52.244 25.583 1.00 24.28 ? 781 HOH A O 1 HETATM 7469 O O . HOH V 9 . ? 7.782 33.953 12.879 1.00 43.20 ? 782 HOH A O 1 HETATM 7470 O O . HOH V 9 . ? 37.864 36.749 25.199 1.00 37.87 ? 783 HOH A O 1 HETATM 7471 O O . HOH V 9 . ? 5.580 43.329 9.429 1.00 33.63 ? 784 HOH A O 1 HETATM 7472 O O . HOH V 9 . ? -6.548 36.238 37.576 1.00 40.36 ? 785 HOH A O 1 HETATM 7473 O O . HOH V 9 . ? 8.943 57.074 5.735 1.00 45.57 ? 786 HOH A O 1 HETATM 7474 O O . HOH V 9 . ? 10.635 24.586 13.229 1.00 27.72 ? 787 HOH A O 1 HETATM 7475 O O . HOH V 9 . ? 21.763 50.818 27.525 1.00 19.31 ? 788 HOH A O 1 HETATM 7476 O O . HOH V 9 . ? 12.868 46.653 17.608 1.00 21.16 ? 789 HOH A O 1 HETATM 7477 O O . HOH V 9 . ? 9.324 31.984 13.413 1.00 40.79 ? 790 HOH A O 1 HETATM 7478 O O . HOH V 9 . ? -0.610 53.559 39.612 1.00 25.83 ? 791 HOH A O 1 HETATM 7479 O O . HOH V 9 . ? 12.617 44.216 15.153 1.00 31.98 ? 792 HOH A O 1 HETATM 7480 O O . HOH V 9 . ? 31.226 55.115 17.970 1.00 38.70 ? 793 HOH A O 1 HETATM 7481 O O . HOH V 9 . ? 17.065 23.535 41.788 1.00 37.54 ? 794 HOH A O 1 HETATM 7482 O O . HOH V 9 . ? 23.179 39.942 26.838 1.00 16.98 ? 795 HOH A O 1 HETATM 7483 O O . HOH V 9 . ? 28.047 47.052 8.680 1.00 46.83 ? 796 HOH A O 1 HETATM 7484 O O . HOH V 9 . ? 12.423 50.341 14.531 1.00 30.88 ? 797 HOH A O 1 HETATM 7485 O O . HOH V 9 . ? 26.749 33.697 7.212 1.00 31.55 ? 798 HOH A O 1 HETATM 7486 O O . HOH V 9 . ? 17.560 56.991 9.787 1.00 39.87 ? 799 HOH A O 1 HETATM 7487 O O . HOH V 9 . ? 11.102 62.817 14.281 1.00 35.94 ? 800 HOH A O 1 HETATM 7488 O O . HOH V 9 . ? -0.001 39.048 46.711 1.00 32.65 ? 801 HOH A O 1 HETATM 7489 O O . HOH V 9 . ? 21.540 51.946 21.140 1.00 17.10 ? 802 HOH A O 1 HETATM 7490 O O . HOH V 9 . ? 12.239 51.842 16.772 1.00 25.42 ? 803 HOH A O 1 HETATM 7491 O O . HOH V 9 . ? 34.631 29.908 17.459 1.00 37.68 ? 804 HOH A O 1 HETATM 7492 O O . HOH V 9 . ? -2.067 46.978 48.305 1.00 45.67 ? 805 HOH A O 1 HETATM 7493 O O . HOH V 9 . ? 32.549 37.815 42.883 1.00 29.66 ? 806 HOH A O 1 HETATM 7494 O O . HOH V 9 . ? 30.023 64.707 35.242 1.00 54.10 ? 807 HOH A O 1 HETATM 7495 O O . HOH V 9 . ? 28.139 41.693 -1.605 1.00 57.12 ? 808 HOH A O 1 HETATM 7496 O O . HOH V 9 . ? -0.363 48.881 47.288 1.00 48.24 ? 809 HOH A O 1 HETATM 7497 O O . HOH V 9 . ? 13.718 25.430 11.703 1.00 28.79 ? 810 HOH A O 1 HETATM 7498 O O . HOH V 9 . ? 22.137 47.242 30.952 1.00 15.18 ? 811 HOH A O 1 HETATM 7499 O O . HOH V 9 . ? 36.905 37.290 20.776 1.00 44.47 ? 812 HOH A O 1 HETATM 7500 O O . HOH V 9 . ? 14.460 65.256 15.204 1.00 46.10 ? 813 HOH A O 1 HETATM 7501 O O . HOH V 9 . ? 4.076 54.221 44.141 1.00 24.00 ? 814 HOH A O 1 HETATM 7502 O O . HOH V 9 . ? 32.703 58.966 18.664 1.00 41.51 ? 815 HOH A O 1 HETATM 7503 O O . HOH V 9 . ? -1.852 51.697 28.932 1.00 35.79 ? 816 HOH A O 1 HETATM 7504 O O . HOH V 9 . ? 30.207 61.707 19.717 1.00 41.87 ? 817 HOH A O 1 HETATM 7505 O O . HOH V 9 . ? 17.795 66.903 38.563 1.00 40.28 ? 818 HOH A O 1 HETATM 7506 O O . HOH V 9 . ? 8.956 68.238 16.740 1.00 42.81 ? 819 HOH A O 1 HETATM 7507 O O . HOH V 9 . ? 23.768 56.726 36.472 1.00 24.00 ? 820 HOH A O 1 HETATM 7508 O O . HOH V 9 . ? -2.375 31.575 33.981 1.00 28.89 ? 821 HOH A O 1 HETATM 7509 O O . HOH V 9 . ? 3.359 22.171 35.671 1.00 45.89 ? 822 HOH A O 1 HETATM 7510 O O . HOH V 9 . ? 21.444 24.048 21.371 1.00 26.14 ? 823 HOH A O 1 HETATM 7511 O O . HOH V 9 . ? 21.149 37.990 9.055 1.00 29.88 ? 824 HOH A O 1 HETATM 7512 O O . HOH V 9 . ? -5.815 45.717 47.230 1.00 48.02 ? 825 HOH A O 1 HETATM 7513 O O . HOH V 9 . ? 0.056 64.708 29.312 1.00 34.71 ? 826 HOH A O 1 HETATM 7514 O O . HOH V 9 . ? 23.279 39.330 5.180 1.00 47.53 ? 827 HOH A O 1 HETATM 7515 O O . HOH V 9 . ? 5.533 28.242 28.062 1.00 28.71 ? 828 HOH A O 1 HETATM 7516 O O . HOH V 9 . ? 9.538 44.490 23.753 1.00 32.71 ? 829 HOH A O 1 HETATM 7517 O O . HOH V 9 . ? 35.141 61.562 31.283 1.00 43.39 ? 830 HOH A O 1 HETATM 7518 O O . HOH V 9 . ? 5.330 47.974 55.437 1.00 45.46 ? 831 HOH A O 1 HETATM 7519 O O . HOH V 9 . ? 23.191 63.829 9.577 1.00 52.98 ? 832 HOH A O 1 HETATM 7520 O O . HOH V 9 . ? 33.905 61.588 26.499 1.00 41.57 ? 833 HOH A O 1 HETATM 7521 O O . HOH V 9 . ? 23.623 57.642 43.636 1.00 51.36 ? 834 HOH A O 1 HETATM 7522 O O . HOH V 9 . ? 26.198 43.055 11.473 1.00 31.69 ? 835 HOH A O 1 HETATM 7523 O O . HOH V 9 . ? 10.130 21.501 20.898 1.00 46.26 ? 836 HOH A O 1 HETATM 7524 O O . HOH V 9 . ? 29.893 31.095 40.771 1.00 41.55 ? 837 HOH A O 1 HETATM 7525 O O . HOH V 9 . ? 11.408 36.528 53.869 1.00 49.75 ? 838 HOH A O 1 HETATM 7526 O O . HOH V 9 . ? 9.205 42.137 7.463 1.00 50.84 ? 839 HOH A O 1 HETATM 7527 O O . HOH V 9 . ? 20.395 37.748 51.715 1.00 25.14 ? 840 HOH A O 1 HETATM 7528 O O . HOH V 9 . ? 29.925 28.667 5.484 1.00 30.55 ? 841 HOH A O 1 HETATM 7529 O O . HOH V 9 . ? -3.019 42.983 30.771 1.00 24.84 ? 842 HOH A O 1 HETATM 7530 O O . HOH V 9 . ? 10.401 50.393 28.128 1.00 20.36 ? 843 HOH A O 1 HETATM 7531 O O . HOH V 9 . ? 40.320 44.757 33.800 1.00 35.03 ? 844 HOH A O 1 HETATM 7532 O O . HOH V 9 . ? 21.887 48.246 13.050 1.00 23.23 ? 845 HOH A O 1 HETATM 7533 O O . HOH V 9 . ? 21.001 43.318 55.004 1.00 49.29 ? 846 HOH A O 1 HETATM 7534 O O . HOH V 9 . ? 5.979 57.030 8.683 1.00 50.81 ? 847 HOH A O 1 HETATM 7535 O O . HOH V 9 . ? 10.589 60.802 7.681 1.00 39.53 ? 848 HOH A O 1 HETATM 7536 O O . HOH V 9 . ? 38.417 41.960 25.589 1.00 53.28 ? 849 HOH A O 1 HETATM 7537 O O . HOH V 9 . ? -1.695 57.145 34.531 1.00 40.56 ? 850 HOH A O 1 HETATM 7538 O O . HOH V 9 . ? 38.721 29.780 45.036 1.00 53.12 ? 851 HOH A O 1 HETATM 7539 O O . HOH V 9 . ? 36.543 36.495 12.715 1.00 50.29 ? 852 HOH A O 1 HETATM 7540 O O . HOH V 9 . ? -1.508 60.438 31.676 1.00 45.15 ? 853 HOH A O 1 HETATM 7541 O O . HOH V 9 . ? 37.286 43.847 20.955 1.00 34.55 ? 854 HOH A O 1 HETATM 7542 O O . HOH V 9 . ? 12.641 49.931 56.085 1.00 38.95 ? 855 HOH A O 1 HETATM 7543 O O . HOH V 9 . ? 18.945 52.868 3.722 1.00 60.18 ? 856 HOH A O 1 HETATM 7544 O O . HOH V 9 . ? 26.794 65.896 25.912 1.00 44.51 ? 857 HOH A O 1 HETATM 7545 O O . HOH V 9 . ? 8.916 37.200 48.685 1.00 34.73 ? 858 HOH A O 1 HETATM 7546 O O . HOH V 9 . ? 17.995 70.159 37.162 1.00 44.74 ? 859 HOH A O 1 HETATM 7547 O O . HOH V 9 . ? 20.210 19.229 22.955 1.00 53.73 ? 860 HOH A O 1 HETATM 7548 O O . HOH V 9 . ? 35.336 45.379 39.970 1.00 31.53 ? 861 HOH A O 1 HETATM 7549 O O . HOH V 9 . ? 20.070 63.934 39.055 1.00 44.24 ? 862 HOH A O 1 HETATM 7550 O O . HOH V 9 . ? 18.312 61.791 8.952 1.00 47.96 ? 863 HOH A O 1 HETATM 7551 O O . HOH V 9 . ? 21.504 67.849 31.600 1.00 40.47 ? 864 HOH A O 1 HETATM 7552 O O . HOH V 9 . ? 27.081 53.968 13.487 1.00 49.70 ? 865 HOH A O 1 HETATM 7553 O O . HOH V 9 . ? 35.158 56.414 31.261 1.00 38.34 ? 866 HOH A O 1 HETATM 7554 O O . HOH V 9 . ? 22.281 40.790 51.811 1.00 28.65 ? 867 HOH A O 1 HETATM 7555 O O . HOH V 9 . ? 6.915 43.038 25.351 1.00 33.81 ? 868 HOH A O 1 HETATM 7556 O O . HOH V 9 . ? 18.642 61.911 13.703 1.00 33.00 ? 869 HOH A O 1 HETATM 7557 O O . HOH V 9 . ? 21.806 42.816 7.971 1.00 46.56 ? 870 HOH A O 1 HETATM 7558 O O . HOH V 9 . ? 1.534 28.515 22.987 1.00 32.78 ? 871 HOH A O 1 HETATM 7559 O O . HOH V 9 . ? 15.925 63.639 12.396 1.00 45.11 ? 872 HOH A O 1 HETATM 7560 O O . HOH V 9 . ? 14.333 53.794 25.030 1.00 17.85 ? 873 HOH A O 1 HETATM 7561 O O . HOH V 9 . ? 3.760 31.472 49.177 1.00 33.39 ? 874 HOH A O 1 HETATM 7562 O O . HOH V 9 . ? 14.325 46.211 54.885 1.00 43.98 ? 875 HOH A O 1 HETATM 7563 O O . HOH V 9 . ? 4.697 57.726 37.646 1.00 21.70 ? 876 HOH A O 1 HETATM 7564 O O . HOH V 9 . ? 23.143 45.106 56.286 1.00 54.52 ? 877 HOH A O 1 HETATM 7565 O O . HOH V 9 . ? 32.654 41.232 8.984 1.00 48.44 ? 878 HOH A O 1 HETATM 7566 O O . HOH V 9 . ? 32.191 47.328 12.009 1.00 44.08 ? 879 HOH A O 1 HETATM 7567 O O . HOH V 9 . ? 3.711 41.588 25.239 1.00 42.62 ? 880 HOH A O 1 HETATM 7568 O O . HOH V 9 . ? 34.900 35.021 20.199 1.00 35.18 ? 881 HOH A O 1 HETATM 7569 O O . HOH V 9 . ? 6.669 37.299 13.137 1.00 36.22 ? 882 HOH A O 1 HETATM 7570 O O . HOH V 9 . ? 4.875 38.458 50.769 1.00 44.53 ? 883 HOH A O 1 HETATM 7571 O O . HOH V 9 . ? 22.788 63.609 37.338 1.00 31.33 ? 884 HOH A O 1 HETATM 7572 O O . HOH V 9 . ? 22.033 20.530 5.957 1.00 50.60 ? 885 HOH A O 1 HETATM 7573 O O . HOH V 9 . ? -0.968 49.379 30.051 1.00 22.40 ? 886 HOH A O 1 HETATM 7574 O O . HOH V 9 . ? -2.596 56.894 29.445 1.00 48.17 ? 