data_5C92 # _entry.id 5C92 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.284 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 5C92 WWPDB D_1000211235 # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 5C92 _pdbx_database_status.recvd_initial_deposition_date 2015-06-26 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site PDBE _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 'Urresti, S.' 1 'Yin, D.T.' 2 'LaFond, M.' 3 'Derikvand, F.' 4 'Berrin, G.J.' 5 'Henrissat, B.' 6 'Walton, P.H.' 7 'Brumer, H.' 8 'Davies, G.J.' 9 # _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country UK _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev 'Nat Commun' _citation.journal_id_ASTM ? _citation.journal_id_CSD ? _citation.journal_id_ISSN 2041-1723 _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 6 _citation.language ? _citation.page_first 10197 _citation.page_last 10197 _citation.title 'Structure-function characterization reveals new catalytic diversity in the galactose oxidase and glyoxal oxidase family.' _citation.year 2015 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1038/ncomms10197 _citation.pdbx_database_id_PubMed 26680532 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Yin, D.T.' 1 primary 'Urresti, S.' 2 primary 'Lafond, M.' 3 primary 'Johnston, E.M.' 4 primary 'Derikvand, F.' 5 primary 'Ciano, L.' 6 primary 'Berrin, J.G.' 7 primary 'Henrissat, B.' 8 primary 'Walton, P.H.' 9 primary 'Davies, G.J.' 10 primary 'Brumer, H.' 11 # _cell.angle_alpha 90.00 _cell.angle_alpha_esd ? _cell.angle_beta 90.00 _cell.angle_beta_esd ? _cell.angle_gamma 90.00 _cell.angle_gamma_esd ? _cell.entry_id 5C92 _cell.details ? _cell.formula_units_Z ? _cell.length_a 81.580 _cell.length_a_esd ? _cell.length_b 81.580 _cell.length_b_esd ? _cell.length_c 154.250 _cell.length_c_esd ? _cell.volume ? _cell.volume_esd ? _cell.Z_PDB 8 _cell.reciprocal_angle_alpha ? _cell.reciprocal_angle_beta ? _cell.reciprocal_angle_gamma ? _cell.reciprocal_angle_alpha_esd ? _cell.reciprocal_angle_beta_esd ? _cell.reciprocal_angle_gamma_esd ? _cell.reciprocal_length_a ? _cell.reciprocal_length_b ? _cell.reciprocal_length_c ? _cell.reciprocal_length_a_esd ? _cell.reciprocal_length_b_esd ? _cell.reciprocal_length_c_esd ? _cell.pdbx_unique_axis ? # _symmetry.entry_id 5C92 _symmetry.cell_setting ? _symmetry.Int_Tables_number 96 _symmetry.space_group_name_Hall ? _symmetry.space_group_name_H-M 'P 43 21 2' _symmetry.pdbx_full_space_group_name_H-M ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man 'Kelch domain-containing protein' 52386.680 1 ? ? ? ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 2 ? ? ? ? 3 non-polymer syn 'COPPER (I) ION' 63.546 1 ? ? ? ? 4 non-polymer syn 'ACETATE ION' 59.044 1 ? ? ? ? 5 water nat water 18.015 224 ? ? ? ? # _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 ;QNVGKWGPMVKFPVVPVAVALVPETGNLLVWSSGWPNRWTTAGNGKTYTSLYNVNTGNISDAIVQNTQHDMFCPGTSLDA DGRIIVTGGSSAAKTSVLDFKKGESSPWTPLSNMQISRGYQSSCTTSEGKIFVIGGSFSGAGTRNGEVYDPKANTWTKLA GCPVKPLVMQRGMFPDSHAWLWSWKNGSVLQAGPSKKMNWYDTKGTGSNTPAGLRGTDEDSMCGVSVMYDAVAGKIFTYG GGKGYTGYDSTSNAHILTLGEPGQAVQVQKLANGKYNRGFANAVVMPDGKIWVVGGMQKMWLFSDTTPQLTPELFDPATG SFTPTTPHTVPRNYHSTALLMADATIWSGGGGLCGANCKENHFDGQFWSPPYLFEADGVTPAKRPVIQSLSDTAVRAGAP ITITMQDAGAYTFSMIRVSATTHTVNTDQRRIPLDGQDGGDGKSFTVNVPNDYGVAIPGYYMLFAMNEAGVPCVAQFFKV TLHHHHHH ; _entity_poly.pdbx_seq_one_letter_code_can ;QNVGKWGPMVKFPVVPVAVALVPETGNLLVWSSGWPNRWTTAGNGKTYTSLYNVNTGNISDAIVQNTQHDMFCPGTSLDA DGRIIVTGGSSAAKTSVLDFKKGESSPWTPLSNMQISRGYQSSCTTSEGKIFVIGGSFSGAGTRNGEVYDPKANTWTKLA GCPVKPLVMQRGMFPDSHAWLWSWKNGSVLQAGPSKKMNWYDTKGTGSNTPAGLRGTDEDSMCGVSVMYDAVAGKIFTYG GGKGYTGYDSTSNAHILTLGEPGQAVQVQKLANGKYNRGFANAVVMPDGKIWVVGGMQKMWLFSDTTPQLTPELFDPATG SFTPTTPHTVPRNYHSTALLMADATIWSGGGGLCGANCKENHFDGQFWSPPYLFEADGVTPAKRPVIQSLSDTAVRAGAP ITITMQDAGAYTFSMIRVSATTHTVNTDQRRIPLDGQDGGDGKSFTVNVPNDYGVAIPGYYMLFAMNEAGVPCVAQFFKV TLHHHHHH ; _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 GLN n 1 2 ASN n 1 3 VAL n 1 4 GLY n 1 5 LYS n 1 6 TRP n 1 7 GLY n 1 8 PRO n 1 9 MET n 1 10 VAL n 1 11 LYS n 1 12 PHE n 1 13 PRO n 1 14 VAL n 1 15 VAL n 1 16 PRO n 1 17 VAL n 1 18 ALA n 1 19 VAL n 1 20 ALA n 1 21 LEU n 1 22 VAL n 1 23 PRO n 1 24 GLU n 1 25 THR n 1 26 GLY n 1 27 ASN n 1 28 LEU n 1 29 LEU n 1 30 VAL n 1 31 TRP n 1 32 SER n 1 33 SER n 1 34 GLY n 1 35 TRP n 1 36 PRO n 1 37 ASN n 1 38 ARG n 1 39 TRP n 1 40 THR n 1 41 THR n 1 42 ALA n 1 43 GLY n 1 44 ASN n 1 45 GLY n 1 46 LYS n 1 47 THR n 1 48 TYR n 1 49 THR n 1 50 SER n 1 51 LEU n 1 52 TYR n 1 53 ASN n 1 54 VAL n 1 55 ASN n 1 56 THR n 1 57 GLY n 1 58 ASN n 1 59 ILE n 1 60 SER n 1 61 ASP n 1 62 ALA n 1 63 ILE n 1 64 VAL n 1 65 GLN n 1 66 ASN n 1 67 THR n 1 68 GLN n 1 69 HIS n 1 70 ASP n 1 71 MET n 1 72 PHE n 1 73 CYS n 1 74 PRO n 1 75 GLY n 1 76 THR n 1 77 SER n 1 78 LEU n 1 79 ASP n 1 80 ALA n 1 81 ASP n 1 82 GLY n 1 83 ARG n 1 84 ILE n 1 85 ILE n 1 86 VAL n 1 87 THR n 1 88 GLY n 1 89 GLY n 1 90 SER n 1 91 SER n 1 92 ALA n 1 93 ALA n 1 94 LYS n 1 95 THR n 1 96 SER n 1 97 VAL n 1 98 LEU n 1 99 ASP n 1 100 PHE n 1 101 LYS n 1 102 LYS n 1 103 GLY n 1 104 GLU n 1 105 SER n 1 106 SER n 1 107 PRO n 1 108 TRP n 1 109 THR n 1 110 PRO n 1 111 LEU n 1 112 SER n 1 113 ASN n 1 114 MET n 1 115 GLN n 1 116 ILE n 1 117 SER n 1 118 ARG n 1 119 GLY n 1 120 TYR n 1 121 GLN n 1 122 SER n 1 123 SER n 1 124 CYS n 1 125 THR n 1 126 THR n 1 127 SER n 1 128 GLU n 1 129 GLY n 1 130 LYS n 1 131 ILE n 1 132 PHE n 1 133 VAL n 1 134 ILE n 1 135 GLY n 1 136 GLY n 1 137 SER n 1 138 PHE n 1 139 SER n 1 140 GLY n 1 141 ALA n 1 142 GLY n 1 143 THR n 1 144 ARG n 1 145 ASN n 1 146 GLY n 1 147 GLU n 1 148 VAL n 1 149 TYR n 1 150 ASP n 1 151 PRO n 1 152 LYS n 1 153 ALA n 1 154 ASN n 1 155 THR n 1 156 TRP n 1 157 THR n 1 158 LYS n 1 159 LEU n 1 160 ALA n 1 161 GLY n 1 162 CYS n 1 163 PRO n 1 164 VAL n 1 165 LYS n 1 166 PRO n 1 167 LEU n 1 168 VAL n 1 169 MET n 1 170 GLN n 1 171 ARG n 1 172 GLY n 1 173 MET n 1 174 PHE n 1 175 PRO n 1 176 ASP n 1 177 SER n 1 178 HIS n 1 179 ALA n 1 180 TRP n 1 181 LEU n 1 182 TRP n 1 183 SER n 1 184 TRP n 1 185 LYS n 1 186 ASN n 1 187 GLY n 1 188 SER n 1 189 VAL n 1 190 LEU n 1 191 GLN n 1 192 ALA n 1 193 GLY n 1 194 PRO n 1 195 SER n 1 196 LYS n 1 197 LYS n 1 198 MET n 1 199 ASN n 1 200 TRP n 1 201 TYR n 1 202 ASP n 1 203 THR n 1 204 LYS n 1 205 GLY n 1 206 THR n 1 207 GLY n 1 208 SER n 1 209 ASN n 1 210 THR n 1 211 PRO n 1 212 ALA n 1 213 GLY n 1 214 LEU n 1 215 ARG n 1 216 GLY n 1 217 THR n 1 218 ASP n 1 219 GLU n 1 220 ASP n 1 221 SER n 1 222 MET n 1 223 CYS n 1 224 GLY n 1 225 VAL n 1 226 SER n 1 227 VAL n 1 228 MET n 1 229 TYR n 1 230 ASP n 1 231 ALA n 1 232 VAL n 1 233 ALA n 1 234 GLY n 1 235 LYS n 1 236 ILE n 1 237 PHE n 1 238 THR n 1 239 TYR n 1 240 GLY n 1 241 GLY n 1 242 GLY n 1 243 LYS n 1 244 GLY n 1 245 TYR n 1 246 THR n 1 247 GLY n 1 248 TYR n 1 249 ASP n 1 250 SER n 1 251 THR n 1 252 SER n 1 253 ASN n 1 254 ALA n 1 255 HIS n 1 256 ILE n 1 257 LEU n 1 258 THR n 1 259 LEU n 1 260 GLY n 1 261 GLU n 1 262 PRO n 1 263 GLY n 1 264 GLN n 1 265 ALA n 1 266 VAL n 1 267 GLN n 1 268 VAL n 1 269 GLN n 1 270 LYS n 1 271 LEU n 1 272 ALA n 1 273 ASN n 1 274 GLY n 1 275 LYS n 1 276 TYR n 1 277 ASN n 1 278 ARG n 1 279 GLY n 1 280 PHE n 1 281 ALA n 1 282 ASN n 1 283 ALA n 1 284 VAL n 1 285 VAL n 1 286 MET n 1 287 PRO n 1 288 ASP n 1 289 GLY n 1 290 LYS n 1 291 ILE n 1 292 TRP n 1 293 VAL n 1 294 VAL n 1 295 GLY n 1 296 GLY n 1 297 MET n 1 298 GLN n 1 299 LYS n 1 300 MET n 1 301 TRP n 1 302 LEU n 1 303 PHE n 1 304 SER n 1 305 ASP n 1 306 THR n 1 307 THR n 1 308 PRO n 1 309 GLN n 1 310 LEU n 1 311 THR n 1 312 PRO n 1 313 GLU n 1 314 LEU n 1 315 PHE n 1 316 ASP n 1 317 PRO n 1 318 ALA n 1 319 THR n 1 320 GLY n 1 321 SER n 1 322 PHE n 1 323 THR n 1 324 PRO n 1 325 THR n 1 326 THR n 1 327 PRO n 1 328 HIS n 1 329 THR n 1 330 VAL n 1 331 PRO n 1 332 ARG n 1 333 ASN n 1 334 TYR n 1 335 HIS n 1 336 SER n 1 337 THR n 1 338 ALA n 1 339 LEU n 1 340 LEU n 1 341 MET n 1 342 ALA n 1 343 ASP n 1 344 ALA n 1 345 THR n 1 346 ILE n 1 347 TRP n 1 348 SER n 1 349 GLY n 1 350 GLY n 1 351 GLY n 1 352 GLY n 1 353 LEU n 1 354 CYS n 1 355 GLY n 1 356 ALA n 1 357 ASN n 1 358 CYS n 1 359 LYS n 1 360 GLU n 1 361 ASN n 1 362 HIS n 1 363 PHE n 1 364 ASP n 1 365 GLY n 1 366 GLN n 1 367 PHE n 1 368 TRP n 1 369 SER n 1 370 PRO n 1 371 PRO n 1 372 TYR n 1 373 LEU n 1 374 PHE n 1 375 GLU n 1 376 ALA n 1 377 ASP n 1 378 GLY n 1 379 VAL n 1 380 THR n 1 381 PRO n 1 382 ALA n 1 383 LYS n 1 384 ARG n 1 385 PRO n 1 386 VAL n 1 387 ILE n 1 388 GLN n 1 389 SER n 1 390 LEU n 1 391 SER n 1 392 ASP n 1 393 THR n 1 394 ALA n 1 395 VAL n 1 396 ARG n 1 397 ALA n 1 398 GLY n 1 399 ALA n 1 400 PRO n 1 401 ILE n 1 402 THR n 1 403 ILE n 1 404 THR n 1 405 MET n 1 406 GLN n 1 407 ASP n 1 408 ALA n 1 409 GLY n 1 410 ALA n 1 411 TYR n 1 412 THR n 1 413 PHE n 1 414 SER n 1 415 MET n 1 416 ILE n 1 417 ARG n 1 418 VAL n 1 419 SER n 1 420 ALA n 1 421 THR n 1 422 THR n 1 423 HIS n 1 424 THR n 1 425 VAL n 1 426 ASN n 1 427 THR n 1 428 ASP n 1 429 GLN n 1 430 ARG n 1 431 ARG n 1 432 ILE n 1 433 PRO n 1 434 LEU n 1 435 ASP n 1 436 GLY n 1 437 GLN n 1 438 ASP n 1 439 GLY n 1 440 GLY n 1 441 ASP n 1 442 GLY n 1 443 LYS n 1 444 SER n 1 445 PHE n 1 446 THR n 1 447 VAL n 1 448 ASN n 1 449 VAL n 1 450 PRO n 1 451 ASN n 1 452 ASP n 1 453 TYR n 1 454 GLY n 1 455 VAL n 1 456 ALA n 1 457 ILE n 1 458 PRO n 1 459 GLY n 1 460 TYR n 1 461 TYR n 1 462 MET n 1 463 LEU n 1 464 PHE n 1 465 ALA n 1 466 MET n 1 467 ASN n 1 468 GLU n 1 469 ALA n 1 470 GLY n 1 471 VAL n 1 472 PRO n 1 473 CYS n 1 474 VAL n 1 475 ALA n 1 476 GLN n 1 477 PHE n 1 478 PHE n 1 479 LYS n 1 480 VAL n 1 481 THR n 1 482 LEU n 1 483 HIS n 1 484 HIS n 1 485 HIS n 1 486 HIS n 1 487 HIS n 1 488 HIS 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 488 _entity_src_gen.gene_src_common_name 'Maize anthracnose fungus' _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene GLRG_05590 _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 'Colletotrichum graminicola M1.001' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 645133 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name 'Komagataella pastoris' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 4922 _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 Plasmid _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pPICZa-C _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code E3QHV8_COLGM _struct_ref.pdbx_db_accession E3QHV8 _struct_ref.pdbx_db_isoform ? _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;QNVGKWGPMVKFPVVPVAVALVPETGNLLVWSSGWPNRWTTAGNGKTYTSLYNVNTGNISDAIVQNTQHDMFCPGTSLDA DGRIIVTGGSSAAKTSVLDFKKGESSPWTPLSNMQISRGYQSSCTTSEGKIFVIGGSFSGAGTRNGEVYDPKANTWTKLA GCPVKPLVMQRGMFPDSHAWLWSWKNGSVLQAGPSKKMNWYDTKGTGSNTPAGLRGTDEDSMCGVSVMYDAVAGKIFTYG GGKGYTGYDSTSNAHILTLGEPGQAVQVQKLANGKYNRGFANAVVMPDGKIWVVGGMQKMWLFSDTTPQLTPELFDPATG SFTPTTPHTVPRNYHSTALLMADATIWSGGGGLCGANCKENHFDGQFWSPPYLFEADGVTPAKRPVIQSLSDTAVRAGAP ITITMQDAGAYTFSMIRVSATTHTVNTDQRRIPLDGQDGGDGKSFTVNVPNDYGVAIPGYYMLFAMNEAGVPCVAQFFKV TL ; _struct_ref.pdbx_align_begin 25 # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 5C92 _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 482 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession E3QHV8 _struct_ref_seq.db_align_beg 25 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 506 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 1 _struct_ref_seq.pdbx_auth_seq_align_end 482 # 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 5C92 HIS A 483 ? UNP E3QHV8 ? ? 'expression tag' 483 1 1 5C92 HIS A 484 ? UNP E3QHV8 ? ? 'expression tag' 484 2 1 5C92 HIS A 485 ? UNP E3QHV8 ? ? 'expression tag' 485 3 1 5C92 HIS A 486 ? UNP E3QHV8 ? ? 'expression tag' 486 4 1 5C92 HIS A 487 ? UNP E3QHV8 ? ? 'expression tag' 487 5 1 5C92 HIS A 488 ? UNP E3QHV8 ? ? 'expression tag' 488 6 # 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 ACT non-polymer . 'ACETATE ION' ? 'C2 H3 O2 -1' 59.044 ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CU1 non-polymer . 'COPPER (I) ION' ? 'Cu 1' 63.546 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 5C92 _exptl.crystals_number ? _exptl.details ? _exptl.method 'X-RAY DIFFRACTION' _exptl.method_details ? # _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 2.45 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 49.86 _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, SITTING DROP' _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH 6.5 _exptl_crystal_grow.pressure ? _exptl_crystal_grow.pressure_esd ? _exptl_crystal_grow.seeding ? _exptl_crystal_grow.seeding_ref ? _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.temp_esd ? _exptl_crystal_grow.time ? _exptl_crystal_grow.pdbx_details '50% tacsimate buffer pH 6.5' _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 PIXEL _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'DECTRIS PILATUS 6M' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2014-10-02 # _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 0.979 _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 'DIAMOND BEAMLINE I03' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 0.979 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline I03 _diffrn_source.pdbx_synchrotron_site Diamond # _reflns.B_iso_Wilson_estimate ? _reflns.entry_id 5C92 _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 2.10 _reflns.d_resolution_low 72.12 _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 29704 _reflns.number_obs 29704 _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 100 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 12.9 _reflns.pdbx_Rmerge_I_obs 0.1 _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value 0.029 _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 20.6 _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 ? # _reflns_shell.d_res_high 2.10 _reflns_shell.d_res_low 2.15 _reflns_shell.meanI_over_sigI_all ? _reflns_shell.meanI_over_sigI_obs 4.3 _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_possible ? _reflns_shell.number_unique_all ? _reflns_shell.number_unique_obs ? _reflns_shell.percent_possible_all 99.9 _reflns_shell.percent_possible_obs ? _reflns_shell.Rmerge_F_all ? _reflns_shell.Rmerge_F_obs ? _reflns_shell.Rmerge_I_all ? _reflns_shell.Rmerge_I_obs 0.701 _reflns_shell.meanI_over_sigI_gt ? _reflns_shell.meanI_over_uI_all ? _reflns_shell.meanI_over_uI_gt ? _reflns_shell.number_measured_gt ? _reflns_shell.number_unique_gt ? _reflns_shell.percent_possible_gt ? _reflns_shell.Rmerge_F_gt ? _reflns_shell.Rmerge_I_gt ? _reflns_shell.pdbx_redundancy 13.2 _reflns_shell.pdbx_Rsym_value ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_netI_over_sigmaI_all ? _reflns_shell.pdbx_netI_over_sigmaI_obs ? _reflns_shell.pdbx_Rrim_I_all ? _reflns_shell.pdbx_Rpim_I_all ? _reflns_shell.pdbx_rejects ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 _reflns_shell.pdbx_CC_half ? _reflns_shell.pdbx_R_split ? # _refine.aniso_B[1][1] 0.89 _refine.aniso_B[1][2] -0.00 _refine.aniso_B[1][3] -0.00 _refine.aniso_B[2][2] 0.89 _refine.aniso_B[2][3] -0.00 _refine.aniso_B[3][3] -1.77 _refine.B_iso_max ? _refine.B_iso_mean 32.422 _refine.B_iso_min ? _refine.correlation_coeff_Fo_to_Fc 0.973 _refine.correlation_coeff_Fo_to_Fc_free 0.947 _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 5C92 _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_abs_structure_details ? _refine.ls_abs_structure_Flack ? _refine.ls_abs_structure_Flack_esd ? _refine.ls_abs_structure_Rogers ? _refine.ls_abs_structure_Rogers_esd ? _refine.ls_d_res_high 2.10 _refine.ls_d_res_low 72.12 _refine.ls_extinction_coef ? _refine.ls_extinction_coef_esd ? _refine.ls_extinction_expression ? _refine.ls_extinction_method ? _refine.ls_goodness_of_fit_all ? _refine.ls_goodness_of_fit_all_esd ? _refine.ls_goodness_of_fit_obs ? _refine.ls_goodness_of_fit_obs_esd ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 29704 _refine.ls_number_reflns_R_free 1487 _refine.ls_number_reflns_R_work ? _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 100.00 _refine.ls_percent_reflns_R_free 4.8 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.14451 _refine.ls_R_factor_R_free 0.20097 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.14167 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details MASK _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F ? _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model 5C86 _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R 0.158 _refine.pdbx_overall_ESU_R_Free 0.155 _refine.pdbx_solvent_vdw_probe_radii 1.20 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B 4.051 _refine.overall_SU_ML 0.106 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 3614 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 33 _refine_hist.number_atoms_solvent 224 _refine_hist.number_atoms_total 3871 _refine_hist.d_res_high 2.10 _refine_hist.d_res_low 72.12 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.criterion _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.number _refine_ls_restr.rejects _refine_ls_restr.type _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' ? 0.015 0.020 3749 ? r_bond_refined_d ? ? 'X-RAY DIFFRACTION' ? 0.001 0.020 3425 ? r_bond_other_d ? ? 'X-RAY DIFFRACTION' ? 1.584 1.944 5110 ? r_angle_refined_deg ? ? 'X-RAY DIFFRACTION' ? 0.808 3.000 7904 ? r_angle_other_deg ? ? 'X-RAY DIFFRACTION' ? 8.119 5.000 480 ? r_dihedral_angle_1_deg ? ? 'X-RAY DIFFRACTION' ? 37.711 24.384 146 ? r_dihedral_angle_2_deg ? ? 'X-RAY DIFFRACTION' ? 13.872 15.000 555 ? r_dihedral_angle_3_deg ? ? 'X-RAY DIFFRACTION' ? 21.630 15.000 13 ? r_dihedral_angle_4_deg ? ? 'X-RAY DIFFRACTION' ? 0.095 0.200 557 ? r_chiral_restr ? ? 'X-RAY DIFFRACTION' ? 0.014 0.021 4307 ? r_gen_planes_refined ? ? 'X-RAY DIFFRACTION' ? 0.002 0.020 856 ? r_gen_planes_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_other ? ? 'X-RAY DIFFRACTION' ? 3.464 3.130 1924 ? r_mcbond_it ? ? 'X-RAY DIFFRACTION' ? 3.441 3.127 1922 ? r_mcbond_other ? ? 'X-RAY DIFFRACTION' ? 4.293 4.676 2402 ? r_mcangle_it ? ? 'X-RAY DIFFRACTION' ? 4.295 4.678 2403 ? r_mcangle_other ? ? 'X-RAY DIFFRACTION' ? 3.799 3.313 1825 ? r_scbond_it ? ? 'X-RAY DIFFRACTION' ? 3.801 3.313 1826 ? r_scbond_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_scangle_it ? ? 'X-RAY DIFFRACTION' ? 4.920 4.870 2709 ? r_scangle_other ? ? 'X-RAY DIFFRACTION' ? 5.919 25.391 4308 ? r_long_range_B_refined ? ? 'X-RAY DIFFRACTION' ? 5.895 25.251 4229 ? r_long_range_B_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_rigid_bond_restr ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_sphericity_free ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_sphericity_bonded ? ? # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.d_res_high 2.100 _refine_ls_shell.d_res_low 2.155 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.number_reflns_R_free 110 _refine_ls_shell.number_reflns_R_work 2141 _refine_ls_shell.percent_reflns_obs 100.00 _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.R_factor_obs ? _refine_ls_shell.R_factor_R_free 0.243 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.R_factor_R_work 0.200 _refine_ls_shell.redundancy_reflns_all ? _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.wR_factor_all ? _refine_ls_shell.wR_factor_obs ? _refine_ls_shell.wR_factor_R_free ? _refine_ls_shell.wR_factor_R_work ? _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.pdbx_phase_error ? _refine_ls_shell.pdbx_fsc_work ? _refine_ls_shell.pdbx_fsc_free ? # _struct.entry_id 5C92 _struct.title 'Novel fungal alcohol oxidase with catalytic diversity among the AA5 family, in complex with copper' _struct.pdbx_descriptor 'Kelch domain-containing protein' _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 5C92 _struct_keywords.text 'Kelch motif, AA5, Fungal alcohol oxidase, oxidoreductase' _struct_keywords.pdbx_keywords OXIDOREDUCTASE # 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 5 ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 AA1 ASP A 99 ? GLY A 103 ? ASP A 99 GLY A 103 5 ? 5 HELX_P HELX_P2 AA2 VAL A 164 ? VAL A 168 ? VAL A 164 VAL A 168 5 ? 5 HELX_P HELX_P3 AA3 PRO A 370 ? PHE A 374 ? PRO A 370 PHE A 374 5 ? 5 # _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 354 SG ? ? ? 1_555 A CYS 358 SG ? ? A CYS 354 A CYS 358 1_555 ? ? ? ? ? ? ? 2.135 ? covale1 covale one ? A ASN 58 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 58 A NAG 501 1_555 ? ? ? ? ? ? ? 1.417 ? covale2 covale none ? A CYS 73 SG ? ? ? 1_555 A TYR 120 CE1 ? ? A CYS 73 A TYR 120 1_555 ? ? ? ? ? ? ? 1.712 ? metalc1 metalc ? ? A TYR 120 OH ? ? ? 1_555 D CU1 . CU ? ? A TYR 120 A CU1 503 1_555 ? ? ? ? ? ? ? 2.097 ? covale3 covale one ? A ASN 186 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 186 A NAG 502 1_555 ? ? ? ? ? ? ? 1.427 ? metalc2 metalc ? ? A HIS 335 NE2 ? ? ? 1_555 D CU1 . CU ? ? A HIS 335 A CU1 503 1_555 ? ? ? ? ? ? ? 2.207 ? metalc3 metalc ? ? A HIS 423 NE2 ? ? ? 1_555 D CU1 . CU ? ? A HIS 423 A CU1 503 1_555 ? ? ? ? ? ? ? 2.146 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # _struct_mon_prot_cis.pdbx_id 1 _struct_mon_prot_cis.label_comp_id GLY _struct_mon_prot_cis.label_seq_id 193 _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 GLY _struct_mon_prot_cis.auth_seq_id 193 _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_2 194 _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_2 194 _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 0.88 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 3 ? AA2 ? 4 ? AA3 ? 5 ? AA4 ? 4 ? AA5 ? 4 ? AA6 ? 4 ? AA7 ? 4 ? AA8 ? 4 ? AA9 ? 4 ? AB1 ? 5 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense AA1 1 2 ? anti-parallel AA1 2 3 ? anti-parallel AA2 1 2 ? anti-parallel AA2 2 3 ? anti-parallel AA2 3 4 ? anti-parallel AA3 1 2 ? anti-parallel AA3 2 3 ? anti-parallel AA3 3 4 ? anti-parallel AA3 4 5 ? anti-parallel AA4 1 2 ? anti-parallel AA4 2 3 ? anti-parallel AA4 3 4 ? anti-parallel AA5 1 2 ? anti-parallel AA5 2 3 ? anti-parallel AA5 3 4 ? anti-parallel AA6 1 2 ? anti-parallel AA6 2 3 ? anti-parallel AA6 3 4 ? anti-parallel AA7 1 2 ? anti-parallel AA7 2 3 ? anti-parallel AA7 3 4 ? anti-parallel AA8 1 2 ? anti-parallel AA8 2 3 ? anti-parallel AA8 3 4 ? anti-parallel AA9 1 2 ? anti-parallel AA9 2 3 ? anti-parallel AA9 3 4 ? anti-parallel AB1 1 2 ? parallel AB1 2 3 ? anti-parallel AB1 3 4 ? anti-parallel AB1 4 5 ? 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 LYS A 5 ? TRP A 6 ? LYS A 5 TRP A 6 AA1 2 ASP A 364 ? SER A 369 ? ASP A 364 SER A 369 AA1 3 VAL A 10 ? LYS A 11 ? VAL A 10 LYS A 11 AA2 1 LYS A 5 ? TRP A 6 ? LYS A 5 TRP A 6 AA2 2 ASP A 364 ? SER A 369 ? ASP A 364 SER A 369 AA2 3 ILE A 346 ? GLY A 350 ? ILE A 346 GLY A 350 AA2 4 SER A 336 ? LEU A 340 ? SER A 336 LEU A 340 AA3 1 ASN A 58 ? ASN A 66 ? ASN A 58 ASN A 66 AA3 2 THR A 47 ? ASN A 53 ? THR A 47 ASN A 53 AA3 3 LEU A 28 ? TRP A 31 ? LEU A 28 TRP A 31 AA3 4 ALA A 18 ? LEU A 21 ? ALA A 18 LEU A 21 AA3 5 ALA A 420 ? THR A 422 ? ALA A 420 THR A 422 AA4 1 GLY A 75 ? LEU A 78 ? GLY A 75 LEU A 78 AA4 2 ILE A 84 ? THR A 87 ? ILE A 84 THR A 87 AA4 3 THR A 95 ? LEU A 98 ? THR A 95 LEU A 98 AA4 4 THR A 109 ? LEU A 111 ? THR A 109 LEU A 111 AA5 1 SER A 122 ? THR A 125 ? SER A 122 THR A 125 AA5 2 ILE A 131 ? ILE A 134 ? ILE A 131 ILE A 134 AA5 3 GLU A 147 ? ASP A 150 ? GLU A 147 ASP A 150 AA5 4 THR A 155 ? LYS A 158 ? THR A 155 LYS A 158 AA6 1 LEU A 181 ? SER A 183 ? LEU A 181 SER A 183 AA6 2 SER A 188 ? GLN A 191 ? SER A 188 GLN A 191 AA6 3 LYS A 197 ? ASP A 202 ? LYS A 197 ASP A 202 AA6 4 SER A 208 ? LEU A 214 ? SER A 208 LEU A 214 AA7 1 VAL A 225 ? ASP A 230 ? VAL A 225 ASP A 230 AA7 2 LYS A 235 ? TYR A 239 ? LYS A 235 TYR A 239 AA7 3 ALA A 254 ? THR A 258 ? ALA A 254 THR A 258 AA7 4 GLN A 267 ? LYS A 270 ? GLN A 267 LYS A 270 AA8 1 ASN A 282 ? VAL A 285 ? ASN A 282 VAL A 285 AA8 2 ILE A 291 ? VAL A 294 ? ILE A 291 VAL A 294 AA8 3 GLU A 313 ? PHE A 315 ? GLU A 313 PHE A 315 AA8 4 PHE A 322 ? PRO A 324 ? PHE A 322 PRO A 324 AA9 1 ILE A 387 ? LEU A 390 ? ILE A 387 LEU A 390 AA9 2 PRO A 400 ? MET A 405 ? PRO A 400 MET A 405 AA9 3 SER A 444 ? ASN A 448 ? SER A 444 ASN A 448 AA9 4 GLN A 437 ? ASP A 438 ? GLN A 437 ASP A 438 AB1 1 ALA A 394 ? VAL A 395 ? ALA A 394 VAL A 395 AB1 2 GLN A 476 ? VAL A 480 ? GLN A 476 VAL A 480 AB1 3 GLY A 459 ? MET A 466 ? GLY A 459 MET A 466 AB1 4 THR A 412 ? ARG A 417 ? THR A 412 ARG A 417 AB1 5 ARG A 431 ? LEU A 434 ? ARG A 431 LEU A 434 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id AA1 1 2 N LYS A 5 ? N LYS A 5 O SER A 369 ? O SER A 369 AA1 2 3 O GLY A 365 ? O GLY A 365 N VAL A 10 ? N VAL A 10 AA2 1 2 N LYS A 5 ? N LYS A 5 O SER A 369 ? O SER A 369 AA2 2 3 O TRP A 368 ? O TRP A 368 N ILE A 346 ? N ILE A 346 AA2 3 4 O GLY A 349 ? O GLY A 349 N THR A 337 ? N THR A 337 AA3 1 2 O ASN A 58 ? O ASN A 58 N ASN A 53 ? N ASN A 53 AA3 2 3 O SER A 50 ? O SER A 50 N VAL A 30 ? N VAL A 30 AA3 3 4 O LEU A 29 ? O LEU A 29 N ALA A 20 ? N ALA A 20 AA3 4 5 N VAL A 19 ? N VAL A 19 O THR A 421 ? O THR A 421 AA4 1 2 N SER A 77 ? N SER A 77 O ILE A 85 ? O ILE A 85 AA4 2 3 N ILE A 84 ? N ILE A 84 O LEU A 98 ? O LEU A 98 AA4 3 4 N THR A 95 ? N THR A 95 O LEU A 111 ? O LEU A 111 AA5 1 2 N CYS A 124 ? N CYS A 124 O PHE A 132 ? O PHE A 132 AA5 2 3 N VAL A 133 ? N VAL A 133 O GLU A 147 ? O GLU A 147 AA5 3 4 N ASP A 150 ? N ASP A 150 O THR A 155 ? O THR A 155 AA6 1 2 N TRP A 182 ? N TRP A 182 O LEU A 190 ? O LEU A 190 AA6 2 3 N GLN A 191 ? N GLN A 191 O ASN A 199 ? O ASN A 199 AA6 3 4 N TRP A 200 ? N TRP A 200 O THR A 210 ? O THR A 210 AA7 1 2 N VAL A 227 ? N VAL A 227 O PHE A 237 ? O PHE A 237 AA7 2 3 N ILE A 236 ? N ILE A 236 O LEU A 257 ? O LEU A 257 AA7 3 4 N ILE A 256 ? N ILE A 256 O GLN A 269 ? O GLN A 269 AA8 1 2 N VAL A 284 ? N VAL A 284 O TRP A 292 ? O TRP A 292 AA8 2 3 N ILE A 291 ? N ILE A 291 O PHE A 315 ? O PHE A 315 AA8 3 4 N LEU A 314 ? N LEU A 314 O THR A 323 ? O THR A 323 AA9 1 2 N GLN A 388 ? N GLN A 388 O THR A 404 ? O THR A 404 AA9 2 3 N ILE A 403 ? N ILE A 403 O PHE A 445 ? O PHE A 445 AA9 3 4 O THR A 446 ? O THR A 446 N GLN A 437 ? N GLN A 437 AB1 1 2 N VAL A 395 ? N VAL A 395 O LYS A 479 ? O LYS A 479 AB1 2 3 O GLN A 476 ? O GLN A 476 N LEU A 463 ? N LEU A 463 AB1 3 4 O MET A 466 ? O MET A 466 N THR A 412 ? N THR A 412 AB1 4 5 N MET A 415 ? N MET A 415 O ILE A 432 ? O ILE A 432 # 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 CU1 503 ? 6 'binding site for residue CU1 A 503' AC2 Software A ACT 504 ? 4 'binding site for residue ACT A 504' AC3 Software A NAG 501 ? 8 'binding site for Mono-Saccharide NAG A 501 bound to ASN A 58' AC4 Software A NAG 502 ? 3 'binding site for Mono-Saccharide NAG A 502 bound to ASN A 186' # 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 PHE A 72 ? PHE A 72 . ? 1_555 ? 2 AC1 6 CYS A 73 ? CYS A 73 . ? 1_555 ? 3 AC1 6 TYR A 120 ? TYR A 120 . ? 1_555 ? 4 AC1 6 TYR A 334 ? TYR A 334 . ? 1_555 ? 5 AC1 6 HIS A 335 ? HIS A 335 . ? 1_555 ? 6 AC1 6 HIS A 423 ? HIS A 423 . ? 1_555 ? 7 AC2 4 TYR A 52 ? TYR A 52 . ? 1_555 ? 8 AC2 4 ASP A 343 ? ASP A 343 . ? 1_555 ? 9 AC2 4 THR A 345 ? THR A 345 . ? 1_555 ? 10 AC2 4 HOH F . ? HOH A 757 . ? 1_555 ? 11 AC3 8 THR A 56 ? THR A 56 . ? 1_555 ? 12 AC3 8 ASN A 58 ? ASN A 58 . ? 1_555 ? 13 AC3 8 THR A 251 ? THR A 251 . ? 5_544 ? 14 AC3 8 SER A 252 ? SER A 252 . ? 5_544 ? 15 AC3 8 ASN A 253 ? ASN A 253 . ? 5_544 ? 16 AC3 8 ASN A 273 ? ASN A 273 . ? 5_544 ? 17 AC3 8 HOH F . ? HOH A 698 . ? 1_555 ? 18 AC3 8 HOH F . ? HOH A 758 . ? 5_544 ? 19 AC4 3 ASN A 186 ? ASN A 186 . ? 1_555 ? 20 AC4 3 ASP A 202 ? ASP A 202 . ? 1_555 ? 21 AC4 3 LYS A 204 ? LYS A 204 . ? 1_555 ? # _atom_sites.entry_id 5C92 _atom_sites.fract_transf_matrix[1][1] 0.012258 _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] 0.012258 _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] 0.006483 _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 CU N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . ASN A 1 2 ? 37.951 -26.331 -17.749 1.00 58.73 ? 2 ASN A N 1 ATOM 2 C CA . ASN A 1 2 ? 36.903 -26.941 -16.867 1.00 59.76 ? 2 ASN A CA 1 ATOM 3 C C . ASN A 1 2 ? 35.451 -26.572 -17.241 1.00 58.09 ? 2 ASN A C 1 ATOM 4 O O . ASN A 1 2 ? 34.944 -25.512 -16.819 1.00 51.42 ? 2 ASN A O 1 ATOM 5 C CB . ASN A 1 2 ? 37.141 -26.598 -15.393 1.00 58.00 ? 2 ASN A CB 1 ATOM 6 C CG . ASN A 1 2 ? 36.368 -27.515 -14.460 1.00 60.12 ? 2 ASN A CG 1 ATOM 7 O OD1 . ASN A 1 2 ? 35.763 -28.527 -14.892 1.00 56.11 ? 2 ASN A OD1 1 ATOM 8 N ND2 . ASN A 1 2 ? 36.429 -27.217 -13.172 1.00 56.43 ? 2 ASN A ND2 1 ATOM 9 N N . VAL A 1 3 ? 34.810 -27.523 -17.953 1.00 51.71 ? 3 VAL A N 1 ATOM 10 C CA . VAL A 1 3 ? 33.422 -27.501 -18.485 1.00 43.98 ? 3 VAL A CA 1 ATOM 11 C C . VAL A 1 3 ? 32.610 -28.691 -17.867 1.00 42.95 ? 3 VAL A C 1 ATOM 12 O O . VAL A 1 3 ? 31.653 -29.217 -18.468 1.00 45.27 ? 3 VAL A O 1 ATOM 13 C CB . VAL A 1 3 ? 33.447 -27.726 -20.018 0.90 43.44 ? 3 VAL A CB 1 ATOM 14 C CG1 . VAL A 1 3 ? 33.822 -26.453 -20.774 0.60 38.69 ? 3 VAL A CG1 1 ATOM 15 C CG2 . VAL A 1 3 ? 34.380 -28.890 -20.379 0.60 39.56 ? 3 VAL A CG2 1 ATOM 16 N N . GLY A 1 4 ? 33.087 -29.212 -16.739 1.00 37.07 ? 4 GLY A N 1 ATOM 17 C CA . GLY A 1 4 ? 32.478 -30.400 -16.099 1.00 35.02 ? 4 GLY A CA 1 ATOM 18 C C . GLY A 1 4 ? 32.668 -31.690 -16.880 1.00 30.54 ? 4 GLY A C 1 ATOM 19 O O . GLY A 1 4 ? 33.474 -31.738 -17.803 1.00 25.89 ? 4 GLY A O 1 ATOM 20 N N . LYS A 1 5 ? 31.888 -32.729 -16.575 1.00 28.76 ? 5 LYS A N 1 ATOM 21 C CA . LYS A 1 5 ? 32.172 -34.036 -17.141 1.00 30.91 ? 5 LYS A CA 1 ATOM 22 C C . LYS A 1 5 ? 30.940 -34.888 -17.065 1.00 25.87 ? 5 LYS A C 1 ATOM 23 O O . LYS A 1 5 ? 30.222 -34.850 -16.070 1.00 30.54 ? 5 LYS A O 1 ATOM 24 C CB . LYS A 1 5 ? 33.324 -34.692 -16.348 1.00 34.89 ? 5 LYS A CB 1 ATOM 25 C CG . LYS A 1 5 ? 33.928 -35.949 -16.924 0.90 42.73 ? 5 LYS A CG 1 ATOM 26 C CD . LYS A 1 5 ? 35.339 -36.152 -16.342 0.70 48.05 ? 5 LYS A CD 1 ATOM 27 C CE . LYS A 1 5 ? 36.021 -37.362 -16.951 0.70 55.00 ? 5 LYS A CE 1 ATOM 28 N NZ . LYS A 1 5 ? 35.300 -38.612 -16.570 0.70 60.42 ? 5 LYS A NZ 1 ATOM 29 N N . TRP A 1 6 ? 30.719 -35.675 -18.102 1.00 24.32 ? 6 TRP A N 1 ATOM 30 C CA . TRP A 1 6 ? 29.617 -36.586 -18.108 1.00 27.37 ? 6 TRP A CA 1 ATOM 31 C C . TRP A 1 6 ? 29.998 -37.850 -17.390 1.00 32.42 ? 6 TRP A C 1 ATOM 32 O O . TRP A 1 6 ? 31.101 -38.309 -17.490 1.00 34.09 ? 6 TRP A O 1 ATOM 33 C CB . TRP A 1 6 ? 29.192 -36.930 -19.527 1.00 28.79 ? 6 TRP A CB 1 ATOM 34 C CG . TRP A 1 6 ? 28.448 -35.848 -20.213 1.00 30.21 ? 6 TRP A CG 1 ATOM 35 C CD1 . TRP A 1 6 ? 28.935 -35.028 -21.151 1.00 29.29 ? 6 TRP A CD1 1 ATOM 36 C CD2 . TRP A 1 6 ? 27.063 -35.482 -20.031 1.00 25.76 ? 6 TRP A CD2 1 ATOM 37 N NE1 . TRP A 1 6 ? 27.950 -34.187 -21.617 1.00 30.17 ? 6 TRP A NE1 1 ATOM 38 C CE2 . TRP A 1 6 ? 26.795 -34.423 -20.931 1.00 27.80 ? 6 TRP A CE2 1 ATOM 39 C CE3 . TRP A 1 6 ? 26.050 -35.935 -19.208 1.00 24.08 ? 6 TRP A CE3 1 ATOM 40 C CZ2 . TRP A 1 6 ? 25.554 -33.799 -21.025 1.00 25.85 ? 6 TRP A CZ2 1 ATOM 41 C CZ3 . TRP A 1 6 ? 24.789 -35.329 -19.314 1.00 28.80 ? 6 TRP A CZ3 1 ATOM 42 C CH2 . TRP A 1 6 ? 24.550 -34.290 -20.244 1.00 25.01 ? 6 TRP A CH2 1 ATOM 43 N N . GLY A 1 7 ? 29.037 -38.408 -16.688 1.00 29.89 ? 7 GLY A N 1 ATOM 44 C CA . GLY A 1 7 ? 29.154 -39.702 -16.084 1.00 32.93 ? 7 GLY A CA 1 ATOM 45 C C . GLY A 1 7 ? 28.698 -40.776 -17.063 1.00 32.18 ? 7 GLY A C 1 ATOM 46 O O . GLY A 1 7 ? 28.418 -40.499 -18.228 1.00 29.13 ? 7 GLY A O 1 ATOM 47 N N . PRO A 1 8 ? 28.755 -42.035 -16.629 1.00 39.44 ? 8 PRO A N 1 ATOM 48 C CA . PRO A 1 8 ? 28.395 -43.166 -17.514 1.00 36.88 ? 8 PRO A CA 1 ATOM 49 C C . PRO A 1 8 ? 26.891 -43.213 -17.818 1.00 26.91 ? 8 PRO A C 1 ATOM 50 O O . PRO A 1 8 ? 26.081 -42.670 -17.127 1.00 25.38 ? 8 PRO A O 1 ATOM 51 C CB . PRO A 1 8 ? 28.835 -44.402 -16.709 1.00 42.31 ? 8 PRO A CB 1 ATOM 52 C CG . PRO A 1 8 ? 29.876 -43.882 -15.764 1.00 46.73 ? 8 PRO A CG 1 ATOM 53 C CD . PRO A 1 8 ? 29.445 -42.488 -15.405 1.00 49.14 ? 8 PRO A CD 1 ATOM 54 N N . MET A 1 9 ? 26.549 -43.824 -18.907 1.00 28.69 ? 9 MET A N 1 ATOM 55 C CA . MET A 1 9 ? 25.204 -43.800 -19.358 1.00 28.36 ? 9 MET A CA 1 ATOM 56 C C . MET A 1 9 ? 24.420 -44.893 -18.672 1.00 28.36 ? 9 MET A C 1 ATOM 57 O O . MET A 1 9 ? 24.943 -45.984 -18.438 1.00 23.41 ? 9 MET A O 1 ATOM 58 C CB . MET A 1 9 ? 25.229 -43.998 -20.859 1.00 33.18 ? 9 MET A CB 1 ATOM 59 C CG . MET A 1 9 ? 26.200 -43.030 -21.562 1.00 46.11 ? 9 MET A CG 1 ATOM 60 S SD . MET A 1 9 ? 26.239 -43.342 -23.321 1.00 58.80 ? 9 MET A SD 1 ATOM 61 C CE . MET A 1 9 ? 24.478 -43.162 -23.690 0.80 54.60 ? 9 MET A CE 1 ATOM 62 N N . VAL A 1 10 ? 23.168 -44.594 -18.374 1.00 25.64 ? 10 VAL A N 1 ATOM 63 C CA . VAL A 1 10 ? 22.268 -45.561 -17.835 1.00 25.95 ? 10 VAL A CA 1 ATOM 64 C C . VAL A 1 10 ? 21.103 -45.658 -18.789 1.00 29.86 ? 10 VAL A C 1 ATOM 65 O O . VAL A 1 10 ? 20.902 -44.785 -19.632 1.00 28.66 ? 10 VAL A O 1 ATOM 66 C CB . VAL A 1 10 ? 21.845 -45.212 -16.394 1.00 25.48 ? 10 VAL A CB 1 ATOM 67 C CG1 . VAL A 1 10 ? 23.060 -45.029 -15.516 1.00 29.65 ? 10 VAL A CG1 1 ATOM 68 C CG2 . VAL A 1 10 ? 21.048 -43.944 -16.331 1.00 28.40 ? 10 VAL A CG2 1 ATOM 69 N N . LYS A 1 11 ? 20.410 -46.786 -18.741 1.00 25.20 ? 11 LYS A N 1 ATOM 70 C CA . LYS A 1 11 ? 19.285 -47.034 -19.639 1.00 26.20 ? 11 LYS A CA 1 ATOM 71 C C . LYS A 1 11 ? 18.159 -47.656 -18.846 1.00 27.78 ? 11 LYS A C 1 ATOM 72 O O . LYS A 1 11 ? 18.196 -48.839 -18.514 1.00 27.78 ? 11 LYS A O 1 ATOM 73 C CB . LYS A 1 11 ? 19.727 -47.939 -20.827 1.00 25.77 ? 11 LYS A CB 1 ATOM 74 C CG . LYS A 1 11 ? 18.686 -48.224 -21.906 1.00 30.16 ? 11 LYS A CG 1 ATOM 75 C CD . LYS A 1 11 ? 19.345 -48.914 -23.112 1.00 38.41 ? 11 LYS A CD 1 ATOM 76 C CE . LYS A 1 11 ? 18.490 -48.977 -24.360 1.00 41.51 ? 11 LYS A CE 1 ATOM 77 N NZ . LYS A 1 11 ? 17.498 -50.068 -24.172 1.00 46.20 ? 11 LYS A NZ 1 ATOM 78 N N . PHE A 1 12 ? 17.134 -46.859 -18.576 1.00 22.72 ? 12 PHE A N 1 ATOM 79 C CA . PHE A 1 12 ? 15.996 -47.316 -17.853 1.00 23.94 ? 12 PHE A CA 1 ATOM 80 C C . PHE A 1 12 ? 15.090 -48.234 -18.687 1.00 24.42 ? 12 PHE A C 1 ATOM 81 O O . PHE A 1 12 ? 15.100 -48.180 -19.903 1.00 28.68 ? 12 PHE A O 1 ATOM 82 C CB . PHE A 1 12 ? 15.173 -46.124 -17.370 1.00 23.38 ? 12 PHE A CB 1 ATOM 83 C CG . PHE A 1 12 ? 15.797 -45.353 -16.262 1.00 25.04 ? 12 PHE A CG 1 ATOM 84 C CD1 . PHE A 1 12 ? 15.629 -45.753 -14.932 1.00 30.12 ? 12 PHE A CD1 1 ATOM 85 C CD2 . PHE A 1 12 ? 16.547 -44.211 -16.533 1.00 25.56 ? 12 PHE A CD2 1 ATOM 86 C CE1 . PHE A 1 12 ? 16.177 -45.002 -13.895 1.00 28.01 ? 12 PHE A CE1 1 ATOM 87 C CE2 . PHE A 1 12 ? 17.108 -43.474 -15.501 1.00 28.17 ? 12 PHE A CE2 1 ATOM 88 C CZ . PHE A 1 12 ? 16.883 -43.836 -14.183 1.00 27.56 ? 12 PHE A CZ 1 ATOM 89 N N . PRO A 1 13 ? 14.275 -49.035 -18.024 1.00 24.70 ? 13 PRO A N 1 ATOM 90 C CA . PRO A 1 13 ? 13.336 -49.951 -18.664 1.00 26.10 ? 13 PRO A CA 1 ATOM 91 C C . PRO A 1 13 ? 11.998 -49.259 -18.896 1.00 27.81 ? 13 PRO A C 1 ATOM 92 O O . PRO A 1 13 ? 11.059 -49.887 -19.276 1.00 27.90 ? 13 PRO A O 1 ATOM 93 C CB . PRO A 1 13 ? 13.125 -51.009 -17.604 1.00 24.85 ? 13 PRO A CB 1 ATOM 94 C CG . PRO A 1 13 ? 13.331 -50.275 -16.299 1.00 25.35 ? 13 PRO A CG 1 ATOM 95 C CD . PRO A 1 13 ? 14.459 -49.350 -16.591 1.00 27.24 ? 13 PRO A CD 1 ATOM 96 N N . VAL A 1 14 ? 11.879 -47.989 -18.508 1.00 26.78 ? 14 VAL A N 1 ATOM 97 C CA . VAL A 1 14 ? 10.831 -47.110 -19.026 1.00 25.82 ? 14 VAL A CA 1 ATOM 98 C C . VAL A 1 14 ? 11.462 -45.801 -19.553 1.00 24.54 ? 14 VAL A C 1 ATOM 99 O O . VAL A 1 14 ? 12.546 -45.449 -19.142 1.00 26.49 ? 14 VAL A O 1 ATOM 100 C CB . VAL A 1 14 ? 9.771 -46.775 -17.943 1.00 29.27 ? 14 VAL A CB 1 ATOM 101 C CG1 . VAL A 1 14 ? 9.232 -48.008 -17.281 1.00 32.15 ? 14 VAL A CG1 1 ATOM 102 C CG2 . VAL A 1 14 ? 10.311 -45.830 -16.871 1.00 28.84 ? 14 VAL A CG2 1 ATOM 103 N N . VAL A 1 15 ? 10.796 -45.091 -20.446 1.00 23.86 ? 15 VAL A N 1 ATOM 104 C CA . VAL A 1 15 ? 11.337 -43.819 -20.914 1.00 23.15 ? 15 VAL A CA 1 ATOM 105 C C . VAL A 1 15 ? 11.112 -42.782 -19.825 1.00 21.24 ? 15 VAL A C 1 ATOM 106 O O . VAL A 1 15 ? 9.989 -42.624 -19.374 1.00 19.81 ? 15 VAL A O 1 ATOM 107 C CB . VAL A 1 15 ? 10.647 -43.332 -22.172 1.00 26.79 ? 15 VAL A CB 1 ATOM 108 C CG1 . VAL A 1 15 ? 11.313 -42.024 -22.649 1.00 24.95 ? 15 VAL A CG1 1 ATOM 109 C CG2 . VAL A 1 15 ? 10.666 -44.430 -23.218 1.00 26.29 ? 15 VAL A CG2 1 ATOM 110 N N . PRO A 1 16 ? 12.187 -42.175 -19.302 1.00 18.77 ? 16 PRO A N 1 ATOM 111 C CA . PRO A 1 16 ? 12.041 -41.281 -18.130 1.00 18.37 ? 16 PRO A CA 1 ATOM 112 C C . PRO A 1 16 ? 11.507 -39.905 -18.542 1.00 19.60 ? 16 PRO A C 1 ATOM 113 O O . PRO A 1 16 ? 12.220 -38.900 -18.477 1.00 19.93 ? 16 PRO A O 1 ATOM 114 C CB . PRO A 1 16 ? 13.453 -41.222 -17.573 1.00 18.42 ? 16 PRO A CB 1 ATOM 115 C CG . PRO A 1 16 ? 14.293 -41.368 -18.773 1.00 19.05 ? 16 PRO A CG 1 ATOM 116 C CD . PRO A 1 16 ? 13.592 -42.291 -19.717 1.00 18.45 ? 16 PRO A CD 1 ATOM 117 N N . VAL A 1 17 ? 10.220 -39.884 -18.887 1.00 18.90 ? 17 VAL A N 1 ATOM 118 C CA . VAL A 1 17 ? 9.470 -38.685 -19.251 1.00 21.71 ? 17 VAL A CA 1 ATOM 119 C C . VAL A 1 17 ? 9.131 -37.772 -18.072 1.00 20.31 ? 17 VAL A C 1 ATOM 120 O O . VAL A 1 17 ? 8.937 -36.565 -18.253 1.00 22.58 ? 17 VAL A O 1 ATOM 121 C CB . VAL A 1 17 ? 8.185 -39.088 -20.051 1.00 19.67 ? 17 VAL A CB 1 ATOM 122 C CG1 . VAL A 1 17 ? 7.350 -37.886 -20.443 1.00 22.55 ? 17 VAL A CG1 1 ATOM 123 C CG2 . VAL A 1 17 ? 8.634 -39.800 -21.309 1.00 22.60 ? 17 VAL A CG2 1 ATOM 124 N N . ALA A 1 18 ? 8.953 -38.370 -16.901 1.00 18.75 ? 18 ALA A N 1 ATOM 125 C CA . ALA A 1 18 ? 8.791 -37.632 -15.653 1.00 21.01 ? 18 ALA A CA 1 ATOM 126 C C . ALA A 1 18 ? 9.758 -38.251 -14.683 1.00 24.30 ? 18 ALA A C 1 ATOM 127 O O . ALA A 1 18 ? 10.014 -39.473 -14.716 1.00 21.45 ? 18 ALA A O 1 ATOM 128 C CB . ALA A 1 18 ? 7.381 -37.773 -15.119 1.00 22.62 ? 18 ALA A CB 1 ATOM 129 N N . VAL A 1 19 ? 10.308 -37.408 -13.841 1.00 23.36 ? 19 VAL A N 1 ATOM 130 C CA . VAL A 1 19 ? 11.269 -37.823 -12.844 1.00 20.44 ? 19 VAL A CA 1 ATOM 131 C C . VAL A 1 19 ? 11.097 -37.000 -11.571 1.00 22.77 ? 19 VAL A C 1 ATOM 132 O O . VAL A 1 19 ? 10.625 -35.844 -11.587 1.00 21.91 ? 19 VAL A O 1 ATOM 133 C CB . VAL A 1 19 ? 12.733 -37.696 -13.320 1.00 22.52 ? 19 VAL A CB 1 ATOM 134 C CG1 . VAL A 1 19 ? 12.966 -38.479 -14.611 1.00 24.53 ? 19 VAL A CG1 1 ATOM 135 C CG2 . VAL A 1 19 ? 13.185 -36.223 -13.464 1.00 22.67 ? 19 VAL A CG2 1 ATOM 136 N N . ALA A 1 20 ? 11.454 -37.614 -10.454 1.00 21.45 ? 20 ALA A N 1 ATOM 137 C CA . ALA A 1 20 ? 11.350 -36.961 -9.128 1.00 25.84 ? 20 ALA A CA 1 ATOM 138 C C . ALA A 1 20 ? 12.504 -37.383 -8.260 1.00 24.30 ? 20 ALA A C 1 ATOM 139 O O . ALA A 1 20 ? 12.904 -38.572 -8.276 1.00 24.29 ? 20 ALA A O 1 ATOM 140 C CB . ALA A 1 20 ? 10.058 -37.352 -8.468 1.00 24.66 ? 20 ALA A CB 1 ATOM 141 N N . LEU A 1 21 ? 13.076 -36.434 -7.534 1.00 23.20 ? 21 LEU A N 1 ATOM 142 C CA . LEU A 1 21 ? 14.022 -36.763 -6.461 1.00 22.19 ? 21 LEU A CA 1 ATOM 143 C C . LEU A 1 21 ? 13.304 -37.152 -5.162 1.00 23.11 ? 21 LEU A C 1 ATOM 144 O O . LEU A 1 21 ? 12.460 -36.417 -4.665 1.00 25.87 ? 21 LEU A O 1 ATOM 145 C CB . LEU A 1 21 ? 14.969 -35.605 -6.192 1.00 23.91 ? 21 LEU A CB 1 ATOM 146 C CG . LEU A 1 21 ? 16.186 -35.887 -5.334 1.00 25.08 ? 21 LEU A CG 1 ATOM 147 C CD1 . LEU A 1 21 ? 17.197 -36.667 -6.115 1.00 27.15 ? 21 LEU A CD1 1 ATOM 148 C CD2 . LEU A 1 21 ? 16.832 -34.612 -4.769 1.00 30.28 ? 21 LEU A CD2 1 ATOM 149 N N . VAL A 1 22 ? 13.620 -38.335 -4.626 1.00 24.77 ? 22 VAL A N 1 ATOM 150 C CA . VAL A 1 22 ? 12.913 -38.844 -3.436 1.00 22.84 ? 22 VAL A CA 1 ATOM 151 C C . VAL A 1 22 ? 13.610 -38.256 -2.203 1.00 21.55 ? 22 VAL A C 1 ATOM 152 O O . VAL A 1 22 ? 14.852 -38.398 -2.046 1.00 23.92 ? 22 VAL A O 1 ATOM 153 C CB . VAL A 1 22 ? 12.917 -40.382 -3.342 1.00 26.65 ? 22 VAL A CB 1 ATOM 154 C CG1 . VAL A 1 22 ? 11.948 -40.833 -2.224 1.00 26.88 ? 22 VAL A CG1 1 ATOM 155 C CG2 . VAL A 1 22 ? 12.568 -40.999 -4.691 1.00 25.16 ? 22 VAL A CG2 1 ATOM 156 N N . PRO A 1 23 ? 12.838 -37.637 -1.305 1.00 20.69 ? 23 PRO A N 1 ATOM 157 C CA . PRO A 1 23 ? 13.453 -37.115 -0.096 1.00 21.98 ? 23 PRO A CA 1 ATOM 158 C C . PRO A 1 23 ? 14.185 -38.197 0.735 1.00 23.79 ? 23 PRO A C 1 ATOM 159 O O . PRO A 1 23 ? 13.836 -39.401 0.672 1.00 23.97 ? 23 PRO A O 1 ATOM 160 C CB . PRO A 1 23 ? 12.264 -36.547 0.675 1.00 20.99 ? 23 PRO A CB 1 ATOM 161 C CG . PRO A 1 23 ? 11.288 -36.180 -0.357 1.00 20.42 ? 23 PRO A CG 1 ATOM 162 C CD . PRO A 1 23 ? 11.427 -37.224 -1.410 1.00 22.23 ? 23 PRO A CD 1 ATOM 163 N N . GLU A 1 24 ? 15.203 -37.745 1.445 1.00 24.60 ? 24 GLU A N 1 ATOM 164 C CA . GLU A 1 24 ? 15.995 -38.519 2.410 1.00 26.44 ? 24 GLU A CA 1 ATOM 165 C C . GLU A 1 24 ? 17.035 -39.420 1.776 1.00 25.42 ? 24 GLU A C 1 ATOM 166 O O . GLU A 1 24 ? 18.228 -39.215 2.020 1.00 28.02 ? 24 GLU A O 1 ATOM 167 C CB . GLU A 1 24 ? 15.128 -39.288 3.414 1.00 26.42 ? 24 GLU A CB 1 ATOM 168 C CG . GLU A 1 24 ? 14.251 -38.412 4.299 1.00 27.95 ? 24 GLU A CG 1 ATOM 169 C CD . GLU A 1 24 ? 14.990 -37.606 5.387 1.00 27.10 ? 24 GLU A CD 1 ATOM 170 O OE1 . GLU A 1 24 ? 14.288 -36.856 6.099 1.00 30.40 ? 24 GLU A OE1 1 ATOM 171 O OE2 . GLU A 1 24 ? 16.229 -37.626 5.485 1.00 28.88 ? 24 GLU A OE2 1 ATOM 172 N N . THR A 1 25 ? 16.651 -40.315 0.871 1.00 27.91 ? 25 THR A N 1 ATOM 173 C CA . THR A 1 25 ? 17.668 -41.039 0.095 1.00 25.57 ? 25 THR A CA 1 ATOM 174 C C . THR A 1 25 ? 18.303 -40.210 -1.006 1.00 25.90 ? 25 THR A C 1 ATOM 175 O O . THR A 1 25 ? 19.485 -40.412 -1.348 1.00 23.30 ? 25 THR A O 1 ATOM 176 C CB . THR A 1 25 ? 17.084 -42.276 -0.569 1.00 23.45 ? 25 THR A CB 1 ATOM 177 O OG1 . THR A 1 25 ? 15.918 -41.911 -1.309 1.00 21.80 ? 25 THR A OG1 1 ATOM 178 C CG2 . THR A 1 25 ? 16.659 -43.292 0.505 1.00 24.09 ? 25 THR A CG2 1 ATOM 179 N N . GLY A 1 26 ? 17.483 -39.425 -1.696 1.00 25.61 ? 26 GLY A N 1 ATOM 180 C CA . GLY A 1 26 ? 17.922 -38.841 -2.963 1.00 23.75 ? 26 GLY A CA 1 ATOM 181 C C . GLY A 1 26 ? 17.895 -39.776 -4.156 1.00 22.65 ? 26 GLY A C 1 ATOM 182 O O . GLY A 1 26 ? 18.565 -39.524 -5.162 1.00 21.36 ? 26 GLY A O 1 ATOM 183 N N . ASN A 1 27 ? 17.171 -40.888 -4.049 1.00 20.24 ? 27 ASN A N 1 ATOM 184 C CA . ASN A 1 27 ? 16.992 -41.738 -5.212 1.00 24.15 ? 27 ASN A CA 1 ATOM 185 C C . ASN A 1 27 ? 16.154 -41.009 -6.270 1.00 21.89 ? 27 ASN A C 1 ATOM 186 O O . ASN A 1 27 ? 15.394 -40.087 -5.960 1.00 23.17 ? 27 ASN A O 1 ATOM 187 C CB . ASN A 1 27 ? 16.323 -43.067 -4.821 1.00 22.32 ? 27 ASN A CB 1 ATOM 188 C CG . ASN A 1 27 ? 17.209 -43.904 -3.902 1.00 23.40 ? 27 ASN A CG 1 ATOM 189 O OD1 . ASN A 1 27 ? 18.436 -43.793 -3.909 1.00 18.97 ? 27 ASN A OD1 1 ATOM 190 N ND2 . ASN A 1 27 ? 16.569 -44.748 -3.095 1.00 21.50 ? 27 ASN A ND2 1 ATOM 191 N N . LEU A 1 28 ? 16.305 -41.443 -7.499 1.00 19.54 ? 28 LEU A N 1 ATOM 192 C CA . LEU A 1 28 ? 15.624 -40.839 -8.645 1.00 20.56 ? 28 LEU A CA 1 ATOM 193 C C . LEU A 1 28 ? 14.565 -41.782 -9.150 1.00 19.64 ? 28 LEU A C 1 ATOM 194 O O . LEU A 1 28 ? 14.858 -42.912 -9.600 1.00 19.90 ? 28 LEU A O 1 ATOM 195 C CB . LEU A 1 28 ? 16.610 -40.563 -9.769 1.00 22.44 ? 28 LEU A CB 1 ATOM 196 C CG . LEU A 1 28 ? 16.049 -39.871 -11.018 1.00 22.31 ? 28 LEU A CG 1 ATOM 197 C CD1 . LEU A 1 28 ? 15.778 -38.391 -10.711 1.00 25.28 ? 28 LEU A CD1 1 ATOM 198 C CD2 . LEU A 1 28 ? 17.108 -40.020 -12.074 1.00 26.90 ? 28 LEU A CD2 1 ATOM 199 N N . LEU A 1 29 ? 13.329 -41.363 -8.985 1.00 18.15 ? 29 LEU A N 1 ATOM 200 C CA . LEU A 1 29 ? 12.172 -42.125 -9.417 1.00 19.40 ? 29 LEU A CA 1 ATOM 201 C C . LEU A 1 29 ? 11.765 -41.610 -10.816 1.00 23.50 ? 29 LEU A C 1 ATOM 202 O O . LEU A 1 29 ? 11.739 -40.376 -11.045 1.00 21.80 ? 29 LEU A O 1 ATOM 203 C CB . LEU A 1 29 ? 11.069 -41.880 -8.434 1.00 20.91 ? 29 LEU A CB 1 ATOM 204 C CG . LEU A 1 29 ? 9.700 -42.521 -8.720 1.00 27.82 ? 29 LEU A CG 1 ATOM 205 C CD1 . LEU A 1 29 ? 9.778 -44.032 -8.714 1.00 30.10 ? 29 LEU A CD1 1 ATOM 206 C CD2 . LEU A 1 29 ? 8.697 -42.037 -7.671 1.00 30.55 ? 29 LEU A CD2 1 ATOM 207 N N . VAL A 1 30 ? 11.499 -42.517 -11.756 1.00 21.09 ? 30 VAL A N 1 ATOM 208 C CA . VAL A 1 30 ? 11.179 -42.121 -13.141 1.00 20.98 ? 30 VAL A CA 1 ATOM 209 C C . VAL A 1 30 ? 9.937 -42.840 -13.513 1.00 24.48 ? 30 VAL A C 1 ATOM 210 O O . VAL A 1 30 ? 9.690 -43.950 -13.016 1.00 21.58 ? 30 VAL A O 1 ATOM 211 C CB . VAL A 1 30 ? 12.341 -42.348 -14.155 1.00 23.19 ? 30 VAL A CB 1 ATOM 212 C CG1 . VAL A 1 30 ? 13.667 -41.780 -13.596 1.00 22.43 ? 30 VAL A CG1 1 ATOM 213 C CG2 . VAL A 1 30 ? 12.558 -43.798 -14.539 1.00 23.77 ? 30 VAL A CG2 1 ATOM 214 N N . TRP A 1 31 ? 9.108 -42.187 -14.311 1.00 21.01 ? 31 TRP A N 1 ATOM 215 C CA . TRP A 1 31 ? 7.921 -42.845 -14.877 1.00 23.68 ? 31 TRP A CA 1 ATOM 216 C C . TRP A 1 31 ? 7.510 -42.382 -16.250 1.00 23.41 ? 31 TRP A C 1 ATOM 217 O O . TRP A 1 31 ? 7.846 -41.285 -16.673 1.00 22.37 ? 31 TRP A O 1 ATOM 218 C CB . TRP A 1 31 ? 6.711 -42.715 -13.968 1.00 24.18 ? 31 TRP A CB 1 ATOM 219 C CG . TRP A 1 31 ? 6.032 -41.387 -13.866 1.00 24.34 ? 31 TRP A CG 1 ATOM 220 C CD1 . TRP A 1 31 ? 4.920 -40.969 -14.567 1.00 28.20 ? 31 TRP A CD1 1 ATOM 221 C CD2 . TRP A 1 31 ? 6.235 -40.418 -12.836 1.00 23.72 ? 31 TRP A CD2 1 ATOM 222 N NE1 . TRP A 1 31 ? 4.468 -39.767 -14.068 1.00 25.53 ? 31 TRP A NE1 1 ATOM 223 C CE2 . TRP A 1 31 ? 5.274 -39.405 -13.015 1.00 27.04 ? 31 TRP A CE2 1 ATOM 224 C CE3 . TRP A 1 31 ? 7.189 -40.272 -11.824 1.00 28.03 ? 31 TRP A CE3 1 ATOM 225 C CZ2 . TRP A 1 31 ? 5.241 -38.252 -12.215 1.00 29.51 ? 31 TRP A CZ2 1 ATOM 226 C CZ3 . TRP A 1 31 ? 7.147 -39.115 -11.015 1.00 26.90 ? 31 TRP A CZ3 1 ATOM 227 C CH2 . TRP A 1 31 ? 6.179 -38.136 -11.221 1.00 30.05 ? 31 TRP A CH2 1 ATOM 228 N N . SER A 1 32 ? 6.780 -43.250 -16.948 1.00 24.45 ? 32 SER A N 1 ATOM 229 C CA . SER A 1 32 ? 6.344 -42.975 -18.297 1.00 25.17 ? 32 SER A CA 1 ATOM 230 C C . SER A 1 32 ? 4.830 -42.767 -18.311 1.00 29.35 ? 32 SER A C 1 ATOM 231 O O . SER A 1 32 ? 4.331 -41.630 -18.422 1.00 27.46 ? 32 SER A O 1 ATOM 232 C CB . SER A 1 32 ? 6.762 -44.078 -19.264 1.00 24.57 ? 32 SER A CB 1 ATOM 233 O OG . SER A 1 32 ? 6.452 -45.384 -18.763 1.00 25.39 ? 32 SER A OG 1 ATOM 234 N N . SER A 1 33 ? 4.119 -43.879 -18.216 1.00 27.15 ? 33 SER A N 1 ATOM 235 C CA . SER A 1 33 ? 2.686 -43.929 -18.486 1.00 30.78 ? 33 SER A CA 1 ATOM 236 C C . SER A 1 33 ? 2.206 -45.341 -18.197 1.00 31.51 ? 33 SER A C 1 ATOM 237 O O . SER A 1 33 ? 2.907 -46.137 -17.537 1.00 28.51 ? 33 SER A O 1 ATOM 238 C CB . SER A 1 33 ? 2.382 -43.607 -19.967 1.00 29.87 ? 33 SER A CB 1 ATOM 239 O OG . SER A 1 33 ? 2.913 -44.638 -20.799 1.00 32.99 ? 33 SER A OG 1 ATOM 240 N N . GLY A 1 34 ? 1.050 -45.674 -18.778 1.00 33.24 ? 34 GLY A N 1 ATOM 241 C CA . GLY A 1 34 ? 0.498 -47.020 -18.709 1.00 30.49 ? 34 GLY A CA 1 ATOM 242 C C . GLY A 1 34 ? 1.217 -48.072 -19.515 1.00 29.70 ? 34 GLY A C 1 ATOM 243 O O . GLY A 1 34 ? 0.790 -49.211 -19.527 1.00 30.75 ? 34 GLY A O 1 ATOM 244 N N . TRP A 1 35 ? 2.206 -47.659 -20.298 1.00 30.00 ? 35 TRP A N 1 ATOM 245 C CA . TRP A 1 35 ? 3.154 -48.553 -20.952 1.00 31.64 ? 35 TRP A CA 1 ATOM 246 C C . TRP A 1 35 ? 4.574 -47.997 -20.774 1.00 34.56 ? 35 TRP A C 1 ATOM 247 O O . TRP A 1 35 ? 4.766 -46.764 -20.545 1.00 31.63 ? 35 TRP A O 1 ATOM 248 C CB . TRP A 1 35 ? 2.888 -48.641 -22.475 1.00 41.00 ? 35 TRP A CB 1 ATOM 249 C CG . TRP A 1 35 ? 1.502 -49.104 -22.866 1.00 37.72 ? 35 TRP A CG 1 ATOM 250 C CD1 . TRP A 1 35 ? 1.121 -50.385 -23.194 1.00 41.26 ? 35 TRP A CD1 1 ATOM 251 C CD2 . TRP A 1 35 ? 0.311 -48.296 -22.926 1.00 39.88 ? 35 TRP A CD2 1 ATOM 252 N NE1 . TRP A 1 35 ? -0.249 -50.418 -23.418 1.00 43.47 ? 35 TRP A NE1 1 ATOM 253 C CE2 . TRP A 1 35 ? -0.758 -49.148 -23.311 1.00 42.83 ? 35 TRP A CE2 1 ATOM 254 C CE3 . TRP A 1 35 ? 0.037 -46.941 -22.682 1.00 38.09 ? 35 TRP A CE3 1 ATOM 255 C CZ2 . TRP A 1 35 ? -2.078 -48.673 -23.484 1.00 40.20 ? 35 TRP A CZ2 1 ATOM 256 C CZ3 . TRP A 1 35 ? -1.283 -46.469 -22.862 1.00 41.56 ? 35 TRP A CZ3 1 ATOM 257 C CH2 . TRP A 1 35 ? -2.314 -47.340 -23.257 1.00 38.45 ? 35 TRP A CH2 1 ATOM 258 N N . PRO A 1 36 ? 5.577 -48.875 -20.926 1.00 31.04 ? 36 PRO A N 1 ATOM 259 C CA . PRO A 1 36 ? 6.971 -48.407 -20.771 1.00 33.82 ? 36 PRO A CA 1 ATOM 260 C C . PRO A 1 36 ? 7.405 -47.443 -21.892 1.00 35.47 ? 36 PRO A C 1 ATOM 261 O O . PRO A 1 36 ? 8.330 -46.628 -21.682 1.00 29.73 ? 36 PRO A O 1 ATOM 262 C CB . PRO A 1 36 ? 7.800 -49.690 -20.831 1.00 34.30 ? 36 PRO A CB 1 ATOM 263 C CG . PRO A 1 36 ? 6.842 -50.801 -20.560 1.00 36.70 ? 36 PRO A CG 1 ATOM 264 C CD . PRO A 1 36 ? 5.493 -50.341 -21.067 1.00 34.62 ? 36 PRO A CD 1 ATOM 265 N N . ASN A 1 37 ? 6.777 -47.592 -23.071 1.00 29.71 ? 37 ASN A N 1 ATOM 266 C CA . ASN A 1 37 ? 7.322 -47.061 -24.316 1.00 31.46 ? 37 ASN A CA 1 ATOM 267 C C . ASN A 1 37 ? 6.283 -46.335 -25.150 1.00 31.38 ? 37 ASN A C 1 ATOM 268 O O . ASN A 1 37 ? 6.591 -45.872 -26.227 1.00 30.82 ? 37 ASN A O 1 ATOM 269 C CB . ASN A 1 37 ? 7.905 -48.190 -25.144 1.00 28.10 ? 37 ASN A CB 1 ATOM 270 C CG . ASN A 1 37 ? 6.844 -49.208 -25.532 1.00 32.82 ? 37 ASN A CG 1 ATOM 271 O OD1 . ASN A 1 37 ? 5.724 -49.211 -25.002 1.00 34.37 ? 37 ASN A OD1 1 ATOM 272 N ND2 . ASN A 1 37 ? 7.195 -50.084 -26.434 1.00 43.28 ? 37 ASN A ND2 1 ATOM 273 N N . ARG A 1 38 ? 5.086 -46.136 -24.614 1.00 28.93 ? 38 ARG A N 1 ATOM 274 C CA . ARG A 1 38 ? 4.075 -45.403 -25.365 1.00 34.53 ? 38 ARG A CA 1 ATOM 275 C C . ARG A 1 38 ? 3.002 -44.813 -24.464 1.00 33.05 ? 38 ARG A C 1 ATOM 276 O O . ARG A 1 38 ? 2.941 -45.131 -23.281 1.00 33.16 ? 38 ARG A O 1 ATOM 277 C CB . ARG A 1 38 ? 3.454 -46.324 -26.412 1.00 36.00 ? 38 ARG A CB 1 ATOM 278 C CG . ARG A 1 38 ? 2.529 -47.412 -25.865 1.00 38.91 ? 38 ARG A CG 1 ATOM 279 C CD . ARG A 1 38 ? 2.202 -48.358 -27.013 1.00 44.09 ? 38 ARG A CD 1 ATOM 280 N NE . ARG A 1 38 ? 1.084 -49.255 -26.743 0.80 51.09 ? 38 ARG A NE 1 ATOM 281 C CZ . ARG A 1 38 ? -0.217 -48.943 -26.803 0.70 47.00 ? 38 ARG A CZ 1 ATOM 282 N NH1 . ARG A 1 38 ? -0.646 -47.704 -27.027 0.70 44.05 ? 38 ARG A NH1 1 ATOM 283 N NH2 . ARG A 1 38 ? -1.105 -49.888 -26.543 0.70 49.41 ? 38 ARG A NH2 1 ATOM 284 N N . TRP A 1 39 ? 2.085 -44.050 -25.063 1.00 33.46 ? 39 TRP A N 1 ATOM 285 C CA . TRP A 1 39 ? 1.011 -43.380 -24.324 1.00 35.39 ? 39 TRP A CA 1 ATOM 286 C C . TRP A 1 39 ? -0.259 -43.305 -25.183 1.00 36.13 ? 39 TRP A C 1 ATOM 287 O O . TRP A 1 39 ? -0.183 -43.460 -26.395 1.00 38.18 ? 39 TRP A O 1 ATOM 288 C CB . TRP A 1 39 ? 1.424 -41.955 -23.974 1.00 35.71 ? 39 TRP A CB 1 ATOM 289 C CG . TRP A 1 39 ? 1.645 -41.123 -25.195 1.00 37.94 ? 39 TRP A CG 1 ATOM 290 C CD1 . TRP A 1 39 ? 2.798 -41.015 -25.907 1.00 41.41 ? 39 TRP A CD1 1 ATOM 291 C CD2 . TRP A 1 39 ? 0.672 -40.285 -25.859 1.00 33.34 ? 39 TRP A CD2 1 ATOM 292 N NE1 . TRP A 1 39 ? 2.617 -40.150 -26.972 1.00 40.05 ? 39 TRP A NE1 1 ATOM 293 C CE2 . TRP A 1 39 ? 1.313 -39.703 -26.971 1.00 35.90 ? 39 TRP A CE2 1 ATOM 294 C CE3 . TRP A 1 39 ? -0.677 -39.997 -25.630 1.00 33.13 ? 39 TRP A CE3 1 ATOM 295 C CZ2 . TRP A 1 39 ? 0.642 -38.858 -27.870 1.00 35.68 ? 39 TRP A CZ2 1 ATOM 296 C CZ3 . TRP A 1 39 ? -1.355 -39.141 -26.530 1.00 39.22 ? 39 TRP A CZ3 1 ATOM 297 C CH2 . TRP A 1 39 ? -0.677 -38.567 -27.619 1.00 33.30 ? 39 TRP A CH2 1 ATOM 298 N N . THR A 1 40 ? -1.396 -43.012 -24.549 1.00 38.85 ? 40 THR A N 1 ATOM 299 C CA . THR A 1 40 ? -2.639 -42.615 -25.258 1.00 37.66 ? 40 THR A CA 1 ATOM 300 C C . THR A 1 40 ? -3.337 -41.538 -24.424 1.00 39.49 ? 40 THR A C 1 ATOM 301 O O . THR A 1 40 ? -3.025 -41.365 -23.232 1.00 35.59 ? 40 THR A O 1 ATOM 302 C CB . THR A 1 40 ? -3.613 -43.821 -25.463 1.00 40.73 ? 40 THR A CB 1 ATOM 303 O OG1 . THR A 1 40 ? -4.197 -44.194 -24.204 1.00 34.27 ? 40 THR A OG1 1 ATOM 304 C CG2 . THR A 1 40 ? -2.907 -45.040 -26.101 1.00 38.23 ? 40 THR A CG2 1 ATOM 305 N N . THR A 1 41 ? -4.261 -40.794 -25.023 1.00 35.70 ? 41 THR A N 1 ATOM 306 C CA . THR A 1 41 ? -4.919 -39.714 -24.277 1.00 45.53 ? 41 THR A CA 1 ATOM 307 C C . THR A 1 41 ? -5.723 -40.263 -23.104 1.00 40.48 ? 41 THR A C 1 ATOM 308 O O . THR A 1 41 ? -5.729 -39.663 -22.029 1.00 41.00 ? 41 THR A O 1 ATOM 309 C CB . THR A 1 41 ? -5.865 -38.871 -25.156 1.00 49.98 ? 41 THR A CB 1 ATOM 310 O OG1 . THR A 1 41 ? -5.172 -38.517 -26.352 1.00 53.90 ? 41 THR A OG1 1 ATOM 311 C CG2 . THR A 1 41 ? -6.346 -37.602 -24.410 1.00 46.19 ? 41 THR A CG2 1 ATOM 312 N N . ALA A 1 42 ? -6.399 -41.388 -23.338 1.00 40.61 ? 42 ALA A N 1 ATOM 313 C CA . ALA A 1 42 ? -7.259 -42.033 -22.348 1.00 44.02 ? 42 ALA A CA 1 ATOM 314 C C . ALA A 1 42 ? -6.408 -42.780 -21.319 1.00 41.24 ? 42 ALA A C 1 ATOM 315 O O . ALA A 1 42 ? -6.818 -42.980 -20.145 1.00 37.56 ? 42 ALA A O 1 ATOM 316 C CB . ALA A 1 42 ? -8.191 -43.013 -23.057 1.00 43.84 ? 42 ALA A CB 1 ATOM 317 N N . GLY A 1 43 ? -5.254 -43.252 -21.795 1.00 42.30 ? 43 GLY A N 1 ATOM 318 C CA . GLY A 1 43 ? -4.296 -43.977 -20.953 1.00 44.27 ? 43 GLY A CA 1 ATOM 319 C C . GLY A 1 43 ? -4.704 -45.395 -20.609 1.00 45.49 ? 43 GLY A C 1 ATOM 320 O O . GLY A 1 43 ? -5.789 -45.858 -20.996 1.00 38.72 ? 43 GLY A O 1 ATOM 321 N N . ASN A 1 44 ? -3.844 -46.065 -19.842 1.00 42.00 ? 44 ASN A N 1 ATOM 322 C CA . ASN A 1 44 ? -3.971 -47.492 -19.561 1.00 40.00 ? 44 ASN A CA 1 ATOM 323 C C . ASN A 1 44 ? -4.424 -47.762 -18.122 1.00 36.48 ? 44 ASN A C 1 ATOM 324 O O . ASN A 1 44 ? -4.261 -48.853 -17.625 1.00 37.37 ? 44 ASN A O 1 ATOM 325 C CB . ASN A 1 44 ? -2.639 -48.192 -19.846 1.00 42.38 ? 44 ASN A CB 1 ATOM 326 C CG . ASN A 1 44 ? -2.809 -49.623 -20.282 1.00 47.68 ? 44 ASN A CG 1 ATOM 327 O OD1 . ASN A 1 44 ? -3.915 -50.055 -20.579 1.00 38.75 ? 44 ASN A OD1 1 ATOM 328 N ND2 . ASN A 1 44 ? -1.734 -50.391 -20.225 1.00 38.20 ? 44 ASN A ND2 1 ATOM 329 N N . GLY A 1 45 ? -4.941 -46.745 -17.441 1.00 34.63 ? 45 GLY A N 1 ATOM 330 C CA . GLY A 1 45 ? -5.418 -46.900 -16.068 1.00 35.06 ? 45 GLY A CA 1 ATOM 331 C C . GLY A 1 45 ? -4.325 -47.308 -15.075 1.00 39.70 ? 45 GLY A C 1 ATOM 332 O O . GLY A 1 45 ? -4.628 -47.780 -13.978 1.00 32.90 ? 45 GLY A O 1 ATOM 333 N N . LYS A 1 46 ? -3.052 -47.097 -15.443 1.00 35.78 ? 46 LYS A N 1 ATOM 334 C CA . LYS A 1 46 ? -1.930 -47.484 -14.598 1.00 34.72 ? 46 LYS A CA 1 ATOM 335 C C . LYS A 1 46 ? -0.639 -46.773 -15.060 1.00 34.51 ? 46 LYS A C 1 ATOM 336 O O . LYS A 1 46 ? -0.605 -46.252 -16.183 1.00 30.64 ? 46 LYS A O 1 ATOM 337 C CB . LYS A 1 46 ? -1.747 -49.018 -14.628 1.00 31.41 ? 46 LYS A CB 1 ATOM 338 C CG . LYS A 1 46 ? -1.231 -49.583 -15.934 1.00 34.88 ? 46 LYS A CG 1 ATOM 339 C CD . LYS A 1 46 ? -1.572 -51.067 -16.094 1.00 38.75 ? 46 LYS A CD 1 ATOM 340 C CE . LYS A 1 46 ? -0.727 -51.692 -17.174 0.80 48.07 ? 46 LYS A CE 1 ATOM 341 N NZ . LYS A 1 46 ? -1.243 -53.034 -17.565 0.70 55.94 ? 46 LYS A NZ 1 ATOM 342 N N . THR A 1 47 ? 0.422 -46.843 -14.234 1.00 31.38 ? 47 THR A N 1 ATOM 343 C CA . THR A 1 47 ? 1.749 -46.279 -14.561 1.00 27.29 ? 47 THR A CA 1 ATOM 344 C C . THR A 1 47 ? 2.891 -47.235 -14.204 1.00 25.98 ? 47 THR A C 1 ATOM 345 O O . THR A 1 47 ? 2.930 -47.759 -13.103 1.00 25.76 ? 47 THR A O 1 ATOM 346 C CB . THR A 1 47 ? 1.984 -44.964 -13.773 1.00 25.77 ? 47 THR A CB 1 ATOM 347 O OG1 . THR A 1 47 ? 0.843 -44.104 -13.882 1.00 27.23 ? 47 THR A OG1 1 ATOM 348 C CG2 . THR A 1 47 ? 3.193 -44.244 -14.242 1.00 24.55 ? 47 THR A CG2 1 ATOM 349 N N . TYR A 1 48 ? 3.793 -47.414 -15.159 1.00 23.99 ? 48 TYR A N 1 ATOM 350 C CA . TYR A 1 48 ? 5.116 -47.949 -15.014 1.00 25.10 ? 48 TYR A CA 1 ATOM 351 C C . TYR A 1 48 ? 6.139 -46.964 -14.489 1.00 25.59 ? 48 TYR A C 1 ATOM 352 O O . TYR A 1 48 ? 6.288 -45.857 -14.998 1.00 23.77 ? 48 TYR A O 1 ATOM 353 C CB . TYR A 1 48 ? 5.613 -48.454 -16.362 1.00 28.32 ? 48 TYR A CB 1 ATOM 354 C CG . TYR A 1 48 ? 4.914 -49.746 -16.821 1.00 33.51 ? 48 TYR A CG 1 ATOM 355 C CD1 . TYR A 1 48 ? 3.704 -49.696 -17.500 1.00 37.02 ? 48 TYR A CD1 1 ATOM 356 C CD2 . TYR A 1 48 ? 5.448 -51.025 -16.484 1.00 36.89 ? 48 TYR A CD2 1 ATOM 357 C CE1 . TYR A 1 48 ? 3.067 -50.872 -17.919 1.00 37.30 ? 48 TYR A CE1 1 ATOM 358 C CE2 . TYR A 1 48 ? 4.782 -52.213 -16.829 1.00 36.65 ? 48 TYR A CE2 1 ATOM 359 C CZ . TYR A 1 48 ? 3.594 -52.120 -17.563 1.00 38.77 ? 48 TYR A CZ 1 ATOM 360 O OH . TYR A 1 48 ? 2.907 -53.246 -17.933 1.00 40.55 ? 48 TYR A OH 1 ATOM 361 N N . THR A 1 49 ? 6.887 -47.416 -13.494 1.00 24.12 ? 49 THR A N 1 ATOM 362 C CA . THR A 1 49 ? 7.926 -46.630 -12.887 1.00 24.18 ? 49 THR A CA 1 ATOM 363 C C . THR A 1 49 ? 9.212 -47.458 -12.735 1.00 26.42 ? 49 THR A C 1 ATOM 364 O O . THR A 1 49 ? 9.190 -48.700 -12.782 1.00 25.11 ? 49 THR A O 1 ATOM 365 C CB . THR A 1 49 ? 7.518 -46.121 -11.494 1.00 24.09 ? 49 THR A CB 1 ATOM 366 O OG1 . THR A 1 49 ? 7.557 -47.195 -10.559 1.00 28.16 ? 49 THR A OG1 1 ATOM 367 C CG2 . THR A 1 49 ? 6.102 -45.427 -11.469 1.00 24.39 ? 49 THR A CG2 1 ATOM 368 N N . SER A 1 50 ? 10.330 -46.753 -12.583 1.00 22.81 ? 50 SER A N 1 ATOM 369 C CA . SER A 1 50 ? 11.639 -47.348 -12.296 1.00 21.91 ? 50 SER A CA 1 ATOM 370 C C . SER A 1 50 ? 12.401 -46.379 -11.421 1.00 22.60 ? 50 SER A C 1 ATOM 371 O O . SER A 1 50 ? 12.009 -45.220 -11.249 1.00 23.01 ? 50 SER A O 1 ATOM 372 C CB . SER A 1 50 ? 12.369 -47.661 -13.573 1.00 23.62 ? 50 SER A CB 1 ATOM 373 O OG . SER A 1 50 ? 13.679 -48.118 -13.364 1.00 21.33 ? 50 SER A OG 1 ATOM 374 N N . LEU A 1 51 ? 13.409 -46.893 -10.747 1.00 25.90 ? 51 LEU A N 1 ATOM 375 C CA . LEU A 1 51 ? 14.105 -46.160 -9.702 1.00 23.30 ? 51 LEU A CA 1 ATOM 376 C C . LEU A 1 51 ? 15.610 -46.410 -9.759 1.00 21.02 ? 51 LEU A C 1 ATOM 377 O O . LEU A 1 51 ? 16.043 -47.560 -9.864 1.00 21.19 ? 51 LEU A O 1 ATOM 378 C CB . LEU A 1 51 ? 13.542 -46.600 -8.385 1.00 27.53 ? 51 LEU A CB 1 ATOM 379 C CG . LEU A 1 51 ? 14.135 -45.943 -7.152 1.00 31.58 ? 51 LEU A CG 1 ATOM 380 C CD1 . LEU A 1 51 ? 13.463 -44.608 -6.925 1.00 31.93 ? 51 LEU A CD1 1 ATOM 381 C CD2 . LEU A 1 51 ? 13.848 -46.907 -6.018 1.00 37.24 ? 51 LEU A CD2 1 ATOM 382 N N . TYR A 1 52 ? 16.371 -45.312 -9.772 1.00 19.84 ? 52 TYR A N 1 ATOM 383 C CA . TYR A 1 52 ? 17.813 -45.312 -9.696 1.00 20.02 ? 52 TYR A CA 1 ATOM 384 C C . TYR A 1 52 ? 18.171 -45.051 -8.250 1.00 22.69 ? 52 TYR A C 1 ATOM 385 O O . TYR A 1 52 ? 17.840 -43.985 -7.685 1.00 21.98 ? 52 TYR A O 1 ATOM 386 C CB . TYR A 1 52 ? 18.407 -44.220 -10.615 1.00 19.72 ? 52 TYR A CB 1 ATOM 387 C CG . TYR A 1 52 ? 19.899 -44.083 -10.533 1.00 20.21 ? 52 TYR A CG 1 ATOM 388 C CD1 . TYR A 1 52 ? 20.486 -43.246 -9.607 1.00 22.86 ? 52 TYR A CD1 1 ATOM 389 C CD2 . TYR A 1 52 ? 20.717 -44.780 -11.389 1.00 24.14 ? 52 TYR A CD2 1 ATOM 390 C CE1 . TYR A 1 52 ? 21.866 -43.154 -9.511 1.00 23.64 ? 52 TYR A CE1 1 ATOM 391 C CE2 . TYR A 1 52 ? 22.100 -44.706 -11.293 1.00 24.46 ? 52 TYR A CE2 1 ATOM 392 C CZ . TYR A 1 52 ? 22.655 -43.892 -10.367 1.00 27.04 ? 52 TYR A CZ 1 ATOM 393 O OH . TYR A 1 52 ? 24.007 -43.759 -10.363 1.00 24.53 ? 52 TYR A OH 1 ATOM 394 N N . ASN A 1 53 ? 18.950 -45.958 -7.683 1.00 20.87 ? 53 ASN A N 1 ATOM 395 C CA . ASN A 1 53 ? 19.382 -45.867 -6.292 1.00 22.54 ? 53 ASN A CA 1 ATOM 396 C C . ASN A 1 53 ? 20.705 -45.198 -6.246 1.00 23.02 ? 53 ASN A C 1 ATOM 397 O O . ASN A 1 53 ? 21.676 -45.795 -6.689 1.00 24.70 ? 53 ASN A O 1 ATOM 398 C CB . ASN A 1 53 ? 19.454 -47.285 -5.645 1.00 22.14 ? 53 ASN A CB 1 ATOM 399 C CG . ASN A 1 53 ? 19.731 -47.246 -4.139 1.00 20.52 ? 53 ASN A CG 1 ATOM 400 O OD1 . ASN A 1 53 ? 20.811 -46.889 -3.719 1.00 21.74 ? 53 ASN A OD1 1 ATOM 401 N ND2 . ASN A 1 53 ? 18.772 -47.665 -3.344 1.00 19.65 ? 53 ASN A ND2 1 ATOM 402 N N . VAL A 1 54 ? 20.795 -44.037 -5.575 1.00 23.47 ? 54 VAL A N 1 ATOM 403 C CA . VAL A 1 54 ? 22.079 -43.313 -5.519 1.00 24.43 ? 54 VAL A CA 1 ATOM 404 C C . VAL A 1 54 ? 23.050 -43.882 -4.514 1.00 24.14 ? 54 VAL A C 1 ATOM 405 O O . VAL A 1 54 ? 24.213 -43.585 -4.580 1.00 25.28 ? 54 VAL A O 1 ATOM 406 C CB . VAL A 1 54 ? 21.928 -41.764 -5.277 1.00 24.98 ? 54 VAL A CB 1 ATOM 407 C CG1 . VAL A 1 54 ? 21.098 -41.146 -6.406 1.00 25.87 ? 54 VAL A CG1 1 ATOM 408 C CG2 . VAL A 1 54 ? 21.242 -41.455 -3.945 1.00 25.34 ? 54 VAL A CG2 1 ATOM 409 N N . ASN A 1 55 ? 22.587 -44.617 -3.521 1.00 26.39 ? 55 ASN A N 1 ATOM 410 C CA . ASN A 1 55 ? 23.520 -45.264 -2.608 1.00 24.68 ? 55 ASN A CA 1 ATOM 411 C C . ASN A 1 55 ? 24.261 -46.390 -3.345 1.00 31.26 ? 55 ASN A C 1 ATOM 412 O O . ASN A 1 55 ? 25.442 -46.548 -3.136 1.00 27.14 ? 55 ASN A O 1 ATOM 413 C CB . ASN A 1 55 ? 22.790 -45.813 -1.372 1.00 29.01 ? 55 ASN A CB 1 ATOM 414 C CG . ASN A 1 55 ? 23.726 -46.451 -0.366 1.00 28.82 ? 55 ASN A CG 1 ATOM 415 O OD1 . ASN A 1 55 ? 24.608 -45.817 0.122 1.00 37.77 ? 55 ASN A OD1 1 ATOM 416 N ND2 . ASN A 1 55 ? 23.413 -47.652 0.056 1.00 32.76 ? 55 ASN A ND2 1 ATOM 417 N N . THR A 1 56 ? 23.577 -47.203 -4.166 1.00 28.88 ? 56 THR A N 1 ATOM 418 C CA . THR A 1 56 ? 24.237 -48.366 -4.778 1.00 26.36 ? 56 THR A CA 1 ATOM 419 C C . THR A 1 56 ? 24.717 -48.120 -6.194 1.00 27.41 ? 56 THR A C 1 ATOM 420 O O . THR A 1 56 ? 25.631 -48.791 -6.680 1.00 29.17 ? 56 THR A O 1 ATOM 421 C CB . THR A 1 56 ? 23.321 -49.569 -4.827 1.00 28.14 ? 56 THR A CB 1 ATOM 422 O OG1 . THR A 1 56 ? 22.174 -49.258 -5.613 1.00 28.13 ? 56 THR A OG1 1 ATOM 423 C CG2 . THR A 1 56 ? 22.885 -50.012 -3.432 1.00 27.17 ? 56 THR A CG2 1 ATOM 424 N N . GLY A 1 57 ? 24.067 -47.204 -6.886 1.00 26.16 ? 57 GLY A N 1 ATOM 425 C CA . GLY A 1 57 ? 24.346 -46.932 -8.310 1.00 24.26 ? 57 GLY A CA 1 ATOM 426 C C . GLY A 1 57 ? 23.536 -47.840 -9.243 1.00 23.19 ? 57 GLY A C 1 ATOM 427 O O . GLY A 1 57 ? 23.749 -47.859 -10.432 1.00 25.14 ? 57 GLY A O 1 ATOM 428 N N . ASN A 1 58 ? 22.550 -48.558 -8.727 1.00 22.66 ? 58 ASN A N 1 ATOM 429 C CA . ASN A 1 58 ? 21.828 -49.484 -9.566 1.00 22.10 ? 58 ASN A CA 1 ATOM 430 C C . ASN A 1 58 ? 20.363 -49.086 -9.751 1.00 24.93 ? 58 ASN A C 1 ATOM 431 O O . ASN A 1 58 ? 19.778 -48.397 -8.917 1.00 26.75 ? 58 ASN A O 1 ATOM 432 C CB . ASN A 1 58 ? 21.907 -50.867 -8.953 1.00 23.63 ? 58 ASN A CB 1 ATOM 433 C CG . ASN A 1 58 ? 23.282 -51.483 -9.064 1.00 26.16 ? 58 ASN A CG 1 ATOM 434 O OD1 . ASN A 1 58 ? 24.006 -51.277 -10.051 1.00 24.05 ? 58 ASN A OD1 1 ATOM 435 N ND2 . ASN A 1 58 ? 23.644 -52.290 -8.045 1.00 26.13 ? 58 ASN A ND2 1 ATOM 436 N N . ILE A 1 59 ? 19.800 -49.588 -10.846 1.00 26.56 ? 59 ILE A N 1 ATOM 437 C CA . ILE A 1 59 ? 18.450 -49.309 -11.305 1.00 24.90 ? 59 ILE A CA 1 ATOM 438 C C . ILE A 1 59 ? 17.628 -50.546 -11.130 1.00 25.96 ? 59 ILE A C 1 ATOM 439 O O . ILE A 1 59 ? 18.034 -51.623 -11.557 1.00 26.52 ? 59 ILE A O 1 ATOM 440 C CB . ILE A 1 59 ? 18.493 -48.971 -12.812 1.00 25.40 ? 59 ILE A CB 1 ATOM 441 C CG1 . ILE A 1 59 ? 19.191 -47.622 -13.034 1.00 27.55 ? 59 ILE A CG1 1 ATOM 442 C CG2 . ILE A 1 59 ? 17.117 -48.969 -13.425 1.00 26.11 ? 59 ILE A CG2 1 ATOM 443 C CD1 . ILE A 1 59 ? 19.570 -47.330 -14.472 1.00 32.16 ? 59 ILE A CD1 1 ATOM 444 N N . SER A 1 60 ? 16.395 -50.364 -10.728 1.00 25.29 ? 60 SER A N 1 ATOM 445 C CA . SER A 1 60 ? 15.488 -51.472 -10.598 1.00 28.88 ? 60 SER A CA 1 ATOM 446 C C . SER A 1 60 ? 14.578 -51.577 -11.789 1.00 33.31 ? 60 SER A C 1 ATOM 447 O O . SER A 1 60 ? 14.273 -50.575 -12.459 1.00 31.45 ? 60 SER A O 1 ATOM 448 C CB . SER A 1 60 ? 14.665 -51.296 -9.306 1.00 35.50 ? 60 SER A CB 1 ATOM 449 O OG . SER A 1 60 ? 13.973 -50.059 -9.314 1.00 36.42 ? 60 SER A OG 1 ATOM 450 N N . ASP A 1 61 ? 14.114 -52.798 -12.057 1.00 33.12 ? 61 ASP A N 1 ATOM 451 C CA . ASP A 1 61 ? 13.332 -53.075 -13.267 1.00 35.16 ? 61 ASP A CA 1 ATOM 452 C C . ASP A 1 61 ? 11.940 -52.456 -13.102 1.00 30.22 ? 61 ASP A C 1 ATOM 453 O O . ASP A 1 61 ? 11.513 -52.144 -12.012 1.00 29.82 ? 61 ASP A O 1 ATOM 454 C CB . ASP A 1 61 ? 13.275 -54.614 -13.614 1.00 36.17 ? 61 ASP A CB 1 ATOM 455 C CG . ASP A 1 61 ? 13.176 -54.915 -15.190 1.00 42.02 ? 61 ASP A CG 1 ATOM 456 O OD1 . ASP A 1 61 ? 12.612 -54.098 -15.962 1.00 36.37 ? 61 ASP A OD1 1 ATOM 457 O OD2 . ASP A 1 61 ? 13.733 -55.947 -15.688 1.00 40.31 ? 61 ASP A OD2 1 ATOM 458 N N . ALA A 1 62 ? 11.269 -52.249 -14.234 1.00 29.04 ? 62 ALA A N 1 ATOM 459 C CA . ALA A 1 62 ? 10.001 -51.544 -14.318 1.00 28.11 ? 62 ALA A CA 1 ATOM 460 C C . ALA A 1 62 ? 8.925 -52.234 -13.498 1.00 31.15 ? 62 ALA A C 1 ATOM 461 O O . ALA A 1 62 ? 8.813 -53.439 -13.568 1.00 28.14 ? 62 ALA A O 1 ATOM 462 C CB . ALA A 1 62 ? 9.578 -51.458 -15.794 1.00 31.68 ? 62 ALA A CB 1 ATOM 463 N N . ILE A 1 63 ? 8.118 -51.477 -12.750 1.00 25.76 ? 63 ILE A N 1 ATOM 464 C CA . ILE A 1 63 ? 6.951 -52.046 -12.066 1.00 29.29 ? 63 ILE A CA 1 ATOM 465 C C . ILE A 1 63 ? 5.703 -51.219 -12.366 1.00 29.11 ? 63 ILE A C 1 ATOM 466 O O . ILE A 1 63 ? 5.789 -50.015 -12.680 1.00 25.61 ? 63 ILE A O 1 ATOM 467 C CB . ILE A 1 63 ? 7.153 -52.078 -10.549 1.00 28.27 ? 63 ILE A CB 1 ATOM 468 C CG1 . ILE A 1 63 ? 7.676 -50.736 -10.071 1.00 30.58 ? 63 ILE A CG1 1 ATOM 469 C CG2 . ILE A 1 63 ? 8.216 -53.111 -10.168 1.00 29.46 ? 63 ILE A CG2 1 ATOM 470 C CD1 . ILE A 1 63 ? 7.552 -50.557 -8.595 1.00 35.15 ? 63 ILE A CD1 1 ATOM 471 N N . VAL A 1 64 ? 4.541 -51.847 -12.215 1.00 26.72 ? 64 VAL A N 1 ATOM 472 C CA . VAL A 1 64 ? 3.298 -51.136 -12.257 1.00 27.17 ? 64 VAL A CA 1 ATOM 473 C C . VAL A 1 64 ? 3.028 -50.634 -10.876 1.00 31.81 ? 64 VAL A C 1 ATOM 474 O O . VAL A 1 64 ? 2.525 -51.344 -10.028 1.00 33.24 ? 64 VAL A O 1 ATOM 475 C CB . VAL A 1 64 ? 2.144 -52.027 -12.753 1.00 31.47 ? 64 VAL A CB 1 ATOM 476 C CG1 . VAL A 1 64 ? 0.824 -51.252 -12.712 1.00 32.42 ? 64 VAL A CG1 1 ATOM 477 C CG2 . VAL A 1 64 ? 2.457 -52.551 -14.150 1.00 31.37 ? 64 VAL A CG2 1 ATOM 478 N N . GLN A 1 65 ? 3.417 -49.401 -10.608 1.00 28.14 ? 65 GLN A N 1 ATOM 479 C CA . GLN A 1 65 ? 3.425 -48.914 -9.239 1.00 24.55 ? 65 GLN A CA 1 ATOM 480 C C . GLN A 1 65 ? 2.170 -48.137 -8.922 1.00 26.31 ? 65 GLN A C 1 ATOM 481 O O . GLN A 1 65 ? 1.817 -47.902 -7.751 1.00 29.73 ? 65 GLN A O 1 ATOM 482 C CB . GLN A 1 65 ? 4.694 -48.070 -9.018 1.00 24.72 ? 65 GLN A CB 1 ATOM 483 C CG . GLN A 1 65 ? 5.072 -47.900 -7.558 1.00 24.49 ? 65 GLN A CG 1 ATOM 484 C CD . GLN A 1 65 ? 6.033 -46.746 -7.311 1.00 27.71 ? 65 GLN A CD 1 ATOM 485 O OE1 . GLN A 1 65 ? 6.640 -46.205 -8.242 1.00 30.12 ? 65 GLN A OE1 1 ATOM 486 N NE2 . GLN A 1 65 ? 6.181 -46.373 -6.048 1.00 25.29 ? 65 GLN A NE2 1 ATOM 487 N N . ASN A 1 66 ? 1.485 -47.696 -9.960 1.00 27.24 ? 66 ASN A N 1 ATOM 488 C CA . ASN A 1 66 ? 0.210 -47.041 -9.776 1.00 29.97 ? 66 ASN A CA 1 ATOM 489 C C . ASN A 1 66 ? -0.796 -47.826 -10.571 1.00 29.16 ? 66 ASN A C 1 ATOM 490 O O . ASN A 1 66 ? -0.609 -48.043 -11.791 1.00 28.37 ? 66 ASN A O 1 ATOM 491 C CB . ASN A 1 66 ? 0.250 -45.566 -10.225 1.00 31.65 ? 66 ASN A CB 1 ATOM 492 C CG . ASN A 1 66 ? -0.953 -44.781 -9.740 1.00 33.76 ? 66 ASN A CG 1 ATOM 493 O OD1 . ASN A 1 66 ? -2.074 -45.331 -9.664 1.00 31.14 ? 66 ASN A OD1 1 ATOM 494 N ND2 . ASN A 1 66 ? -0.750 -43.494 -9.431 1.00 28.84 ? 66 ASN A ND2 1 ATOM 495 N N . THR A 1 67 ? -1.786 -48.390 -9.874 1.00 34.64 ? 67 THR A N 1 ATOM 496 C CA . THR A 1 67 ? -2.662 -49.342 -10.538 1.00 34.55 ? 67 THR A CA 1 ATOM 497 C C . THR A 1 67 ? -4.005 -48.729 -10.870 1.00 35.28 ? 67 THR A C 1 ATOM 498 O O . THR A 1 67 ? -4.833 -49.419 -11.462 1.00 39.33 ? 67 THR A O 1 ATOM 499 C CB . THR A 1 67 ? -2.880 -50.617 -9.699 1.00 33.76 ? 67 THR A CB 1 ATOM 500 O OG1 . THR A 1 67 ? -3.458 -50.222 -8.460 1.00 34.04 ? 67 THR A OG1 1 ATOM 501 C CG2 . THR A 1 67 ? -1.542 -51.358 -9.488 1.00 34.27 ? 67 THR A CG2 1 ATOM 502 N N . GLN A 1 68 ? -4.222 -47.467 -10.485 1.00 32.57 ? 68 GLN A N 1 ATOM 503 C CA . GLN A 1 68 ? -5.479 -46.735 -10.771 1.00 43.08 ? 68 GLN A CA 1 ATOM 504 C C . GLN A 1 68 ? -5.339 -45.514 -11.708 1.00 42.87 ? 68 GLN A C 1 ATOM 505 O O . GLN A 1 68 ? -6.343 -44.955 -12.137 1.00 39.38 ? 68 GLN A O 1 ATOM 506 C CB . GLN A 1 68 ? -6.124 -46.243 -9.446 1.00 39.69 ? 68 GLN A CB 1 ATOM 507 C CG . GLN A 1 68 ? -6.405 -47.369 -8.459 0.80 42.52 ? 68 GLN A CG 1 ATOM 508 C CD . GLN A 1 68 ? -6.992 -46.865 -7.167 0.70 47.27 ? 68 GLN A CD 1 ATOM 509 O OE1 . GLN A 1 68 ? -8.093 -46.337 -7.150 0.70 45.20 ? 68 GLN A OE1 1 ATOM 510 N NE2 . GLN A 1 68 ? -6.275 -47.056 -6.071 0.70 49.37 ? 68 GLN A NE2 1 ATOM 511 N N . HIS A 1 69 ? -4.124 -45.008 -11.895 1.00 34.60 ? 69 HIS A N 1 ATOM 512 C CA . HIS A 1 69 ? -3.923 -43.717 -12.549 1.00 28.43 ? 69 HIS A CA 1 ATOM 513 C C . HIS A 1 69 ? -2.757 -43.800 -13.533 1.00 31.64 ? 69 HIS A C 1 ATOM 514 O O . HIS A 1 69 ? -1.692 -44.329 -13.209 1.00 29.40 ? 69 HIS A O 1 ATOM 515 C CB . HIS A 1 69 ? -3.716 -42.724 -11.438 1.00 28.97 ? 69 HIS A CB 1 ATOM 516 C CG . HIS A 1 69 ? -3.428 -41.320 -11.852 1.00 26.23 ? 69 HIS A CG 1 ATOM 517 N ND1 . HIS A 1 69 ? -3.202 -40.340 -10.910 1.00 26.08 ? 69 HIS A ND1 1 ATOM 518 C CD2 . HIS A 1 69 ? -3.340 -40.711 -13.057 1.00 30.81 ? 69 HIS A CD2 1 ATOM 519 C CE1 . HIS A 1 69 ? -3.018 -39.174 -11.515 1.00 26.57 ? 69 HIS A CE1 1 ATOM 520 N NE2 . HIS A 1 69 ? -3.094 -39.371 -12.817 1.00 26.73 ? 69 HIS A NE2 1 ATOM 521 N N . ASP A 1 70 ? -3.037 -43.467 -14.792 1.00 27.59 ? 70 ASP A N 1 ATOM 522 C CA . ASP A 1 70 ? -2.012 -43.337 -15.805 1.00 28.75 ? 70 ASP A CA 1 ATOM 523 C C . ASP A 1 70 ? -1.494 -41.888 -15.694 1.00 30.15 ? 70 ASP A C 1 ATOM 524 O O . ASP A 1 70 ? -2.175 -40.927 -16.097 1.00 24.71 ? 70 ASP A O 1 ATOM 525 C CB . ASP A 1 70 ? -2.569 -43.639 -17.218 1.00 29.55 ? 70 ASP A CB 1 ATOM 526 C CG . ASP A 1 70 ? -1.482 -43.689 -18.276 1.00 33.56 ? 70 ASP A CG 1 ATOM 527 O OD1 . ASP A 1 70 ? -0.473 -42.953 -18.102 1.00 29.94 ? 70 ASP A OD1 1 ATOM 528 O OD2 . ASP A 1 70 ? -1.605 -44.497 -19.245 1.00 29.58 ? 70 ASP A OD2 1 ATOM 529 N N . MET A 1 71 ? -0.304 -41.754 -15.101 1.00 26.37 ? 71 MET A N 1 ATOM 530 C CA . MET A 1 71 ? 0.246 -40.466 -14.695 1.00 25.67 ? 71 MET A CA 1 ATOM 531 C C . MET A 1 71 ? 1.080 -39.773 -15.811 1.00 26.16 ? 71 MET A C 1 ATOM 532 O O . MET A 1 71 ? 1.974 -38.991 -15.541 1.00 30.56 ? 71 MET A O 1 ATOM 533 C CB . MET A 1 71 ? 1.105 -40.676 -13.433 1.00 25.83 ? 71 MET A CB 1 ATOM 534 C CG . MET A 1 71 ? 0.285 -41.079 -12.199 1.00 29.19 ? 71 MET A CG 1 ATOM 535 S SD . MET A 1 71 ? 1.247 -41.200 -10.676 1.00 29.27 ? 71 MET A SD 1 ATOM 536 C CE . MET A 1 71 ? 2.616 -42.283 -11.135 1.00 26.82 ? 71 MET A CE 1 ATOM 537 N N . PHE A 1 72 ? 0.873 -40.156 -17.058 1.00 26.64 ? 72 PHE A N 1 ATOM 538 C CA . PHE A 1 72 ? 1.411 -39.432 -18.183 1.00 25.89 ? 72 PHE A CA 1 ATOM 539 C C . PHE A 1 72 ? 0.747 -38.070 -18.286 1.00 26.24 ? 72 PHE A C 1 ATOM 540 O O . PHE A 1 72 ? -0.467 -37.932 -18.068 1.00 24.99 ? 72 PHE A O 1 ATOM 541 C CB . PHE A 1 72 ? 1.169 -40.222 -19.431 1.00 24.32 ? 72 PHE A CB 1 ATOM 542 C CG . PHE A 1 72 ? 1.676 -39.584 -20.676 1.00 26.20 ? 72 PHE A CG 1 ATOM 543 C CD1 . PHE A 1 72 ? 3.032 -39.461 -20.912 1.00 23.66 ? 72 PHE A CD1 1 ATOM 544 C CD2 . PHE A 1 72 ? 0.754 -39.087 -21.646 1.00 25.88 ? 72 PHE A CD2 1 ATOM 545 C CE1 . PHE A 1 72 ? 3.474 -38.833 -22.092 1.00 26.70 ? 72 PHE A CE1 1 ATOM 546 C CE2 . PHE A 1 72 ? 1.198 -38.545 -22.821 1.00 24.22 ? 72 PHE A CE2 1 ATOM 547 C CZ . PHE A 1 72 ? 2.563 -38.396 -23.039 1.00 25.99 ? 72 PHE A CZ 1 ATOM 548 N N . CYS A 1 73 ? 1.561 -37.074 -18.591 1.00 25.84 ? 73 CYS A N 1 ATOM 549 C CA . CYS A 1 73 ? 1.069 -35.705 -18.859 1.00 27.38 ? 73 CYS A CA 1 ATOM 550 C C . CYS A 1 73 ? 0.421 -35.042 -17.629 1.00 27.83 ? 73 CYS A C 1 ATOM 551 O O . CYS A 1 73 ? -0.556 -34.321 -17.786 1.00 24.62 ? 73 CYS A O 1 ATOM 552 C CB . CYS A 1 73 ? 0.106 -35.723 -20.087 1.00 26.94 ? 73 CYS A CB 1 ATOM 553 S SG . CYS A 1 73 ? 0.960 -35.506 -21.671 1.00 28.55 ? 73 CYS A SG 1 ATOM 554 N N . PRO A 1 74 ? 1.022 -35.193 -16.401 1.00 23.50 ? 74 PRO A N 1 ATOM 555 C CA . PRO A 1 74 ? 0.326 -34.699 -15.237 1.00 24.75 ? 74 PRO A CA 1 ATOM 556 C C . PRO A 1 74 ? 0.858 -33.371 -14.764 1.00 23.20 ? 74 PRO A C 1 ATOM 557 O O . PRO A 1 74 ? 1.914 -32.913 -15.210 1.00 24.22 ? 74 PRO A O 1 ATOM 558 C CB . PRO A 1 74 ? 0.673 -35.742 -14.192 1.00 25.47 ? 74 PRO A CB 1 ATOM 559 C CG . PRO A 1 74 ? 2.108 -36.048 -14.498 1.00 25.38 ? 74 PRO A CG 1 ATOM 560 C CD . PRO A 1 74 ? 2.250 -35.894 -15.995 1.00 25.36 ? 74 PRO A CD 1 ATOM 561 N N . GLY A 1 75 ? 0.178 -32.825 -13.769 1.00 22.12 ? 75 GLY A N 1 ATOM 562 C CA . GLY A 1 75 ? 0.779 -31.864 -12.821 1.00 20.81 ? 75 GLY A CA 1 ATOM 563 C C . GLY A 1 75 ? 1.599 -32.618 -11.780 1.00 24.14 ? 75 GLY A C 1 ATOM 564 O O . GLY A 1 75 ? 1.260 -33.754 -11.471 1.00 25.23 ? 75 GLY A O 1 ATOM 565 N N . THR A 1 76 ? 2.687 -32.029 -11.286 1.00 22.25 ? 76 THR A N 1 ATOM 566 C CA . THR A 1 76 ? 3.463 -32.601 -10.160 1.00 25.83 ? 76 THR A CA 1 ATOM 567 C C . THR A 1 76 ? 3.815 -31.524 -9.166 1.00 25.12 ? 76 THR A C 1 ATOM 568 O O . THR A 1 76 ? 4.144 -30.385 -9.538 1.00 25.22 ? 76 THR A O 1 ATOM 569 C CB . THR A 1 76 ? 4.813 -33.210 -10.616 1.00 29.02 ? 76 THR A CB 1 ATOM 570 O OG1 . THR A 1 76 ? 5.627 -32.188 -11.203 1.00 30.25 ? 76 THR A OG1 1 ATOM 571 C CG2 . THR A 1 76 ? 4.604 -34.264 -11.681 1.00 27.14 ? 76 THR A CG2 1 ATOM 572 N N . SER A 1 77 ? 3.771 -31.889 -7.896 1.00 24.20 ? 77 SER A N 1 ATOM 573 C CA . SER A 1 77 ? 4.254 -31.031 -6.817 1.00 27.24 ? 77 SER A CA 1 ATOM 574 C C . SER A 1 77 ? 4.650 -31.897 -5.603 1.00 26.82 ? 77 SER A C 1 ATOM 575 O O . SER A 1 77 ? 4.128 -32.999 -5.386 1.00 28.45 ? 77 SER A O 1 ATOM 576 C CB . SER A 1 77 ? 3.174 -30.021 -6.397 1.00 26.73 ? 77 SER A CB 1 ATOM 577 O OG . SER A 1 77 ? 2.882 -29.075 -7.402 1.00 31.09 ? 77 SER A OG 1 ATOM 578 N N . LEU A 1 78 ? 5.636 -31.441 -4.863 1.00 26.44 ? 78 LEU A N 1 ATOM 579 C CA . LEU A 1 78 ? 5.923 -32.068 -3.595 1.00 26.34 ? 78 LEU A CA 1 ATOM 580 C C . LEU A 1 78 ? 5.312 -31.238 -2.459 1.00 28.19 ? 78 LEU A C 1 ATOM 581 O O . LEU A 1 78 ? 5.518 -30.004 -2.359 1.00 31.55 ? 78 LEU A O 1 ATOM 582 C CB . LEU A 1 78 ? 7.421 -32.197 -3.434 1.00 26.34 ? 78 LEU A CB 1 ATOM 583 C CG . LEU A 1 78 ? 7.997 -33.449 -4.059 1.00 27.33 ? 78 LEU A CG 1 ATOM 584 C CD1 . LEU A 1 78 ? 8.172 -33.269 -5.543 1.00 31.36 ? 78 LEU A CD1 1 ATOM 585 C CD2 . LEU A 1 78 ? 9.291 -33.853 -3.411 1.00 32.86 ? 78 LEU A CD2 1 ATOM 586 N N . ASP A 1 79 ? 4.576 -31.922 -1.593 1.00 30.09 ? 79 ASP A N 1 ATOM 587 C CA . ASP A 1 79 ? 3.895 -31.245 -0.504 1.00 32.07 ? 79 ASP A CA 1 ATOM 588 C C . ASP A 1 79 ? 4.792 -31.060 0.687 1.00 28.32 ? 79 ASP A C 1 ATOM 589 O O . ASP A 1 79 ? 6.006 -31.332 0.602 1.00 27.80 ? 79 ASP A O 1 ATOM 590 C CB . ASP A 1 79 ? 2.648 -31.992 -0.133 1.00 31.52 ? 79 ASP A CB 1 ATOM 591 C CG . ASP A 1 79 ? 2.901 -33.165 0.782 1.00 33.17 ? 79 ASP A CG 1 ATOM 592 O OD1 . ASP A 1 79 ? 4.070 -33.455 1.158 1.00 31.88 ? 79 ASP A OD1 1 ATOM 593 O OD2 . ASP A 1 79 ? 1.876 -33.798 1.108 1.00 31.81 ? 79 ASP A OD2 1 ATOM 594 N N . ALA A 1 80 ? 4.221 -30.515 1.767 1.00 27.99 ? 80 ALA A N 1 ATOM 595 C CA . ALA A 1 80 ? 5.034 -30.070 2.947 1.00 33.29 ? 80 ALA A CA 1 ATOM 596 C C . ALA A 1 80 ? 5.780 -31.218 3.620 1.00 29.37 ? 80 ALA A C 1 ATOM 597 O O . ALA A 1 80 ? 6.784 -31.008 4.278 1.00 29.29 ? 80 ALA A O 1 ATOM 598 C CB . ALA A 1 80 ? 4.157 -29.373 3.993 1.00 36.68 ? 80 ALA A CB 1 ATOM 599 N N . ASP A 1 81 ? 5.299 -32.434 3.426 1.00 33.80 ? 81 ASP A N 1 ATOM 600 C CA . ASP A 1 81 ? 5.949 -33.604 4.023 1.00 37.64 ? 81 ASP A CA 1 ATOM 601 C C . ASP A 1 81 ? 6.731 -34.410 3.023 1.00 35.58 ? 81 ASP A C 1 ATOM 602 O O . ASP A 1 81 ? 7.220 -35.442 3.385 1.00 33.01 ? 81 ASP A O 1 ATOM 603 C CB . ASP A 1 81 ? 4.898 -34.480 4.693 1.00 36.42 ? 81 ASP A CB 1 ATOM 604 C CG . ASP A 1 81 ? 4.140 -33.710 5.779 1.00 42.46 ? 81 ASP A CG 1 ATOM 605 O OD1 . ASP A 1 81 ? 4.797 -33.117 6.653 1.00 45.26 ? 81 ASP A OD1 1 ATOM 606 O OD2 . ASP A 1 81 ? 2.916 -33.583 5.671 1.00 50.74 ? 81 ASP A OD2 1 ATOM 607 N N . GLY A 1 82 ? 6.989 -33.889 1.822 1.00 32.77 ? 82 GLY A N 1 ATOM 608 C CA . GLY A 1 82 ? 7.820 -34.639 0.876 1.00 31.22 ? 82 GLY A CA 1 ATOM 609 C C . GLY A 1 82 ? 7.041 -35.696 0.093 1.00 26.15 ? 82 GLY A C 1 ATOM 610 O O . GLY A 1 82 ? 7.620 -36.516 -0.564 1.00 27.06 ? 82 GLY A O 1 ATOM 611 N N . ARG A 1 83 ? 5.717 -35.669 0.168 1.00 25.17 ? 83 ARG A N 1 ATOM 612 C CA . ARG A 1 83 ? 4.908 -36.530 -0.627 1.00 26.93 ? 83 ARG A CA 1 ATOM 613 C C . ARG A 1 83 ? 4.838 -35.971 -2.048 1.00 26.46 ? 83 ARG A C 1 ATOM 614 O O . ARG A 1 83 ? 4.828 -34.761 -2.253 1.00 25.28 ? 83 ARG A O 1 ATOM 615 C CB . ARG A 1 83 ? 3.520 -36.676 -0.022 1.00 28.56 ? 83 ARG A CB 1 ATOM 616 C CG . ARG A 1 83 ? 3.484 -37.277 1.386 1.00 33.97 ? 83 ARG A CG 1 ATOM 617 C CD . ARG A 1 83 ? 2.046 -37.622 1.778 1.00 35.39 ? 83 ARG A CD 1 ATOM 618 N NE . ARG A 1 83 ? 1.157 -36.445 1.692 1.00 35.32 ? 83 ARG A NE 1 ATOM 619 C CZ . ARG A 1 83 ? -0.164 -36.487 1.548 1.00 38.36 ? 83 ARG A CZ 1 ATOM 620 N NH1 . ARG A 1 83 ? -0.793 -37.649 1.534 1.00 41.01 ? 83 ARG A NH1 1 ATOM 621 N NH2 . ARG A 1 83 ? -0.871 -35.363 1.445 1.00 38.00 ? 83 ARG A NH2 1 ATOM 622 N N . ILE A 1 84 ? 4.912 -36.864 -3.022 1.00 27.34 ? 84 ILE A N 1 ATOM 623 C CA . ILE A 1 84 ? 4.843 -36.463 -4.398 1.00 23.34 ? 84 ILE A CA 1 ATOM 624 C C . ILE A 1 84 ? 3.407 -36.558 -4.840 1.00 25.76 ? 84 ILE A C 1 ATOM 625 O O . ILE A 1 84 ? 2.823 -37.629 -4.821 1.00 22.77 ? 84 ILE A O 1 ATOM 626 C CB . ILE A 1 84 ? 5.728 -37.328 -5.314 1.00 26.79 ? 84 ILE A CB 1 ATOM 627 C CG1 . ILE A 1 84 ? 7.154 -37.343 -4.782 1.00 32.63 ? 84 ILE A CG1 1 ATOM 628 C CG2 . ILE A 1 84 ? 5.675 -36.798 -6.767 1.00 26.23 ? 84 ILE A CG2 1 ATOM 629 C CD1 . ILE A 1 84 ? 8.024 -38.452 -5.335 1.00 33.02 ? 84 ILE A CD1 1 ATOM 630 N N . ILE A 1 85 ? 2.823 -35.418 -5.185 1.00 23.34 ? 85 ILE A N 1 ATOM 631 C CA . ILE A 1 85 ? 1.406 -35.384 -5.567 1.00 27.27 ? 85 ILE A CA 1 ATOM 632 C C . ILE A 1 85 ? 1.300 -35.116 -7.070 1.00 28.27 ? 85 ILE A C 1 ATOM 633 O O . ILE A 1 85 ? 1.747 -34.059 -7.574 1.00 21.41 ? 85 ILE A O 1 ATOM 634 C CB . ILE A 1 85 ? 0.627 -34.328 -4.758 1.00 24.47 ? 85 ILE A CB 1 ATOM 635 C CG1 . ILE A 1 85 ? 0.576 -34.718 -3.264 1.00 32.97 ? 85 ILE A CG1 1 ATOM 636 C CG2 . ILE A 1 85 ? -0.779 -34.141 -5.334 1.00 27.52 ? 85 ILE A CG2 1 ATOM 637 C CD1 . ILE A 1 85 ? -0.035 -33.661 -2.347 1.00 34.96 ? 85 ILE A CD1 1 ATOM 638 N N . VAL A 1 86 ? 0.722 -36.087 -7.768 1.00 27.74 ? 86 VAL A N 1 ATOM 639 C CA . VAL A 1 86 ? 0.632 -36.067 -9.213 1.00 27.65 ? 86 VAL A CA 1 ATOM 640 C C . VAL A 1 86 ? -0.840 -36.018 -9.616 1.00 31.56 ? 86 VAL A C 1 ATOM 641 O O . VAL A 1 86 ? -1.637 -36.861 -9.216 1.00 28.87 ? 86 VAL A O 1 ATOM 642 C CB . VAL A 1 86 ? 1.265 -37.363 -9.775 1.00 26.81 ? 86 VAL A CB 1 ATOM 643 C CG1 . VAL A 1 86 ? 1.133 -37.455 -11.269 1.00 25.29 ? 86 VAL A CG1 1 ATOM 644 C CG2 . VAL A 1 86 ? 2.735 -37.470 -9.351 1.00 25.92 ? 86 VAL A CG2 1 ATOM 645 N N . THR A 1 87 ? -1.172 -35.076 -10.479 1.00 29.51 ? 87 THR A N 1 ATOM 646 C CA . THR A 1 87 ? -2.541 -34.858 -10.889 1.00 27.30 ? 87 THR A CA 1 ATOM 647 C C . THR A 1 87 ? -2.755 -35.066 -12.394 1.00 26.56 ? 87 THR A C 1 ATOM 648 O O . THR A 1 87 ? -1.986 -34.609 -13.252 1.00 29.92 ? 87 THR A O 1 ATOM 649 C CB . THR A 1 87 ? -2.959 -33.401 -10.590 1.00 29.69 ? 87 THR A CB 1 ATOM 650 O OG1 . THR A 1 87 ? -1.873 -32.543 -10.966 1.00 28.78 ? 87 THR A OG1 1 ATOM 651 C CG2 . THR A 1 87 ? -3.280 -33.186 -9.140 1.00 30.07 ? 87 THR A CG2 1 ATOM 652 N N . GLY A 1 88 ? -3.903 -35.617 -12.706 1.00 27.79 ? 88 GLY A N 1 ATOM 653 C CA . GLY A 1 88 ? -4.461 -35.550 -14.028 1.00 31.03 ? 88 GLY A CA 1 ATOM 654 C C . GLY A 1 88 ? -3.603 -36.264 -15.034 1.00 30.27 ? 88 GLY A C 1 ATOM 655 O O . GLY A 1 88 ? -2.980 -37.283 -14.736 1.00 31.69 ? 88 GLY A O 1 ATOM 656 N N . GLY A 1 89 ? -3.647 -35.774 -16.265 1.00 30.26 ? 89 GLY A N 1 ATOM 657 C CA . GLY A 1 89 ? -2.973 -36.440 -17.344 1.00 29.33 ? 89 GLY A CA 1 ATOM 658 C C . GLY A 1 89 ? -3.882 -37.425 -18.006 1.00 31.86 ? 89 GLY A C 1 ATOM 659 O O . GLY A 1 89 ? -5.023 -37.107 -18.240 1.00 33.68 ? 89 GLY A O 1 ATOM 660 N N . SER A 1 90 ? -3.341 -38.576 -18.391 1.00 29.94 ? 90 SER A N 1 ATOM 661 C CA . SER A 1 90 ? -4.120 -39.600 -19.075 1.00 33.49 ? 90 SER A CA 1 ATOM 662 C C . SER A 1 90 ? -5.349 -40.100 -18.285 1.00 33.78 ? 90 SER A C 1 ATOM 663 O O . SER A 1 90 ? -6.395 -40.263 -18.861 1.00 40.89 ? 90 SER A O 1 ATOM 664 C CB . SER A 1 90 ? -3.254 -40.769 -19.512 1.00 28.50 ? 90 SER A CB 1 ATOM 665 O OG . SER A 1 90 ? -2.468 -40.454 -20.672 1.00 33.03 ? 90 SER A OG 1 ATOM 666 N N . SER A 1 91 ? -5.242 -40.247 -16.978 1.00 31.61 ? 91 SER A N 1 ATOM 667 C CA . SER A 1 91 ? -6.417 -40.341 -16.112 1.00 31.86 ? 91 SER A CA 1 ATOM 668 C C . SER A 1 91 ? -6.771 -38.941 -15.552 1.00 31.92 ? 91 SER A C 1 ATOM 669 O O . SER A 1 91 ? -6.340 -38.535 -14.485 1.00 29.36 ? 91 SER A O 1 ATOM 670 C CB . SER A 1 91 ? -6.193 -41.396 -15.003 1.00 30.75 ? 91 SER A CB 1 ATOM 671 O OG . SER A 1 91 ? -5.664 -42.594 -15.579 1.00 29.56 ? 91 SER A OG 1 ATOM 672 N N . ALA A 1 92 ? -7.575 -38.197 -16.306 1.00 32.64 ? 92 ALA A N 1 ATOM 673 C CA . ALA A 1 92 ? -7.525 -36.736 -16.273 1.00 31.90 ? 92 ALA A CA 1 ATOM 674 C C . ALA A 1 92 ? -8.149 -36.117 -15.002 1.00 32.54 ? 92 ALA A C 1 ATOM 675 O O . ALA A 1 92 ? -7.861 -34.976 -14.653 1.00 30.22 ? 92 ALA A O 1 ATOM 676 C CB . ALA A 1 92 ? -8.167 -36.182 -17.542 1.00 35.27 ? 92 ALA A CB 1 ATOM 677 N N . ALA A 1 93 ? -8.909 -36.914 -14.253 1.00 33.84 ? 93 ALA A N 1 ATOM 678 C CA . ALA A 1 93 ? -9.648 -36.481 -13.044 1.00 35.50 ? 93 ALA A CA 1 ATOM 679 C C . ALA A 1 93 ? -8.884 -36.765 -11.741 1.00 37.13 ? 93 ALA A C 1 ATOM 680 O O . ALA A 1 93 ? -9.162 -36.183 -10.663 1.00 33.28 ? 93 ALA A O 1 ATOM 681 C CB . ALA A 1 93 ? -10.993 -37.206 -12.997 1.00 38.64 ? 93 ALA A CB 1 ATOM 682 N N . LYS A 1 94 ? -7.924 -37.675 -11.843 1.00 36.23 ? 94 LYS A N 1 ATOM 683 C CA . LYS A 1 94 ? -7.350 -38.305 -10.668 1.00 33.80 ? 94 LYS A CA 1 ATOM 684 C C . LYS A 1 94 ? -6.204 -37.521 -10.005 1.00 35.15 ? 94 LYS A C 1 ATOM 685 O O . LYS A 1 94 ? -5.532 -36.667 -10.627 1.00 31.98 ? 94 LYS A O 1 ATOM 686 C CB . LYS A 1 94 ? -6.966 -39.745 -11.016 1.00 36.14 ? 94 LYS A CB 1 ATOM 687 C CG . LYS A 1 94 ? -8.191 -40.649 -10.981 1.00 39.66 ? 94 LYS A CG 1 ATOM 688 C CD . LYS A 1 94 ? -7.930 -42.030 -11.552 1.00 47.91 ? 94 LYS A CD 1 ATOM 689 C CE . LYS A 1 94 ? -9.222 -42.718 -12.006 0.80 42.44 ? 94 LYS A CE 1 ATOM 690 N NZ . LYS A 1 94 ? -9.750 -43.559 -10.908 0.70 48.98 ? 94 LYS A NZ 1 ATOM 691 N N . THR A 1 95 ? -6.088 -37.713 -8.692 1.00 26.44 ? 95 THR A N 1 ATOM 692 C CA . THR A 1 95 ? -4.935 -37.314 -7.936 1.00 27.25 ? 95 THR A CA 1 ATOM 693 C C . THR A 1 95 ? -4.346 -38.553 -7.266 1.00 33.57 ? 95 THR A C 1 ATOM 694 O O . THR A 1 95 ? -5.080 -39.362 -6.701 1.00 28.65 ? 95 THR A O 1 ATOM 695 C CB . THR A 1 95 ? -5.328 -36.317 -6.884 1.00 29.54 ? 95 THR A CB 1 ATOM 696 O OG1 . THR A 1 95 ? -6.080 -35.284 -7.494 1.00 29.93 ? 95 THR A OG1 1 ATOM 697 C CG2 . THR A 1 95 ? -4.087 -35.737 -6.192 1.00 30.84 ? 95 THR A CG2 1 ATOM 698 N N . SER A 1 96 ? -3.034 -38.731 -7.375 1.00 28.13 ? 96 SER A N 1 ATOM 699 C CA . SER A 1 96 ? -2.344 -39.803 -6.668 1.00 23.93 ? 96 SER A CA 1 ATOM 700 C C . SER A 1 96 ? -1.226 -39.241 -5.848 1.00 26.86 ? 96 SER A C 1 ATOM 701 O O . SER A 1 96 ? -0.685 -38.150 -6.155 1.00 27.28 ? 96 SER A O 1 ATOM 702 C CB . SER A 1 96 ? -1.764 -40.810 -7.624 1.00 26.65 ? 96 SER A CB 1 ATOM 703 O OG . SER A 1 96 ? -2.699 -41.349 -8.537 1.00 29.72 ? 96 SER A OG 1 ATOM 704 N N . VAL A 1 97 ? -0.786 -40.024 -4.865 1.00 24.86 ? 97 VAL A N 1 ATOM 705 C CA . VAL A 1 97 ? 0.276 -39.589 -3.978 1.00 25.62 ? 97 VAL A CA 1 ATOM 706 C C . VAL A 1 97 ? 1.264 -40.723 -3.647 1.00 29.32 ? 97 VAL A C 1 ATOM 707 O O . VAL A 1 97 ? 0.891 -41.894 -3.604 1.00 30.82 ? 97 VAL A O 1 ATOM 708 C CB . VAL A 1 97 ? -0.293 -38.933 -2.709 1.00 29.21 ? 97 VAL A CB 1 ATOM 709 C CG1 . VAL A 1 97 ? -1.136 -39.901 -1.853 1.00 35.98 ? 97 VAL A CG1 1 ATOM 710 C CG2 . VAL A 1 97 ? 0.811 -38.365 -1.890 1.00 25.12 ? 97 VAL A CG2 1 ATOM 711 N N . LEU A 1 98 ? 2.542 -40.392 -3.613 1.00 28.08 ? 98 LEU A N 1 ATOM 712 C CA . LEU A 1 98 ? 3.564 -41.325 -3.115 1.00 30.62 ? 98 LEU A CA 1 ATOM 713 C C . LEU A 1 98 ? 4.232 -40.699 -1.933 1.00 28.35 ? 98 LEU A C 1 ATOM 714 O O . LEU A 1 98 ? 4.792 -39.570 -2.001 1.00 29.63 ? 98 LEU A O 1 ATOM 715 C CB . LEU A 1 98 ? 4.631 -41.686 -4.154 1.00 31.57 ? 98 LEU A CB 1 ATOM 716 C CG . LEU A 1 98 ? 5.684 -42.690 -3.689 1.00 29.49 ? 98 LEU A CG 1 ATOM 717 C CD1 . LEU A 1 98 ? 5.025 -44.066 -3.500 1.00 30.36 ? 98 LEU A CD1 1 ATOM 718 C CD2 . LEU A 1 98 ? 6.782 -42.728 -4.734 1.00 32.47 ? 98 LEU A CD2 1 ATOM 719 N N . ASP A 1 99 ? 4.103 -41.428 -0.820 1.00 29.35 ? 99 ASP A N 1 ATOM 720 C CA . ASP A 1 99 ? 4.748 -41.094 0.438 1.00 29.12 ? 99 ASP A CA 1 ATOM 721 C C . ASP A 1 99 ? 5.945 -41.979 0.560 1.00 29.79 ? 99 ASP A C 1 ATOM 722 O O . ASP A 1 99 ? 5.803 -43.206 0.844 1.00 27.38 ? 99 ASP A O 1 ATOM 723 C CB . ASP A 1 99 ? 3.827 -41.353 1.646 1.00 30.78 ? 99 ASP A CB 1 ATOM 724 C CG . ASP A 1 99 ? 4.432 -40.848 2.943 1.00 32.04 ? 99 ASP A CG 1 ATOM 725 O OD1 . ASP A 1 99 ? 5.655 -40.536 3.007 1.00 36.41 ? 99 ASP A OD1 1 ATOM 726 O OD2 . ASP A 1 99 ? 3.673 -40.642 3.887 1.00 39.28 ? 99 ASP A OD2 1 ATOM 727 N N . PHE A 1 100 ? 7.120 -41.380 0.418 1.00 24.20 ? 100 PHE A N 1 ATOM 728 C CA . PHE A 1 100 ? 8.362 -42.189 0.377 1.00 28.22 ? 100 PHE A CA 1 ATOM 729 C C . PHE A 1 100 ? 8.586 -43.078 1.627 1.00 31.07 ? 100 PHE A C 1 ATOM 730 O O . PHE A 1 100 ? 9.291 -44.083 1.533 1.00 27.67 ? 100 PHE A O 1 ATOM 731 C CB . PHE A 1 100 ? 9.583 -41.283 0.194 1.00 25.31 ? 100 PHE A CB 1 ATOM 732 C CG . PHE A 1 100 ? 9.877 -40.437 1.370 1.00 28.01 ? 100 PHE A CG 1 ATOM 733 C CD1 . PHE A 1 100 ? 9.295 -39.184 1.505 1.00 28.47 ? 100 PHE A CD1 1 ATOM 734 C CD2 . PHE A 1 100 ? 10.744 -40.892 2.359 1.00 27.94 ? 100 PHE A CD2 1 ATOM 735 C CE1 . PHE A 1 100 ? 9.559 -38.390 2.606 1.00 28.35 ? 100 PHE A CE1 1 ATOM 736 C CE2 . PHE A 1 100 ? 10.991 -40.132 3.472 1.00 28.45 ? 100 PHE A CE2 1 ATOM 737 C CZ . PHE A 1 100 ? 10.416 -38.867 3.601 1.00 30.58 ? 100 PHE A CZ 1 ATOM 738 N N . LYS A 1 101 ? 8.141 -42.588 2.792 1.00 27.01 ? 101 LYS A N 1 ATOM 739 C CA . LYS A 1 101 ? 8.291 -43.246 4.099 1.00 31.42 ? 101 LYS A CA 1 ATOM 740 C C . LYS A 1 101 ? 7.741 -44.677 4.024 1.00 28.99 ? 101 LYS A C 1 ATOM 741 O O . LYS A 1 101 ? 8.243 -45.561 4.663 1.00 27.28 ? 101 LYS A O 1 ATOM 742 C CB . LYS A 1 101 ? 7.445 -42.546 5.169 1.00 32.03 ? 101 LYS A CB 1 ATOM 743 C CG . LYS A 1 101 ? 7.908 -41.202 5.688 0.70 38.49 ? 101 LYS A CG 1 ATOM 744 C CD . LYS A 1 101 ? 6.779 -40.596 6.534 0.60 39.40 ? 101 LYS A CD 1 ATOM 745 C CE . LYS A 1 101 ? 6.729 -39.075 6.470 0.50 43.72 ? 101 LYS A CE 1 ATOM 746 N NZ . LYS A 1 101 ? 6.177 -38.550 5.182 0.50 45.04 ? 101 LYS A NZ 1 ATOM 747 N N . LYS A 1 102 ? 6.655 -44.850 3.293 1.00 25.88 ? 102 LYS A N 1 ATOM 748 C CA . LYS A 1 102 ? 5.990 -46.136 3.153 1.00 26.94 ? 102 LYS A CA 1 ATOM 749 C C . LYS A 1 102 ? 6.660 -47.074 2.168 1.00 27.07 ? 102 LYS A C 1 ATOM 750 O O . LYS A 1 102 ? 6.231 -48.198 2.015 1.00 28.97 ? 102 LYS A O 1 ATOM 751 C CB . LYS A 1 102 ? 4.526 -45.919 2.715 1.00 31.53 ? 102 LYS A CB 1 ATOM 752 C CG . LYS A 1 102 ? 3.645 -45.219 3.757 1.00 35.42 ? 102 LYS A CG 1 ATOM 753 C CD . LYS A 1 102 ? 2.233 -44.961 3.225 0.90 34.18 ? 102 LYS A CD 1 ATOM 754 C CE . LYS A 1 102 ? 1.400 -44.136 4.188 0.70 37.14 ? 102 LYS A CE 1 ATOM 755 N NZ . LYS A 1 102 ? 0.241 -43.584 3.439 0.60 41.10 ? 102 LYS A NZ 1 ATOM 756 N N . GLY A 1 103 ? 7.690 -46.607 1.478 1.00 29.26 ? 103 GLY A N 1 ATOM 757 C CA . GLY A 1 103 ? 8.366 -47.390 0.490 1.00 30.70 ? 103 GLY A CA 1 ATOM 758 C C . GLY A 1 103 ? 8.420 -46.681 -0.867 1.00 25.86 ? 103 GLY A C 1 ATOM 759 O O . GLY A 1 103 ? 7.397 -46.379 -1.457 1.00 27.42 ? 103 GLY A O 1 ATOM 760 N N . GLU A 1 104 ? 9.614 -46.562 -1.409 1.00 25.11 ? 104 GLU A N 1 ATOM 761 C CA . GLU A 1 104 ? 9.825 -45.849 -2.687 1.00 28.68 ? 104 GLU A CA 1 ATOM 762 C C . GLU A 1 104 ? 9.201 -46.627 -3.831 1.00 29.34 ? 104 GLU A C 1 ATOM 763 O O . GLU A 1 104 ? 8.813 -46.039 -4.842 1.00 26.36 ? 104 GLU A O 1 ATOM 764 C CB . GLU A 1 104 ? 11.313 -45.646 -2.936 1.00 24.33 ? 104 GLU A CB 1 ATOM 765 C CG . GLU A 1 104 ? 11.873 -44.500 -2.110 1.00 28.90 ? 104 GLU A CG 1 ATOM 766 C CD . GLU A 1 104 ? 13.395 -44.397 -2.153 1.00 27.82 ? 