887 HOH A O 1 HETATM 7575 O O . HOH V 9 . ? 27.123 45.957 50.709 1.00 36.73 ? 888 HOH A O 1 HETATM 7576 O O . HOH V 9 . ? 20.302 39.563 55.322 1.00 49.39 ? 889 HOH A O 1 HETATM 7577 O O . HOH V 9 . ? 33.646 53.342 21.079 1.00 29.79 ? 890 HOH A O 1 HETATM 7578 O O . HOH V 9 . ? 1.791 48.506 48.534 1.00 42.97 ? 891 HOH A O 1 HETATM 7579 O O . HOH V 9 . ? 8.587 28.882 29.037 1.00 38.56 ? 892 HOH A O 1 HETATM 7580 O O . HOH V 9 . ? 24.444 33.300 8.998 1.00 31.01 ? 893 HOH A O 1 HETATM 7581 O O . HOH V 9 . ? 14.573 41.000 51.959 1.00 27.81 ? 894 HOH A O 1 HETATM 7582 O O . HOH V 9 . ? 17.812 47.194 52.312 1.00 26.33 ? 895 HOH A O 1 HETATM 7583 O O . HOH V 9 . ? 28.832 64.816 29.538 1.00 29.79 ? 896 HOH A O 1 HETATM 7584 O O . HOH V 9 . ? 21.371 57.021 37.746 1.00 17.99 ? 897 HOH A O 1 HETATM 7585 O O . HOH V 9 . ? 37.745 40.882 21.386 1.00 48.63 ? 898 HOH A O 1 HETATM 7586 O O . HOH V 9 . ? 8.715 17.227 31.119 1.00 54.43 ? 899 HOH A O 1 HETATM 7587 O O . HOH V 9 . ? 11.082 64.115 30.564 1.00 46.87 ? 900 HOH A O 1 HETATM 7588 O O . HOH V 9 . ? -5.232 43.751 45.264 1.00 33.69 ? 901 HOH A O 1 HETATM 7589 O O . HOH V 9 . ? 11.456 54.090 9.636 1.00 30.65 ? 902 HOH A O 1 HETATM 7590 O O . HOH V 9 . ? 11.768 57.235 52.850 1.00 50.39 ? 903 HOH A O 1 HETATM 7591 O O . HOH V 9 . ? 3.163 52.387 16.399 1.00 43.96 ? 904 HOH A O 1 HETATM 7592 O O . HOH V 9 . ? 12.352 31.462 55.282 1.00 55.64 ? 905 HOH A O 1 HETATM 7593 O O . HOH V 9 . ? 4.382 25.174 41.197 1.00 41.12 ? 906 HOH A O 1 HETATM 7594 O O . HOH V 9 . ? 34.975 42.480 50.282 1.00 35.30 ? 907 HOH A O 1 HETATM 7595 O O . HOH V 9 . ? 1.900 51.133 18.195 1.00 36.83 ? 908 HOH A O 1 HETATM 7596 O O . HOH V 9 . ? 32.195 27.559 43.046 1.00 44.62 ? 909 HOH A O 1 HETATM 7597 O O . HOH V 9 . ? 38.249 41.230 18.467 1.00 50.65 ? 910 HOH A O 1 HETATM 7598 O O . HOH V 9 . ? -4.304 38.862 45.968 1.00 43.95 ? 911 HOH A O 1 HETATM 7599 O O . HOH V 9 . ? 9.040 44.143 53.803 1.00 51.07 ? 912 HOH A O 1 HETATM 7600 O O . HOH V 9 . ? 33.102 43.869 10.266 1.00 46.02 ? 913 HOH A O 1 HETATM 7601 O O . HOH V 9 . ? 47.974 47.824 68.175 1.00 48.67 ? 914 HOH A O 1 HETATM 7602 O O . HOH V 9 . ? 35.530 35.144 45.006 1.00 51.25 ? 915 HOH A O 1 HETATM 7603 O O . HOH V 9 . ? 11.048 60.446 32.550 1.00 18.38 ? 916 HOH A O 1 HETATM 7604 O O . HOH V 9 . ? 24.165 42.938 26.021 1.00 19.84 ? 917 HOH A O 1 HETATM 7605 O O . HOH V 9 . ? -3.015 49.327 33.993 1.00 25.66 ? 918 HOH A O 1 HETATM 7606 O O . HOH V 9 . ? 5.504 51.805 15.075 1.00 51.38 ? 919 HOH A O 1 HETATM 7607 O O . HOH V 9 . ? 27.438 53.147 49.834 1.00 33.25 ? 920 HOH A O 1 HETATM 7608 O O . HOH V 9 . ? 22.179 38.649 14.089 1.00 27.81 ? 921 HOH A O 1 HETATM 7609 O O . HOH V 9 . ? 12.155 51.935 10.838 1.00 47.87 ? 922 HOH A O 1 HETATM 7610 O O . HOH V 9 . ? 20.814 59.332 49.416 1.00 50.22 ? 923 HOH A O 1 HETATM 7611 O O . HOH V 9 . ? 25.310 24.178 19.519 1.00 30.70 ? 924 HOH A O 1 HETATM 7612 O O . HOH V 9 . ? 35.496 32.775 38.423 1.00 29.50 ? 925 HOH A O 1 HETATM 7613 O O . HOH V 9 . ? -0.392 33.033 41.652 1.00 29.30 ? 926 HOH A O 1 HETATM 7614 O O . HOH V 9 . ? 20.086 50.223 12.719 1.00 37.82 ? 927 HOH A O 1 HETATM 7615 O O . HOH V 9 . ? 19.778 41.422 52.983 1.00 51.93 ? 928 HOH A O 1 HETATM 7616 O O . HOH V 9 . ? -2.545 42.812 45.836 1.00 28.14 ? 929 HOH A O 1 HETATM 7617 O O . HOH V 9 . ? 5.066 65.911 33.015 1.00 43.67 ? 930 HOH A O 1 HETATM 7618 O O . HOH V 9 . ? 32.569 61.446 36.947 1.00 56.23 ? 931 HOH A O 1 HETATM 7619 O O . HOH V 9 . ? 19.712 16.649 6.620 1.00 54.77 ? 932 HOH A O 1 HETATM 7620 O O . HOH V 9 . ? 2.140 28.669 42.554 1.00 40.54 ? 933 HOH A O 1 HETATM 7621 O O . HOH V 9 . ? 31.377 27.888 21.135 1.00 40.36 ? 934 HOH A O 1 HETATM 7622 O O . HOH V 9 . ? 16.477 69.687 32.836 1.00 36.46 ? 935 HOH A O 1 HETATM 7623 O O . HOH V 9 . ? 6.994 31.268 20.573 1.00 37.42 ? 936 HOH A O 1 HETATM 7624 O O . HOH V 9 . ? 13.177 22.792 44.731 1.00 52.18 ? 937 HOH A O 1 HETATM 7625 O O . HOH V 9 . ? 14.198 23.966 3.476 1.00 37.14 ? 938 HOH A O 1 HETATM 7626 O O . HOH V 9 . ? 16.689 61.607 49.359 1.00 51.56 ? 939 HOH A O 1 HETATM 7627 O O . HOH V 9 . ? 33.835 26.257 27.975 1.00 52.31 ? 940 HOH A O 1 HETATM 7628 O O . HOH V 9 . ? 4.449 21.049 33.814 1.00 37.39 ? 941 HOH A O 1 HETATM 7629 O O . HOH V 9 . ? 36.518 38.426 8.778 1.00 45.95 ? 942 HOH A O 1 HETATM 7630 O O . HOH V 9 . ? 32.105 37.167 14.117 1.00 27.41 ? 943 HOH A O 1 HETATM 7631 O O . HOH V 9 . ? -5.070 35.516 43.278 1.00 56.88 ? 944 HOH A O 1 HETATM 7632 O O . HOH V 9 . ? 12.470 17.862 29.488 1.00 50.88 ? 945 HOH A O 1 HETATM 7633 O O . HOH V 9 . ? 6.327 26.350 38.895 1.00 26.85 ? 946 HOH A O 1 HETATM 7634 O O . HOH V 9 . ? 7.183 59.561 9.301 1.00 32.25 ? 947 HOH A O 1 HETATM 7635 O O . HOH V 9 . ? 23.185 35.754 6.915 1.00 53.14 ? 948 HOH A O 1 HETATM 7636 O O . HOH V 9 . ? 26.179 57.055 43.380 1.00 51.35 ? 949 HOH A O 1 HETATM 7637 O O . HOH V 9 . ? 10.874 64.832 25.481 1.00 38.79 ? 950 HOH A O 1 HETATM 7638 O O . HOH V 9 . ? 6.776 19.055 34.336 1.00 40.21 ? 951 HOH A O 1 HETATM 7639 O O . HOH V 9 . ? 29.648 23.694 31.823 1.00 42.73 ? 952 HOH A O 1 HETATM 7640 O O . HOH V 9 . ? 15.711 22.033 43.339 1.00 46.11 ? 953 HOH A O 1 HETATM 7641 O O . HOH V 9 . ? 20.563 20.357 30.521 1.00 39.59 ? 954 HOH A O 1 HETATM 7642 O O . HOH V 9 . ? 16.509 70.689 15.462 1.00 52.11 ? 955 HOH A O 1 HETATM 7643 O O . HOH V 9 . ? 9.115 46.961 15.405 1.00 43.74 ? 956 HOH A O 1 HETATM 7644 O O . HOH V 9 . ? 35.815 45.328 44.326 1.00 48.23 ? 957 HOH A O 1 HETATM 7645 O O . HOH V 9 . ? 39.793 35.518 11.670 1.00 58.64 ? 958 HOH A O 1 HETATM 7646 O O . HOH V 9 . ? 10.034 45.246 11.831 1.00 41.96 ? 959 HOH A O 1 HETATM 7647 O O . HOH V 9 . ? 11.996 45.500 12.483 1.00 32.11 ? 960 HOH A O 1 HETATM 7648 O O . HOH V 9 . ? 35.726 35.489 38.840 1.00 48.22 ? 961 HOH A O 1 HETATM 7649 O O . HOH V 9 . ? -1.136 59.985 34.615 1.00 59.27 ? 962 HOH A O 1 HETATM 7650 O O . HOH V 9 . ? 23.070 23.135 19.137 1.00 48.90 ? 963 HOH A O 1 HETATM 7651 O O . HOH V 9 . ? 24.641 41.381 9.845 1.00 44.38 ? 964 HOH A O 1 HETATM 7652 O O . HOH V 9 . ? 9.667 62.878 32.377 1.00 34.36 ? 965 HOH A O 1 HETATM 7653 O O . HOH V 9 . ? 20.145 15.725 9.034 1.00 57.77 ? 966 HOH A O 1 HETATM 7654 O O . HOH V 9 . ? 21.567 71.024 40.540 1.00 54.17 ? 967 HOH A O 1 HETATM 7655 O O . HOH V 9 . ? 25.727 56.316 12.256 1.00 45.46 ? 968 HOH A O 1 HETATM 7656 O O . HOH V 9 . ? -4.800 55.365 30.219 1.00 49.74 ? 969 HOH A O 1 HETATM 7657 O O . HOH V 9 . ? 22.744 39.796 7.844 1.00 49.31 ? 970 HOH A O 1 HETATM 7658 O O . HOH V 9 . ? 4.833 48.467 16.490 1.00 54.22 ? 971 HOH A O 1 HETATM 7659 O O . HOH V 9 . ? 33.274 46.236 8.907 1.00 53.35 ? 972 HOH A O 1 HETATM 7660 O O . HOH V 9 . ? 5.363 28.008 9.653 1.00 54.54 ? 973 HOH A O 1 HETATM 7661 O O . HOH V 9 . ? 32.786 64.607 27.199 1.00 49.60 ? 974 HOH A O 1 HETATM 7662 O O . HOH V 9 . ? 12.403 44.717 53.355 1.00 43.22 ? 975 HOH A O 1 HETATM 7663 O O . HOH V 9 . ? 32.061 38.322 3.810 1.00 54.06 ? 976 HOH A O 1 HETATM 7664 O O . HOH V 9 . ? 22.596 37.503 11.339 1.00 29.14 ? 977 HOH A O 1 HETATM 7665 O O . HOH V 9 . ? -4.484 47.770 35.458 1.00 51.54 ? 978 HOH A O 1 HETATM 7666 O O . HOH V 9 . ? 8.591 52.599 15.006 1.00 26.13 ? 979 HOH A O 1 HETATM 7667 O O . HOH V 9 . ? 4.002 56.986 48.147 1.00 49.51 ? 980 HOH A O 1 HETATM 7668 O O . HOH V 9 . ? 29.410 52.543 14.306 1.00 55.92 ? 981 HOH A O 1 HETATM 7669 O O . HOH V 9 . ? 6.570 70.250 43.873 1.00 34.76 ? 982 HOH A O 1 HETATM 7670 O O . HOH V 9 . ? 10.868 64.293 17.733 1.00 44.59 ? 983 HOH A O 1 HETATM 7671 O O . HOH V 9 . ? -0.883 41.892 27.389 1.00 37.56 ? 984 HOH A O 1 HETATM 7672 O O . HOH V 9 . ? 10.100 59.129 50.445 1.00 63.63 ? 985 HOH A O 1 HETATM 7673 O O . HOH V 9 . ? 28.450 54.985 48.570 1.00 46.85 ? 986 HOH A O 1 HETATM 7674 O O . HOH V 9 . ? 26.092 25.638 8.571 1.00 39.33 ? 987 HOH A O 1 HETATM 7675 O O . HOH V 9 . ? 8.571 66.554 31.074 1.00 52.45 ? 988 HOH A O 1 HETATM 7676 O O . HOH V 9 . ? 30.864 65.986 27.853 1.00 47.66 ? 989 HOH A O 1 HETATM 7677 O O . HOH V 9 . ? 9.757 65.911 15.425 1.00 56.16 ? 990 HOH A O 1 HETATM 7678 O O . HOH V 9 . ? 26.178 29.886 7.333 1.00 49.61 ? 991 HOH A O 1 HETATM 7679 O O . HOH V 9 . ? 8.259 22.854 4.173 1.00 48.71 ? 992 HOH A O 1 HETATM 7680 O O . HOH V 9 . ? 12.071 65.437 28.994 1.00 48.77 ? 993 HOH A O 1 HETATM 7681 O O . HOH V 9 . ? 21.141 69.468 21.787 1.00 52.12 ? 994 HOH A O 1 HETATM 7682 O O . HOH V 9 . ? 0.931 55.656 40.668 1.00 42.81 ? 995 HOH A O 1 HETATM 7683 O O . HOH V 9 . ? 36.954 33.258 23.695 1.00 44.66 ? 996 HOH A O 1 HETATM 7684 O O . HOH V 9 . ? 21.872 58.423 39.900 1.00 27.96 ? 997 HOH A O 1 HETATM 7685 O O . HOH V 9 . ? 14.780 36.504 7.579 1.00 50.23 ? 998 HOH A O 1 HETATM 7686 O O . HOH V 9 . ? 11.007 40.858 6.610 1.00 52.31 ? 999 HOH A O 1 HETATM 7687 O O . HOH V 9 . ? -1.894 42.955 48.216 1.00 42.99 ? 1000 HOH A O 1 HETATM 7688 O O . HOH V 9 . ? 34.708 49.197 47.911 1.00 44.51 ? 1001 HOH A O 1 HETATM 7689 O O . HOH V 9 . ? 12.420 39.367 19.426 1.00 47.82 ? 1002 HOH A O 1 HETATM 7690 O O . HOH V 9 . ? 13.846 57.278 6.923 1.00 41.99 ? 1003 HOH A O 1 HETATM 7691 O O . HOH V 9 . ? 36.642 51.470 47.733 1.00 50.62 ? 1004 HOH A O 1 HETATM 7692 O O . HOH V 9 . ? 34.004 24.862 12.137 1.00 43.94 ? 1005 HOH A O 1 HETATM 7693 O O . HOH V 9 . ? 6.064 24.097 14.461 1.00 49.35 ? 1006 HOH A O 1 HETATM 7694 O O . HOH V 9 . ? 26.598 50.004 54.072 1.00 46.32 ? 1007 HOH A O 1 HETATM 7695 O O . HOH V 9 . ? 0.560 46.113 29.433 1.00 24.94 ? 1008 HOH A O 1 HETATM 7696 O O . HOH V 9 . ? 5.576 25.123 16.217 1.00 37.28 ? 1009 HOH A O 1 HETATM 7697 O O . HOH V 9 . ? 30.379 22.383 27.329 1.00 55.72 ? 1010 HOH A O 1 HETATM 7698 O O . HOH V 9 . ? 11.851 65.024 22.288 1.00 53.33 ? 1011 HOH A O 1 HETATM 7699 O O . HOH V 9 . ? 39.793 47.348 35.904 1.00 60.81 ? 1012 HOH A O 1 HETATM 7700 O O . HOH V 9 . ? -4.488 57.491 33.799 1.00 52.46 ? 1013 HOH A O 1 HETATM 7701 O O . HOH V 9 . ? 8.531 23.136 14.568 1.00 42.76 ? 1014 HOH A O 1 HETATM 7702 O O . HOH V 9 . ? 11.872 30.001 52.986 1.00 41.68 ? 1015 HOH A O 1 HETATM 7703 O O . HOH V 9 . ? 4.506 30.339 20.378 1.00 49.56 ? 1016 HOH A O 1 HETATM 7704 O O . HOH V 9 . ? 20.489 35.633 7.868 1.00 39.33 ? 1017 HOH A O 1 HETATM 7705 O O . HOH V 9 . ? 22.807 34.845 10.628 1.00 31.45 ? 1018 HOH A O 1 HETATM 7706 O O . HOH V 9 . ? 5.503 61.434 10.611 1.00 51.36 ? 1019 HOH A O 1 HETATM 7707 O O . HOH V 9 . ? 8.198 30.343 50.397 1.00 41.26 ? 1020 HOH A O 1 HETATM 7708 O O . HOH V 9 . ? 8.764 66.330 25.340 1.00 45.95 ? 1021 HOH A O 1 HETATM 7709 O O . HOH V 9 . ? 14.705 60.990 8.549 1.00 53.87 ? 1022 HOH A O 1 HETATM 7710 O O . HOH V 9 . ? 2.518 26.764 41.789 1.00 52.71 ? 1023 HOH A O 1 HETATM 7711 O O . HOH V 9 . ? 16.315 19.980 36.136 1.00 38.88 ? 1024 HOH A O 1 HETATM 7712 O O . HOH V 9 . ? 10.487 48.553 26.372 1.00 28.28 ? 1025 HOH A O 1 HETATM 7713 O O . HOH V 9 . ? 32.984 29.033 19.729 1.00 52.57 ? 1026 HOH A O 1 HETATM 7714 O O . HOH V 9 . ? -2.022 40.091 45.324 1.00 41.98 ? 1027 HOH A O 1 HETATM 7715 O O . HOH V 9 . ? 16.017 20.439 27.218 1.00 56.86 ? 1028 HOH A O 1 HETATM 7716 O O . HOH V 9 . ? 5.157 61.527 13.080 1.00 48.88 ? 1029 HOH A O 1 HETATM 7717 O O . HOH V 9 . ? 14.405 29.772 52.396 1.00 41.83 ? 1030 HOH A O 1 HETATM 7718 O O . HOH V 9 . ? 16.457 45.156 53.122 1.00 32.26 ? 1031 HOH A O 1 HETATM 7719 O O . HOH V 9 . ? 36.282 47.286 42.653 1.00 49.55 ? 1032 HOH A O 1 HETATM 7720 O O . HOH V 9 . ? -5.538 44.919 33.954 1.00 53.41 ? 1033 HOH A O 1 HETATM 7721 O O . HOH V 9 . ? -1.179 30.778 29.391 1.00 45.42 ? 1034 HOH A O 1 HETATM 7722 O O . HOH V 9 . ? 9.489 45.804 26.471 1.00 27.94 ? 1035 HOH A O 1 HETATM 7723 O O . HOH V 9 . ? 15.704 70.187 19.423 1.00 47.56 ? 1036 HOH A O 1 HETATM 7724 O O . HOH V 9 . ? 20.070 69.355 35.570 1.00 46.00 ? 1037 HOH A O 1 HETATM 7725 O O . HOH V 9 . ? 37.126 55.190 39.731 1.00 56.45 ? 1038 HOH A O 1 HETATM 7726 O O . HOH V 9 . ? 5.031 44.490 25.679 1.00 46.24 ? 1039 HOH A O 1 HETATM 7727 O O . HOH V 9 . ? 1.237 36.801 24.921 1.00 58.86 ? 1040 HOH A O 1 HETATM 7728 O O . HOH V 9 . ? 16.595 61.074 62.749 1.00 51.59 ? 1041 HOH A O 1 HETATM 7729 O O . HOH V 9 . ? 5.815 31.430 11.515 1.00 60.58 ? 1042 HOH A O 1 HETATM 7730 O O . HOH V 9 . ? 3.471 33.976 49.553 1.00 43.37 ? 1043 HOH A O 1 HETATM 7731 O O . HOH V 9 . ? 12.103 17.060 31.810 1.00 58.81 ? 1044 HOH A O 1 HETATM 7732 O O . HOH V 9 . ? 10.633 63.652 20.012 1.00 44.53 ? 1045 HOH A O 1 HETATM 7733 O O . HOH V 9 . ? 24.686 58.322 40.115 1.00 32.29 ? 1046 HOH A O 1 HETATM 7734 O O . HOH V 9 . ? 2.057 23.160 20.288 1.00 40.07 ? 1047 HOH A O 1 HETATM 7735 O O . HOH V 9 . ? 28.784 59.577 13.656 1.00 51.46 ? 1048 HOH A O 1 HETATM 7736 O O . HOH V 9 . ? -3.040 47.691 31.254 1.00 48.52 ? 1049 HOH A O 1 HETATM 7737 O O . HOH V 9 . ? 2.601 38.727 24.445 1.00 47.88 ? 1050 HOH A O 1 HETATM 7738 O O . HOH V 9 . ? 1.917 62.179 36.443 1.00 57.16 ? 1051 HOH A O 1 HETATM 7739 O O . HOH V 9 . ? -0.578 47.142 23.434 1.00 57.25 ? 1052 HOH A O 1 HETATM 7740 O O . HOH V 9 . ? 17.445 61.344 11.449 1.00 35.78 ? 1053 HOH A O 1 HETATM 7741 O O . HOH V 9 . ? -1.988 62.717 30.031 1.00 44.29 ? 1054 HOH A O 1 HETATM 7742 O O . HOH V 9 . ? 2.297 43.302 26.808 1.00 36.33 ? 1055 HOH A O 1 HETATM 7743 O O . HOH V 9 . ? -1.329 39.996 26.046 1.00 43.41 ? 1056 HOH A O 1 HETATM 7744 O O . HOH V 9 . ? 12.994 49.803 26.137 1.00 17.45 ? 1057 HOH A O 1 HETATM 7745 O O . HOH V 9 . ? -1.489 45.023 49.500 1.00 51.63 ? 1058 HOH A O 1 HETATM 7746 O O . HOH V 9 . ? 25.083 23.339 14.566 1.00 48.01 ? 1059 HOH A O 1 HETATM 7747 O O . HOH V 9 . ? 1.395 35.709 50.011 1.00 52.51 ? 1060 HOH A O 1 HETATM 7748 O O . HOH V 9 . ? 38.795 38.930 23.724 1.00 51.62 ? 1061 HOH A O 1 HETATM 7749 O O . HOH V 9 . ? 26.865 23.194 12.588 1.00 42.03 ? 1062 HOH A O 1 HETATM 7750 O O . HOH V 9 . ? -1.596 57.132 37.346 1.00 55.67 ? 1063 HOH A O 1 HETATM 7751 O O . HOH V 9 . ? 29.277 22.859 13.741 1.00 42.62 ? 1064 HOH A O 1 HETATM 7752 O O . HOH V 9 . ? 5.639 30.479 9.251 1.00 45.77 ? 1065 HOH A O 1 HETATM 7753 O O . HOH V 9 . ? 18.987 29.271 52.857 1.00 49.54 ? 1066 HOH A O 1 HETATM 7754 O O . HOH V 9 . ? 13.134 62.986 12.057 1.00 43.68 ? 1067 HOH A O 1 HETATM 7755 O O . HOH V 9 . ? 0.904 20.773 27.822 1.00 45.08 ? 1068 HOH A O 1 HETATM 7756 O O . HOH V 9 . ? -2.672 30.166 31.575 1.00 43.68 ? 1069 HOH A O 1 HETATM 7757 O O . HOH V 9 . ? -2.752 32.808 28.311 1.00 45.88 ? 1070 HOH A O 1 HETATM 7758 O O . HOH V 9 . ? 1.889 55.460 43.451 1.00 35.24 ? 1071 HOH A O 1 HETATM 7759 O O . HOH V 9 . ? 30.252 49.362 12.317 1.00 62.57 ? 1072 HOH A O 1 HETATM 7760 O O . HOH V 9 . ? 1.448 32.088 25.749 1.00 52.74 ? 1073 HOH A O 1 HETATM 7761 O O . HOH V 9 . ? 16.327 19.788 38.449 1.00 58.53 ? 1074 HOH A O 1 HETATM 7762 O O . HOH V 9 . ? 6.957 31.226 7.300 1.00 35.57 ? 1075 HOH A O 1 HETATM 7763 O O . HOH V 9 . ? -1.814 45.032 29.278 1.00 33.01 ? 1076 HOH A O 1 HETATM 7764 O O . HOH V 9 . ? 10.163 51.274 13.419 1.00 41.96 ? 1077 HOH A O 1 HETATM 7765 O O . HOH V 9 . ? 3.035 19.974 31.397 1.00 40.87 ? 1078 HOH A O 1 HETATM 7766 O O . HOH V 9 . ? 12.138 19.585 37.752 1.00 56.21 ? 1079 HOH A O 1 HETATM 7767 O O . HOH V 9 . ? 26.513 67.633 29.903 1.00 42.84 ? 1080 HOH A O 1 HETATM 7768 O O . HOH V 9 . ? 7.356 40.295 51.309 1.00 55.76 ? 1081 HOH A O 1 HETATM 7769 O O . HOH V 9 . ? 1.623 30.218 49.773 1.00 47.51 ? 1082 HOH A O 1 HETATM 7770 O O . HOH V 9 . ? 18.461 19.234 35.075 1.00 41.42 ? 1083 HOH A O 1 HETATM 7771 O O . HOH V 9 . ? 4.952 31.270 5.373 1.00 33.65 ? 1084 HOH A O 1 HETATM 7772 O O . HOH V 9 . ? 10.219 68.552 29.435 1.00 53.08 ? 1085 HOH A O 1 HETATM 7773 O O . HOH V 9 . ? -2.498 54.663 38.185 1.00 39.69 ? 1086 HOH A O 1 HETATM 7774 O O . HOH V 9 . ? 13.145 66.362 13.344 1.00 56.95 ? 1087 HOH A O 1 HETATM 7775 O O . HOH V 9 . ? -0.944 48.761 26.026 1.00 36.08 ? 1088 HOH A O 1 HETATM 7776 O O . HOH V 9 . ? 37.740 35.244 23.230 1.00 45.71 ? 1089 HOH A O 1 HETATM 7777 O O . HOH V 9 . ? -2.862 33.376 42.547 1.00 50.91 ? 1090 HOH A O 1 HETATM 7778 O O . HOH V 9 . ? 20.007 20.567 39.804 1.00 47.17 ? 1091 HOH A O 1 HETATM 7779 O O . HOH V 9 . ? 23.006 19.862 36.263 1.00 45.39 ? 1092 HOH A O 1 HETATM 7780 O O . HOH V 9 . ? 11.962 47.731 15.225 1.00 35.45 ? 1093 HOH A O 1 HETATM 7781 O O . HOH V 9 . ? 19.508 64.150 47.205 1.00 38.28 ? 1094 HOH A O 1 HETATM 7782 O O . HOH V 9 . ? 26.066 20.129 12.518 1.00 52.98 ? 1095 HOH A O 1 HETATM 7783 O O . HOH V 9 . ? -0.574 26.687 21.869 1.00 48.54 ? 1096 HOH A O 1 HETATM 7784 O O . HOH V 9 . ? 3.707 52.192 46.180 1.00 36.49 ? 