104 GLU A CD 1 ATOM 767 O OE1 . GLU A 1 104 ? 14.030 -45.186 -2.927 1.00 29.80 ? 104 GLU A OE1 1 ATOM 768 O OE2 . GLU A 1 104 ? 13.958 -43.590 -1.353 1.00 32.78 ? 104 GLU A OE2 1 ATOM 769 N N . SER A 1 105 ? 9.036 -47.941 -3.644 1.00 26.39 ? 105 SER A N 1 ATOM 770 C CA . SER A 1 105 ? 8.364 -48.768 -4.642 1.00 25.65 ? 105 SER A CA 1 ATOM 771 C C . SER A 1 105 ? 7.022 -49.255 -4.210 1.00 24.87 ? 105 SER A C 1 ATOM 772 O O . SER A 1 105 ? 6.446 -50.087 -4.888 1.00 26.22 ? 105 SER A O 1 ATOM 773 C CB . SER A 1 105 ? 9.242 -49.955 -5.026 1.00 31.01 ? 105 SER A CB 1 ATOM 774 O OG . SER A 1 105 ? 10.559 -49.496 -5.307 1.00 34.41 ? 105 SER A OG 1 ATOM 775 N N . SER A 1 106 ? 6.448 -48.635 -3.190 1.00 26.19 ? 106 SER A N 1 ATOM 776 C CA . SER A 1 106 ? 5.144 -49.037 -2.696 1.00 28.92 ? 106 SER A CA 1 ATOM 777 C C . SER A 1 106 ? 4.034 -48.363 -3.544 1.00 31.32 ? 106 SER A C 1 ATOM 778 O O . SER A 1 106 ? 4.289 -47.453 -4.311 1.00 27.01 ? 106 SER A O 1 ATOM 779 C CB . SER A 1 106 ? 5.027 -48.705 -1.204 1.00 28.79 ? 106 SER A CB 1 ATOM 780 O OG . SER A 1 106 ? 4.854 -47.286 -0.952 1.00 30.09 ? 106 SER A OG 1 ATOM 781 N N . PRO A 1 107 ? 2.830 -48.894 -3.487 1.00 35.54 ? 107 PRO A N 1 ATOM 782 C CA . PRO A 1 107 ? 1.783 -48.377 -4.360 1.00 34.77 ? 107 PRO A CA 1 ATOM 783 C C . PRO A 1 107 ? 1.489 -46.888 -4.183 1.00 33.56 ? 107 PRO A C 1 ATOM 784 O O . PRO A 1 107 ? 1.452 -46.347 -3.068 1.00 30.02 ? 107 PRO A O 1 ATOM 785 C CB . PRO A 1 107 ? 0.554 -49.212 -3.964 1.00 41.02 ? 107 PRO A CB 1 ATOM 786 C CG . PRO A 1 107 ? 1.137 -50.487 -3.364 1.00 39.05 ? 107 PRO A CG 1 ATOM 787 C CD . PRO A 1 107 ? 2.359 -50.029 -2.654 1.00 39.84 ? 107 PRO A CD 1 ATOM 788 N N . TRP A 1 108 ? 1.300 -46.215 -5.302 1.00 28.66 ? 108 TRP A N 1 ATOM 789 C CA . TRP A 1 108 ? 0.784 -44.886 -5.219 1.00 29.11 ? 108 TRP A CA 1 ATOM 790 C C . TRP A 1 108 ? -0.647 -45.038 -4.738 1.00 29.50 ? 108 TRP A C 1 ATOM 791 O O . TRP A 1 108 ? -1.299 -45.988 -5.123 1.00 32.05 ? 108 TRP A O 1 ATOM 792 C CB . TRP A 1 108 ? 0.782 -44.266 -6.606 1.00 32.80 ? 108 TRP A CB 1 ATOM 793 C CG . TRP A 1 108 ? 2.164 -43.908 -7.121 1.00 29.06 ? 108 TRP A CG 1 ATOM 794 C CD1 . TRP A 1 108 ? 3.114 -44.745 -7.612 1.00 27.76 ? 108 TRP A CD1 1 ATOM 795 C CD2 . TRP A 1 108 ? 2.680 -42.597 -7.260 1.00 25.23 ? 108 TRP A CD2 1 ATOM 796 N NE1 . TRP A 1 108 ? 4.208 -44.041 -8.021 1.00 25.44 ? 108 TRP A NE1 1 ATOM 797 C CE2 . TRP A 1 108 ? 3.966 -42.711 -7.818 1.00 23.62 ? 108 TRP A CE2 1 ATOM 798 C CE3 . TRP A 1 108 ? 2.184 -41.338 -6.972 1.00 23.53 ? 108 TRP A CE3 1 ATOM 799 C CZ2 . TRP A 1 108 ? 4.742 -41.625 -8.086 1.00 23.11 ? 108 TRP A CZ2 1 ATOM 800 C CZ3 . TRP A 1 108 ? 2.967 -40.235 -7.284 1.00 23.72 ? 108 TRP A CZ3 1 ATOM 801 C CH2 . TRP A 1 108 ? 4.223 -40.394 -7.795 1.00 24.12 ? 108 TRP A CH2 1 ATOM 802 N N . THR A 1 109 ? -1.159 -44.098 -3.967 1.00 31.33 ? 109 THR A N 1 ATOM 803 C CA . THR A 1 109 ? -2.520 -44.209 -3.453 1.00 32.18 ? 109 THR A CA 1 ATOM 804 C C . THR A 1 109 ? -3.383 -43.001 -3.856 1.00 34.93 ? 109 THR A C 1 ATOM 805 O O . THR A 1 109 ? -2.854 -41.911 -4.133 1.00 29.48 ? 109 THR A O 1 ATOM 806 C CB . THR A 1 109 ? -2.505 -44.334 -1.946 1.00 31.10 ? 109 THR A CB 1 ATOM 807 O OG1 . THR A 1 109 ? -1.852 -43.192 -1.373 1.00 34.03 ? 109 THR A OG1 1 ATOM 808 C CG2 . THR A 1 109 ? -1.780 -45.602 -1.528 1.00 32.15 ? 109 THR A CG2 1 ATOM 809 N N . PRO A 1 110 ? -4.716 -43.167 -3.837 1.00 37.92 ? 110 PRO A N 1 ATOM 810 C CA . PRO A 1 110 ? -5.565 -42.100 -4.380 1.00 35.71 ? 110 PRO A CA 1 ATOM 811 C C . PRO A 1 110 ? -5.821 -40.946 -3.417 1.00 35.00 ? 110 PRO A C 1 ATOM 812 O O . PRO A 1 110 ? -5.825 -41.125 -2.238 1.00 41.04 ? 110 PRO A O 1 ATOM 813 C CB . PRO A 1 110 ? -6.863 -42.828 -4.748 1.00 42.17 ? 110 PRO A CB 1 ATOM 814 C CG . PRO A 1 110 ? -6.900 -44.030 -3.878 1.00 46.37 ? 110 PRO A CG 1 ATOM 815 C CD . PRO A 1 110 ? -5.467 -44.415 -3.582 1.00 41.12 ? 110 PRO A CD 1 ATOM 816 N N . LEU A 1 111 ? -6.053 -39.757 -3.943 1.00 32.11 ? 111 LEU A N 1 ATOM 817 C CA . LEU A 1 111 ? -6.584 -38.639 -3.171 1.00 29.27 ? 111 LEU A CA 1 ATOM 818 C C . LEU A 1 111 ? -7.826 -38.181 -3.893 1.00 28.21 ? 111 LEU A C 1 ATOM 819 O O . LEU A 1 111 ? -8.218 -38.813 -4.873 1.00 29.65 ? 111 LEU A O 1 ATOM 820 C CB . LEU A 1 111 ? -5.559 -37.533 -3.082 1.00 35.14 ? 111 LEU A CB 1 ATOM 821 C CG . LEU A 1 111 ? -4.282 -38.006 -2.377 1.00 34.47 ? 111 LEU A CG 1 ATOM 822 C CD1 . LEU A 1 111 ? -3.284 -36.863 -2.323 1.00 33.45 ? 111 LEU A CD1 1 ATOM 823 C CD2 . LEU A 1 111 ? -4.576 -38.527 -0.970 1.00 33.72 ? 111 LEU A CD2 1 ATOM 824 N N . SER A 1 112 ? -8.460 -37.107 -3.447 1.00 32.16 ? 112 SER A N 1 ATOM 825 C CA . SER A 1 112 ? -9.701 -36.686 -4.142 1.00 40.13 ? 112 SER A CA 1 ATOM 826 C C . SER A 1 112 ? -9.412 -36.322 -5.586 1.00 38.11 ? 112 SER A C 1 ATOM 827 O O . SER A 1 112 ? -8.382 -35.689 -5.886 1.00 36.08 ? 112 SER A O 1 ATOM 828 C CB . SER A 1 112 ? -10.359 -35.484 -3.466 1.00 46.39 ? 112 SER A CB 1 ATOM 829 O OG . SER A 1 112 ? -10.636 -35.752 -2.111 1.00 50.63 ? 112 SER A OG 1 ATOM 830 N N . ASN A 1 113 ? -10.313 -36.750 -6.466 1.00 36.28 ? 113 ASN A N 1 ATOM 831 C CA . ASN A 1 113 ? -10.422 -36.233 -7.809 1.00 34.11 ? 113 ASN A CA 1 ATOM 832 C C . ASN A 1 113 ? -10.402 -34.723 -7.839 1.00 38.36 ? 113 ASN A C 1 ATOM 833 O O . ASN A 1 113 ? -10.937 -34.087 -6.956 1.00 35.60 ? 113 ASN A O 1 ATOM 834 C CB . ASN A 1 113 ? -11.728 -36.684 -8.419 1.00 35.92 ? 113 ASN A CB 1 ATOM 835 C CG . ASN A 1 113 ? -11.663 -38.082 -8.944 1.00 36.76 ? 113 ASN A CG 1 ATOM 836 O OD1 . ASN A 1 113 ? -10.721 -38.830 -8.699 1.00 38.06 ? 113 ASN A OD1 1 ATOM 837 N ND2 . ASN A 1 113 ? -12.635 -38.423 -9.727 1.00 44.94 ? 113 ASN A ND2 1 ATOM 838 N N . MET A 1 114 ? -9.762 -34.148 -8.856 1.00 38.59 ? 114 MET A N 1 ATOM 839 C CA . MET A 1 114 ? -9.890 -32.726 -9.124 1.00 35.26 ? 114 MET A CA 1 ATOM 840 C C . MET A 1 114 ? -11.326 -32.350 -9.515 1.00 33.51 ? 114 MET A C 1 ATOM 841 O O . MET A 1 114 ? -12.046 -33.166 -10.055 1.00 35.06 ? 114 MET A O 1 ATOM 842 C CB . MET A 1 114 ? -8.933 -32.294 -10.250 1.00 35.48 ? 114 MET A CB 1 ATOM 843 C CG . MET A 1 114 ? -7.473 -32.164 -9.795 1.00 36.79 ? 114 MET A CG 1 ATOM 844 S SD . MET A 1 114 ? -6.388 -31.778 -11.182 1.00 31.27 ? 114 MET A SD 1 ATOM 845 C CE . MET A 1 114 ? -6.672 -33.200 -12.229 1.00 33.57 ? 114 MET A CE 1 ATOM 846 N N . GLN A 1 115 ? -11.698 -31.103 -9.259 1.00 35.85 ? 115 GLN A N 1 ATOM 847 C CA . GLN A 1 115 ? -12.989 -30.543 -9.727 1.00 37.21 ? 115 GLN A CA 1 ATOM 848 C C . GLN A 1 115 ? -13.027 -30.430 -11.235 1.00 40.84 ? 115 GLN A C 1 ATOM 849 O O . GLN A 1 115 ? -14.035 -30.744 -11.884 1.00 38.68 ? 115 GLN A O 1 ATOM 850 C CB . GLN A 1 115 ? -13.185 -29.143 -9.165 1.00 37.64 ? 115 GLN A CB 1 ATOM 851 C CG . GLN A 1 115 ? -13.258 -29.029 -7.652 1.00 39.08 ? 115 GLN A CG 1 ATOM 852 C CD . GLN A 1 115 ? -14.446 -29.775 -7.040 1.00 48.02 ? 115 GLN A CD 1 ATOM 853 O OE1 . GLN A 1 115 ? -15.276 -30.362 -7.721 1.00 46.18 ? 115 GLN A OE1 1 ATOM 854 N NE2 . GLN A 1 115 ? -14.509 -29.752 -5.743 1.00 55.29 ? 115 GLN A NE2 1 ATOM 855 N N . ILE A 1 116 ? -11.906 -30.028 -11.816 1.00 37.32 ? 116 ILE A N 1 ATOM 856 C CA . ILE A 1 116 ? -11.825 -29.978 -13.264 1.00 35.60 ? 116 ILE A CA 1 ATOM 857 C C . ILE A 1 116 ? -10.790 -30.947 -13.797 1.00 33.98 ? 116 ILE A C 1 ATOM 858 O O . ILE A 1 116 ? -9.615 -30.874 -13.443 1.00 30.15 ? 116 ILE A O 1 ATOM 859 C CB . ILE A 1 116 ? -11.547 -28.542 -13.759 1.00 35.72 ? 116 ILE A CB 1 ATOM 860 C CG1 . ILE A 1 116 ? -12.572 -27.551 -13.192 1.00 38.57 ? 116 ILE A CG1 1 ATOM 861 C CG2 . ILE A 1 116 ? -11.666 -28.481 -15.263 1.00 40.72 ? 116 ILE A CG2 1 ATOM 862 C CD1 . ILE A 1 116 ? -12.139 -26.102 -13.219 1.00 42.83 ? 116 ILE A CD1 1 ATOM 863 N N . SER A 1 117 ? -11.223 -31.831 -14.684 1.00 31.37 ? 117 SER A N 1 ATOM 864 C CA . SER A 1 117 ? -10.317 -32.764 -15.313 1.00 37.67 ? 117 SER A CA 1 ATOM 865 C C . SER A 1 117 ? -9.352 -32.093 -16.298 1.00 39.59 ? 117 SER A C 1 ATOM 866 O O . SER A 1 117 ? -9.770 -31.249 -17.112 1.00 37.64 ? 117 SER A O 1 ATOM 867 C CB . SER A 1 117 ? -11.101 -33.843 -16.039 1.00 40.84 ? 117 SER A CB 1 ATOM 868 O OG . SER A 1 117 ? -11.797 -34.591 -15.094 1.00 39.63 ? 117 SER A OG 1 ATOM 869 N N . ARG A 1 118 ? -8.077 -32.521 -16.267 1.00 33.47 ? 118 ARG A N 1 ATOM 870 C CA . ARG A 1 118 ? -7.042 -31.806 -16.989 1.00 31.40 ? 118 ARG A CA 1 ATOM 871 C C . ARG A 1 118 ? -5.758 -32.612 -17.167 1.00 32.79 ? 118 ARG A C 1 ATOM 872 O O . ARG A 1 118 ? -5.534 -33.638 -16.492 1.00 26.99 ? 118 ARG A O 1 ATOM 873 C CB . ARG A 1 118 ? -6.757 -30.529 -16.254 1.00 30.41 ? 118 ARG A CB 1 ATOM 874 C CG . ARG A 1 118 ? -6.264 -30.782 -14.851 1.00 30.02 ? 118 ARG A CG 1 ATOM 875 C CD . ARG A 1 118 ? -5.957 -29.516 -14.116 1.00 30.02 ? 118 ARG A CD 1 ATOM 876 N NE . ARG A 1 118 ? -7.128 -28.958 -13.449 1.00 34.35 ? 118 ARG A NE 1 ATOM 877 C CZ . ARG A 1 118 ? -7.484 -27.663 -13.481 1.00 34.13 ? 118 ARG A CZ 1 ATOM 878 N NH1 . ARG A 1 118 ? -6.899 -26.768 -14.289 1.00 32.26 ? 118 ARG A NH1 1 ATOM 879 N NH2 . ARG A 1 118 ? -8.501 -27.273 -12.762 1.00 35.08 ? 118 ARG A NH2 1 ATOM 880 N N . GLY A 1 119 ? -4.956 -32.144 -18.128 1.00 26.95 ? 119 GLY A N 1 ATOM 881 C CA . GLY A 1 119 ? -3.685 -32.728 -18.471 1.00 27.42 ? 119 GLY A CA 1 ATOM 882 C C . GLY A 1 119 ? -2.770 -31.668 -19.053 1.00 30.25 ? 119 GLY A C 1 ATOM 883 O O . GLY A 1 119 ? -3.238 -30.771 -19.743 1.00 26.14 ? 119 GLY A O 1 ATOM 884 N N . TYR A 1 120 ? -1.469 -31.753 -18.725 1.00 24.70 ? 120 TYR A N 1 ATOM 885 C CA . TYR A 1 120 ? -0.466 -30.732 -19.078 1.00 23.64 ? 120 TYR A CA 1 ATOM 886 C C . TYR A 1 120 ? -0.700 -29.449 -18.386 1.00 24.43 ? 120 TYR A C 1 ATOM 887 O O . TYR A 1 120 ? -0.127 -28.420 -18.764 1.00 25.70 ? 120 TYR A O 1 ATOM 888 C CB . TYR A 1 120 ? -0.429 -30.441 -20.575 1.00 23.85 ? 120 TYR A CB 1 ATOM 889 C CG . TYR A 1 120 ? 0.118 -31.514 -21.473 1.00 23.76 ? 120 TYR A CG 1 ATOM 890 C CD1 . TYR A 1 120 ? 0.331 -32.829 -21.036 1.00 24.63 ? 120 TYR A CD1 1 ATOM 891 C CD2 . TYR A 1 120 ? 0.476 -31.193 -22.774 1.00 26.78 ? 120 TYR A CD2 1 ATOM 892 C CE1 . TYR A 1 120 ? 0.837 -33.811 -21.881 1.00 26.23 ? 120 TYR A CE1 1 ATOM 893 C CE2 . TYR A 1 120 ? 1.026 -32.122 -23.605 1.00 27.19 ? 120 TYR A CE2 1 ATOM 894 C CZ . TYR A 1 120 ? 1.180 -33.421 -23.147 1.00 28.64 ? 120 TYR A CZ 1 ATOM 895 O OH . TYR A 1 120 ? 1.695 -34.354 -23.969 1.00 27.94 ? 120 TYR A OH 1 ATOM 896 N N . GLN A 1 121 ? -1.443 -29.490 -17.289 1.00 26.94 ? 121 GLN A N 1 ATOM 897 C CA . GLN A 1 121 ? -1.470 -28.346 -16.389 1.00 25.34 ? 121 GLN A CA 1 ATOM 898 C C . GLN A 1 121 ? -0.125 -28.194 -15.647 1.00 27.93 ? 121 GLN A C 1 ATOM 899 O O . GLN A 1 121 ? 0.775 -29.047 -15.741 1.00 23.76 ? 121 GLN A O 1 ATOM 900 C CB . GLN A 1 121 ? -2.611 -28.521 -15.378 1.00 28.30 ? 121 GLN A CB 1 ATOM 901 C CG . GLN A 1 121 ? -2.298 -29.486 -14.220 1.00 27.03 ? 121 GLN A CG 1 ATOM 902 C CD . GLN A 1 121 ? -2.653 -30.922 -14.532 1.00 26.14 ? 121 GLN A CD 1 ATOM 903 O OE1 . GLN A 1 121 ? -2.694 -31.345 -15.687 1.00 25.65 ? 121 GLN A OE1 1 ATOM 904 N NE2 . GLN A 1 121 ? -2.880 -31.706 -13.482 1.00 27.58 ? 121 GLN A NE2 1 ATOM 905 N N . SER A 1 122 ? 0.015 -27.083 -14.939 1.00 27.08 ? 122 SER A N 1 ATOM 906 C CA . SER A 1 122 ? 1.069 -26.917 -13.972 1.00 29.53 ? 122 SER A CA 1 ATOM 907 C C . SER A 1 122 ? 0.452 -26.895 -12.586 1.00 28.43 ? 122 SER A C 1 ATOM 908 O O . SER A 1 122 ? -0.660 -26.416 -12.398 1.00 28.43 ? 122 SER A O 1 ATOM 909 C CB . SER A 1 122 ? 1.841 -25.621 -14.209 1.00 30.33 ? 122 SER A CB 1 ATOM 910 O OG . SER A 1 122 ? 2.500 -25.670 -15.472 1.00 29.46 ? 122 SER A OG 1 ATOM 911 N N . SER A 1 123 ? 1.203 -27.432 -11.642 1.00 25.12 ? 123 SER A N 1 ATOM 912 C CA . SER A 1 123 ? 0.821 -27.612 -10.266 1.00 23.56 ? 123 SER A CA 1 ATOM 913 C C . SER A 1 123 ? 1.926 -27.032 -9.450 1.00 24.70 ? 123 SER A C 1 ATOM 914 O O . SER A 1 123 ? 3.131 -27.199 -9.807 1.00 23.63 ? 123 SER A O 1 ATOM 915 C CB . SER A 1 123 ? 0.713 -29.109 -9.995 1.00 27.87 ? 123 SER A CB 1 ATOM 916 O OG . SER A 1 123 ? 0.469 -29.368 -8.650 1.00 29.48 ? 123 SER A OG 1 ATOM 917 N N . CYS A 1 124 ? 1.565 -26.275 -8.411 1.00 23.02 ? 124 CYS A N 1 ATOM 918 C CA . CYS A 1 124 ? 2.561 -25.803 -7.464 1.00 26.48 ? 124 CYS A CA 1 ATOM 919 C C . CYS A 1 124 ? 2.086 -25.815 -6.011 1.00 30.14 ? 124 CYS A C 1 ATOM 920 O O . CYS A 1 124 ? 0.887 -25.760 -5.727 1.00 30.84 ? 124 CYS A O 1 ATOM 921 C CB . CYS A 1 124 ? 3.096 -24.400 -7.846 1.00 30.31 ? 124 CYS A CB 1 ATOM 922 S SG . CYS A 1 124 ? 1.850 -23.097 -7.765 1.00 31.26 ? 124 CYS A SG 1 ATOM 923 N N . THR A 1 125 ? 3.055 -26.003 -5.127 1.00 26.29 ? 125 THR A N 1 ATOM 924 C CA . THR A 1 125 ? 2.848 -25.980 -3.702 1.00 27.11 ? 125 THR A CA 1 ATOM 925 C C . THR A 1 125 ? 2.975 -24.522 -3.227 1.00 26.79 ? 125 THR A C 1 ATOM 926 O O . THR A 1 125 ? 3.987 -23.861 -3.509 1.00 24.27 ? 125 THR A O 1 ATOM 927 C CB . THR A 1 125 ? 3.896 -26.853 -2.986 1.00 29.77 ? 125 THR A CB 1 ATOM 928 O OG1 . THR A 1 125 ? 3.780 -28.186 -3.468 1.00 29.59 ? 125 THR A OG1 1 ATOM 929 C CG2 . THR A 1 125 ? 3.673 -26.828 -1.467 1.00 30.11 ? 125 THR A CG2 1 ATOM 930 N N . THR A 1 126 ? 1.892 -24.019 -2.619 1.00 28.75 ? 126 THR A N 1 ATOM 931 C CA . THR A 1 126 ? 1.779 -22.610 -2.191 1.00 31.47 ? 126 THR A CA 1 ATOM 932 C C . THR A 1 126 ? 2.378 -22.438 -0.833 1.00 32.08 ? 126 THR A C 1 ATOM 933 O O . THR A 1 126 ? 2.774 -23.437 -0.210 1.00 30.16 ? 126 THR A O 1 ATOM 934 C CB . THR A 1 126 ? 0.312 -22.151 -2.094 1.00 31.46 ? 126 THR A CB 1 ATOM 935 O OG1 . THR A 1 126 ? -0.338 -22.775 -0.966 1.00 34.60 ? 126 THR A OG1 1 ATOM 936 C CG2 . THR A 1 126 ? -0.413 -22.491 -3.374 1.00 32.20 ? 126 THR A CG2 1 ATOM 937 N N . SER A 1 127 ? 2.562 -21.175 -0.424 1.00 31.02 ? 127 SER A N 1 ATOM 938 C CA . SER A 1 127 ? 3.117 -20.836 0.883 1.00 33.43 ? 127 SER A CA 1 ATOM 939 C C . SER A 1 127 ? 2.316 -21.422 2.070 1.00 33.19 ? 127 SER A C 1 ATOM 940 O O . SER A 1 127 ? 2.852 -21.476 3.169 1.00 31.92 ? 127 SER A O 1 ATOM 941 C CB . SER A 1 127 ? 3.195 -19.307 1.076 1.00 34.72 ? 127 SER A CB 1 ATOM 942 O OG . SER A 1 127 ? 1.897 -18.752 1.003 1.00 30.37 ? 127 SER A OG 1 ATOM 943 N N . GLU A 1 128 ? 1.060 -21.815 1.841 1.00 33.63 ? 128 GLU A N 1 ATOM 944 C CA . GLU A 1 128 ? 0.236 -22.505 2.855 1.00 38.07 ? 128 GLU A CA 1 ATOM 945 C C . GLU A 1 128 ? 0.322 -24.027 2.768 1.00 42.66 ? 128 GLU A C 1 ATOM 946 O O . GLU A 1 128 ? -0.458 -24.714 3.427 1.00 36.13 ? 128 GLU A O 1 ATOM 947 C CB . GLU A 1 128 ? -1.245 -22.116 2.708 1.00 40.51 ? 128 GLU A CB 1 ATOM 948 C CG . GLU A 1 128 ? -1.511 -20.625 2.755 1.00 40.50 ? 128 GLU A CG 1 ATOM 949 C CD . GLU A 1 128 ? -2.975 -20.262 2.514 1.00 49.36 ? 128 GLU A CD 1 ATOM 950 O OE1 . GLU A 1 128 ? -3.714 -20.924 1.730 1.00 50.60 ? 128 GLU A OE1 1 ATOM 951 O OE2 . GLU A 1 128 ? -3.417 -19.296 3.157 1.00 61.22 ? 128 GLU A OE2 1 ATOM 952 N N . GLY A 1 129 ? 1.175 -24.561 1.882 1.00 34.86 ? 129 GLY A N 1 ATOM 953 C CA . GLY A 1 129 ? 1.280 -25.995 1.717 1.00 30.52 ? 129 GLY A CA 1 ATOM 954 C C . GLY A 1 129 ? 0.095 -26.538 0.956 1.00 28.74 ? 129 GLY A C 1 ATOM 955 O O . GLY A 1 129 ? -0.055 -27.733 0.820 1.00 31.42 ? 129 GLY A O 1 ATOM 956 N N . LYS A 1 130 ? -0.720 -25.677 0.360 1.00 28.88 ? 130 LYS A N 1 ATOM 957 C CA . LYS A 1 130 ? -1.728 -26.199 -0.561 1.00 31.57 ? 130 LYS A CA 1 ATOM 958 C C . LYS A 1 130 ? -1.145 -26.435 -1.968 1.00 26.14 ? 130 LYS A C 1 ATOM 959 O O . LYS A 1 130 ? -0.075 -25.955 -2.259 1.00 28.07 ? 130 LYS A O 1 ATOM 960 C CB . LYS A 1 130 ? -2.927 -25.246 -0.630 1.00 33.34 ? 130 LYS A CB 1 ATOM 961 C CG . LYS A 1 130 ? -3.711 -25.169 0.682 0.80 38.38 ? 130 LYS A CG 1 ATOM 962 C CD . LYS A 1 130 ? -4.731 -24.037 0.655 0.80 35.75 ? 130 LYS A CD 1 ATOM 963 C CE . LYS A 1 130 ? -5.459 -23.886 1.980 0.70 41.01 ? 130 LYS A CE 1 ATOM 964 N NZ . LYS A 1 130 ? -6.688 -24.731 1.929 0.50 48.79 ? 130 LYS A NZ 1 ATOM 965 N N . ILE A 1 131 ? -1.885 -27.140 -2.819 1.00 28.75 ? 131 ILE A N 1 ATOM 966 C CA . ILE A 1 131 ? -1.472 -27.428 -4.191 1.00 32.93 ? 131 ILE A CA 1 ATOM 967 C C . ILE A 1 131 ? -2.417 -26.727 -5.151 1.00 30.21 ? 131 ILE A C 1 ATOM 968 O O . ILE A 1 131 ? -3.598 -27.047 -5.192 1.00 33.17 ? 131 ILE A O 1 ATOM 969 C CB . ILE A 1 131 ? -1.473 -28.929 -4.525 1.00 30.61 ? 131 ILE A CB 1 ATOM 970 C CG1 . ILE A 1 131 ? -0.738 -29.760 -3.464 1.00 35.02 ? 131 ILE A CG1 1 ATOM 971 C CG2 . ILE A 1 131 ? -0.856 -29.172 -5.892 1.00 33.02 ? 131 ILE A CG2 1 ATOM 972 C CD1 . ILE A 1 131 ? 0.679 -29.356 -3.175 1.00 33.69 ? 131 ILE A CD1 1 ATOM 973 N N . PHE A 1 132 ? -1.877 -25.791 -5.940 1.00 28.25 ? 132 PHE A N 1 ATOM 974 C CA . PHE A 1 132 ? -2.680 -25.009 -6.914 1.00 27.69 ? 132 PHE A CA 1 ATOM 975 C C . PHE A 1 132 ? -2.397 -25.530 -8.282 1.00 26.52 ? 132 PHE A C 1 ATOM 976 O O . PHE A 1 132 ? -1.242 -25.616 -8.657 1.00 26.74 ? 132 PHE A O 1 ATOM 977 C CB . PHE A 1 132 ? -2.279 -23.533 -6.780 1.00 29.58 ? 132 PHE A CB 1 ATOM 978 C CG . PHE A 1 132 ? -2.834 -22.637 -7.823 1.00 33.32 ? 132 PHE A CG 1 ATOM 979 C CD1 . PHE A 1 132 ? -4.153 -22.181 -7.737 1.00 33.09 ? 132 PHE A CD1 1 ATOM 980 C CD2 . PHE A 1 132 ? -1.988 -22.099 -8.810 1.00 32.40 ? 132 PHE A CD2 1 ATOM 981 C CE1 . PHE A 1 132 ? -4.650 -21.315 -8.694 1.00 35.42 ? 132 PHE A CE1 1 ATOM 982 C CE2 . PHE A 1 132 ? -2.485 -21.226 -9.765 1.00 34.53 ? 132 PHE A CE2 1 ATOM 983 C CZ . PHE A 1 132 ? -3.804 -20.819 -9.699 1.00 31.66 ? 132 PHE A CZ 1 ATOM 984 N N . VAL A 1 133 ? -3.432 -25.913 -9.020 1.00 22.15 ? 133 VAL A N 1 ATOM 985 C CA . VAL A 1 133 ? -3.320 -26.189 -10.438 1.00 26.60 ? 133 VAL A CA 1 ATOM 986 C C . VAL A 1 133 ? -4.093 -25.213 -11.329 1.00 28.64 ? 133 VAL A C 1 ATOM 987 O O . VAL A 1 133 ? -5.140 -24.634 -10.922 1.00 26.90 ? 133 VAL A O 1 ATOM 988 C CB . VAL A 1 133 ? -3.717 -27.651 -10.761 1.00 28.75 ? 133 VAL A CB 1 ATOM 989 C CG1 . VAL A 1 133 ? -2.912 -28.600 -9.901 1.00 33.13 ? 133 VAL A CG1 1 ATOM 990 C CG2 . VAL A 1 133 ? -5.165 -27.894 -10.490 1.00 31.00 ? 133 VAL A CG2 1 ATOM 991 N N . ILE A 1 134 ? -3.589 -25.023 -12.549 1.00 27.79 ? 134 ILE A N 1 ATOM 992 C CA . ILE A 1 134 ? -4.305 -24.190 -13.556 1.00 28.84 ? 134 ILE A CA 1 ATOM 993 C C . ILE A 1 134 ? -3.939 -24.604 -14.945 1.00 29.05 ? 134 ILE A C 1 ATOM 994 O O . ILE A 1 134 ? -2.829 -25.080 -15.202 1.00 30.68 ? 134 ILE A O 1 ATOM 995 C CB . ILE A 1 134 ? -4.143 -22.672 -13.276 1.00 30.39 ? 134 ILE A CB 1 ATOM 996 C CG1 . ILE A 1 134 ? -5.236 -21.841 -13.993 1.00 31.25 ? 134 ILE A CG1 1 ATOM 997 C CG2 . ILE A 1 134 ? -2.720 -22.178 -13.605 1.00 30.84 ? 134 ILE A CG2 1 ATOM 998 C CD1 . ILE A 1 134 ? -5.307 -20.410 -13.474 1.00 30.56 ? 134 ILE A CD1 1 ATOM 999 N N . GLY A 1 135 ? -4.935 -24.573 -15.801 1.00 27.88 ? 135 GLY A N 1 ATOM 1000 C CA . GLY A 1 135 ? -4.771 -24.894 -17.164 1.00 26.56 ? 135 GLY A CA 1 ATOM 1001 C C . GLY A 1 135 ? -4.785 -26.362 -17.448 1.00 27.69 ? 135 GLY A C 1 ATOM 1002 O O . GLY A 1 135 ? -5.187 -27.167 -16.620 1.00 31.24 ? 135 GLY A O 1 ATOM 1003 N N . GLY A 1 136 ? -4.305 -26.701 -18.646 1.00 29.78 ? 136 GLY A N 1 ATOM 1004 C CA . GLY A 1 136 ? -4.017 -28.060 -19.039 1.00 29.72 ? 136 GLY A CA 1 ATOM 1005 C C . GLY A 1 136 ? -5.102 -28.765 -19.862 1.00 31.42 ? 136 GLY A C 1 ATOM 1006 O O . GLY A 1 136 ? -5.976 -29.421 -19.316 1.00 30.66 ? 136 GLY A O 1 ATOM 1007 N N . SER A 1 137 ? -4.961 -28.728 -21.180 1.00 27.15 ? 137 SER A N 1 ATOM 1008 C CA . SER A 1 137 ? -5.997 -29.148 -22.079 1.00 30.22 ? 137 SER A CA 1 ATOM 1009 C C . SER A 1 137 ? -5.518 -30.335 -22.894 1.00 29.64 ? 137 SER A C 1 ATOM 1010 O O . SER A 1 137 ? -6.118 -30.698 -23.887 1.00 31.11 ? 137 SER A O 1 ATOM 1011 C CB . SER A 1 137 ? -6.454 -27.963 -22.961 1.00 32.26 ? 137 SER A CB 1 ATOM 1012 O OG . SER A 1 137 ? -5.350 -27.248 -23.496 1.00 33.61 ? 137 SER A OG 1 ATOM 1013 N N . PHE A 1 138 ? -4.467 -31.016 -22.446 1.00 27.76 ? 138 PHE A N 1 ATOM 1014 C CA . PHE A 1 138 ? -4.154 -32.313 -23.071 1.00 27.74 ? 138 PHE A CA 1 ATOM 1015 C C . PHE A 1 138 ? -5.285 -33.341 -22.939 1.00 28.92 ? 138 PHE A C 1 ATOM 1016 O O . PHE A 1 138 ? -5.490 -34.203 -23.817 1.00 30.38 ? 138 PHE A O 1 ATOM 1017 C CB . PHE A 1 138 ? -2.931 -32.896 -22.404 1.00 31.37 ? 138 PHE A CB 1 ATOM 1018 C CG . PHE A 1 138 ? -2.662 -34.319 -22.768 1.00 28.10 ? 138 PHE A CG 1 ATOM 1019 C CD1 . PHE A 1 138 ? -2.071 -34.624 -23.970 1.00 25.86 ? 138 PHE A CD1 1 ATOM 1020 C CD2 . PHE A 1 138 ? -2.946 -35.348 -21.853 1.00 30.72 ? 138 PHE A CD2 1 ATOM 1021 C CE1 . PHE A 1 138 ? -1.785 -35.949 -24.301 1.00 30.16 ? 138 PHE A CE1 1 ATOM 1022 C CE2 . PHE A 1 138 ? -2.724 -36.664 -22.196 1.00 29.92 ? 138 PHE A CE2 1 ATOM 1023 C CZ . PHE A 1 138 ? -2.145 -36.967 -23.433 1.00 28.36 ? 138 PHE A CZ 1 ATOM 1024 N N . SER A 1 139 ? -5.914 -33.326 -21.774 1.00 31.89 ? 139 SER A N 1 ATOM 1025 C CA . SER A 1 139 ? -7.053 -34.187 -21.497 1.00 35.13 ? 139 SER A CA 1 ATOM 1026 C C . SER A 1 139 ? -8.076 -33.403 -20.711 1.00 31.21 ? 139 SER A C 1 ATOM 1027 O O . SER A 1 139 ? -7.841 -32.232 -20.367 1.00 33.48 ? 139 SER A O 1 ATOM 1028 C CB . SER A 1 139 ? -6.561 -35.387 -20.696 1.00 38.62 ? 139 SER A CB 1 ATOM 1029 O OG . SER A 1 139 ? -5.937 -34.925 -19.502 1.00 31.90 ? 139 SER A OG 1 ATOM 1030 N N . GLY A 1 140 ? -9.179 -34.061 -20.373 1.00 35.55 ? 140 GLY A N 1 ATOM 1031 C CA . GLY A 1 140 ? -10.199 -33.496 -19.490 1.00 36.92 ? 140 GLY A CA 1 ATOM 1032 C C . GLY A 1 140 ? -11.232 -32.753 -20.300 1.00 37.53 ? 140 GLY A C 1 ATOM 1033 O O . GLY A 1 140 ? -11.286 -32.938 -21.498 1.00 38.11 ? 140 GLY A O 1 ATOM 1034 N N . ALA A 1 141 ? -11.956 -31.827 -19.662 1.00 42.55 ? 141 ALA A N 1 ATOM 1035 C CA . ALA A 1 141 ? -13.064 -31.106 -20.298 1.00 43.04 ? 141 ALA A CA 1 ATOM 1036 C C . ALA A 1 141 ? -13.414 -29.846 -19.514 1.00 47.73 ? 141 ALA A C 1 ATOM 1037 O O . ALA A 1 141 ? -13.115 -29.744 -18.324 1.00 48.59 ? 141 ALA A O 1 ATOM 1038 C CB . ALA A 1 141 ? -14.293 -32.008 -20.406 1.00 40.61 ? 141 ALA A CB 1 ATOM 1039 N N . GLY A 1 142 ? -14.025 -28.884 -20.201 1.00 48.21 ? 142 GLY A N 1 ATOM 1040 C CA . GLY A 1 142 ? -14.357 -27.593 -19.605 1.00 40.64 ? 142 GLY A CA 1 ATOM 1041 C C . GLY A 1 142 ? -13.182 -26.648 -19.613 1.00 47.69 ? 142 GLY A C 1 ATOM 1042 O O . GLY A 1 142 ? -12.024 -27.072 -19.627 1.00 50.15 ? 142 GLY A O 1 ATOM 1043 N N . THR A 1 143 ? -13.471 -25.351 -19.590 1.00 42.87 ? 143 THR A N 1 ATOM 1044 C CA . THR A 1 143 ? -12.445 -24.345 -19.338 1.00 45.09 ? 143 THR A CA 1 ATOM 1045 C C . THR A 1 143 ? -11.583 -24.745 -18.132 1.00 40.93 ? 143 THR A C 1 ATOM 1046 O O . THR A 1 143 ? -12.086 -24.914 -17.026 1.00 31.64 ? 143 THR A O 1 ATOM 1047 C CB . THR A 1 143 ? -13.088 -22.964 -19.123 1.00 40.52 ? 143 THR A CB 1 ATOM 1048 O OG1 . THR A 1 143 ? -13.951 -22.707 -20.223 1.00 40.65 ? 143 THR A OG1 1 ATOM 1049 C CG2 . THR A 1 143 ? -12.065 -21.900 -19.069 1.00 41.61 ? 143 THR A CG2 1 ATOM 1050 N N . ARG A 1 144 ? -10.272 -24.845 -18.349 1.00 40.96 ? 144 ARG A N 1 ATOM 1051 C CA . ARG A 1 144 ? -9.357 -25.364 -17.329 1.00 30.03 ? 144 ARG A CA 1 ATOM 1052 C C . ARG A 1 144 ? -8.944 -24.294 -16.347 1.00 34.30 ? 144 ARG A C 1 ATOM 1053 O O . ARG A 1 144 ? -7.732 -23.989 -16.139 1.00 31.04 ? 144 ARG A O 1 ATOM 1054 C CB . ARG A 1 144 ? -8.130 -26.029 -17.983 1.00 32.68 ? 144 ARG A CB 1 ATOM 1055 C CG . ARG A 1 144 ? -8.439 -26.964 -19.161 1.00 29.65 ? 144 ARG A CG 1 ATOM 1056 C CD . ARG A 1 144 ? -9.150 -28.234 -18.701 1.00 31.59 ? 144 ARG A CD 1 ATOM 1057 N NE . ARG A 1 144 ? -8.973 -29.306 -19.682 1.00 32.38 ? 144 ARG A NE 1 ATOM 1058 C CZ . ARG A 1 144 ? -9.619 -29.397 -20.853 1.00 36.11 ? 144 ARG A CZ 1 ATOM 1059 N NH1 . ARG A 1 144 ? -10.574 -28.531 -21.182 1.00 32.47 ? 144 ARG A NH1 1 ATOM 1060 N NH2 . ARG A 1 144 ? -9.290 -30.349 -21.712 1.00 33.09 ? 144 ARG A NH2 1 ATOM 1061 N N . ASN A 1 145 ? -9.938 -23.804 -15.617 1.00 33.37 ? 145 ASN A N 1 ATOM 1062 C CA . ASN A 1 145 ? -9.712 -22.803 -14.599 1.00 32.18 ? 145 ASN A CA 1 ATOM 1063 C C . ASN A 1 145 ? -8.955 -23.323 -13.348 1.00 32.90 ? 145 ASN A C 1 ATOM 1064 O O . ASN A 1 145 ? -8.740 -24.506 -13.191 1.00 35.73 ? 145 ASN A O 1 ATOM 1065 C CB . ASN A 1 145 ? -11.056 -22.121 -14.227 1.00 35.30 ? 145 ASN A CB 1 ATOM 1066 C CG . ASN A 1 145 ? -11.588 -21.239 -15.367 1.00 43.47 ? 145 ASN A CG 1 ATOM 1067 O OD1 . ASN A 1 145 ? -10.851 -20.423 -15.964 1.00 40.05 ? 145 ASN A OD1 1 ATOM 1068 N ND2 . ASN A 1 145 ? -12.843 -21.458 -15.732 1.00 42.33 ? 145 ASN A ND2 1 ATOM 1069 N N . GLY A 1 146 ? -8.596 -22.411 -12.466 1.00 30.43 ? 146 GLY A N 1 ATOM 1070 C CA . GLY A 1 146 ? -7.754 -22.691 -11.308 1.00 36.57 ? 146 GLY A CA 1 ATOM 1071 C C . GLY A 1 146 ? -8.522 -23.331 -10.154 1.00 40.85 ? 146 GLY A C 1 ATOM 1072 O O . GLY A 1 146 ? -9.674 -22.974 -9.886 1.00 33.68 ? 146 GLY A O 1 ATOM 1073 N N . GLU A 1 147 ? -7.867 -24.281 -9.492 1.00 33.64 ? 147 GLU A N 1 ATOM 1074 C CA . GLU A 1 147 ? -8.335 -24.928 -8.245 1.00 32.68 ? 147 GLU A CA 1 ATOM 1075 C C . GLU A 1 147 ? -7.189 -25.287 -7.294 1.00 37.86 ? 147 GLU A C 1 ATOM 1076 O O . GLU A 1 147 ? -5.990 -25.275 -7.682 1.00 31.49 ? 147 GLU A O 1 ATOM 1077 C CB . GLU A 1 147 ? -9.165 -26.182 -8.544 1.00 36.32 ? 147 GLU A CB 1 ATOM 1078 C CG . GLU A 1 147 ? -8.458 -27.309 -9.262 1.00 33.43 ? 147 GLU A CG 1 ATOM 1079 C CD . GLU A 1 147 ? -9.367 -28.467 -9.533 1.00 31.98 ? 147 GLU A CD 1 ATOM 1080 O OE1 . GLU A 1 147 ? -9.584 -28.802 -10.730 1.00 35.02 ? 147 GLU A OE1 1 ATOM 1081 O OE2 . GLU A 1 147 ? -9.910 -29.011 -8.548 1.00 33.62 ? 147 GLU A OE2 1 ATOM 1082 N N . VAL A 1 148 ? -7.546 -25.488 -6.022 1.00 32.31 ? 148 VAL A N 1 ATOM 1083 C CA . VAL A 1 148 ? -6.563 -25.589 -4.952 1.00 30.03 ? 148 VAL A CA 1 ATOM 1084 C C . VAL A 1 148 ? -6.863 -26.814 -4.061 1.00 34.91 ? 148 VAL A C 1 ATOM 1085 O O . VAL A 1 148 ? -8.025 -27.168 -3.866 1.00 36.25 ? 148 VAL A O 1 ATOM 1086 C CB . VAL A 1 148 ? -6.467 -24.268 -4.161 1.00 35.12 ? 148 VAL A CB 1 ATOM 1087 C CG1 . VAL A 1 148 ? -7.750 -23.994 -3.361 1.00 38.60 ? 148 VAL A CG1 1 ATOM 1088 C CG2 . VAL A 1 148 ? -5.270 -24.293 -3.250 1.00 32.11 ? 148 VAL A CG2 1 ATOM 1089 N N . TYR A 1 149 ? -5.809 -27.558 -3.707 1.00 38.41 ? 149 TYR A N 1 ATOM 1090 C CA . TYR A 1 149 ? -5.919 -28.808 -2.953 1.00 35.81 ? 149 TYR A CA 1 ATOM 1091 C C . TYR A 1 149 ? -5.454 -28.537 -1.554 1.00 34.54 ? 149 TYR A C 1 ATOM 1092 O O . TYR A 1 149 ? -4.330 -28.033 -1.317 1.00 34.65 ? 149 TYR A O 1 ATOM 1093 C CB . TYR A 1 149 ? -5.102 -29.964 -3.576 1.00 34.70 ? 149 TYR A CB 1 ATOM 1094 C CG . TYR A 1 149 ? -5.204 -31.294 -2.833 1.00 32.29 ? 149 TYR A CG 1 ATOM 1095 C CD1 . TYR A 1 149 ? -6.375 -32.042 -2.840 1.00 37.88 ? 149 TYR A CD1 1 ATOM 1096 C CD2 . TYR A 1 149 ? -4.131 -31.796 -2.104 1.00 34.23 ? 149 TYR A CD2 1 ATOM 1097 C CE1 . TYR A 1 149 ? -6.475 -33.244 -2.119 1.00 37.09 ? 149 TYR A CE1 1 ATOM 1098 C CE2 . TYR A 1 149 ? -4.222 -33.014 -1.403 1.00 33.20 ? 149 TYR A CE2 1 ATOM 1099 C CZ . TYR A 1 149 ? -5.398 -33.730 -1.394 1.00 31.99 ? 149 TYR A CZ 1 ATOM 1100 O OH . TYR A 1 149 ? -5.482 -34.926 -0.664 1.00 26.72 ? 149 TYR A OH 1 ATOM 1101 N N . ASP A 1 150 ? -6.357 -28.851 -0.626 1.00 41.16 ? 150 ASP A N 1 ATOM 1102 C CA . ASP A 1 150 ? -6.082 -28.821 0.805 1.00 44.17 ? 150 ASP A CA 1 ATOM 1103 C C . ASP A 1 150 ? -5.754 -30.249 1.241 1.00 38.41 ? 150 ASP A C 1 ATOM 1104 O O . ASP A 1 150 ? -6.634 -31.112 1.237 1.00 41.22 ? 150 ASP A O 1 ATOM 1105 C CB . ASP A 1 150 ? -7.306 -28.326 1.597 1.00 51.75 ? 150 ASP A CB 1 ATOM 1106 C CG . ASP A 1 150 ? -6.962 -28.012 3.051 1.00 53.23 ? 150 ASP A CG 1 ATOM 1107 O OD1 . ASP A 1 150 ? -6.008 -28.623 3.581 1.00 48.51 ? 150 ASP A OD1 1 ATOM 1108 O OD2 . ASP A 1 150 ? -7.573 -27.082 3.625 1.00 53.63 ? 150 ASP A OD2 1 ATOM 1109 N N . PRO A 1 151 ? -4.485 -30.512 1.574 1.00 38.28 ? 151 PRO A N 1 ATOM 1110 C CA . PRO A 1 151 ? -4.084 -31.898 1.864 1.00 39.97 ? 151 PRO A CA 1 ATOM 1111 C C . PRO A 1 151 ? -4.474 -32.372 3.280 1.00 44.30 ? 151 PRO A C 1 ATOM 1112 O O . PRO A 1 151 ? -4.536 -33.582 3.490 1.00 44.61 ? 151 PRO A O 1 ATOM 1113 C CB . PRO A 1 151 ? -2.557 -31.867 1.690 1.00 38.48 ? 151 PRO A CB 1 ATOM 1114 C CG . PRO A 1 151 ? -2.167 -30.465 1.984 1.00 40.84 ? 151 PRO A CG 1 ATOM 1115 C CD . PRO A 1 151 ? -3.343 -29.581 1.617 1.00 36.80 ? 151 PRO A CD 1 ATOM 1116 N N . LYS A 1 152 ? -4.742 -31.445 4.215 1.00 43.23 ? 152 LYS A N 1 ATOM 1117 C CA . LYS A 1 152 ? -5.401 -31.781 5.502 1.00 45.77 ? 152 LYS A CA 1 ATOM 1118 C C . LYS A 1 152 ? -6.851 -32.221 5.271 1.00 42.09 ? 152 LYS A C 1 ATOM 1119 O O . LYS A 1 152 ? -7.249 -33.301 5.656 1.00 50.27 ? 152 LYS A O 1 ATOM 1120 C CB . LYS A 1 152 ? -5.362 -30.592 6.476 1.00 45.27 ? 152 LYS A CB 1 ATOM 1121 C CG . LYS A 1 152 ? -4.049 -30.457 7.244 0.50 45.30 ? 152 LYS A CG 1 ATOM 1122 C CD . LYS A 1 152 ? -3.689 -28.998 7.495 0.50 44.39 ? 152 LYS A CD 1 ATOM 1123 C CE . LYS A 1 152 ? -2.470 -28.883 8.389 0.50 44.60 ? 152 LYS A CE 1 ATOM 1124 N NZ . LYS A 1 152 ? -1.820 -27.555 8.246 0.50 47.35 ? 152 LYS A NZ 1 ATOM 1125 N N . ALA A 1 153 ? -7.629 -31.409 4.582 1.00 40.01 ? 153 ALA A N 1 ATOM 1126 C CA . ALA A 1 153 ? -9.012 -31.782 4.254 1.00 36.76 ? 153 ALA A CA 1 ATOM 1127 C C . ALA A 1 153 ? -9.142 -32.855 3.185 1.00 40.07 ? 153 ALA A C 1 ATOM 1128 O O . ALA A 1 153 ? -10.222 -33.395 3.002 1.00 47.22 ? 153 ALA A O 1 ATOM 1129 C CB . ALA A 1 153 ? -9.791 -30.548 3.814 1.00 40.56 ? 153 ALA A CB 1 ATOM 1130 N N . ASN A 1 154 ? -8.119 -33.058 2.356 1.00 37.00 ? 154 ASN A N 1 ATOM 1131 C CA . ASN A 1 154 ? -8.277 -33.868 1.153 1.00 32.08 ? 154 ASN A CA 1 ATOM 1132 C C . ASN A 1 154 ? -9.473 -33.405 0.313 1.00 32.55 ? 154 ASN A C 1 ATOM 1133 O O . ASN A 1 154 ? -10.263 -34.189 -0.144 1.00 36.77 ? 154 ASN A O 1 ATOM 1134 C CB . ASN A 1 154 ? -8.358 -35.357 1.486 1.00 39.57 ? 154 ASN A CB 1 ATOM 1135 C CG . ASN A 1 154 ? -8.391 -36.242 0.249 1.00 41.80 ? 154 ASN A CG 1 ATOM 1136 O OD1 . ASN A 1 154 ? -7.771 -35.966 -0.787 1.00 41.46 ? 154 ASN A OD1 1 ATOM 1137 N ND2 . ASN A 1 154 ? -9.164 -37.287 0.337 1.00 37.39 ? 154 ASN A ND2 1 ATOM 1138 N N . THR A 1 155 ? -9.519 -32.116 0.026 1.00 35.64 ? 155 THR A N 1 ATOM 1139 C CA . THR A 1 155 ? -10.499 -31.572 -0.907 1.00 41.71 ? 155 THR A CA 1 ATOM 1140 C C . THR A 1 155 ? -9.839 -30.680 -1.971 1.00 33.60 ? 155 THR A C 1 ATOM 1141 O O . THR A 1 155 ? -8.841 -30.025 -1.711 1.00 37.03 ? 155 THR A O 1 ATOM 1142 C CB . THR A 1 155 ? -11.469 -30.651 -0.149 1.00 45.91 ? 155 THR A CB 1 ATOM 1143 O OG1 . THR A 1 155 ? -10.727 -29.544 0.365 1.00 39.62 ? 155 THR A OG1 1 ATOM 1144 C CG2 . THR A 1 155 ? -12.126 -31.393 1.041 1.00 41.88 ? 155 THR A CG2 1 ATOM 1145 N N . TRP A 1 156 ? -10.459 -30.665 -3.136 1.00 34.21 ? 156 TRP A N 1 ATOM 1146 C CA . TRP A 1 156 ? -10.236 -29.698 -4.202 1.00 35.89 ? 156 TRP A CA 1 ATOM 1147 C C . TRP A 1 156 ? -11.389 -28.686 -4.304 1.00 37.95 ? 156 TRP A C 1 ATOM 1148 O O . TRP A 1 156 ? -12.544 -29.076 -4.423 1.00 39.23 ? 156 TRP A O 1 ATOM 1149 C CB . TRP A 1 156 ? -10.147 -30.434 -5.543 1.00 36.88 ? 156 TRP A CB 1 ATOM 1150 C CG . TRP A 1 156 ? -8.882 -31.234 -5.738 1.00 37.90 ? 156 TRP A CG 1 ATOM 1151 C CD1 . TRP A 1 156 ? -8.735 -32.588 -5.617 1.00 36.89 ? 156 TRP A CD1 1 ATOM 1152 C CD2 . TRP A 1 156 ? -7.617 -30.733 -6.183 1.00 39.00 ? 156 TRP A CD2 1 ATOM 1153 N NE1 . TRP A 1 156 ? -7.470 -32.949 -5.930 1.00 39.72 ? 156 TRP A NE1 1 ATOM 1154 C CE2 . TRP A 1 156 ? -6.753 -31.837 -6.290 1.00 37.60 ? 156 TRP A CE2 1 ATOM 1155 C CE3 . TRP A 1 156 ? -7.162 -29.475 -6.591 1.00 34.87 ? 156 TRP A CE3 1 ATOM 1156 C CZ2 . TRP A 1 156 ? -5.421 -31.715 -6.740 1.00 35.76 ? 156 TRP A CZ2 1 ATOM 1157 C CZ3 . TRP A 1 156 ? -5.823 -29.335 -6.941 1.00 40.08 ? 156 TRP A CZ3 1 ATOM 1158 C CH2 . TRP A 1 156 ? -4.967 -30.459 -7.008 1.00 38.66 ? 156 TRP A CH2 1 ATOM 1159 N N . THR A 1 157 ? -11.048 -27.411 -4.418 1.00 39.05 ? 157 THR A N 1 ATOM 1160 C CA . THR A 1 157 ? -11.999 -26.333 -4.542 1.00 39.24 ? 157 THR A CA 1 ATOM 1161 C C . THR A 1 157 ? -11.688 -25.444 -5.738 1.00 40.04 ? 157 THR A C 1 ATOM 1162 O O . THR A 1 157 ? -10.579 -24.917 -5.827 1.00 38.79 ? 157 THR A O 1 ATOM 1163 C CB . THR A 1 157 ? -11.903 -25.477 -3.264 1.00 45.80 ? 157 THR A CB 1 ATOM 1164 O OG1 . THR A 1 157 ? -12.006 -26.347 -2.141 1.00 39.07 ? 157 THR A OG1 1 ATOM 1165 C CG2 . THR A 1 157 ? -12.994 -24.444 -3.211 1.00 48.54 ? 157 THR A CG2 1 ATOM 1166 N N . LYS A 1 158 ? -12.673 -25.239 -6.623 1.00 36.41 ? 158 LYS A N 1 ATOM 1167 C CA . LYS A 1 158 ? -12.582 -24.225 -7.676 1.00 37.42 ? 158 LYS A CA 1 ATOM 1168 C C . LYS A 1 158 ? -12.358 -22.855 -7.096 1.00 40.74 ? 158 LYS A C 1 ATOM 1169 O O . LYS A 1 158 ? -12.828 -22.579 -6.020 1.00 39.96 ? 158 LYS A O 1 ATOM 1170 C CB . LYS A 1 158 ? -13.843 -24.228 -8.505 1.00 39.50 ? 158 LYS A CB 1 ATOM 1171 C CG . LYS A 1 158 ? -14.015 -25.494 -9.318 1.00 37.25 ? 158 LYS A CG 1 ATOM 1172 C CD . LYS A 1 158 ? -15.251 -25.402 -10.220 1.00 47.39 ? 158 LYS A CD 1 ATOM 1173 C CE . LYS A 1 158 ? -15.690 -26.797 -10.662 1.00 55.52 ? 158 LYS A CE 1 ATOM 1174 N NZ . LYS A 1 158 ? -16.691 -26.763 -11.761 1.00 62.41 ? 158 LYS A NZ 1 ATOM 1175 N N . LEU A 1 159 ? -11.551 -22.032 -7.754 1.00 42.35 ? 159 LEU A N 1 ATOM 1176 C CA . LEU A 1 159 ? -11.364 -20.638 -7.351 1.00 39.91 ? 159 LEU A CA 1 ATOM 1177 C C . LEU A 1 159 ? -11.879 -19.715 -8.449 1.00 44.63 ? 159 LEU A C 1 ATOM 1178 O O . LEU A 1 159 ? -11.190 -19.457 -9.437 1.00 45.36 ? 159 LEU A O 1 ATOM 1179 C CB . LEU A 1 159 ? -9.898 -20.357 -7.100 1.00 44.63 ? 159 LEU A CB 1 ATOM 1180 C CG . LEU A 1 159 ? -9.267 -21.008 -5.874 1.00 44.47 ? 159 LEU A CG 1 ATOM 1181 C CD1 . LEU A 1 159 ? -7.755 -20.958 -5.982 1.00 44.96 ? 159 LEU A CD1 1 ATOM 1182 C CD2 . LEU A 1 159 ? -9.697 -20.296 -4.612 1.00 52.02 ? 159 LEU A CD2 1 ATOM 1183 N N . ALA A 1 160 ? -13.119 -19.268 -8.304 1.00 42.70 ? 160 ALA A N 1 ATOM 1184 C CA . ALA A 1 160 ? -13.771 -18.395 -9.284 1.00 41.80 ? 160 ALA A CA 1 ATOM 1185 C C . ALA A 1 160 ? -12.882 -17.210 -9.660 1.00 36.09 ? 160 ALA A C 1 ATOM 1186 O O . ALA A 1 160 ? -12.896 -16.782 -10.805 1.00 47.50 ? 160 ALA A O 1 ATOM 1187 C CB . ALA A 1 160 ? -15.113 -17.889 -8.731 1.00 40.52 ? 160 ALA A CB 1 ATOM 1188 N N . GLY A 1 161 ? -12.120 -16.686 -8.702 1.00 32.85 ? 161 GLY A N 1 ATOM 1189 C CA . GLY A 1 161 ? -11.182 -15.587 -8.945 1.00 41.61 ? 161 GLY A CA 1 ATOM 1190 C C . GLY A 1 161 ? -9.859 -15.887 -9.693 1.00 45.22 ? 161 GLY A C 1 ATOM 1191 O O . GLY A 1 161 ? -9.012 -15.005 -9.829 1.00 39.30 ? 161 GLY A O 1 ATOM 1192 N N . CYS A 1 162 ? -9.700 -17.117 -10.185 1.00 41.50 ? 162 CYS A N 1 ATOM 1193 C CA . CYS A 1 162 ? -8.420 -17.609 -10.742 1.00 40.60 ? 162 CYS A CA 1 ATOM 1194 C C . CYS A 1 162 ? -8.759 -18.248 -12.063 1.00 35.16 ? 162 CYS A C 1 ATOM 1195 O O . CYS A 1 162 ? -8.637 -19.458 -12.227 1.00 33.33 ? 162 CYS A O 1 ATOM 1196 C CB . CYS A 1 162 ? -7.751 -18.629 -9.790 1.00 38.00 ? 162 CYS A CB 1 ATOM 1197 S SG . CYS A 1 162 ? -7.110 -17.923 -8.253 1.00 37.57 ? 162 CYS A SG 1 ATOM 1198 N N . PRO A 1 163 ? -9.340 -17.453 -12.976 1.00 36.78 ? 163 PRO A N 1 ATOM 1199 C CA . PRO A 1 163 ? -9.587 -17.974 -14.302 1.00 36.98 ? 163 PRO A CA 1 ATOM 1200 C C . PRO A 1 163 ? -8.280 -18.215 -15.098 1.00 32.79 ? 163 PRO A C 1 ATOM 1201 O O . PRO A 1 163 ? -7.264 -17.559 -14.856 1.00 32.37 ? 163 PRO A O 1 ATOM 1202 C CB . PRO A 1 163 ? -10.435 -16.887 -14.948 1.00 34.99 ? 163 PRO A CB 1 ATOM 1203 C CG . PRO A 1 163 ? -9.944 -15.650 -14.341 1.00 35.81 ? 163 PRO A CG 1 ATOM 1204 C CD . PRO A 1 163 ? -9.568 -15.993 -12.917 1.00 39.41 ? 163 PRO A CD 1 ATOM 1205 N N . VAL A 1 164 ? -8.348 -19.153 -16.032 1.00 33.34 ? 164 VAL A N 1 ATOM 1206 C CA . VAL A 1 164 ? -7.217 -19.442 -16.918 1.00 36.32 ? 164 VAL A CA 1 ATOM 1207 C C . VAL A 1 164 ? -7.021 -18.357 -17.999 1.00 34.12 ? 164 VAL A C 1 ATOM 1208 O O . VAL A 1 164 ? -5.889 -18.043 -18.395 1.00 28.02 ? 164 VAL A O 1 ATOM 1209 C CB . VAL A 1 164 ? -7.357 -20.854 -17.532 1.00 37.49 ? 164 VAL A CB 1 ATOM 1210 C CG1 . VAL A 1 164 ? -8.421 -20.916 -18.611 1.00 39.76 ? 164 VAL A CG1 1 ATOM 1211 C CG2 . VAL A 1 164 ? -6.019 -21.341 -18.083 1.00 39.95 ? 164 VAL A CG2 1 ATOM 1212 N N . LYS A 1 165 ? -8.112 -17.707 -18.382 1.00 33.57 ? 165 LYS A N 1 ATOM 1213 C CA . LYS A 1 165 ? -8.142 -16.798 -19.531 1.00 33.26 ? 165 LYS A CA 1 ATOM 1214 C C . LYS A 1 165 ? -6.922 -15.878 -19.628 1.00 28.37 ? 165 LYS A C 1 ATOM 1215 O O . LYS A 1 165 ? -6.300 -15.789 -20.659 1.00 28.90 ? 165 LYS A O 1 ATOM 1216 C CB . LYS A 1 165 ? -9.442 -15.955 -19.544 0.90 33.66 ? 165 LYS A CB 1 ATOM 1217 C CG . LYS A 1 165 ? -9.679 -15.255 -20.863 0.75 37.04 ? 165 LYS A CG 1 ATOM 1218 C CD . LYS A 1 165 ? -11.167 -15.047 -21.131 0.70 40.66 ? 165 LYS A CD 1 ATOM 1219 C CE . LYS A 1 165 ? -11.634 -13.735 -20.543 0.65 39.75 ? 165 LYS A CE 1 ATOM 1220 N NZ . LYS A 1 165 ? -11.039 -12.585 -21.265 0.60 41.14 ? 165 LYS A NZ 1 ATOM 1221 N N . PRO A 1 166 ? -6.597 -15.152 -18.578 1.00 30.62 ? 166 PRO A N 1 ATOM 1222 C CA . PRO A 1 166 ? -5.512 -14.201 -18.822 1.00 31.72 ? 166 PRO A CA 1 ATOM 1223 C C . PRO A 1 166 ? -4.133 -14.818 -19.102 1.00 31.41 ? 166 PRO A C 1 ATOM 1224 O O . PRO A 1 166 ? -3.255 -14.106 -19.583 1.00 24.75 ? 166 PRO A O 1 ATOM 1225 C CB . PRO A 1 166 ? -5.453 -13.399 -17.535 1.00 31.25 ? 166 PRO A CB 1 ATOM 1226 C CG . PRO A 1 166 ? -6.139 -14.218 -16.534 1.00 33.77 ? 166 PRO A CG 1 ATOM 1227 C CD . PRO A 1 166 ? -7.191 -14.986 -17.251 1.00 35.43 ? 166 PRO A CD 1 ATOM 1228 N N . LEU A 1 167 ? -3.945 -16.120 -18.855 1.00 32.06 ? 167 LEU A N 1 ATOM 1229 C CA . LEU A 1 167 ? -2.640 -16.734 -19.160 1.00 29.21 ? 167 LEU A CA 1 ATOM 1230 C C . LEU A 1 167 ? -2.565 -17.403 -20.535 1.00 29.80 ? 167 LEU A C 1 ATOM 1231 O O . LEU A 1 167 ? -1.472 -17.674 -21.026 1.00 28.04 ? 167 LEU A O 1 ATOM 1232 C CB . LEU A 1 167 ? -2.214 -17.705 -18.041 1.00 28.38 ? 167 LEU A CB 1 ATOM 1233 C CG . LEU A 1 167 ? -2.915 -19.024 -17.882 1.00 26.32 ? 167 LEU A CG 1 ATOM 1234 C CD1 . LEU A 1 167 ? -2.603 -20.060 -18.974 1.00 30.36 ? 167 LEU A CD1 1 ATOM 1235 C CD2 . LEU A 1 167 ? -2.574 -19.525 -16.472 1.00 33.12 ? 167 LEU A CD2 1 ATOM 1236 N N . VAL A 1 168 ? -3.715 -17.620 -21.180 1.00 26.78 ? 168 VAL A N 1 ATOM 1237 C CA . VAL A 1 168 ? -3.749 -18.382 -22.396 1.00 27.75 ? 168 VAL A CA 1 ATOM 1238 C C . VAL A 1 168 ? -2.915 -17.711 -23.461 1.00 28.64 ? 168 VAL A C 1 ATOM 1239 O O . VAL A 1 168 ? -3.035 -16.508 -23.641 1.00 30.09 ? 168 VAL A O 1 ATOM 1240 C CB . VAL A 1 168 ? -5.196 -18.539 -22.851 1.00 31.69 ? 168 VAL A CB 1 ATOM 1241 C CG1 . VAL A 1 168 ? -5.275 -19.213 -24.188 1.00 35.47 ? 168 VAL A CG1 1 ATOM 1242 C CG2 . VAL A 1 168 ? -5.975 -19.334 -21.818 1.00 35.44 ? 168 VAL A CG2 1 ATOM 1243 N N . MET A 1 169 ? -2.066 -18.452 -24.177 1.00 27.68 ? 169 MET A N 1 ATOM 1244 C CA . MET A 1 169 ? -1.335 -17.816 -25.265 1.00 29.05 ? 169 MET A CA 1 ATOM 1245 C C . MET A 1 169 ? -2.181 -17.675 -26.578 1.00 29.76 ? 169 MET A C 1 ATOM 1246 O O . MET A 1 169 ? -3.235 -18.290 -26.747 1.00 30.26 ? 169 MET A O 1 ATOM 1247 C CB . MET A 1 169 ? -0.009 -18.512 -25.642 1.00 32.70 ? 169 MET A CB 1 ATOM 1248 C CG . MET A 1 169 ? 0.637 -19.513 -24.729 1.00 35.56 ? 169 MET A CG 1 ATOM 1249 S SD . MET A 1 169 ? 2.372 -19.714 -25.190 1.00 28.40 ? 169 MET A SD 1 ATOM 1250 C CE . MET A 1 169 ? 2.313 -20.088 -26.915 1.00 30.19 ? 169 MET A CE 1 ATOM 1251 N N . GLN A 1 170 ? -1.635 -16.953 -27.543 1.00 30.80 ? 170 GLN A N 1 ATOM 1252 C CA . GLN A 1 170 ? -2.360 -16.679 -28.771 1.00 36.10 ? 170 GLN A CA 1 ATOM 1253 C C . GLN A 1 170 ? -2.432 -17.830 -29.764 1.00 36.43 ? 170 GLN A C 1 ATOM 1254 O O . GLN A 1 170 ? -3.453 -18.009 -30.364 1.00 41.36 ? 170 GLN A O 1 ATOM 1255 C CB . GLN A 1 170 ? -1.734 -15.511 -29.499 1.00 38.64 ? 170 GLN A CB 1 ATOM 1256 C CG . GLN A 1 170 ? -2.613 -15.052 -30.665 0.90 38.67 ? 170 GLN A CG 1 ATOM 1257 C CD . GLN A 1 170 ? -2.136 -13.728 -31.223 0.70 42.64 ? 170 GLN A CD 1 ATOM 1258 O OE1 . GLN A 1 170 ? -0.924 -13.453 -31.283 0.74 41.26 ? 170 GLN A OE1 1 ATOM 1259 N NE2 . GLN A 1 170 ? -3.086 -12.874 -31.583 0.70 44.79 ? 170 GLN A NE2 1 ATOM 1260 N N . ARG A 1 171 ? -1.332 -18.551 -29.967 1.00 28.19 ? 171 ARG A N 1 ATOM 1261 C CA . ARG A 1 171 ? -1.192 -19.558 -31.019 1.00 29.93 ? 171 ARG A CA 1 ATOM 1262 C C . ARG A 1 171 ? -0.918 -20.976 -30.436 1.00 33.90 ? 171 ARG A C 1 ATOM 1263 O O . ARG A 1 171 ? -0.347 -21.150 -29.319 1.00 28.87 ? 171 ARG A O 1 ATOM 1264 C CB . ARG A 1 171 ? 0.023 -19.244 -31.901 1.00 30.40 ? 171 ARG A CB 1 ATOM 1265 C CG . ARG A 1 171 ? 0.005 -17.864 -32.524 1.00 33.80 ? 171 ARG A CG 1 ATOM 1266 C CD . ARG A 1 171 ? 1.212 -17.657 -33.392 0.80 36.47 ? 171 ARG A CD 1 ATOM 1267 N NE . ARG A 1 171 ? 1.272 -16.296 -33.937 0.60 44.61 ? 171 ARG A NE 1 ATOM 1268 C CZ . ARG A 1 171 ? 1.366 -15.990 -35.232 0.50 48.67 ? 171 ARG A CZ 1 ATOM 1269 N NH1 . ARG A 1 171 ? 1.376 -16.930 -36.179 0.50 48.81 ? 171 ARG A NH1 1 ATOM 1270 N NH2 . ARG A 1 171 ? 1.454 -14.719 -35.589 0.45 51.80 ? 171 ARG A NH2 1 ATOM 1271 N N . GLY A 1 172 ? -1.157 -21.950 -31.290 1.00 29.05 ? 172 GLY A N 1 ATOM 1272 C CA . GLY A 1 172 ? -0.627 -23.285 -31.152 1.00 28.56 ? 172 GLY A CA 1 ATOM 1273 C C . GLY A 1 172 ? -1.455 -24.151 -30.236 1.00 26.08 ? 172 GLY A C 1 ATOM 1274 O O . GLY A 1 172 ? -2.412 -23.701 -29.598 1.00 25.39 ? 172 GLY A O 1 ATOM 1275 N N . MET A 1 173 ? -1.040 -25.402 -30.150 1.00 27.90 ? 173 MET A N 1 ATOM 1276 C CA . MET A 1 173 ? -1.707 -26.381 -29.295 1.00 28.21 ? 173 MET A CA 1 ATOM 1277 C C . MET A 1 173 ? -1.585 -26.024 -27.817 1.00 26.45 ? 173 MET A C 1 ATOM 1278 O O . MET A 1 173 ? -0.562 -25.488 -27.350 1.00 26.97 ? 173 MET A O 1 ATOM 1279 C CB . MET A 1 173 ? -1.074 -27.749 -29.481 1.00 27.05 ? 173 MET A CB 1 ATOM 1280 C CG . MET A 1 173 ? -1.153 -28.318 -30.878 1.00 36.98 ? 173 MET A CG 1 ATOM 1281 S SD . MET A 1 173 ? -0.137 -29.798 -31.059 1.00 45.61 ? 173 MET A SD 1 ATOM 1282 C CE . MET A 1 173 ? -1.166 -30.822 -30.078 1.00 43.62 ? 173 MET A CE 1 ATOM 1283 N N . PHE A 1 174 ? -2.590 -26.439 -27.075 1.00 25.79 ? 174 PHE A N 1 ATOM 1284 C CA . PHE A 1 174 ? -2.562 -26.409 -25.614 1.00 29.47 ? 174 PHE A CA 1 ATOM 1285 C C . PHE A 1 174 ? -2.067 -25.048 -25.088 1.00 27.27 ? 174 PHE A C 1 ATOM 1286 O O . PHE A 1 174 ? -1.229 -24.994 -24.192 1.00 25.72 ? 174 PHE A O 1 ATOM 1287 C CB . PHE A 1 174 ? -1.677 -27.531 -25.035 1.00 27.56 ? 174 PHE A CB 1 ATOM 1288 C CG . PHE A 1 174 ? -1.920 -28.882 -25.633 1.00 29.18 ? 174 PHE A CG 1 ATOM 1289 C CD1 . PHE A 1 174 ? -3.194 -29.432 -25.650 1.00 29.42 ? 174 PHE A CD1 1 ATOM 1290 C CD2 . PHE A 1 174 ? -0.850 -29.644 -26.123 1.00 31.05 ? 174 PHE A CD2 1 ATOM 1291 C CE1 . PHE A 1 174 ? -3.416 -30.694 -26.185 1.00 29.86 ? 174 PHE A CE1 1 ATOM 1292 C CE2 . PHE A 1 174 ? -1.071 -30.911 -26.645 1.00 32.39 ? 174 PHE A CE2 1 ATOM 1293 C CZ . PHE A 1 174 ? -2.359 -31.451 -26.642 1.00 28.52 ? 174 PHE A CZ 1 ATOM 1294 N N . PRO A 1 175 ? -2.718 -23.971 -25.508 1.00 27.35 ? 175 PRO A N 1 ATOM 1295 C CA . PRO A 1 175 ? -2.173 -22.652 -25.176 1.00 24.78 ? 175 PRO A CA 1 ATOM 1296 C C . PRO A 1 175 ? -2.365 -22.215 -23.731 1.00 23.14 ? 175 PRO A C 1 ATOM 1297 O O . PRO A 1 175 ? -1.789 -21.195 -23.311 1.00 23.35 ? 175 PRO A O 1 ATOM 1298 C CB . PRO A 1 175 ? -2.905 -21.718 -26.169 1.00 26.92 ? 175 PRO A CB 1 ATOM 1299 C CG . PRO A 1 175 ? -4.189 -22.408 -26.436 1.00 30.44 ? 175 PRO A CG 1 ATOM 1300 C CD . PRO A 1 175 ? -3.850 -23.875 -26.456 1.00 26.48 ? 175 PRO A CD 1 ATOM 1301 N N . ASP A 1 176 ? -3.145 -23.002 -22.990 1.00 25.04 ? 176 ASP A N 1 ATOM 1302 C CA . ASP A 1 176 ? -3.363 -22.875 -21.570 1.00 25.69 ? 176 ASP A CA 1 ATOM 1303 C C . ASP A 1 176 ? -2.499 -23.791 -20.649 1.00 25.19 ? 176 ASP A C 1 ATOM 1304 O O . ASP A 1 176 ? -2.686 -23.794 -19.421 1.00 27.82 ? 176 ASP A O 1 ATOM 1305 C CB . ASP A 1 176 ? -4.838 -23.155 -21.272 1.00 29.48 ? 176 ASP A CB 1 ATOM 1306 C CG . ASP A 1 176 ? -5.224 -24.589 -21.582 1.00 36.02 ? 176 ASP A CG 1 ATOM 1307 O OD1 . ASP A 1 176 ? -4.459 -25.264 -22.307 1.00 33.92 ? 176 ASP A OD1 1 ATOM 1308 O OD2 . ASP A 1 176 ? -6.297 -25.044 -21.110 1.00 41.00 ? 176 ASP A OD2 1 ATOM 1309 N N . SER A 1 177 ? -1.513 -24.450 -21.219 1.00 24.06 ? 177 SER A N 1 ATOM 1310 C CA . SER A 1 177 ? -0.781 -25.527 -20.558 1.00 25.60 ? 177 SER A CA 1 ATOM 1311 C C . SER A 1 177 ? 0.667 -25.135 -20.235 1.00 24.87 ? 177 SER A C 1 ATOM 1312 O O . SER A 1 177 ? 1.178 -24.125 -20.747 1.00 19.12 ? 177 SER A O 1 ATOM 1313 C CB . SER A 1 177 ? -0.858 -26.762 -21.445 1.00 25.20 ? 177 SER A CB 1 ATOM 1314 O OG . SER A 1 177 ? -2.234 -27.113 -21.579 1.00 27.44 ? 177 SER A OG 1 ATOM 1315 N N . HIS A 1 178 ? 1.280 -25.918 -19.332 1.00 24.10 ? 178 HIS A N 1 ATOM 1316 C CA . HIS A 1 178 ? 2.614 -25.746 -18.881 1.00 18.45 ? 178 HIS A CA 1 ATOM 1317 C C . HIS A 1 178 ? 2.909 -24.323 -18.401 1.00 20.85 ? 178 HIS A C 1 ATOM 1318 O O . HIS A 1 178 ? 4.002 -23.808 -18.629 1.00 20.42 ? 178 HIS A O 1 ATOM 1319 C CB . HIS A 1 178 ? 3.592 -26.101 -20.009 1.00 20.91 ? 178 HIS A CB 1 ATOM 1320 C CG . HIS A 1 178 ? 3.367 -27.446 -20.620 1.00 19.78 ? 178 HIS A CG 1 ATOM 1321 N ND1 . HIS A 1 178 ? 3.128 -28.581 -19.880 1.00 18.82 ? 178 HIS A ND1 1 ATOM 1322 C CD2 . HIS A 1 178 ? 3.392 -27.845 -21.912 1.00 19.38 ? 178 HIS A CD2 1 ATOM 1323 C CE1 . HIS A 1 178 ? 2.989 -29.616 -20.694 1.00 17.48 ? 178 HIS A CE1 1 ATOM 1324 N NE2 . HIS A 1 178 ? 3.199 -29.203 -21.926 1.00 19.97 ? 178 HIS A NE2 1 ATOM 1325 N N . ALA A 1 179 ? 1.989 -23.713 -17.658 1.00 20.34 ? 179 ALA A N 1 ATOM 1326 C CA . ALA A 1 179 ? 2.257 -22.409 -17.109 1.00 22.91 ? 179 ALA A CA 1 ATOM 1327 C C . ALA A 1 179 ? 3.513 -22.416 -16.233 1.00 25.68 ? 179 ALA A C 1 ATOM 1328 O O . ALA A 1 179 ? 3.779 -23.376 -15.515 1.00 23.52 ? 179 ALA A O 1 ATOM 1329 C CB . ALA A 1 179 ? 1.083 -21.897 -16.300 1.00 23.58 ? 179 ALA A CB 1 ATOM 1330 N N . TRP A 1 180 ? 4.267 -21.318 -16.303 1.00 22.23 ? 180 TRP A N 1 ATOM 1331 C CA . TRP A 1 180 ? 5.425 -21.102 -15.429 1.00 22.73 ? 180 TRP A CA 1 ATOM 1332 C C . TRP A 1 180 ? 4.999 -20.528 -14.064 1.00 24.32 ? 180 TRP A C 1 ATOM 1333 O O . TRP A 1 180 ? 5.122 -19.329 -13.789 1.00 25.77 ? 180 TRP A O 1 ATOM 1334 C CB . TRP A 1 180 ? 6.430 -20.132 -16.065 1.00 22.62 ? 180 TRP A CB 1 ATOM 1335 C CG . TRP A 1 180 ? 6.776 -20.369 -17.534 1.00 18.24 ? 180 TRP A CG 1 ATOM 1336 C CD1 . TRP A 1 180 ? 6.513 -21.482 -18.312 1.00 22.44 ? 180 TRP A CD1 1 ATOM 1337 C CD2 . TRP A 1 180 ? 7.627 -19.540 -18.300 1.00 19.20 ? 180 TRP A CD2 1 ATOM 1338 N NE1 . TRP A 1 180 ? 7.133 -21.360 -19.528 1.00 21.02 ? 180 TRP A NE1 1 ATOM 1339 C CE2 . TRP A 1 180 ? 7.779 -20.142 -19.564 1.00 20.01 ? 180 TRP A CE2 1 ATOM 1340 C CE3 . TRP A 1 180 ? 8.250 -18.297 -18.050 1.00 21.08 ? 180 TRP A CE3 1 ATOM 1341 C CZ2 . TRP A 1 180 ? 8.557 -19.570 -20.563 1.00 18.92 ? 180 TRP A CZ2 1 ATOM 1342 C CZ3 . TRP A 1 180 ? 8.979 -17.692 -19.064 1.00 19.19 ? 180 TRP A CZ3 1 ATOM 1343 C CH2 . TRP A 1 180 ? 9.142 -18.337 -20.300 1.00 21.36 ? 180 TRP A CH2 1 ATOM 1344 N N . LEU A 1 181 ? 4.545 -21.414 -13.199 1.00 25.34 ? 181 LEU A N 1 ATOM 1345 C CA . LEU A 1 181 ? 3.987 -21.068 -11.906 1.00 24.11 ? 181 LEU A CA 1 ATOM 1346 C C . LEU A 1 181 ? 5.037 -20.969 -10.816 1.00 24.93 ? 181 LEU A C 1 ATOM 1347 O O . LEU A 1 181 ? 5.840 -21.871 -10.620 1.00 27.31 ? 181 LEU A O 1 ATOM 1348 C CB . LEU A 1 181 ? 2.952 -22.100 -11.492 1.00 23.74 ? 181 LEU A CB 1 ATOM 1349 C CG . LEU A 1 181 ? 1.742 -22.244 -12.395 1.00 25.58 ? 181 LEU A CG 1 ATOM 1350 C CD1 . LEU A 1 181 ? 0.827 -23.272 -11.774 1.00 24.53 ? 181 LEU A CD1 1 ATOM 1351 C CD2 . LEU A 1 181 ? 0.997 -20.916 -12.608 1.00 24.20 ? 181 LEU A CD2 1 ATOM 1352 N N . TRP A 1 182 ? 5.057 -19.837 -10.133 1.00 23.77 ? 182 TRP A N 1 ATOM 1353 C CA . TRP A 1 182 ? 6.009 -19.605 -9.064 1.00 23.24 ? 182 TRP A CA 1 ATOM 1354 C C . TRP A 1 182 ? 5.288 -19.092 -7.824 1.00 25.84 ? 182 TRP A C 1 ATOM 1355 O O . TRP A 1 182 ? 4.821 -17.950 -7.764 1.00 32.85 ? 182 TRP A O 1 ATOM 1356 C CB . TRP A 1 182 ? 7.092 -18.642 -9.500 1.00 23.77 ? 182 TRP A CB 1 ATOM 1357 C CG . TRP A 1 182 ? 8.018 -19.256 -10.457 1.00 25.98 ? 182 TRP A CG 1 ATOM 1358 C CD1 . TRP A 1 182 ? 8.038 -19.080 -11.813 1.00 26.00 ? 182 TRP A CD1 1 ATOM 1359 C CD2 . TRP A 1 182 ? 8.955 -20.269 -10.165 1.00 26.14 ? 182 TRP A CD2 1 ATOM 1360 N NE1 . TRP A 1 182 ? 8.957 -19.913 -12.391 1.00 28.10 ? 182 TRP A NE1 1 ATOM 1361 C CE2 . TRP A 1 182 ? 9.507 -20.699 -11.420 1.00 29.23 ? 182 TRP A CE2 1 ATOM 1362 C CE3 . TRP A 1 182 ? 9.278 -20.972 -9.009 1.00 24.01 ? 182 TRP A CE3 1 ATOM 1363 C CZ2 . TRP A 1 182 ? 10.470 -21.699 -11.521 1.00 24.69 ? 182 TRP A CZ2 1 ATOM 1364 C CZ3 . TRP A 1 182 ? 10.203 -22.061 -9.126 1.00 23.13 ? 182 TRP A CZ3 1 ATOM 1365 C CH2 . TRP A 1 182 ? 10.782 -22.397 -10.383 1.00 25.13 ? 182 TRP A CH2 1 ATOM 1366 N N . SER A 1 183 ? 5.211 -19.946 -6.831 1.00 26.79 ? 183 SER A N 1 ATOM 1367 C CA . SER A 1 183 ? 4.600 -19.602 -5.564 1.00 24.88 ? 183 SER A CA 1 ATOM 1368 C C . SER A 1 183 ? 5.345 -18.469 -4.868 1.00 25.37 ? 183 SER A C 1 ATOM 1369 O O . SER A 1 183 ? 6.600 -18.353 -4.879 1.00 25.65 ? 183 SER A O 1 ATOM 1370 C CB . SER A 1 183 ? 4.550 -20.864 -4.692 1.00 27.62 ? 183 SER A CB 1 ATOM 1371 O OG . SER A 1 183 ? 3.568 -21.725 -5.191 1.00 26.06 ? 183 SER A OG 1 ATOM 1372 N N . TRP A 1 184 ? 4.581 -17.555 -4.293 1.00 29.13 ? 184 TRP A N 1 ATOM 1373 C CA . TRP A 1 184 ? 5.235 -16.448 -3.611 1.00 27.88 ? 184 TRP A CA 1 ATOM 1374 C C . TRP A 1 184 ? 4.444 -16.067 -2.325 1.00 32.63 ? 184 TRP A C 1 ATOM 1375 O O . TRP A 1 184 ? 3.689 -16.911 -1.773 1.00 32.16 ? 184 TRP A O 1 ATOM 1376 C CB . TRP A 1 184 ? 5.443 -15.317 -4.628 1.00 25.41 ? 184 TRP A CB 1 ATOM 1377 C CG . TRP A 1 184 ? 6.351 -14.177 -4.262 1.00 25.09 ? 184 TRP A CG 1 ATOM 1378 C CD1 . TRP A 1 184 ? 6.009 -12.829 -4.265 1.00 26.94 ? 184 TRP A CD1 1 ATOM 1379 C CD2 . TRP A 1 184 ? 7.760 -14.220 -3.964 1.00 28.15 ? 184 TRP A CD2 1 ATOM 1380 N NE1 . TRP A 1 184 ? 7.118 -12.064 -3.988 1.00 26.37 ? 184 TRP A NE1 1 ATOM 1381 C CE2 . TRP A 1 184 ? 8.186 -12.877 -3.745 1.00 25.49 ? 184 TRP A CE2 1 ATOM 1382 C CE3 . TRP A 1 184 ? 8.687 -15.247 -3.816 1.00 27.97 ? 184 TRP A CE3 1 ATOM 1383 C CZ2 . TRP A 1 184 ? 9.478 -12.547 -3.391 1.00 29.25 ? 184 TRP A CZ2 1 ATOM 1384 C CZ3 . TRP A 1 184 ? 9.970 -14.914 -3.459 1.00 30.48 ? 184 TRP A CZ3 1 ATOM 1385 C CH2 . TRP A 1 184 ? 10.366 -13.566 -3.270 1.00 31.53 ? 184 TRP A CH2 1 ATOM 1386 N N . LYS A 1 185 ? 4.662 -14.841 -1.839 1.00 34.56 ? 185 LYS A N 1 ATOM 1387 C CA . LYS A 1 185 ? 4.241 -14.420 -0.494 1.00 35.08 ? 185 LYS A CA 1 ATOM 1388 C C . LYS A 1 185 ? 2.723 -14.481 -0.346 1.00 31.46 ? 185 LYS A C 1 ATOM 1389 O O . LYS A 1 185 ? 1.961 -14.348 -1.323 1.00 32.48 ? 185 LYS A O 1 ATOM 1390 C CB . LYS A 1 185 ? 4.754 -13.007 -0.171 1.00 34.92 ? 185 LYS A CB 1 ATOM 1391 C CG . LYS A 1 185 ? 6.258 -12.839 -0.110 1.00 35.29 ? 185 LYS A CG 1 ATOM 1392 C CD . LYS A 1 185 ? 6.706 -11.385 0.019 0.80 38.30 ? 185 LYS A CD 1 ATOM 1393 C CE . LYS A 1 185 ? 8.207 -11.299 0.289 0.70 39.27 ? 185 LYS A CE 1 ATOM 1394 N NZ . LYS A 1 185 ? 8.759 -10.032 -0.263 0.60 41.73 ? 185 LYS A NZ 1 ATOM 1395 N N . ASN A 1 186 ? 2.282 -14.846 0.853 1.00 36.34 ? 186 ASN A N 1 ATOM 1396 C CA . ASN A 1 186 ? 0.871 -14.759 1.200 1.00 31.62 ? 186 ASN A CA 1 ATOM 1397 C C . ASN A 1 186 ? -0.041 -15.521 0.230 1.00 37.12 ? 186 ASN A C 1 ATOM 1398 O O . ASN A 1 186 ? -1.113 -15.051 -0.146 1.00 35.55 ? 186 ASN A O 1 ATOM 1399 C CB . ASN A 1 186 ? 0.514 -13.257 1.289 0.80 36.64 ? 186 ASN A CB 1 ATOM 1400 C CG . ASN A 1 186 ? -0.849 -12.997 1.917 0.70 39.22 ? 186 ASN A CG 1 ATOM 1401 O OD1 . ASN A 1 186 ? -1.349 -13.776 2.720 0.80 35.14 ? 186 ASN A OD1 1 ATOM 1402 N ND2 . ASN A 1 186 ? -1.450 -11.886 1.537 0.55 48.36 ? 186 ASN A ND2 1 ATOM 1403 N N . GLY A 1 187 ? 0.342 -16.746 -0.141 1.00 37.55 ? 187 GLY A N 1 ATOM 1404 C CA . GLY A 1 187 ? -0.528 -17.588 -0.992 1.00 27.47 ? 187 GLY A CA 1 ATOM 1405 C C . GLY A 1 187 ? -0.644 -17.182 -2.470 1.00 26.08 ? 187 GLY A C 1 ATOM 1406 O O . GLY A 1 187 ? -1.514 -17.667 -3.192 1.00 29.43 ? 187 GLY A O 1 ATOM 1407 N N . SER A 1 188 ? 0.226 -16.288 -2.911 1.00 30.00 ? 188 SER A N 1 ATOM 1408 C CA . SER A 1 188 ? 0.197 -15.781 -4.271 1.00 33.30 ? 188 SER A CA 1 ATOM 1409 C C . SER A 1 188 ? 0.970 -16.769 -5.160 1.00 34.34 ? 188 SER A C 1 ATOM 1410 O O . SER A 1 188 ? 1.857 -17.503 -4.651 1.00 30.51 ? 188 SER A O 1 ATOM 1411 C CB . SER A 1 188 ? 0.849 -14.409 -4.339 1.00 28.98 ? 188 SER A CB 1 ATOM 1412 O OG . SER A 1 188 ? 2.229 -14.452 -3.977 1.00 32.31 ? 188 SER A OG 1 ATOM 1413 N N . VAL A 1 189 ? 0.581 -16.823 -6.440 1.00 32.87 ? 189 VAL A N 1 ATOM 1414 C CA . VAL A 1 189 ? 1.340 -17.519 -7.497 1.00 28.02 ? 189 VAL A CA 1 ATOM 1415 C C . VAL A 1 189 ? 1.533 -16.579 -8.685 1.00 30.95 ? 189 VAL A C 1 ATOM 1416 O O . VAL A 1 189 ? 0.556 -16.043 -9.208 1.00 27.80 ? 189 VAL A O 1 ATOM 1417 C CB . VAL A 1 189 ? 0.598 -18.778 -7.949 1.00 31.29 ? 189 VAL A CB 1 ATOM 1418 C CG1 . VAL A 1 189 ? 1.343 -19.464 -9.077 1.00 29.22 ? 189 VAL A CG1 1 ATOM 1419 C CG2 . VAL A 1 189 ? 0.371 -19.736 -6.780 1.00 29.70 ? 189 VAL A CG2 1 ATOM 1420 N N . LEU A 1 190 ? 2.791 -16.385 -9.121 1.00 29.06 ? 190 LEU A N 1 ATOM 1421 C CA . LEU A 1 190 ? 3.098 -15.709 -10.374 1.00 25.91 ? 190 LEU A CA 1 ATOM 1422 C C . LEU A 1 190 ? 3.117 -16.737 -11.502 1.00 31.26 ? 190 LEU A C 1 ATOM 1423 O O . LEU A 1 190 ? 3.734 -17.789 -11.354 1.00 29.02 ? 190 LEU A O 1 ATOM 1424 C CB . LEU A 1 190 ? 4.428 -15.015 -10.307 1.00 28.98 ? 190 LEU A CB 1 ATOM 1425 C CG . LEU A 1 190 ? 4.847 -14.335 -11.602 1.00 26.11 ? 190 LEU A CG 1 ATOM 1426 C CD1 . LEU A 1 190 ? 3.946 -13.153 -11.946 1.00 32.78 ? 190 LEU A CD1 1 ATOM 1427 C CD2 . LEU A 1 190 ? 6.280 -13.896 -11.492 1.00 23.86 ? 190 LEU A CD2 1 ATOM 1428 N N . GLN A 1 191 ? 2.257 -16.510 -12.499 1.00 26.38 ? 191 GLN A N 1 ATOM 1429 C CA . GLN A 1 191 ? 2.366 -17.130 -13.792 1.00 26.50 ? 191 GLN A CA 1 ATOM 1430 C C . GLN A 1 191 ? 3.265 -16.244 -14.645 1.00 28.09 ? 191 GLN A C 1 ATOM 1431 O O . GLN A 1 191 ? 2.858 -15.175 -15.131 1.00 25.97 ? 191 GLN A O 1 ATOM 1432 C CB . GLN A 1 191 ? 0.991 -17.335 -14.380 1.00 27.45 ? 191 GLN A CB 1 ATOM 1433 C CG . GLN A 1 191 ? 0.959 -17.686 -15.882 1.00 29.59 ? 191 GLN A CG 1 ATOM 1434 C CD . GLN A 1 191 ? 0.752 -16.438 -16.765 1.00 33.69 ? 191 GLN A CD 1 ATOM 1435 O OE1 . GLN A 1 191 ? -0.007 -15.519 -16.417 1.00 32.65 ? 191 GLN A OE1 1 ATOM 1436 N NE2 . GLN A 1 191 ? 1.423 -16.407 -17.907 1.00 26.76 ? 191 GLN A NE2 1 ATOM 1437 N N . ALA A 1 192 ? 4.503 -16.701 -14.805 1.00 24.73 ? 192 ALA A N 1 ATOM 1438 C CA . ALA A 1 192 ? 5.610 -15.914 -15.374 1.00 22.34 ? 192 ALA A CA 1 ATOM 1439 C C . ALA A 1 192 ? 5.659 -16.114 -16.885 1.00 23.64 ? 192 ALA A C 1 ATOM 1440 O O . ALA A 1 192 ? 6.337 -15.393 -17.592 1.00 24.51 ? 192 ALA A O 1 ATOM 1441 C CB . ALA A 1 192 ? 6.940 -16.336 -14.734 1.00 23.86 ? 192 ALA A CB 1 ATOM 1442 N N . GLY A 1 193 ? 4.838 -17.012 -17.391 1.00 23.16 ? 193 GLY A N 1 ATOM 1443 C CA . GLY A 1 193 ? 4.904 -17.420 -18.785 1.00 22.85 ? 193 GLY A CA 1 ATOM 1444 C C . GLY A 1 193 ? 4.155 -18.733 -18.902 1.00 22.04 ? 193 GLY A C 1 ATOM 1445 O O . GLY A 1 193 ? 3.412 -19.100 -17.982 1.00 21.16 ? 193 GLY A O 1 ATOM 1446 N N . PRO A 1 194 ? 4.173 -19.363 -20.066 1.00 20.93 ? 194 PRO A N 1 ATOM 1447 C CA . PRO A 1 194 ? 4.864 -18.928 -21.263 1.00 20.62 ? 194 PRO A CA 1 ATOM 1448 C C . PRO A 1 194 ? 4.275 -17.735 -22.059 1.00 22.01 ? 194 PRO A C 1 ATOM 1449 O O . PRO A 1 194 ? 4.996 -17.147 -22.858 1.00 23.31 ? 194 PRO A O 1 ATOM 1450 C CB . PRO A 1 194 ? 4.800 -20.175 -22.141 1.00 20.89 ? 194 PRO A CB 1 ATOM 1451 C CG . PRO A 1 194 ? 3.510 -20.820 -21.708 1.00 20.53 ? 194 PRO A CG 1 ATOM 1452 C CD . PRO A 1 194 ? 3.403 -20.607 -20.275 1.00 19.44 ? 194 PRO A CD 1 ATOM 1453 N N . SER A 1 195 ? 3.001 -17.409 -21.906 1.00 22.36 ? 195 SER A N 1 ATOM 1454 C CA . SER A 1 195 ? 2.490 -16.158 -22.468 1.00 24.69 ? 195 SER A CA 1 ATOM 1455 C C . SER A 1 195 ? 3.360 -14.945 -22.064 1.00 24.82 ? 195 SER A C 1 ATOM 1456 O O . SER A 1 195 ? 3.903 -14.873 -20.950 1.00 23.54 ? 195 SER A O 1 ATOM 1457 C CB . SER A 1 195 ? 1.049 -15.907 -22.006 1.00 28.88 ? 195 SER A CB 1 ATOM 1458 O OG . SER A 1 195 ? 0.662 -14.617 -22.378 1.00 32.19 ? 195 SER A OG 1 ATOM 1459 N N . LYS A 1 196 ? 3.624 -14.077 -23.030 1.00 28.41 ? 196 LYS A N 1 ATOM 1460 C CA . LYS A 1 196 ? 4.293 -12.816 -22.750 1.00 26.73 ? 196 LYS A CA 1 ATOM 1461 C C . LYS A 1 196 ? 3.564 -11.973 -21.689 1.00 24.99 ? 196 LYS A C 1 ATOM 1462 O O . LYS A 1 196 ? 4.200 -11.178 -21.024 1.00 25.65 ? 196 LYS A O 1 ATOM 1463 C CB . LYS A 1 196 ? 4.527 -12.022 -24.036 1.00 30.52 ? 196 LYS A CB 1 ATOM 1464 C CG . LYS A 1 196 ? 3.269 -11.555 -24.740 1.00 32.30 ? 196 LYS A CG 1 ATOM 1465 C CD . LYS A 1 196 ? 3.626 -10.834 -26.031 0.80 36.76 ? 196 LYS A CD 1 ATOM 1466 C CE . LYS A 1 196 ? 2.382 -10.482 -26.807 0.80 43.15 ? 196 LYS A CE 1 ATOM 1467 N NZ . LYS A 1 196 ? 2.608 -9.214 -27.535 0.70 53.84 ? 196 LYS A NZ 1 ATOM 1468 N N . LYS A 1 197 ? 2.269 -12.190 -21.506 1.00 24.80 ? 197 LYS A N 1 ATOM 1469 C CA . LYS A 1 197 ? 1.519 -11.556 -20.417 1.00 28.83 ? 197 LYS A CA 1 ATOM 1470 C C . LYS A 1 197 ? 1.609 -12.364 -19.107 1.00 26.13 ? 197 LYS A C 1 ATOM 1471 O O . LYS A 1 197 ? 1.103 -13.458 -19.021 1.00 24.03 ? 197 LYS A O 1 ATOM 1472 C CB . LYS A 1 197 ? 0.050 -11.398 -20.826 1.00 29.97 ? 197 LYS A CB 1 ATOM 1473 C CG . LYS A 1 197 ? -0.135 -10.505 -22.055 0.80 32.91 ? 197 LYS A CG 1 ATOM 1474 C CD . LYS A 1 197 ? -1.569 -10.016 -22.173 0.70 37.62 ? 197 LYS A CD 1 ATOM 1475 C CE . LYS A 1 197 ? -2.435 -11.055 -22.861 0.55 43.07 ? 197 LYS A CE 1 ATOM 1476 N NZ . LYS A 1 197 ? -3.848 -10.590 -22.971 0.50 52.04 ? 197 LYS A NZ 1 ATOM 1477 N N . MET A 1 198 ? 2.255 -11.802 -18.093 1.00 26.77 ? 198 MET A N 1 ATOM 1478 C CA . MET A 1 198 ? 2.372 -12.436 -16.775 1.00 27.36 ? 198 MET A CA 1 ATOM 1479 C C . MET A 1 198 ? 1.246 -11.979 -15.878 1.00 30.85 ? 198 MET A C 1 ATOM 1480 O O . MET A 1 198 ? 0.725 -10.887 -16.071 1.00 27.59 ? 198 MET A O 1 ATOM 1481 C CB . MET A 1 198 ? 3.713 -12.042 -16.150 1.00 26.11 ? 198 MET A CB 1 ATOM 1482 C CG . MET A 1 198 ? 4.855 -12.317 -17.089 1.00 25.76 ? 198 MET A CG 1 ATOM 1483 S SD . MET A 1 198 ? 6.498 -12.102 -16.377 1.00 28.98 ? 198 MET A SD 1 ATOM 1484 C CE . MET A 1 198 ? 6.497 -10.334 -16.037 1.00 30.64 ? 198 MET A CE 1 ATOM 1485 N N . ASN A 1 199 ? 0.843 -12.827 -14.941 1.00 27.63 ? 199 ASN A N 1 ATOM 1486 C CA . ASN A 1 199 ? -0.338 -12.612 -14.104 1.00 30.16 ? 199 ASN A CA 1 ATOM 1487 C C . ASN A 1 199 ? -0.100 -13.154 -12.692 1.00 30.82 ? 199 ASN A C 1 ATOM 1488 O O . ASN A 1 199 ? 0.556 -14.192 -12.491 1.00 30.89 ? 199 ASN A O 1 ATOM 1489 C CB . ASN A 1 199 ? -1.603 -13.271 -14.683 1.00 32.77 ? 199 ASN A CB 1 ATOM 1490 C CG . ASN A 1 199 ? -2.063 -12.653 -16.004 1.00 34.46 ? 199 ASN A CG 1 ATOM 1491 O OD1 . ASN A 1 199 ? -2.780 -11.653 -16.038 1.00 32.81 ? 199 ASN A OD1 1 ATOM 1492 N ND2 . ASN A 1 199 ? -1.654 -13.251 -17.093 1.00 29.75 ? 199 ASN A ND2 1 ATOM 1493 N N . TRP A 1 200 ? -0.561 -12.397 -11.705 1.00 29.98 ? 200 TRP A N 1 ATOM 1494 C CA . TRP A 1 200 ? -0.575 -12.837 -10.324 1.00 31.25 ? 200 TRP A CA 1 ATOM 1495 C C . TRP A 1 200 ? -1.865 -13.533 -10.069 1.00 33.12 ? 200 TRP A C 1 ATOM 1496 O O . TRP A 1 200 ? -2.925 -13.124 -10.546 1.00 33.84 ? 200 TRP A O 1 ATOM 1497 C CB . TRP A 1 200 ? -0.457 -11.676 -9.355 1.00 31.28 ? 200 TRP A CB 1 ATOM 1498 C CG . TRP A 1 200 ? 0.901 -11.095 -9.297 1.00 30.06 ? 200 TRP A CG 1 ATOM 1499 C CD1 . TRP A 1 200 ? 1.284 -9.906 -9.796 1.00 31.04 ? 200 TRP A CD1 1 ATOM 1500 C CD2 . TRP A 1 200 ? 2.003 -11.596 -8.555 1.00 31.17 ? 200 TRP A CD2 1 ATOM 1501 N NE1 . TRP A 1 200 ? 2.559 -9.659 -9.468 1.00 35.70 ? 200 TRP A NE1 1 ATOM 1502 C CE2 . TRP A 1 200 ? 3.039 -10.693 -8.715 1.00 30.96 ? 200 TRP A CE2 1 ATOM 1503 C CE3 . TRP A 1 200 ? 2.221 -12.759 -7.802 1.00 33.33 ? 200 TRP A CE3 1 ATOM 1504 C CZ2 . TRP A 1 200 ? 4.298 -10.889 -8.143 1.00 38.27 ? 200 TRP A CZ2 1 ATOM 1505 C CZ3 . TRP A 1 200 ? 3.431 -12.943 -7.205 1.00 33.22 ? 200 TRP A CZ3 1 ATOM 1506 C CH2 . TRP A 1 200 ? 4.478 -12.037 -7.401 1.00 37.53 ? 200 TRP A CH2 1 ATOM 1507 N N . TYR A 1 201 ? -1.772 -14.616 -9.334 1.00 28.63 ? 201 TYR A N 1 ATOM 1508 C CA . TYR A 1 201 ? -2.949 -15.274 -8.830 1.00 31.67 ? 201 TYR A CA 1 ATOM 1509 C C . TYR A 1 201 ? -2.858 -15.322 -7.297 1.00 31.83 ? 201 TYR A C 1 ATOM 1510 O O . TYR A 1 201 ? -1.751 -15.408 -6.717 1.00 35.33 ? 201 TYR A O 1 ATOM 1511 C CB . TYR A 1 201 ? -3.061 -16.685 -9.376 1.00 29.80 ? 201 TYR A CB 1 ATOM 1512 C CG . TYR A 1 201 ? -3.446 -16.762 -10.790 1.00 33.17 ? 201 TYR A CG 1 ATOM 1513 C CD1 . TYR A 1 201 ? -4.786 -16.816 -11.160 1.00 32.70 ? 201 TYR A CD1 1 ATOM 1514 C CD2 . TYR A 1 201 ? -2.476 -16.793 -11.801 1.00 30.84 ? 201 TYR A CD2 1 ATOM 1515 C CE1 . TYR A 1 201 ? -5.158 -16.888 -12.491 1.00 31.50 ? 201 TYR A CE1 1 ATOM 1516 C CE2 . TYR A 1 201 ? -2.857 -16.847 -13.146 1.00 29.46 ? 201 TYR A CE2 1 ATOM 1517 C CZ . TYR A 1 201 ? -4.190 -16.925 -13.489 1.00 31.13 ? 201 TYR A CZ 1 ATOM 1518 O OH . TYR A 1 201 ? -4.584 -17.028 -14.845 1.00 27.26 ? 201 TYR A OH 1 ATOM 1519 N N . ASP A 1 202 ? -4.021 -15.232 -6.652 1.00 34.53 ? 202 ASP A N 1 ATOM 1520 C CA . ASP A 1 202 ? -4.137 -15.295 -5.172 1.00 32.26 ? 202 ASP A CA 1 ATOM 1521 C C . ASP A 1 202 ? -4.956 -16.541 -4.873 1.00 29.73 ? 202 ASP A C 1 ATOM 1522 O O . ASP A 1 202 ? -6.065 -16.760 -5.443 1.00 32.52 ? 202 ASP A O 1 ATOM 1523 C CB . ASP A 1 202 ? -4.770 -14.007 -4.641 0.80 36.12 ? 202 ASP A CB 1 ATOM 1524 C CG . ASP A 1 202 ? -4.985 -14.018 -3.142 0.70 39.49 ? 202 ASP A CG 1 ATOM 1525 O OD1 . ASP A 1 202 ? -4.727 -15.034 -2.449 0.70 35.63 ? 202 ASP A OD1 1 ATOM 1526 O OD2 . ASP A 1 202 ? -5.429 -12.961 -2.657 0.60 39.59 ? 202 ASP A OD2 1 ATOM 1527 N N . THR A 1 203 ? -4.314 -17.496 -4.200 1.00 33.12 ? 203 THR A N 1 ATOM 1528 C CA . THR A 1 203 ? -4.964 -18.797 -4.021 1.00 36.50 ? 203 THR A CA 1 ATOM 1529 C C . THR A 1 203 ? -5.843 -18.870 -2.782 1.00 37.18 ? 203 THR A C 1 ATOM 1530 O O . THR A 1 203 ? -6.527 -19.871 -2.634 1.00 37.15 ? 203 THR A O 1 ATOM 1531 C CB . THR A 1 203 ? -3.964 -19.976 -3.990 1.00 33.35 ? 203 THR A CB 1 ATOM 1532 O OG1 . THR A 1 203 ? -3.019 -19.759 -2.934 1.00 37.11 ? 203 THR A OG1 1 ATOM 1533 C CG2 . THR A 1 203 ? -3.243 -20.060 -5.353 1.00 36.36 ? 203 THR A CG2 1 ATOM 1534 N N . LYS A 1 204 ? -5.859 -17.805 -1.970 1.00 44.29 ? 204 LYS A N 1 ATOM 1535 C CA . LYS A 1 204 ? -6.733 -17.715 -0.784 1.00 47.79 ? 204 LYS A CA 1 ATOM 1536 C C . LYS A 1 204 ? -8.164 -17.325 -1.124 1.00 52.14 ? 204 LYS A C 1 ATOM 1537 O O . LYS A 1 204 ? -8.455 -16.701 -2.152 1.00 51.46 ? 204 LYS A O 1 ATOM 1538 C CB . LYS A 1 204 ? -6.161 -16.716 0.207 1.00 46.94 ? 204 LYS A CB 1 ATOM 1539 C CG . LYS A 1 204 ? -4.763 -17.097 0.651 1.00 46.92 ? 204 LYS A CG 1 ATOM 1540 C CD . LYS A 1 204 ? -4.249 -16.255 1.797 1.00 50.29 ? 204 LYS A CD 1 ATOM 1541 C CE . LYS A 1 204 ? -4.308 -14.760 1.507 1.00 55.46 ? 204 LYS A CE 1 ATOM 1542 N NZ . LYS A 1 204 ? -3.729 -14.402 0.182 1.00 61.35 ? 204 LYS A NZ 1 ATOM 1543 N N . GLY A 1 205 ? -9.082 -17.769 -0.284 1.00 55.17 ? 205 GLY A N 1 ATOM 1544 C CA . GLY A 1 205 ? -10.471 -17.377 -0.402 1.00 44.57 ? 205 GLY A CA 1 ATOM 1545 C C . GLY A 1 205 ? -11.154 -17.994 -1.581 1.00 41.88 ? 205 GLY A C 1 ATOM 1546 O O . GLY A 1 205 ? -11.091 -19.194 -1.799 1.00 43.02 ? 205 GLY A O 1 ATOM 1547 N N . THR A 1 206 ? -11.827 -17.161 -2.363 1.00 46.21 ? 206 THR A N 1 ATOM 1548 C CA . THR A 1 206 ? -12.389 -17.606 -3.641 1.00 45.45 ? 206 THR A CA 1 ATOM 1549 C C . THR A 1 206 ? -11.495 -17.269 -4.818 1.00 39.12 ? 206 THR A C 1 ATOM 1550 O O . THR A 1 206 ? -11.892 -17.479 -5.968 1.00 41.05 ? 206 THR A O 1 ATOM 1551 C CB . THR A 1 206 ? -13.732 -16.894 -3.912 1.00 55.63 ? 206 THR A CB 1 ATOM 1552 O OG1 . THR A 1 206 ? -13.560 -15.481 -3.685 1.00 50.83 ? 206 THR A OG1 1 ATOM 1553 C CG2 . THR A 1 206 ? -14.837 -17.469 -3.013 1.00 53.57 ? 206 THR A CG2 1 ATOM 1554 N N . GLY A 1 207 ? -10.331 -16.686 -4.537 1.00 40.47 ? 207 GLY A N 1 ATOM 1555 C CA . GLY A 1 207 ? -9.319 -16.435 -5.573 1.00 49.72 ? 207 GLY A CA 1 ATOM 1556 C C . GLY A 1 207 ? -9.293 -14.994 -6.011 1.00 51.81 ? 207 GLY A C 1 ATOM 1557 O O . GLY A 1 207 ? -10.249 -14.287 -5.805 1.00 46.11 ? 207 GLY A O 1 ATOM 1558 N N . SER A 1 208 ? -8.170 -14.535 -6.541 1.00 43.89 ? 208 SER A N 1 ATOM 1559 C CA . SER A 1 208 ? -8.162 -13.330 -7.345 1.00 47.80 ? 208 SER A CA 1 ATOM 1560 C C . SER A 1 208 ? -7.006 -13.401 -8.346 1.00 45.97 ? 208 SER A C 1 ATOM 1561 O O . SER A 1 208 ? -6.162 -14.292 -8.275 1.00 40.86 ? 208 SER A O 1 ATOM 1562 C CB . SER A 1 208 ? -8.089 -12.087 -6.458 1.00 44.47 ? 208 SER A CB 1 ATOM 1563 O OG . SER A 1 208 ? -6.800 -11.524 -6.448 1.00 54.95 ? 208 SER A OG 1 ATOM 1564 N N . ASN A 1 209 ? -7.016 -12.512 -9.317 1.00 38.98 ? 209 ASN A N 1 ATOM 1565 C CA . ASN A 1 209 ? -5.930 -12.446 -10.271 1.00 45.24 ? 209 ASN A CA 1 ATOM 1566 C C . ASN A 1 209 ? -5.751 -11.034 -10.744 1.00 41.99 ? 209 ASN A C 1 ATOM 1567 O O . ASN A 1 209 ? -6.703 -10.283 -10.772 1.00 36.96 ? 209 ASN A O 1 ATOM 1568 C CB . ASN A 1 209 ? -6.206 -13.379 -11.458 1.00 37.98 ? 209 ASN A CB 1 ATOM 1569 C CG . ASN A 1 209 ? -7.286 -12.851 -12.373 1.00 45.39 ? 209 ASN A CG 1 ATOM 1570 O OD1 . ASN A 1 209 ? -6.990 -12.234 -13.395 1.00 37.30 ? 209 ASN A OD1 1 ATOM 1571 N ND2 . ASN A 1 209 ? -8.548 -13.069 -12.001 1.00 38.73 ? 209 ASN A ND2 1 ATOM 1572 N N . THR A 1 210 ? -4.534 -10.656 -11.105 1.00 40.97 ? 210 THR A N 1 ATOM 1573 C CA . THR A 1 210 ? -4.309 -9.340 -11.665 1.00 37.44 ? 210 THR A CA 1 ATOM 1574 C C . THR A 1 210 ? -3.039 -9.347 -12.521 1.00 40.86 ? 210 THR A C 1 ATOM 1575 O O . THR A 1 210 ? -2.121 -10.129 -12.257 1.00 36.87 ? 210 THR A O 1 ATOM 1576 C CB . THR A 1 210 ? -4.239 -8.293 -10.528 1.00 40.41 ? 210 THR A CB 1 ATOM 1577 O OG1 . THR A 1 210 ? -4.280 -6.977 -11.067 1.00 46.23 ? 210 THR A OG1 1 ATOM 1578 C CG2 . THR A 1 210 ? -3.015 -8.424 -9.703 1.00 38.46 ? 210 THR A CG2 1 ATOM 1579 N N . PRO A 1 211 ? -2.974 -8.475 -13.541 1.00 35.89 ? 211 PRO A N 1 ATOM 1580 C CA . PRO A 1 211 ? -1.794 -8.502 -14.381 1.00 34.67 ? 211 PRO A CA 1 ATOM 1581 C C . PRO A 1 211 ? -0.506 -8.296 -13.639 1.00 37.13 ? 211 PRO A C 1 ATOM 1582 O O . PRO A 1 211 ? -0.481 -7.615 -12.640 1.00 33.80 ? 211 PRO A O 1 ATOM 1583 C CB . PRO A 1 211 ? -2.068 -7.377 -15.390 1.00 37.97 ? 211 PRO A CB 1 ATOM 1584 C CG . PRO A 1 211 ? -3.543 -7.480 -15.608 1.00 38.95 ? 211 PRO A CG 1 ATOM 1585 C CD . PRO A 1 211 ? -4.090 -7.777 -14.220 1.00 39.88 ? 211 PRO A CD 1 ATOM 1586 N N . ALA A 1 212 ? 0.566 -8.936 -14.086 1.00 35.32 ? 212 ALA A N 1 ATOM 1587 C CA . ALA A 1 212 ? 1.869 -8.670 -13.504 1.00 32.38 ? 212 ALA A CA 1 ATOM 1588 C C . ALA A 1 212 ? 2.797 -7.951 -14.462 1.00 31.48 ? 212 ALA A C 1 ATOM 1589 O O . ALA A 1 212 ? 3.945 -7.679 -14.128 1.00 29.35 ? 212 ALA A O 1 ATOM 1590 C CB . ALA A 1 212 ? 2.505 -9.974 -13.050 1.00 34.95 ? 212 ALA A CB 1 ATOM 1591 N N . GLY A 1 213 ? 2.321 -7.694 -15.671 1.00 32.81 ? 213 GLY A N 1 ATOM 1592 C CA . GLY A 1 213 ? 3.116 -7.013 -16.660 1.00 36.00 ? 213 GLY A CA 1 ATOM 1593 C C . GLY A 1 213 ? 3.517 -7.983 -17.755 1.00 34.53 ? 213 GLY A C 1 ATOM 1594 O O . GLY A 1 213 ? 3.249 -9.182 -17.676 1.00 32.79 ? 213 GLY A O 1 ATOM 1595 N N . LEU A 1 214 ? 4.067 -7.417 -18.813 1.00 28.72 ? 214 LEU A N 1 ATOM 1596 C CA . LEU A 1 214 ? 4.634 -8.182 -19.915 1.00 31.68 ? 214 LEU A CA 1 ATOM 1597 C C . LEU A 1 214 ? 6.005 -8.659 -19.525 1.00 26.29 ? 214 LEU A C 1 ATOM 1598 O O . LEU A 1 214 ? 6.740 -7.955 -18.824 1.00 24.17 ? 214 LEU A O 1 ATOM 1599 C CB . LEU A 1 214 ? 4.751 -7.337 -21.187 1.00 32.85 ? 214 LEU A CB 1 ATOM 1600 C CG . LEU A 1 214 ? 3.430 -6.920 -21.845 1.00 37.02 ? 214 LEU A CG 1 ATOM 1601 C CD1 . LEU A 1 214 ? 3.752 -5.854 -22.880 1.00 39.83 ? 214 LEU A CD1 1 ATOM 1602 C CD2 . LEU A 1 214 ? 2.655 -8.059 -22.514 1.00 37.65 ? 214 LEU A CD2 1 ATOM 1603 N N . ARG A 1 215 ? 6.437 -9.759 -20.140 1.00 25.53 ? 215 ARG A N 1 ATOM 1604 C CA . ARG A 1 215 ? 7.790 -10.213 -19.940 1.00 24.64 ? 215 ARG A CA 1 ATOM 1605 C C . ARG A 1 215 ? 8.706 -9.453 -20.901 1.00 27.08 ? 215 ARG A C 1 ATOM 1606 O O . ARG A 1 215 ? 9.245 -10.011 -21.894 1.00 26.59 ? 215 ARG A O 1 ATOM 1607 C CB . ARG A 1 215 ? 7.881 -11.768 -20.073 1.00 23.74 ? 215 ARG A CB 1 ATOM 1608 C CG . ARG A 1 215 ? 9.237 -12.339 -19.691 1.00 21.92 ? 215 ARG A CG 1 ATOM 1609 C CD . ARG A 1 215 ? 9.258 -13.889 -19.623 1.00 24.16 ? 215 ARG A CD 1 ATOM 1610 N NE . ARG A 1 215 ? 8.826 -14.454 -20.887 1.00 21.11 ? 215 ARG A NE 1 ATOM 1611 C CZ . ARG A 1 215 ? 7.589 -14.814 -21.187 1.00 20.59 ? 215 ARG A CZ 1 ATOM 1612 N NH1 . ARG A 1 215 ? 6.664 -14.892 -20.268 1.00 20.84 ? 215 ARG A NH1 1 ATOM 1613 N NH2 . ARG A 1 215 ? 7.295 -15.171 -22.442 1.00 24.29 ? 215 ARG A NH2 1 ATOM 1614 N N . GLY A 1 216 ? 8.902 -8.164 -20.593 1.00 29.63 ? 216 GLY A N 1 ATOM 1615 C CA . GLY A 1 216 ? 9.748 -7.285 -21.400 1.00 24.21 ? 216 GLY A CA 1 ATOM 1616 C C . GLY A 1 216 ? 9.313 -7.295 -22.844 1.00 24.77 ? 216 GLY A C 1 ATOM 1617 O O . GLY A 1 216 ? 8.116 -7.161 -23.148 1.00 26.90 ? 216 GLY A O 1 ATOM 1618 N N . THR A 1 217 ? 10.280 -7.506 -23.742 1.00 29.46 ? 217 THR A N 1 ATOM 1619 C CA . THR A 1 217 ? 10.008 -7.612 -25.167 1.00 27.23 ? 217 THR A CA 1 ATOM 1620 C C . THR A 1 217 ? 9.840 -9.078 -25.598 1.00 30.18 ? 217 THR A C 1 ATOM 1621 O O . THR A 1 217 ? 9.801 -9.347 -26.767 1.00 26.03 ? 217 THR A O 1 ATOM 1622 C CB . THR A 1 217 ? 11.161 -7.008 -26.036 1.00 31.13 ? 217 THR A CB 1 ATOM 1623 O OG1 . THR A 1 217 ? 12.400 -7.638 -25.714 1.00 32.28 ? 217 THR A OG1 1 ATOM 1624 C CG2 . THR A 1 217 ? 11.322 -5.491 -25.798 1.00 36.64 ? 217 THR A CG2 1 ATOM 1625 N N . ASP A 1 218 ? 9.797 -10.034 -24.681 1.00 28.39 ? 218 ASP A N 1 ATOM 1626 C CA . ASP A 1 218 ? 9.795 -11.431 -25.102 1.00 24.01 ? 218 ASP A CA 1 ATOM 1627 C C . ASP A 1 218 ? 8.488 -11.738 -25.865 1.00 27.76 ? 218 ASP A C 1 ATOM 1628 O O . ASP A 1 218 ? 7.463 -11.127 -25.638 1.00 31.32 ? 218 ASP A O 1 ATOM 1629 C CB . ASP A 1 218 ? 9.932 -12.332 -23.887 1.00 23.25 ? 218 ASP A CB 1 ATOM 1630 C CG . ASP A 1 218 ? 10.422 -13.759 -24.222 1.00 25.79 ? 218 ASP A CG 1 ATOM 1631 O OD1 . ASP A 1 218 ? 10.936 -13.976 -25.319 1.00 27.64 ? 218 ASP A OD1 1 ATOM 1632 O OD2 . ASP A 1 218 ? 10.249 -14.664 -23.357 1.00 26.40 ? 218 ASP A OD2 1 ATOM 1633 N N . GLU A 1 219 ? 8.532 -12.713 -26.747 1.00 26.19 ? 219 GLU A N 1 ATOM 1634 C CA . GLU A 1 219 ? 7.333 -13.275 -27.326 1.00 29.21 ? 219 GLU A CA 1 ATOM 1635 C C . GLU A 1 219 ? 6.844 -14.433 -26.438 1.00 28.22 ? 219 GLU A C 1 ATOM 1636 O O . GLU A 1 219 ? 7.567 -14.883 -25.536 1.00 26.18 ? 219 GLU A O 1 ATOM 1637 C CB . GLU A 1 219 ? 7.668 -13.743 -28.737 1.00 31.40 ? 219 GLU A CB 1 ATOM 1638 C CG . GLU A 1 219 ? 6.482 -14.083 -29.632 0.70 44.70 ? 219 GLU A CG 1 ATOM 1639 C CD . GLU A 1 219 ? 5.320 -13.113 -29.514 0.60 43.91 ? 219 GLU A CD 1 ATOM 1640 O OE1 . GLU A 1 219 ? 5.507 -11.924 -29.897 0.55 44.16 ? 219 GLU A OE1 1 ATOM 1641 O OE2 . GLU A 1 219 ? 4.243 -13.551 -28.995 0.80 35.19 ? 219 GLU A OE2 1 ATOM 1642 N N . ASP A 1 220 ? 5.611 -14.890 -26.706 1.00 25.97 ? 220 ASP A N 1 ATOM 1643 C CA . ASP A 1 220 ? 5.096 -16.140 -26.214 1.00 26.61 ? 220 ASP A CA 1 ATOM 1644 C C . ASP A 1 220 ? 6.135 -17.237 -26.372 1.00 21.42 ? 220 ASP A C 1 ATOM 1645 O O . ASP A 1 220 ? 6.739 -17.427 -27.454 1.00 20.55 ? 220 ASP A O 1 ATOM 1646 C CB . ASP A 1 220 ? 3.817 -16.563 -26.971 1.00 29.94 ? 220 ASP A CB 1 ATOM 1647 C CG . ASP A 1 220 ? 2.582 -15.676 -26.664 1.00 23.77 ? 220 ASP A CG 1 ATOM 1648 O OD1 . ASP A 1 220 ? 2.569 -14.947 -25.672 1.00 26.14 ? 220 ASP A OD1 1 ATOM 1649 O OD2 . ASP A 1 220 ? 1.564 -15.864 -27.331 1.00 27.93 ? 220 ASP A OD2 1 ATOM 1650 N N . SER A 1 221 ? 6.248 -18.043 -25.326 1.00 20.71 ? 221 SER A N 1 ATOM 1651 C CA . SER A 1 221 ? 7.451 -18.905 -25.142 1.00 20.75 ? 221 SER A CA 1 ATOM 1652 C C . SER A 1 221 ? 7.082 -20.338 -24.619 1.00 20.67 ? 221 SER A C 1 ATOM 1653 O O . SER A 1 221 ? 7.509 -20.751 -23.549 1.00 20.13 ? 221 SER A O 1 ATOM 1654 C CB . SER A 1 221 ? 8.419 -18.182 -24.184 1.00 19.78 ? 221 SER A CB 1 ATOM 1655 O OG . SER A 1 221 ? 9.146 -17.117 -24.843 1.00 20.62 ? 221 SER A OG 1 ATOM 1656 N N . MET A 1 222 ? 6.142 -20.998 -25.280 1.00 20.91 ? 222 MET A N 1 ATOM 1657 C CA . MET A 1 222 ? 5.726 -22.330 -24.891 1.00 19.61 ? 222 MET A CA 1 ATOM 1658 C C . MET A 1 222 ? 6.923 -23.280 -24.834 1.00 20.10 ? 222 MET A C 1 ATOM 1659 O O . MET A 1 222 ? 7.772 -23.297 -25.744 1.00 18.75 ? 222 MET A O 1 ATOM 1660 C CB . MET A 1 222 ? 4.623 -22.873 -25.786 1.00 21.24 ? 222 MET A CB 1 ATOM 1661 C CG . MET A 1 222 ? 4.154 -24.311 -25.474 1.00 21.16 ? 222 MET A CG 1 ATOM 1662 S SD . MET A 1 222 ? 3.393 -24.399 -23.859 1.00 24.99 ? 222 MET A SD 1 ATOM 1663 C CE . MET A 1 222 ? 1.800 -23.638 -24.171 1.00 31.66 ? 222 MET A CE 1 ATOM 1664 N N . CYS A 1 223 ? 7.027 -23.969 -23.696 1.00 21.84 ? 223 CYS A N 1 ATOM 1665 C CA . CYS A 1 223 ? 8.108 -24.946 -23.393 1.00 21.46 ? 223 CYS A CA 1 ATOM 1666 C C . CYS A 1 223 ? 9.466 -24.258 -23.446 1.00 22.52 ? 223 CYS A C 1 ATOM 1667 O O . CYS A 1 223 ? 10.495 -24.865 -23.770 1.00 22.07 ? 223 CYS A O 1 ATOM 1668 C CB . CYS A 1 223 ? 7.986 -26.150 -24.331 1.00 23.92 ? 223 CYS A CB 1 ATOM 1669 S SG . CYS A 1 223 ? 6.408 -27.022 -24.021 1.00 28.46 ? 223 CYS A SG 1 ATOM 1670 N N . GLY A 1 224 ? 9.468 -22.955 -23.149 1.00 19.52 ? 224 GLY A N 1 ATOM 1671 C CA . GLY A 1 224 ? 10.636 -22.386 -22.512 1.00 20.42 ? 224 GLY A CA 1 ATOM 1672 C C . GLY A 1 224 ? 10.764 -22.840 -21.057 1.00 20.37 ? 224 GLY A C 1 ATOM 1673 O O . GLY A 1 224 ? 9.895 -23.501 -20.516 1.00 26.50 ? 224 GLY A O 1 ATOM 1674 N N . VAL A 1 225 ? 11.840 -22.447 -20.414 1.00 20.44 ? 225 VAL A N 1 ATOM 1675 C CA . VAL A 1 225 ? 12.128 -22.867 -19.052 1.00 22.74 ? 225 VAL A CA 1 ATOM 1676 C C . VAL A 1 225 ? 12.292 -21.670 -18.121 1.00 23.20 ? 225 VAL A C 1 ATOM 1677 O O . VAL A 1 225 ? 12.765 -20.593 -18.525 1.00 20.30 ? 225 VAL A O 1 ATOM 1678 C CB . VAL A 1 225 ? 13.387 -23.766 -19.004 1.00 22.59 ? 225 VAL A CB 1 ATOM 1679 C CG1 . VAL A 1 225 ? 13.040 -25.115 -19.619 1.00 24.93 ? 225 VAL A CG1 1 ATOM 1680 C CG2 . VAL A 1 225 ? 14.571 -23.158 -19.757 1.00 23.67 ? 225 VAL A CG2 1 ATOM 1681 N N . SER A 1 226 ? 12.023 -21.914 -16.848 1.00 21.24 ? 226 SER A N 1 ATOM 1682 C CA . SER A 1 226 ? 12.277 -20.933 -15.842 1.00 22.97 ? 226 SER A CA 1 ATOM 1683 C C . SER A 1 226 ? 12.639 -21.589 -14.530 1.00 23.13 ? 226 SER A C 1 ATOM 1684 O O . SER A 1 226 ? 12.311 -22.743 -14.288 1.00 22.22 ? 226 SER A O 1 ATOM 1685 C CB . SER A 1 226 ? 11.053 -20.047 -15.678 1.00 22.97 ? 226 SER A CB 1 ATOM 1686 O OG . SER A 1 226 ? 9.970 -20.767 -15.131 1.00 21.95 ? 226 SER A OG 1 ATOM 1687 N N . VAL A 1 227 ? 13.447 -20.897 -13.747 1.00 23.08 ? 227 VAL A N 1 ATOM 1688 C CA . VAL A 1 227 ? 13.836 -21.389 -12.461 1.00 25.22 ? 227 VAL A CA 1 ATOM 1689 C C . VAL A 1 227 ? 14.073 -20.221 -11.505 1.00 26.03 ? 227 VAL A C 1 ATOM 1690 O O . VAL A 1 227 ? 14.771 -19.269 -11.858 1.00 23.66 ? 227 VAL A O 1 ATOM 1691 C CB . VAL A 1 227 ? 15.067 -22.311 -12.565 1.00 25.67 ? 227 VAL A CB 1 ATOM 1692 C CG1 . VAL A 1 227 ? 16.279 -21.598 -13.072 1.00 26.49 ? 227 VAL A CG1 1 ATOM 1693 C CG2 . VAL A 1 227 ? 15.394 -22.896 -11.198 1.00 27.65 ? 227 VAL A CG2 1 ATOM 1694 N N . MET A 1 228 ? 13.605 -20.363 -10.257 1.00 25.56 ? 228 MET A N 1 ATOM 1695 C CA . MET A 1 228 ? 13.806 -19.322 -9.204 1.00 26.03 ? 228 MET A CA 1 ATOM 1696 C C . MET A 1 228 ? 15.131 -19.570 -8.497 1.00 21.95 ? 228 MET A C 1 ATOM 1697 O O . MET A 1 228 ? 15.255 -20.439 -7.658 1.00 23.51 ? 228 MET A O 1 ATOM 1698 C CB . MET A 1 228 ? 12.639 -19.330 -8.225 1.00 28.79 ? 228 MET A CB 1 ATOM 1699 C CG . MET A 1 228 ? 12.812 -18.345 -7.062 1.00 27.68 ? 228 MET A CG 1 ATOM 1700 S SD . MET A 1 228 ? 11.378 -18.298 -5.997 1.00 29.15 ? 228 MET A SD 1 ATOM 1701 C CE . MET A 1 228 ? 10.157 -17.481 -7.016 1.00 26.00 ? 228 MET A CE 1 ATOM 1702 N N . TYR A 1 229 ? 16.175 -18.949 -8.981 1.00 20.73 ? 229 TYR A N 1 ATOM 1703 C CA . TYR A 1 229 ? 17.511 -19.290 -8.567 1.00 24.94 ? 229 TYR A CA 1 ATOM 1704 C C . TYR A 1 229 ? 17.956 -18.569 -7.267 1.00 24.44 ? 229 TYR A C 1 ATOM 1705 O O . TYR A 1 229 ? 19.017 -18.890 -6.709 1.00 27.32 ? 229 TYR A O 1 ATOM 1706 C CB . TYR A 1 229 ? 18.513 -19.033 -9.702 1.00 25.49 ? 229 TYR A CB 1 ATOM 1707 C CG . TYR A 1 229 ? 18.696 -17.568 -10.023 1.00 25.63 ? 229 TYR A CG 1 ATOM 1708 C CD1 . TYR A 1 229 ? 19.642 -16.780 -9.336 1.00 25.00 ? 229 TYR A CD1 1 ATOM 1709 C CD2 . TYR A 1 229 ? 17.948 -16.974 -11.027 1.00 25.68 ? 229 TYR A CD2 1 ATOM 1710 C CE1 . TYR A 1 229 ? 19.795 -15.441 -9.625 1.00 24.61 ? 229 TYR A CE1 1 ATOM 1711 C CE2 . TYR A 1 229 ? 18.093 -15.649 -11.331 1.00 26.11 ? 229 TYR A CE2 1 ATOM 1712 C CZ . TYR A 1 229 ? 19.005 -14.885 -10.608 1.00 33.03 ? 229 TYR A CZ 1 ATOM 1713 O OH . TYR A 1 229 ? 19.153 -13.588 -10.964 1.00 29.39 ? 229 TYR A OH 1 ATOM 1714 N N . ASP A 1 230 ? 17.191 -17.568 -6.842 1.00 27.02 ? 230 ASP A N 1 ATOM 1715 C CA . ASP A 1 230 ? 17.453 -16.850 -5.579 1.00 25.09 ? 230 ASP A CA 1 ATOM 1716 C C . ASP A 1 230 ? 16.151 -16.361 -5.020 1.00 28.16 ? 230 ASP A C 1 ATOM 1717 O O . ASP A 1 230 ? 15.684 -15.267 -5.341 1.00 28.88 ? 230 ASP A O 1 ATOM 1718 C CB . ASP A 1 230 ? 18.413 -15.694 -5.785 1.00 29.30 ? 230 ASP A CB 1 ATOM 1719 C CG . ASP A 1 230 ? 18.775 -14.997 -4.447 1.00 34.48 ? 230 ASP A CG 1 ATOM 1720 O OD1 . ASP A 1 230 ? 17.992 -15.142 -3.459 1.00 31.06 ? 230 ASP A OD1 1 ATOM 1721 O OD2 . ASP A 1 230 ? 19.904 -14.457 -4.375 1.00 32.13 ? 230 ASP A OD2 1 ATOM 1722 N N . ALA A 1 231 ? 15.459 -17.251 -4.328 1.00 25.97 ? 231 ALA A N 1 ATOM 1723 C CA . ALA A 1 231 ? 14.171 -16.907 -3.819 1.00 27.62 ? 231 ALA A CA 1 ATOM 1724 C C . ALA A 1 231 ? 14.208 -15.681 -2.882 1.00 28.34 ? 231 ALA A C 1 ATOM 1725 O O . ALA A 1 231 ? 13.190 -15.000 -2.747 1.00 31.64 ? 231 ALA A O 1 ATOM 1726 C CB . ALA A 1 231 ? 13.544 -18.096 -3.101 1.00 27.76 ? 231 ALA A CB 1 ATOM 1727 N N . VAL A 1 232 ? 15.315 -15.479 -2.189 1.00 33.46 ? 232 VAL A N 1 ATOM 1728 C CA . VAL A 1 232 ? 15.404 -14.412 -1.191 1.00 36.96 ? 232 VAL A CA 1 ATOM 1729 C C . VAL A 1 232 ? 15.381 -13.080 -1.895 1.00 34.03 ? 232 VAL A C 1 ATOM 1730 O O . VAL A 1 232 ? 14.591 -12.228 -1.550 1.00 34.22 ? 232 VAL A O 1 ATOM 1731 C CB . VAL A 1 232 ? 16.676 -14.494 -0.353 1.00 36.78 ? 232 VAL A CB 1 ATOM 1732 C CG1 . VAL A 1 232 ? 16.824 -13.233 0.515 1.00 37.31 ? 232 VAL A CG1 1 ATOM 1733 C CG2 . VAL A 1 232 ? 16.620 -15.757 0.506 1.00 45.05 ? 232 VAL A CG2 1 ATOM 1734 N N . ALA A 1 233 ? 16.108 -12.986 -2.994 1.00 34.98 ? 233 ALA A N 1 ATOM 1735 C CA . ALA A 1 233 ? 16.065 -11.799 -3.854 1.00 35.47 ? 233 ALA A CA 1 ATOM 1736 C C . ALA A 1 233 ? 14.852 -11.744 -4.766 1.00 30.64 ? 233 ALA A C 1 ATOM 1737 O O . ALA A 1 233 ? 14.697 -10.783 -5.531 1.00 35.37 ? 233 ALA A O 1 ATOM 1738 C CB . ALA A 1 233 ? 17.342 -11.717 -4.670 1.00 33.84 ? 233 ALA A CB 1 ATOM 1739 N N . GLY A 1 234 ? 14.035 -12.790 -4.789 1.00 30.51 ? 234 GLY A N 1 ATOM 1740 C CA . GLY A 1 234 ? 12.913 -12.840 -5.747 1.00 31.48 ? 234 GLY A CA 1 ATOM 1741 C C . GLY A 1 234 ? 13.277 -13.016 -7.226 1.00 30.55 ? 234 GLY A C 1 ATOM 1742 O O . GLY A 1 234 ? 12.522 -12.638 -8.108 1.00 31.35 ? 234 GLY A O 1 ATOM 1743 N N . LYS A 1 235 ? 14.412 -13.616 -7.503 1.00 24.30 ? 235 LYS A N 1 ATOM 1744 C CA . LYS A 1 235 ? 14.882 -13.761 -8.868 1.00 25.15 ? 235 LYS A CA 1 ATOM 1745 C C . LYS A 1 235 ? 14.498 -15.058 -9.532 1.00 27.11 ? 235 LYS A C 1 ATOM 1746 O O . LYS A 1 235 ? 14.775 -16.141 -8.999 1.00 23.03 ? 235 LYS A O 1 ATOM 1747 C CB . LYS A 1 235 ? 16.375 -13.690 -8.877 1.00 25.26 ? 235 LYS A CB 1 ATOM 1748 C CG . LYS A 1 235 ? 16.903 -12.461 -8.165 1.00 32.14 ? 235 LYS A CG 1 ATOM 1749 C CD . LYS A 1 235 ? 16.726 -11.257 -9.017 1.00 31.65 ? 235 LYS A CD 1 ATOM 1750 C CE . LYS A 1 235 ? 16.994 -10.005 -8.182 1.00 38.20 ? 235 LYS A CE 1 ATOM 1751 N NZ . LYS A 1 235 ? 17.420 -8.889 -9.045 1.00 35.90 ? 235 LYS A NZ 1 ATOM 1752 N N . ILE A 1 236 ? 14.023 -14.924 -10.767 1.00 26.32 ? 236 ILE A N 1 ATOM 1753 C CA . ILE A 1 236 ? 13.686 -16.035 -11.653 1.00 23.80 ? 236 ILE A CA 1 ATOM 1754 C C . ILE A 1 236 ? 14.361 -15.847 -12.996 1.00 25.41 ? 236 ILE A C 1 ATOM 1755 O O . ILE A 1 236 ? 14.347 -14.732 -13.565 1.00 24.08 ? 236 ILE A O 1 ATOM 1756 C CB . ILE A 1 236 ? 12.200 -16.085 -11.906 1.00 22.88 ? 236 ILE A CB 1 ATOM 1757 C CG1 . ILE A 1 236 ? 11.470 -16.309 -10.595 1.00 26.92 ? 236 ILE A CG1 1 ATOM 1758 C CG2 . ILE A 1 236 ? 11.857 -17.206 -12.884 1.00 25.21 ? 236 ILE A CG2 1 ATOM 1759 C CD1 . ILE A 1 236 ? 9.989 -16.098 -10.711 1.00 23.42 ? 236 ILE A CD1 1 ATOM 1760 N N . PHE A 1 237 ? 15.063 -16.881 -13.447 1.00 20.65 ? 237 PHE A N 1 ATOM 1761 C CA . PHE A 1 237 ? 15.690 -16.874 -14.776 1.00 20.96 ? 237 PHE A CA 1 ATOM 1762 C C . PHE A 1 237 ? 14.714 -17.566 -15.750 1.00 23.12 ? 237 PHE A C 1 ATOM 1763 O O . PHE A 1 237 ? 14.063 -18.581 -15.376 1.00 21.73 ? 237 PHE A O 1 ATOM 1764 C CB . PHE A 1 237 ? 17.028 -17.580 -14.669 1.00 22.49 ? 237 PHE A CB 1 ATOM 1765 C CG . PHE A 1 237 ? 17.635 -17.973 -15.968 1.00 21.03 ? 237 PHE A CG 1 ATOM 1766 C CD1 . PHE A 1 237 ? 18.434 -17.090 -16.665 1.00 22.65 ? 237 PHE A CD1 1 ATOM 1767 C CD2 . PHE A 1 237 ? 17.417 -19.236 -16.496 1.00 22.41 ? 237 PHE A CD2 1 ATOM 1768 C CE1 . PHE A 1 237 ? 19.049 -17.451 -17.847 1.00 23.55 ? 237 PHE A CE1 1 ATOM 1769 C CE2 . PHE A 1 237 ? 17.996 -19.595 -17.696 1.00 20.37 ? 237 PHE A CE2 1 ATOM 1770 C CZ . PHE A 1 237 ? 18.829 -18.709 -18.356 1.00 20.45 ? 237 PHE A CZ 1 ATOM 1771 N N . THR A 1 238 ? 14.542 -16.980 -16.930 1.00 20.20 ? 238 THR A N 1 ATOM 1772 C CA . THR A 1 238 ? 13.717 -17.560 -18.058 1.00 20.63 ? 238 THR A CA 1 ATOM 1773 C C . THR A 1 238 ? 14.512 -17.666 -19.341 1.00 21.33 ? 238 THR A C 1 ATOM 1774 O O . THR A 1 238 ? 15.461 -16.900 -19.553 1.00 19.45 ? 238 THR A O 1 ATOM 1775 C CB . THR A 1 238 ? 12.472 -16.742 -18.304 1.00 23.05 ? 238 THR A CB 1 ATOM 1776 O OG1 . THR A 1 238 ? 12.840 -15.519 -18.959 1.00 21.24 ? 238 THR A OG1 1 ATOM 1777 C CG2 . THR A 1 238 ? 11.783 -16.450 -16.991 1.00 23.78 ? 238 THR A CG2 1 ATOM 1778 N N . TYR A 1 239 ? 14.312 -18.778 -20.053 1.00 18.41 ? 239 TYR A N 1 ATOM 1779 C CA . TYR A 1 239 ? 14.991 -19.031 -21.316 1.00 18.28 ? 239 TYR A CA 1 ATOM 1780 C C . TYR A 1 239 ? 14.122 -19.744 -22.365 1.00 19.28 ? 239 TYR A C 1 ATOM 1781 O O . TYR A 1 239 ? 13.458 -20.790 -22.093 1.00 20.36 ? 239 TYR A O 1 ATOM 1782 C CB . TYR A 1 239 ? 16.213 -19.887 -21.079 1.00 18.55 ? 239 TYR A CB 1 ATOM 1783 C CG . TYR A 1 239 ? 17.163 -19.939 -22.220 1.00 21.17 ? 239 TYR A CG 1 ATOM 1784 C CD1 . TYR A 1 239 ? 18.178 -18.990 -22.338 1.00 17.97 ? 239 TYR A CD1 1 ATOM 1785 C CD2 . TYR A 1 239 ? 17.090 -20.946 -23.196 1.00 19.36 ? 239 TYR A CD2 1 ATOM 1786 C CE1 . TYR A 1 239 ? 19.062 -19.009 -23.417 1.00 20.87 ? 239 TYR A CE1 1 ATOM 1787 C CE2 . TYR A 1 239 ? 17.973 -20.956 -24.272 1.00 17.48 ? 239 TYR A CE2 1 ATOM 1788 C CZ . TYR A 1 239 ? 18.920 -19.949 -24.417 1.00 21.79 ? 239 TYR A CZ 1 ATOM 1789 O OH . TYR A 1 239 ? 19.858 -19.955 -25.426 1.00 20.19 ? 239 TYR A OH 1 ATOM 1790 N N . GLY A 1 240 ? 14.182 -19.217 -23.574 1.00 17.70 ? 240 GLY A N 1 ATOM 1791 C CA . GLY A 1 240 ? 13.787 -19.966 -24.785 1.00 19.50 ? 240 GLY A CA 1 ATOM 1792 C C . GLY A 1 240 ? 12.303 -20.183 -24.898 1.00 20.26 ? 240 GLY A C 1 ATOM 1793 O O . GLY A 1 240 ? 11.546 -19.376 -24.394 1.00 19.92 ? 240 GLY A O 1 ATOM 1794 N N . GLY A 1 241 ? 11.889 -21.296 -25.530 1.00 19.03 ? 241 GLY A N 1 ATOM 1795 C CA . GLY A 1 241 ? 10.512 -21.457 -25.939 1.00 19.45 ? 241 GLY A CA 1 ATOM 1796 C C . GLY A 1 241 ? 10.148 -20.911 -27.314 1.00 20.79 ? 241 GLY A C 1 ATOM 1797 O O . GLY A 1 241 ? 10.983 -20.321 -28.029 1.00 22.19 ? 241 GLY A O 1 ATOM 1798 N N . GLY A 1 242 ? 8.907 -21.164 -27.723 1.00 24.08 ? 242 GLY A N 1 ATOM 1799 C CA . GLY A 1 242 ? 8.456 -20.774 -29.056 1.00 22.68 ? 242 GLY A CA 1 ATOM 1800 C C . GLY A 1 242 ? 7.070 -20.212 -29.024 1.00 22.58 ? 242 GLY A C 1 ATOM 1801 O O . GLY A 1 242 ? 6.379 -20.360 -28.027 1.00 21.49 ? 242 GLY A O 1 ATOM 1802 N N . LYS A 1 243 ? 6.675 -19.568 -30.133 1.00 21.76 ? 243 LYS A N 1 ATOM 1803 C CA . LYS A 1 243 ? 5.373 -18.847 -30.267 1.00 27.44 ? 243 LYS A CA 1 ATOM 1804 C C . LYS A 1 243 ? 4.212 -19.795 -30.193 1.00 23.25 ? 243 LYS A C 1 ATOM 1805 O O . LYS A 1 243 ? 3.063 -19.392 -30.040 1.00 20.84 ? 243 LYS A O 1 ATOM 1806 C CB . LYS A 1 243 ? 5.278 -18.203 -31.656 1.00 32.97 ? 243 LYS A CB 1 ATOM 1807 C CG . LYS A 1 243 ? 5.646 -16.765 -31.767 0.70 46.05 ? 243 LYS A CG 1 ATOM 1808 C CD . LYS A 1 243 ? 5.008 -16.153 -33.012 0.70 40.03 ? 243 LYS A CD 1 ATOM 1809 C CE . LYS A 1 243 ? 5.324 -16.903 -34.294 0.65 39.27 ? 243 LYS A CE 1 ATOM 1810 N NZ . LYS A 1 243 ? 5.130 -15.980 -35.461 0.70 37.30 ? 243 LYS A NZ 1 ATOM 1811 N N . GLY A 1 244 ? 4.476 -21.045 -30.546 1.00 20.59 ? 244 GLY A N 1 ATOM 1812 C CA . GLY A 1 244 ? 3.505 -22.089 -30.342 1.00 23.92 ? 244 GLY A CA 1 ATOM 1813 C C . GLY A 1 244 ? 4.132 -23.358 -29.798 1.00 22.26 ? 244 GLY A C 1 ATOM 1814 O O . GLY A 1 244 ? 5.333 -23.508 -29.821 1.00 24.00 ? 244 GLY A O 1 ATOM 1815 N N . TYR A 1 245 ? 3.278 -24.278 -29.373 1.00 23.77 ? 245 TYR A N 1 ATOM 1816 C CA . TYR A 1 245 ? 3.715 -25.625 -28.916 1.00 26.29 ? 245 TYR A CA 1 ATOM 1817 C C . TYR A 1 245 ? 4.600 -26.309 -29.920 1.00 25.41 ? 245 TYR A C 1 ATOM 1818 O O . TYR A 1 245 ? 5.646 -26.862 -29.565 1.00 23.16 ? 245 TYR A O 1 ATOM 1819 C CB . TYR A 1 245 ? 2.509 -26.517 -28.588 1.00 26.29 ? 245 TYR A CB 1 ATOM 1820 C CG . TYR A 1 245 ? 2.779 -27.532 -27.482 1.00 26.42 ? 245 TYR A CG 1 ATOM 1821 C CD1 . TYR A 1 245 ? 3.583 -28.664 -27.707 1.00 28.98 ? 245 TYR A CD1 1 ATOM 1822 C CD2 . TYR A 1 245 ? 2.242 -27.364 -26.223 1.00 29.22 ? 245 TYR A CD2 1 ATOM 1823 C CE1 . TYR A 1 245 ? 3.851 -29.580 -26.681 1.00 30.02 ? 245 TYR A CE1 1 ATOM 1824 C CE2 . TYR A 1 245 ? 2.492 -28.279 -25.208 1.00 29.79 ? 245 TYR A CE2 1 ATOM 1825 C CZ . TYR A 1 245 ? 3.304 -29.375 -25.438 1.00 25.87 ? 245 TYR A CZ 1 ATOM 1826 O OH . TYR A 1 245 ? 3.507 -30.266 -24.410 1.00 25.36 ? 245 TYR A OH 1 ATOM 1827 N N . THR A 1 246 ? 4.142 -26.314 -31.181 1.00 23.27 ? 246 THR A N 1 ATOM 1828 C CA . THR A 1 246 ? 4.937 -26.761 -32.299 1.00 22.61 ? 246 THR A CA 1 ATOM 1829 C C . THR A 1 246 ? 4.857 -25.779 -33.460 1.00 26.41 ? 246 THR A C 1 ATOM 1830 O O . THR A 1 246 ? 4.001 -24.887 -33.465 1.00 24.17 ? 246 THR A O 1 ATOM 1831 C CB . THR A 1 246 ? 4.408 -28.107 -32.815 1.00 24.89 ? 246 THR A CB 1 ATOM 1832 O OG1 . THR A 1 246 ? 3.028 -27.968 -33.178 1.00 24.16 ? 246 THR A OG1 1 ATOM 1833 C CG2 . THR A 1 246 ? 4.589 -29.178 -31.732 1.00 25.60 ? 246 THR A CG2 1 ATOM 1834 N N . GLY A 1 247 ? 5.688 -25.981 -34.476 1.00 24.25 ? 247 GLY A N 1 ATOM 1835 C CA . GLY A 1 247 ? 5.516 -25.227 -35.714 1.00 26.60 ? 247 GLY A CA 1 ATOM 1836 C C . GLY A 1 247 ? 6.499 -24.095 -35.982 1.00 26.34 ? 247 GLY A C 1 ATOM 1837 O O . GLY A 1 247 ? 6.649 -23.692 -37.136 1.00 23.99 ? 247 GLY A O 1 ATOM 1838 N N . TYR A 1 248 ? 7.141 -23.576 -34.932 1.00 22.63 ? 248 TYR A N 1 ATOM 1839 C CA . TYR A 1 248 ? 7.949 -22.367 -35.008 1.00 25.36 ? 248 TYR A CA 1 ATOM 1840 C C . TYR A 1 248 ? 9.315 -22.639 -34.433 1.00 25.26 ? 248 TYR A C 1 ATOM 1841 O O . TYR A 1 248 ? 9.480 -23.574 -33.643 1.00 25.41 ? 248 TYR A O 1 ATOM 1842 C CB . TYR A 1 248 ? 7.273 -21.212 -34.226 1.00 23.60 ? 248 TYR A CB 1 ATOM 1843 C CG . TYR A 1 248 ? 5.879 -20.941 -34.682 1.00 24.72 ? 248 TYR A CG 1 ATOM 1844 C CD1 . TYR A 1 248 ? 5.656 -20.218 -35.853 1.00 26.23 ? 248 TYR A CD1 1 ATOM 1845 C CD2 . TYR A 1 248 ? 4.796 -21.492 -34.039 1.00 25.68 ? 248 TYR A CD2 1 ATOM 1846 C CE1 . TYR A 1 248 ? 4.394 -20.037 -36.339 1.00 24.76 ? 248 TYR A CE1 1 ATOM 1847 C CE2 . TYR A 1 248 ? 3.510 -21.213 -34.457 1.00 28.70 ? 248 TYR A CE2 1 ATOM 1848 C CZ . TYR A 1 248 ? 3.332 -20.531 -35.648 1.00 28.07 ? 