1097 HOH A O 1 HETATM 7785 O O . HOH V 9 . ? 26.066 60.031 10.415 1.00 45.04 ? 1098 HOH A O 1 HETATM 7786 O O . HOH V 9 . ? -1.077 29.440 35.153 1.00 39.67 ? 1099 HOH A O 1 HETATM 7787 O O . HOH V 9 . ? -2.235 34.808 46.939 1.00 44.67 ? 1100 HOH A O 1 HETATM 7788 O O . HOH V 9 . ? 3.218 46.768 20.213 1.00 50.90 ? 1101 HOH A O 1 HETATM 7789 O O . HOH V 9 . ? 22.639 23.058 41.641 1.00 46.73 ? 1102 HOH A O 1 HETATM 7790 O O . HOH V 9 . ? 5.742 30.643 51.105 1.00 42.77 ? 1103 HOH A O 1 HETATM 7791 O O . HOH V 9 . ? -0.106 29.928 24.564 1.00 53.17 ? 1104 HOH A O 1 HETATM 7792 O O . HOH V 9 . ? -1.424 37.366 26.020 1.00 47.46 ? 1105 HOH A O 1 HETATM 7793 O O . HOH V 9 . ? 24.422 61.922 8.721 1.00 56.86 ? 1106 HOH A O 1 HETATM 7794 O O . HOH V 9 . ? 37.830 56.608 37.574 1.00 52.06 ? 1107 HOH A O 1 HETATM 7795 O O . HOH V 9 . ? 32.512 23.850 28.402 1.00 53.26 ? 1108 HOH A O 1 HETATM 7796 O O . HOH V 9 . ? 0.025 29.977 42.064 1.00 43.60 ? 1109 HOH A O 1 HETATM 7797 O O . HOH V 9 . ? 37.169 56.331 34.655 1.00 48.24 ? 1110 HOH A O 1 HETATM 7798 O O . HOH V 9 . ? -0.027 28.822 48.132 1.00 58.48 ? 1111 HOH A O 1 HETATM 7799 O O . HOH V 9 . ? 0.000 24.891 20.130 0.50 36.80 ? 1112 HOH A O 1 HETATM 7800 O O . HOH V 9 . ? 22.413 21.547 39.497 1.00 56.18 ? 1113 HOH A O 1 HETATM 7801 O O . HOH V 9 . ? -1.659 25.048 32.101 1.00 57.84 ? 1114 HOH A O 1 HETATM 7802 O O . HOH V 9 . ? 3.435 48.885 13.401 1.00 53.10 ? 1115 HOH A O 1 HETATM 7803 O O . HOH V 9 . ? 4.389 28.014 51.802 1.00 53.24 ? 1116 HOH A O 1 HETATM 7804 O O . HOH V 9 . ? -3.088 33.600 45.337 1.00 46.46 ? 1117 HOH A O 1 HETATM 7805 O O . HOH V 9 . ? 1.528 25.275 10.674 1.00 53.24 ? 1118 HOH A O 1 HETATM 7806 O O . HOH V 9 . ? 34.218 47.492 54.539 1.00 48.49 ? 1119 HOH A O 1 HETATM 7807 O O . HOH V 9 . ? -5.034 54.364 39.586 1.00 46.84 ? 1120 HOH A O 1 # 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 ASP 1 13 ? ? ? A . n A 1 2 ARG 2 14 ? ? ? A . n A 1 3 HIS 3 15 ? ? ? A . n A 1 4 HIS 4 16 ? ? ? A . n A 1 5 HIS 5 17 ? ? ? A . n A 1 6 HIS 6 18 ? ? ? A . n A 1 7 HIS 7 19 ? ? ? A . n A 1 8 HIS 8 20 20 HIS HIS A . n A 1 9 LYS 9 21 21 LYS LYS A . n A 1 10 LEU 10 22 22 LEU LEU A . n A 1 11 VAL 11 23 23 VAL VAL A . n A 1 12 PRO 12 24 24 PRO PRO A . n A 1 13 LEU 13 25 25 LEU LEU A . n A 1 14 ALA 14 26 26 ALA ALA A . n A 1 15 PRO 15 27 27 PRO PRO A . n A 1 16 ALA 16 28 28 ALA ALA A . n A 1 17 ASP 17 29 29 ASP ASP A . n A 1 18 ARG 18 30 30 ARG ARG A . n A 1 19 ALA 19 31 31 ALA ALA A . n A 1 20 PRO 20 32 32 PRO PRO A . n A 1 21 ALA 21 33 33 ALA ALA A . n A 1 22 VAL 22 34 34 VAL VAL A . n A 1 23 GLY 23 35 35 GLY GLY A . n A 1 24 GLN 24 36 36 GLN GLN A . n A 1 25 PHE 25 37 37 PHE PHE A . n A 1 26 TRP 26 38 38 TRP TRP A . n A 1 27 HIS 27 39 39 HIS HIS A . n A 1 28 VAL 28 40 40 VAL VAL A . n A 1 29 THR 29 41 41 THR THR A . n A 1 30 ASP 30 42 42 ASP ASP A . n A 1 31 LEU 31 43 43 LEU LEU A . n A 1 32 HIS 32 44 44 HIS HIS A . n A 1 33 LEU 33 45 45 LEU LEU A . n A 1 34 ASP 34 46 46 ASP ASP A . n A 1 35 PRO 35 47 47 PRO PRO A . n A 1 36 THR 36 48 48 THR THR A . n A 1 37 TYR 37 49 49 TYR TYR A . n A 1 38 HIS 38 50 50 HIS HIS A . n A 1 39 ILE 39 51 51 ILE ILE A . n A 1 40 THR 40 52 52 THR THR A . n A 1 41 ASP 41 53 53 ASP ASP A . n A 1 42 ASP 42 54 54 ASP ASP A . n A 1 43 ARG 43 55 55 ARG ARG A . n A 1 44 THR 44 56 56 THR THR A . n A 1 45 LYS 45 57 57 LYS LYS A . n A 1 46 VAL 46 58 58 VAL VAL A . n A 1 47 CYS 47 59 59 CYS CYS A . n A 1 48 ALA 48 60 60 ALA ALA A . n A 1 49 SER 49 61 61 SER SER A . n A 1 50 SER 50 62 62 SER SER A . n A 1 51 LYS 51 63 63 LYS LYS A . n A 1 52 GLY 52 64 64 GLY GLY A . n A 1 53 ALA 53 65 65 ALA ALA A . n A 1 54 ASN 54 66 66 ASN ASN A . n A 1 55 ALA 55 67 67 ALA ALA A . n A 1 56 SER 56 68 68 SER SER A . n A 1 57 ASN 57 69 69 ASN ASN A . n A 1 58 PRO 58 70 70 PRO PRO A . n A 1 59 GLY 59 71 71 GLY GLY A . n A 1 60 PRO 60 72 72 PRO PRO A . n A 1 61 PHE 61 73 73 PHE PHE A . n A 1 62 GLY 62 74 74 GLY GLY A . n A 1 63 ASP 63 75 75 ASP ASP A . n A 1 64 VAL 64 76 76 VAL VAL A . n A 1 65 LEU 65 77 77 LEU LEU A . n A 1 66 CYS 66 78 78 CYS CYS A . n A 1 67 ASP 67 79 79 ASP ASP A . n A 1 68 SER 68 80 80 SER SER A . n A 1 69 PRO 69 81 81 PRO PRO A . n A 1 70 TYR 70 82 82 TYR TYR A . n A 1 71 GLN 71 83 83 GLN GLN A . n A 1 72 LEU 72 84 84 LEU LEU A . n A 1 73 ILE 73 85 85 ILE ILE A . n A 1 74 LEU 74 86 86 LEU LEU A . n A 1 75 SER 75 87 87 SER SER A . n A 1 76 ALA 76 88 88 ALA ALA A . n A 1 77 PHE 77 89 89 PHE PHE A . n A 1 78 ASP 78 90 90 ASP ASP A . n A 1 79 PHE 79 91 91 PHE PHE A . n A 1 80 ILE 80 92 92 ILE ILE A . n A 1 81 LYS 81 93 93 LYS LYS A . n A 1 82 ASN 82 94 94 ASN ASN A . n A 1 83 SER 83 95 95 SER SER A . n A 1 84 GLY 84 96 96 GLY GLY A . n A 1 85 GLN 85 97 97 GLN GLN A . n A 1 86 GLU 86 98 98 GLU GLU A . n A 1 87 ALA 87 99 99 ALA ALA A . n A 1 88 SER 88 100 100 SER SER A . n A 1 89 PHE 89 101 101 PHE PHE A . n A 1 90 MET 90 102 102 MET MET A . n A 1 91 ILE 91 103 103 ILE ILE A . n A 1 92 TRP 92 104 104 TRP TRP A . n A 1 93 THR 93 105 105 THR THR A . n A 1 94 GLY 94 106 106 GLY GLY A . n A 1 95 ASP 95 107 107 ASP ASP A . n A 1 96 SER 96 108 108 SER SER A . n A 1 97 PRO 97 109 109 PRO PRO A . n A 1 98 PRO 98 110 110 PRO PRO A . n A 1 99 HIS 99 111 111 HIS HIS A . n A 1 100 VAL 100 112 112 VAL VAL A . n A 1 101 PRO 101 113 113 PRO PRO A . n A 1 102 VAL 102 114 114 VAL VAL A . n A 1 103 PRO 103 115 115 PRO PRO A . n A 1 104 GLU 104 116 116 GLU GLU A . n A 1 105 LEU 105 117 117 LEU LEU A . n A 1 106 SER 106 118 118 SER SER A . n A 1 107 THR 107 119 119 THR THR A . n A 1 108 GLY 108 120 120 GLY GLY A . n A 1 109 THR 109 121 121 THR THR A . n A 1 110 VAL 110 122 122 VAL VAL A . n A 1 111 ILE 111 123 123 ILE ILE A . n A 1 112 LYS 112 124 124 LYS LYS A . n A 1 113 VAL 113 125 125 VAL VAL A . n A 1 114 ILE 114 126 126 ILE ILE A . n A 1 115 THR 115 127 127 THR THR A . n A 1 116 ASN 116 128 128 ASN ASN A . n A 1 117 MET 117 129 129 MET MET A . n A 1 118 THR 118 130 130 THR THR A . n A 1 119 MET 119 131 131 MET MET A . n A 1 120 THR 120 132 132 THR THR A . n A 1 121 VAL 121 133 133 VAL VAL A . n A 1 122 GLN 122 134 134 GLN GLN A . n A 1 123 ASN 123 135 135 ASN ASN A . n A 1 124 LEU 124 136 136 LEU LEU A . n A 1 125 PHE 125 137 137 PHE PHE A . n A 1 126 PRO 126 138 138 PRO PRO A . n A 1 127 ASN 127 139 139 ASN ASN A . n A 1 128 LEU 128 140 140 LEU LEU A . n A 1 129 GLN 129 141 141 GLN GLN A . n A 1 130 VAL 130 142 142 VAL VAL A . n A 1 131 PHE 131 143 143 PHE PHE A . n A 1 132 PRO 132 144 144 PRO PRO A . n A 1 133 ALA 133 145 145 ALA ALA A . n A 1 134 LEU 134 146 146 LEU LEU A . n A 1 135 GLY 135 147 147 GLY GLY A . n A 1 136 ASN 136 148 148 ASN ASN A . n A 1 137 HIS 137 149 149 HIS HIS A . n A 1 138 ASP 138 150 150 ASP ASP A . n A 1 139 TYR 139 151 151 TYR TYR A . n A 1 140 TRP 140 152 152 TRP TRP A . n A 1 141 PRO 141 153 153 PRO PRO A . n A 1 142 GLN 142 154 154 GLN GLN A . n A 1 143 ASP 143 155 155 ASP ASP A . n A 1 144 GLN 144 156 156 GLN GLN A . n A 1 145 LEU 145 157 157 LEU LEU A . n A 1 146 PRO 146 158 158 PRO PRO A . n A 1 147 ILE 147 159 159 ILE ILE A . n A 1 148 VAL 148 160 160 VAL VAL A . n A 1 149 THR 149 161 161 THR THR A . n A 1 150 SER 150 162 162 SER SER A . n A 1 151 LYS 151 163 163 LYS LYS A . n A 1 152 VAL 152 164 164 VAL VAL A . n A 1 153 TYR 153 165 165 TYR TYR A . n A 1 154 SER 154 166 166 SER SER A . n A 1 155 ALA 155 167 167 ALA ALA A . n A 1 156 VAL 156 168 168 VAL VAL A . n A 1 157 ALA 157 169 169 ALA ALA A . n A 1 158 ASP 158 170 170 ASP ASP A . n A 1 159 LEU 159 171 171 LEU LEU A . n A 1 160 TRP 160 172 172 TRP TRP A . n A 1 161 LYS 161 173 173 LYS LYS A . n A 1 162 PRO 162 174 174 PRO PRO A . n A 1 163 TRP 163 175 175 TRP TRP A . n A 1 164 LEU 164 176 176 LEU LEU A . n A 1 165 GLY 165 177 177 GLY GLY A . n A 1 166 GLU 166 178 178 GLU GLU A . n A 1 167 GLU 167 179 179 GLU GLU A . n A 1 168 ALA 168 180 180 ALA ALA A . n A 1 169 ILE 169 181 181 ILE ILE A . n A 1 170 SER 170 182 182 SER SER A . n A 1 171 THR 171 183 183 THR THR A . n A 1 172 LEU 172 184 184 LEU LEU A . n A 1 173 LYS 173 185 185 LYS LYS A . n A 1 174 LYS 174 186 186 LYS LYS A . n A 1 175 GLY 175 187 187 GLY GLY A . n A 1 176 GLY 176 188 188 GLY GLY A . n A 1 177 PHE 177 189 189 PHE PHE A . n A 1 178 TYR 178 190 190 TYR TYR A . n A 1 179 SER 179 191 191 SER SER A . n A 1 180 GLN 180 192 192 GLN GLN A . n A 1 181 LYS 181 193 193 LYS LYS A . n A 1 182 VAL 182 194 194 VAL VAL A . n A 1 183 ALA 183 195 195 ALA ALA A . n A 1 184 SER 184 196 196 SER SER A . n A 1 185 ASN 185 197 197 ASN ASN A . n A 1 186 PRO 186 198 198 PRO PRO A . n A 1 187 GLY 187 199 199 GLY GLY A . n A 1 188 LEU 188 200 200 LEU LEU A . n A 1 189 ARG 189 201 201 ARG ARG A . n A 1 190 ILE 190 202 202 ILE ILE A . n A 1 191 ILE 191 203 203 ILE ILE A . n A 1 192 SER 192 204 204 SER SER A . n A 1 193 LEU 193 205 205 LEU LEU A . n A 1 194 ASN 194 206 206 ASN ASN A . n A 1 195 THR 195 207 207 THR THR A . n A 1 196 ASN 196 208 208 ASN ASN A . n A 1 197 LEU 197 209 209 LEU LEU A . n A 1 198 TYR 198 210 210 TYR TYR A . n A 1 199 TYR 199 211 211 TYR TYR A . n A 1 200 GLY 200 212 212 GLY GLY A . n A 1 201 PRO 201 213 213 PRO PRO A . n A 1 202 ASN 202 214 214 ASN ASN A . n A 1 203 ILE 203 215 215 ILE ILE A . n A 1 204 MET 204 216 216 MET MET A . n A 1 205 THR 205 217 217 THR THR A . n A 1 206 LEU 206 218 218 LEU LEU A . n A 1 207 ASN 207 219 219 ASN ASN A . n A 1 208 LYS 208 220 220 LYS LYS A . n A 1 209 THR 209 221 221 THR THR A . n A 1 210 ASP 210 222 222 ASP ASP A . n A 1 211 PRO 211 223 223 PRO PRO A . n A 1 212 ALA 212 224 224 ALA ALA A . n A 1 213 ASN 213 225 225 ASN ASN A . n A 1 214 GLN 214 226 226 GLN GLN A . n A 1 215 PHE 215 227 227 PHE PHE A . n A 1 216 GLU 216 228 228 GLU GLU A . n A 1 217 TRP 217 229 229 TRP TRP A . n A 1 218 LEU 218 230 230 LEU LEU A . n A 1 219 GLU 219 231 231 GLU GLU A . n A 1 220 ASN 220 232 232 ASN ASN A . n A 1 221 THR 221 233 233 THR THR A . n A 1 222 LEU 222 234 234 LEU LEU A . n A 1 223 ASN 223 235 235 ASN ASN A . n A 1 224 SER 224 236 236 SER SER A . n A 1 225 SER 225 237 237 SER SER A . n A 1 226 LEU 226 238 238 LEU LEU A . n A 1 227 TRP 227 239 239 TRP TRP A . n A 1 228 ASN 228 240 240 ASN ASN A . n A 1 229 LYS 229 241 241 LYS LYS A . n A 1 230 GLU 230 242 242 GLU GLU A . n A 1 231 LYS 231 243 243 LYS LYS A . n A 1 232 VAL 232 244 244 VAL VAL A . n A 1 233 TYR 233 245 245 TYR TYR A . n A 1 234 ILE 234 246 246 ILE ILE A . n A 1 235 ILE 235 247 247 ILE ILE A . n A 1 236 ALA 236 248 248 ALA ALA A . n A 1 237 HIS 237 249 249 HIS HIS A . n A 1 238 VAL 238 250 250 VAL VAL A . n A 1 239 PRO 239 251 251 PRO PRO A . n A 1 240 VAL 240 252 252 VAL VAL A . n A 1 241 GLY 241 253 253 GLY GLY A . n A 1 242 TYR 242 254 254 TYR TYR A . n A 1 243 LEU 243 255 255 LEU LEU A . n A 1 244 PRO 244 256 256 PRO PRO A . n A 1 245 TYR 245 257 257 TYR TYR A . n A 1 246 ALA 246 258 258 ALA ALA A . n A 1 247 THR 247 259 259 THR THR A . n A 1 248 ASP 248 260 260 ASP ASP A . n A 1 249 THR 249 261 261 THR THR A . n A 1 250 PRO 250 262 262 PRO PRO A . n A 1 251 ALA 251 263 263 ALA ALA A . n A 1 252 ILE 252 264 264 ILE ILE A . n A 1 253 ARG 253 265 265 ARG ARG A . n A 1 254 GLN 254 266 266 GLN GLN A . n A 1 255 TYR 255 267 267 TYR TYR A . n A 1 256 TYR 256 268 268 TYR TYR A . n A 1 257 ASN 257 269 269 ASN ASN A . n A 1 258 GLU 258 270 270 GLU GLU A . n A 1 259 LYS 259 271 271 LYS LYS A . n A 1 260 LEU 260 272 272 LEU LEU A . n A 1 261 LEU 261 273 273 LEU LEU A . n A 1 262 ASP 262 274 274 ASP ASP A . n A 1 263 ILE 263 275 275 ILE ILE A . n A 1 264 PHE 264 276 276 PHE PHE A . n A 1 265 ARG 265 277 277 ARG ARG A . n A 1 266 ARG 266 278 278 ARG ARG A . n A 1 267 TYR 267 279 279 TYR TYR A . n A 1 268 SER 268 280 280 SER SER A . n A 1 269 SER 269 281 281 SER SER A . n A 1 270 VAL 270 282 282 VAL VAL A . n A 1 271 ILE 271 283 283 ILE ILE A . n A 1 272 ALA 272 284 284 ALA ALA A . n A 1 273 GLY 273 285 285 GLY GLY A . n A 1 274 GLN 274 286 286 GLN GLN A . n A 1 275 PHE 275 287 287 PHE PHE A . n A 1 276 TYR 276 288 288 TYR TYR A . n A 1 277 GLY 277 289 289 GLY GLY A . n A 1 278 HIS 278 290 290 HIS HIS A . n A 1 279 THR 279 291 291 THR THR A . n A 1 280 HIS 280 292 292 HIS HIS A . n A 1 281 ARG 281 293 293 ARG ARG A . n A 1 282 ASP 282 294 294 ASP ASP A . n A 1 283 SER 283 295 295 SER SER A . n A 1 284 LEU 284 296 296 LEU LEU A . n A 1 285 MET 285 297 297 MET MET A . n A 1 286 VAL 286 298 298 VAL VAL A . n A 1 287 LEU 287 299 299 LEU LEU A . n A 1 288 SER 288 300 300 SER SER A . n A 1 289 ASP 289 301 301 ASP ASP A . n A 1 290 LYS 290 302 302 LYS LYS A . n A 1 291 ASN 291 303 303 ASN ASN A . n A 1 292 GLY 292 304 304 GLY GLY A . n A 1 293 ASN 293 305 305 ASN ASN A . n A 1 294 PRO 294 306 306 PRO PRO A . n A 1 295 LEU 295 307 307 LEU LEU A . n A 1 296 ASN 296 308 308 ASN ASN A . n A 1 297 SER 297 309 309 SER SER A . n A 1 298 VAL 298 310 310 VAL VAL A . n A 1 299 PHE 299 311 311 PHE PHE A . n A 1 300 VAL 300 312 312 VAL VAL A . n A 1 301 ALA 301 313 313 ALA ALA A . n A 1 302 PRO 302 314 314 PRO PRO A . n A 1 303 ALA 303 315 315 ALA ALA A . n A 1 304 VAL 304 316 316 VAL VAL A . n A 1 305 THR 305 317 317 THR THR A . n A 1 306 PRO 306 318 318 PRO PRO A . n A 1 307 VAL 307 319 319 VAL VAL A . n A 1 308 LYS 308 320 320 LYS LYS A . n A 1 309 GLY 309 321 321 GLY GLY A . n A 1 310 VAL 310 322 322 VAL VAL A . n A 1 311 LEU 311 323 323 LEU LEU A . n A 1 312 GLN 312 324 324 GLN GLN A . n A 1 313 LYS 313 325 325 LYS LYS A . n A 1 314 GLU 314 326 326 GLU GLU A . n A 1 315 THR 315 327 327 THR THR A . n A 1 316 ASN 316 328 328 ASN ASN A . n A 1 317 ASN 317 329 329 ASN ASN A . n A 1 318 PRO 318 330 330 PRO PRO A . n A 1 319 GLY 319 331 331 GLY GLY A . n A 1 320 VAL 320 332 332 VAL VAL A . n A 1 321 ARG 321 333 333 ARG ARG A . n A 1 322 LEU 322 334 334 LEU LEU A . n A 1 323 PHE 323 335 335 PHE PHE A . n A 1 324 GLN 324 336 336 GLN GLN A . n A 1 325 TYR 325 337 337 TYR TYR A . n A 1 326 LYS 326 338 338 LYS LYS A . n A 1 327 PRO 327 339 339 PRO PRO A . n A 1 328 GLY 328 340 340 GLY GLY A . n A 1 329 ASP 329 341 341 ASP ASP A . n A 1 330 TYR 330 342 342 TYR TYR A . n A 1 331 THR 331 343 343 THR THR A . n A 1 332 LEU 332 344 344 LEU LEU A . n A 1 333 LEU 333 345 345 LEU LEU A . n A 1 334 ASP 334 346 346 ASP ASP A . n A 1 335 MET 335 347 347 MET MET A . n A 1 336 VAL 336 348 348 VAL VAL A . n A 1 337 GLN 337 349 349 GLN GLN A . n A 1 338 TYR 338 350 350 TYR TYR A . n A 1 339 TYR 339 351 351 TYR TYR A . n A 1 340 LEU 340 352 352 LEU LEU A . n A 1 341 ASN 341 353 353 ASN ASN A . n A 1 342 LEU 342 354 354 LEU LEU A . n A 1 343 THR 343 355 355 THR THR A . n A 1 344 GLU 344 356 356 GLU GLU A . n A 1 345 ALA 345 357 357 ALA ALA A . n A 1 346 ASN 346 358 358 ASN ASN A . n A 1 347 LEU 347 359 359 LEU LEU A . n A 1 348 LYS 348 360 360 LYS LYS A . n A 1 349 GLY 349 361 361 GLY GLY A . n A 1 350 GLU 350 362 362 GLU GLU A . n A 1 351 SER 351 363 363 SER SER A . n A 1 352 ASN 352 364 364 ASN ASN A . n A 1 353 TRP 353 365 365 TRP TRP A . n A 1 354 THR 354 366 366 THR THR A . n A 1 355 LEU 355 367 367 LEU LEU A . n A 1 356 GLU 356 368 368 GLU GLU A . n A 1 357 TYR 357 369 369 TYR TYR A . n A 1 358 VAL 358 370 370 VAL VAL A . n A 1 359 LEU 359 371 371 LEU LEU A . n A 1 360 THR 360 372 372 THR THR A . n A 1 361 GLN 361 373 373 GLN GLN A . n A 1 362 ALA 362 374 374 ALA ALA A . n A 1 363 TYR 363 375 375 TYR TYR A . n A 1 364 SER 364 376 376 SER SER A . n A 1 365 VAL 365 377 377 VAL VAL A . n A 1 366 ALA 366 378 378 ALA ALA A . n A 1 367 ASP 367 379 379 ASP ASP A . n A 1 368 LEU 368 380 380 LEU LEU A . n A 1 369 GLN 369 381 381 GLN GLN A . n A 1 370 PRO 370 382 382 PRO PRO A . n A 1 371 LYS 371 383 383 LYS LYS A . n A 1 372 SER 372 384 384 SER SER A . n A 1 373 LEU 373 385 385 LEU LEU A . n A 1 374 TYR 374 386 386 TYR TYR A . n A 1 375 ALA 375 387 387 ALA ALA A . n A 1 376 LEU 376 388 388 LEU LEU A . n A 1 377 VAL 377 389 389 VAL VAL A . n A 1 378 GLN 378 390 390 GLN GLN A . n A 1 379 GLN 379 391 391 GLN GLN A . n A 1 380 PHE 380 392 392 PHE PHE A . n A 1 381 ALA 381 393 393 ALA ALA A . n A 1 382 THR 382 394 394 THR THR A . n A 1 383 LYS 383 395 395 LYS LYS A . n A 1 384 ASP 384 396 396 ASP ASP A . n A 1 385 SER 385 397 397 SER SER A . n A 1 386 LYS 386 398 398 LYS LYS A . n A 1 387 GLN 387 399 399 GLN GLN A . n A 1 388 PHE 388 400 400 PHE PHE A . n A 1 389 LEU 389 401 401 LEU LEU A . n A 1 390 LYS 390 402 402 LYS LYS A . n A 1 391 TYR 391 403 403 TYR TYR A . n A 1 392 TYR 392 404 404 TYR TYR A . n A 1 393 HIS 393 405 405 HIS HIS A . n A 1 394 TYR 394 406 406 TYR TYR A . n A 1 395 TYR 395 407 407 TYR TYR A . n A 1 396 PHE 