248 TYR A CZ 1 ATOM 1849 O OH . TYR A 1 248 ? 2.089 -20.326 -36.165 1.00 26.54 ? 248 TYR A OH 1 ATOM 1850 N N . ASP A 1 249 ? 10.266 -21.793 -34.823 1.00 23.14 ? 249 ASP A N 1 ATOM 1851 C CA . ASP A 1 249 ? 11.587 -21.723 -34.239 1.00 23.43 ? 249 ASP A CA 1 ATOM 1852 C C . ASP A 1 249 ? 11.526 -21.290 -32.764 1.00 23.29 ? 249 ASP A C 1 ATOM 1853 O O . ASP A 1 249 ? 10.831 -20.370 -32.412 1.00 24.77 ? 249 ASP A O 1 ATOM 1854 C CB . ASP A 1 249 ? 12.492 -20.781 -35.041 1.00 26.97 ? 249 ASP A CB 1 ATOM 1855 C CG . ASP A 1 249 ? 13.075 -21.448 -36.339 1.00 33.94 ? 249 ASP A CG 1 ATOM 1856 O OD1 . ASP A 1 249 ? 12.887 -22.640 -36.600 1.00 38.59 ? 249 ASP A OD1 1 ATOM 1857 O OD2 . ASP A 1 249 ? 13.822 -20.785 -37.049 1.00 52.40 ? 249 ASP A OD2 1 ATOM 1858 N N . SER A 1 250 ? 12.193 -22.046 -31.894 1.00 21.35 ? 250 SER A N 1 ATOM 1859 C CA . SER A 1 250 ? 12.437 -21.614 -30.516 1.00 21.85 ? 250 SER A CA 1 ATOM 1860 C C . SER A 1 250 ? 13.409 -20.394 -30.496 1.00 18.67 ? 250 SER A C 1 ATOM 1861 O O . SER A 1 250 ? 14.097 -20.105 -31.487 1.00 18.26 ? 250 SER A O 1 ATOM 1862 C CB . SER A 1 250 ? 13.044 -22.773 -29.693 1.00 19.78 ? 250 SER A CB 1 ATOM 1863 O OG . SER A 1 250 ? 14.272 -23.228 -30.293 1.00 20.49 ? 250 SER A OG 1 ATOM 1864 N N . THR A 1 251 ? 13.526 -19.769 -29.334 1.00 21.13 ? 251 THR A N 1 ATOM 1865 C CA . THR A 1 251 ? 14.410 -18.611 -29.160 1.00 21.43 ? 251 THR A CA 1 ATOM 1866 C C . THR A 1 251 ? 15.503 -18.936 -28.214 1.00 22.00 ? 251 THR A C 1 ATOM 1867 O O . THR A 1 251 ? 15.468 -19.961 -27.522 1.00 21.89 ? 251 THR A O 1 ATOM 1868 C CB . THR A 1 251 ? 13.686 -17.352 -28.672 1.00 21.44 ? 251 THR A CB 1 ATOM 1869 O OG1 . THR A 1 251 ? 13.458 -17.430 -27.263 1.00 23.56 ? 251 THR A OG1 1 ATOM 1870 C CG2 . THR A 1 251 ? 12.364 -17.153 -29.438 1.00 20.12 ? 251 THR A CG2 1 ATOM 1871 N N . SER A 1 252 ? 16.540 -18.111 -28.284 1.00 24.16 ? 252 SER A N 1 ATOM 1872 C CA . SER A 1 252 ? 17.572 -18.104 -27.274 1.00 19.95 ? 252 SER A CA 1 ATOM 1873 C C . SER A 1 252 ? 17.457 -16.927 -26.312 1.00 20.36 ? 252 SER A C 1 ATOM 1874 O O . SER A 1 252 ? 18.435 -16.521 -25.689 1.00 20.13 ? 252 SER A O 1 ATOM 1875 C CB . SER A 1 252 ? 18.926 -18.124 -27.989 1.00 23.49 ? 252 SER A CB 1 ATOM 1876 O OG . SER A 1 252 ? 19.061 -17.014 -28.883 1.00 20.94 ? 252 SER A OG 1 ATOM 1877 N N . ASN A 1 253 ? 16.255 -16.399 -26.167 1.00 23.28 ? 253 ASN A N 1 ATOM 1878 C CA . ASN A 1 253 ? 16.026 -15.281 -25.292 1.00 20.72 ? 253 ASN A CA 1 ATOM 1879 C C . ASN A 1 253 ? 16.145 -15.673 -23.824 1.00 24.44 ? 253 ASN A C 1 ATOM 1880 O O . ASN A 1 253 ? 15.689 -16.740 -23.414 1.00 22.26 ? 253 ASN A O 1 ATOM 1881 C CB . ASN A 1 253 ? 14.660 -14.711 -25.531 1.00 20.76 ? 253 ASN A CB 1 ATOM 1882 C CG . ASN A 1 253 ? 14.576 -13.935 -26.834 1.00 23.54 ? 253 ASN A CG 1 ATOM 1883 O OD1 . ASN A 1 253 ? 15.562 -13.650 -27.464 1.00 25.04 ? 253 ASN A OD1 1 ATOM 1884 N ND2 . ASN A 1 253 ? 13.385 -13.593 -27.218 1.00 23.26 ? 253 ASN A ND2 1 ATOM 1885 N N . ALA A 1 254 ? 16.775 -14.804 -23.044 1.00 21.35 ? 254 ALA A N 1 ATOM 1886 C CA . ALA A 1 254 ? 17.060 -15.050 -21.632 1.00 21.60 ? 254 ALA A CA 1 ATOM 1887 C C . ALA A 1 254 ? 16.681 -13.810 -20.841 1.00 23.88 ? 254 ALA A C 1 ATOM 1888 O O . ALA A 1 254 ? 17.147 -12.691 -21.180 1.00 22.52 ? 254 ALA A O 1 ATOM 1889 C CB . ALA A 1 254 ? 18.542 -15.304 -21.495 1.00 21.56 ? 254 ALA A CB 1 ATOM 1890 N N . HIS A 1 255 ? 15.843 -13.971 -19.818 1.00 22.50 ? 255 HIS A N 1 ATOM 1891 C CA . HIS A 1 255 ? 15.461 -12.859 -18.933 1.00 20.45 ? 255 HIS A CA 1 ATOM 1892 C C . HIS A 1 255 ? 15.672 -13.171 -17.473 1.00 26.15 ? 255 HIS A C 1 ATOM 1893 O O . HIS A 1 255 ? 15.679 -14.350 -17.046 1.00 20.32 ? 255 HIS A O 1 ATOM 1894 C CB . HIS A 1 255 ? 13.987 -12.517 -19.129 1.00 20.25 ? 255 HIS A CB 1 ATOM 1895 C CG . HIS A 1 255 ? 13.706 -11.913 -20.448 1.00 25.02 ? 255 HIS A CG 1 ATOM 1896 N ND1 . HIS A 1 255 ? 13.614 -12.663 -21.603 1.00 24.77 ? 255 HIS A ND1 1 ATOM 1897 C CD2 . HIS A 1 255 ? 13.704 -10.611 -20.842 1.00 24.76 ? 255 HIS A CD2 1 ATOM 1898 C CE1 . HIS A 1 255 ? 13.464 -11.852 -22.636 1.00 26.88 ? 255 HIS A CE1 1 ATOM 1899 N NE2 . HIS A 1 255 ? 13.496 -10.605 -22.196 1.00 23.91 ? 255 HIS A NE2 1 ATOM 1900 N N . ILE A 1 256 ? 15.761 -12.114 -16.674 1.00 24.87 ? 256 ILE A N 1 ATOM 1901 C CA . ILE A 1 256 ? 15.692 -12.221 -15.227 1.00 23.82 ? 256 ILE A CA 1 ATOM 1902 C C . ILE A 1 256 ? 14.490 -11.448 -14.774 1.00 23.18 ? 256 ILE A C 1 ATOM 1903 O O . ILE A 1 256 ? 14.365 -10.291 -15.138 1.00 28.04 ? 256 ILE A O 1 ATOM 1904 C CB . ILE A 1 256 ? 16.919 -11.578 -14.563 1.00 28.42 ? 256 ILE A CB 1 ATOM 1905 C CG1 . ILE A 1 256 ? 18.230 -12.200 -15.052 1.00 28.03 ? 256 ILE A CG1 1 ATOM 1906 C CG2 . ILE A 1 256 ? 16.769 -11.562 -13.036 1.00 27.72 ? 256 ILE A CG2 1 ATOM 1907 C CD1 . ILE A 1 256 ? 18.591 -13.523 -14.469 1.00 31.01 ? 256 ILE A CD1 1 ATOM 1908 N N . LEU A 1 257 ? 13.592 -12.088 -14.030 1.00 22.70 ? 257 LEU A N 1 ATOM 1909 C CA . LEU A 1 257 ? 12.459 -11.465 -13.375 1.00 23.39 ? 257 LEU A CA 1 ATOM 1910 C C . LEU A 1 257 ? 12.739 -11.248 -11.902 1.00 29.00 ? 257 LEU A C 1 ATOM 1911 O O . LEU A 1 257 ? 13.308 -12.122 -11.208 1.00 22.94 ? 257 LEU A O 1 ATOM 1912 C CB . LEU A 1 257 ? 11.194 -12.311 -13.469 1.00 26.22 ? 257 LEU A CB 1 ATOM 1913 C CG . LEU A 1 257 ? 10.943 -13.039 -14.769 1.00 32.34 ? 257 LEU A CG 1 ATOM 1914 C CD1 . LEU A 1 257 ? 9.624 -13.822 -14.754 1.00 30.92 ? 257 LEU A CD1 1 ATOM 1915 C CD2 . LEU A 1 257 ? 11.038 -12.120 -15.957 1.00 30.72 ? 257 LEU A CD2 1 ATOM 1916 N N . THR A 1 258 ? 12.252 -10.123 -11.392 1.00 25.03 ? 258 THR A N 1 ATOM 1917 C CA . THR A 1 258 ? 12.477 -9.763 -9.980 1.00 27.50 ? 258 THR A CA 1 ATOM 1918 C C . THR A 1 258 ? 11.118 -9.464 -9.395 1.00 29.06 ? 258 THR A C 1 ATOM 1919 O O . THR A 1 258 ? 10.397 -8.603 -9.886 1.00 30.11 ? 258 THR A O 1 ATOM 1920 C CB . THR A 1 258 ? 13.434 -8.568 -9.752 1.00 31.52 ? 258 THR A CB 1 ATOM 1921 O OG1 . THR A 1 258 ? 14.722 -8.882 -10.227 1.00 28.37 ? 258 THR A OG1 1 ATOM 1922 C CG2 . THR A 1 258 ? 13.615 -8.286 -8.236 1.00 36.08 ? 258 THR A CG2 1 ATOM 1923 N N . LEU A 1 259 ? 10.723 -10.277 -8.440 1.00 28.29 ? 259 LEU A N 1 ATOM 1924 C CA . LEU A 1 259 ? 9.404 -10.208 -7.863 1.00 31.23 ? 259 LEU A CA 1 ATOM 1925 C C . LEU A 1 259 ? 9.518 -9.262 -6.660 1.00 34.50 ? 259 LEU A C 1 ATOM 1926 O O . LEU A 1 259 ? 10.518 -9.270 -5.968 1.00 35.76 ? 259 LEU A O 1 ATOM 1927 C CB . LEU A 1 259 ? 8.959 -11.596 -7.379 1.00 34.85 ? 259 LEU A CB 1 ATOM 1928 C CG . LEU A 1 259 ? 8.219 -12.511 -8.353 1.00 34.71 ? 259 LEU A CG 1 ATOM 1929 C CD1 . LEU A 1 259 ? 9.036 -12.608 -9.617 1.00 41.65 ? 259 LEU A CD1 1 ATOM 1930 C CD2 . LEU A 1 259 ? 8.036 -13.874 -7.707 1.00 37.30 ? 259 LEU A CD2 1 ATOM 1931 N N . GLY A 1 260 ? 8.504 -8.429 -6.452 1.00 40.38 ? 260 GLY A N 1 ATOM 1932 C CA . GLY A 1 260 ? 8.357 -7.657 -5.199 1.00 39.22 ? 260 GLY A CA 1 ATOM 1933 C C . GLY A 1 260 ? 7.156 -8.168 -4.438 1.00 40.08 ? 260 GLY A C 1 ATOM 1934 O O . GLY A 1 260 ? 7.178 -9.291 -3.915 1.00 47.64 ? 260 GLY A O 1 ATOM 1935 N N . GLU A 1 261 ? 6.101 -7.358 -4.391 1.00 34.54 ? 261 GLU A N 1 ATOM 1936 C CA . GLU A 1 261 ? 4.907 -7.704 -3.661 1.00 35.80 ? 261 GLU A CA 1 ATOM 1937 C C . GLU A 1 261 ? 4.003 -8.311 -4.667 1.00 33.66 ? 261 GLU A C 1 ATOM 1938 O O . GLU A 1 261 ? 4.002 -7.885 -5.816 1.00 38.31 ? 261 GLU A O 1 ATOM 1939 C CB . GLU A 1 261 ? 4.238 -6.457 -3.003 0.80 40.50 ? 261 GLU A CB 1 ATOM 1940 C CG . GLU A 1 261 ? 4.960 -5.882 -1.766 0.70 41.73 ? 261 GLU A CG 1 ATOM 1941 C CD . GLU A 1 261 ? 5.394 -6.936 -0.756 0.60 45.25 ? 261 GLU A CD 1 ATOM 1942 O OE1 . GLU A 1 261 ? 4.521 -7.560 -0.131 0.60 46.09 ? 261 GLU A OE1 1 ATOM 1943 O OE2 . GLU A 1 261 ? 6.610 -7.166 -0.587 0.60 48.17 ? 261 GLU A OE2 1 ATOM 1944 N N . PRO A 1 262 ? 3.194 -9.300 -4.248 1.00 34.98 ? 262 PRO A N 1 ATOM 1945 C CA . PRO A 1 262 ? 2.158 -9.832 -5.103 1.00 37.66 ? 262 PRO A CA 1 ATOM 1946 C C . PRO A 1 262 ? 1.163 -8.790 -5.544 1.00 44.88 ? 262 PRO A C 1 ATOM 1947 O O . PRO A 1 262 ? 0.842 -7.917 -4.786 1.00 50.04 ? 262 PRO A O 1 ATOM 1948 C CB . PRO A 1 262 ? 1.445 -10.877 -4.226 1.00 40.15 ? 262 PRO A CB 1 ATOM 1949 C CG . PRO A 1 262 ? 2.336 -11.123 -3.080 1.00 42.23 ? 262 PRO A CG 1 ATOM 1950 C CD . PRO A 1 262 ? 3.226 -9.940 -2.932 1.00 35.98 ? 262 PRO A CD 1 ATOM 1951 N N . GLY A 1 263 ? 0.607 -8.953 -6.735 1.00 47.76 ? 263 GLY A N 1 ATOM 1952 C CA . GLY A 1 263 ? -0.155 -7.912 -7.383 1.00 43.37 ? 263 GLY A CA 1 ATOM 1953 C C . GLY A 1 263 ? 0.602 -6.708 -7.925 1.00 35.92 ? 263 GLY A C 1 ATOM 1954 O O . GLY A 1 263 ? 0.024 -5.968 -8.666 1.00 45.11 ? 263 GLY A O 1 ATOM 1955 N N . GLN A 1 264 ? 1.865 -6.491 -7.580 1.00 41.64 ? 264 GLN A N 1 ATOM 1956 C CA . GLN A 1 264 ? 2.681 -5.420 -8.219 1.00 42.65 ? 264 GLN A CA 1 ATOM 1957 C C . GLN A 1 264 ? 3.380 -5.868 -9.493 1.00 45.98 ? 264 GLN A C 1 ATOM 1958 O O . GLN A 1 264 ? 3.514 -7.051 -9.755 1.00 50.19 ? 264 GLN A O 1 ATOM 1959 C CB . GLN A 1 264 ? 3.765 -4.917 -7.246 1.00 51.99 ? 264 GLN A CB 1 ATOM 1960 C CG . GLN A 1 264 ? 3.206 -4.256 -5.995 1.00 58.63 ? 264 GLN A CG 1 ATOM 1961 C CD . GLN A 1 264 ? 2.173 -3.195 -6.347 1.00 62.66 ? 264 GLN A CD 1 ATOM 1962 O OE1 . GLN A 1 264 ? 2.477 -2.209 -7.030 0.80 64.13 ? 264 GLN A OE1 1 ATOM 1963 N NE2 . GLN A 1 264 ? 0.926 -3.447 -5.980 1.00 65.36 ? 264 GLN A NE2 1 ATOM 1964 N N . ALA A 1 265 ? 3.932 -4.908 -10.218 1.00 43.00 ? 265 ALA A N 1 ATOM 1965 C CA . ALA A 1 265 ? 4.597 -5.180 -11.463 1.00 45.40 ? 265 ALA A CA 1 ATOM 1966 C C . ALA A 1 265 ? 5.890 -5.949 -11.223 1.00 38.06 ? 265 ALA A C 1 ATOM 1967 O O . ALA A 1 265 ? 6.554 -5.792 -10.213 1.00 42.63 ? 265 ALA A O 1 ATOM 1968 C CB . ALA A 1 265 ? 4.872 -3.891 -12.210 1.00 43.79 ? 265 ALA A CB 1 ATOM 1969 N N . VAL A 1 266 ? 6.171 -6.896 -12.096 1.00 36.35 ? 266 VAL A N 1 ATOM 1970 C CA . VAL A 1 266 ? 7.387 -7.686 -11.944 1.00 32.79 ? 266 VAL A CA 1 ATOM 1971 C C . VAL A 1 266 ? 8.428 -7.006 -12.796 1.00 30.96 ? 266 VAL A C 1 ATOM 1972 O O . VAL A 1 266 ? 8.194 -6.713 -13.942 1.00 33.67 ? 266 VAL A O 1 ATOM 1973 C CB . VAL A 1 266 ? 7.116 -9.158 -12.351 1.00 33.02 ? 266 VAL A CB 1 ATOM 1974 C CG1 . VAL A 1 266 ? 8.390 -9.956 -12.429 1.00 29.39 ? 266 VAL A CG1 1 ATOM 1975 C CG2 . VAL A 1 266 ? 6.209 -9.785 -11.304 1.00 33.39 ? 266 VAL A CG2 1 ATOM 1976 N N . GLN A 1 267 ? 9.591 -6.730 -12.246 1.00 30.59 ? 267 GLN A N 1 ATOM 1977 C CA . GLN A 1 267 ? 10.680 -6.232 -13.083 1.00 31.58 ? 267 GLN A CA 1 ATOM 1978 C C . GLN A 1 267 ? 11.278 -7.332 -14.009 1.00 29.13 ? 267 GLN A C 1 ATOM 1979 O O . GLN A 1 267 ? 11.634 -8.422 -13.560 1.00 31.14 ? 267 GLN A O 1 ATOM 1980 C CB . GLN A 1 267 ? 11.792 -5.647 -12.192 1.00 31.41 ? 267 GLN A CB 1 ATOM 1981 C CG . GLN A 1 267 ? 13.001 -5.171 -12.976 1.00 41.71 ? 267 GLN A CG 1 ATOM 1982 C CD . GLN A 1 267 ? 14.255 -4.974 -12.136 1.00 47.61 ? 267 GLN A CD 1 ATOM 1983 O OE1 . GLN A 1 267 ? 14.509 -5.679 -11.169 1.00 52.46 ? 267 GLN A OE1 1 ATOM 1984 N NE2 . GLN A 1 267 ? 15.060 -4.030 -12.542 1.00 55.25 ? 267 GLN A NE2 1 ATOM 1985 N N . VAL A 1 268 ? 11.586 -6.940 -15.234 1.00 24.83 ? 268 VAL A N 1 ATOM 1986 C CA . VAL A 1 268 ? 12.132 -7.804 -16.251 1.00 24.78 ? 268 VAL A CA 1 ATOM 1987 C C . VAL A 1 268 ? 13.372 -7.162 -16.797 1.00 27.03 ? 268 VAL A C 1 ATOM 1988 O O . VAL A 1 268 ? 13.331 -5.988 -17.211 1.00 29.30 ? 268 VAL A O 1 ATOM 1989 C CB . VAL A 1 268 ? 11.111 -8.018 -17.360 1.00 23.51 ? 268 VAL A CB 1 ATOM 1990 C CG1 . VAL A 1 268 ? 11.654 -8.867 -18.478 1.00 29.63 ? 268 VAL A CG1 1 ATOM 1991 C CG2 . VAL A 1 268 ? 9.867 -8.669 -16.811 1.00 24.53 ? 268 VAL A CG2 1 ATOM 1992 N N . GLN A 1 269 ? 14.493 -7.900 -16.740 1.00 21.57 ? 269 GLN A N 1 ATOM 1993 C CA . GLN A 1 269 ? 15.676 -7.553 -17.462 1.00 24.17 ? 269 GLN A CA 1 ATOM 1994 C C . GLN A 1 269 ? 16.035 -8.560 -18.537 1.00 29.15 ? 269 GLN A C 1 ATOM 1995 O O . GLN A 1 269 ? 16.155 -9.765 -18.242 1.00 25.36 ? 269 GLN A O 1 ATOM 1996 C CB . GLN A 1 269 ? 16.811 -7.496 -16.485 1.00 27.94 ? 269 GLN A CB 1 ATOM 1997 C CG . GLN A 1 269 ? 16.654 -6.327 -15.512 1.00 34.90 ? 269 GLN A CG 1 ATOM 1998 C CD . GLN A 1 269 ? 17.585 -6.487 -14.381 1.00 40.37 ? 269 GLN A CD 1 ATOM 1999 O OE1 . GLN A 1 269 ? 17.552 -7.528 -13.626 1.00 39.33 ? 269 GLN A OE1 1 ATOM 2000 N NE2 . GLN A 1 269 ? 18.575 -5.646 -14.397 1.00 41.17 ? 269 GLN A NE2 1 ATOM 2001 N N . LYS A 1 270 ? 16.419 -8.039 -19.703 1.00 25.61 ? 270 LYS A N 1 ATOM 2002 C CA . LYS A 1 270 ? 16.781 -8.856 -20.856 1.00 22.06 ? 270 LYS A CA 1 ATOM 2003 C C . LYS A 1 270 ? 18.287 -9.002 -20.964 1.00 24.20 ? 270 LYS A C 1 ATOM 2004 O O . LYS A 1 270 ? 19.059 -8.043 -21.037 1.00 23.23 ? 270 LYS A O 1 ATOM 2005 C CB . LYS A 1 270 ? 16.150 -8.287 -22.116 1.00 24.83 ? 270 LYS A CB 1 ATOM 2006 C CG . LYS A 1 270 ? 16.552 -9.055 -23.354 1.00 23.78 ? 270 LYS A CG 1 ATOM 2007 C CD . LYS A 1 270 ? 15.830 -8.596 -24.604 1.00 25.05 ? 270 LYS A CD 1 ATOM 2008 C CE . LYS A 1 270 ? 16.398 -9.288 -25.827 1.00 26.83 ? 270 LYS A CE 1 ATOM 2009 N NZ . LYS A 1 270 ? 15.900 -10.684 -26.013 1.00 26.03 ? 270 LYS A NZ 1 ATOM 2010 N N . LEU A 1 271 ? 18.726 -10.241 -20.909 1.00 22.19 ? 271 LEU A N 1 ATOM 2011 C CA . LEU A 1 271 ? 20.139 -10.559 -20.966 1.00 21.73 ? 271 LEU A CA 1 ATOM 2012 C C . LEU A 1 271 ? 20.590 -10.771 -22.372 1.00 20.69 ? 271 LEU A C 1 ATOM 2013 O O . LEU A 1 271 ? 19.777 -10.907 -23.283 1.00 24.68 ? 271 LEU A O 1 ATOM 2014 C CB . LEU A 1 271 ? 20.383 -11.851 -20.186 1.00 26.88 ? 271 LEU A CB 1 ATOM 2015 C CG . LEU A 1 271 ? 20.022 -11.836 -18.703 1.00 29.97 ? 271 LEU A CG 1 ATOM 2016 C CD1 . LEU A 1 271 ? 19.591 -13.254 -18.297 1.00 32.27 ? 271 LEU A CD1 1 ATOM 2017 C CD2 . LEU A 1 271 ? 21.207 -11.390 -17.851 1.00 29.34 ? 271 LEU A CD2 1 ATOM 2018 N N . ALA A 1 272 ? 21.898 -10.899 -22.549 1.00 23.29 ? 272 ALA A N 1 ATOM 2019 C CA . ALA A 1 272 ? 22.432 -11.438 -23.773 1.00 25.30 ? 272 ALA A CA 1 ATOM 2020 C C . ALA A 1 272 ? 21.808 -12.808 -24.071 1.00 24.87 ? 272 ALA A C 1 ATOM 2021 O O . ALA A 1 272 ? 21.584 -13.601 -23.161 1.00 26.53 ? 272 ALA A O 1 ATOM 2022 C CB . ALA A 1 272 ? 23.939 -11.603 -23.675 1.00 28.62 ? 272 ALA A CB 1 ATOM 2023 N N . ASN A 1 273 ? 21.476 -13.051 -25.328 1.00 23.57 ? 273 ASN A N 1 ATOM 2024 C CA . ASN A 1 273 ? 20.943 -14.370 -25.739 1.00 24.72 ? 273 ASN A CA 1 ATOM 2025 C C . ASN A 1 273 ? 21.931 -15.490 -25.470 1.00 25.35 ? 273 ASN A C 1 ATOM 2026 O O . ASN A 1 273 ? 23.153 -15.300 -25.502 1.00 21.69 ? 273 ASN A O 1 ATOM 2027 C CB . ASN A 1 273 ? 20.535 -14.370 -27.221 1.00 26.50 ? 273 ASN A CB 1 ATOM 2028 C CG . ASN A 1 273 ? 19.170 -13.728 -27.422 1.00 27.43 ? 273 ASN A CG 1 ATOM 2029 O OD1 . ASN A 1 273 ? 18.840 -12.747 -26.739 1.00 29.17 ? 273 ASN A OD1 1 ATOM 2030 N ND2 . ASN A 1 273 ? 18.305 -14.399 -28.158 1.00 22.48 ? 273 ASN A ND2 1 ATOM 2031 N N . GLY A 1 274 ? 21.392 -16.672 -25.184 1.00 24.19 ? 274 GLY A N 1 ATOM 2032 C CA . GLY A 1 274 ? 22.229 -17.847 -25.198 1.00 19.91 ? 274 GLY A CA 1 ATOM 2033 C C . GLY A 1 274 ? 22.759 -18.110 -26.577 1.00 22.20 ? 274 GLY A C 1 ATOM 2034 O O . GLY A 1 274 ? 22.193 -17.659 -27.551 1.00 19.53 ? 274 GLY A O 1 ATOM 2035 N N . LYS A 1 275 ? 23.794 -18.935 -26.676 1.00 21.87 ? 275 LYS A N 1 ATOM 2036 C CA . LYS A 1 275 ? 24.258 -19.334 -27.957 1.00 23.70 ? 275 LYS A CA 1 ATOM 2037 C C . LYS A 1 275 ? 23.214 -20.186 -28.708 1.00 25.63 ? 275 LYS A C 1 ATOM 2038 O O . LYS A 1 275 ? 23.077 -20.034 -29.893 1.00 20.98 ? 275 LYS A O 1 ATOM 2039 C CB . LYS A 1 275 ? 25.530 -20.126 -27.825 1.00 27.50 ? 275 LYS A CB 1 ATOM 2040 C CG . LYS A 1 275 ? 26.220 -20.414 -29.146 1.00 32.29 ? 275 LYS A CG 1 ATOM 2041 C CD . LYS A 1 275 ? 27.572 -21.019 -28.777 0.70 36.21 ? 275 LYS A CD 1 ATOM 2042 C CE . LYS A 1 275 ? 28.581 -20.854 -29.869 0.60 38.25 ? 275 LYS A CE 1 ATOM 2043 N NZ . LYS A 1 275 ? 28.238 -21.797 -30.944 0.60 36.10 ? 275 LYS A NZ 1 ATOM 2044 N N . TYR A 1 276 ? 22.460 -21.033 -28.013 1.00 22.20 ? 276 TYR A N 1 ATOM 2045 C CA . TYR A 1 276 ? 21.595 -21.964 -28.691 1.00 19.66 ? 276 TYR A CA 1 ATOM 2046 C C . TYR A 1 276 ? 20.138 -21.723 -28.356 1.00 20.54 ? 276 TYR A C 1 ATOM 2047 O O . TYR A 1 276 ? 19.727 -21.798 -27.159 1.00 19.40 ? 276 TYR A O 1 ATOM 2048 C CB . TYR A 1 276 ? 22.003 -23.395 -28.266 1.00 20.52 ? 276 TYR A CB 1 ATOM 2049 C CG . TYR A 1 276 ? 23.424 -23.704 -28.656 1.00 21.77 ? 276 TYR A CG 1 ATOM 2050 C CD1 . TYR A 1 276 ? 23.779 -23.875 -29.986 1.00 24.88 ? 276 TYR A CD1 1 ATOM 2051 C CD2 . TYR A 1 276 ? 24.400 -23.878 -27.682 1.00 23.63 ? 276 TYR A CD2 1 ATOM 2052 C CE1 . TYR A 1 276 ? 25.086 -24.194 -30.343 1.00 23.37 ? 276 TYR A CE1 1 ATOM 2053 C CE2 . TYR A 1 276 ? 25.685 -24.226 -28.006 1.00 25.18 ? 276 TYR A CE2 1 ATOM 2054 C CZ . TYR A 1 276 ? 26.028 -24.358 -29.332 1.00 26.79 ? 276 TYR A CZ 1 ATOM 2055 O OH . TYR A 1 276 ? 27.327 -24.690 -29.584 1.00 27.84 ? 276 TYR A OH 1 ATOM 2056 N N . ASN A 1 277 ? 19.327 -21.616 -29.403 1.00 18.91 ? 277 ASN A N 1 ATOM 2057 C CA . ASN A 1 277 ? 17.858 -21.530 -29.216 1.00 19.80 ? 277 ASN A CA 1 ATOM 2058 C C . ASN A 1 277 ? 17.259 -22.884 -28.894 1.00 17.02 ? 277 ASN A C 1 ATOM 2059 O O . ASN A 1 277 ? 17.714 -23.856 -29.422 1.00 20.68 ? 277 ASN A O 1 ATOM 2060 C CB . ASN A 1 277 ? 17.177 -20.855 -30.426 1.00 19.35 ? 277 ASN A CB 1 ATOM 2061 C CG . ASN A 1 277 ? 17.450 -21.565 -31.736 1.00 23.39 ? 277 ASN A CG 1 ATOM 2062 O OD1 . ASN A 1 277 ? 18.562 -21.943 -32.010 1.00 22.47 ? 277 ASN A OD1 1 ATOM 2063 N ND2 . ASN A 1 277 ? 16.410 -21.794 -32.531 1.00 21.48 ? 277 ASN A ND2 1 ATOM 2064 N N . ARG A 1 278 ? 16.346 -22.937 -27.925 1.00 19.15 ? 278 ARG A N 1 ATOM 2065 C CA . ARG A 1 278 ? 15.862 -24.187 -27.355 1.00 18.88 ? 278 ARG A CA 1 ATOM 2066 C C . ARG A 1 278 ? 14.397 -24.136 -27.056 1.00 18.76 ? 278 ARG A C 1 ATOM 2067 O O . ARG A 1 278 ? 13.918 -23.240 -26.340 1.00 23.10 ? 278 ARG A O 1 ATOM 2068 C CB . ARG A 1 278 ? 16.563 -24.510 -26.053 1.00 18.55 ? 278 ARG A CB 1 ATOM 2069 C CG . ARG A 1 278 ? 18.083 -24.622 -26.114 1.00 18.78 ? 278 ARG A CG 1 ATOM 2070 C CD . ARG A 1 278 ? 18.641 -24.791 -24.716 1.00 20.87 ? 278 ARG A CD 1 ATOM 2071 N NE . ARG A 1 278 ? 20.058 -24.471 -24.640 1.00 20.67 ? 278 ARG A NE 1 ATOM 2072 C CZ . ARG A 1 278 ? 21.052 -25.301 -24.923 1.00 20.41 ? 278 ARG A CZ 1 ATOM 2073 N NH1 . ARG A 1 278 ? 20.859 -26.620 -25.136 1.00 21.31 ? 278 ARG A NH1 1 ATOM 2074 N NH2 . ARG A 1 278 ? 22.282 -24.839 -24.817 1.00 21.06 ? 278 ARG A NH2 1 ATOM 2075 N N . GLY A 1 279 ? 13.688 -25.138 -27.544 1.00 18.05 ? 279 GLY A N 1 ATOM 2076 C CA . GLY A 1 279 ? 12.356 -25.457 -27.068 1.00 17.32 ? 279 GLY A CA 1 ATOM 2077 C C . GLY A 1 279 ? 12.322 -26.930 -26.625 1.00 18.98 ? 279 GLY A C 1 ATOM 2078 O O . GLY A 1 279 ? 13.003 -27.731 -27.229 1.00 19.76 ? 279 GLY A O 1 ATOM 2079 N N . PHE A 1 280 ? 11.653 -27.232 -25.490 1.00 17.81 ? 280 PHE A N 1 ATOM 2080 C CA . PHE A 1 280 ? 11.691 -28.551 -24.814 1.00 19.75 ? 280 PHE A CA 1 ATOM 2081 C C . PHE A 1 280 ? 13.016 -28.868 -24.085 1.00 20.33 ? 280 PHE A C 1 ATOM 2082 O O . PHE A 1 280 ? 13.199 -29.984 -23.639 1.00 20.18 ? 280 PHE A O 1 ATOM 2083 C CB . PHE A 1 280 ? 11.319 -29.717 -25.731 1.00 17.00 ? 280 PHE A CB 1 ATOM 2084 C CG . PHE A 1 280 ? 10.112 -29.466 -26.582 1.00 18.96 ? 280 PHE A CG 1 ATOM 2085 C CD1 . PHE A 1 280 ? 8.919 -29.050 -26.028 1.00 20.94 ? 280 PHE A CD1 1 ATOM 2086 C CD2 . PHE A 1 280 ? 10.160 -29.701 -27.957 1.00 20.03 ? 280 PHE A CD2 1 ATOM 2087 C CE1 . PHE A 1 280 ? 7.799 -28.847 -26.829 1.00 20.96 ? 280 PHE A CE1 1 ATOM 2088 C CE2 . PHE A 1 280 ? 9.055 -29.482 -28.751 1.00 18.63 ? 280 PHE A CE2 1 ATOM 2089 C CZ . PHE A 1 280 ? 7.891 -29.000 -28.187 1.00 19.72 ? 280 PHE A CZ 1 ATOM 2090 N N . ALA A 1 281 ? 13.741 -27.824 -23.694 1.00 20.84 ? 281 ALA A N 1 ATOM 2091 C CA . ALA A 1 281 ? 14.908 -27.944 -22.810 1.00 19.89 ? 281 ALA A CA 1 ATOM 2092 C C . ALA A 1 281 ? 14.455 -28.071 -21.360 1.00 21.16 ? 281 ALA A C 1 ATOM 2093 O O . ALA A 1 281 ? 13.266 -27.976 -21.047 1.00 19.29 ? 281 ALA A O 1 ATOM 2094 C CB . ALA A 1 281 ? 15.782 -26.731 -22.971 1.00 19.61 ? 281 ALA A CB 1 ATOM 2095 N N . ASN A 1 282 ? 15.427 -28.292 -20.498 1.00 20.03 ? 282 ASN A N 1 ATOM 2096 C CA . ASN A 1 282 ? 15.226 -28.266 -19.051 1.00 22.00 ? 282 ASN A CA 1 ATOM 2097 C C . ASN A 1 282 ? 16.287 -27.358 -18.503 1.00 18.56 ? 282 ASN A C 1 ATOM 2098 O O . ASN A 1 282 ? 17.401 -27.308 -19.040 1.00 20.69 ? 282 ASN A O 1 ATOM 2099 C CB . ASN A 1 282 ? 15.392 -29.692 -18.437 1.00 23.22 ? 282 ASN A CB 1 ATOM 2100 C CG . ASN A 1 282 ? 14.263 -30.615 -18.810 1.00 20.37 ? 282 ASN A CG 1 ATOM 2101 O OD1 . ASN A 1 282 ? 13.316 -30.746 -18.073 1.00 21.76 ? 282 ASN A OD1 1 ATOM 2102 N ND2 . ASN A 1 282 ? 14.354 -31.243 -19.983 1.00 21.72 ? 282 ASN A ND2 1 ATOM 2103 N N . ALA A 1 283 ? 15.941 -26.668 -17.435 1.00 18.88 ? 283 ALA A N 1 ATOM 2104 C CA . ALA A 1 283 ? 16.841 -25.818 -16.680 1.00 22.37 ? 283 ALA A CA 1 ATOM 2105 C C . ALA A 1 283 ? 16.900 -26.268 -15.237 1.00 21.60 ? 283 ALA A C 1 ATOM 2106 O O . ALA A 1 283 ? 15.862 -26.413 -14.588 1.00 24.41 ? 283 ALA A O 1 ATOM 2107 C CB . ALA A 1 283 ? 16.389 -24.373 -16.721 1.00 23.68 ? 283 ALA A CB 1 ATOM 2108 N N . VAL A 1 284 ? 18.119 -26.344 -14.721 1.00 18.34 ? 284 VAL A N 1 ATOM 2109 C CA . VAL A 1 284 ? 18.381 -26.851 -13.368 1.00 22.00 ? 284 VAL A CA 1 ATOM 2110 C C . VAL A 1 284 ? 19.282 -25.840 -12.605 1.00 20.21 ? 284 VAL A C 1 ATOM 2111 O O . VAL A 1 284 ? 20.359 -25.516 -13.079 1.00 20.56 ? 284 VAL A O 1 ATOM 2112 C CB . VAL A 1 284 ? 19.056 -28.217 -13.411 1.00 22.35 ? 284 VAL A CB 1 ATOM 2113 C CG1 . VAL A 1 284 ? 19.420 -28.708 -12.023 1.00 26.20 ? 284 VAL A CG1 1 ATOM 2114 C CG2 . VAL A 1 284 ? 18.147 -29.212 -14.097 1.00 24.66 ? 284 VAL A CG2 1 ATOM 2115 N N . VAL A 1 285 ? 18.794 -25.330 -11.466 1.00 21.55 ? 285 VAL A N 1 ATOM 2116 C CA . VAL A 1 285 ? 19.631 -24.524 -10.535 1.00 22.57 ? 285 VAL A CA 1 ATOM 2117 C C . VAL A 1 285 ? 20.491 -25.386 -9.595 1.00 23.67 ? 285 VAL A C 1 ATOM 2118 O O . VAL A 1 285 ? 20.059 -26.425 -9.104 1.00 23.77 ? 285 VAL A O 1 ATOM 2119 C CB . VAL A 1 285 ? 18.783 -23.515 -9.762 1.00 22.98 ? 285 VAL A CB 1 ATOM 2120 C CG1 . VAL A 1 285 ? 17.794 -24.189 -8.795 1.00 25.21 ? 285 VAL A CG1 1 ATOM 2121 C CG2 . VAL A 1 285 ? 19.705 -22.519 -9.067 1.00 26.17 ? 285 VAL A CG2 1 ATOM 2122 N N . MET A 1 286 ? 21.767 -25.072 -9.611 1.00 21.50 ? 286 MET A N 1 ATOM 2123 C CA . MET A 1 286 ? 22.756 -25.702 -8.811 1.00 23.12 ? 286 MET A CA 1 ATOM 2124 C C . MET A 1 286 ? 23.020 -24.956 -7.497 1.00 26.33 ? 286 MET A C 1 ATOM 2125 O O . MET A 1 286 ? 22.597 -23.804 -7.317 1.00 28.43 ? 286 MET A O 1 ATOM 2126 C CB . MET A 1 286 ? 24.031 -25.783 -9.598 1.00 25.48 ? 286 MET A CB 1 ATOM 2127 C CG . MET A 1 286 ? 23.930 -26.816 -10.677 1.00 26.31 ? 286 MET A CG 1 ATOM 2128 S SD . MET A 1 286 ? 25.176 -26.536 -11.928 1.00 28.67 ? 286 MET A SD 1 ATOM 2129 C CE . MET A 1 286 ? 24.376 -25.251 -12.814 1.00 28.78 ? 286 MET A CE 1 ATOM 2130 N N . PRO A 1 287 ? 23.640 -25.641 -6.532 1.00 26.73 ? 287 PRO A N 1 ATOM 2131 C CA . PRO A 1 287 ? 23.820 -25.007 -5.192 1.00 32.29 ? 287 PRO A CA 1 ATOM 2132 C C . PRO A 1 287 ? 24.605 -23.675 -5.142 1.00 27.36 ? 287 PRO A C 1 ATOM 2133 O O . PRO A 1 287 ? 24.346 -22.875 -4.256 1.00 32.19 ? 287 PRO A O 1 ATOM 2134 C CB . PRO A 1 287 ? 24.532 -26.086 -4.371 1.00 31.22 ? 287 PRO A CB 1 ATOM 2135 C CG . PRO A 1 287 ? 25.005 -27.092 -5.335 1.00 27.72 ? 287 PRO A CG 1 ATOM 2136 C CD . PRO A 1 287 ? 24.116 -27.029 -6.556 1.00 28.41 ? 287 PRO A CD 1 ATOM 2137 N N . ASP A 1 288 ? 25.454 -23.410 -6.120 1.00 28.46 ? 288 ASP A N 1 ATOM 2138 C CA . ASP A 1 288 ? 26.174 -22.128 -6.207 1.00 32.80 ? 288 ASP A CA 1 ATOM 2139 C C . ASP A 1 288 ? 25.352 -21.031 -6.905 1.00 33.80 ? 288 ASP A C 1 ATOM 2140 O O . ASP A 1 288 ? 25.852 -19.966 -7.160 1.00 37.33 ? 288 ASP A O 1 ATOM 2141 C CB . ASP A 1 288 ? 27.505 -22.320 -6.944 1.00 33.93 ? 288 ASP A CB 1 ATOM 2142 C CG . ASP A 1 288 ? 27.328 -22.881 -8.358 1.00 37.41 ? 288 ASP A CG 1 ATOM 2143 O OD1 . ASP A 1 288 ? 26.233 -23.307 -8.749 1.00 34.61 ? 288 ASP A OD1 1 ATOM 2144 O OD2 . ASP A 1 288 ? 28.287 -22.867 -9.112 1.00 39.61 ? 288 ASP A OD2 1 ATOM 2145 N N . GLY A 1 289 ? 24.123 -21.344 -7.296 1.00 31.79 ? 289 GLY A N 1 ATOM 2146 C CA . GLY A 1 289 ? 23.283 -20.419 -8.003 1.00 27.96 ? 289 GLY A CA 1 ATOM 2147 C C . GLY A 1 289 ? 23.469 -20.310 -9.508 1.00 24.40 ? 289 GLY A C 1 ATOM 2148 O O . GLY A 1 289 ? 22.704 -19.626 -10.131 1.00 27.18 ? 289 GLY A O 1 ATOM 2149 N N . LYS A 1 290 ? 24.376 -21.072 -10.107 1.00 23.86 ? 290 LYS A N 1 ATOM 2150 C CA . LYS A 1 290 ? 24.386 -21.247 -11.530 1.00 23.79 ? 290 LYS A CA 1 ATOM 2151 C C . LYS A 1 290 ? 23.198 -22.087 -12.030 1.00 23.84 ? 290 LYS A C 1 ATOM 2152 O O . LYS A 1 290 ? 22.542 -22.791 -11.262 1.00 24.08 ? 290 LYS A O 1 ATOM 2153 C CB . LYS A 1 290 ? 25.702 -21.820 -12.012 1.00 23.49 ? 290 LYS A CB 1 ATOM 2154 C CG . LYS A 1 290 ? 26.855 -20.837 -11.749 1.00 30.07 ? 290 LYS A CG 1 ATOM 2155 C CD . LYS A 1 290 ? 28.075 -21.333 -12.487 1.00 32.77 ? 290 LYS A CD 1 ATOM 2156 C CE . LYS A 1 290 ? 29.334 -20.539 -12.246 1.00 42.06 ? 290 LYS A CE 1 ATOM 2157 N NZ . LYS A 1 290 ? 29.694 -20.795 -10.852 1.00 47.70 ? 290 LYS A NZ 1 ATOM 2158 N N . ILE A 1 291 ? 22.878 -21.910 -13.308 1.00 20.31 ? 291 ILE A N 1 ATOM 2159 C CA . ILE A 1 291 ? 21.780 -22.630 -13.940 1.00 22.71 ? 291 ILE A CA 1 ATOM 2160 C C . ILE A 1 291 ? 22.289 -23.362 -15.158 1.00 23.10 ? 291 ILE A C 1 ATOM 2161 O O . ILE A 1 291 ? 23.004 -22.802 -15.979 1.00 24.60 ? 291 ILE A O 1 ATOM 2162 C CB . ILE A 1 291 ? 20.709 -21.653 -14.375 1.00 23.03 ? 291 ILE A CB 1 ATOM 2163 C CG1 . ILE A 1 291 ? 20.236 -20.922 -13.112 1.00 24.85 ? 291 ILE A CG1 1 ATOM 2164 C CG2 . ILE A 1 291 ? 19.557 -22.384 -15.098 1.00 24.01 ? 291 ILE A CG2 1 ATOM 2165 C CD1 . ILE A 1 291 ? 19.492 -19.667 -13.436 1.00 26.78 ? 291 ILE A CD1 1 ATOM 2166 N N . TRP A 1 292 ? 21.926 -24.626 -15.264 1.00 20.52 ? 292 TRP A N 1 ATOM 2167 C CA . TRP A 1 292 ? 22.370 -25.432 -16.383 1.00 19.33 ? 292 TRP A CA 1 ATOM 2168 C C . TRP A 1 292 ? 21.159 -25.633 -17.307 1.00 21.46 ? 292 TRP A C 1 ATOM 2169 O O . TRP A 1 292 ? 20.072 -25.922 -16.845 1.00 21.19 ? 292 TRP A O 1 ATOM 2170 C CB . TRP A 1 292 ? 22.890 -26.759 -15.887 1.00 19.84 ? 292 TRP A CB 1 ATOM 2171 C CG . TRP A 1 292 ? 23.567 -27.589 -16.933 1.00 20.59 ? 292 TRP A CG 1 ATOM 2172 C CD1 . TRP A 1 292 ? 24.650 -27.248 -17.663 1.00 20.05 ? 292 TRP A CD1 1 ATOM 2173 C CD2 . TRP A 1 292 ? 23.261 -28.934 -17.266 1.00 21.08 ? 292 TRP A CD2 1 ATOM 2174 N NE1 . TRP A 1 292 ? 25.082 -28.320 -18.396 1.00 22.67 ? 292 TRP A NE1 1 ATOM 2175 C CE2 . TRP A 1 292 ? 24.226 -29.365 -18.168 1.00 20.40 ? 292 TRP A CE2 1 ATOM 2176 C CE3 . TRP A 1 292 ? 22.315 -29.845 -16.806 1.00 22.69 ? 292 TRP A CE3 1 ATOM 2177 C CZ2 . TRP A 1 292 ? 24.270 -30.651 -18.628 1.00 24.24 ? 292 TRP A CZ2 1 ATOM 2178 C CZ3 . TRP A 1 292 ? 22.315 -31.078 -17.327 1.00 22.21 ? 292 TRP A CZ3 1 ATOM 2179 C CH2 . TRP A 1 292 ? 23.309 -31.497 -18.184 1.00 20.64 ? 292 TRP A CH2 1 ATOM 2180 N N . VAL A 1 293 ? 21.338 -25.341 -18.594 1.00 18.46 ? 293 VAL A N 1 ATOM 2181 C CA . VAL A 1 293 ? 20.250 -25.441 -19.553 1.00 21.64 ? 293 VAL A CA 1 ATOM 2182 C C . VAL A 1 293 ? 20.641 -26.506 -20.580 1.00 19.15 ? 293 VAL A C 1 ATOM 2183 O O . VAL A 1 293 ? 21.661 -26.394 -21.248 1.00 20.67 ? 293 VAL A O 1 ATOM 2184 C CB . VAL A 1 293 ? 19.966 -24.121 -20.288 1.00 21.29 ? 293 VAL A CB 1 ATOM 2185 C CG1 . VAL A 1 293 ? 18.729 -24.276 -21.163 1.00 22.88 ? 293 VAL A CG1 1 ATOM 2186 C CG2 . VAL A 1 293 ? 19.690 -23.005 -19.299 1.00 24.26 ? 293 VAL A CG2 1 ATOM 2187 N N . VAL A 1 294 ? 19.857 -27.566 -20.645 1.00 17.99 ? 294 VAL A N 1 ATOM 2188 C CA . VAL A 1 294 ? 20.249 -28.742 -21.423 1.00 16.55 ? 294 VAL A CA 1 ATOM 2189 C C . VAL A 1 294 ? 19.134 -29.176 -22.364 1.00 17.85 ? 294 VAL A C 1 ATOM 2190 O O . VAL A 1 294 ? 17.933 -29.175 -21.992 1.00 17.35 ? 294 VAL A O 1 ATOM 2191 C CB . VAL A 1 294 ? 20.606 -29.908 -20.496 1.00 19.96 ? 294 VAL A CB 1 ATOM 2192 C CG1 . VAL A 1 294 ? 19.479 -30.247 -19.534 1.00 20.12 ? 294 VAL A CG1 1 ATOM 2193 C CG2 . VAL A 1 294 ? 21.038 -31.132 -21.280 1.00 20.92 ? 294 VAL A CG2 1 ATOM 2194 N N . GLY A 1 295 ? 19.528 -29.557 -23.577 1.00 15.79 ? 295 GLY A N 1 ATOM 2195 C CA . GLY A 1 295 ? 18.577 -30.132 -24.517 1.00 16.53 ? 295 GLY A CA 1 ATOM 2196 C C . GLY A 1 295 ? 17.854 -29.112 -25.313 1.00 18.57 ? 295 GLY A C 1 ATOM 2197 O O . GLY A 1 295 ? 18.267 -27.906 -25.414 1.00 18.53 ? 295 GLY A O 1 ATOM 2198 N N . GLY A 1 296 ? 16.699 -29.553 -25.785 1.00 19.05 ? 296 GLY A N 1 ATOM 2199 C CA . GLY A 1 296 ? 15.843 -28.727 -26.626 1.00 19.75 ? 296 GLY A CA 1 ATOM 2200 C C . GLY A 1 296 ? 16.210 -28.745 -28.075 1.00 17.05 ? 296 GLY A C 1 ATOM 2201 O O . GLY A 1 296 ? 17.269 -29.201 -28.455 1.00 20.67 ? 296 GLY A O 1 ATOM 2202 N N . MET A 1 297 ? 15.295 -28.252 -28.883 1.00 19.43 ? 297 MET A N 1 ATOM 2203 C CA . MET A 1 297 ? 15.480 -28.210 -30.321 1.00 20.09 ? 297 MET A CA 1 ATOM 2204 C C . MET A 1 297 ? 15.163 -26.819 -30.861 1.00 20.58 ? 297 MET A C 1 ATOM 2205 O O . MET A 1 297 ? 14.560 -25.975 -30.155 1.00 19.42 ? 297 MET A O 1 ATOM 2206 C CB . MET A 1 297 ? 14.555 -29.241 -30.968 1.00 22.04 ? 297 MET A CB 1 ATOM 2207 C CG . MET A 1 297 ? 13.073 -28.927 -30.792 1.00 20.20 ? 297 MET A CG 1 ATOM 2208 S SD . MET A 1 297 ? 11.965 -30.327 -31.013 1.00 22.66 ? 297 MET A SD 1 ATOM 2209 C CE . MET A 1 297 ? 12.541 -31.050 -32.564 1.00 21.69 ? 297 MET A CE 1 ATOM 2210 N N . GLN A 1 298 ? 15.487 -26.630 -32.138 1.00 20.56 ? 298 GLN A N 1 ATOM 2211 C CA . GLN A 1 298 ? 15.308 -25.346 -32.824 1.00 24.67 ? 298 GLN A CA 1 ATOM 2212 C C . GLN A 1 298 ? 13.916 -25.203 -33.372 1.00 24.03 ? 298 GLN A C 1 ATOM 2213 O O . GLN A 1 298 ? 13.133 -24.449 -32.821 1.00 30.65 ? 298 GLN A O 1 ATOM 2214 C CB . GLN A 1 298 ? 16.336 -25.188 -33.919 1.00 22.49 ? 298 GLN A CB 1 ATOM 2215 C CG . GLN A 1 298 ? 17.723 -25.153 -33.353 1.00 29.07 ? 298 GLN A CG 1 ATOM 2216 C CD . GLN A 1 298 ? 18.760 -25.004 -34.426 1.00 32.35 ? 298 GLN A CD 1 ATOM 2217 O OE1 . GLN A 1 298 ? 19.026 -25.913 -35.160 1.00 39.94 ? 298 GLN A OE1 1 ATOM 2218 N NE2 . GLN A 1 298 ? 19.277 -23.838 -34.550 1.00 33.71 ? 298 GLN A NE2 1 ATOM 2219 N N . LYS A 1 299 ? 13.524 -26.019 -34.346 1.00 24.66 ? 299 LYS A N 1 ATOM 2220 C CA . LYS A 1 299 ? 12.125 -25.926 -34.817 1.00 23.86 ? 299 LYS A CA 1 ATOM 2221 C C . LYS A 1 299 ? 11.337 -27.002 -34.093 1.00 22.61 ? 299 LYS A C 1 ATOM 2222 O O . LYS A 1 299 ? 11.648 -28.205 -34.230 1.00 25.65 ? 299 LYS A O 1 ATOM 2223 C CB . LYS A 1 299 ? 11.944 -26.058 -36.350 1.00 30.77 ? 299 LYS A CB 1 ATOM 2224 C CG . LYS A 1 299 ? 10.423 -25.919 -36.670 1.00 36.06 ? 299 LYS A CG 1 ATOM 2225 C CD . LYS A 1 299 ? 10.047 -25.554 -38.058 0.85 38.66 ? 299 LYS A CD 1 ATOM 2226 C CE . LYS A 1 299 ? 10.394 -24.133 -38.388 0.80 37.85 ? 299 LYS A CE 1 ATOM 2227 N NZ . LYS A 1 299 ? 9.883 -23.972 -39.762 0.70 42.77 ? 299 LYS A NZ 1 ATOM 2228 N N . MET A 1 300 ? 10.293 -26.591 -33.389 1.00 18.53 ? 300 MET A N 1 ATOM 2229 C CA . MET A 1 300 ? 9.651 -27.442 -32.406 1.00 21.22 ? 300 MET A CA 1 ATOM 2230 C C . MET A 1 300 ? 8.611 -28.384 -32.996 1.00 26.38 ? 300 MET A C 1 ATOM 2231 O O . MET A 1 300 ? 7.647 -27.970 -33.615 1.00 26.95 ? 300 MET A O 1 ATOM 2232 C CB . MET A 1 300 ? 9.040 -26.575 -31.311 1.00 21.70 ? 300 MET A CB 1 ATOM 2233 C CG . MET A 1 300 ? 10.111 -25.763 -30.574 1.00 25.20 ? 300 MET A CG 1 ATOM 2234 S SD . MET A 1 300 ? 9.465 -24.413 -29.579 1.00 23.05 ? 300 MET A SD 1 ATOM 2235 C CE . MET A 1 300 ? 8.418 -25.250 -28.392 1.00 26.46 ? 300 MET A CE 1 ATOM 2236 N N . TRP A 1 301 ? 8.871 -29.683 -32.835 1.00 27.16 ? 301 TRP A N 1 ATOM 2237 C CA . TRP A 1 301 ? 7.948 -30.726 -33.194 1.00 25.67 ? 301 TRP A CA 1 ATOM 2238 C C . TRP A 1 301 ? 8.031 -31.778 -32.083 1.00 26.01 ? 301 TRP A C 1 ATOM 2239 O O . TRP A 1 301 ? 9.085 -31.914 -31.430 1.00 25.63 ? 301 TRP A O 1 ATOM 2240 C CB . TRP A 1 301 ? 8.372 -31.389 -34.531 1.00 24.90 ? 301 TRP A CB 1 ATOM 2241 C CG . TRP A 1 301 ? 8.479 -30.469 -35.670 1.00 23.86 ? 301 TRP A CG 1 ATOM 2242 C CD1 . TRP A 1 301 ? 9.606 -30.174 -36.374 1.00 30.16 ? 301 TRP A CD1 1 ATOM 2243 C CD2 . TRP A 1 301 ? 7.412 -29.737 -36.293 1.00 22.40 ? 301 TRP A CD2 1 ATOM 2244 N NE1 . TRP A 1 301 ? 9.313 -29.274 -37.376 1.00 27.80 ? 301 TRP A NE1 1 ATOM 2245 C CE2 . TRP A 1 301 ? 7.967 -29.003 -37.349 1.00 26.28 ? 301 TRP A CE2 1 ATOM 2246 C CE3 . TRP A 1 301 ? 6.037 -29.656 -36.072 1.00 27.19 ? 301 TRP A CE3 1 ATOM 2247 C CZ2 . TRP A 1 301 ? 7.190 -28.177 -38.186 1.00 26.13 ? 301 TRP A CZ2 1 ATOM 2248 C CZ3 . TRP A 1 301 ? 5.276 -28.782 -36.868 1.00 27.43 ? 301 TRP A CZ3 1 ATOM 2249 C CH2 . TRP A 1 301 ? 5.845 -28.130 -37.940 1.00 26.37 ? 301 TRP A CH2 1 ATOM 2250 N N . LEU A 1 302 ? 6.966 -32.569 -31.959 1.00 20.45 ? 302 LEU A N 1 ATOM 2251 C CA . LEU A 1 302 ? 6.874 -33.628 -30.966 1.00 22.87 ? 302 LEU A CA 1 ATOM 2252 C C . LEU A 1 302 ? 7.456 -34.930 -31.510 1.00 23.91 ? 302 LEU A C 1 ATOM 2253 O O . LEU A 1 302 ? 7.515 -35.158 -32.717 1.00 26.50 ? 302 LEU A O 1 ATOM 2254 C CB . LEU A 1 302 ? 5.442 -33.815 -30.598 1.00 24.15 ? 302 LEU A CB 1 ATOM 2255 C CG . LEU A 1 302 ? 4.678 -32.561 -30.189 1.00 27.20 ? 302 LEU A CG 1 ATOM 2256 C CD1 . LEU A 1 302 ? 3.369 -33.015 -29.557 1.00 29.10 ? 302 LEU A CD1 1 ATOM 2257 C CD2 . LEU A 1 302 ? 5.442 -31.659 -29.214 1.00 27.29 ? 302 LEU A CD2 1 ATOM 2258 N N . PHE A 1 303 ? 8.003 -35.746 -30.632 1.00 23.45 ? 303 PHE A N 1 ATOM 2259 C CA . PHE A 1 303 ? 8.486 -37.060 -31.028 1.00 24.43 ? 303 PHE A CA 1 ATOM 2260 C C . PHE A 1 303 ? 9.450 -37.003 -32.166 1.00 25.22 ? 303 PHE A C 1 ATOM 2261 O O . PHE A 1 303 ? 9.351 -37.749 -33.107 1.00 27.67 ? 303 PHE A O 1 ATOM 2262 C CB . PHE A 1 303 ? 7.293 -37.971 -31.357 1.00 27.07 ? 303 PHE A CB 1 ATOM 2263 C CG . PHE A 1 303 ? 6.201 -37.910 -30.322 1.00 25.73 ? 303 PHE A CG 1 ATOM 2264 C CD1 . PHE A 1 303 ? 6.399 -38.392 -29.060 1.00 24.70 ? 303 PHE A CD1 1 ATOM 2265 C CD2 . PHE A 1 303 ? 4.961 -37.369 -30.631 1.00 29.26 ? 303 PHE A CD2 1 ATOM 2266 C CE1 . PHE A 1 303 ? 5.401 -38.295 -28.094 1.00 27.76 ? 303 PHE A CE1 1 ATOM 2267 C CE2 . PHE A 1 303 ? 3.948 -37.272 -29.675 1.00 30.21 ? 303 PHE A CE2 1 ATOM 2268 C CZ . PHE A 1 303 ? 4.173 -37.721 -28.383 1.00 28.39 ? 303 PHE A CZ 1 ATOM 2269 N N . SER A 1 304 ? 10.402 -36.091 -32.088 1.00 21.24 ? 304 SER A N 1 ATOM 2270 C CA . SER A 1 304 ? 11.309 -35.866 -33.170 1.00 21.46 ? 304 SER A CA 1 ATOM 2271 C C . SER A 1 304 ? 12.687 -35.557 -32.638 1.00 24.16 ? 304 SER A C 1 ATOM 2272 O O . SER A 1 304 ? 12.822 -34.715 -31.728 1.00 26.96 ? 304 SER A O 1 ATOM 2273 C CB . SER A 1 304 ? 10.825 -34.644 -33.981 1.00 24.22 ? 304 SER A CB 1 ATOM 2274 O OG . SER A 1 304 ? 11.828 -34.165 -34.886 1.00 25.84 ? 304 SER A OG 1 ATOM 2275 N N . ASP A 1 305 ? 13.689 -36.145 -33.260 1.00 21.54 ? 305 ASP A N 1 ATOM 2276 C CA . ASP A 1 305 ? 15.069 -35.843 -32.972 1.00 25.63 ? 305 ASP A CA 1 ATOM 2277 C C . ASP A 1 305 ? 15.702 -34.790 -33.889 1.00 26.54 ? 305 ASP A C 1 ATOM 2278 O O . ASP A 1 305 ? 16.920 -34.645 -33.872 1.00 23.50 ? 305 ASP A O 1 ATOM 2279 C CB . ASP A 1 305 ? 15.896 -37.122 -33.097 1.00 26.63 ? 305 ASP A CB 1 ATOM 2280 C CG . ASP A 1 305 ? 15.686 -38.064 -31.924 1.00 28.19 ? 305 ASP A CG 1 ATOM 2281 O OD1 . ASP A 1 305 ? 15.026 -37.690 -30.936 1.00 29.10 ? 305 ASP A OD1 1 ATOM 2282 O OD2 . ASP A 1 305 ? 16.116 -39.228 -32.019 1.00 35.28 ? 305 ASP A OD2 1 ATOM 2283 N N . THR A 1 306 ? 14.891 -34.061 -34.661 1.00 25.90 ? 306 THR A N 1 ATOM 2284 C CA . THR A 1 306 ? 15.405 -33.051 -35.594 1.00 24.36 ? 306 THR A CA 1 ATOM 2285 C C . THR A 1 306 ? 15.865 -31.784 -34.836 1.00 27.67 ? 306 THR A C 1 ATOM 2286 O O . THR A 1 306 ? 15.485 -31.583 -33.689 1.00 24.93 ? 306 THR A O 1 ATOM 2287 C CB . THR A 1 306 ? 14.317 -32.661 -36.642 1.00 29.15 ? 306 THR A CB 1 ATOM 2288 O OG1 . THR A 1 306 ? 13.136 -32.212 -35.964 1.00 23.81 ? 306 THR A OG1 1 ATOM 2289 C CG2 . THR A 1 306 ? 13.921 -33.881 -37.508 1.00 26.65 ? 306 THR A CG2 1 ATOM 2290 N N . THR A 1 307 ? 16.689 -30.971 -35.523 1.00 25.30 ? 307 THR A N 1 ATOM 2291 C CA . THR A 1 307 ? 17.388 -29.775 -35.022 1.00 26.48 ? 307 THR A CA 1 ATOM 2292 C C . THR A 1 307 ? 17.725 -29.774 -33.520 1.00 24.65 ? 307 THR A C 1 ATOM 2293 O O . THR A 1 307 ? 17.395 -28.847 -32.829 1.00 25.61 ? 307 THR A O 1 ATOM 2294 C CB . THR A 1 307 ? 16.660 -28.456 -35.415 1.00 28.60 ? 307 THR A CB 1 ATOM 2295 O OG1 . THR A 1 307 ? 15.353 -28.365 -34.817 1.00 25.37 ? 307 THR A OG1 1 ATOM 2296 C CG2 . THR A 1 307 ? 16.484 -28.380 -36.970 1.00 34.41 ? 307 THR A CG2 1 ATOM 2297 N N . PRO A 1 308 ? 18.378 -30.840 -33.041 1.00 25.13 ? 308 PRO A N 1 ATOM 2298 C CA . PRO A 1 308 ? 18.631 -30.993 -31.622 1.00 23.26 ? 308 PRO A CA 1 ATOM 2299 C C . PRO A 1 308 ? 19.698 -30.046 -31.214 1.00 23.87 ? 308 PRO A C 1 ATOM 2300 O O . PRO A 1 308 ? 20.614 -29.833 -31.974 1.00 24.66 ? 308 PRO A O 1 ATOM 2301 C CB . PRO A 1 308 ? 19.191 -32.422 -31.539 1.00 25.56 ? 308 PRO A CB 1 ATOM 2302 C CG . PRO A 1 308 ? 19.918 -32.646 -32.862 1.00 22.43 ? 308 PRO A CG 1 ATOM 2303 C CD . PRO A 1 308 ? 18.989 -31.940 -33.841 1.00 25.01 ? 308 PRO A CD 1 ATOM 2304 N N . GLN A 1 309 ? 19.592 -29.478 -30.032 1.00 20.09 ? 309 GLN A N 1 ATOM 2305 C CA . GLN A 1 309 ? 20.703 -28.735 -29.456 1.00 21.42 ? 309 GLN A CA 1 ATOM 2306 C C . GLN A 1 309 ? 21.469 -29.676 -28.483 1.00 21.85 ? 309 GLN A C 1 ATOM 2307 O O . GLN A 1 309 ? 20.951 -30.028 -27.434 1.00 22.88 ? 309 GLN A O 1 ATOM 2308 C CB . GLN A 1 309 ? 20.146 -27.478 -28.741 1.00 23.41 ? 309 GLN A CB 1 ATOM 2309 C CG . GLN A 1 309 ? 19.398 -26.555 -29.693 1.00 23.81 ? 309 GLN A CG 1 ATOM 2310 C CD . GLN A 1 309 ? 20.353 -25.799 -30.623 1.00 24.94 ? 309 GLN A CD 1 ATOM 2311 O OE1 . GLN A 1 309 ? 21.517 -26.166 -30.755 1.00 24.79 ? 309 GLN A OE1 1 ATOM 2312 N NE2 . GLN A 1 309 ? 19.923 -24.638 -31.087 1.00 24.90 ? 309 GLN A NE2 1 ATOM 2313 N N . LEU A 1 310 ? 22.632 -30.159 -28.914 1.00 19.19 ? 310 LEU A N 1 ATOM 2314 C CA . LEU A 1 310 ? 23.383 -31.177 -28.197 1.00 21.66 ? 310 LEU A CA 1 ATOM 2315 C C . LEU A 1 310 ? 24.409 -30.577 -27.256 1.00 25.65 ? 310 LEU A C 1 ATOM 2316 O O . LEU A 1 310 ? 24.985 -31.308 -26.470 1.00 22.87 ? 310 LEU A O 1 ATOM 2317 C CB . LEU A 1 310 ? 24.091 -32.126 -29.190 1.00 23.71 ? 310 LEU A CB 1 ATOM 2318 C CG . LEU A 1 310 ? 23.145 -32.845 -30.166 1.00 22.08 ? 310 LEU A CG 1 ATOM 2319 C CD1 . LEU A 1 310 ? 23.891 -33.763 -31.151 1.00 26.76 ? 310 LEU A CD1 1 ATOM 2320 C CD2 . LEU A 1 310 ? 22.168 -33.709 -29.392 1.00 23.91 ? 310 LEU A CD2 1 ATOM 2321 N N . THR A 1 311 ? 24.585 -29.245 -27.282 1.00 22.36 ? 311 THR A N 1 ATOM 2322 C CA . THR A 1 311 ? 25.515 -28.580 -26.405 1.00 20.71 ? 311 THR A CA 1 ATOM 2323 C C . THR A 1 311 ? 24.802 -27.771 -25.349 1.00 20.98 ? 311 THR A C 1 ATOM 2324 O O . THR A 1 311 ? 24.123 -26.799 -25.663 1.00 21.44 ? 311 THR A O 1 ATOM 2325 C CB . THR A 1 311 ? 26.464 -27.669 -27.211 1.00 24.37 ? 311 THR A CB 1 ATOM 2326 O OG1 . THR A 1 311 ? 27.168 -28.475 -28.146 1.00 23.95 ? 311 THR A OG1 1 ATOM 2327 C CG2 . THR A 1 311 ? 27.486 -26.975 -26.326 1.00 23.77 ? 311 THR A CG2 1 ATOM 2328 N N . PRO A 1 312 ? 24.893 -28.203 -24.090 1.00 21.06 ? 312 PRO A N 1 ATOM 2329 C CA . PRO A 1 312 ? 24.256 -27.450 -23.046 1.00 20.51 ? 312 PRO A CA 1 ATOM 2330 C C . PRO A 1 312 ? 25.014 -26.196 -22.703 1.00 22.26 ? 312 PRO A C 1 ATOM 2331 O O . PRO A 1 312 ? 26.199 -26.085 -23.056 1.00 22.77 ? 312 PRO A O 1 ATOM 2332 C CB . PRO A 1 312 ? 24.314 -28.385 -21.842 1.00 20.36 ? 312 PRO A CB 1 ATOM 2333 C CG . PRO A 1 312 ? 24.619 -29.730 -22.382 1.00 22.19 ? 312 PRO A CG 1 ATOM 2334 C CD . PRO A 1 312 ? 25.469 -29.455 -23.559 1.00 25.13 ? 312 PRO A CD 1 ATOM 2335 N N . GLU A 1 313 ? 24.355 -25.324 -21.927 1.00 23.84 ? 313 GLU A N 1 ATOM 2336 C CA . GLU A 1 313 ? 24.982 -24.051 -21.472 1.00 21.81 ? 313 GLU A CA 1 ATOM 2337 C C . GLU A 1 313 ? 24.795 -23.814 -19.970 1.00 21.44 ? 313 GLU A C 1 ATOM 2338 O O . GLU A 1 313 ? 23.757 -24.082 -19.382 1.00 21.33 ? 313 GLU A O 1 ATOM 2339 C CB . GLU A 1 313 ? 24.430 -22.872 -22.238 1.00 22.35 ? 313 GLU A CB 1 ATOM 2340 C CG . GLU A 1 313 ? 24.816 -22.865 -23.706 1.00 26.02 ? 313 GLU A CG 1 ATOM 2341 C CD . GLU A 1 313 ? 24.116 -21.753 -24.495 1.00 28.59 ? 313 GLU A CD 1 ATOM 2342 O OE1 . GLU A 1 313 ? 22.964 -21.986 -25.007 1.00 23.82 ? 313 GLU A OE1 1 ATOM 2343 O OE2 . GLU A 1 313 ? 24.714 -20.639 -24.506 1.00 25.36 ? 313 GLU A OE2 1 ATOM 2344 N N . LEU A 1 314 ? 25.855 -23.341 -19.353 1.00 22.91 ? 314 LEU A N 1 ATOM 2345 C CA . LEU A 1 314 ? 25.841 -22.983 -17.966 1.00 25.60 ? 314 LEU A CA 1 ATOM 2346 C C . LEU A 1 314 ? 25.652 -21.477 -17.935 1.00 24.84 ? 314 LEU A C 1 ATOM 2347 O O . LEU A 1 314 ? 26.471 -20.750 -18.429 1.00 26.03 ? 314 LEU A O 1 ATOM 2348 C CB . LEU A 1 314 ? 27.200 -23.383 -17.381 1.00 26.96 ? 314 LEU A CB 1 ATOM 2349 C CG . LEU A 1 314 ? 27.483 -23.330 -15.901 1.00 32.14 ? 314 LEU A CG 1 ATOM 2350 C CD1 . LEU A 1 314 ? 26.468 -24.135 -15.141 1.00 30.26 ? 314 LEU A CD1 1 ATOM 2351 C CD2 . LEU A 1 314 ? 28.885 -23.894 -15.679 1.00 37.18 ? 314 LEU A CD2 1 ATOM 2352 N N . PHE A 1 315 ? 24.617 -21.017 -17.263 1.00 22.96 ? 315 PHE A N 1 ATOM 2353 C CA . PHE A 1 315 ? 24.426 -19.621 -17.109 1.00 25.69 ? 315 PHE A CA 1 ATOM 2354 C C . PHE A 1 315 ? 24.844 -19.221 -15.702 1.00 29.62 ? 315 PHE A C 1 ATOM 2355 O O . PHE A 1 315 ? 24.395 -19.854 -14.727 1.00 25.84 ? 315 PHE A O 1 ATOM 2356 C CB . PHE A 1 315 ? 22.966 -19.308 -17.263 1.00 25.61 ? 315 PHE A CB 1 ATOM 2357 C CG . PHE A 1 315 ? 22.643 -17.843 -17.044 1.00 25.94 ? 315 PHE A CG 1 ATOM 2358 C CD1 . PHE A 1 315 ? 23.033 -16.875 -17.982 1.00 29.89 ? 315 PHE A CD1 1 ATOM 2359 C CD2 . PHE A 1 315 ? 21.989 -17.431 -15.900 1.00 26.73 ? 315 PHE A CD2 1 ATOM 2360 C CE1 . PHE A 1 315 ? 22.721 -15.530 -17.786 1.00 30.04 ? 315 PHE A CE1 1 ATOM 2361 C CE2 . PHE A 1 315 ? 21.700 -16.088 -15.682 1.00 29.86 ? 315 PHE A CE2 1 ATOM 2362 C CZ . PHE A 1 315 ? 22.059 -15.135 -16.621 1.00 28.27 ? 315 PHE A CZ 1 ATOM 2363 N N . ASP A 1 316 ? 25.649 -18.163 -15.576 1.00 26.10 ? 316 ASP A N 1 ATOM 2364 C CA . ASP A 1 316 ? 25.987 -17.591 -14.240 1.00 24.72 ? 316 ASP A CA 1 ATOM 2365 C C . ASP A 1 316 ? 25.290 -16.224 -14.001 1.00 26.77 ? 316 ASP A C 1 ATOM 2366 O O . ASP A 1 316 ? 25.629 -15.241 -14.619 1.00 25.33 ? 316 ASP A O 1 ATOM 2367 C CB . ASP A 1 316 ? 27.491 -17.411 -14.120 1.00 31.22 ? 316 ASP A CB 1 ATOM 2368 C CG . ASP A 1 316 ? 27.922 -16.938 -12.703 1.00 27.98 ? 316 ASP A CG 1 ATOM 2369 O OD1 . ASP A 1 316 ? 27.070 -16.770 -11.818 1.00 31.72 ? 316 ASP A OD1 1 ATOM 2370 O OD2 . ASP A 1 316 ? 29.122 -16.740 -12.500 1.00 33.98 ? 316 ASP A OD2 1 ATOM 2371 N N . PRO A 1 317 ? 24.299 -16.172 -13.121 1.00 25.70 ? 317 PRO A N 1 ATOM 2372 C CA . PRO A 1 317 ? 23.625 -14.911 -12.899 1.00 26.85 ? 317 PRO A CA 1 ATOM 2373 C C . PRO A 1 317 ? 24.547 -13.799 -12.366 1.00 32.49 ? 317 PRO A C 1 ATOM 2374 O O . PRO A 1 317 ? 24.245 -12.627 -12.563 1.00 34.02 ? 317 PRO A O 1 ATOM 2375 C CB . PRO A 1 317 ? 22.526 -15.250 -11.871 1.00 29.12 ? 317 PRO A CB 1 ATOM 2376 C CG . PRO A 1 317 ? 22.346 -16.727 -11.966 1.00 26.93 ? 317 PRO A CG 1 ATOM 2377 C CD . PRO A 1 317 ? 23.680 -17.290 -12.389 1.00 28.24 ? 317 PRO A CD 1 ATOM 2378 N N . ALA A 1 318 ? 25.692 -14.135 -11.790 1.00 33.44 ? 318 ALA A N 1 ATOM 2379 C CA . ALA A 1 318 ? 26.571 -13.087 -11.253 1.00 32.94 ? 318 ALA A CA 1 ATOM 2380 C C . ALA A 1 318 ? 27.355 -12.411 -12.379 1.00 38.43 ? 318 ALA A C 1 ATOM 2381 O O . ALA A 1 318 ? 27.811 -11.299 -12.202 1.00 46.08 ? 318 ALA A O 1 ATOM 2382 C CB . ALA A 1 318 ? 27.500 -13.653 -10.216 1.00 31.71 ? 318 ALA A CB 1 ATOM 2383 N N . THR A 1 319 ? 27.512 -13.069 -13.534 1.00 32.87 ? 319 THR A N 1 ATOM 2384 C CA . THR A 1 319 ? 28.151 -12.457 -14.697 1.00 28.35 ? 319 THR A CA 1 ATOM 2385 C C . THR A 1 319 ? 27.123 -12.106 -15.813 1.00 32.33 ? 319 THR A C 1 ATOM 2386 O O . THR A 1 319 ? 