396 408 408 PHE PHE A . n A 1 397 VAL 397 409 409 VAL VAL A . n A 1 398 SER 398 410 410 SER SER A . n A 1 399 TYR 399 411 411 TYR TYR A . n A 1 400 ASP 400 412 412 ASP ASP A . n A 1 401 SER 401 413 413 SER SER A . n A 1 402 SER 402 414 414 SER SER A . n A 1 403 ALA 403 415 415 ALA ALA A . n A 1 404 THR 404 416 416 THR THR A . n A 1 405 CYS 405 417 417 CYS CYS A . n A 1 406 ASP 406 418 418 ASP ASP A . n A 1 407 GLN 407 419 419 GLN GLN A . n A 1 408 HIS 408 420 420 HIS HIS A . n A 1 409 CYS 409 421 421 CYS CYS A . n A 1 410 LYS 410 422 422 LYS LYS A . n A 1 411 THR 411 423 423 THR THR A . n A 1 412 LEU 412 424 424 LEU LEU A . n A 1 413 GLN 413 425 425 GLN GLN A . n A 1 414 VAL 414 426 426 VAL VAL A . n A 1 415 CYS 415 427 427 CYS CYS A . n A 1 416 ALA 416 428 428 ALA ALA A . n A 1 417 ILE 417 429 429 ILE ILE A . n A 1 418 MET 418 430 430 MET MET A . n A 1 419 ASN 419 431 431 ASN ASN A . n A 1 420 LEU 420 432 432 LEU LEU A . n A 1 421 ASP 421 433 433 ASP ASP A . n A 1 422 SER 422 434 434 SER SER A . n A 1 423 MET 423 435 435 MET MET A . n A 1 424 SER 424 436 436 SER SER A . n A 1 425 TYR 425 437 437 TYR TYR A . n A 1 426 ASP 426 438 438 ASP ASP A . n A 1 427 ASP 427 439 439 ASP ASP A . n A 1 428 CYS 428 440 440 CYS CYS A . n A 1 429 LEU 429 441 441 LEU LEU A . n A 1 430 LYS 430 442 442 LYS LYS A . n A 1 431 GLN 431 443 443 GLN GLN A . n A 1 432 HIS 432 444 444 HIS HIS A . n A 1 433 LEU 433 445 445 LEU LEU 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 ZN 1 501 1 ZN ZN A . C 2 ZN 1 502 2 ZN ZN A . D 3 NAG 1 503 1 NAG NAG A . E 4 FUC 2 504 1 FUC FUC A . F 3 NAG 3 505 5 NAG NAG A . G 3 NAG 1 506 2 NAG NAG A . H 3 NAG 2 507 6 NAG NAG A . I 5 BMA 1 508 1 BMA BMA A . J 6 MAN 2 509 1 MAN MAN A . K 6 MAN 3 510 2 MAN MAN A . L 3 NAG 4 511 3 NAG NAG A . M 3 NAG 5 512 4 NAG NAG A . N 4 FUC 1 513 3 FUC FUC A . O 3 NAG 2 514 7 NAG NAG A . P 3 NAG 3 515 8 NAG NAG A . Q 7 GOL 1 516 1 GOL GOL A . R 7 GOL 1 517 2 GOL GOL A . S 7 GOL 1 518 3 GOL GOL A . T 7 GOL 1 519 4 GOL GOL A . U 8 AP2 1 520 1 AP2 AP2 A . V 9 HOH 1 601 174 HOH HOH A . V 9 HOH 2 602 457 HOH HOH A . V 9 HOH 3 603 330 HOH HOH A . V 9 HOH 4 604 506 HOH HOH A . V 9 HOH 5 605 390 HOH HOH A . V 9 HOH 6 606 215 HOH HOH A . V 9 HOH 7 607 479 HOH HOH A . V 9 HOH 8 608 331 HOH HOH A . V 9 HOH 9 609 396 HOH HOH A . V 9 HOH 10 610 159 HOH HOH A . V 9 HOH 11 611 515 HOH HOH A . V 9 HOH 12 612 144 HOH HOH A . V 9 HOH 13 613 401 HOH HOH A . V 9 HOH 14 614 221 HOH HOH A . V 9 HOH 15 615 308 HOH HOH A . V 9 HOH 16 616 67 HOH HOH A . V 9 HOH 17 617 25 HOH HOH A . V 9 HOH 18 618 469 HOH HOH A . V 9 HOH 19 619 77 HOH HOH A . V 9 HOH 20 620 147 HOH HOH A . V 9 HOH 21 621 492 HOH HOH A . V 9 HOH 22 622 72 HOH HOH A . V 9 HOH 23 623 37 HOH HOH A . V 9 HOH 24 624 440 HOH HOH A . V 9 HOH 25 625 198 HOH HOH A . V 9 HOH 26 626 263 HOH HOH A . V 9 HOH 27 627 404 HOH HOH A . V 9 HOH 28 628 499 HOH HOH A . V 9 HOH 29 629 464 HOH HOH A . V 9 HOH 30 630 254 HOH HOH A . V 9 HOH 31 631 120 HOH HOH A . V 9 HOH 32 632 84 HOH HOH A . V 9 HOH 33 633 450 HOH HOH A . V 9 HOH 34 634 196 HOH HOH A . V 9 HOH 35 635 356 HOH HOH A . V 9 HOH 36 636 342 HOH HOH A . V 9 HOH 37 637 248 HOH HOH A . V 9 HOH 38 638 370 HOH HOH A . V 9 HOH 39 639 323 HOH HOH A . V 9 HOH 40 640 99 HOH HOH A . V 9 HOH 41 641 146 HOH HOH A . V 9 HOH 42 642 477 HOH HOH A . V 9 HOH 43 643 435 HOH HOH A . V 9 HOH 44 644 366 HOH HOH A . V 9 HOH 45 645 62 HOH HOH A . V 9 HOH 46 646 21 HOH HOH A . V 9 HOH 47 647 306 HOH HOH A . V 9 HOH 48 648 243 HOH HOH A . V 9 HOH 49 649 32 HOH HOH A . V 9 HOH 50 650 22 HOH HOH A . V 9 HOH 51 651 157 HOH HOH A . V 9 HOH 52 652 219 HOH HOH A . V 9 HOH 53 653 429 HOH HOH A . V 9 HOH 54 654 296 HOH HOH A . V 9 HOH 55 655 268 HOH HOH A . V 9 HOH 56 656 36 HOH HOH A . V 9 HOH 57 657 250 HOH HOH A . V 9 HOH 58 658 83 HOH HOH A . V 9 HOH 59 659 334 HOH HOH A . V 9 HOH 60 660 300 HOH HOH A . V 9 HOH 61 661 190 HOH HOH A . V 9 HOH 62 662 281 HOH HOH A . V 9 HOH 63 663 14 HOH HOH A . V 9 HOH 64 664 222 HOH HOH A . V 9 HOH 65 665 40 HOH HOH A . V 9 HOH 66 666 307 HOH HOH A . V 9 HOH 67 667 319 HOH HOH A . V 9 HOH 68 668 199 HOH HOH A . V 9 HOH 69 669 16 HOH HOH A . V 9 HOH 70 670 265 HOH HOH A . V 9 HOH 71 671 87 HOH HOH A . V 9 HOH 72 672 335 HOH HOH A . V 9 HOH 73 673 65 HOH HOH A . V 9 HOH 74 674 465 HOH HOH A . V 9 HOH 75 675 387 HOH HOH A . V 9 HOH 76 676 140 HOH HOH A . V 9 HOH 77 677 317 HOH HOH A . V 9 HOH 78 678 51 HOH HOH A . V 9 HOH 79 679 103 HOH HOH A . V 9 HOH 80 680 30 HOH HOH A . V 9 HOH 81 681 379 HOH HOH A . V 9 HOH 82 682 348 HOH HOH A . V 9 HOH 83 683 367 HOH HOH A . V 9 HOH 84 684 214 HOH HOH A . V 9 HOH 85 685 400 HOH HOH A . V 9 HOH 86 686 376 HOH HOH A . V 9 HOH 87 687 109 HOH HOH A . V 9 HOH 88 688 384 HOH HOH A . V 9 HOH 89 689 260 HOH HOH A . V 9 HOH 90 690 344 HOH HOH A . V 9 HOH 91 691 52 HOH HOH A . V 9 HOH 92 692 58 HOH HOH A . V 9 HOH 93 693 4 HOH HOH A . V 9 HOH 94 694 490 HOH HOH A . V 9 HOH 95 695 474 HOH HOH A . V 9 HOH 96 696 35 HOH HOH A . V 9 HOH 97 697 369 HOH HOH A . V 9 HOH 98 698 309 HOH HOH A . V 9 HOH 99 699 305 HOH HOH A . V 9 HOH 100 700 284 HOH HOH A . V 9 HOH 101 701 256 HOH HOH A . V 9 HOH 102 702 15 HOH HOH A . V 9 HOH 103 703 278 HOH HOH A . V 9 HOH 104 704 218 HOH HOH A . V 9 HOH 105 705 355 HOH HOH A . V 9 HOH 106 706 285 HOH HOH A . V 9 HOH 107 707 41 HOH HOH A . V 9 HOH 108 708 64 HOH HOH A . V 9 HOH 109 709 44 HOH HOH A . V 9 HOH 110 710 352 HOH HOH A . V 9 HOH 111 711 320 HOH HOH A . V 9 HOH 112 712 452 HOH HOH A . V 9 HOH 113 713 23 HOH HOH A . V 9 HOH 114 714 33 HOH HOH A . V 9 HOH 115 715 472 HOH HOH A . V 9 HOH 116 716 239 HOH HOH A . V 9 HOH 117 717 98 HOH HOH A . V 9 HOH 118 718 50 HOH HOH A . V 9 HOH 119 719 94 HOH HOH A . V 9 HOH 120 720 251 HOH HOH A . V 9 HOH 121 721 436 HOH HOH A . V 9 HOH 122 722 282 HOH HOH A . V 9 HOH 123 723 276 HOH HOH A . V 9 HOH 124 724 363 HOH HOH A . V 9 HOH 125 725 123 HOH HOH A . V 9 HOH 126 726 252 HOH HOH A . V 9 HOH 127 727 96 HOH HOH A . V 9 HOH 128 728 59 HOH HOH A . V 9 HOH 129 729 293 HOH HOH A . V 9 HOH 130 730 18 HOH HOH A . V 9 HOH 131 731 368 HOH HOH A . V 9 HOH 132 732 446 HOH HOH A . V 9 HOH 133 733 289 HOH HOH A . V 9 HOH 134 734 115 HOH HOH A . V 9 HOH 135 735 510 HOH HOH A . V 9 HOH 136 736 79 HOH HOH A . V 9 HOH 137 737 5 HOH HOH A . V 9 HOH 138 738 197 HOH HOH A . V 9 HOH 139 739 19 HOH HOH A . V 9 HOH 140 740 47 HOH HOH A . V 9 HOH 141 741 364 HOH HOH A . V 9 HOH 142 742 54 HOH HOH A . V 9 HOH 143 743 427 HOH HOH A . V 9 HOH 144 744 274 HOH HOH A . V 9 HOH 145 745 491 HOH HOH A . V 9 HOH 146 746 509 HOH HOH A . V 9 HOH 147 747 280 HOH HOH A . V 9 HOH 148 748 242 HOH HOH A . V 9 HOH 149 749 113 HOH HOH A . V 9 HOH 150 750 56 HOH HOH A . V 9 HOH 151 751 489 HOH HOH A . V 9 HOH 152 752 28 HOH HOH A . V 9 HOH 153 753 279 HOH HOH A . V 9 HOH 154 754 102 HOH HOH A . V 9 HOH 155 755 442 HOH HOH A . V 9 HOH 156 756 53 HOH HOH A . V 9 HOH 157 757 143 HOH HOH A . V 9 HOH 158 758 353 HOH HOH A . V 9 HOH 159 759 445 HOH HOH A . V 9 HOH 160 760 391 HOH HOH A . V 9 HOH 161 761 393 HOH HOH A . V 9 HOH 162 762 405 HOH HOH A . V 9 HOH 163 763 124 HOH HOH A . V 9 HOH 164 764 326 HOH HOH A . V 9 HOH 165 765 175 HOH HOH A . V 9 HOH 166 766 383 HOH HOH A . V 9 HOH 167 767 292 HOH HOH A . V 9 HOH 168 768 466 HOH HOH A . V 9 HOH 169 769 318 HOH HOH A . V 9 HOH 170 770 271 HOH HOH A . V 9 HOH 171 771 38 HOH HOH A . V 9 HOH 172 772 95 HOH HOH A . V 9 HOH 173 773 45 HOH HOH A . V 9 HOH 174 774 286 HOH HOH A . V 9 HOH 175 775 301 HOH HOH A . V 9 HOH 176 776 165 HOH HOH A . V 9 HOH 177 777 107 HOH HOH A . V 9 HOH 178 778 298 HOH HOH A . V 9 HOH 179 779 511 HOH HOH A . V 9 HOH 180 780 433 HOH HOH A . V 9 HOH 181 781 63 HOH HOH A . V 9 HOH 182 782 325 HOH HOH A . V 9 HOH 183 783 261 HOH HOH A . V 9 HOH 184 784 295 HOH HOH A . V 9 HOH 185 785 141 HOH HOH A . V 9 HOH 186 786 494 HOH HOH A . V 9 HOH 187 787 71 HOH HOH A . V 9 HOH 188 788 31 HOH HOH A . V 9 HOH 189 789 43 HOH HOH A . V 9 HOH 190 790 341 HOH HOH A . V 9 HOH 191 791 93 HOH HOH A . V 9 HOH 192 792 277 HOH HOH A . V 9 HOH 193 793 290 HOH HOH A . V 9 HOH 194 794 354 HOH HOH A . V 9 HOH 195 795 27 HOH HOH A . V 9 HOH 196 796 444 HOH HOH A . V 9 HOH 197 797 90 HOH HOH A . V 9 HOH 198 798 116 HOH HOH A . V 9 HOH 199 799 420 HOH