27.434 -11.390 -16.743 1.00 34.38 ? 319 THR A O 1 ATOM 2387 C CB . THR A 1 319 ? 29.185 -13.400 -15.287 1.00 35.10 ? 319 THR A CB 1 ATOM 2388 O OG1 . THR A 1 319 ? 28.539 -14.623 -15.673 1.00 34.60 ? 319 THR A OG1 1 ATOM 2389 C CG2 . THR A 1 319 ? 30.271 -13.728 -14.279 1.00 39.77 ? 319 THR A CG2 1 ATOM 2390 N N . GLY A 1 320 ? 25.916 -12.646 -15.758 1.00 29.11 ? 320 GLY A N 1 ATOM 2391 C CA . GLY A 1 320 ? 24.956 -12.491 -16.880 1.00 30.78 ? 320 GLY A CA 1 ATOM 2392 C C . GLY A 1 320 ? 25.384 -13.114 -18.221 1.00 28.78 ? 320 GLY A C 1 ATOM 2393 O O . GLY A 1 320 ? 24.876 -12.749 -19.296 1.00 26.93 ? 320 GLY A O 1 ATOM 2394 N N . SER A 1 321 ? 26.233 -14.138 -18.134 1.00 21.66 ? 321 SER A N 1 ATOM 2395 C CA . SER A 1 321 ? 26.858 -14.710 -19.276 1.00 23.84 ? 321 SER A CA 1 ATOM 2396 C C . SER A 1 321 ? 26.616 -16.249 -19.252 1.00 24.44 ? 321 SER A C 1 ATOM 2397 O O . SER A 1 321 ? 26.483 -16.849 -18.180 1.00 22.22 ? 321 SER A O 1 ATOM 2398 C CB . SER A 1 321 ? 28.344 -14.390 -19.187 1.00 27.85 ? 321 SER A CB 1 ATOM 2399 O OG . SER A 1 321 ? 28.903 -14.181 -20.438 1.00 35.37 ? 321 SER A OG 1 ATOM 2400 N N . PHE A 1 322 ? 26.656 -16.849 -20.430 1.00 23.88 ? 322 PHE A N 1 ATOM 2401 C CA . PHE A 1 322 ? 26.571 -18.273 -20.657 1.00 25.22 ? 322 PHE A CA 1 ATOM 2402 C C . PHE A 1 322 ? 27.924 -18.824 -20.994 1.00 28.83 ? 322 PHE A C 1 ATOM 2403 O O . PHE A 1 322 ? 28.609 -18.212 -21.748 1.00 27.72 ? 322 PHE A O 1 ATOM 2404 C CB . PHE A 1 322 ? 25.679 -18.509 -21.879 1.00 25.31 ? 322 PHE A CB 1 ATOM 2405 C CG . PHE A 1 322 ? 24.230 -18.186 -21.626 1.00 22.67 ? 322 PHE A CG 1 ATOM 2406 C CD1 . PHE A 1 322 ? 23.394 -19.141 -21.142 1.00 21.45 ? 322 PHE A CD1 1 ATOM 2407 C CD2 . PHE A 1 322 ? 23.733 -16.936 -21.867 1.00 23.33 ? 322 PHE A CD2 1 ATOM 2408 C CE1 . PHE A 1 322 ? 22.062 -18.872 -20.924 1.00 27.55 ? 322 PHE A CE1 1 ATOM 2409 C CE2 . PHE A 1 322 ? 22.400 -16.645 -21.672 1.00 26.07 ? 322 PHE A CE2 1 ATOM 2410 C CZ . PHE A 1 322 ? 21.563 -17.600 -21.148 1.00 26.36 ? 322 PHE A CZ 1 ATOM 2411 N N . THR A 1 323 ? 28.157 -20.094 -20.679 1.00 23.07 ? 323 THR A N 1 ATOM 2412 C CA . THR A 1 323 ? 29.292 -20.838 -21.158 1.00 25.08 ? 323 THR A CA 1 ATOM 2413 C C . THR A 1 323 ? 28.824 -22.259 -21.644 1.00 26.15 ? 323 THR A C 1 ATOM 2414 O O . THR A 1 323 ? 28.161 -22.984 -20.879 1.00 25.86 ? 323 THR A O 1 ATOM 2415 C CB . THR A 1 323 ? 30.250 -21.108 -19.968 1.00 31.31 ? 323 THR A CB 1 ATOM 2416 O OG1 . THR A 1 323 ? 30.598 -19.894 -19.350 1.00 39.30 ? 323 THR A OG1 1 ATOM 2417 C CG2 . THR A 1 323 ? 31.505 -21.792 -20.400 1.00 40.58 ? 323 THR A CG2 1 ATOM 2418 N N . PRO A 1 324 ? 29.280 -22.712 -22.810 1.00 26.22 ? 324 PRO A N 1 ATOM 2419 C CA . PRO A 1 324 ? 28.951 -24.078 -23.249 1.00 26.28 ? 324 PRO A CA 1 ATOM 2420 C C . PRO A 1 324 ? 29.646 -25.113 -22.445 1.00 28.38 ? 324 PRO A C 1 ATOM 2421 O O . PRO A 1 324 ? 30.763 -24.892 -22.000 1.00 27.05 ? 324 PRO A O 1 ATOM 2422 C CB . PRO A 1 324 ? 29.469 -24.136 -24.689 1.00 31.88 ? 324 PRO A CB 1 ATOM 2423 C CG . PRO A 1 324 ? 30.473 -23.062 -24.748 1.00 36.66 ? 324 PRO A CG 1 ATOM 2424 C CD . PRO A 1 324 ? 29.943 -21.949 -23.875 1.00 29.84 ? 324 PRO A CD 1 ATOM 2425 N N . THR A 1 325 ? 28.955 -26.243 -22.241 1.00 28.26 ? 325 THR A N 1 ATOM 2426 C CA . THR A 1 325 ? 29.510 -27.370 -21.556 1.00 27.50 ? 325 THR A CA 1 ATOM 2427 C C . THR A 1 325 ? 29.614 -28.576 -22.519 1.00 28.45 ? 325 THR A C 1 ATOM 2428 O O . THR A 1 325 ? 29.346 -28.472 -23.721 1.00 26.03 ? 325 THR A O 1 ATOM 2429 C CB . THR A 1 325 ? 28.719 -27.713 -20.259 1.00 27.70 ? 325 THR A CB 1 ATOM 2430 O OG1 . THR A 1 325 ? 27.403 -28.159 -20.582 1.00 27.73 ? 325 THR A OG1 1 ATOM 2431 C CG2 . THR A 1 325 ? 28.634 -26.520 -19.315 1.00 27.47 ? 325 THR A CG2 1 ATOM 2432 N N . THR A 1 326 ? 30.091 -29.713 -22.026 1.00 28.00 ? 326 THR A N 1 ATOM 2433 C CA . THR A 1 326 ? 30.410 -30.802 -22.943 1.00 28.26 ? 326 THR A CA 1 ATOM 2434 C C . THR A 1 326 ? 29.136 -31.330 -23.594 1.00 26.53 ? 326 THR A C 1 ATOM 2435 O O . THR A 1 326 ? 28.133 -31.550 -22.899 1.00 25.41 ? 326 THR A O 1 ATOM 2436 C CB . THR A 1 326 ? 31.131 -31.956 -22.245 1.00 33.57 ? 326 THR A CB 1 ATOM 2437 O OG1 . THR A 1 326 ? 32.296 -31.424 -21.629 1.00 36.12 ? 326 THR A OG1 1 ATOM 2438 C CG2 . THR A 1 326 ? 31.538 -33.062 -23.292 1.00 33.44 ? 326 THR A CG2 1 ATOM 2439 N N . PRO A 1 327 ? 29.167 -31.496 -24.912 1.00 23.99 ? 327 PRO A N 1 ATOM 2440 C CA . PRO A 1 327 ? 28.037 -31.958 -25.705 1.00 26.75 ? 327 PRO A CA 1 ATOM 2441 C C . PRO A 1 327 ? 27.621 -33.376 -25.306 1.00 28.22 ? 327 PRO A C 1 ATOM 2442 O O . PRO A 1 327 ? 28.458 -34.148 -24.869 1.00 25.22 ? 327 PRO A O 1 ATOM 2443 C CB . PRO A 1 327 ? 28.595 -31.965 -27.125 1.00 26.44 ? 327 PRO A CB 1 ATOM 2444 C CG . PRO A 1 327 ? 29.728 -30.991 -27.116 1.00 26.86 ? 327 PRO A CG 1 ATOM 2445 C CD . PRO A 1 327 ? 30.292 -31.027 -25.753 1.00 28.19 ? 327 PRO A CD 1 ATOM 2446 N N . HIS A 1 328 ? 26.341 -33.701 -25.432 1.00 26.72 ? 328 HIS A N 1 ATOM 2447 C CA . HIS A 1 328 ? 25.887 -35.104 -25.345 1.00 24.49 ? 328 HIS A CA 1 ATOM 2448 C C . HIS A 1 328 ? 25.646 -35.563 -26.760 1.00 27.69 ? 328 HIS A C 1 ATOM 2449 O O . HIS A 1 328 ? 25.692 -34.753 -27.701 1.00 26.78 ? 328 HIS A O 1 ATOM 2450 C CB . HIS A 1 328 ? 24.633 -35.232 -24.453 1.00 25.03 ? 328 HIS A CB 1 ATOM 2451 C CG . HIS A 1 328 ? 23.538 -34.228 -24.745 1.00 24.25 ? 328 HIS A CG 1 ATOM 2452 N ND1 . HIS A 1 328 ? 23.474 -32.977 -24.150 1.00 27.23 ? 328 HIS A ND1 1 ATOM 2453 C CD2 . HIS A 1 328 ? 22.440 -34.316 -25.531 1.00 20.69 ? 328 HIS A CD2 1 ATOM 2454 C CE1 . HIS A 1 328 ? 22.391 -32.334 -24.563 1.00 19.66 ? 328 HIS A CE1 1 ATOM 2455 N NE2 . HIS A 1 328 ? 21.741 -33.131 -25.390 1.00 30.57 ? 328 HIS A NE2 1 ATOM 2456 N N . THR A 1 329 ? 25.492 -36.854 -26.969 1.00 24.54 ? 329 THR A N 1 ATOM 2457 C CA . THR A 1 329 ? 25.308 -37.372 -28.340 1.00 30.83 ? 329 THR A CA 1 ATOM 2458 C C . THR A 1 329 ? 23.860 -37.657 -28.696 1.00 26.83 ? 329 THR A C 1 ATOM 2459 O O . THR A 1 329 ? 23.497 -37.567 -29.850 1.00 28.93 ? 329 THR A O 1 ATOM 2460 C CB . THR A 1 329 ? 26.141 -38.645 -28.570 1.00 35.71 ? 329 THR A CB 1 ATOM 2461 O OG1 . THR A 1 329 ? 25.820 -39.581 -27.544 1.00 41.51 ? 329 THR A OG1 1 ATOM 2462 C CG2 . THR A 1 329 ? 27.657 -38.304 -28.493 1.00 39.57 ? 329 THR A CG2 1 ATOM 2463 N N . VAL A 1 330 ? 23.003 -37.870 -27.706 1.00 23.19 ? 330 VAL A N 1 ATOM 2464 C CA . VAL A 1 330 ? 21.594 -38.176 -27.985 1.00 23.82 ? 330 VAL A CA 1 ATOM 2465 C C . VAL A 1 330 ? 20.775 -36.894 -27.875 1.00 24.32 ? 330 VAL A C 1 ATOM 2466 O O . VAL A 1 330 ? 20.892 -36.234 -26.892 1.00 22.12 ? 330 VAL A O 1 ATOM 2467 C CB . VAL A 1 330 ? 21.101 -39.228 -26.959 1.00 29.94 ? 330 VAL A CB 1 ATOM 2468 C CG1 . VAL A 1 330 ? 19.599 -39.498 -27.100 1.00 30.83 ? 330 VAL A CG1 1 ATOM 2469 C CG2 . VAL A 1 330 ? 21.888 -40.533 -27.151 1.00 30.92 ? 330 VAL A CG2 1 ATOM 2470 N N . PRO A 1 331 ? 19.798 -36.660 -28.771 1.00 24.24 ? 331 PRO A N 1 ATOM 2471 C CA . PRO A 1 331 ? 18.919 -35.489 -28.592 1.00 22.34 ? 331 PRO A CA 1 ATOM 2472 C C . PRO A 1 331 ? 18.090 -35.599 -27.317 1.00 24.46 ? 331 PRO A C 1 ATOM 2473 O O . PRO A 1 331 ? 17.612 -36.682 -26.992 1.00 24.61 ? 331 PRO A O 1 ATOM 2474 C CB . PRO A 1 331 ? 17.979 -35.549 -29.818 1.00 23.41 ? 331 PRO A CB 1 ATOM 2475 C CG . PRO A 1 331 ? 18.798 -36.281 -30.852 1.00 29.77 ? 331 PRO A CG 1 ATOM 2476 C CD . PRO A 1 331 ? 19.497 -37.361 -30.026 1.00 28.42 ? 331 PRO A CD 1 ATOM 2477 N N . ARG A 1 332 ? 17.771 -34.461 -26.720 1.00 20.02 ? 332 ARG A N 1 ATOM 2478 C CA . ARG A 1 332 ? 16.981 -34.414 -25.526 1.00 19.67 ? 332 ARG A CA 1 ATOM 2479 C C . ARG A 1 332 ? 15.931 -33.384 -25.815 1.00 22.42 ? 332 ARG A C 1 ATOM 2480 O O . ARG A 1 332 ? 16.021 -32.197 -25.393 1.00 18.93 ? 332 ARG A O 1 ATOM 2481 C CB . ARG A 1 332 ? 17.823 -34.067 -24.283 1.00 20.55 ? 332 ARG A CB 1 ATOM 2482 C CG . ARG A 1 332 ? 18.959 -35.032 -23.920 1.00 23.80 ? 332 ARG A CG 1 ATOM 2483 C CD . ARG A 1 332 ? 18.447 -36.419 -23.531 1.00 24.75 ? 332 ARG A CD 1 ATOM 2484 N NE . ARG A 1 332 ? 19.569 -37.318 -23.288 1.00 27.30 ? 332 ARG A NE 1 ATOM 2485 C CZ . ARG A 1 332 ? 19.518 -38.650 -23.408 1.00 23.69 ? 332 ARG A CZ 1 ATOM 2486 N NH1 . ARG A 1 332 ? 18.363 -39.263 -23.725 1.00 29.72 ? 332 ARG A NH1 1 ATOM 2487 N NH2 . ARG A 1 332 ? 20.620 -39.372 -23.188 1.00 24.66 ? 332 ARG A NH2 1 ATOM 2488 N N . ASN A 1 333 ? 14.947 -33.823 -26.604 1.00 18.46 ? 333 ASN A N 1 ATOM 2489 C CA . ASN A 1 333 ? 13.936 -32.898 -27.132 1.00 20.08 ? 333 ASN A CA 1 ATOM 2490 C C . ASN A 1 333 ? 12.603 -33.089 -26.347 1.00 18.16 ? 333 ASN A C 1 ATOM 2491 O O . ASN A 1 333 ? 12.611 -33.148 -25.128 1.00 18.40 ? 333 ASN A O 1 ATOM 2492 C CB . ASN A 1 333 ? 13.745 -33.037 -28.646 1.00 19.57 ? 333 ASN A CB 1 ATOM 2493 C CG . ASN A 1 333 ? 14.981 -32.663 -29.472 1.00 19.61 ? 333 ASN A CG 1 ATOM 2494 O OD1 . ASN A 1 333 ? 15.029 -33.001 -30.655 1.00 27.22 ? 333 ASN A OD1 1 ATOM 2495 N ND2 . ASN A 1 333 ? 15.933 -31.956 -28.907 1.00 16.54 ? 333 ASN A ND2 1 ATOM 2496 N N . TYR A 1 334 ? 11.478 -33.212 -27.038 1.00 19.12 ? 334 TYR A N 1 ATOM 2497 C CA . TYR A 1 334 ? 10.208 -33.399 -26.364 1.00 19.17 ? 334 TYR A CA 1 ATOM 2498 C C . TYR A 1 334 ? 10.286 -34.605 -25.446 1.00 17.32 ? 334 TYR A C 1 ATOM 2499 O O . TYR A 1 334 ? 10.736 -35.656 -25.871 1.00 18.47 ? 334 TYR A O 1 ATOM 2500 C CB . TYR A 1 334 ? 9.073 -33.652 -27.364 1.00 19.40 ? 334 TYR A CB 1 ATOM 2501 C CG . TYR A 1 334 ? 7.708 -33.520 -26.785 1.00 19.88 ? 334 TYR A CG 1 ATOM 2502 C CD1 . TYR A 1 334 ? 7.333 -32.359 -26.097 1.00 21.08 ? 334 TYR A CD1 1 ATOM 2503 C CD2 . TYR A 1 334 ? 6.749 -34.502 -26.957 1.00 25.31 ? 334 TYR A CD2 1 ATOM 2504 C CE1 . TYR A 1 334 ? 6.057 -32.206 -25.584 1.00 24.19 ? 334 TYR A CE1 1 ATOM 2505 C CE2 . TYR A 1 334 ? 5.431 -34.321 -26.465 1.00 25.69 ? 334 TYR A CE2 1 ATOM 2506 C CZ . TYR A 1 334 ? 5.102 -33.160 -25.814 1.00 23.73 ? 334 TYR A CZ 1 ATOM 2507 O OH . TYR A 1 334 ? 3.848 -32.952 -25.329 1.00 28.82 ? 334 TYR A OH 1 ATOM 2508 N N . HIS A 1 335 ? 9.663 -34.480 -24.290 1.00 18.24 ? 335 HIS A N 1 ATOM 2509 C CA . HIS A 1 335 ? 9.661 -35.533 -23.240 1.00 21.46 ? 335 HIS A CA 1 ATOM 2510 C C . HIS A 1 335 ? 11.019 -35.884 -22.568 1.00 21.24 ? 335 HIS A C 1 ATOM 2511 O O . HIS A 1 335 ? 11.167 -36.979 -21.998 1.00 19.93 ? 335 HIS A O 1 ATOM 2512 C CB . HIS A 1 335 ? 9.054 -36.810 -23.813 1.00 23.03 ? 335 HIS A CB 1 ATOM 2513 C CG . HIS A 1 335 ? 7.585 -36.756 -23.976 1.00 20.28 ? 335 HIS A CG 1 ATOM 2514 N ND1 . HIS A 1 335 ? 6.907 -37.661 -24.753 1.00 26.41 ? 335 HIS A ND1 1 ATOM 2515 C CD2 . HIS A 1 335 ? 6.654 -35.924 -23.456 1.00 23.68 ? 335 HIS A CD2 1 ATOM 2516 C CE1 . HIS A 1 335 ? 5.619 -37.371 -24.736 1.00 24.05 ? 335 HIS A CE1 1 ATOM 2517 N NE2 . HIS A 1 335 ? 5.438 -36.347 -23.931 1.00 27.74 ? 335 HIS A NE2 1 ATOM 2518 N N . SER A 1 336 ? 12.011 -35.005 -22.730 1.00 20.92 ? 336 SER A N 1 ATOM 2519 C CA . SER A 1 336 ? 13.276 -35.084 -22.022 1.00 19.93 ? 336 SER A CA 1 ATOM 2520 C C . SER A 1 336 ? 13.136 -34.490 -20.631 1.00 20.71 ? 336 SER A C 1 ATOM 2521 O O . SER A 1 336 ? 12.232 -33.681 -20.368 1.00 21.01 ? 336 SER A O 1 ATOM 2522 C CB . SER A 1 336 ? 14.411 -34.392 -22.817 1.00 21.52 ? 336 SER A CB 1 ATOM 2523 O OG . SER A 1 336 ? 14.285 -32.965 -22.924 1.00 19.88 ? 336 SER A OG 1 ATOM 2524 N N . THR A 1 337 ? 14.018 -34.900 -19.715 1.00 20.57 ? 337 THR A N 1 ATOM 2525 C CA . THR A 1 337 ? 13.981 -34.422 -18.311 1.00 18.26 ? 337 THR A CA 1 ATOM 2526 C C . THR A 1 337 ? 15.395 -34.142 -17.818 1.00 20.53 ? 337 THR A C 1 ATOM 2527 O O . THR A 1 337 ? 16.366 -34.639 -18.412 1.00 17.00 ? 337 THR A O 1 ATOM 2528 C CB . THR A 1 337 ? 13.354 -35.465 -17.359 1.00 20.46 ? 337 THR A CB 1 ATOM 2529 O OG1 . THR A 1 337 ? 14.017 -36.740 -17.523 1.00 20.25 ? 337 THR A OG1 1 ATOM 2530 C CG2 . THR A 1 337 ? 11.871 -35.597 -17.604 1.00 19.40 ? 337 THR A CG2 1 ATOM 2531 N N . ALA A 1 338 ? 15.517 -33.234 -16.842 1.00 20.89 ? 338 ALA A N 1 ATOM 2532 C CA . ALA A 1 338 ? 16.768 -33.021 -16.130 1.00 19.66 ? 338 ALA A CA 1 ATOM 2533 C C . ALA A 1 338 ? 16.481 -32.640 -14.696 1.00 20.90 ? 338 ALA A C 1 ATOM 2534 O O . ALA A 1 338 ? 15.415 -32.121 -14.416 1.00 20.12 ? 338 ALA A O 1 ATOM 2535 C CB . ALA A 1 338 ? 17.619 -31.972 -16.799 1.00 19.18 ? 338 ALA A CB 1 ATOM 2536 N N . LEU A 1 339 ? 17.371 -32.993 -13.769 1.00 19.27 ? 339 LEU A N 1 ATOM 2537 C CA . LEU A 1 339 ? 17.067 -32.789 -12.334 1.00 20.25 ? 339 LEU A CA 1 ATOM 2538 C C . LEU A 1 339 ? 18.344 -32.812 -11.522 1.00 20.98 ? 339 LEU A C 1 ATOM 2539 O O . LEU A 1 339 ? 19.239 -33.578 -11.794 1.00 21.75 ? 339 LEU A O 1 ATOM 2540 C CB . LEU A 1 339 ? 16.116 -33.848 -11.802 1.00 21.96 ? 339 LEU A CB 1 ATOM 2541 C CG . LEU A 1 339 ? 15.268 -33.520 -10.573 1.00 23.57 ? 339 LEU A CG 1 ATOM 2542 C CD1 . LEU A 1 339 ? 14.102 -32.652 -10.980 1.00 25.00 ? 339 LEU A CD1 1 ATOM 2543 C CD2 . LEU A 1 339 ? 14.715 -34.784 -9.906 1.00 26.56 ? 339 LEU A CD2 1 ATOM 2544 N N . LEU A 1 340 ? 18.374 -31.973 -10.504 1.00 19.91 ? 340 LEU A N 1 ATOM 2545 C CA . LEU A 1 340 ? 19.498 -31.867 -9.605 1.00 21.19 ? 340 LEU A CA 1 ATOM 2546 C C . LEU A 1 340 ? 19.410 -33.014 -8.641 1.00 20.89 ? 340 LEU A C 1 ATOM 2547 O O . LEU A 1 340 ? 18.346 -33.260 -8.065 1.00 20.49 ? 340 LEU A O 1 ATOM 2548 C CB . LEU A 1 340 ? 19.440 -30.547 -8.822 1.00 21.88 ? 340 LEU A CB 1 ATOM 2549 C CG . LEU A 1 340 ? 20.656 -30.302 -7.873 1.00 23.04 ? 340 LEU A CG 1 ATOM 2550 C CD1 . LEU A 1 340 ? 21.912 -30.114 -8.669 1.00 22.85 ? 340 LEU A CD1 1 ATOM 2551 C CD2 . LEU A 1 340 ? 20.410 -29.093 -7.012 1.00 27.03 ? 340 LEU A CD2 1 ATOM 2552 N N . MET A 1 341 ? 20.539 -33.672 -8.461 1.00 22.83 ? 341 MET A N 1 ATOM 2553 C CA . MET A 1 341 ? 20.715 -34.748 -7.458 1.00 25.71 ? 341 MET A CA 1 ATOM 2554 C C . MET A 1 341 ? 21.362 -34.229 -6.152 1.00 25.57 ? 341 MET A C 1 ATOM 2555 O O . MET A 1 341 ? 22.013 -33.176 -6.128 1.00 24.27 ? 341 MET A O 1 ATOM 2556 C CB . MET A 1 341 ? 21.590 -35.806 -8.054 1.00 20.85 ? 341 MET A CB 1 ATOM 2557 C CG . MET A 1 341 ? 21.165 -36.348 -9.397 1.00 24.41 ? 341 MET A CG 1 ATOM 2558 S SD . MET A 1 341 ? 19.495 -37.025 -9.340 1.00 27.47 ? 341 MET A SD 1 ATOM 2559 C CE . MET A 1 341 ? 19.768 -38.538 -8.447 1.00 26.63 ? 341 MET A CE 1 ATOM 2560 N N . ALA A 1 342 ? 21.187 -34.963 -5.062 1.00 26.01 ? 342 ALA A N 1 ATOM 2561 C CA . ALA A 1 342 ? 21.739 -34.535 -3.761 1.00 24.74 ? 342 ALA A CA 1 ATOM 2562 C C . ALA A 1 342 ? 23.248 -34.501 -3.703 1.00 23.89 ? 342 ALA A C 1 ATOM 2563 O O . ALA A 1 342 ? 23.804 -33.795 -2.879 1.00 26.18 ? 342 ALA A O 1 ATOM 2564 C CB . ALA A 1 342 ? 21.165 -35.354 -2.592 1.00 28.68 ? 342 ALA A CB 1 ATOM 2565 N N . ASP A 1 343 ? 23.917 -35.215 -4.581 1.00 23.57 ? 343 ASP A N 1 ATOM 2566 C CA . ASP A 1 343 ? 25.371 -35.063 -4.723 1.00 25.20 ? 343 ASP A CA 1 ATOM 2567 C C . ASP A 1 343 ? 25.813 -33.962 -5.682 1.00 25.17 ? 343 ASP A C 1 ATOM 2568 O O . ASP A 1 343 ? 26.989 -33.905 -6.038 1.00 25.02 ? 343 ASP A O 1 ATOM 2569 C CB . ASP A 1 343 ? 26.004 -36.390 -5.160 1.00 27.39 ? 343 ASP A CB 1 ATOM 2570 C CG . ASP A 1 343 ? 25.673 -36.755 -6.563 1.00 33.74 ? 343 ASP A CG 1 ATOM 2571 O OD1 . ASP A 1 343 ? 24.942 -35.992 -7.244 1.00 32.54 ? 343 ASP A OD1 1 ATOM 2572 O OD2 . ASP A 1 343 ? 26.245 -37.766 -7.023 1.00 31.78 ? 343 ASP A OD2 1 ATOM 2573 N N . ALA A 1 344 ? 24.893 -33.058 -6.044 1.00 25.70 ? 344 ALA A N 1 ATOM 2574 C CA . ALA A 1 344 ? 25.210 -31.873 -6.858 1.00 24.31 ? 344 ALA A CA 1 ATOM 2575 C C . ALA A 1 344 ? 25.538 -32.186 -8.325 1.00 21.84 ? 344 ALA A C 1 ATOM 2576 O O . ALA A 1 344 ? 25.999 -31.291 -9.044 1.00 22.72 ? 344 ALA A O 1 ATOM 2577 C CB . ALA A 1 344 ? 26.386 -31.083 -6.220 1.00 26.12 ? 344 ALA A CB 1 ATOM 2578 N N . THR A 1 345 ? 25.388 -33.449 -8.751 1.00 20.90 ? 345 THR A N 1 ATOM 2579 C CA . THR A 1 345 ? 25.363 -33.788 -10.159 1.00 21.04 ? 345 THR A CA 1 ATOM 2580 C C . THR A 1 345 ? 23.959 -33.577 -10.695 1.00 20.68 ? 345 THR A C 1 ATOM 2581 O O . THR A 1 345 ? 23.040 -33.247 -9.947 1.00 24.26 ? 345 THR A O 1 ATOM 2582 C CB . THR A 1 345 ? 25.798 -35.243 -10.462 1.00 24.53 ? 345 THR A CB 1 ATOM 2583 O OG1 . THR A 1 345 ? 24.869 -36.159 -9.898 1.00 26.13 ? 345 THR A OG1 1 ATOM 2584 C CG2 . THR A 1 345 ? 27.197 -35.525 -9.901 1.00 27.14 ? 345 THR A CG2 1 ATOM 2585 N N . ILE A 1 346 ? 23.802 -33.727 -12.007 1.00 20.22 ? 346 ILE A N 1 ATOM 2586 C CA . ILE A 1 346 ? 22.549 -33.416 -12.674 1.00 20.02 ? 346 ILE A CA 1 ATOM 2587 C C . ILE A 1 346 ? 22.179 -34.490 -13.693 1.00 19.33 ? 346 ILE A C 1 ATOM 2588 O O . ILE A 1 346 ? 22.909 -34.783 -14.621 1.00 20.78 ? 346 ILE A O 1 ATOM 2589 C CB . ILE A 1 346 ? 22.531 -32.050 -13.391 1.00 21.40 ? 346 ILE A CB 1 ATOM 2590 C CG1 . ILE A 1 346 ? 22.941 -30.901 -12.465 1.00 23.92 ? 346 ILE A CG1 1 ATOM 2591 C CG2 . ILE A 1 346 ? 21.122 -31.766 -13.912 1.00 20.57 ? 346 ILE A CG2 1 ATOM 2592 C CD1 . ILE A 1 346 ? 23.084 -29.547 -13.182 1.00 25.97 ? 346 ILE A CD1 1 ATOM 2593 N N . TRP A 1 347 ? 21.026 -35.086 -13.442 1.00 20.22 ? 347 TRP A N 1 ATOM 2594 C CA . TRP A 1 347 ? 20.420 -36.039 -14.347 1.00 20.61 ? 347 TRP A CA 1 ATOM 2595 C C . TRP A 1 347 ? 20.012 -35.320 -15.614 1.00 18.35 ? 347 TRP A C 1 ATOM 2596 O O . TRP A 1 347 ? 19.389 -34.261 -15.533 1.00 19.78 ? 347 TRP A O 1 ATOM 2597 C CB . TRP A 1 347 ? 19.186 -36.657 -13.713 1.00 17.03 ? 347 TRP A CB 1 ATOM 2598 C CG . TRP A 1 347 ? 18.210 -37.267 -14.696 1.00 18.94 ? 347 TRP A CG 1 ATOM 2599 C CD1 . TRP A 1 347 ? 16.992 -36.761 -15.061 1.00 21.28 ? 347 TRP A CD1 1 ATOM 2600 C CD2 . TRP A 1 347 ? 18.396 -38.434 -15.468 1.00 18.90 ? 347 TRP A CD2 1 ATOM 2601 N NE1 . TRP A 1 347 ? 16.390 -37.570 -15.967 1.00 19.76 ? 347 TRP A NE1 1 ATOM 2602 C CE2 . TRP A 1 347 ? 17.240 -38.611 -16.241 1.00 20.69 ? 347 TRP A CE2 1 ATOM 2603 C CE3 . TRP A 1 347 ? 19.380 -39.411 -15.515 1.00 18.93 ? 347 TRP A CE3 1 ATOM 2604 C CZ2 . TRP A 1 347 ? 17.077 -39.688 -17.079 1.00 21.11 ? 347 TRP A CZ2 1 ATOM 2605 C CZ3 . TRP A 1 347 ? 19.222 -40.468 -16.380 1.00 19.45 ? 347 TRP A CZ3 1 ATOM 2606 C CH2 . TRP A 1 347 ? 18.102 -40.594 -17.150 1.00 22.80 ? 347 TRP A CH2 1 ATOM 2607 N N . SER A 1 348 ? 20.281 -35.957 -16.755 1.00 17.74 ? 348 SER A N 1 ATOM 2608 C CA . SER A 1 348 ? 19.683 -35.553 -18.041 1.00 19.96 ? 348 SER A CA 1 ATOM 2609 C C . SER A 1 348 ? 19.339 -36.822 -18.821 1.00 17.87 ? 348 SER A C 1 ATOM 2610 O O . SER A 1 348 ? 20.213 -37.649 -19.069 1.00 20.05 ? 348 SER A O 1 ATOM 2611 C CB . SER A 1 348 ? 20.704 -34.683 -18.813 1.00 19.83 ? 348 SER A CB 1 ATOM 2612 O OG . SER A 1 348 ? 20.304 -34.452 -20.139 1.00 18.56 ? 348 SER A OG 1 ATOM 2613 N N . GLY A 1 349 ? 18.113 -36.945 -19.310 1.00 17.66 ? 349 GLY A N 1 ATOM 2614 C CA . GLY A 1 349 ? 17.823 -38.057 -20.155 1.00 17.72 ? 349 GLY A CA 1 ATOM 2615 C C . GLY A 1 349 ? 16.443 -38.027 -20.739 1.00 22.07 ? 349 GLY A C 1 ATOM 2616 O O . GLY A 1 349 ? 15.723 -37.015 -20.664 1.00 18.66 ? 349 GLY A O 1 ATOM 2617 N N . GLY A 1 350 ? 16.044 -39.167 -21.294 1.00 18.01 ? 350 GLY A N 1 ATOM 2618 C CA . GLY A 1 350 ? 14.710 -39.297 -21.782 1.00 20.21 ? 350 GLY A CA 1 ATOM 2619 C C . GLY A 1 350 ? 14.537 -38.706 -23.160 1.00 20.94 ? 350 GLY A C 1 ATOM 2620 O O . GLY A 1 350 ? 15.513 -38.401 -23.860 1.00 23.79 ? 350 GLY A O 1 ATOM 2621 N N . GLY A 1 351 ? 13.286 -38.400 -23.469 1.00 25.05 ? 351 GLY A N 1 ATOM 2622 C CA . GLY A 1 351 ? 12.884 -38.066 -24.814 1.00 24.79 ? 351 GLY A CA 1 ATOM 2623 C C . GLY A 1 351 ? 12.080 -39.174 -25.502 1.00 27.29 ? 351 GLY A C 1 ATOM 2624 O O . GLY A 1 351 ? 12.376 -40.359 -25.344 1.00 29.19 ? 351 GLY A O 1 ATOM 2625 N N . GLY A 1 352 ? 11.099 -38.769 -26.309 1.00 24.90 ? 352 GLY A N 1 ATOM 2626 C CA . GLY A 1 352 ? 10.320 -39.672 -27.164 1.00 27.16 ? 352 GLY A CA 1 ATOM 2627 C C . GLY A 1 352 ? 8.990 -40.084 -26.553 1.00 27.53 ? 352 GLY A C 1 ATOM 2628 O O . GLY A 1 352 ? 8.119 -39.244 -26.292 1.00 31.63 ? 352 GLY A O 1 ATOM 2629 N N . LEU A 1 353 ? 8.879 -41.377 -26.266 1.00 27.17 ? 353 LEU A N 1 ATOM 2630 C CA . LEU A 1 353 ? 7.640 -42.072 -25.806 1.00 24.64 ? 353 LEU A CA 1 ATOM 2631 C C . LEU A 1 353 ? 6.622 -42.200 -26.941 1.00 27.09 ? 353 LEU A C 1 ATOM 2632 O O . LEU A 1 353 ? 5.527 -41.701 -26.870 1.00 33.15 ? 353 LEU A O 1 ATOM 2633 C CB . LEU A 1 353 ? 7.031 -41.485 -24.539 1.00 26.51 ? 353 LEU A CB 1 ATOM 2634 C CG . LEU A 1 353 ? 6.143 -42.492 -23.790 1.00 26.35 ? 353 LEU A CG 1 ATOM 2635 C CD1 . LEU A 1 353 ? 6.955 -43.613 -23.118 1.00 32.75 ? 353 LEU A CD1 1 ATOM 2636 C CD2 . LEU A 1 353 ? 5.232 -41.829 -22.784 1.00 27.43 ? 353 LEU A CD2 1 ATOM 2637 N N . CYS A 1 354 ? 7.030 -42.862 -28.016 1.00 31.64 ? 354 CYS A N 1 ATOM 2638 C CA . CYS A 1 354 ? 6.242 -42.864 -29.247 1.00 38.19 ? 354 CYS A CA 1 ATOM 2639 C C . CYS A 1 354 ? 5.990 -44.274 -29.812 1.00 35.97 ? 354 CYS A C 1 ATOM 2640 O O . CYS A 1 354 ? 5.749 -44.406 -30.971 1.00 40.77 ? 354 CYS A O 1 ATOM 2641 C CB . CYS A 1 354 ? 6.951 -41.985 -30.279 1.00 37.01 ? 354 CYS A CB 1 ATOM 2642 S SG . CYS A 1 354 ? 8.752 -42.158 -30.346 1.00 42.54 ? 354 CYS A SG 1 ATOM 2643 N N . GLY A 1 355 ? 6.111 -45.323 -29.007 1.00 38.49 ? 355 GLY A N 1 ATOM 2644 C CA . GLY A 1 355 ? 5.695 -46.671 -29.419 1.00 37.03 ? 355 GLY A CA 1 ATOM 2645 C C . GLY A 1 355 ? 6.857 -47.626 -29.595 1.00 37.07 ? 355 GLY A C 1 ATOM 2646 O O . GLY A 1 355 ? 8.023 -47.207 -29.630 1.00 34.61 ? 355 GLY A O 1 ATOM 2647 N N . ALA A 1 356 ? 6.537 -48.912 -29.801 1.00 42.18 ? 356 ALA A N 1 ATOM 2648 C CA . ALA A 1 356 ? 7.557 -49.953 -30.009 1.00 42.43 ? 356 ALA A CA 1 ATOM 2649 C C . ALA A 1 356 ? 8.286 -49.765 -31.326 1.00 44.64 ? 356 ALA A C 1 ATOM 2650 O O . ALA A 1 356 ? 7.681 -49.411 -32.335 1.00 55.50 ? 356 ALA A O 1 ATOM 2651 C CB . ALA A 1 356 ? 6.902 -51.326 -29.962 1.00 52.61 ? 356 ALA A CB 1 ATOM 2652 N N . ASN A 1 357 ? 9.596 -49.960 -31.320 1.00 55.45 ? 357 ASN A N 1 ATOM 2653 C CA . ASN A 1 357 ? 10.444 -49.679 -32.501 1.00 65.95 ? 357 ASN A CA 1 ATOM 2654 C C . ASN A 1 357 ? 10.341 -48.241 -33.042 1.00 60.91 ? 357 ASN A C 1 ATOM 2655 O O . ASN A 1 357 ? 10.368 -48.045 -34.250 1.00 64.25 ? 357 ASN A O 1 ATOM 2656 C CB . ASN A 1 357 ? 10.149 -50.666 -33.659 1.00 75.81 ? 357 ASN A CB 1 ATOM 2657 C CG . ASN A 1 357 ? 9.763 -52.052 -33.172 1.00 78.08 ? 357 ASN A CG 1 ATOM 2658 O OD1 . ASN A 1 357 ? 10.439 -52.643 -32.318 1.00 68.91 ? 357 ASN A OD1 1 ATOM 2659 N ND2 . ASN A 1 357 ? 8.645 -52.561 -33.688 1.00 70.28 ? 357 ASN A ND2 1 ATOM 2660 N N . CYS A 1 358 ? 10.175 -47.253 -32.163 1.00 52.43 ? 358 CYS A N 1 ATOM 2661 C CA . CYS A 1 358 ? 10.274 -45.843 -32.539 1.00 41.44 ? 358 CYS A CA 1 ATOM 2662 C C . CYS A 1 358 ? 11.722 -45.431 -32.253 1.00 38.83 ? 358 CYS A C 1 ATOM 2663 O O . CYS A 1 358 ? 12.185 -45.502 -31.102 1.00 40.30 ? 358 CYS A O 1 ATOM 2664 C CB . CYS A 1 358 ? 9.287 -45.023 -31.695 1.00 53.22 ? 358 CYS A CB 1 ATOM 2665 S SG . CYS A 1 358 ? 9.225 -43.263 -32.111 1.00 45.29 ? 358 CYS A SG 1 ATOM 2666 N N . LYS A 1 359 ? 12.463 -45.019 -33.280 1.00 34.18 ? 359 LYS A N 1 ATOM 2667 C CA . LYS A 1 359 ? 13.839 -44.626 -33.081 1.00 33.68 ? 359 LYS A CA 1 ATOM 2668 C C . LYS A 1 359 ? 13.980 -43.291 -32.287 1.00 33.25 ? 359 LYS A C 1 ATOM 2669 O O . LYS A 1 359 ? 15.054 -42.996 -31.775 1.00 33.21 ? 359 LYS A O 1 ATOM 2670 C CB . LYS A 1 359 ? 14.650 -44.655 -34.383 1.00 37.24 ? 359 LYS A CB 1 ATOM 2671 C CG . LYS A 1 359 ? 14.330 -43.561 -35.381 0.70 43.47 ? 359 LYS A CG 1 ATOM 2672 C CD . LYS A 1 359 ? 14.742 -43.955 -36.801 0.60 42.90 ? 359 LYS A CD 1 ATOM 2673 C CE . LYS A 1 359 ? 14.070 -43.049 -37.816 0.50 45.23 ? 359 LYS A CE 1 ATOM 2674 N NZ . LYS A 1 359 ? 14.255 -41.616 -37.440 0.50 46.25 ? 359 LYS A NZ 1 ATOM 2675 N N . GLU A 1 360 ? 12.873 -42.598 -32.017 1.00 33.24 ? 360 GLU A N 1 ATOM 2676 C CA . GLU A 1 360 ? 12.935 -41.368 -31.216 1.00 30.76 ? 360 GLU A CA 1 ATOM 2677 C C . GLU A 1 360 ? 12.768 -41.635 -29.719 1.00 30.03 ? 360 GLU A C 1 ATOM 2678 O O . GLU A 1 360 ? 12.906 -40.700 -28.933 1.00 29.51 ? 360 GLU A O 1 ATOM 2679 C CB . GLU A 1 360 ? 11.917 -40.332 -31.707 1.00 33.19 ? 360 GLU A CB 1 ATOM 2680 C CG . GLU A 1 360 ? 12.357 -39.600 -32.994 1.00 33.61 ? 360 GLU A CG 1 ATOM 2681 C CD . GLU A 1 360 ? 12.067 -40.422 -34.223 1.00 37.70 ? 360 GLU A CD 1 ATOM 2682 O OE1 . GLU A 1 360 ? 11.043 -41.115 -34.193 1.00 41.17 ? 360 GLU A OE1 1 ATOM 2683 O OE2 . GLU A 1 360 ? 12.904 -40.483 -35.133 1.00 44.31 ? 360 GLU A OE2 1 ATOM 2684 N N . ASN A 1 361 ? 12.507 -42.895 -29.317 1.00 27.68 ? 361 ASN A N 1 ATOM 2685 C CA . ASN A 1 361 ? 12.464 -43.266 -27.887 1.00 32.39 ? 361 ASN A CA 1 ATOM 2686 C C . ASN A 1 361 ? 13.847 -43.266 -27.308 1.00 28.27 ? 361 ASN A C 1 ATOM 2687 O O . ASN A 1 361 ? 14.719 -43.955 -27.818 1.00 30.64 ? 361 ASN A O 1 ATOM 2688 C CB . ASN A 1 361 ? 11.908 -44.657 -27.651 1.00 32.28 ? 361 ASN A CB 1 ATOM 2689 C CG . ASN A 1 361 ? 10.422 -44.717 -27.728 1.00 36.85 ? 361 ASN A CG 1 ATOM 2690 O OD1 . ASN A 1 361 ? 9.700 -43.816 -27.257 1.00 33.27 ? 361 ASN A OD1 1 ATOM 2691 N ND2 . ASN A 1 361 ? 9.931 -45.855 -28.213 1.00 37.03 ? 361 ASN A ND2 1 ATOM 2692 N N . HIS A 1 362 ? 14.055 -42.530 -26.226 1.00 24.71 ? 362 HIS A N 1 ATOM 2693 C CA . HIS A 1 362 ? 15.358 -42.542 -25.553 1.00 24.53 ? 362 HIS A CA 1 ATOM 2694 C C . HIS A 1 362 ? 15.134 -42.927 -24.115 1.00 28.63 ? 362 HIS A C 1 ATOM 2695 O O . HIS A 1 362 ? 14.729 -42.086 -23.301 1.00 28.65 ? 362 HIS A O 1 ATOM 2696 C CB . HIS A 1 362 ? 16.023 -41.188 -25.650 1.00 27.69 ? 362 HIS A CB 1 ATOM 2697 C CG . HIS A 1 362 ? 16.243 -40.739 -27.050 1.00 29.38 ? 362 HIS A CG 1 ATOM 2698 N ND1 . HIS A 1 362 ? 16.955 -41.479 -27.957 1.00 30.68 ? 362 HIS A ND1 1 ATOM 2699 C CD2 . HIS A 1 362 ? 15.769 -39.667 -27.726 1.00 30.76 ? 362 HIS A CD2 1 ATOM 2700 C CE1 . HIS A 1 362 ? 16.953 -40.867 -29.129 1.00 32.46 ? 362 HIS A CE1 1 ATOM 2701 N NE2 . HIS A 1 362 ? 16.190 -39.793 -29.025 1.00 33.61 ? 362 HIS A NE2 1 ATOM 2702 N N . PHE A 1 363 ? 15.411 -44.205 -23.803 1.00 25.43 ? 363 PHE A N 1 ATOM 2703 C CA . PHE A 1 363 ? 15.313 -44.744 -22.448 1.00 21.98 ? 363 PHE A CA 1 ATOM 2704 C C . PHE A 1 363 ? 16.487 -44.323 -21.588 1.00 20.13 ? 363 PHE A C 1 ATOM 2705 O O . PHE A 1 363 ? 16.485 -44.532 -20.376 1.00 23.27 ? 363 PHE A O 1 ATOM 2706 C CB . PHE A 1 363 ? 15.282 -46.304 -22.493 1.00 22.79 ? 363 PHE A CB 1 ATOM 2707 C CG . PHE A 1 363 ? 14.070 -46.875 -23.124 1.00 22.81 ? 363 PHE A CG 1 ATOM 2708 C CD1 . PHE A 1 363 ? 13.957 -46.955 -24.499 1.00 32.23 ? 363 PHE A CD1 1 ATOM 2709 C CD2 . PHE A 1 363 ? 13.008 -47.271 -22.351 1.00 26.48 ? 363 PHE A CD2 1 ATOM 2710 C CE1 . PHE A 1 363 ? 12.807 -47.438 -25.083 1.00 29.82 ? 363 PHE A CE1 1 ATOM 2711 C CE2 . PHE A 1 363 ? 11.894 -47.825 -22.915 1.00 28.12 ? 363 PHE A CE2 1 ATOM 2712 C CZ . PHE A 1 363 ? 11.791 -47.913 -24.283 1.00 31.46 ? 363 PHE A CZ 1 ATOM 2713 N N . ASP A 1 364 ? 17.503 -43.742 -22.191 1.00 23.25 ? 364 ASP A N 1 ATOM 2714 C CA . ASP A 1 364 ? 18.740 -43.542 -21.521 1.00 24.14 ? 364 ASP A CA 1 ATOM 2715 C C . ASP A 1 364 ? 18.876 -42.090 -20.969 1.00 25.49 ? 364 ASP A C 1 ATOM 2716 O O . ASP A 1 364 ? 18.014 -41.229 -21.163 1.00 23.24 ? 364 ASP A O 1 ATOM 2717 C CB . ASP A 1 364 ? 19.873 -43.910 -22.460 1.00 29.83 ? 364 ASP A CB 1 ATOM 2718 C CG . ASP A 1 364 ? 20.058 -42.903 -23.590 1.00 38.18 ? 364 ASP A CG 1 ATOM 2719 O OD1 . ASP A 1 364 ? 19.034 -42.506 -24.193 1.00 34.60 ? 364 ASP A OD1 1 ATOM 2720 O OD2 . ASP A 1 364 ? 21.192 -42.372 -23.719 0.80 44.98 ? 364 ASP A OD2 1 ATOM 2721 N N . GLY A 1 365 ? 19.953 -41.905 -20.223 1.00 20.98 ? 365 GLY A N 1 ATOM 2722 C CA . GLY A 1 365 ? 20.437 -40.635 -19.769 1.00 23.10 ? 365 GLY A CA 1 ATOM 2723 C C . GLY A 1 365 ? 21.751 -40.808 -19.064 1.00 23.07 ? 365 GLY A C 1 ATOM 2724 O O . GLY A 1 365 ? 22.396 -41.871 -19.165 1.00 23.48 ? 365 GLY A O 1 ATOM 2725 N N . GLN A 1 366 ? 22.226 -39.706 -18.501 1.00 25.25 ? 366 GLN A N 1 ATOM 2726 C CA . GLN A 1 366 ? 23.519 -39.634 -17.824 1.00 26.19 ? 366 GLN A CA 1 ATOM 2727 C C . GLN A 1 366 ? 23.451 -38.542 -16.812 1.00 24.87 ? 366 GLN A C 1 ATOM 2728 O O . GLN A 1 366 ? 22.559 -37.690 -16.859 1.00 22.57 ? 366 GLN A O 1 ATOM 2729 C CB . GLN A 1 366 ? 24.648 -39.226 -18.751 1.00 31.54 ? 366 GLN A CB 1 ATOM 2730 C CG . GLN A 1 366 ? 24.630 -39.814 -20.098 1.00 40.47 ? 366 GLN A CG 1 ATOM 2731 C CD . GLN A 1 366 ? 25.808 -39.317 -20.919 1.00 33.32 ? 366 GLN A CD 1 ATOM 2732 O OE1 . GLN A 1 366 ? 26.964 -39.582 -20.635 1.00 33.63 ? 366 GLN A OE1 1 ATOM 2733 N NE2 . GLN A 1 366 ? 25.488 -38.629 -21.955 1.00 28.23 ? 366 GLN A NE2 1 ATOM 2734 N N . PHE A 1 367 ? 24.397 -38.574 -15.890 1.00 22.40 ? 367 PHE A N 1 ATOM 2735 C CA . PHE A 1 367 ? 24.508 -37.567 -14.871 1.00 22.55 ? 367 PHE A CA 1 ATOM 2736 C C . PHE A 1 367 ? 25.702 -36.691 -15.236 1.00 29.65 ? 367 PHE A C 1 ATOM 2737 O O . PHE A 1 367 ? 26.808 -37.187 -15.533 1.00 27.23 ? 367 PHE A O 1 ATOM 2738 C CB . PHE A 1 367 ? 24.721 -38.199 -13.489 1.00 28.33 ? 367 PHE A CB 1 ATOM 2739 C CG . PHE A 1 367 ? 23.563 -39.011 -13.013 1.00 25.44 ? 367 PHE A CG 1 ATOM 2740 C CD1 . PHE A 1 367 ? 23.430 -40.340 -13.389 1.00 31.08 ? 367 PHE A CD1 1 ATOM 2741 C CD2 . PHE A 1 367 ? 22.568 -38.442 -12.295 1.00 22.41 ? 367 PHE A CD2 1 ATOM 2742 C CE1 . PHE A 1 367 ? 22.341 -41.099 -12.988 1.00 26.03 ? 367 PHE A CE1 1 ATOM 2743 C CE2 . PHE A 1 367 ? 21.466 -39.209 -11.874 1.00 26.25 ? 367 PHE A CE2 1 ATOM 2744 C CZ . PHE A 1 367 ? 21.348 -40.523 -12.249 1.00 23.39 ? 367 PHE A CZ 1 ATOM 2745 N N . TRP A 1 368 ? 25.481 -35.386 -15.192 1.00 24.59 ? 368 TRP A N 1 ATOM 2746 C CA . TRP A 1 368 ? 26.518 -34.433 -15.508 1.00 26.42 ? 368 TRP A CA 1 ATOM 2747 C C . TRP A 1 368 ? 27.072 -33.851 -14.215 1.00 25.36 ? 368 TRP A C 1 ATOM 2748 O O . TRP A 1 368 ? 26.326 -33.387 -13.319 1.00 21.88 ? 368 TRP A O 1 ATOM 2749 C CB . TRP A 1 368 ? 25.964 -33.320 -16.413 1.00 25.66 ? 368 TRP A CB 1 ATOM 2750 C CG . TRP A 1 368 ? 26.947 -32.325 -16.810 1.00 20.27 ? 368 TRP A CG 1 ATOM 2751 C CD1 . TRP A 1 368 ? 28.030 -32.541 -17.611 1.00 21.63 ? 368 TRP A CD1 1 ATOM 2752 C CD2 . TRP A 1 368 ? 27.038 -30.972 -16.357 1.00 18.73 ? 368 TRP A CD2 1 ATOM 2753 N NE1 . TRP A 1 368 ? 28.751 -31.387 -17.730 1.00 23.40 ? 368 TRP A NE1 1 ATOM 2754 C CE2 . TRP A 1 368 ? 28.175 -30.410 -16.968 1.00 20.10 ? 368 TRP A CE2 1 ATOM 2755 C CE3 . TRP A 1 368 ? 26.230 -30.155 -15.542 1.00 20.92 ? 368 TRP A CE3 1 ATOM 2756 C CZ2 . TRP A 1 368 ? 28.540 -29.092 -16.788 1.00 21.67 ? 368 TRP A CZ2 1 ATOM 2757 C CZ3 . TRP A 1 368 ? 26.584 -28.854 -15.363 1.00 23.59 ? 368 TRP A CZ3 1 ATOM 2758 C CH2 . TRP A 1 368 ? 27.754 -28.331 -15.962 1.00 22.93 ? 368 TRP A CH2 1 ATOM 2759 N N . SER A 1 369 ? 28.376 -33.989 -14.093 1.00 22.54 ? 369 SER A N 1 ATOM 2760 C CA . SER A 1 369 ? 29.142 -33.410 -12.964 1.00 25.08 ? 369 SER A CA 1 ATOM 2761 C C . SER A 1 369 ? 29.604 -32.004 -13.307 1.00 21.90 ? 369 SER A C 1 ATOM 2762 O O . SER A 1 369 ? 30.386 -31.863 -14.219 1.00 20.84 ? 369 SER A O 1 ATOM 2763 C CB . SER A 1 369 ? 30.393 -34.264 -12.710 1.00 20.96 ? 369 SER A CB 1 ATOM 2764 O OG . SER A 1 369 ? 30.030 -35.517 -12.195 1.00 23.37 ? 369 SER A OG 1 ATOM 2765 N N . PRO A 1 370 ? 29.083 -30.968 -12.626 1.00 23.54 ? 370 PRO A N 1 ATOM 2766 C CA . PRO A 1 370 ? 29.490 -29.613 -13.017 1.00 27.46 ? 370 PRO A CA 1 ATOM 2767 C C . PRO A 1 370 ? 30.966 -29.279 -12.639 1.00 31.59 ? 370 PRO A C 1 ATOM 2768 O O . PRO A 1 370 ? 31.568 -30.017 -11.841 1.00 28.29 ? 370 PRO A O 1 ATOM 2769 C CB . PRO A 1 370 ? 28.539 -28.701 -12.217 1.00 25.50 ? 370 PRO A CB 1 ATOM 2770 C CG . PRO A 1 370 ? 27.366 -29.558 -11.908 1.00 25.12 ? 370 PRO A CG 1 ATOM 2771 C CD . PRO A 1 370 ? 27.944 -30.950 -11.701 1.00 24.46 ? 370 PRO A CD 1 ATOM 2772 N N . PRO A 1 371 ? 31.520 -28.149 -13.163 1.00 30.29 ? 371 PRO A N 1 ATOM 2773 C CA . PRO A 1 371 ? 32.913 -27.693 -12.839 1.00 31.33 ? 371 PRO A CA 1 ATOM 2774 C C . PRO A 1 371 ? 33.241 -27.668 -11.348 1.00 31.20 ? 371 PRO A C 1 ATOM 2775 O O . PRO A 1 371 ? 34.306 -28.110 -10.942 1.00 33.09 ? 371 PRO A O 1 ATOM 2776 C CB . PRO A 1 371 ? 32.980 -26.279 -13.453 1.00 33.23 ? 371 PRO A CB 1 ATOM 2777 C CG . PRO A 1 371 ? 31.956 -26.324 -14.554 1.00 34.64 ? 371 PRO A CG 1 ATOM 2778 C CD . PRO A 1 371 ? 30.842 -27.201 -14.062 1.00 29.69 ? 371 PRO A CD 1 ATOM 2779 N N . TYR A 1 372 ? 32.271 -27.322 -10.513 1.00 31.08 ? 372 TYR A N 1 ATOM 2780 C CA . TYR A 1 372 ? 32.554 -27.239 -9.092 1.00 29.02 ? 372 TYR A CA 1 ATOM 2781 C C . TYR A 1 372 ? 32.931 -28.579 -8.440 1.00 32.79 ? 372 TYR A C 1 ATOM 2782 O O . TYR A 1 372 ? 33.368 -28.599 -7.288 1.00 31.46 ? 372 TYR A O 1 ATOM 2783 C CB . TYR A 1 372 ? 31.436 -26.549 -8.308 1.00 31.79 ? 372 TYR A CB 1 ATOM 2784 C CG . TYR A 1 372 ? 30.026 -27.127 -8.434 1.00 29.77 ? 372 TYR A CG 1 ATOM 2785 C CD1 . TYR A 1 372 ? 29.777 -28.507 -8.386 1.00 33.62 ? 372 TYR A CD1 1 ATOM 2786 C CD2 . TYR A 1 372 ? 28.936 -26.276 -8.521 1.00 29.47 ? 372 TYR A CD2 1 ATOM 2787 C CE1 . TYR A 1 372 ? 28.463 -29.009 -8.416 1.00 29.96 ? 372 TYR A CE1 1 ATOM 2788 C CE2 . TYR A 1 372 ? 27.633 -26.755 -8.601 1.00 27.80 ? 372 TYR A CE2 1 ATOM 2789 C CZ . TYR A 1 372 ? 27.403 -28.131 -8.562 1.00 28.18 ? 372 TYR A CZ 1 ATOM 2790 O OH . TYR A 1 372 ? 26.118 -28.602 -8.721 1.00 22.16 ? 372 TYR A OH 1 ATOM 2791 N N . LEU A 1 373 ? 32.779 -29.692 -9.147 1.00 33.48 ? 373 LEU A N 1 ATOM 2792 C CA . LEU A 1 373 ? 33.207 -30.980 -8.601 1.00 32.62 ? 373 LEU A CA 1 ATOM 2793 C C . LEU A 1 373 ? 34.669 -31.327 -8.962 1.00 37.98 ? 373 LEU A C 1 ATOM 2794 O O . LEU A 1 373 ? 35.164 -32.414 -8.615 1.00 35.51 ? 373 LEU A O 1 ATOM 2795 C CB . LEU A 1 373 ? 32.264 -32.105 -9.063 1.00 32.71 ? 373 LEU A CB 1 ATOM 2796 C CG . LEU A 1 373 ? 30.840 -32.049 -8.485 1.00 29.14 ? 373 LEU A CG 1 ATOM 2797 C CD1 . LEU A 1 373 ? 30.033 -33.289 -8.837 1.00 25.74 ? 373 LEU A CD1 1 ATOM 2798 C CD2 . LEU A 1 373 ? 30.908 -31.929 -7.000 1.00 27.93 ? 373 LEU A CD2 1 ATOM 2799 N N . PHE A 1 374 ? 35.324 -30.460 -9.730 1.00 37.07 ? 374 PHE A N 1 ATOM 2800 C CA . PHE A 1 374 ? 36.669 -30.749 -10.217 1.00 35.31 ? 374 PHE A CA 1 ATOM 2801 C C . PHE A 1 374 ? 37.642 -29.653 -9.798 1.00 44.70 ? 374 PHE A C 1 ATOM 2802 O O . PHE A 1 374 ? 37.229 -28.536 -9.463 1.00 37.53 ? 374 PHE A O 1 ATOM 2803 C CB . PHE A 1 374 ? 36.671 -30.881 -11.727 1.00 36.44 ? 374 PHE A CB 1 ATOM 2804 C CG . PHE A 1 374 ? 35.849 -32.024 -12.202 1.00 37.67 ? 374 PHE A CG 1 ATOM 2805 C CD1 . PHE A 1 374 ? 36.358 -33.319 -12.189 1.00 40.92 ? 374 PHE A CD1 1 ATOM 2806 C CD2 . PHE A 1 374 ? 34.525 -31.838 -12.518 1.00 38.73 ? 374 PHE A CD2 1 ATOM 2807 C CE1 . PHE A 1 374 ? 35.569 -34.390 -12.553 1.00 33.31 ? 374 PHE A CE1 1 ATOM 2808 C CE2 . PHE A 1 374 ? 33.732 -32.913 -12.904 1.00 38.68 ? 374 PHE A CE2 1 ATOM 2809 C CZ . PHE A 1 374 ? 34.249 -34.183 -12.908 1.00 35.44 ? 374 PHE A CZ 1 ATOM 2810 N N . GLU A 1 375 ? 38.930 -29.998 -9.777 1.00 49.60 ? 375 GLU A N 1 ATOM 2811 C CA . GLU A 1 375 ? 39.995 -29.037 -9.472 1.00 56.41 ? 375 GLU A CA 1 ATOM 2812 C C . GLU A 1 375 ? 40.233 -28.189 -10.697 1.00 53.34 ? 375 GLU A C 1 ATOM 2813 O O . GLU A 1 375 ? 39.572 -28.399 -11.709 1.00 42.87 ? 375 GLU A O 1 ATOM 2814 C CB . GLU A 1 375 ? 41.256 -29.767 -9.014 1.00 57.86 ? 375 GLU A CB 1 ATOM 2815 C CG . GLU A 1 375 ? 41.031 -30.416 -7.659 1.00 64.86 ? 375 GLU A CG 1 ATOM 2816 C CD . GLU A 1 375 ? 42.233 -31.179 -7.147 0.80 71.49 ? 375 GLU A CD 1 ATOM 2817 O OE1 . GLU A 1 375 ? 42.097 -31.876 -6.108 0.80 58.11 ? 375 GLU A OE1 1 ATOM 2818 O OE2 . GLU A 1 375 ? 43.303 -31.076 -7.781 0.80 62.66 ? 375 GLU A OE2 1 ATOM 2819 N N . ALA A 1 376 ? 41.113 -27.192 -10.588 1.00 59.81 ? 376 ALA A N 1 ATOM 2820 C CA . ALA A 1 376 ? 41.267 -26.159 -11.628 1.00 58.51 ? 376 ALA A CA 1 ATOM 2821 C C . ALA A 1 376 ? 41.629 -26.713 -13.023 1.00 58.99 ? 376 ALA A C 1 ATOM 2822 O O . ALA A 1 376 ? 41.274 -26.127 -14.044 1.00 59.27 ? 376 ALA A O 1 ATOM 2823 C CB . ALA A 1 376 ? 42.294 -25.134 -11.181 1.00 60.21 ? 376 ALA A CB 1 ATOM 2824 N N . ASP A 1 377 ? 42.282 -27.870 -13.057 1.00 59.97 ? 377 ASP A N 1 ATOM 2825 C CA . ASP A 1 377 ? 42.536 -28.603 -14.306 1.00 64.61 ? 377 ASP A CA 1 ATOM 2826 C C . ASP A 1 377 ? 41.279 -29.186 -14.985 1.00 65.34 ? 377 ASP A C 1 ATOM 2827 O O . ASP A 1 377 ? 41.378 -29.797 -16.052 1.00 58.60 ? 377 ASP A O 1 ATOM 2828 C CB . ASP A 1 377 ? 43.516 -29.750 -14.025 1.00 64.89 ? 377 ASP A CB 1 ATOM 2829 C CG . ASP A 1 377 ? 42.895 -30.871 -13.202 1.00 72.64 ? 377 ASP A CG 1 ATOM 2830 O OD1 . ASP A 1 377 ? 41.851 -30.635 -12.549 1.00 73.21 ? 377 ASP A OD1 1 ATOM 2831 O OD2 . ASP A 1 377 ? 43.441 -31.998 -13.214 1.00 68.58 ? 377 ASP A OD2 1 ATOM 2832 N N . GLY A 1 378 ? 40.139 -29.138 -14.295 1.00 64.79 ? 378 GLY A N 1 ATOM 2833 C CA . GLY A 1 378 ? 38.862 -29.593 -14.854 1.00 69.02 ? 378 GLY A CA 1 ATOM 2834 C C . GLY A 1 378 ? 38.672 -31.082 -15.118 1.00 64.73 ? 378 GLY A C 1 ATOM 2835 O O . GLY A 1 378 ? 37.722 -31.478 -15.789 1.00 56.91 ? 378 GLY A O 1 ATOM 2836 N N . VAL A 1 379 ? 39.519 -31.913 -14.528 1.00 58.71 ? 379 VAL A N 1 ATOM 2837 C CA . VAL A 1 379 ? 39.489 -33.354 -14.770 1.00 58.92 ? 379 VAL A CA 1 ATOM 2838 C C . VAL A 1 379 ? 39.725 -34.187 -13.481 1.00 58.26 ? 379 VAL A C 1 ATOM 2839 O O . VAL A 1 379 ? 39.232 -35.308 -13.371 1.00 56.83 ? 379 VAL A O 1 ATOM 2840 C CB . VAL A 1 379 ? 40.487 -33.730 -15.889 1.00 59.49 ? 379 VAL A CB 1 ATOM 2841 C CG1 . VAL A 1 379 ? 41.893 -33.254 -15.537 1.00 59.82 ? 379 VAL A CG1 1 ATOM 2842 C CG2 . VAL A 1 379 ? 40.465 -35.227 -16.182 1.00 59.43 ? 379 VAL A CG2 1 ATOM 2843 N N . THR A 1 380 ? 40.416 -33.622 -12.492 1.00 53.25 ? 380 THR A N 1 ATOM 2844 C CA . THR A 1 380 ? 40.622 -34.288 -11.212 1.00 50.08 ? 380 THR A CA 1 ATOM 2845 C C . THR A 1 380 ? 39.518 -33.950 -10.190 1.00 44.16 ? 380 THR A C 1 ATOM 2846 O O . THR A 1 380 ? 39.277 -32.788 -9.866 1.00 39.40 ? 380 THR A O 1 ATOM 2847 C CB . THR A 1 380 ? 41.998 -33.894 -10.632 1.00 56.25 ? 380 THR A CB 1 ATOM 2848 O OG1 . THR A 1 380 ? 43.015 -34.234 -11.588 1.00 50.98 ? 380 THR A OG1 1 ATOM 2849 C CG2 . THR A 1 380 ? 42.273 -34.620 -9.299 1.00 53.31 ? 380 THR A CG2 1 ATOM 2850 N N . PRO A 1 381 ? 38.870 -34.975 -9.658 1.00 35.89 ? 381 PRO A N 1 ATOM 2851 C CA . PRO A 1 381 ? 37.753 -34.747 -8.747 1.00 43.53 ? 381 PRO A CA 1 ATOM 2852 C C . PRO A 1 381 ? 38.226 -34.115 -7.456 1.00 52.70 ? 381 PRO A C 1 ATOM 2853 O O . PRO A 1 381 ? 39.174 -34.605 -6.853 1.00 52.16 ? 381 PRO A O 1 ATOM 2854 C CB . PRO A 1 381 ? 37.197 -36.148 -8.484 1.00 38.23 ? 381 PRO A CB 1 ATOM 2855 C CG . PRO A 1 381 ? 37.682 -36.982 -9.624 1.00 40.92 ? 381 PRO A CG 1 ATOM 2856 C CD . PRO A 1 381 ? 38.945 -36.367 -10.136 1.00 43.63 ? 381 PRO A CD 1 ATOM 2857 N N . ALA A 1 382 ? 37.608 -33.010 -7.064 1.00 46.16 ? 382 ALA A N 1 ATOM 2858 C CA . ALA A 1 382 ? 38.034 -32.305 -5.866 1.00 48.98 ? 382 ALA A CA 1 ATOM 2859 C C . ALA A 1 382 ? 37.515 -32.991 -4.604 1.00 55.84 ? 382 ALA A C 1 ATOM 2860 O O . ALA A 1 382 ? 36.519 -33.739 -4.626 1.00 47.78 ? 382 ALA A O 1 ATOM 2861 C CB . ALA A 1 382 ? 37.571 -30.860 -5.912 1.00 50.36 ? 382 ALA A CB 1 ATOM 2862 N N . LYS A 1 383 ? 38.196 -32.742 -3.497 1.00 50.93 ? 383 LYS A N 1 ATOM 2863 C CA . LYS A 1 383 ? 37.733 -33.232 -2.221 1.00 52.79 ? 383 LYS A CA 1 ATOM 2864 C C . LYS A 1 383 ? 36.513 -32.416 -1.826 1.00 40.48 ? 383 LYS A C 1 ATOM 2865 O O . LYS A 1 383 ? 36.473 -31.217 -2.039 1.00 49.08 ? 383 LYS A O 1 ATOM 2866 C CB . LYS A 1 383 ? 38.834 -33.107 -1.146 1.00 54.34 ? 383 LYS A CB 1 ATOM 2867 C CG . LYS A 1 383 ? 39.973 -34.095 -1.297 0.30 55.19 ? 383 LYS A CG 1 ATOM 2868 C CD . LYS A 1 383 ? 40.887 -34.053 -0.084 0.40 55.61 ? 383 LYS A CD 1 ATOM 2869 C CE . LYS A 1 383 ? 42.319 -33.888 -0.534 1.00 60.01 ? 383 LYS A CE 1 ATOM 2870 N NZ . LYS A 1 383 ? 42.665 -34.926 -1.544 0.40 57.53 ? 383 LYS A NZ 1 ATOM 2871 N N . ARG A 1 384 ? 35.604 -33.071 -1.122 1.00 47.94 ? 384 ARG A N 1 ATOM 2872 C CA . ARG A 1 384 ? 34.296 -32.562 -0.846 1.00 48.80 ? 384 ARG A CA 1 ATOM 2873 C C . ARG A 1 384 ? 34.137 -32.471 0.646 1.00 40.36 ? 384 ARG A C 1 ATOM 2874 O O . ARG A 1 384 ? 34.383 -33.447 1.324 1.00 44.63 ? 384 ARG A O 1 ATOM 2875 C CB . ARG A 1 384 ? 33.245 -33.538 -1.397 1.00 42.81 ? 384 ARG A CB 1 ATOM 2876 C CG . ARG A 1 384 ? 33.282 -33.723 -2.918 1.00 49.18 ? 384 ARG A CG 1 ATOM 2877 C CD . ARG A 1 384 ? 32.030 -34.402 -3.483 1.00 43.36 ? 384 ARG A CD 1 ATOM 2878 N NE . ARG A 1 384 ? 30.863 -33.509 -3.415 1.00 46.37 ? 384 ARG A NE 1 ATOM 2879 C CZ . ARG A 1 384 ? 29.716 -33.697 -4.066 1.00 30.61 ? 384 ARG A CZ 1 ATOM 2880 N NH1 . ARG A 1 384 ? 29.578 -34.700 -4.901 1.00 30.94 ? 384 ARG A NH1 1 ATOM 2881 N NH2 . ARG A 1 384 ? 28.738 -32.824 -3.930 1.00 35.99 ? 384 ARG A NH2 1 ATOM 2882 N N . PRO A 1 385 ? 33.619 -31.344 1.147 1.00 39.21 ? 385 PRO A N 1 ATOM 2883 C CA . PRO A 1 385 ? 33.265 -31.203 2.567 1.00 35.19 ? 385 PRO A CA 1 ATOM 2884 C C . PRO A 1 385 ? 32.126 -32.117 2.958 1.00 41.80 ? 385 PRO A C 1 ATOM 2885 O O . PRO A 1 385 ? 31.523 -32.798 2.078 1.00 40.10 ? 385 PRO A O 1 ATOM 2886 C CB . PRO A 1 385 ? 32.806 -29.740 2.675 1.00 41.23 ? 385 PRO A CB 1 ATOM 2887 C CG . PRO A 1 385 ? 32.512 -29.289 1.283 1.00 40.65 ? 385 PRO A CG 1 ATOM 2888 C CD . PRO A 1 385 ? 33.402 -30.086 0.393 1.00 44.46 ? 385 PRO A CD 1 ATOM 2889 N N . VAL A 1 386 ? 31.838 -32.164 4.251 1.00 39.02 ? 386 VAL A N 1 ATOM 2890 C CA . VAL A 1 386 ? 30.818 -33.083 4.766 1.00 44.50 ? 386 VAL A CA 1 ATOM 2891 C C . VAL A 1 386 ? 30.020 -32.410 5.852 1.00 48.29 ? 386 VAL A C 1 ATOM 2892 O O . VAL A 1 386 ? 30.581 -31.926 6.818 1.00 51.22 ? 386 VAL A O 1 ATOM 2893 C CB . VAL A 1 386 ? 31.422 -34.383 5.362 1.00 47.51 ? 386 VAL A CB 1 ATOM 2894 C CG1 . VAL A 1 386 ? 30.351 -35.148 6.131 1.00 51.25 ? 386 VAL A CG1 1 ATOM 2895 C CG2 . VAL A 1 386 ? 32.058 -35.277 4.284 1.00 46.55 ? 386 VAL A CG2 1 ATOM 2896 N N . ILE A 1 387 ? 28.701 -32.447 5.732 1.00 45.28 ? 387 ILE A N 1 ATOM 2897 C CA . ILE A 1 387 ? 27.852 -32.140 6.863 1.00 48.02 ? 387 ILE A CA 1 ATOM 2898 C C . ILE A 1 387 ? 27.683 -33.403 7.732 1.00 50.31 ? 387 ILE A C 1 ATOM 2899 O O . ILE A 1 387 ? 27.211 -34.434 7.260 1.00 52.17 ? 387 ILE A O 1 ATOM 2900 C CB . ILE A 1 387 ? 26.484 -31.620 6.419 1.00 45.71 ? 387 ILE A CB 1 ATOM 2901 C CG1 . ILE A 1 387 ? 26.660 -30.380 5.542 1.00 44.43 ? 387 ILE A CG1 1 ATOM 2902 C CG2 . ILE A 1 387 ? 25.602 -31.349 7.633 1.00 47.21 ? 387 ILE A CG2 1 ATOM 2903 C CD1 . ILE A 1 387 ? 25.408 -30.009 4.779 1.00 49.76 ? 387 ILE A CD1 1 ATOM 2904 N N . GLN A 1 388 ? 28.089 -33.314 9.003 1.00 50.72 ? 388 GLN A N 1 ATOM 2905 C CA . GLN A 1 388 ? 27.940 -34.438 9.928 1.00 49.41 ? 388 GLN A CA 1 ATOM 2906 C C . GLN A 1 388 ? 26.526 -34.526 10.435 1.00 50.36 ? 388 GLN A C 1 ATOM 2907 O O . GLN A 1 388 ? 25.963 -35.631 10.500 1.00 46.27 ? 388 GLN A O 1 ATOM 2908 C CB . GLN A 1 388 ? 28.883 -34.309 11.094 1.00 54.95 ? 388 GLN A CB 1 ATOM 2909 C CG . GLN A 1 388 ? 30.299 -34.113 10.608 1.00 65.94 ? 388 GLN A CG 1 ATOM 2910 C CD . GLN A 1 388 ? 31.319 -34.624 11.593 1.00 69.64 ? 388 GLN A CD 1 ATOM 2911 O OE1 . GLN A 1 388 ? 32.167 -35.452 11.247 1.00 63.53 ? 388 GLN A OE1 1 ATOM 2912 N NE2 . GLN A 1 388 ? 31.265 -34.108 12.820 1.00 66.51 ? 388 GLN A NE2 1 ATOM 2913 N N . SER A 1 389 ? 25.953 -33.365 10.758 1.00 43.32 ? 389 SER A N 1 ATOM 2914 C CA . SER A 1 389 ? 24.673 -33.323 11.426 1.00 50.70 ? 389 SER A CA 1 ATOM 2915 C C . SER A 1 389 ? 24.000 -31.987 11.161 1.00 44.06 ? 389 SER A C 1 ATOM 2916 O O . SER A 1 389 ? 24.638 -30.958 10.962 1.00 39.37 ? 389 SER A O 1 ATOM 2917 C CB . SER A 1 389 ? 24.858 -33.515 12.962 1.00 47.55 ? 389 SER A CB 1 ATOM 2918 O OG . SER A 1 389 ? 25.218 -32.275 13.607 1.00 53.18 ? 389 SER A OG 1 ATOM 2919 N N . LEU A 1 390 ? 22.688 -32.017 11.276 1.00 49.93 ? 390 LEU A N 1 ATOM 2920 C CA . LEU A 1 390 ? 21.934 -30.835 11.519 1.00 52.19 ? 390 LEU A CA 1 ATOM 2921 C C . LEU A 1 390 ? 21.327 -30.866 12.945 1.00 49.73 ? 390 LEU A C 1 ATOM 2922 O O . LEU A 1 390 ? 20.825 -31.912 13.386 1.00 50.14 ? 390 LEU A O 1 ATOM 2923 C CB . LEU A 1 390 ? 