HOH A . V 9 HOH 200 800 288 HOH HOH A . V 9 HOH 201 801 112 HOH HOH A . V 9 HOH 202 802 24 HOH HOH A . V 9 HOH 203 803 49 HOH HOH A . V 9 HOH 204 804 311 HOH HOH A . V 9 HOH 205 805 208 HOH HOH A . V 9 HOH 206 806 81 HOH HOH A . V 9 HOH 207 807 459 HOH HOH A . V 9 HOH 208 808 402 HOH HOH A . V 9 HOH 209 809 207 HOH HOH A . V 9 HOH 210 810 88 HOH HOH A . V 9 HOH 211 811 13 HOH HOH A . V 9 HOH 212 812 365 HOH HOH A . V 9 HOH 213 813 362 HOH HOH A . V 9 HOH 214 814 89 HOH HOH A . V 9 HOH 215 815 373 HOH HOH A . V 9 HOH 216 816 324 HOH HOH A . V 9 HOH 217 817 328 HOH HOH A . V 9 HOH 218 818 255 HOH HOH A . V 9 HOH 219 819 439 HOH HOH A . V 9 HOH 220 820 48 HOH HOH A . V 9 HOH 221 821 266 HOH HOH A . V 9 HOH 222 822 184 HOH HOH A . V 9 HOH 223 823 55 HOH HOH A . V 9 HOH 224 824 257 HOH HOH A . V 9 HOH 225 825 507 HOH HOH A . V 9 HOH 226 826 156 HOH HOH A . V 9 HOH 227 827 182 HOH HOH A . V 9 HOH 228 828 80 HOH HOH A . V 9 HOH 229 829 111 HOH HOH A . V 9 HOH 230 830 425 HOH HOH A . V 9 HOH 231 831 203 HOH HOH A . V 9 HOH 232 832 129 HOH HOH A . V 9 HOH 233 833 410 HOH HOH A . V 9 HOH 234 834 447 HOH HOH A . V 9 HOH 235 835 85 HOH HOH A . V 9 HOH 236 836 403 HOH HOH A . V 9 HOH 237 837 347 HOH HOH A . V 9 HOH 238 838 178 HOH HOH A . V 9 HOH 239 839 142 HOH HOH A . V 9 HOH 240 840 60 HOH HOH A . V 9 HOH 241 841 75 HOH HOH A . V 9 HOH 242 842 57 HOH HOH A . V 9 HOH 243 843 29 HOH HOH A . V 9 HOH 244 844 313 HOH HOH A . V 9 HOH 245 845 46 HOH HOH A . V 9 HOH 246 846 480 HOH HOH A . V 9 HOH 247 847 397 HOH HOH A . V 9 HOH 248 848 493 HOH HOH A . V 9 HOH 249 849 478 HOH HOH A . V 9 HOH 250 850 360 HOH HOH A . V 9 HOH 251 851 418 HOH HOH A . V 9 HOH 252 852 232 HOH HOH A . V 9 HOH 253 853 426 HOH HOH A . V 9 HOH 254 854 314 HOH HOH A . V 9 HOH 255 855 321 HOH HOH A . V 9 HOH 256 856 195 HOH HOH A . V 9 HOH 257 857 443 HOH HOH A . V 9 HOH 258 858 315 HOH HOH A . V 9 HOH 259 859 332 HOH HOH A . V 9 HOH 260 860 179 HOH HOH A . V 9 HOH 261 861 100 HOH HOH A . V 9 HOH 262 862 269 HOH HOH A . V 9 HOH 263 863 130 HOH HOH A . V 9 HOH 264 864 294 HOH HOH A . V 9 HOH 265 865 441 HOH HOH A . V 9 HOH 266 866 380 HOH HOH A . V 9 HOH 267 867 86 HOH HOH A . V 9 HOH 268 868 241 HOH HOH A . V 9 HOH 269 869 74 HOH HOH A . V 9 HOH 270 870 392 HOH HOH A . V 9 HOH 271 871 291 HOH HOH A . V 9 HOH 272 872 316 HOH HOH A . V 9 HOH 273 873 17 HOH HOH A . V 9 HOH 274 874 262 HOH HOH A . V 9 HOH 275 875 386 HOH HOH A . V 9 HOH 276 876 42 HOH HOH A . V 9 HOH 277 877 514 HOH HOH A . V 9 HOH 278 878 438 HOH HOH A . V 9 HOH 279 879 191 HOH HOH A . V 9 HOH 280 880 378 HOH HOH A . V 9 HOH 281 881 343 HOH HOH A . V 9 HOH 282 882 272 HOH HOH A . V 9 HOH 283 883 437 HOH HOH A . V 9 HOH 284 884 70 HOH HOH A . V 9 HOH 285 885 416 HOH HOH A . V 9 HOH 286 886 61 HOH HOH A . V 9 HOH 287 887 415 HOH HOH A . V 9 HOH 288 888 339 HOH HOH A . V 9 HOH 289 889 481 HOH HOH A . V 9 HOH 290 890 101 HOH HOH A . V 9 HOH 291 891 206 HOH HOH A . V 9 HOH 292 892 333 HOH HOH A . V 9 HOH 293 893 105 HOH HOH A . V 9 HOH 294 894 69 HOH HOH A . V 9 HOH 295 895 66 HOH HOH A . V 9 HOH 296 896 249 HOH HOH A . V 9 HOH 297 897 34 HOH HOH A . V 9 HOH 298 898 423 HOH HOH A . V 9 HOH 299 899 476 HOH HOH A . V 9 HOH 300 900 501 HOH HOH A . V 9 HOH 301 901 302 HOH HOH A . V 9 HOH 302 902 246 HOH HOH A . V 9 HOH 303 903 411 HOH HOH A . V 9 HOH 304 904 11 HOH HOH A . V 9 HOH 305 905 462 HOH HOH A . V 9 HOH 306 906 395 HOH HOH A . V 9 HOH 307 907 297 HOH HOH A . V 9 HOH 308 908 12 HOH HOH A . V 9 HOH 309 909 322 HOH HOH A . V 9 HOH 310 910 236 HOH HOH A . V 9 HOH 311 911 394 HOH HOH A . V 9 HOH 312 912 201 HOH HOH A . V 9 HOH 313 913 192 HOH HOH A . V 9 HOH 314 914 153 HOH HOH A . V 9 HOH 315 915 412 HOH HOH A . V 9 HOH 316 916 26 HOH HOH A . V 9 HOH 317 917 39 HOH HOH A . V 9 HOH 318 918 73 HOH HOH A . V 9 HOH 319 919 351 HOH HOH A . V 9 HOH 320 920 350 HOH HOH A . V 9 HOH 321 921 91 HOH HOH A . V 9 HOH 322 922 428 HOH HOH A . V 9 HOH 323 923 498 HOH HOH A . V 9 HOH 324 924 108 HOH HOH A . V 9 HOH 325 925 247 HOH HOH A . V 9 HOH 326 926 244 HOH HOH A . V 9 HOH 327 927 463 HOH HOH A . V 9 HOH 328 928 517 HOH HOH A . V 9 HOH 329 929 92 HOH HOH A . V 9 HOH 330 930 388 HOH HOH A . V 9 HOH 331 931 216 HOH HOH A . V 9 HOH 332 932 225 HOH HOH A . V 9 HOH 333 933 422 HOH HOH A . V 9 HOH 334 934 516 HOH HOH A . V 9 HOH 335 935 245 HOH HOH A . V 9 HOH 336 936 270 HOH HOH A . V 9 HOH 337 937 424 HOH HOH A . V 9 HOH 338 938 267 HOH HOH A . V 9 HOH 339 939 345 HOH HOH A . V 9 HOH 340 940 160 HOH HOH A . V 9 HOH 341 941 253 HOH HOH A . V 9 HOH 342 942 233 HOH HOH A . V 9 HOH 343 943 264 HOH HOH A . V 9 HOH 344 944 456 HOH HOH A . V 9 HOH 345 945 154 HOH HOH A . V 9 HOH 346 946 82 HOH HOH A . V 9 HOH 347 947 97 HOH HOH A . V 9 HOH 348 948 181 HOH HOH A . V 9 HOH 349 949 125 HOH HOH A . V 9 HOH 350 950 502 HOH HOH A . V 9 HOH 351 951 475 HOH HOH A . V 9 HOH 352 952 487 HOH HOH A . V 9 HOH 353 953 449 HOH HOH A . V 9 HOH 354 954 389 HOH HOH A . V 9 HOH 355 955 434 HOH HOH A . V 9 HOH 356 956 468 HOH HOH A . V 9 HOH 357 957 149 HOH HOH A . V 9 HOH 358 958 234 HOH HOH A . V 9 HOH 359 959 471 HOH HOH A . V 9 HOH 360 960 470 HOH HOH A . V 9 HOH 361 961 217 HOH HOH A . V 9 HOH 362 962 432 HOH HOH A . V 9 HOH 363 963 180 HOH HOH A . V 9 HOH 364 964 336 HOH HOH A . V 9 HOH 365 965 473 HOH HOH A . V 9 HOH 366 966 226 HOH HOH A . V 9 HOH 367 967 238 HOH HOH A . V 9 HOH 368 968 431 HOH HOH A . V 9 HOH 369 969 519 HOH HOH A . V 9 HOH 370 970 183 HOH HOH A . V 9 HOH 371 971 200 HOH HOH A . V 9 HOH 372 972 1 HOH HOH A . V 9 HOH 373 973 170 HOH HOH A . V 9 HOH 374 974 138 HOH HOH A . V 9 HOH 375 975 202 HOH HOH A . V 9 HOH 376 976 166 HOH HOH A . V 9 HOH 377 977 114 HOH HOH A . V 9 HOH 378 978 227 HOH HOH A . V 9 HOH 379 979 76 HOH HOH A . V 9 HOH 380 980 139 HOH HOH A . V 9 HOH 381 981 194 HOH HOH A . V 9 HOH 382 982 372 HOH HOH A . V 9 HOH 383 983 496 HOH HOH A . V 9 HOH 384 984 118 HOH HOH A . V 9 HOH 385 985 454 HOH HOH A . V 9 HOH 386 986 455 HOH HOH A . V 9 HOH 387 987 374 HOH HOH A . V 9 HOH 388 988 213 HOH HOH A . V 9 HOH 389 989 137 HOH HOH A . V 9 HOH 390 990 230 HOH HOH A . V 9 HOH 391 991 7 HOH HOH A . V 9 HOH 392 992 176 HOH HOH A . V 9 HOH 393 993 500 HOH HOH A . V 9 HOH 394 994 9 HOH HOH A . V 9 HOH 395 995 381 HOH HOH A . V 9 HOH 396 996 414 HOH HOH A . V 9 HOH 397 997 110 HOH HOH A . V 9 HOH 398 998 220 HOH HOH A . V 9 HOH 399 999 513 HOH HOH A . V 9 HOH 400 1000 209 HOH HOH A . V 9 HOH 401 1001 150 HOH HOH A . V 9 HOH 402 1002 512 HOH HOH A . V 9 HOH 403 1003 495 HOH HOH A . V 9 HOH 404 1004 237 HOH HOH A . V 9 HOH 405 1005 148 HOH HOH A . V 9 HOH 406 1006 497 HOH HOH A . V 9 HOH 407 1007 204 HOH HOH A . V 9 HOH 408 1008 104 HOH HOH A . V 9 HOH 409 1009 377 HOH HOH A . V 9 HOH 410 1010 161 HOH HOH A . V 9 HOH 411 1011 132 HOH HOH A . V 9 HOH 412 1012 212 HOH HOH A . V 9 HOH 413 1013 134 HOH HOH A . V 9 HOH 414 1014 399 HOH HOH A . V 9 HOH 415 1015 385 HOH HOH A . V 9 HOH 416 1016 167 HOH HOH A . V 9 HOH 417 1017 287 HOH HOH A . V 9 HOH 418 1018 275 HOH HOH A . V 9 HOH 419 1019 10 HOH HOH A . V 9 HOH 420 1020 299 HOH HOH A . V 9 HOH 421 1021 131 HOH HOH A . V 9 HOH 422 1022 185 HOH HOH A . V 9 HOH 423 1023 518 HOH HOH A . V 9 HOH 424 1024 371 HOH HOH A . V 9 HOH 425 1025 68 HOH HOH A . V 9 HOH 426 1026 231 HOH HOH A . V 9 HOH 427 1027 304 HOH HOH A . V 9 HOH 428 1028 152 HOH HOH A . V 9 HOH 429 1029 223 HOH HOH A . V 9 HOH 430 1030 417 HOH HOH A . V 9 HOH 431 1031 259 HOH HOH A . V 9 HOH 432 1032 224 HOH HOH A . V 9 HOH 433 1033 228 HOH HOH A . V 9 HOH 434 1034 346 HOH HOH A . V 9 HOH 435 1035 78 HOH HOH A . V 9 HOH 436 1036 158 HOH HOH A . V 9 HOH 437 1037 3 HOH HOH A . V 9 HOH 438 1038 122 HOH HOH A . V 9 HOH 439 1039 133 HOH HOH A . V 9 HOH 440 1040 508 HOH HOH A . V 9 HOH 441 1041 8 HOH HOH A . V 9 HOH 442 1042 169 HOH HOH A . V 9 HOH 443 1043 186 HOH HOH A . V 9 HOH 444 1044 155 HOH HOH A . V 9 HOH 445 1045 382 HOH HOH A . V 9 HOH 446 1046 258 HOH HOH A . V 9 HOH 447 1047 375 HOH HOH A . V 9 HOH 448 1048 460 HOH HOH A . V 9 HOH 449 1049 406 HOH HOH A . V 9 HOH 450 1050 119 HOH HOH A . V 9 HOH 451 1051 136 HOH HOH A . V 9 HOH 452 1052 145 HOH HOH A . V 9 HOH 453 1053 240 HOH HOH A . V 9 HOH 454 1054 483 HOH HOH A . V 9 HOH 455 1055 349 HOH HOH A . V 9 HOH 456 1056 