20.840 -30.729 10.437 1.00 53.20 ? 390 LEU A CB 1 ATOM 2924 C CG . LEU A 1 390 ? 21.289 -30.705 8.961 1.00 47.98 ? 390 LEU A CG 1 ATOM 2925 C CD1 . LEU A 1 390 ? 20.076 -30.577 8.049 1.00 49.71 ? 390 LEU A CD1 1 ATOM 2926 C CD2 . LEU A 1 390 ? 22.264 -29.570 8.715 1.00 44.84 ? 390 LEU A CD2 1 ATOM 2927 N N . SER A 1 391 ? 21.257 -29.690 13.576 1.00 50.64 ? 391 SER A N 1 ATOM 2928 C CA . SER A 1 391 ? 20.619 -29.534 14.873 1.00 46.28 ? 391 SER A CA 1 ATOM 2929 C C . SER A 1 391 ? 19.153 -29.994 14.811 1.00 54.63 ? 391 SER A C 1 ATOM 2930 O O . SER A 1 391 ? 18.669 -30.735 15.716 1.00 52.88 ? 391 SER A O 1 ATOM 2931 C CB . SER A 1 391 ? 20.669 -28.071 15.320 1.00 51.20 ? 391 SER A CB 1 ATOM 2932 O OG . SER A 1 391 ? 19.457 -27.336 15.019 1.00 55.56 ? 391 SER A OG 1 ATOM 2933 N N . ASP A 1 392 ? 18.463 -29.488 13.776 1.00 45.20 ? 392 ASP A N 1 ATOM 2934 C CA . ASP A 1 392 ? 17.039 -29.763 13.491 1.00 48.98 ? 392 ASP A CA 1 ATOM 2935 C C . ASP A 1 392 ? 16.834 -30.142 12.021 1.00 44.41 ? 392 ASP A C 1 ATOM 2936 O O . ASP A 1 392 ? 17.564 -29.686 11.137 1.00 44.39 ? 392 ASP A O 1 ATOM 2937 C CB . ASP A 1 392 ? 16.184 -28.521 13.770 1.00 51.75 ? 392 ASP A CB 1 ATOM 2938 C CG . ASP A 1 392 ? 16.036 -28.226 15.240 0.70 63.89 ? 392 ASP A CG 1 ATOM 2939 O OD1 . ASP A 1 392 ? 17.000 -27.681 15.837 0.60 65.07 ? 392 ASP A OD1 1 ATOM 2940 O OD2 . ASP A 1 392 ? 14.946 -28.534 15.778 0.70 68.05 ? 392 ASP A OD2 1 ATOM 2941 N N . THR A 1 393 ? 15.822 -30.946 11.751 1.00 41.89 ? 393 THR A N 1 ATOM 2942 C CA . THR A 1 393 ? 15.549 -31.378 10.377 1.00 42.70 ? 393 THR A CA 1 ATOM 2943 C C . THR A 1 393 ? 14.131 -31.056 9.969 1.00 43.31 ? 393 THR A C 1 ATOM 2944 O O . THR A 1 393 ? 13.763 -31.302 8.834 1.00 35.12 ? 393 THR A O 1 ATOM 2945 C CB . THR A 1 393 ? 15.815 -32.894 10.172 1.00 42.95 ? 393 THR A CB 1 ATOM 2946 O OG1 . THR A 1 393 ? 14.948 -33.678 11.011 1.00 40.37 ? 393 THR A OG1 1 ATOM 2947 C CG2 . THR A 1 393 ? 17.254 -33.223 10.464 1.00 38.20 ? 393 THR A CG2 1 ATOM 2948 N N . ALA A 1 394 ? 13.345 -30.492 10.883 1.00 34.16 ? 394 ALA A N 1 ATOM 2949 C CA . ALA A 1 394 ? 12.006 -30.027 10.583 1.00 37.00 ? 394 ALA A CA 1 ATOM 2950 C C . ALA A 1 394 ? 11.850 -28.696 11.259 1.00 41.79 ? 394 ALA A C 1 ATOM 2951 O O . ALA A 1 394 ? 11.628 -28.663 12.463 1.00 45.29 ? 394 ALA A O 1 ATOM 2952 C CB . ALA A 1 394 ? 10.962 -31.002 11.101 1.00 37.23 ? 394 ALA A CB 1 ATOM 2953 N N . VAL A 1 395 ? 12.120 -27.605 10.543 1.00 47.22 ? 395 VAL A N 1 ATOM 2954 C CA . VAL A 1 395 ? 12.095 -26.278 11.147 1.00 44.05 ? 395 VAL A CA 1 ATOM 2955 C C . VAL A 1 395 ? 11.039 -25.384 10.528 1.00 44.15 ? 395 VAL A C 1 ATOM 2956 O O . VAL A 1 395 ? 10.553 -25.654 9.440 1.00 41.71 ? 395 VAL A O 1 ATOM 2957 C CB . VAL A 1 395 ? 13.481 -25.641 11.150 1.00 52.48 ? 395 VAL A CB 1 ATOM 2958 C CG1 . VAL A 1 395 ? 14.465 -26.638 11.708 1.00 60.66 ? 395 VAL A CG1 1 ATOM 2959 C CG2 . VAL A 1 395 ? 13.912 -25.211 9.769 1.00 53.20 ? 395 VAL A CG2 1 ATOM 2960 N N . ARG A 1 396 ? 10.607 -24.390 11.297 1.00 43.14 ? 396 ARG A N 1 ATOM 2961 C CA . ARG A 1 396 ? 9.574 -23.456 10.878 1.00 45.36 ? 396 ARG A CA 1 ATOM 2962 C C . ARG A 1 396 ? 10.284 -22.339 10.130 1.00 42.33 ? 396 ARG A C 1 ATOM 2963 O O . ARG A 1 396 ? 11.520 -22.238 10.190 1.00 39.63 ? 396 ARG A O 1 ATOM 2964 C CB . ARG A 1 396 ? 8.803 -22.887 12.093 1.00 51.10 ? 396 ARG A CB 1 ATOM 2965 C CG . ARG A 1 396 ? 7.551 -23.669 12.493 0.85 53.33 ? 396 ARG A CG 1 ATOM 2966 C CD . ARG A 1 396 ? 6.607 -22.823 13.352 0.70 61.81 ? 396 ARG A CD 1 ATOM 2967 N NE . ARG A 1 396 ? 5.212 -23.288 13.307 0.60 63.83 ? 396 ARG A NE 1 ATOM 2968 C CZ . ARG A 1 396 ? 4.178 -22.629 12.767 0.60 69.71 ? 396 ARG A CZ 1 ATOM 2969 N NH1 . ARG A 1 396 ? 2.967 -23.181 12.794 0.60 69.44 ? 396 ARG A NH1 1 ATOM 2970 N NH2 . ARG A 1 396 ? 4.330 -21.438 12.184 0.60 67.15 ? 396 ARG A NH2 1 ATOM 2971 N N . ALA A 1 397 ? 9.502 -21.500 9.439 1.00 42.54 ? 397 ALA A N 1 ATOM 2972 C CA . ALA A 1 397 ? 10.034 -20.315 8.762 1.00 47.43 ? 397 ALA A CA 1 ATOM 2973 C C . ALA A 1 397 ? 10.679 -19.403 9.799 1.00 50.44 ? 397 ALA A C 1 ATOM 2974 O O . ALA A 1 397 ? 10.116 -19.219 10.860 1.00 55.49 ? 397 ALA A O 1 ATOM 2975 C CB . ALA A 1 397 ? 8.923 -19.583 8.014 1.00 47.87 ? 397 ALA A CB 1 ATOM 2976 N N . GLY A 1 398 ? 11.871 -18.882 9.532 1.00 49.41 ? 398 GLY A N 1 ATOM 2977 C CA . GLY A 1 398 ? 12.573 -18.040 10.504 1.00 46.82 ? 398 GLY A CA 1 ATOM 2978 C C . GLY A 1 398 ? 13.542 -18.847 11.360 1.00 48.15 ? 398 GLY A C 1 ATOM 2979 O O . GLY A 1 398 ? 14.603 -18.353 11.726 1.00 54.20 ? 398 GLY A O 1 ATOM 2980 N N . ALA A 1 399 ? 13.214 -20.104 11.657 1.00 49.39 ? 399 ALA A N 1 ATOM 2981 C CA . ALA A 1 399 ? 13.957 -20.856 12.690 1.00 44.71 ? 399 ALA A CA 1 ATOM 2982 C C . ALA A 1 399 ? 15.398 -21.125 12.290 1.00 48.34 ? 399 ALA A C 1 ATOM 2983 O O . ALA A 1 399 ? 15.704 -21.199 11.099 1.00 43.29 ? 399 ALA A O 1 ATOM 2984 C CB . ALA A 1 399 ? 13.246 -22.163 13.045 1.00 51.35 ? 399 ALA A CB 1 ATOM 2985 N N . PRO A 1 400 ? 16.307 -21.187 13.287 1.00 58.22 ? 400 PRO A N 1 ATOM 2986 C CA . PRO A 1 400 ? 17.722 -21.455 13.026 1.00 49.69 ? 400 PRO A CA 1 ATOM 2987 C C . PRO A 1 400 ? 17.985 -22.938 12.868 1.00 45.24 ? 400 PRO A C 1 ATOM 2988 O O . PRO A 1 400 ? 17.193 -23.775 13.306 1.00 53.58 ? 400 PRO A O 1 ATOM 2989 C CB . PRO A 1 400 ? 18.415 -20.942 14.293 1.00 55.28 ? 400 PRO A CB 1 ATOM 2990 C CG . PRO A 1 400 ? 17.387 -21.120 15.360 1.00 52.72 ? 400 PRO A CG 1 ATOM 2991 C CD . PRO A 1 400 ? 16.077 -20.814 14.702 1.00 58.44 ? 400 PRO A CD 1 ATOM 2992 N N . ILE A 1 401 ? 19.086 -23.252 12.211 1.00 51.13 ? 401 ILE A N 1 ATOM 2993 C CA . ILE A 1 401 ? 19.551 -24.623 12.081 1.00 47.36 ? 401 ILE A CA 1 ATOM 2994 C C . ILE A 1 401 ? 21.004 -24.509 12.255 1.00 43.16 ? 401 ILE A C 1 ATOM 2995 O O . ILE A 1 401 ? 21.626 -23.678 11.611 1.00 48.16 ? 401 ILE A O 1 ATOM 2996 C CB . ILE A 1 401 ? 19.391 -25.226 10.658 1.00 48.48 ? 401 ILE A CB 1 ATOM 2997 C CG1 . ILE A 1 401 ? 17.922 -25.306 10.264 1.00 55.97 ? 401 ILE A CG1 1 ATOM 2998 C CG2 . ILE A 1 401 ? 20.100 -26.580 10.558 1.00 40.07 ? 401 ILE A CG2 1 ATOM 2999 C CD1 . ILE A 1 401 ? 17.707 -25.486 8.777 1.00 69.46 ? 401 ILE A CD1 1 ATOM 3000 N N . THR A 1 402 ? 21.537 -25.425 13.043 1.00 49.11 ? 402 THR A N 1 ATOM 3001 C CA . THR A 1 402 ? 22.946 -25.457 13.326 1.00 56.16 ? 402 THR A CA 1 ATOM 3002 C C . THR A 1 402 ? 23.515 -26.651 12.605 1.00 48.10 ? 402 THR A C 1 ATOM 3003 O O . THR A 1 402 ? 23.020 -27.795 12.741 1.00 47.18 ? 402 THR A O 1 ATOM 3004 C CB . THR A 1 402 ? 23.246 -25.467 14.849 1.00 54.59 ? 402 THR A CB 1 ATOM 3005 O OG1 . THR A 1 402 ? 23.093 -24.128 15.347 1.00 51.99 ? 402 THR A OG1 1 ATOM 3006 C CG2 . THR A 1 402 ? 24.708 -25.929 15.139 1.00 59.47 ? 402 THR A CG2 1 ATOM 3007 N N . ILE A 1 403 ? 24.523 -26.343 11.801 1.00 41.17 ? 403 ILE A N 1 ATOM 3008 C CA . ILE A 1 403 ? 25.033 -27.253 10.820 1.00 52.86 ? 403 ILE A CA 1 ATOM 3009 C C . ILE A 1 403 ? 26.416 -27.556 11.265 1.00 49.87 ? 403 ILE A C 1 ATOM 3010 O O . ILE A 1 403 ? 27.244 -26.654 11.320 1.00 48.24 ? 403 ILE A O 1 ATOM 3011 C CB . ILE A 1 403 ? 25.152 -26.613 9.407 1.00 53.84 ? 403 ILE A CB 1 ATOM 3012 C CG1 . ILE A 1 403 ? 23.786 -26.210 8.880 1.00 44.84 ? 403 ILE A CG1 1 ATOM 3013 C CG2 . ILE A 1 403 ? 25.829 -27.566 8.423 1.00 45.87 ? 403 ILE A CG2 1 ATOM 3014 C CD1 . ILE A 1 403 ? 23.870 -25.080 7.885 1.00 55.35 ? 403 ILE A CD1 1 ATOM 3015 N N . THR A 1 404 ? 26.698 -28.835 11.424 1.00 48.61 ? 404 THR A N 1 ATOM 3016 C CA . THR A 1 404 ? 27.995 -29.227 11.916 1.00 58.00 ? 404 THR A CA 1 ATOM 3017 C C . THR A 1 404 ? 28.794 -29.922 10.827 1.00 49.39 ? 404 THR A C 1 ATOM 3018 O O . THR A 1 404 ? 28.477 -31.058 10.427 1.00 46.19 ? 404 THR A O 1 ATOM 3019 C CB . THR A 1 404 ? 27.858 -30.089 13.183 1.00 53.21 ? 404 THR A CB 1 ATOM 3020 O OG1 . THR A 1 404 ? 27.248 -29.276 14.194 1.00 53.81 ? 404 THR A OG1 1 ATOM 3021 C CG2 . THR A 1 404 ? 29.230 -30.584 13.659 1.00 53.85 ? 404 THR A CG2 1 ATOM 3022 N N . MET A 1 405 ? 29.820 -29.200 10.369 1.00 43.06 ? 405 MET A N 1 ATOM 3023 C CA . MET A 1 405 ? 30.787 -29.678 9.390 1.00 41.68 ? 405 MET A CA 1 ATOM 3024 C C . MET A 1 405 ? 31.833 -30.603 10.001 1.00 53.49 ? 405 MET A C 1 ATOM 3025 O O . MET A 1 405 ? 32.305 -30.378 11.111 1.00 56.77 ? 405 MET A O 1 ATOM 3026 C CB . MET A 1 405 ? 31.492 -28.470 8.749 1.00 40.21 ? 405 MET A CB 1 ATOM 3027 C CG . MET A 1 405 ? 30.548 -27.520 8.002 1.00 51.92 ? 405 MET A CG 1 ATOM 3028 S SD . MET A 1 405 ? 29.369 -28.340 6.859 1.00 48.36 ? 405 MET A SD 1 ATOM 3029 C CE . MET A 1 405 ? 30.507 -29.060 5.675 1.00 51.64 ? 405 MET A CE 1 ATOM 3030 N N . GLN A 1 406 ? 32.234 -31.601 9.226 1.00 52.35 ? 406 GLN A N 1 ATOM 3031 C CA . GLN A 1 406 ? 33.310 -32.529 9.575 1.00 56.38 ? 406 GLN A CA 1 ATOM 3032 C C . GLN A 1 406 ? 34.681 -31.824 9.665 1.00 66.00 ? 406 GLN A C 1 ATOM 3033 O O . GLN A 1 406 ? 35.487 -32.170 10.523 1.00 66.95 ? 406 GLN A O 1 ATOM 3034 C CB . GLN A 1 406 ? 33.350 -33.657 8.534 1.00 52.01 ? 406 GLN A CB 1 ATOM 3035 C CG . GLN A 1 406 ? 34.470 -34.676 8.653 1.00 54.06 ? 406 GLN A CG 1 ATOM 3036 C CD . GLN A 1 406 ? 34.619 -35.522 7.390 1.00 55.54 ? 406 GLN A CD 1 ATOM 3037 O OE1 . GLN A 1 406 ? 33.965 -36.550 7.226 1.00 50.12 ? 406 GLN A OE1 1 ATOM 3038 N NE2 . GLN A 1 406 ? 35.473 -35.076 6.484 1.00 57.97 ? 406 GLN A NE2 1 ATOM 3039 N N . ASP A 1 407 ? 34.933 -30.843 8.806 1.00 44.46 ? 407 ASP A N 1 ATOM 3040 C CA . ASP A 1 407 ? 36.250 -30.175 8.763 1.00 54.21 ? 407 ASP A CA 1 ATOM 3041 C C . ASP A 1 407 ? 36.093 -28.687 8.964 1.00 52.72 ? 407 ASP A C 1 ATOM 3042 O O . ASP A 1 407 ? 35.156 -28.075 8.433 1.00 56.60 ? 407 ASP A O 1 ATOM 3043 C CB . ASP A 1 407 ? 36.945 -30.431 7.431 1.00 50.68 ? 407 ASP A CB 1 ATOM 3044 C CG . ASP A 1 407 ? 36.635 -31.791 6.889 1.00 62.17 ? 407 ASP A CG 1 ATOM 3045 O OD1 . ASP A 1 407 ? 37.264 -32.753 7.353 1.00 62.43 ? 407 ASP A OD1 1 ATOM 3046 O OD2 . ASP A 1 407 ? 35.710 -31.909 6.045 1.00 70.96 ? 407 ASP A OD2 1 ATOM 3047 N N . ALA A 1 408 ? 36.997 -28.103 9.747 1.00 52.26 ? 408 ALA A N 1 ATOM 3048 C CA . ALA A 1 408 ? 36.971 -26.666 10.058 1.00 55.18 ? 408 ALA A CA 1 ATOM 3049 C C . ALA A 1 408 ? 37.386 -25.833 8.852 1.00 49.36 ? 408 ALA A C 1 ATOM 3050 O O . ALA A 1 408 ? 38.292 -26.225 8.131 1.00 46.09 ? 408 ALA A O 1 ATOM 3051 C CB . ALA A 1 408 ? 37.887 -26.358 11.238 1.00 51.33 ? 408 ALA A CB 1 ATOM 3052 N N . GLY A 1 409 ? 36.723 -24.691 8.642 1.00 53.11 ? 409 GLY A N 1 ATOM 3053 C CA . GLY A 1 409 ? 37.005 -23.841 7.468 1.00 55.81 ? 409 GLY A CA 1 ATOM 3054 C C . GLY A 1 409 ? 35.964 -22.753 7.190 1.00 59.28 ? 409 GLY A C 1 ATOM 3055 O O . GLY A 1 409 ? 35.007 -22.577 7.965 1.00 52.03 ? 409 GLY A O 1 ATOM 3056 N N . ALA A 1 410 ? 36.190 -22.000 6.099 1.00 56.17 ? 410 ALA A N 1 ATOM 3057 C CA . ALA A 1 410 ? 35.233 -21.011 5.575 1.00 56.90 ? 410 ALA A CA 1 ATOM 3058 C C . ALA A 1 410 ? 34.246 -21.629 4.552 1.00 57.22 ? 410 ALA A C 1 ATOM 3059 O O . ALA A 1 410 ? 34.643 -21.964 3.434 1.00 56.83 ? 410 ALA A O 1 ATOM 3060 C CB . ALA A 1 410 ? 35.992 -19.880 4.902 1.00 55.88 ? 410 ALA A CB 1 ATOM 3061 N N . TYR A 1 411 ? 32.963 -21.669 4.911 1.00 50.25 ? 411 TYR A N 1 ATOM 3062 C CA . TYR A 1 411 ? 31.909 -22.311 4.111 1.00 46.18 ? 411 TYR A CA 1 ATOM 3063 C C . TYR A 1 411 ? 30.808 -21.335 3.678 1.00 42.17 ? 411 TYR A C 1 ATOM 3064 O O . TYR A 1 411 ? 30.481 -20.436 4.425 1.00 46.44 ? 411 TYR A O 1 ATOM 3065 C CB . TYR A 1 411 ? 31.256 -23.385 4.962 1.00 44.49 ? 411 TYR A CB 1 ATOM 3066 C CG . TYR A 1 411 ? 32.102 -24.600 5.200 1.00 44.31 ? 411 TYR A CG 1 ATOM 3067 C CD1 . TYR A 1 411 ? 32.227 -25.576 4.234 1.00 40.21 ? 411 TYR A CD1 1 ATOM 3068 C CD2 . TYR A 1 411 ? 32.736 -24.813 6.425 1.00 48.70 ? 411 TYR A CD2 1 ATOM 3069 C CE1 . TYR A 1 411 ? 33.000 -26.695 4.436 1.00 45.40 ? 411 TYR A CE1 1 ATOM 3070 C CE2 . TYR A 1 411 ? 33.481 -25.964 6.658 1.00 43.65 ? 411 TYR A CE2 1 ATOM 3071 C CZ . TYR A 1 411 ? 33.609 -26.910 5.657 1.00 45.13 ? 411 TYR A CZ 1 ATOM 3072 O OH . TYR A 1 411 ? 34.315 -28.078 5.863 1.00 44.58 ? 411 TYR A OH 1 ATOM 3073 N N . THR A 1 412 ? 30.183 -21.548 2.514 1.00 46.53 ? 412 THR A N 1 ATOM 3074 C CA . THR A 1 412 ? 28.909 -20.876 2.169 1.00 34.61 ? 412 THR A CA 1 ATOM 3075 C C . THR A 1 412 ? 27.787 -21.916 2.092 1.00 35.53 ? 412 THR A C 1 ATOM 3076 O O . THR A 1 412 ? 28.056 -23.090 1.978 1.00 33.58 ? 412 THR A O 1 ATOM 3077 C CB . THR A 1 412 ? 29.002 -20.094 0.857 1.00 38.76 ? 412 THR A CB 1 ATOM 3078 O OG1 . THR A 1 412 ? 29.616 -20.881 -0.149 1.00 41.89 ? 412 THR A OG1 1 ATOM 3079 C CG2 . THR A 1 412 ? 29.878 -18.861 1.029 1.00 48.89 ? 412 THR A CG2 1 ATOM 3080 N N . PHE A 1 413 ? 26.535 -21.485 2.206 1.00 32.32 ? 413 PHE A N 1 ATOM 3081 C CA . PHE A 1 413 ? 25.402 -22.396 2.324 1.00 36.36 ? 413 PHE A CA 1 ATOM 3082 C C . PHE A 1 413 ? 24.278 -22.006 1.385 1.00 34.29 ? 413 PHE A C 1 ATOM 3083 O O . PHE A 1 413 ? 24.047 -20.818 1.149 1.00 31.66 ? 413 PHE A O 1 ATOM 3084 C CB . PHE A 1 413 ? 24.863 -22.417 3.771 1.00 36.41 ? 413 PHE A CB 1 ATOM 3085 C CG . PHE A 1 413 ? 25.901 -22.793 4.773 1.00 38.82 ? 413 PHE A CG 1 ATOM 3086 C CD1 . PHE A 1 413 ? 26.183 -24.122 5.021 1.00 38.27 ? 413 PHE A CD1 1 ATOM 3087 C CD2 . PHE A 1 413 ? 26.720 -21.816 5.332 1.00 42.09 ? 413 PHE A CD2 1 ATOM 3088 C CE1 . PHE A 1 413 ? 27.212 -24.488 5.872 1.00 40.68 ? 413 PHE A CE1 1 ATOM 3089 C CE2 . PHE A 1 413 ? 27.785 -22.176 6.144 1.00 40.59 ? 413 PHE A CE2 1 ATOM 3090 C CZ . PHE A 1 413 ? 28.024 -23.511 6.416 1.00 40.10 ? 413 PHE A CZ 1 ATOM 3091 N N . SER A 1 414 ? 23.524 -23.005 0.931 1.00 32.28 ? 414 SER A N 1 ATOM 3092 C CA . SER A 1 414 ? 22.251 -22.756 0.275 1.00 30.45 ? 414 SER A CA 1 ATOM 3093 C C . SER A 1 414 ? 21.349 -23.926 0.504 1.00 32.39 ? 414 SER A C 1 ATOM 3094 O O . SER A 1 414 ? 21.812 -25.017 0.780 1.00 31.89 ? 414 SER A O 1 ATOM 3095 C CB . SER A 1 414 ? 22.445 -22.542 -1.213 1.00 34.19 ? 414 SER A CB 1 ATOM 3096 O OG . SER A 1 414 ? 23.025 -23.674 -1.814 1.00 32.59 ? 414 SER A OG 1 ATOM 3097 N N . MET A 1 415 ? 20.055 -23.671 0.444 1.00 26.64 ? 415 MET A N 1 ATOM 3098 C CA . MET A 1 415 ? 19.088 -24.738 0.443 1.00 30.58 ? 415 MET A CA 1 ATOM 3099 C C . MET A 1 415 ? 18.329 -24.706 -0.906 1.00 30.14 ? 415 MET A C 1 ATOM 3100 O O . MET A 1 415 ? 17.919 -23.640 -1.386 1.00 29.45 ? 415 MET A O 1 ATOM 3101 C CB . MET A 1 415 ? 18.152 -24.659 1.650 1.00 25.15 ? 415 MET A CB 1 ATOM 3102 C CG . MET A 1 415 ? 17.499 -23.321 1.790 1.00 32.69 ? 415 MET A CG 1 ATOM 3103 S SD . MET A 1 415 ? 16.771 -22.921 3.389 1.00 32.30 ? 415 MET A SD 1 ATOM 3104 C CE . MET A 1 415 ? 15.142 -23.658 3.272 1.00 30.71 ? 415 MET A CE 1 ATOM 3105 N N . ILE A 1 416 ? 18.169 -25.886 -1.503 1.00 26.45 ? 416 ILE A N 1 ATOM 3106 C CA . ILE A 1 416 ? 17.450 -26.064 -2.762 1.00 25.82 ? 416 ILE A CA 1 ATOM 3107 C C . ILE A 1 416 ? 16.296 -27.011 -2.560 1.00 24.17 ? 416 ILE A C 1 ATOM 3108 O O . ILE A 1 416 ? 16.489 -28.166 -2.138 1.00 24.70 ? 416 ILE A O 1 ATOM 3109 C CB . ILE A 1 416 ? 18.427 -26.606 -3.805 1.00 27.28 ? 416 ILE A CB 1 ATOM 3110 C CG1 . ILE A 1 416 ? 19.527 -25.570 -3.999 1.00 27.74 ? 416 ILE A CG1 1 ATOM 3111 C CG2 . ILE A 1 416 ? 17.724 -26.875 -5.132 1.00 31.71 ? 416 ILE A CG2 1 ATOM 3112 C CD1 . ILE A 1 416 ? 20.500 -25.907 -5.090 1.00 32.82 ? 416 ILE A CD1 1 ATOM 3113 N N . ARG A 1 417 ? 15.106 -26.555 -2.928 1.00 20.98 ? 417 ARG A N 1 ATOM 3114 C CA . ARG A 1 417 ? 13.929 -27.317 -2.728 1.00 19.64 ? 417 ARG A CA 1 ATOM 3115 C C . ARG A 1 417 ? 13.966 -28.592 -3.620 1.00 22.85 ? 417 ARG A C 1 ATOM 3116 O O . ARG A 1 417 ? 14.395 -28.577 -4.789 1.00 21.90 ? 417 ARG A O 1 ATOM 3117 C CB . ARG A 1 417 ? 12.717 -26.478 -2.939 1.00 21.85 ? 417 ARG A CB 1 ATOM 3118 C CG . ARG A 1 417 ? 11.470 -27.047 -2.312 1.00 23.08 ? 417 ARG A CG 1 ATOM 3119 C CD . ARG A 1 417 ? 10.345 -26.023 -2.189 1.00 22.57 ? 417 ARG A CD 1 ATOM 3120 N NE . ARG A 1 417 ? 9.113 -26.643 -1.724 1.00 24.54 ? 417 ARG A NE 1 ATOM 3121 C CZ . ARG A 1 417 ? 8.325 -27.420 -2.462 1.00 28.95 ? 417 ARG A CZ 1 ATOM 3122 N NH1 . ARG A 1 417 ? 8.649 -27.645 -3.731 1.00 27.40 ? 417 ARG A NH1 1 ATOM 3123 N NH2 . ARG A 1 417 ? 7.232 -28.011 -1.921 1.00 25.02 ? 417 ARG A NH2 1 ATOM 3124 N N . VAL A 1 418 ? 13.647 -29.712 -2.984 1.00 24.06 ? 418 VAL A N 1 ATOM 3125 C CA . VAL A 1 418 ? 13.549 -30.986 -3.635 1.00 24.80 ? 418 VAL A CA 1 ATOM 3126 C C . VAL A 1 418 ? 12.406 -30.954 -4.647 1.00 22.62 ? 418 VAL A C 1 ATOM 3127 O O . VAL A 1 418 ? 11.319 -30.469 -4.339 1.00 22.45 ? 418 VAL A O 1 ATOM 3128 C CB . VAL A 1 418 ? 13.360 -32.132 -2.585 1.00 24.50 ? 418 VAL A CB 1 ATOM 3129 C CG1 . VAL A 1 418 ? 13.197 -33.459 -3.302 1.00 26.73 ? 418 VAL A CG1 1 ATOM 3130 C CG2 . VAL A 1 418 ? 14.569 -32.212 -1.697 1.00 27.37 ? 418 VAL A CG2 1 ATOM 3131 N N . SER A 1 419 ? 12.646 -31.492 -5.849 1.00 22.31 ? 419 SER A N 1 ATOM 3132 C CA . SER A 1 419 ? 11.796 -31.200 -6.995 1.00 22.38 ? 419 SER A CA 1 ATOM 3133 C C . SER A 1 419 ? 11.571 -32.386 -7.920 1.00 24.07 ? 419 SER A C 1 ATOM 3134 O O . SER A 1 419 ? 12.024 -33.526 -7.674 1.00 23.79 ? 419 SER A O 1 ATOM 3135 C CB . SER A 1 419 ? 12.346 -29.972 -7.762 1.00 23.33 ? 419 SER A CB 1 ATOM 3136 O OG . SER A 1 419 ? 13.529 -30.329 -8.492 1.00 25.16 ? 419 SER A OG 1 ATOM 3137 N N . ALA A 1 420 ? 10.745 -32.145 -8.911 1.00 23.64 ? 420 ALA A N 1 ATOM 3138 C CA . ALA A 1 420 ? 10.318 -33.157 -9.882 1.00 25.39 ? 420 ALA A CA 1 ATOM 3139 C C . ALA A 1 420 ? 10.018 -32.449 -11.188 1.00 24.59 ? 420 ALA A C 1 ATOM 3140 O O . ALA A 1 420 ? 9.710 -31.241 -11.179 1.00 21.36 ? 420 ALA A O 1 ATOM 3141 C CB . ALA A 1 420 ? 9.056 -33.832 -9.407 1.00 23.80 ? 420 ALA A CB 1 ATOM 3142 N N . THR A 1 421 ? 10.061 -33.164 -12.297 1.00 19.85 ? 421 THR A N 1 ATOM 3143 C CA . THR A 1 421 ? 9.840 -32.474 -13.566 1.00 23.67 ? 421 THR A CA 1 ATOM 3144 C C . THR A 1 421 ? 9.307 -33.395 -14.622 1.00 20.78 ? 421 THR A C 1 ATOM 3145 O O . THR A 1 421 ? 9.558 -34.632 -14.596 1.00 18.16 ? 421 THR A O 1 ATOM 3146 C CB . THR A 1 421 ? 11.117 -31.722 -14.083 1.00 22.55 ? 421 THR A CB 1 ATOM 3147 O OG1 . THR A 1 421 ? 10.794 -30.896 -15.210 1.00 24.16 ? 421 THR A OG1 1 ATOM 3148 C CG2 . THR A 1 421 ? 12.172 -32.665 -14.511 1.00 25.21 ? 421 THR A CG2 1 ATOM 3149 N N . THR A 1 422 ? 8.475 -32.803 -15.469 1.00 19.18 ? 422 THR A N 1 ATOM 3150 C CA . THR A 1 422 ? 7.997 -33.424 -16.714 1.00 21.62 ? 422 THR A CA 1 ATOM 3151 C C . THR A 1 422 ? 7.534 -32.289 -17.648 1.00 20.20 ? 422 THR A C 1 ATOM 3152 O O . THR A 1 422 ? 7.082 -31.223 -17.170 1.00 20.31 ? 422 THR A O 1 ATOM 3153 C CB . THR A 1 422 ? 6.902 -34.500 -16.469 1.00 23.15 ? 422 THR A CB 1 ATOM 3154 O OG1 . THR A 1 422 ? 6.635 -35.236 -17.673 1.00 22.77 ? 422 THR A OG1 1 ATOM 3155 C CG2 . THR A 1 422 ? 5.592 -33.917 -15.978 1.00 25.84 ? 422 THR A CG2 1 ATOM 3156 N N . HIS A 1 423 ? 7.824 -32.447 -18.930 1.00 19.19 ? 423 HIS A N 1 ATOM 3157 C CA . HIS A 1 423 ? 7.327 -31.540 -19.978 1.00 20.66 ? 423 HIS A CA 1 ATOM 3158 C C . HIS A 1 423 ? 7.832 -30.119 -19.821 1.00 22.01 ? 423 HIS A C 1 ATOM 3159 O O . HIS A 1 423 ? 7.118 -29.199 -20.168 1.00 20.05 ? 423 HIS A O 1 ATOM 3160 C CB . HIS A 1 423 ? 5.783 -31.524 -19.981 1.00 20.80 ? 423 HIS A CB 1 ATOM 3161 C CG . HIS A 1 423 ? 5.187 -32.756 -20.550 1.00 25.11 ? 423 HIS A CG 1 ATOM 3162 N ND1 . HIS A 1 423 ? 5.128 -33.944 -19.848 1.00 30.00 ? 423 HIS A ND1 1 ATOM 3163 C CD2 . HIS A 1 423 ? 4.694 -33.023 -21.780 1.00 25.86 ? 423 HIS A CD2 1 ATOM 3164 C CE1 . HIS A 1 423 ? 4.576 -34.876 -20.602 1.00 29.28 ? 423 HIS A CE1 1 ATOM 3165 N NE2 . HIS A 1 423 ? 4.330 -34.350 -21.784 1.00 28.76 ? 423 HIS A NE2 1 ATOM 3166 N N . THR A 1 424 ? 9.050 -29.971 -19.291 1.00 21.13 ? 424 THR A N 1 ATOM 3167 C CA . THR A 1 424 ? 9.717 -28.733 -19.019 1.00 21.84 ? 424 THR A CA 1 ATOM 3168 C C . THR A 1 424 ? 9.261 -28.043 -17.738 1.00 21.31 ? 424 THR A C 1 ATOM 3169 O O . THR A 1 424 ? 9.793 -26.992 -17.432 1.00 28.06 ? 424 THR A O 1 ATOM 3170 C CB . THR A 1 424 ? 9.687 -27.645 -20.165 1.00 21.71 ? 424 THR A CB 1 ATOM 3171 O OG1 . THR A 1 424 ? 8.377 -27.033 -20.287 1.00 22.00 ? 424 THR A OG1 1 ATOM 3172 C CG2 . THR A 1 424 ? 10.171 -28.241 -21.496 1.00 23.88 ? 424 THR A CG2 1 ATOM 3173 N N . VAL A 1 425 ? 8.254 -28.566 -17.053 1.00 20.22 ? 425 VAL A N 1 ATOM 3174 C CA . VAL A 1 425 ? 7.651 -27.882 -15.911 1.00 21.35 ? 425 VAL A CA 1 ATOM 3175 C C . VAL A 1 425 ? 8.280 -28.413 -14.625 1.00 23.79 ? 425 VAL A C 1 ATOM 3176 O O . VAL A 1 425 ? 8.316 -29.645 -14.385 1.00 24.25 ? 425 VAL A O 1 ATOM 3177 C CB . VAL A 1 425 ? 6.142 -28.091 -15.927 1.00 22.30 ? 425 VAL A CB 1 ATOM 3178 C CG1 . VAL A 1 425 ? 5.455 -27.443 -14.711 1.00 23.45 ? 425 VAL A CG1 1 ATOM 3179 C CG2 . VAL A 1 425 ? 5.613 -27.498 -17.200 1.00 21.34 ? 425 VAL A CG2 1 ATOM 3180 N N . ASN A 1 426 ? 8.902 -27.516 -13.881 1.00 20.11 ? 426 ASN A N 1 ATOM 3181 C CA . ASN A 1 426 ? 9.365 -27.830 -12.533 1.00 20.95 ? 426 ASN A CA 1 ATOM 3182 C C . ASN A 1 426 ? 9.108 -26.675 -11.592 1.00 21.36 ? 426 ASN A C 1 ATOM 3183 O O . ASN A 1 426 ? 9.977 -25.850 -11.389 1.00 19.90 ? 426 ASN A O 1 ATOM 3184 C CB . ASN A 1 426 ? 10.826 -28.282 -12.514 1.00 19.33 ? 426 ASN A CB 1 ATOM 3185 C CG . ASN A 1 426 ? 11.288 -28.750 -11.143 1.00 21.88 ? 426 ASN A CG 1 ATOM 3186 O OD1 . ASN A 1 426 ? 10.643 -28.497 -10.137 1.00 20.84 ? 426 ASN A OD1 1 ATOM 3187 N ND2 . ASN A 1 426 ? 12.478 -29.296 -11.094 1.00 19.89 ? 426 ASN A ND2 1 ATOM 3188 N N . THR A 1 427 ? 7.923 -26.649 -10.983 1.00 20.37 ? 427 THR A N 1 ATOM 3189 C CA . THR A 1 427 ? 7.574 -25.574 -10.040 1.00 21.53 ? 427 THR A CA 1 ATOM 3190 C C . THR A 1 427 ? 8.181 -25.731 -8.676 1.00 23.79 ? 427 THR A C 1 ATOM 3191 O O . THR A 1 427 ? 8.117 -24.786 -7.884 1.00 21.65 ? 427 THR A O 1 ATOM 3192 C CB . THR A 1 427 ? 6.064 -25.410 -9.840 1.00 22.17 ? 427 THR A CB 1 ATOM 3193 O OG1 . THR A 1 427 ? 5.502 -26.539 -9.154 1.00 26.31 ? 427 THR A OG1 1 ATOM 3194 C CG2 . THR A 1 427 ? 5.391 -25.252 -11.204 1.00 20.50 ? 427 THR A CG2 1 ATOM 3195 N N . ASP A 1 428 ? 8.770 -26.907 -8.401 1.00 23.79 ? 428 ASP A N 1 ATOM 3196 C CA . ASP A 1 428 ? 9.158 -27.280 -7.065 1.00 22.54 ? 428 ASP A CA 1 ATOM 3197 C C . ASP A 1 428 ? 10.531 -26.800 -6.786 1.00 22.83 ? 428 ASP A C 1 ATOM 3198 O O . ASP A 1 428 ? 10.903 -26.694 -5.616 1.00 22.94 ? 428 ASP A O 1 ATOM 3199 C CB . ASP A 1 428 ? 9.126 -28.800 -6.847 1.00 24.32 ? 428 ASP A CB 1 ATOM 3200 C CG . ASP A 1 428 ? 7.725 -29.326 -6.568 1.00 30.07 ? 428 ASP A CG 1 ATOM 3201 O OD1 . ASP A 1 428 ? 7.048 -28.923 -5.537 1.00 25.08 ? 428 ASP A OD1 1 ATOM 3202 O OD2 . ASP A 1 428 ? 7.304 -30.167 -7.397 1.00 28.99 ? 428 ASP A OD2 1 ATOM 3203 N N . GLN A 1 429 ? 11.302 -26.503 -7.827 1.00 23.65 ? 429 GLN A N 1 ATOM 3204 C CA . GLN A 1 429 ? 12.691 -26.164 -7.624 1.00 23.98 ? 429 GLN A CA 1 ATOM 3205 C C . GLN A 1 429 ? 12.914 -24.668 -7.388 1.00 24.22 ? 429 GLN A C 1 ATOM 3206 O O . GLN A 1 429 ? 12.601 -23.836 -8.229 1.00 26.87 ? 429 GLN A O 1 ATOM 3207 C CB . GLN A 1 429 ? 13.600 -26.690 -8.747 1.00 27.12 ? 429 GLN A CB 1 ATOM 3208 C CG . GLN A 1 429 ? 13.953 -25.738 -9.816 1.00 29.16 ? 429 GLN A CG 1 ATOM 3209 C CD . GLN A 1 429 ? 14.843 -26.265 -10.919 1.00 24.73 ? 429 GLN A CD 1 ATOM 3210 O OE1 . GLN A 1 429 ? 14.470 -26.165 -12.104 1.00 25.82 ? 429 GLN A OE1 1 ATOM 3211 N NE2 . GLN A 1 429 ? 16.026 -26.758 -10.569 1.00 20.67 ? 429 GLN A NE2 1 ATOM 3212 N N . ARG A 1 430 ? 13.568 -24.388 -6.278 1.00 23.84 ? 430 ARG A N 1 ATOM 3213 C CA . ARG A 1 430 ? 13.994 -23.057 -5.935 1.00 25.83 ? 430 ARG A CA 1 ATOM 3214 C C . ARG A 1 430 ? 15.205 -23.110 -5.044 1.00 27.02 ? 430 ARG A C 1 ATOM 3215 O O . ARG A 1 430 ? 15.446 -24.082 -4.317 1.00 29.03 ? 430 ARG A O 1 ATOM 3216 C CB . ARG A 1 430 ? 12.852 -22.255 -5.304 1.00 22.79 ? 430 ARG A CB 1 ATOM 3217 C CG . ARG A 1 430 ? 12.350 -22.759 -3.965 1.00 26.73 ? 430 ARG A CG 1 ATOM 3218 C CD . ARG A 1 430 ? 11.402 -21.752 -3.360 1.00 25.99 ? 430 ARG A CD 1 ATOM 3219 N NE . ARG A 1 430 ? 10.232 -21.625 -4.201 1.00 24.11 ? 430 ARG A NE 1 ATOM 3220 C CZ . ARG A 1 430 ? 9.374 -20.624 -4.202 1.00 25.06 ? 430 ARG A CZ 1 ATOM 3221 N NH1 . ARG A 1 430 ? 9.502 -19.597 -3.355 1.00 27.20 ? 430 ARG A NH1 1 ATOM 3222 N NH2 . ARG A 1 430 ? 8.357 -20.680 -5.047 1.00 25.29 ? 430 ARG A NH2 1 ATOM 3223 N N . ARG A 1 431 ? 16.060 -22.131 -5.227 1.00 26.62 ? 431 ARG A N 1 ATOM 3224 C CA . ARG A 1 431 ? 17.245 -21.979 -4.411 1.00 26.25 ? 431 ARG A CA 1 ATOM 3225 C C . ARG A 1 431 ? 17.123 -20.762 -3.467 1.00 30.64 ? 431 ARG A C 1 ATOM 3226 O O . ARG A 1 431 ? 16.789 -19.671 -3.894 1.00 31.63 ? 431 ARG A O 1 ATOM 3227 C CB . ARG A 1 431 ? 18.466 -21.804 -5.284 1.00 24.09 ? 431 ARG A CB 1 ATOM 3228 C CG . ARG A 1 431 ? 19.711 -21.489 -4.508 1.00 25.31 ? 431 ARG A CG 1 ATOM 3229 C CD . ARG A 1 431 ? 20.869 -21.438 -5.424 1.00 26.28 ? 431 ARG A CD 1 ATOM 3230 N NE . ARG A 1 431 ? 22.062 -20.878 -4.820 1.00 28.40 ? 431 ARG A NE 1 ATOM 3231 C CZ . ARG A 1 431 ? 22.348 -19.572 -4.803 1.00 32.59 ? 431 ARG A CZ 1 ATOM 3232 N NH1 . ARG A 1 431 ? 21.527 -18.682 -5.303 1.00 28.70 ? 431 ARG A NH1 1 ATOM 3233 N NH2 . ARG A 1 431 ? 23.494 -19.158 -4.324 1.00 28.57 ? 431 ARG A NH2 1 ATOM 3234 N N . ILE A 1 432 ? 17.541 -20.967 -2.221 1.00 32.45 ? 432 ILE A N 1 ATOM 3235 C CA . ILE A 1 432 ? 17.654 -19.916 -1.198 1.00 29.02 ? 432 ILE A CA 1 ATOM 3236 C C . ILE A 1 432 ? 19.115 -19.902 -0.724 1.00 27.59 ? 432 ILE A C 1 ATOM 3237 O O . ILE A 1 432 ? 19.538 -20.851 -0.062 1.00 27.44 ? 432 ILE A O 1 ATOM 3238 C CB . ILE A 1 432 ? 16.722 -20.257 -0.025 1.00 29.83 ? 432 ILE A CB 1 ATOM 3239 C CG1 . ILE A 1 432 ? 15.252 -20.070 -0.442 1.00 26.91 ? 432 ILE A CG1 1 ATOM 3240 C CG2 . ILE A 1 432 ? 17.034 -19.426 1.218 1.00 31.67 ? 432 ILE A CG2 1 ATOM 3241 C CD1 . ILE A 1 432 ? 14.267 -20.804 0.446 1.00 30.78 ? 432 ILE A CD1 1 ATOM 3242 N N . PRO A 1 433 ? 19.905 -18.867 -1.095 1.00 26.14 ? 433 PRO A N 1 ATOM 3243 C CA . PRO A 1 433 ? 21.216 -18.646 -0.439 1.00 30.46 ? 433 PRO A CA 1 ATOM 3244 C C . PRO A 1 433 ? 21.072 -18.362 1.064 1.00 31.99 ? 433 PRO A C 1 ATOM 3245 O O . PRO A 1 433 ? 20.034 -17.892 1.492 1.00 34.07 ? 433 PRO A O 1 ATOM 3246 C CB . PRO A 1 433 ? 21.808 -17.451 -1.175 1.00 29.78 ? 433 PRO A CB 1 ATOM 3247 C CG . PRO A 1 433 ? 20.636 -16.722 -1.714 1.00 32.82 ? 433 PRO A CG 1 ATOM 3248 C CD . PRO A 1 433 ? 19.450 -17.661 -1.804 1.00 31.31 ? 433 PRO A CD 1 ATOM 3249 N N . LEU A 1 434 ? 21.987 -18.895 1.867 1.00 35.27 ? 434 LEU A N 1 ATOM 3250 C CA . LEU A 1 434 ? 21.887 -18.777 3.340 1.00 39.98 ? 434 LEU A CA 1 ATOM 3251 C C . LEU A 1 434 ? 23.177 -18.171 3.913 1.00 39.51 ? 434 LEU A C 1 ATOM 3252 O O . LEU A 1 434 ? 24.235 -18.757 3.711 1.00 45.17 ? 434 LEU A O 1 ATOM 3253 C CB . LEU A 1 434 ? 21.702 -20.170 3.939 1.00 35.84 ? 434 LEU A CB 1 ATOM 3254 C CG . LEU A 1 434 ? 20.382 -20.848 3.733 1.00 35.80 ? 434 LEU A CG 1 ATOM 3255 C CD1 . LEU A 1 434 ? 20.424 -22.305 4.174 1.00 39.67 ? 434 LEU A CD1 1 ATOM 3256 C CD2 . LEU A 1 434 ? 19.266 -20.092 4.425 1.00 39.16 ? 434 LEU A CD2 1 ATOM 3257 N N . ASP A 1 435 ? 23.107 -17.048 4.632 1.00 44.62 ? 435 ASP A N 1 ATOM 3258 C CA . ASP A 1 435 ? 24.294 -16.543 5.413 1.00 53.70 ? 435 ASP A CA 1 ATOM 3259 C C . ASP A 1 435 ? 24.605 -17.426 6.645 1.00 46.53 ? 435 ASP A C 1 ATOM 3260 O O . ASP A 1 435 ? 23.746 -17.656 7.505 1.00 42.66 ? 435 ASP A O 1 ATOM 3261 C CB . ASP A 1 435 ? 24.105 -15.088 5.878 0.90 56.43 ? 435 ASP A CB 1 ATOM 3262 C CG . ASP A 1 435 ? 24.214 -14.081 4.746 0.80 58.80 ? 435 ASP A CG 1 ATOM 3263 O OD1 . ASP A 1 435 ? 25.036 -14.291 3.846 0.70 62.90 ? 435 ASP A OD1 1 ATOM 3264 O OD2 . ASP A 1 435 ? 23.498 -13.056 4.770 0.70 70.01 ? 435 ASP A OD2 1 ATOM 3265 N N . GLY A 1 436 ? 25.815 -17.966 6.698 1.00 41.97 ? 436 GLY A N 1 ATOM 3266 C CA . GLY A 1 436 ? 26.201 -18.866 7.798 1.00 50.59 ? 436 GLY A CA 1 ATOM 3267 C C . GLY A 1 436 ? 27.011 -18.122 8.863 1.00 56.34 ? 436 GLY A C 1 ATOM 3268 O O . GLY A 1 436 ? 27.944 -17.390 8.538 1.00 50.49 ? 436 GLY A O 1 ATOM 3269 N N . GLN A 1 437 ? 26.625 -18.282 10.124 1.00 55.97 ? 437 GLN A N 1 ATOM 3270 C CA . GLN A 1 437 ? 27.298 -17.620 11.243 1.00 60.93 ? 437 GLN A CA 1 ATOM 3271 C C . GLN A 1 437 ? 28.269 -18.610 11.844 1.00 61.50 ? 437 GLN A C 1 ATOM 3272 O O . GLN A 1 437 ? 27.844 -19.640 12.381 1.00 65.58 ? 437 GLN A O 1 ATOM 3273 C CB . GLN A 1 437 ? 26.265 -17.177 12.303 1.00 61.35 ? 437 GLN A CB 1 ATOM 3274 C CG . GLN A 1 437 ? 26.839 -16.352 13.455 0.90 70.59 ? 437 GLN A CG 1 ATOM 3275 C CD . GLN A 1 437 ? 27.689 -15.165 13.000 0.90 67.64 ? 437 GLN A CD 1 ATOM 3276 O OE1 . GLN A 1 437 ? 27.164 -14.129 12.593 0.80 75.93 ? 437 GLN A OE1 1 ATOM 3277 N NE2 . GLN A 1 437 ? 29.007 -15.304 13.102 0.90 65.26 ? 437 GLN A NE2 1 ATOM 3278 N N . ASP A 1 438 ? 29.567 -18.358 11.691 1.00 61.09 ? 438 ASP A N 1 ATOM 3279 C CA . ASP A 1 438 ? 30.561 -19.215 12.333 1.00 60.93 ? 438 ASP A CA 1 ATOM 3280 C C . ASP A 1 438 ? 30.314 -19.288 13.849 1.00 69.53 ? 438 ASP A C 1 ATOM 3281 O O . ASP A 1 438 ? 30.160 -18.264 14.507 1.00 70.90 ? 438 ASP A O 1 ATOM 3282 C CB . ASP A 1 438 ? 31.991 -18.723 12.068 1.00 58.85 ? 438 ASP A CB 1 ATOM 3283 C CG . ASP A 1 438 ? 33.036 -19.792 12.382 1.00 57.41 ? 438 ASP A CG 1 ATOM 3284 O OD1 . ASP A 1 438 ? 32.763 -20.674 13.235 1.00 56.29 ? 438 ASP A OD1 1 ATOM 3285 O OD2 . ASP A 1 438 ? 34.116 -19.779 11.761 1.00 49.87 ? 438 ASP A OD2 1 ATOM 3286 N N . GLY A 1 439 ? 30.261 -20.500 14.394 0.90 73.21 ? 439 GLY A N 1 ATOM 3287 C CA . GLY A 1 439 ? 29.984 -20.683 15.814 0.90 70.96 ? 439 GLY A CA 1 ATOM 3288 C C . GLY A 1 439 ? 31.212 -20.633 16.713 0.90 72.78 ? 439 GLY A C 1 ATOM 3289 O O . GLY A 1 439 ? 31.114 -20.977 17.879 1.00 69.08 ? 439 GLY A O 1 ATOM 3290 N N . GLY A 1 440 ? 32.356 -20.185 16.192 1.00 68.35 ? 440 GLY A N 1 ATOM 3291 C CA . GLY A 1 440 ? 33.608 -20.188 16.940 1.00 66.42 ? 440 GLY A CA 1 ATOM 3292 C C . GLY A 1 440 ? 34.638 -21.129 16.341 1.00 71.83 ? 440 GLY A C 1 ATOM 3293 O O . GLY A 1 440 ? 35.756 -20.723 16.016 0.90 79.99 ? 440 GLY A O 1 ATOM 3294 N N . ASP A 1 441 ? 34.237 -22.374 16.116 1.00 67.87 ? 441 ASP A N 1 ATOM 3295 C CA . ASP A 1 441 ? 35.196 -23.446 15.773 1.00 65.18 ? 441 ASP A CA 1 ATOM 3296 C C . ASP A 1 441 ? 35.479 -23.651 14.280 1.00 58.83 ? 441 ASP A C 1 ATOM 3297 O O . ASP A 1 441 ? 36.259 -24.545 13.930 1.00 60.71 ? 441 ASP A O 1 ATOM 3298 C CB . ASP A 1 441 ? 34.758 -24.789 16.403 0.95 64.70 ? 441 ASP A CB 1 ATOM 3299 C CG . ASP A 1 441 ? 33.274 -25.148 16.123 1.00 64.71 ? 441 ASP A CG 1 ATOM 3300 O OD1 . ASP A 1 441 ? 32.472 -24.286 15.697 0.95 67.95 ? 441 ASP A OD1 1 ATOM 3301 O OD2 . ASP A 1 441 ? 32.903 -26.314 16.347 1.00 63.60 ? 441 ASP A OD2 1 ATOM 3302 N N . GLY A 1 442 ? 34.837 -22.869 13.405 1.00 64.08 ? 442 GLY A N 1 ATOM 3303 C CA . GLY A 1 442 ? 34.856 -23.134 11.936 1.00 64.95 ? 442 GLY A CA 1 ATOM 3304 C C . GLY A 1 442 ? 34.270 -24.472 11.496 1.00 52.82 ? 442 GLY A C 1 ATOM 3305 O O . GLY A 1 442 ? 34.720 -25.064 10.536 1.00 59.05 ? 442 GLY A O 1 ATOM 3306 N N . LYS A 1 443 ? 33.243 -24.937 12.195 1.00 62.72 ? 443 LYS A N 1 ATOM 3307 C CA . LYS A 1 443 ? 32.748 -26.319 12.040 1.00 70.55 ? 443 LYS A CA 1 ATOM 3308 C C . LYS A 1 443 ? 31.232 -26.386 12.268 1.00 67.23 ? 443 LYS A C 1 ATOM 3309 O O . LYS A 1 443 ? 30.502 -27.041 11.508 1.00 69.96 ? 443 LYS A O 1 ATOM 3310 C CB . LYS A 1 443 ? 33.466 -27.276 13.015 1.00 61.70 ? 443 LYS A CB 1 ATOM 3311 C CG . LYS A 1 443 ? 34.734 -27.919 12.469 1.00 63.32 ? 443 LYS A CG 1 ATOM 3312 C CD . LYS A 1 443 ? 35.144 -29.184 13.229 0.97 65.83 ? 443 LYS A CD 1 ATOM 3313 C CE . LYS A 1 443 ? 36.589 -29.577 12.883 0.90 76.01 ? 443 LYS A CE 1 ATOM 3314 N NZ . LYS A 1 443 ? 37.155 -30.773 13.586 0.94 65.61 ? 443 LYS A NZ 1 ATOM 3315 N N . SER A 1 444 ? 30.801 -25.767 13.367 1.00 59.80 ? 444 SER A N 1 ATOM 3316 C CA . SER A 1 444 ? 29.407 -25.461 13.635 1.00 64.26 ? 444 SER A CA 1 ATOM 3317 C C . SER A 1 444 ? 29.088 -24.080 13.099 1.00 53.69 ? 444 SER A C 1 ATOM 3318 O O . SER A 1 444 ? 29.937 -23.185 13.152 1.00 61.51 ? 444 SER A O 1 ATOM 3319 C CB . SER A 1 444 ? 29.078 -25.558 15.139 0.85 65.14 ? 444 SER A CB 1 ATOM 3320 O OG . SER A 1 444 ? 28.481 -26.811 15.444 0.85 62.07 ? 444 SER A OG 1 ATOM 3321 N N . PHE A 1 445 ? 27.934 -24.003 12.418 1.00 54.73 ? 445 PHE A N 1 ATOM 3322 C CA . PHE A 1 445 ? 27.431 -22.797 11.724 1.00 47.96 ? 445 PHE A CA 1 ATOM 3323 C C . PHE A 1 445 ? 25.926 -22.742 11.874 1.00 44.47 ? 445 PHE A C 1 ATOM 3324 O O . PHE A 1 445 ? 25.205 -23.771 11.800 1.00 53.42 ? 445 PHE A O 1 ATOM 3325 C CB . PHE A 1 445 ? 27.723 -22.804 10.227 1.00 45.61 ? 445 PHE A CB 1 ATOM 3326 C CG . PHE A 1 445 ? 29.167 -22.683 9.888 1.00 40.32 ? 445 PHE A CG 1 ATOM 3327 C CD1 . PHE A 1 445 ? 29.984 -23.777 9.948 1.00 43.85 ? 445 PHE A CD1 1 ATOM 3328 C CD2 . PHE A 1 445 ? 29.679 -21.481 9.412 1.00 39.86 ? 445 PHE A CD2 1 ATOM 3329 C CE1 . PHE A 1 445 ? 31.325 -23.667 9.607 1.00 40.69 ? 445 PHE A CE1 1 ATOM 3330 C CE2 . PHE A 1 445 ? 31.017 -21.349 9.115 1.00 36.13 ? 445 PHE A CE2 1 ATOM 3331 C CZ . PHE A 1 445 ? 31.839 -22.451 9.199 1.00 34.62 ? 445 PHE A CZ 1 ATOM 3332 N N . THR A 1 446 ? 25.437 -21.536 12.030 1.00 46.87 ? 446 THR A N 1 ATOM 3333 C CA . THR A 1 446 ? 24.028 -21.384 12.191 1.00 53.14 ? 446 THR A CA 1 ATOM 3334 C C . THR A 1 446 ? 23.491 -20.525 11.066 1.00 54.47 ? 446 THR A C 1 ATOM 3335 O O . THR A 1 446 ? 24.090 -19.525 10.686 1.00 44.12 ? 446 THR A O 1 ATOM 3336 C CB . THR A 1 446 ? 23.684 -20.859 13.588 1.00 54.97 ? 446 THR A CB 1 ATOM 3337 O OG1 . THR A 1 446 ? 23.945 -21.920 14.514 1.00 59.01 ? 446 THR A OG1 1 ATOM 3338 C CG2 . THR A 1 446 ? 22.208 -20.496 13.700 1.00 55.36 ? 446 THR A CG2 1 ATOM 3339 N N . VAL A 1 447 ? 22.394 -21.009 10.488 1.00 48.05 ? 447 VAL A N 1 ATOM 3340 C CA . VAL A 1 447 ? 21.708 -20.331 9.413 1.00 42.58 ? 447 VAL A CA 1 ATOM 3341 C C . VAL A 1 447 ? 20.306 -20.201 9.919 1.00 41.94 ? 447 VAL A C 1 ATOM 3342 O O . VAL A 1 447 ? 19.872 -20.960 10.809 1.00 46.82 ? 447 VAL A O 1 ATOM 3343 C CB . VAL A 1 447 ? 21.721 -21.166 8.095 1.00 38.31 ? 447 VAL A CB 1 ATOM 3344 C CG1 . VAL A 1 447 ? 23.120 -21.279 7.519 1.00 40.05 ? 447 VAL A CG1 1 ATOM 3345 C CG2 . VAL A 1 447 ? 21.178 -22.561 8.314 1.00 43.31 ? 447 VAL A CG2 1 ATOM 3346 N N . ASN A 1 448 ? 19.566 -19.300 9.303 1.00 37.55 ? 448 ASN A N 1 ATOM 3347 C CA . ASN A 1 448 ? 18.135 -19.260 9.495 1.00 42.52 ? 448 ASN A CA 1 ATOM 3348 C C . ASN A 1 448 ? 17.386 -19.454 8.179 1.00 37.79 ? 448 ASN A C 1 ATOM 3349 O O . ASN A 1 448 ? 17.729 -18.880 7.171 1.00 43.86 ? 448 ASN A O 1 ATOM 3350 C CB . ASN A 1 448 ? 17.744 -17.939 10.145 1.00 46.88 ? 448 ASN A CB 1 ATOM 3351 C CG . ASN A 1 448 ? 18.389 -17.765 11.498 1.00 49.71 ? 448 ASN A CG 1 ATOM 3352 O OD1 . ASN A 1 448 ? 19.576 -17.491 11.588 1.00 54.25 ? 448 ASN A OD1 1 ATOM 3353 N ND2 . ASN A 1 448 ? 17.653 -18.094 12.533 1.00 53.97 ? 448 ASN A ND2 1 ATOM 3354 N N . VAL A 1 449 ? 16.337 -20.240 8.232 1.00 40.88 ? 449 VAL A N 1 ATOM 3355 C CA . VAL A 1 449 ? 15.323 -20.249 7.207 1.00 42.95 ? 449 VAL A CA 1 ATOM 3356 C C . VAL A 1 449 ? 14.690 -18.878 7.070 1.00 47.46 ? 449 VAL A C 1 ATOM 3357 O O . VAL A 1 449 ? 14.365 -18.241 8.063 1.00 48.39 ? 449 VAL A O 1 ATOM 3358 C CB . VAL A 1 449 ? 14.255 -21.280 7.546 1.00 41.90 ? 449 VAL A CB 1 ATOM 3359 C CG1 . VAL A 1 449 ? 13.134 -21.267 6.525 1.00 44.87 ? 449 VAL A CG1 1 ATOM 3360 C CG2 . VAL A 1 449 ? 14.917 -22.643 7.653 1.00 41.24 ? 449 VAL A CG2 1 ATOM 3361 N N . PRO A 1 450 ? 14.507 -18.425 5.827 1.00 49.26 ? 450 PRO A N 1 ATOM 3362 C CA . PRO A 1 450 ? 13.825 -17.178 5.632 1.00 40.94 ? 450 PRO A CA 1 ATOM 3363 C C . PRO A 1 450 ? 12.526 -17.175 6.378 1.00 44.10 ? 450 PRO A C 1 ATOM 3364 O O . PRO A 1 450 ? 11.889 -18.204 6.530 1.00 41.19 ? 450 PRO A O 1 ATOM 3365 C CB . PRO A 1 450 ? 13.577 -17.164 4.128 1.00 44.52 ? 450 PRO A CB 1 ATOM 3366 C CG . PRO A 1 450 ? 14.788 -17.827 3.574 1.00 44.93 ? 450 PRO A CG 1 ATOM 3367 C CD . PRO A 1 450 ? 15.177 -18.876 4.592 1.00 50.10 ? 450 PRO A CD 1 ATOM 3368 N N . ASN A 1 451 ? 12.115 -15.983 6.767 1.00 41.22 ? 451 ASN A N 1 ATOM 3369 C CA . ASN A 1 451 ? 11.009 -15.784 7.631 1.00 46.90 ? 451 ASN A CA 1 ATOM 3370 C C . ASN A 1 451 ? 9.693 -15.855 6.912 1.00 48.22 ? 451 ASN A C 1 ATOM 3371 O O . ASN A 1 451 ? 8.662 -15.953 7.547 1.00 64.76 ? 451 ASN A O 1 ATOM 3372 C CB . ASN A 1 451 ? 11.129 -14.409 8.316 1.00 55.91 ? 451 ASN A CB 1 ATOM 3373 C CG . ASN A 1 451 ? 10.521 -14.406 9.705 1.00 58.97 ? 451 ASN A CG 1 ATOM 3374 O OD1 . ASN A 1 451 ? 9.959 -15.408 10.168 1.00 66.35 ? 451 ASN A OD1 1 ATOM 3375 N ND2 . ASN A 1 451 ? 10.592 -13.272 10.362 1.00 74.47 ? 451 ASN A ND2 1 ATOM 3376 N N . ASP A 1 452 ? 9.720 -15.839 5.591 1.00 45.95 ? 452 ASP A N 1 ATOM 3377 C CA . ASP A 1 452 ? 8.502 -15.881 4.794 1.00 40.99 ? 452 ASP A CA 1 ATOM 3378 C C . ASP A 1 452 ? 8.329 -17.252 4.121 1.00 40.79 ? 452 ASP A C 1 ATOM 3379 O O . ASP A 1 452 ? 9.209 -17.691 3.370 1.00 32.59 ? 452 ASP A O 1 ATOM 3380 C CB . ASP A 1 452 ? 8.599 -14.793 3.722 1.00 42.87 ? 452 ASP A CB 1 ATOM 3381 C CG . ASP A 1 452 ? 7.262 -14.369 3.203 1.00 46.79 ? 452 ASP A CG 1 ATOM 3382 O OD1 . ASP A 1 452 ? 6.385 -15.239 2.990 1.00 44.75 ? 452 ASP A OD1 1 ATOM 3383 O OD2 . ASP A 1 452 ? 7.075 -13.145 3.044 1.00 58.49 ? 452 ASP A OD2 1 ATOM 3384 N N . TYR A 1 453 ? 7.140 -17.824 4.250 1.00 31.10 ? 453 TYR A N 1 ATOM 3385 C CA . TYR A 1 453 ? 6.831 -19.118 3.663 1.00 39.28 ? 453 TYR A CA 1 ATOM 3386 C C . TYR A 1 453 ? 6.612 -19.005 2.152 1.00 44.22 ? 453 TYR A C 1 ATOM 3387 O O . TYR A 1 453 ? 6.344 -20.012 1.475 1.00 38.09 ? 453 TYR A O 1 ATOM 3388 C CB . TYR A 1 453 ? 5.549 -19.687 4.265 1.00 40.02 ? 453 TYR A CB 1 ATOM 3389 C CG . TYR A 1 453 ? 5.754 -20.388 5.582 1.00 43.18 ? 453 TYR A CG 1 ATOM 3390 C CD1 . TYR A 1 453 ? 6.612 -21.478 5.680 1.00 41.20 ? 453 TYR A CD1 1 ATOM 3391 C CD2 . TYR A 1 453 ? 5.120 -19.938 6.750 1.00 39.54 ? 453 TYR A CD2 1 ATOM 3392 C CE1 . TYR A 1 453 ? 6.816 -22.143 6.890 1.00 40.24 ? 453 TYR A CE1 1 ATOM 3393 C CE2 . TYR A 1 453 ? 5.307 -20.607 7.969 1.00 41.17 ? 453 TYR A CE2 1 ATOM 3394 C CZ . TYR A 1 453 ? 6.164 -21.702 8.029 1.00 42.93 ? 453 TYR A CZ 1 ATOM 3395 O OH . TYR A 1 453 ? 6.397 -22.350 9.221 1.00 41.75 ? 453 TYR A OH 1 ATOM 3396 N N . GLY A 1 454 ? 6.565 -17.763 1.669 1.00 35.06 ? 454 GLY A N 1 ATOM 3397 C CA . GLY A 1 454 ? 6.489 -17.490 0.262 1.00 38.39 ? 454 GLY A CA 1 ATOM 3398 C C . GLY A 1 454 ? 7.854 -17.595 -0.373 1.00 30.77 ? 454 GLY A C 1 ATOM 3399 O O . GLY A 1 454 ? 7.967 -17.647 -1.576 1.00 34.20 ? 454 GLY A O 1 ATOM 3400 N N . VAL A 1 455 ? 8.882 -17.463 0.436 1.00 30.80 ? 455 VAL A N 1 ATOM 3401 C CA . VAL A 1 455 ? 10.252 -17.632 -0.004 1.00 30.12 ? 455 VAL A CA 1 ATOM 3402 C C . VAL A 1 455 ? 10.610 -19.113 0.216 1.00 35.42 ? 455 VAL A C 1 ATOM 3403 O O . VAL A 1 455 ? 10.881 -19.835 -0.756 1.00 31.43 ? 455 VAL A O 1 ATOM 3404 C CB . VAL A 1 455 ? 11.186 -16.666 0.743 1.00 27.98 ? 455 VAL A CB 1 ATOM 3405 C CG1 . VAL A 1 455 ? 12.648 -16.972 0.482 1.00 28.26 ? 455 VAL A CG1 1 ATOM 3406 C CG2 . VAL A 1 455 ? 10.849 -15.206 0.351 1.00 34.11 ? 455 VAL A CG2 1 ATOM 3407 N N . ALA A 1 456 ? 10.494 -19.563 1.469 1.00 34.14 ? 456 ALA A N 1 ATOM 3408 C CA . ALA A 1 456 ? 10.746 -20.956 1.860 1.00 37.88 ? 456 ALA A CA 1 ATOM 3409 C C . ALA A 1 456 ? 9.435 -21.720 1.826 1.00 34.17 ? 456 ALA A C 1 ATOM 3410 O O . ALA A 1 456 ? 8.675 -21.831 2.806 1.00 35.55 ? 456 ALA A O 1 ATOM 3411 C CB . ALA A 1 456 ? 11.358 -21.008 3.252 1.00 41.99 ? 456 ALA A CB 1 ATOM 3412 N N . ILE A 1 457 ? 9.113 -22.185 0.653 1.00 27.37 ? 457 ILE A N 1 ATOM 3413 C CA . ILE A 1 457 ? 7.852 -22.871 0.492 1.00 27.19 ? 457 ILE A CA 1 ATOM 3414 C C . ILE A 1 457 ? 8.022 -24.139 1.327 1.00 27.05 ? 457 ILE A C 1 ATOM 3415 O O . ILE A 1 457 ? 9.097 -24.740 1.286 1.00 29.97 ? 457 ILE A O 1 ATOM 3416 C CB . ILE A 1 457 ? 7.632 -23.194 -0.985 1.00 24.85 ? 457 ILE A CB 1 ATOM 3417 C CG1 . ILE A 1 457 ? 7.429 -21.873 -1.755 1.00 27.32 ? 457 ILE A CG1 1 ATOM 3418 C CG2 . ILE A 1 457 ? 6.469 -24.162 -1.189 1.00 25.10 ? 457 ILE A CG2 1 ATOM 3419 C CD1 . ILE A 1 457 ? 6.054 -21.221 -1.682 1.00 24.05 ? 457 ILE A CD1 1 ATOM 3420 N N . PRO A 1 458 ? 6.989 -24.533 2.089 1.00 25.71 ? 458 PRO A N 1 ATOM 3421 C CA . PRO A 1 458 ? 7.058 -25.693 2.958 1.00 27.60 ? 458 PRO A CA 1 ATOM 3422 C C . PRO A 1 458 ? 7.517 -26.939 2.178 1.00 28.55 ? 458 PRO A C 1 ATOM 3423 O O . PRO A 1 458 ? 7.131 -27.112 1.057 1.00 26.89 ? 458 PRO A O 1 ATOM 3424 C CB . PRO A 1 458 ? 5.608 -25.886 3.362 1.00 30.14 ? 458 PRO A CB 1 ATOM 3425 C CG . PRO A 1 458 ? 5.073 -24.521 3.410 1.00 33.30 ? 458 PRO A CG 1 ATOM 3426 C CD . PRO A 1 458 ? 5.717 -23.820 2.260 1.00 31.01 ? 458 PRO A CD 1 ATOM 3427 N N . GLY A 1 459 ? 8.269 -27.810 2.809 1.00 28.29 ? 459 GLY A N 1 ATOM 3428 C CA . GLY A 1 459 ? 8.547 -29.143 2.273 1.00 24.01 ? 459 GLY A CA 1 ATOM 3429 C C . GLY A 1 459 ? 10.013 -29.378 2.334 1.00 23.14 ? 459 GLY A C 1 ATOM 3430 O O . GLY A 1 459 ? 10.747 -28.679 3.052 1.00 24.67 ? 459 GLY A O 1 ATOM 3431 N N . TYR A 1 460 ? 10.462 -30.428 1.660 1.00 23.87 ? 460 TYR A N 1 ATOM 3432 C CA . TYR A 1 460 ? 11.858 -30.836 1.800 1.00 23.70 ? 460 TYR A CA 1 ATOM 3433 C C . TYR A 1 460 ? 12.837 -30.030 0.940 1.00 24.23 ? 460 TYR A C 1 ATOM 3434 O O . TYR A 1 460 ? 12.531 -29.665 -0.200 1.00 25.70 ? 460 TYR A O 1 ATOM 3435 C CB . TYR A 1 460 ? 11.951 -32.317 1.413 1.00 28.79 ? 460 TYR A CB 1 ATOM 3436 C CG . TYR A 1 460 ? 11.861 -33.289 2.557 1.00 24.87 ? 460 TYR A CG 1 ATOM 3437 C CD1 . TYR A 1 460 ? 13.015 -33.635 3.240 1.00 25.22 ? 460 TYR A CD1 1 ATOM 3438 C CD2 . TYR A 1 460 ? 10.684 -33.953 2.860 1.00 25.11 ? 460 TYR A CD2 1 ATOM 3439 C CE1 . TYR A 1 460 ? 12.996 -34.574 4.231 1.00 29.51 ? 460 TYR A CE1 1 ATOM 3440 C CE2 . TYR A 1 460 ? 10.639 -34.936 3.876 1.00 27.00 ? 460 TYR A CE2 1 ATOM 3441 C CZ . TYR A 1 460 ? 11.802 -35.218 4.557 1.00 27.13 ? 460 TYR A CZ 1 ATOM 3442 O OH . TYR A 1 460 ? 11.891 -36.110 5.570 1.00 30.23 ? 460 TYR A OH 1 ATOM 3443 N N . TYR A 1 461 ? 14.027 -29.812 1.482 1.00 23.90 ? 461 TYR A N 1 ATOM 3444 C CA . TYR A 1 461 ? 15.091 -29.092 0.870 1.00 24.23 ? 461 TYR A CA 1 ATOM 3445 C C . TYR A 1 461 ? 16.323 -29.902 1.035 1.00 28.67 ? 461 TYR A C 1 ATOM 3446 O O . TYR A 1 461 ? 16.418 -30.729 1.973 1.00 27.60 ? 461 TYR A O 1 ATOM 3447 C CB . TYR A 1 461 ? 15.352 -27.734 1.559 1.00 24.60 ? 461 TYR A CB 1 ATOM 3448 C CG . TYR A 1 461 ? 14.325 -26.688 1.236 1.00 23.56 ? 461 TYR A CG 1 ATOM 3449 C CD1 . TYR A 1 461 ? 13.085 -26.766 1.782 1.00 25.85 ? 461 TYR A CD1 1 ATOM 3450 C CD2 . TYR A 1 461 ? 14.590 -25.659 0.329 1.00 24.76 ? 461 TYR A CD2 1 ATOM 3451 C CE1 . TYR A 1 461 ? 12.103 -25.849 1.489 1.00 24.76 ? 461 TYR A CE1 1 ATOM 3452 C CE2 . TYR A 1 461 ? 13.602 -24.740 0.009 1.00 24.75 ? 461 TYR A CE2 1 ATOM 3453 C CZ . TYR A 1 461 ? 12.389 -24.816 0.628 1.00 22.60 ? 461 TYR A CZ 1 ATOM 3454 O OH . TYR A 1 461 ? 11.344 -23.978 0.354 1.00 27.49 ? 461 TYR A OH 1 ATOM 3455 N N . MET A 1 462 ? 17.292 -29.626 0.162 1.00 26.17 ? 462 MET A N 1 ATOM 3456 C CA . MET A 1 462 ? 18.655 -30.065 0.325 1.00 24.86 ? 462 MET A CA 1 ATOM 3457 C C . MET A 1 462 ? 19.472 -28.907 0.825 1.00 29.42 ? 462 MET A C 1 ATOM 3458 O O . MET A 1 462 ? 19.432 -27.808 0.238 1.00 27.10 ? 462 MET A O 1 ATOM 3459 C CB . MET A 1 462 ? 19.221 -30.558 -0.999 1.00 24.04 ? 462 MET A CB 1 ATOM 3460 C CG . MET A 1 462 ? 18.480 -31.795 -1.558 1.00 27.92 ? 462 MET A CG 1 ATOM 3461 S SD . MET A 1 462 ? 18.974 -32.229 -3.253 1.00 31.36 ? 462 MET A SD 1 ATOM 3462 C CE . MET A 1 462 ? 17.975 -31.081 -4.235 1.00 28.00 ? 462 MET A CE 1 ATOM 3463 N N . LEU A 1 463 ? 20.222 -29.151 1.903 1.00 26.75 ? 463 LEU A N 1 ATOM 3464 C CA . LEU A 1 463 ? 21.165 -28.182 2.440 1.00 26.98 ? 463 LEU A CA 1 ATOM 3465 C C . LEU A 1 463 ? 22.527 -28.502 1.909 1.00 24.97 ? 463 LEU A C 1 ATOM 3466 O O . LEU A 1 463 ? 23.043 -29.580 2.155 1.00 29.12 ? 463 LEU A O 1 ATOM 3467 C CB . LEU A 1 463 ? 21.206 -28.225 3.978 1.00 32.89 ? 