117 HOH HOH A . V 9 HOH 457 1057 20 HOH HOH A . V 9 HOH 458 1058 6 HOH HOH A . V 9 HOH 459 1059 358 HOH HOH A . V 9 HOH 460 1060 505 HOH HOH A . V 9 HOH 461 1061 126 HOH HOH A . V 9 HOH 462 1062 340 HOH HOH A . V 9 HOH 463 1063 135 HOH HOH A . V 9 HOH 464 1064 329 HOH HOH A . V 9 HOH 465 1065 421 HOH HOH A . V 9 HOH 466 1066 235 HOH HOH A . V 9 HOH 467 1067 310 HOH HOH A . V 9 HOH 468 1068 398 HOH HOH A . V 9 HOH 469 1069 171 HOH HOH A . V 9 HOH 470 1070 413 HOH HOH A . V 9 HOH 471 1071 357 HOH HOH A . V 9 HOH 472 1072 193 HOH HOH A . V 9 HOH 473 1073 467 HOH HOH A . V 9 HOH 474 1074 163 HOH HOH A . V 9 HOH 475 1075 338 HOH HOH A . V 9 HOH 476 1076 273 HOH HOH A . V 9 HOH 477 1077 312 HOH HOH A . V 9 HOH 478 1078 327 HOH HOH A . V 9 HOH 479 1079 164 HOH HOH A . V 9 HOH 480 1080 419 HOH HOH A . V 9 HOH 481 1081 504 HOH HOH A . V 9 HOH 482 1082 187 HOH HOH A . V 9 HOH 483 1083 409 HOH HOH A . V 9 HOH 484 1084 359 HOH HOH A . V 9 HOH 485 1085 451 HOH HOH A . V 9 HOH 486 1086 408 HOH HOH A . V 9 HOH 487 1087 229 HOH HOH A . V 9 HOH 488 1088 283 HOH HOH A . V 9 HOH 489 1089 520 HOH HOH A . V 9 HOH 490 1090 485 HOH HOH A . V 9 HOH 491 1091 162 HOH HOH A . V 9 HOH 492 1092 2 HOH HOH A . V 9 HOH 493 1093 106 HOH HOH A . V 9 HOH 494 1094 303 HOH HOH A . V 9 HOH 495 1095 151 HOH HOH A . V 9 HOH 496 1096 430 HOH HOH A . V 9 HOH 497 1097 337 HOH HOH A . V 9 HOH 498 1098 127 HOH HOH A . V 9 HOH 499 1099 177 HOH HOH A . V 9 HOH 500 1100 210 HOH HOH A . V 9 HOH 501 1101 453 HOH HOH A . V 9 HOH 502 1102 482 HOH HOH A . V 9 HOH 503 1103 361 HOH HOH A . V 9 HOH 504 1104 168 HOH HOH A . V 9 HOH 505 1105 458 HOH HOH A . V 9 HOH 506 1106 128 HOH HOH A . V 9 HOH 507 1107 121 HOH HOH A . V 9 HOH 508 1108 488 HOH HOH A . V 9 HOH 509 1109 486 HOH HOH A . V 9 HOH 510 1110 448 HOH HOH A . V 9 HOH 511 1111 188 HOH HOH A . V 9 HOH 512 1112 407 HOH HOH A . V 9 HOH 513 1113 484 HOH HOH A . V 9 HOH 514 1114 173 HOH HOH A . V 9 HOH 515 1115 461 HOH HOH A . V 9 HOH 516 1116 189 HOH HOH A . V 9 HOH 517 1117 211 HOH HOH A . V 9 HOH 518 1118 172 HOH HOH A . V 9 HOH 519 1119 205 HOH HOH A . V 9 HOH 520 1120 503 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,K,L,M,N,O,P,Q,R,S,T,U,V # _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_special_symmetry.id _pdbx_struct_special_symmetry.PDB_model_num _pdbx_struct_special_symmetry.auth_asym_id _pdbx_struct_special_symmetry.auth_comp_id _pdbx_struct_special_symmetry.auth_seq_id _pdbx_struct_special_symmetry.PDB_ins_code _pdbx_struct_special_symmetry.label_asym_id _pdbx_struct_special_symmetry.label_comp_id _pdbx_struct_special_symmetry.label_seq_id 1 1 A HOH 715 ? V HOH . 2 1 A HOH 736 ? V HOH . 3 1 A HOH 1112 ? V HOH . # 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 OD2 ? A ASP 30 ? A ASP 42 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 NE2 ? A HIS 32 ? A HIS 44 ? 1_555 110.9 ? 2 OD2 ? A ASP 30 ? A ASP 42 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 84.9 ? 3 NE2 ? A HIS 32 ? A HIS 44 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 89.2 ? 4 OD2 ? A ASP 30 ? A ASP 42 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 NE2 ? A HIS 280 ? A HIS 292 ? 1_555 93.7 ? 5 NE2 ? A HIS 32 ? A HIS 44 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 NE2 ? A HIS 280 ? A HIS 292 ? 1_555 102.0 ? 6 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 NE2 ? A HIS 280 ? A HIS 292 ? 1_555 168.4 ? 7 OD2 ? A ASP 30 ? A ASP 42 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O1B ? U AP2 . ? A AP2 520 ? 1_555 160.9 ? 8 NE2 ? A HIS 32 ? A HIS 44 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O1B ? U AP2 . ? A AP2 520 ? 1_555 84.1 ? 9 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O1B ? U AP2 . ? A AP2 520 ? 1_555 83.5 ? 10 NE2 ? A HIS 280 ? A HIS 292 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O1B ? U AP2 . ? A AP2 520 ? 1_555 94.6 ? 11 OD2 ? A ASP 30 ? A ASP 42 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 100.4 ? 12 NE2 ? A HIS 32 ? A HIS 44 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 142.9 ? 13 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 73.8 ? 14 NE2 ? A HIS 280 ? A HIS 292 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 95.1 ? 15 O1B ? U AP2 . ? A AP2 520 ? 1_555 ZN ? B ZN . ? A ZN 501 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 61.8 ? 16 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 OD1 ? A ASN 136 ? A ASN 148 ? 1_555 104.4 ? 17 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 NE2 ? A HIS 237 ? A HIS 249 ? 1_555 81.4 ? 18 OD1 ? A ASN 136 ? A ASN 148 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 NE2 ? A HIS 237 ? A HIS 249 ? 1_555 89.0 ? 19 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 ND1 ? A HIS 278 ? A HIS 290 ? 1_555 156.7 ? 20 OD1 ? A ASN 136 ? A ASN 148 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 ND1 ? A HIS 278 ? A HIS 290 ? 1_555 98.6 ? 21 NE2 ? A HIS 237 ? A HIS 249 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 ND1 ? A HIS 278 ? A HIS 290 ? 1_555 95.7 ? 22 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O2B ? U AP2 . ? A AP2 520 ? 1_555 88.6 ? 23 OD1 ? A ASN 136 ? A ASN 148 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O2B ? U AP2 . ? A AP2 520 ? 1_555 89.1 ? 24 NE2 ? A HIS 237 ? A HIS 249 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O2B ? U AP2 . ? A AP2 520 ? 1_555 169.0 ? 25 ND1 ? A HIS 278 ? A HIS 290 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O2B ? U AP2 . ? A AP2 520 ? 1_555 95.3 ? 26 OD2 ? A ASP 95 ? A ASP 107 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 71.6 ? 27 OD1 ? A ASN 136 ? A ASN 148 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 155.8 ? 28 NE2 ? A HIS 237 ? A HIS 249 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 113.3 ? 29 ND1 ? A HIS 278 ? A HIS 290 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 88.8 ? 30 O2B ? U AP2 . ? A AP2 520 ? 1_555 ZN ? C ZN . ? A ZN 502 ? 1_555 O3B ? U AP2 . ? A AP2 520 ? 1_555 67.2 ? # 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 2016-01-27 2 'Structure model' 1 1 2016-02-03 3 'Structure model' 1 2 2016-03-30 # _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' 'Database references' # 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 ? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? '(1.10.1_2155: ???)' 1 ? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 2 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 3 ? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 4 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 O A HOH 611 ? ? O A HOH 695 ? ? 2.02 2 1 O A HOH 959 ? ? O A HOH 960 ? ? 2.08 3 1 O A HOH 933 ? ? O A HOH 1023 ? ? 2.09 4 1 O A HOH 641 ? ? O A HOH 917 ? ? 2.09 5 1 O A HOH 1006 ? ? O A HOH 1009 ? ? 2.09 6 1 O A ASP 53 ? ? O A HOH 601 ? ? 2.12 7 1 O A HOH 1100 ? ? O A HOH 1117 ? ? 2.18 8 1 O A HOH 996 ? ? O A HOH 1089 ? ? 2.19 # 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 LYS A 21 ? ? -144.58 21.88 2 1 ASN A 69 ? ? -163.41 64.92 3 1 ASP A 107 ? ? 73.45 72.94 4 1 ASP A 150 ? ? -84.05 41.27 5 1 ASP A 155 ? ? 75.61 -11.00 6 1 GLN A 156 ? ? -92.19 51.23 7 1 ALA A 224 ? ? 58.91 17.59 8 1 HIS A 249 ? ? -81.61 -70.55 9 1 HIS A 290 ? ? 69.87 -37.05 10 1 TYR A 342 ? ? 83.21 6.71 11 1 ASP A 379 ? ? -168.44 -167.94 # loop_ _pdbx_distant_solvent_atoms.id _pdbx_distant_solvent_atoms.PDB_model_num _pdbx_distant_solvent_atoms.auth_atom_id _pdbx_distant_solvent_atoms.label_alt_id _pdbx_distant_solvent_atoms.auth_asym_id _pdbx_distant_solvent_atoms.auth_comp_id _pdbx_distant_solvent_atoms.auth_seq_id _pdbx_distant_solvent_atoms.PDB_ins_code _pdbx_distant_solvent_atoms.neighbor_macromolecule_distance _pdbx_distant_solvent_atoms.neighbor_ligand_distance 1 1 O ? A HOH 1119 ? 5.87 . 2 1 O ? A HOH 1120 ? 5.89 . # 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 ASP 13 ? A ASP 1 2 1 Y 1 A ARG 14 ? A ARG 2 3 1 Y 1 A HIS 15 ? A HIS 3 4 1 Y 1 A HIS 16 ? A HIS 4 5 1 Y 1 A HIS 17 ? A HIS 5 6 1 Y 1 A HIS 18 ? A HIS 6 7 1 Y 1 A HIS 19 ? A HIS 7 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 'ZINC ION' ZN 3 N-ACETYL-D-GLUCOSAMINE NAG 4 ALPHA-L-FUCOSE FUC 5 BETA-D-MANNOSE BMA 6 ALPHA-D-MANNOSE MAN 7 GLYCEROL GOL 8 'PHOSPHOMETHYLPHOSPHONIC ACID ADENOSYL ESTER' AP2 9 water HOH #