463 LEU A CB 1 ATOM 3468 C CG . LEU A 1 463 ? 21.324 -26.827 4.599 1.00 36.87 ? 463 LEU A CG 1 ATOM 3469 C CD1 . LEU A 1 463 ? 20.833 -26.801 6.043 1.00 45.33 ? 463 LEU A CD1 1 ATOM 3470 C CD2 . LEU A 1 463 ? 22.737 -26.273 4.422 1.00 35.34 ? 463 LEU A CD2 1 ATOM 3471 N N . PHE A 1 464 ? 23.110 -27.584 1.153 1.00 22.83 ? 464 PHE A N 1 ATOM 3472 C CA . PHE A 1 464 ? 24.446 -27.765 0.661 1.00 25.82 ? 464 PHE A CA 1 ATOM 3473 C C . PHE A 1 464 ? 25.391 -26.828 1.419 1.00 31.34 ? 464 PHE A C 1 ATOM 3474 O O . PHE A 1 464 ? 25.117 -25.645 1.572 1.00 30.35 ? 464 PHE A O 1 ATOM 3475 C CB . PHE A 1 464 ? 24.552 -27.434 -0.836 1.00 25.52 ? 464 PHE A CB 1 ATOM 3476 C CG . PHE A 1 464 ? 23.886 -28.456 -1.743 1.00 28.14 ? 464 PHE A CG 1 ATOM 3477 C CD1 . PHE A 1 464 ? 24.613 -29.534 -2.254 1.00 28.51 ? 464 PHE A CD1 1 ATOM 3478 C CD2 . PHE A 1 464 ? 22.601 -28.261 -2.182 1.00 24.54 ? 464 PHE A CD2 1 ATOM 3479 C CE1 . PHE A 1 464 ? 24.027 -30.470 -3.071 1.00 29.97 ? 464 PHE A CE1 1 ATOM 3480 C CE2 . PHE A 1 464 ? 21.996 -29.201 -3.010 1.00 30.50 ? 464 PHE A CE2 1 ATOM 3481 C CZ . PHE A 1 464 ? 22.718 -30.284 -3.487 1.00 24.93 ? 464 PHE A CZ 1 ATOM 3482 N N . ALA A 1 465 ? 26.589 -27.313 1.676 1.00 36.25 ? 465 ALA A N 1 ATOM 3483 C CA . ALA A 1 465 ? 27.680 -26.440 2.154 1.00 37.91 ? 465 ALA A CA 1 ATOM 3484 C C . ALA A 1 465 ? 28.758 -26.443 1.108 1.00 27.48 ? 465 ALA A C 1 ATOM 3485 O O . ALA A 1 465 ? 29.092 -27.468 0.579 1.00 31.92 ? 465 ALA A O 1 ATOM 3486 C CB . ALA A 1 465 ? 28.217 -26.963 3.491 1.00 39.75 ? 465 ALA A CB 1 ATOM 3487 N N . MET A 1 466 ? 29.252 -25.288 0.725 1.00 31.63 ? 466 MET A N 1 ATOM 3488 C CA . MET A 1 466 ? 30.344 -25.239 -0.215 1.00 33.52 ? 466 MET A CA 1 ATOM 3489 C C . MET A 1 466 ? 31.574 -24.667 0.497 1.00 45.77 ? 466 MET A C 1 ATOM 3490 O O . MET A 1 466 ? 31.496 -23.662 1.250 1.00 35.92 ? 466 MET A O 1 ATOM 3491 C CB . MET A 1 466 ? 29.954 -24.408 -1.416 1.00 38.82 ? 466 MET A CB 1 ATOM 3492 C CG . MET A 1 466 ? 28.795 -25.064 -2.210 1.00 42.59 ? 466 MET A CG 1 ATOM 3493 S SD . MET A 1 466 ? 27.651 -23.823 -2.777 1.00 58.81 ? 466 MET A SD 1 ATOM 3494 C CE . MET A 1 466 ? 26.671 -23.610 -1.286 1.00 43.64 ? 466 MET A CE 1 ATOM 3495 N N . ASN A 1 467 ? 32.691 -25.356 0.319 1.00 40.12 ? 467 ASN A N 1 ATOM 3496 C CA . ASN A 1 467 ? 33.908 -24.924 0.965 1.00 50.26 ? 467 ASN A CA 1 ATOM 3497 C C . ASN A 1 467 ? 34.457 -23.729 0.200 1.00 48.30 ? 467 ASN A C 1 ATOM 3498 O O . ASN A 1 467 ? 33.764 -23.138 -0.619 1.00 43.43 ? 467 ASN A O 1 ATOM 3499 C CB . ASN A 1 467 ? 34.912 -26.074 1.076 1.00 43.80 ? 467 ASN A CB 1 ATOM 3500 C CG . ASN A 1 467 ? 35.474 -26.500 -0.272 1.00 40.31 ? 467 ASN A CG 1 ATOM 3501 O OD1 . ASN A 1 467 ? 35.473 -25.754 -1.252 1.00 45.25 ? 467 ASN A OD1 1 ATOM 3502 N ND2 . ASN A 1 467 ? 35.950 -27.717 -0.316 1.00 43.27 ? 467 ASN A ND2 1 ATOM 3503 N N . GLU A 1 468 ? 35.717 -23.400 0.468 1.00 52.92 ? 468 GLU A N 1 ATOM 3504 C CA . GLU A 1 468 ? 36.312 -22.130 0.092 1.00 47.87 ? 468 GLU A CA 1 ATOM 3505 C C . GLU A 1 468 ? 36.709 -22.224 -1.386 1.00 42.03 ? 468 GLU A C 1 ATOM 3506 O O . GLU A 1 468 ? 36.616 -21.253 -2.114 1.00 49.30 ? 468 GLU A O 1 ATOM 3507 C CB . GLU A 1 468 ? 37.514 -21.782 1.026 1.00 52.71 ? 468 GLU A CB 1 ATOM 3508 C CG . GLU A 1 468 ? 37.959 -22.904 1.986 0.70 56.41 ? 468 GLU A CG 1 ATOM 3509 C CD . GLU A 1 468 ? 38.883 -22.432 3.107 0.60 62.93 ? 468 GLU A CD 1 ATOM 3510 O OE1 . GLU A 1 468 ? 39.976 -21.901 2.790 0.70 52.80 ? 468 GLU A OE1 1 ATOM 3511 O OE2 . GLU A 1 468 ? 38.528 -22.628 4.306 0.70 55.46 ? 468 GLU A OE2 1 ATOM 3512 N N . ALA A 1 469 ? 37.054 -23.417 -1.852 1.00 43.36 ? 469 ALA A N 1 ATOM 3513 C CA . ALA A 1 469 ? 37.180 -23.670 -3.289 1.00 45.17 ? 469 ALA A CA 1 ATOM 3514 C C . ALA A 1 469 ? 35.845 -23.605 -4.080 1.00 50.51 ? 469 ALA A C 1 ATOM 3515 O O . ALA A 1 469 ? 35.879 -23.653 -5.290 1.00 51.85 ? 469 ALA A O 1 ATOM 3516 C CB . ALA A 1 469 ? 37.832 -25.025 -3.508 1.00 44.25 ? 469 ALA A CB 1 ATOM 3517 N N . GLY A 1 470 ? 34.680 -23.560 -3.437 1.00 45.05 ? 470 GLY A N 1 ATOM 3518 C CA . GLY A 1 470 ? 33.400 -23.701 -4.190 1.00 42.29 ? 470 GLY A CA 1 ATOM 3519 C C . GLY A 1 470 ? 32.890 -25.144 -4.343 1.00 41.26 ? 470 GLY A C 1 ATOM 3520 O O . GLY A 1 470 ? 31.911 -25.379 -5.026 1.00 37.32 ? 470 GLY A O 1 ATOM 3521 N N . VAL A 1 471 ? 33.531 -26.110 -3.681 1.00 36.21 ? 471 VAL A N 1 ATOM 3522 C CA . VAL A 1 471 ? 33.146 -27.506 -3.816 1.00 33.64 ? 471 VAL A CA 1 ATOM 3523 C C . VAL A 1 471 ? 32.029 -27.815 -2.869 1.00 36.46 ? 471 VAL A C 1 ATOM 3524 O O . VAL A 1 471 ? 32.139 -27.523 -1.686 1.00 38.63 ? 471 VAL A O 1 ATOM 3525 C CB . VAL A 1 471 ? 34.320 -28.449 -3.586 1.00 38.19 ? 471 VAL A CB 1 ATOM 3526 C CG1 . VAL A 1 471 ? 33.943 -29.922 -3.818 1.00 34.02 ? 471 VAL A CG1 1 ATOM 3527 C CG2 . VAL A 1 471 ? 35.460 -28.033 -4.485 1.00 33.44 ? 471 VAL A CG2 1 ATOM 3528 N N . PRO A 1 472 ? 30.888 -28.324 -3.405 1.00 33.85 ? 472 PRO A N 1 ATOM 3529 C CA . PRO A 1 472 ? 29.765 -28.542 -2.532 1.00 32.55 ? 472 PRO A CA 1 ATOM 3530 C C . PRO A 1 472 ? 29.870 -29.913 -1.876 1.00 28.41 ? 472 PRO A C 1 ATOM 3531 O O . PRO A 1 472 ? 30.379 -30.849 -2.464 1.00 32.35 ? 472 PRO A O 1 ATOM 3532 C CB . PRO A 1 472 ? 28.557 -28.487 -3.509 1.00 32.28 ? 472 PRO A CB 1 ATOM 3533 C CG . PRO A 1 472 ? 29.123 -29.017 -4.773 1.00 28.87 ? 472 PRO A CG 1 ATOM 3534 C CD . PRO A 1 472 ? 30.492 -28.415 -4.827 1.00 31.59 ? 472 PRO A CD 1 ATOM 3535 N N . CYS A 1 473 ? 29.273 -30.042 -0.714 1.00 33.41 ? 473 CYS A N 1 ATOM 3536 C CA . CYS A 1 473 ? 29.138 -31.323 -0.072 1.00 34.00 ? 473 CYS A CA 1 ATOM 3537 C C . CYS A 1 473 ? 27.979 -32.091 -0.729 1.00 37.87 ? 473 CYS A C 1 ATOM 3538 O O . CYS A 1 473 ? 27.182 -31.522 -1.469 1.00 31.89 ? 473 CYS A O 1 ATOM 3539 C CB . CYS A 1 473 ? 28.847 -31.090 1.395 1.00 34.15 ? 473 CYS A CB 1 ATOM 3540 S SG . CYS A 1 473 ? 27.207 -30.465 1.811 1.00 35.38 ? 473 CYS A SG 1 ATOM 3541 N N . VAL A 1 474 ? 27.837 -33.354 -0.389 1.00 33.73 ? 474 VAL A N 1 ATOM 3542 C CA . VAL A 1 474 ? 26.565 -34.048 -0.583 1.00 32.56 ? 474 VAL A CA 1 ATOM 3543 C C . VAL A 1 474 ? 25.494 -33.530 0.390 1.00 37.54 ? 474 VAL A C 1 ATOM 3544 O O . VAL A 1 474 ? 25.696 -33.438 1.591 1.00 38.97 ? 474 VAL A O 1 ATOM 3545 C CB . VAL A 1 474 ? 26.741 -35.552 -0.478 1.00 33.58 ? 474 VAL A CB 1 ATOM 3546 C CG1 . VAL A 1 474 ? 25.400 -36.278 -0.657 1.00 35.15 ? 474 VAL A CG1 1 ATOM 3547 C CG2 . VAL A 1 474 ? 27.776 -36.001 -1.498 1.00 34.00 ? 474 VAL A CG2 1 ATOM 3548 N N . ALA A 1 475 ? 24.369 -33.098 -0.140 1.00 30.56 ? 475 ALA A N 1 ATOM 3549 C CA . ALA A 1 475 ? 23.390 -32.431 0.716 1.00 33.21 ? 475 ALA A CA 1 ATOM 3550 C C . ALA A 1 475 ? 22.824 -33.289 1.855 1.00 34.54 ? 475 ALA A C 1 ATOM 3551 O O . ALA A 1 475 ? 22.676 -34.486 1.752 1.00 28.58 ? 475 ALA A O 1 ATOM 3552 C CB . ALA A 1 475 ? 22.245 -31.902 -0.111 1.00 33.87 ? 475 ALA A CB 1 ATOM 3553 N N . GLN A 1 476 ? 22.377 -32.617 2.898 1.00 26.61 ? 476 GLN A N 1 ATOM 3554 C CA . GLN A 1 476 ? 21.519 -33.204 3.856 1.00 29.64 ? 476 GLN A CA 1 ATOM 3555 C C . GLN A 1 476 ? 20.143 -32.744 3.532 1.00 27.22 ? 476 GLN A C 1 ATOM 3556 O O . GLN A 1 476 ? 19.962 -31.641 3.050 1.00 34.47 ? 476 GLN A O 1 ATOM 3557 C CB . GLN A 1 476 ? 21.900 -32.694 5.251 1.00 37.74 ? 476 GLN A CB 1 ATOM 3558 C CG . GLN A 1 476 ? 23.200 -33.302 5.739 1.00 45.68 ? 476 GLN A CG 1 ATOM 3559 C CD . GLN A 1 476 ? 22.947 -34.566 6.554 1.00 52.69 ? 476 GLN A CD 1 ATOM 3560 O OE1 . GLN A 1 476 ? 21.972 -34.643 7.314 1.00 52.50 ? 476 GLN A OE1 1 ATOM 3561 N NE2 . GLN A 1 476 ? 23.786 -35.570 6.362 0.70 53.72 ? 476 GLN A NE2 1 ATOM 3562 N N . PHE A 1 477 ? 19.164 -33.551 3.879 1.00 26.58 ? 477 PHE A N 1 ATOM 3563 C CA . PHE A 1 477 ? 17.796 -33.216 3.666 1.00 30.58 ? 477 PHE A CA 1 ATOM 3564 C C . PHE A 1 477 ? 17.209 -32.669 4.929 1.00 33.23 ? 477 PHE A C 1 ATOM 3565 O O . PHE A 1 477 ? 17.471 -33.205 5.994 1.00 35.03 ? 477 PHE A O 1 ATOM 3566 C CB . PHE A 1 477 ? 17.030 -34.467 3.259 1.00 30.61 ? 477 PHE A CB 1 ATOM 3567 C CG . PHE A 1 477 ? 17.330 -34.930 1.867 1.00 29.39 ? 477 PHE A CG 1 ATOM 3568 C CD1 . PHE A 1 477 ? 16.550 -34.491 0.800 1.00 30.85 ? 477 PHE A CD1 1 ATOM 3569 C CD2 . PHE A 1 477 ? 18.299 -35.893 1.631 1.00 25.59 ? 477 PHE A CD2 1 ATOM 3570 C CE1 . PHE A 1 477 ? 16.821 -34.931 -0.492 1.00 26.61 ? 477 PHE A CE1 1 ATOM 3571 C CE2 . PHE A 1 477 ? 18.597 -36.305 0.344 1.00 24.56 ? 477 PHE A CE2 1 ATOM 3572 C CZ . PHE A 1 477 ? 17.849 -35.825 -0.716 1.00 26.87 ? 477 PHE A CZ 1 ATOM 3573 N N . PHE A 1 478 ? 16.294 -31.715 4.799 1.00 26.85 ? 478 PHE A N 1 ATOM 3574 C CA . PHE A 1 478 ? 15.532 -31.267 5.929 1.00 30.00 ? 478 PHE A CA 1 ATOM 3575 C C . PHE A 1 478 ? 14.266 -30.668 5.417 1.00 32.17 ? 478 PHE A C 1 ATOM 3576 O O . PHE A 1 478 ? 14.161 -30.405 4.232 1.00 30.65 ? 478 PHE A O 1 ATOM 3577 C CB . PHE A 1 478 ? 16.331 -30.262 6.760 1.00 36.87 ? 478 PHE A CB 1 ATOM 3578 C CG . PHE A 1 478 ? 16.482 -28.918 6.125 1.00 32.97 ? 478 PHE A CG 1 ATOM 3579 C CD1 . PHE A 1 478 ? 17.465 -28.700 5.181 1.00 33.00 ? 478 PHE A CD1 1 ATOM 3580 C CD2 . PHE A 1 478 ? 15.610 -27.891 6.440 1.00 34.29 ? 478 PHE A CD2 1 ATOM 3581 C CE1 . PHE A 1 478 ? 17.572 -27.492 4.528 1.00 33.31 ? 478 PHE A CE1 1 ATOM 3582 C CE2 . PHE A 1 478 ? 15.737 -26.662 5.823 1.00 37.80 ? 478 PHE A CE2 1 ATOM 3583 C CZ . PHE A 1 478 ? 16.745 -26.463 4.878 1.00 33.50 ? 478 PHE A CZ 1 ATOM 3584 N N . LYS A 1 479 ? 13.271 -30.542 6.272 1.00 31.14 ? 479 LYS A N 1 ATOM 3585 C CA . LYS A 1 479 ? 12.042 -29.904 5.856 1.00 35.39 ? 479 LYS A CA 1 ATOM 3586 C C . LYS A 1 479 ? 11.698 -28.612 6.562 1.00 36.58 ? 479 LYS A C 1 ATOM 3587 O O . LYS A 1 479 ? 12.144 -28.345 7.668 1.00 36.07 ? 479 LYS A O 1 ATOM 3588 C CB . LYS A 1 479 ? 10.858 -30.869 5.856 1.00 40.27 ? 479 LYS A CB 1 ATOM 3589 C CG . LYS A 1 479 ? 10.577 -31.619 7.096 1.00 48.71 ? 479 LYS A CG 1 ATOM 3590 C CD . LYS A 1 479 ? 9.340 -32.457 6.839 1.00 50.49 ? 479 LYS A CD 1 ATOM 3591 C CE . LYS A 1 479 ? 8.986 -33.249 8.068 1.00 54.49 ? 479 LYS A CE 1 ATOM 3592 N NZ . LYS A 1 479 ? 7.585 -33.722 7.941 1.00 59.20 ? 479 LYS A NZ 1 ATOM 3593 N N . VAL A 1 480 ? 10.954 -27.781 5.837 1.00 36.94 ? 480 VAL A N 1 ATOM 3594 C CA . VAL A 1 480 ? 10.406 -26.555 6.336 1.00 32.58 ? 480 VAL A CA 1 ATOM 3595 C C . VAL A 1 480 ? 8.945 -26.849 6.597 1.00 37.59 ? 480 VAL A C 1 ATOM 3596 O O . VAL A 1 480 ? 8.251 -27.286 5.690 1.00 33.30 ? 480 VAL A O 1 ATOM 3597 C CB . VAL A 1 480 ? 10.591 -25.426 5.315 1.00 37.17 ? 480 VAL A CB 1 ATOM 3598 C CG1 . VAL A 1 480 ? 9.716 -24.227 5.619 1.00 39.84 ? 480 VAL A CG1 1 ATOM 3599 C CG2 . VAL A 1 480 ? 12.042 -25.019 5.277 1.00 35.97 ? 480 VAL A CG2 1 ATOM 3600 N N . THR A 1 481 ? 8.508 -26.729 7.861 1.00 37.69 ? 481 THR A N 1 ATOM 3601 C CA . THR A 1 481 ? 7.125 -27.082 8.258 1.00 35.52 ? 481 THR A CA 1 ATOM 3602 C C . THR A 1 481 ? 6.285 -25.841 8.505 1.00 36.98 ? 481 THR A C 1 ATOM 3603 O O . THR A 1 481 ? 6.837 -24.803 8.769 1.00 38.76 ? 481 THR A O 1 ATOM 3604 C CB . THR A 1 481 ? 7.154 -27.873 9.574 1.00 46.16 ? 481 THR A CB 1 ATOM 3605 O OG1 . THR A 1 481 ? 7.998 -27.174 10.497 1.00 46.94 ? 481 THR A OG1 1 ATOM 3606 C CG2 . THR A 1 481 ? 7.735 -29.253 9.362 1.00 45.97 ? 481 THR A CG2 1 ATOM 3607 N N . LEU A 1 482 ? 4.960 -25.997 8.483 1.00 44.69 ? 482 LEU A N 1 ATOM 3608 C CA . LEU A 1 482 ? 3.969 -24.937 8.730 1.00 54.56 ? 482 LEU A CA 1 ATOM 3609 C C . LEU A 1 482 ? 3.599 -24.769 10.209 1.00 61.28 ? 482 LEU A C 1 ATOM 3610 O O . LEU A 1 482 ? 4.317 -25.233 11.089 1.00 60.89 ? 482 LEU A O 1 ATOM 3611 C CB . LEU A 1 482 ? 2.674 -25.251 7.968 1.00 53.45 ? 482 LEU A CB 1 ATOM 3612 C CG . LEU A 1 482 ? 2.648 -25.015 6.441 1.00 51.95 ? 482 LEU A CG 1 ATOM 3613 C CD1 . LEU A 1 482 ? 1.483 -25.741 5.774 1.00 51.90 ? 482 LEU A CD1 1 ATOM 3614 C CD2 . LEU A 1 482 ? 2.600 -23.515 6.139 1.00 49.04 ? 482 LEU A CD2 1 HETATM 3615 C C1 . NAG B 2 . ? 24.872 -52.997 -8.066 1.00 28.67 ? 501 NAG A C1 1 HETATM 3616 C C2 . NAG B 2 . ? 26.003 -52.328 -7.265 1.00 24.45 ? 501 NAG A C2 1 HETATM 3617 C C3 . NAG B 2 . ? 27.185 -53.285 -7.116 1.00 26.63 ? 501 NAG A C3 1 HETATM 3618 C C4 . NAG B 2 . ? 26.687 -54.617 -6.615 1.00 25.69 ? 501 NAG A C4 1 HETATM 3619 C C5 . NAG B 2 . ? 25.647 -55.174 -7.555 1.00 27.09 ? 501 NAG A C5 1 HETATM 3620 C C6 . NAG B 2 . ? 25.167 -56.589 -7.132 1.00 22.85 ? 501 NAG A C6 1 HETATM 3621 C C7 . NAG B 2 . ? 27.086 -50.945 -9.086 1.00 25.16 ? 501 NAG A C7 1 HETATM 3622 C C8 . NAG B 2 . ? 27.378 -49.521 -9.446 1.00 26.14 ? 501 NAG A C8 1 HETATM 3623 N N2 . NAG B 2 . ? 26.440 -51.102 -7.937 1.00 22.47 ? 501 NAG A N2 1 HETATM 3624 O O3 . NAG B 2 . ? 28.166 -52.784 -6.208 1.00 22.87 ? 501 NAG A O3 1 HETATM 3625 O O4 . NAG B 2 . ? 27.808 -55.509 -6.601 1.00 27.80 ? 501 NAG A O4 1 HETATM 3626 O O5 . NAG B 2 . ? 24.515 -54.272 -7.576 1.00 26.21 ? 501 NAG A O5 1 HETATM 3627 O O6 . NAG B 2 . ? 24.205 -56.990 -8.101 1.00 22.85 ? 501 NAG A O6 1 HETATM 3628 O O7 . NAG B 2 . ? 27.414 -51.859 -9.822 1.00 26.78 ? 501 NAG A O7 1 HETATM 3629 C C1 . NAG C 2 . ? -2.742 -11.507 2.011 1.00 62.38 ? 502 NAG A C1 1 HETATM 3630 C C2 . NAG C 2 . ? -2.516 -10.115 2.597 1.00 68.52 ? 502 NAG A C2 1 HETATM 3631 C C3 . NAG C 2 . ? -3.872 -9.449 2.881 0.95 70.66 ? 502 NAG A C3 1 HETATM 3632 C C4 . NAG C 2 . ? -4.979 -9.722 1.856 1.00 70.75 ? 502 NAG A C4 1 HETATM 3633 C C5 . NAG C 2 . ? -4.972 -11.117 1.263 1.00 76.34 ? 502 NAG A C5 1 HETATM 3634 C C6 . NAG C 2 . ? -5.876 -11.149 0.030 1.00 69.55 ? 502 NAG A C6 1 HETATM 3635 C C7 . NAG C 2 . ? -0.510 -9.705 4.022 0.90 71.34 ? 502 NAG A C7 1 HETATM 3636 C C8 . NAG C 2 . ? 0.180 -10.028 5.323 0.90 72.99 ? 502 NAG A C8 1 HETATM 3637 N N2 . NAG C 2 . ? -1.700 -10.284 3.807 1.00 68.90 ? 502 NAG A N2 1 HETATM 3638 O O3 . NAG C 2 . ? -3.703 -8.035 2.876 1.00 74.73 ? 502 NAG A O3 1 HETATM 3639 O O4 . NAG C 2 . ? -6.271 -9.554 2.437 1.00 71.87 ? 502 NAG A O4 1 HETATM 3640 O O5 . NAG C 2 . ? -3.634 -11.451 0.902 1.00 75.90 ? 502 NAG A O5 1 HETATM 3641 O O6 . NAG C 2 . ? -6.493 -12.430 -0.103 1.00 62.45 ? 502 NAG A O6 1 HETATM 3642 O O7 . NAG C 2 . ? 0.006 -8.940 3.227 1.00 62.99 ? 502 NAG A O7 1 HETATM 3643 CU CU . CU1 D 3 . ? 3.591 -35.180 -23.620 0.75 43.18 ? 503 CU1 A CU 1 HETATM 3644 C C . ACT E 4 . ? 25.006 -40.084 -9.282 1.00 55.99 ? 504 ACT A C 1 HETATM 3645 O O . ACT E 4 . ? 25.875 -39.344 -9.872 1.00 43.44 ? 504 ACT A O 1 HETATM 3646 O OXT . ACT E 4 . ? 25.033 -41.365 -9.434 1.00 39.19 ? 504 ACT A OXT 1 HETATM 3647 C CH3 . ACT E 4 . ? 24.027 -39.453 -8.276 1.00 31.94 ? 504 ACT A CH3 1 HETATM 3648 O O . HOH F 5 . ? 4.068 -14.977 2.899 1.00 42.54 ? 601 HOH A O 1 HETATM 3649 O O . HOH F 5 . ? 26.119 -40.928 -15.566 1.00 38.78 ? 602 HOH A O 1 HETATM 3650 O O . HOH F 5 . ? 28.815 -37.157 -13.448 1.00 35.05 ? 603 HOH A O 1 HETATM 3651 O O . HOH F 5 . ? 32.062 -21.384 -0.426 1.00 41.01 ? 604 HOH A O 1 HETATM 3652 O O . HOH F 5 . ? 22.927 -26.167 -32.785 1.00 38.23 ? 605 HOH A O 1 HETATM 3653 O O . HOH F 5 . ? -14.372 -25.488 -16.257 1.00 42.22 ? 606 HOH A O 1 HETATM 3654 O O . HOH F 5 . ? -9.810 -27.186 -1.313 1.00 42.25 ? 607 HOH A O 1 HETATM 3655 O O . HOH F 5 . ? 30.694 -15.860 -10.757 1.00 44.78 ? 608 HOH A O 1 HETATM 3656 O O . HOH F 5 . ? 3.741 -38.157 5.638 1.00 50.77 ? 609 HOH A O 1 HETATM 3657 O O . HOH F 5 . ? 29.799 -10.623 -17.203 1.00 37.17 ? 610 HOH A O 1 HETATM 3658 O O . HOH F 5 . ? 13.212 -37.911 -29.183 1.00 29.22 ? 611 HOH A O 1 HETATM 3659 O O . HOH F 5 . ? 2.471 -46.269 -0.747 1.00 30.09 ? 612 HOH A O 1 HETATM 3660 O O . HOH F 5 . ? 21.023 -22.010 -23.360 1.00 24.83 ? 613 HOH A O 1 HETATM 3661 O O . HOH F 5 . ? -7.798 -38.774 -20.838 1.00 39.48 ? 614 HOH A O 1 HETATM 3662 O O . HOH F 5 . ? 15.628 -29.299 -6.900 1.00 27.92 ? 615 HOH A O 1 HETATM 3663 O O . HOH F 5 . ? 5.585 -39.516 -17.744 1.00 27.17 ? 616 HOH A O 1 HETATM 3664 O O . HOH F 5 . ? 8.644 -40.275 -33.942 1.00 36.84 ? 617 HOH A O 1 HETATM 3665 O O . HOH F 5 . ? 19.064 -35.639 -34.860 1.00 36.63 ? 618 HOH A O 1 HETATM 3666 O O . HOH F 5 . ? 9.115 -17.209 -28.396 1.00 33.13 ? 619 HOH A O 1 HETATM 3667 O O . HOH F 5 . ? 11.228 -16.538 -26.333 1.00 19.74 ? 620 HOH A O 1 HETATM 3668 O O . HOH F 5 . ? 27.413 -30.735 -20.475 1.00 26.69 ? 621 HOH A O 1 HETATM 3669 O O . HOH F 5 . ? 30.029 -16.516 -16.592 1.00 42.64 ? 622 HOH A O 1 HETATM 3670 O O . HOH F 5 . ? -6.189 -14.571 -22.929 1.00 45.18 ? 623 HOH A O 1 HETATM 3671 O O . HOH F 5 . ? 0.417 -53.053 -19.539 1.00 58.36 ? 624 HOH A O 1 HETATM 3672 O O . HOH F 5 . ? -1.590 -47.805 -6.933 1.00 34.69 ? 625 HOH A O 1 HETATM 3673 O O . HOH F 5 . ? 14.663 -18.370 -33.313 1.00 40.55 ? 626 HOH A O 1 HETATM 3674 O O . HOH F 5 . ? 20.705 -12.335 -9.324 1.00 37.57 ? 627 HOH A O 1 HETATM 3675 O O . HOH F 5 . ? 17.499 -27.629 -8.628 1.00 25.71 ? 628 HOH A O 1 HETATM 3676 O O . HOH F 5 . ? 12.224 -49.427 -3.323 1.00 33.38 ? 629 HOH A O 1 HETATM 3677 O O . HOH F 5 . ? 9.143 -22.733 -16.607 1.00 32.23 ? 630 HOH A O 1 HETATM 3678 O O . HOH F 5 . ? -2.405 -10.134 -18.110 1.00 41.35 ? 631 HOH A O 1 HETATM 3679 O O . HOH F 5 . ? 23.076 -37.896 -22.607 1.00 36.96 ? 632 HOH A O 1 HETATM 3680 O O . HOH F 5 . ? 26.162 -29.103 -30.468 1.00 33.78 ? 633 HOH A O 1 HETATM 3681 O O . HOH F 5 . ? 27.212 -34.149 -29.738 1.00 37.00 ? 634 HOH A O 1 HETATM 3682 O O . HOH F 5 . ? 1.536 -24.318 -34.118 1.00 27.82 ? 635 HOH A O 1 HETATM 3683 O O . HOH F 5 . ? 13.093 -29.599 -35.942 1.00 27.08 ? 636 HOH A O 1 HETATM 3684 O O . HOH F 5 . ? 20.185 -50.914 -5.250 1.00 27.42 ? 637 HOH A O 1 HETATM 3685 O O . HOH F 5 . ? 7.581 -15.237 -35.987 1.00 53.52 ? 638 HOH A O 1 HETATM 3686 O O . HOH F 5 . ? 11.255 -51.203 -7.173 1.00 36.85 ? 639 HOH A O 1 HETATM 3687 O O . HOH F 5 . ? 18.630 -38.396 4.754 1.00 32.30 ? 640 HOH A O 1 HETATM 3688 O O . HOH F 5 . ? 12.031 -25.021 -12.819 1.00 28.95 ? 641 HOH A O 1 HETATM 3689 O O . HOH F 5 . ? 14.353 -47.803 -2.871 1.00 34.99 ? 642 HOH A O 1 HETATM 3690 O O . HOH F 5 . ? 20.616 -37.544 -4.928 1.00 23.57 ? 643 HOH A O 1 HETATM 3691 O O . HOH F 5 . ? 33.583 -33.177 -20.025 1.00 47.04 ? 644 HOH A O 1 HETATM 3692 O O . HOH F 5 . ? 29.435 -23.794 -28.247 1.00 40.50 ? 645 HOH A O 1 HETATM 3693 O O . HOH F 5 . ? 2.754 -29.674 -17.393 1.00 25.24 ? 646 HOH A O 1 HETATM 3694 O O . HOH F 5 . ? 1.453 -29.619 1.921 1.00 33.79 ? 647 HOH A O 1 HETATM 3695 O O . HOH F 5 . ? 8.547 -31.602 -0.145 1.00 20.43 ? 648 HOH A O 1 HETATM 3696 O O . HOH F 5 . ? 30.817 -17.614 -14.360 1.00 40.65 ? 649 HOH A O 1 HETATM 3697 O O . HOH F 5 . ? 13.161 -42.245 0.807 1.00 30.52 ? 650 HOH A O 1 HETATM 3698 O O . HOH F 5 . ? 17.710 -12.305 -24.363 1.00 21.34 ? 651 HOH A O 1 HETATM 3699 O O . HOH F 5 . ? -1.985 -14.510 -22.044 1.00 26.87 ? 652 HOH A O 1 HETATM 3700 O O . HOH F 5 . ? 17.726 -33.498 -20.407 1.00 21.15 ? 653 HOH A O 1 HETATM 3701 O O . HOH F 5 . ? -6.057 -44.174 -17.697 1.00 33.54 ? 654 HOH A O 1 HETATM 3702 O O . HOH F 5 . ? 24.309 -13.894 -27.461 1.00 39.92 ? 655 HOH A O 1 HETATM 3703 O O . HOH F 5 . ? 27.328 -20.065 -24.524 1.00 32.23 ? 656 HOH A O 1 HETATM 3704 O O . HOH F 5 . ? -2.686 -21.370 -0.820 1.00 35.39 ? 657 HOH A O 1 HETATM 3705 O O . HOH F 5 . ? -9.043 -42.012 -19.006 1.00 45.17 ? 658 HOH A O 1 HETATM 3706 O O . HOH F 5 . ? 19.568 -10.262 -25.878 1.00 21.41 ? 659 HOH A O 1 HETATM 3707 O O . HOH F 5 . ? -5.033 -10.832 -14.578 1.00 33.57 ? 660 HOH A O 1 HETATM 3708 O O . HOH F 5 . ? 7.291 -30.409 -10.079 1.00 29.75 ? 661 HOH A O 1 HETATM 3709 O O . HOH F 5 . ? 16.344 -31.591 -21.885 1.00 18.24 ? 662 HOH A O 1 HETATM 3710 O O . HOH F 5 . ? 29.839 -34.735 1.284 1.00 31.59 ? 663 HOH A O 1 HETATM 3711 O O . HOH F 5 . ? 10.984 -24.896 -16.241 1.00 26.02 ? 664 HOH A O 1 HETATM 3712 O O . HOH F 5 . ? -3.732 -35.234 1.357 1.00 36.47 ? 665 HOH A O 1 HETATM 3713 O O . HOH F 5 . ? 0.018 -8.979 -17.833 1.00 36.19 ? 666 HOH A O 1 HETATM 3714 O O . HOH F 5 . ? 29.770 -16.343 -23.302 1.00 51.23 ? 667 HOH A O 1 HETATM 3715 O O . HOH F 5 . ? 20.915 -42.420 -0.258 1.00 22.39 ? 668 HOH A O 1 HETATM 3716 O O . HOH F 5 . ? -11.075 -18.605 -17.943 1.00 37.17 ? 669 HOH A O 1 HETATM 3717 O O . HOH F 5 . ? 22.080 -15.783 -5.259 1.00 37.83 ? 670 HOH A O 1 HETATM 3718 O O . HOH F 5 . ? 26.586 -17.202 -9.200 1.00 44.95 ? 671 HOH A O 1 HETATM 3719 O O . HOH F 5 . ? 11.350 -50.362 -9.868 1.00 33.22 ? 672 HOH A O 1 HETATM 3720 O O . HOH F 5 . ? 2.263 -26.774 -35.474 1.00 38.25 ? 673 HOH A O 1 HETATM 3721 O O . HOH F 5 . ? 23.919 -10.532 -20.510 1.00 24.84 ? 674 HOH A O 1 HETATM 3722 O O . HOH F 5 . ? 13.029 -29.065 -15.975 1.00 33.36 ? 675 HOH A O 1 HETATM 3723 O O . HOH F 5 . ? 6.964 -23.777 -31.962 1.00 21.91 ? 676 HOH A O 1 HETATM 3724 O O . HOH F 5 . ? 25.475 -16.539 -24.864 1.00 31.82 ? 677 HOH A O 1 HETATM 3725 O O . HOH F 5 . ? -4.401 -51.386 -13.276 1.00 45.15 ? 678 HOH A O 1 HETATM 3726 O O . HOH F 5 . ? 7.497 -39.083 -1.440 1.00 25.09 ? 679 HOH A O 1 HETATM 3727 O O . HOH F 5 . ? 0.865 -23.209 -28.018 1.00 24.83 ? 680 HOH A O 1 HETATM 3728 O O . HOH F 5 . ? 6.651 -24.491 -39.738 1.00 37.87 ? 681 HOH A O 1 HETATM 3729 O O . HOH F 5 . ? 10.854 -33.697 -30.147 1.00 18.59 ? 682 HOH A O 1 HETATM 3730 O O . HOH F 5 . ? 11.611 -16.972 -22.871 1.00 26.23 ? 683 HOH A O 1 HETATM 3731 O O . HOH F 5 . ? 7.924 -24.646 -19.024 1.00 22.92 ? 684 HOH A O 1 HETATM 3732 O O . HOH F 5 . ? 6.178 -24.437 -5.024 1.00 26.42 ? 685 HOH A O 1 HETATM 3733 O O . HOH F 5 . ? 2.087 -19.077 -2.243 1.00 29.72 ? 686 HOH A O 1 HETATM 3734 O O . HOH F 5 . ? 6.105 -31.158 -13.785 1.00 26.34 ? 687 HOH A O 1 HETATM 3735 O O . HOH F 5 . ? 22.105 -52.803 -5.828 1.00 31.86 ? 688 HOH A O 1 HETATM 3736 O O . HOH F 5 . ? 10.201 -47.385 -7.029 1.00 36.72 ? 689 HOH A O 1 HETATM 3737 O O . HOH F 5 . ? 28.647 -19.062 -17.601 1.00 33.03 ? 690 HOH A O 1 HETATM 3738 O O . HOH F 5 . ? -4.810 -42.831 -7.585 1.00 41.85 ? 691 HOH A O 1 HETATM 3739 O O . HOH F 5 . ? 0.973 -18.712 -20.311 1.00 23.15 ? 692 HOH A O 1 HETATM 3740 O O . HOH F 5 . ? -15.227 -26.089 -6.056 1.00 41.84 ? 693 HOH A O 1 HETATM 3741 O O . HOH F 5 . ? 14.394 -29.717 -13.549 1.00 32.72 ? 694 HOH A O 1 HETATM 3742 O O . HOH F 5 . ? 8.700 -18.685 -31.969 1.00 29.37 ? 695 HOH A O 1 HETATM 3743 O O . HOH F 5 . ? 15.168 -45.862 -29.752 1.00 46.37 ? 696 HOH A O 1 HETATM 3744 O O . HOH F 5 . ? 21.788 -35.654 -22.129 1.00 32.38 ? 697 HOH A O 1 HETATM 3745 O O . HOH F 5 . ? 22.066 -55.739 -6.880 1.00 40.70 ? 698 HOH A O 1 HETATM 3746 O O . HOH F 5 . ? 13.262 -24.846 -23.787 1.00 19.79 ? 699 HOH A O 1 HETATM 3747 O O . HOH F 5 . ? 10.032 -47.913 -9.551 1.00 28.40 ? 700 HOH A O 1 HETATM 3748 O O . HOH F 5 . ? 8.893 -32.069 -23.171 1.00 21.50 ? 701 HOH A O 1 HETATM 3749 O O . HOH F 5 . ? 34.280 -33.707 -6.254 1.00 35.64 ? 702 HOH A O 1 HETATM 3750 O O . HOH F 5 . ? 5.589 -26.703 -6.328 1.00 24.58 ? 703 HOH A O 1 HETATM 3751 O O . HOH F 5 . ? 15.582 -8.197 -5.060 1.00 38.92 ? 704 HOH A O 1 HETATM 3752 O O . HOH F 5 . ? 6.863 -6.495 -16.467 1.00 44.24 ? 705 HOH A O 1 HETATM 3753 O O . HOH F 5 . ? 15.608 -49.978 -21.959 1.00 35.90 ? 706 HOH A O 1 HETATM 3754 O O . HOH F 5 . ? 6.082 -8.097 -7.776 1.00 36.25 ? 707 HOH A O 1 HETATM 3755 O O . HOH F 5 . ? 10.197 -30.289 -1.800 1.00 23.79 ? 708 HOH A O 1 HETATM 3756 O O . HOH F 5 . ? 13.380 -35.863 10.290 1.00 33.51 ? 709 HOH A O 1 HETATM 3757 O O . HOH F 5 . ? 0.225 -42.567 0.373 1.00 43.16 ? 710 HOH A O 1 HETATM 3758 O O . HOH F 5 . ? 10.738 -31.787 -17.899 1.00 20.37 ? 711 HOH A O 1 HETATM 3759 O O . HOH F 5 . ? 22.004 -29.582 -24.892 1.00 20.05 ? 712 HOH A O 1 HETATM 3760 O O . HOH F 5 . ? 31.074 -27.183 -25.489 1.00 36.43 ? 713 HOH A O 1 HETATM 3761 O O . HOH F 5 . ? 3.865 -49.461 2.778 1.00 30.33 ? 714 HOH A O 1 HETATM 3762 O O . HOH F 5 . ? 11.455 -31.559 -22.134 1.00 20.10 ? 715 HOH A O 1 HETATM 3763 O O . HOH F 5 . ? 1.865 -17.091 -38.922 1.00 41.70 ? 716 HOH A O 1 HETATM 3764 O O . HOH F 5 . ? 6.328 -8.845 -24.497 1.00 32.33 ? 717 HOH A O 1 HETATM 3765 O O . HOH F 5 . ? 18.633 -43.425 -26.860 1.00 39.58 ? 718 HOH A O 1 HETATM 3766 O O . HOH F 5 . ? -8.883 -24.010 -20.833 1.00 37.31 ? 719 HOH A O 1 HETATM 3767 O O . HOH F 5 . ? 19.773 -44.428 -1.532 1.00 24.68 ? 720 HOH A O 1 HETATM 3768 O O . HOH F 5 . ? 4.581 -37.059 -18.228 1.00 24.41 ? 721 HOH A O 1 HETATM 3769 O O . HOH F 5 . ? -8.165 -39.452 -7.601 1.00 33.17 ? 722 HOH A O 1 HETATM 3770 O O . HOH F 5 . ? 12.940 -7.914 -22.960 1.00 27.00 ? 723 HOH A O 1 HETATM 3771 O O . HOH F 5 . ? 20.927 -48.856 -0.443 1.00 28.41 ? 724 HOH A O 1 HETATM 3772 O O . HOH F 5 . ? -14.489 -19.782 -17.271 1.00 45.55 ? 725 HOH A O 1 HETATM 3773 O O . HOH F 5 . ? 17.550 -31.973 -38.002 1.00 35.59 ? 726 HOH A O 1 HETATM 3774 O O . HOH F 5 . ? 8.524 -24.779 -14.392 1.00 24.61 ? 727 HOH A O 1 HETATM 3775 O O . HOH F 5 . ? 23.968 -18.050 -31.678 1.00 55.38 ? 728 HOH A O 1 HETATM 3776 O O . HOH F 5 . ? 21.923 -17.008 -30.275 1.00 41.31 ? 729 HOH A O 1 HETATM 3777 O O . HOH F 5 . ? 9.422 -34.510 -20.117 1.00 18.57 ? 730 HOH A O 1 HETATM 3778 O O . HOH F 5 . ? -13.168 -14.472 -12.395 1.00 51.61 ? 731 HOH A O 1 HETATM 3779 O O . HOH F 5 . ? 14.768 -36.520 -27.418 1.00 25.90 ? 732 HOH A O 1 HETATM 3780 O O . HOH F 5 . ? 0.004 -32.176 -8.751 1.00 27.02 ? 733 HOH A O 1 HETATM 3781 O O . HOH F 5 . ? -4.043 -11.481 -20.264 1.00 46.22 ? 734 HOH A O 1 HETATM 3782 O O . HOH F 5 . ? 27.600 -33.981 3.628 1.00 44.10 ? 735 HOH A O 1 HETATM 3783 O O . HOH F 5 . ? -8.884 -25.126 0.189 1.00 44.96 ? 736 HOH A O 1 HETATM 3784 O O . HOH F 5 . ? 20.659 -28.324 -34.371 1.00 48.41 ? 737 HOH A O 1 HETATM 3785 O O . HOH F 5 . ? 2.205 -43.536 -0.724 1.00 38.00 ? 738 HOH A O 1 HETATM 3786 O O . HOH F 5 . ? 32.512 -35.517 -20.303 1.00 40.22 ? 739 HOH A O 1 HETATM 3787 O O . HOH F 5 . ? 3.708 -30.715 -15.018 1.00 22.81 ? 740 HOH A O 1 HETATM 3788 O O . HOH F 5 . ? 3.672 -51.084 -25.615 1.00 55.24 ? 741 HOH A O 1 HETATM 3789 O O . HOH F 5 . ? 14.867 -8.340 -13.017 1.00 30.88 ? 742 HOH A O 1 HETATM 3790 O O . HOH F 5 . ? 6.865 -22.447 -6.854 1.00 24.86 ? 743 HOH A O 1 HETATM 3791 O O . HOH F 5 . ? 23.920 -38.672 -25.131 1.00 37.19 ? 744 HOH A O 1 HETATM 3792 O O . HOH F 5 . ? 13.504 -15.596 -21.737 1.00 24.84 ? 745 HOH A O 1 HETATM 3793 O O . HOH F 5 . ? 19.902 -12.892 -1.982 1.00 43.58 ? 746 HOH A O 1 HETATM 3794 O O . HOH F 5 . ? 27.587 -47.043 -18.172 1.00 42.26 ? 747 HOH A O 1 HETATM 3795 O O . HOH F 5 . ? 18.566 -31.902 -27.773 1.00 18.36 ? 748 HOH A O 1 HETATM 3796 O O . HOH F 5 . ? -5.645 -19.236 -27.980 1.00 42.54 ? 749 HOH A O 1 HETATM 3797 O O . HOH F 5 . ? 8.938 -24.012 -5.247 1.00 30.00 ? 750 HOH A O 1 HETATM 3798 O O . HOH F 5 . ? 16.572 -22.070 -35.382 1.00 31.85 ? 751 HOH A O 1 HETATM 3799 O O . HOH F 5 . ? 13.186 -37.619 -35.670 1.00 27.62 ? 752 HOH A O 1 HETATM 3800 O O . HOH F 5 . ? 9.589 -49.672 -1.422 1.00 34.09 ? 753 HOH A O 1 HETATM 3801 O O . HOH F 5 . ? 2.602 -32.530 -17.972 1.00 27.12 ? 754 HOH A O 1 HETATM 3802 O O . HOH F 5 . ? -0.866 -24.364 -17.272 1.00 28.02 ? 755 HOH A O 1 HETATM 3803 O O . HOH F 5 . ? 6.030 -21.696 -39.113 1.00 25.90 ? 756 HOH A O 1 HETATM 3804 O O . HOH F 5 . ? 25.574 -42.111 -6.708 1.00 46.60 ? 757 HOH A O 1 HETATM 3805 O O . HOH F 5 . ? 13.014 -10.443 -25.931 1.00 22.25 ? 758 HOH A O 1 HETATM 3806 O O . HOH F 5 . ? 12.025 -54.134 -9.992 1.00 44.28 ? 759 HOH A O 1 HETATM 3807 O O . HOH F 5 . ? 23.490 -27.018 -28.755 1.00 30.46 ? 760 HOH A O 1 HETATM 3808 O O . HOH F 5 . ? 4.665 -54.683 -11.648 1.00 40.13 ? 761 HOH A O 1 HETATM 3809 O O . HOH F 5 . ? 1.214 -26.015 -32.037 1.00 29.13 ? 762 HOH A O 1 HETATM 3810 O O . HOH F 5 . ? 5.707 -28.723 -11.341 1.00 27.86 ? 763 HOH A O 1 HETATM 3811 O O . HOH F 5 . ? 9.886 -21.101 -40.251 1.00 49.65 ? 764 HOH A O 1 HETATM 3812 O O . HOH F 5 . ? -1.014 -42.841 -21.569 1.00 28.63 ? 765 HOH A O 1 HETATM 3813 O O . HOH F 5 . ? 0.170 -21.403 -21.028 1.00 27.50 ? 766 HOH A O 1 HETATM 3814 O O . HOH F 5 . ? -12.643 -32.600 -3.184 1.00 46.20 ? 767 HOH A O 1 HETATM 3815 O O . HOH F 5 . ? 26.265 -46.885 -11.547 1.00 36.22 ? 768 HOH A O 1 HETATM 3816 O O . HOH F 5 . ? -13.822 -31.487 -16.091 1.00 41.88 ? 769 HOH A O 1 HETATM 3817 O O . HOH F 5 . ? 15.917 -33.752 13.770 1.00 45.38 ? 770 HOH A O 1 HETATM 3818 O O . HOH F 5 . ? 7.600 -22.928 -12.705 1.00 25.08 ? 771 HOH A O 1 HETATM 3819 O O . HOH F 5 . ? 16.313 -48.794 -4.463 1.00 33.72 ? 772 HOH A O 1 HETATM 3820 O O . HOH F 5 . ? 5.999 -23.732 -20.841 1.00 23.65 ? 773 HOH A O 1 HETATM 3821 O O . HOH F 5 . ? -12.669 -38.209 -5.482 1.00 45.44 ? 774 HOH A O 1 HETATM 3822 O O . HOH F 5 . ? 27.611 -24.697 -11.322 1.00 34.22 ? 775 HOH A O 1 HETATM 3823 O O . HOH F 5 . ? 23.778 -29.308 -31.495 1.00 29.11 ? 776 HOH A O 1 HETATM 3824 O O . HOH F 5 . ? -9.542 -10.990 -9.206 1.00 47.92 ? 777 HOH A O 1 HETATM 3825 O O . HOH F 5 . ? 5.207 -16.406 5.973 1.00 44.06 ? 778 HOH A O 1 HETATM 3826 O O . HOH F 5 . ? 16.479 -48.986 -7.307 1.00 36.72 ? 779 HOH A O 1 HETATM 3827 O O . HOH F 5 . ? -14.550 -36.870 -11.365 1.00 49.91 ? 780 HOH A O 1 HETATM 3828 O O . HOH F 5 . ? -3.633 -45.140 -7.148 1.00 38.40 ? 781 HOH A O 1 HETATM 3829 O O . HOH F 5 . ? 3.301 -29.380 -12.471 1.00 19.38 ? 782 HOH A O 1 HETATM 3830 O O . HOH F 5 . ? 18.423 -50.545 -7.357 1.00 41.24 ? 783 HOH A O 1 HETATM 3831 O O . HOH F 5 . ? 15.238 -24.994 15.204 1.00 41.11 ? 784 HOH A O 1 HETATM 3832 O O . HOH F 5 . ? -9.314 -36.668 -21.831 1.00 44.82 ? 785 HOH A O 1 HETATM 3833 O O . HOH F 5 . ? 16.204 -29.917 -10.579 1.00 21.65 ? 786 HOH A O 1 HETATM 3834 O O . HOH F 5 . ? 17.216 -45.610 -25.733 1.00 33.38 ? 787 HOH A O 1 HETATM 3835 O O . HOH F 5 . ? 21.841 -38.574 -1.597 1.00 40.04 ? 788 HOH A O 1 HETATM 3836 O O . HOH F 5 . ? 1.160 -13.183 -28.614 1.00 42.54 ? 789 HOH A O 1 HETATM 3837 O O . HOH F 5 . ? -10.475 -37.963 2.953 1.00 51.53 ? 790 HOH A O 1 HETATM 3838 O O . HOH F 5 . ? 11.568 -48.229 -29.061 1.00 44.38 ? 791 HOH A O 1 HETATM 3839 O O . HOH F 5 . ? 9.540 -19.546 -36.690 1.00 30.75 ? 792 HOH A O 1 HETATM 3840 O O . HOH F 5 . ? 13.250 -26.448 -16.093 1.00 39.91 ? 793 HOH A O 1 HETATM 3841 O O . HOH F 5 . ? 18.356 -33.414 14.350 1.00 41.05 ? 794 HOH A O 1 HETATM 3842 O O . HOH F 5 . ? 4.195 -4.424 -19.247 1.00 43.60 ? 795 HOH A O 1 HETATM 3843 O O . HOH F 5 . ? 10.529 -36.668 -28.718 1.00 23.33 ? 796 HOH A O 1 HETATM 3844 O O . HOH F 5 . ? 30.087 -25.430 -11.426 1.00 34.88 ? 797 HOH A O 1 HETATM 3845 O O . HOH F 5 . ? 6.217 -4.486 -5.368 1.00 40.75 ? 798 HOH A O 1 HETATM 3846 O O . HOH F 5 . ? 18.649 -52.809 -8.827 1.00 35.18 ? 799 HOH A O 1 HETATM 3847 O O . HOH F 5 . ? 19.964 -36.111 5.313 1.00 35.14 ? 800 HOH A O 1 HETATM 3848 O O . HOH F 5 . ? 14.040 -31.090 14.337 1.00 49.26 ? 801 HOH A O 1 HETATM 3849 O O . HOH F 5 . ? 0.148 -40.521 2.120 1.00 39.66 ? 802 HOH A O 1 HETATM 3850 O O . HOH F 5 . ? -4.085 -21.108 -29.787 1.00 50.94 ? 803 HOH A O 1 HETATM 3851 O O . HOH F 5 . ? 3.032 -43.311 -27.915 1.00 38.49 ? 804 HOH A O 1 HETATM 3852 O O . HOH F 5 . ? 15.735 -31.988 -6.889 1.00 25.53 ? 805 HOH A O 1 HETATM 3853 O O . HOH F 5 . ? 6.718 -30.118 -23.181 1.00 30.16 ? 806 HOH A O 1 HETATM 3854 O O . HOH F 5 . ? -9.892 -39.898 -14.928 1.00 43.58 ? 807 HOH A O 1 HETATM 3855 O O . HOH F 5 . ? 23.002 -38.186 -5.423 1.00 30.28 ? 808 HOH A O 1 HETATM 3856 O O . HOH F 5 . ? 8.474 -5.183 -18.965 1.00 48.14 ? 809 HOH A O 1 HETATM 3857 O O . HOH F 5 . ? 31.701 -37.751 -14.274 1.00 45.94 ? 810 HOH A O 1 HETATM 3858 O O . HOH F 5 . ? 5.336 -7.538 -26.516 1.00 51.27 ? 811 HOH A O 1 HETATM 3859 O O . HOH F 5 . ? 11.121 -36.782 -37.041 1.00 45.38 ? 812 HOH A O 1 HETATM 3860 O O . HOH F 5 . ? 12.741 -29.274 -38.539 1.00 38.64 ? 813 HOH A O 1 HETATM 3861 O O . HOH F 5 . ? 23.843 -16.475 -8.279 1.00 52.42 ? 814 HOH A O 1 HETATM 3862 O O . HOH F 5 . ? -7.330 -42.357 -8.094 1.00 45.79 ? 815 HOH A O 1 HETATM 3863 O O . HOH F 5 . ? 27.020 -41.919 -13.129 1.00 41.41 ? 816 HOH A O 1 HETATM 3864 O O . HOH F 5 . ? 27.267 -44.906 -6.920 1.00 53.46 ? 817 HOH A O 1 HETATM 3865 O O . HOH F 5 . ? 9.168 -16.552 -30.895 1.00 36.26 ? 818 HOH A O 1 HETATM 3866 O O . HOH F 5 . ? 30.012 -20.182 -15.399 1.00 39.20 ? 819 HOH A O 1 HETATM 3867 O O . HOH F 5 . ? 18.648 -10.244 -1.455 1.00 46.15 ? 820 HOH A O 1 HETATM 3868 O O . HOH F 5 . ? -6.423 -9.465 -16.447 1.00 41.22 ? 821 HOH A O 1 HETATM 3869 O O . HOH F 5 . ? 13.003 -5.026 -28.926 1.00 39.20 ? 822 HOH A O 1 HETATM 3870 O O . HOH F 5 . ? 27.639 -31.741 -30.880 1.00 35.06 ? 823 HOH A O 1 HETATM 3871 O O . HOH F 5 . ? 23.939 -39.254 -3.034 1.00 35.59 ? 824 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 GLN 1 1 ? ? ? A . n A 1 2 ASN 2 2 2 ASN ASN A . n A 1 3 VAL 3 3 3 VAL VAL A . n A 1 4 GLY 4 4 4 GLY GLY A . n A 1 5 LYS 5 5 5 LYS LYS A . n A 1 6 TRP 6 6 6 TRP TRP A . n A 1 7 GLY 7 7 7 GLY GLY A . n A 1 8 PRO 8 8 8 PRO PRO A . n A 1 9 MET 9 9 9 MET MET A . n A 1 10 VAL 10 10 10 VAL VAL A . n A 1 11 LYS 11 11 11 LYS LYS A . n A 1 12 PHE 12 12 12 PHE PHE A . n A 1 13 PRO 13 13 13 PRO PRO A . n A 1 14 VAL 14 14 14 VAL VAL A . n A 1 15 VAL 15 15 15 VAL VAL A . n A 1 16 PRO 16 16 16 PRO PRO A . n A 1 17 VAL 17 17 17 VAL VAL A . n A 1 18 ALA 18 18 18 ALA ALA A . n A 1 19 VAL 19 19 19 VAL VAL A . n A 1 20 ALA 20 20 20 ALA ALA A . n A 1 21 LEU 21 21 21 LEU LEU A . n A 1 22 VAL 22 22 22 VAL VAL A . n A 1 23 PRO 23 23 23 PRO PRO A . n A 1 24 GLU 24 24 24 GLU GLU A . n A 1 25 THR 25 25 25 THR THR A . n A 1 26 GLY 26 26 26 GLY GLY A . n A 1 27 ASN 27 27 27 ASN ASN A . n A 1 28 LEU 28 28 28 LEU LEU A . n A 1 29 LEU 29 29 29 LEU LEU A . n A 1 30 VAL 30 30 30 VAL VAL A . n A 1 31 TRP 31 31 31 TRP TRP A . n A 1 32 SER 32 32 32 SER SER A . n A 1 33 SER 33 33 33 SER SER A . n A 1 34 GLY 34 34 34 GLY GLY A . n A 1 35 TRP 35 35 35 TRP TRP A . n A 1 36 PRO 36 36 36 PRO PRO A . n A 1 37 ASN 37 37 37 ASN ASN A . n A 1 38 ARG 38 38 38 ARG ARG A . n A 1 39 TRP 39 39 39 TRP TRP A . n A 1 40 THR 40 40 40 THR THR A . n A 1 41 THR 41 41 41 THR THR A . n A 1 42 ALA 42 42 42 ALA ALA A . n A 1 43 GLY 43 43 43 GLY GLY A . n A 1 44 ASN 44 44 44 ASN ASN A . n A 1 45 GLY 45 45 45 GLY GLY A . n A 1 46 LYS 46 46 46 LYS LYS A . n A 1 47 THR 47 47 47 THR THR A . n A 1 48 TYR 48 48 48 TYR TYR A . n A 1 49 THR 49 49 49 THR THR A . n A 1 50 SER 50 50 50 SER SER A . n A 1 51 LEU 51 51 51 LEU LEU A . n A 1 52 TYR 52 52 52 TYR TYR A . n A 1 53 ASN 53 53 53 ASN ASN A . n A 1 54 VAL 54 54 54 VAL VAL A . n A 1 55 ASN 55 55 55 ASN ASN A . n A 1 56 THR 56 56 56 THR THR A . n A 1 57 GLY 57 57 57 GLY GLY A . n A 1 58 ASN 58 58 58 ASN ASN A . n A 1 59 ILE 59 59 59 ILE ILE A . n A 1 60 SER 60 60 60 SER SER A . n A 1 61 ASP 61 61 61 ASP ASP A . n A 1 62 ALA 62 62 62 ALA ALA A . n A 1 63 ILE 63 63 63 ILE ILE A . n A 1 64 VAL 64 64 64 VAL VAL A . n A 1 65 GLN 65 65 65 GLN GLN A . n A 1 66 ASN 66 66 66 ASN ASN A . n A 1 67 THR 67 67 67 THR THR A . n A 1 68 GLN 68 68 68 GLN GLN A . n A 1 69 HIS 69 69 69 HIS HIS A . n A 1 70 ASP 70 70 70 ASP ASP A . n A 1 71 MET 71 71 71 MET MET A . n A 1 72 PHE 72 72 72 PHE PHE A . n A 1 73 CYS 73 73 73 CYS CYS A . n A 1 74 PRO 74 74 74 PRO PRO A . n A 1 75 GLY 75 75 75 GLY GLY A . n A 1 76 THR 76 76 76 THR THR A . n A 1 77 SER 77 77 77 SER SER A . n A 1 78 LEU 78 78 78 LEU LEU A . n A 1 79 ASP 79 79 79 ASP ASP A . n A 1 80 ALA 80 80 80 ALA ALA A . n A 1 81 ASP 81 81 81 ASP ASP A . n A 1 82 GLY 82 82 82 GLY GLY A . n A 1 83 ARG 83 83 83 ARG ARG A . n A 1 84 ILE 84 84 84 ILE ILE A . n A 1 85 ILE 85 85 85 ILE ILE A . n A 1 86 VAL 86 86 86 VAL VAL A . n A 1 87 THR 87 87 87 THR THR A . n A 1 88 GLY 88 88 88 GLY GLY A . n A 1 89 GLY 89 89 89 GLY GLY A . n A 1 90 SER 90 90 90 SER SER A . n A 1 91 SER 91 91 91 SER SER A . n A 1 92 ALA 92 92 92 ALA ALA A . n A 1 93 ALA 93 93 93 ALA ALA A . n A 1 94 LYS 94 94 94 LYS LYS A . n A 1 95 THR 95 95 95 THR THR A . n A 1 96 SER 96 96 96 SER SER A . n A 1 97 VAL 97 97 97 VAL VAL A . n A 1 98 LEU 98 98 98 LEU LEU A . n A 1 99 ASP 99 99 99 ASP ASP A . n A 1 100 PHE 100 100 100 PHE PHE A . n A 1 101 LYS 101 101 101 LYS LYS A . n A 1 102 LYS 102 102 102 LYS LYS A . n A 1 103 GLY 103 103 103 GLY GLY A . n A 1 104 GLU 104 104 104 GLU GLU A . n A 1 105 SER 105 105 105 SER SER A . n A 1 106 SER 106 106 106 SER SER A . n A 1 107 PRO 107 107 107 PRO PRO A . n A 1 108 TRP 108 108 108 TRP TRP A . n A 1 109 THR 109 109 109 THR THR A . n A 1 110 PRO 110 110 110 PRO PRO A . n A 1 111 LEU 111 111 111 LEU LEU A . n A 1 112 SER 112 112 112 SER SER A . n A 1 113 ASN 113 113 113 ASN ASN A . n A 1 114 MET 114 114 114 MET MET A . n A 1 115 GLN 115 115 115 GLN GLN A . n A 1 116 ILE 116 116 116 ILE ILE A . n A 1 117 SER 117 117 117 SER SER A . n A 1 118 ARG 118 118 118 ARG ARG A . n A 1 119 GLY 119 119 119 GLY GLY A . n A 1 120 TYR 120 120 120 TYR TYR A . n A 1 121 GLN 121 121 121 GLN GLN A . n A 1 122 SER 122 122 122 SER SER A . n A 1 123 SER 123 123 123 SER SER A . n A 1 124 CYS 124 124 124 CYS CYS A . n A 1 125 THR 125 125 125 THR THR A . n A 1 126 THR 126 126 126 THR THR A . n A 1 127 SER 127 127 127 SER SER A . n A 1 128 GLU 128 128 128 GLU GLU A . n A 1 129 GLY 129 129 129 GLY GLY A . n A 1 130 LYS 130 130 130 LYS LYS A . n A 1 131 ILE 131 131 131 ILE ILE A . n A 1 132 PHE 132 132 132 PHE PHE A . n A 1 133 VAL 133 133 133 VAL VAL A . n A 1 134 ILE 134 134 134 ILE ILE A . n A 1 135 GLY 135 135 135 GLY GLY A . n A 1 136 GLY 136 136 136 GLY GLY A . n A 1 137 SER 137 137 137 SER SER A . n A 1 138 PHE 138 138 138 PHE PHE A . n A 1 139 SER 139 139 139 SER SER A . n A 1 140 GLY 140 140 140 GLY GLY A . n A 1 141 ALA 141 141 141 ALA ALA A . n A 1 142 GLY 142 142 142 GLY GLY A . n A 1 143 THR 143 143 143 THR THR A . n A 1 144 ARG 144 144 144 ARG ARG A . n A 1 145 ASN 145 145 145 ASN ASN A . n A 1 146 GLY 146 146 146 GLY GLY A . n A 1 147 GLU 147 147 147 GLU GLU A . n A 1 148 VAL 148 148 148 VAL VAL A . n A 1 149 TYR 149 149 149 TYR TYR A . n A 1 150 ASP 150 150 150 ASP ASP A . n A 1 151 PRO 151 151 151 PRO PRO A . n A 1 152 LYS 152 152 152 LYS LYS A . n A 1 153 ALA 153 153 153 ALA ALA A . n A 1 154 ASN 154 154 154 ASN ASN A . n A 1 155 THR 155 155 155 THR THR A . n A 1 156 TRP 156 156 156 TRP TRP A . n A 1 157 THR 157 157 157 THR THR A . n A 1 158 LYS 158 158 158 LYS LYS A . n A 1 159 LEU 159 159 159 LEU LEU A . n A 1 160 ALA 160 160 160 ALA ALA A . n A 1 161 GLY 161 161 161 GLY GLY A . n A 1 162 CYS 162 162 162 CYS CYS A . n A 1 163 PRO 163 163 163 PRO PRO A . n A 1 164 VAL 164 164 164 VAL VAL A . n A 1 165 LYS 165 165 165 LYS LYS A . n A 1 166 PRO 166 166 166 PRO PRO A . n A 1 167 LEU 167 167 167 LEU LEU A . n A 1 168 VAL 168 168 168 VAL VAL A . n A 1 169 MET 169 169 169 MET MET A . n A 1 170 GLN 170 170 170 GLN GLN A . n A 1 171 ARG 171 171 171 ARG ARG A . n A 1 172 GLY 172 172 172 GLY GLY A . n A 1 173 MET 173 173 173 MET MET A . n A 1 174 PHE 174 174 174 PHE PHE A . n A 1 175 PRO 175 175 175 PRO PRO A . n A 1 176 ASP 176 176 176 ASP ASP A . n A 1 177 SER 177 177 177 SER SER A . n A 1 178 HIS 178 178 178 HIS HIS A . n A 1 179 ALA 179 179 179 ALA ALA A . n A 1 180 TRP 180 180 180 TRP TRP A . n A 1 181 LEU 181 181 181 LEU LEU A . n A 1 182 TRP 182 182 182 TRP TRP A . n A 1 183 SER 183 183 183 SER SER A . n A 1 184 TRP 184 184 184 TRP TRP A . n A 1 185 LYS 185 185 185 LYS LYS A . n A 1 186 ASN 186 186 186 ASN ASN A . n A 1 187 GLY 187 187 187 GLY GLY A . n A 1 188 SER 188 188 188 SER SER A . n A 1 189 VAL 189 189 189 VAL VAL A . n A 1 190 LEU 190 190 190 LEU LEU A . n A 1 191 GLN 191 191 191 GLN GLN A . n A 1 192 ALA 192 192 192 ALA ALA A . n A 1 193 GLY 193 193 193 GLY GLY A . n A 1 194 PRO 194 194 194 PRO PRO A . n A 1 195 SER 195 195 195 SER SER A . n A 1 196 LYS 196 196 196 LYS LYS A . n A 1 197 LYS 197 197 197 LYS LYS A . n A 1 198 MET 198 198 198 MET MET A . n A 1 199 ASN 199 199 199 ASN ASN A . n A 1 200 TRP 200 200 200 TRP TRP A . n A 1 201 TYR 201 201 201 TYR TYR A . n A 1 202 ASP 202 202 202 ASP ASP A . n A 1 203 THR 203 203 203 THR THR A . n A 1 204 LYS 204 204 204 LYS LYS A . n A 1 205 GLY 205 205 205 GLY GLY A . n A 1 206 THR 206 206 206 THR THR A . n A 1 207 GLY 207 207 207 GLY GLY A . n A 1 208 SER 208 208 208 SER SER A . n A 1 209 ASN 209 209 209 ASN ASN A . n A 1 210 THR 210 210 210 THR THR A . n A 1 211 PRO 211 211 211 PRO PRO A . n A 1 212 ALA 212 212 212 ALA ALA A . n A 1 213 GLY 213 213 213 GLY GLY A . n A 1 214 LEU 214 214 214 LEU LEU A . n A 1 215 ARG 215 215 215 ARG ARG A . n A 1 216 GLY 216 216 216 GLY GLY A . n A 1 217 THR 217 217 217 THR THR A . n A 1 218 ASP 218 218 218 ASP ASP A . n A 1 219 GLU 219 219 219 GLU GLU A . n A 1 220 ASP 220 220 220 ASP ASP A . n A 1 221 SER 221 221 221 SER SER A . n A 1 222 MET 222 222 222 MET MET A . n A 1 223 CYS 223 223 223 CYS CYS A . n A 1 224 GLY 224 224 224 GLY GLY A . n A 1 225 VAL 225 225 225 VAL VAL A . n A 1 226 SER 226 226 226 SER SER A . n A 1 227 VAL 227 227 227 VAL VAL A . n A 1 228 MET 228 228 228 MET MET A . n A 1 229 TYR 229 229 229 TYR TYR A . n A 1 230 ASP 230 230 230 ASP ASP A . n A 1 231 ALA 231 231 231 ALA ALA A . n A 1 232 VAL 232 232 232 VAL VAL A . n A 1 233 ALA 233 233 233 ALA ALA A . n A 1 234 GLY 234 234 234 GLY GLY A . n A 1 235 LYS 235 235 235 LYS LYS A . n A 1 236 ILE 236 236 236 ILE ILE A . n A 1 237 PHE 237 237 237 PHE PHE A . n A 1 238 THR 238 238 238 THR THR A . n A 1 239 TYR 239 239 239 TYR TYR A . n A 1 240 GLY 240 240 240 GLY GLY A . n A 1 241 GLY 241 241 241 GLY GLY A . n A 1 242 GLY 242 242 242 GLY GLY A . n A 1 243 LYS 243 243 243 LYS LYS A . n A 1 244 GLY 244 244 244 GLY GLY A . n A 1 245 TYR 245 245 245 TYR TYR A . n A 1 246 THR 246 246 246 THR THR A . n A 1 247 GLY 247 247 247 GLY GLY A . n A 1 248 TYR 248 248 248 TYR TYR A . n A 1 249 ASP 249 249 249 ASP ASP A . n A 1 250 SER 250 250 250 SER SER A . n A 1 251 THR 251 251 251 THR THR A . n A 1 252 SER 252 252 252 SER SER A . n A 1 253 ASN 253 253 253 ASN ASN A . n A 1 254 ALA 254 254 254 ALA ALA A . n A 1 255 HIS 255 255 255 HIS HIS A . n A 1 256 ILE 256 256 256 ILE ILE A . n A 1 257 LEU 257 257 257 LEU LEU A . n A 1 258 THR 258 258 258 THR THR A . n A 1 259 LEU 259 259 259 LEU LEU A . n A 1 260 GLY 260 260 260 GLY GLY A . n A 1 261 GLU 261 261 261 GLU GLU A . n A 1 262 PRO 262 262 262 PRO PRO A . n A 1 263 GLY 263 263 263 GLY GLY A . n A 1 264 GLN 264 264 264 GLN GLN A . n A 1 265 ALA 265 265 265 ALA ALA A . n A 1 266 VAL 266 266 266 VAL VAL A . n A 1 267 GLN 267 267 267 GLN GLN A . n A 1 268 VAL 268 268 268 VAL VAL A . n A 1 269 GLN 269 269 269 GLN GLN A . n A 1 270 LYS 270 270 270 LYS LYS A . n A 1 271 LEU 271 271 271 LEU LEU A . n A 1 272 ALA 272 272 272 ALA ALA A . n A 1 273 ASN 273 273 273 ASN ASN A . n A 1 274 GLY 274 274 274 GLY GLY A . n A 1 275 LYS 275 275 275 LYS LYS A . n A 1 276 TYR 276 276 276 TYR TYR A . n A 1 277 ASN 277 277 277 ASN ASN A . n A 1 278 ARG 278 278 278 ARG ARG A . n A 1 279 GLY 279 279 279 GLY GLY A . n A 1 280 PHE 280 280 280 PHE PHE A . n A 1 281 ALA 281 281 281 ALA ALA A . n A 1 282 ASN 282 282 282 ASN ASN A . n A 1 283 ALA 283 283 283 ALA ALA A . n A 1 284 VAL 284 284 284 VAL VAL A . n A 1 285 VAL 285 285 285 VAL VAL A . n A 1 286 MET 286 286 286 MET MET A . n A 1 287 PRO 287 287 287 PRO PRO A . n A 1 288 ASP 288 288 288 ASP ASP A . n A 1 289 GLY 289 289 289 GLY GLY A . n A 1 290 LYS 290 290 290 LYS LYS A . n A 1 291 ILE 291 291 291 ILE ILE A . n A 1 292 TRP 292 292 292 TRP TRP A . n A 1 293 VAL 293 293 293 VAL VAL A . n A 1 294 VAL 294 294 294 VAL VAL A . n A 1 295 GLY 295 295 295 GLY GLY A . n A 1 296 GLY 296 296 296 GLY GLY A . n A 1 297 MET 297 297 297 MET MET A . n A 1 298 GLN 298 298 298 GLN GLN A . n A 1 299 LYS 299 299 299 LYS LYS A . n A 1 300 MET 300 300 300 MET MET A . n A 1 301 TRP 301 301 301 TRP TRP A . n A 1 302 LEU 302 302 302 LEU LEU A . n A 1 303 PHE 303 303 303 PHE PHE A . n A 1 304 SER 304 304 304 SER SER A . n A 1 305 ASP 305 305 305 ASP ASP A . n A 1 306 THR 306 306 306 THR THR A . n A 1 307 THR 307 307 307 THR THR A . n A 1 308 PRO 308 308 308 PRO PRO A . n A 1 309 GLN 309 309 309 GLN GLN A . n A 1 310 LEU 310 310 310 LEU LEU A . n A 1 311 THR 311 311 311 THR THR A . n A 1 312 PRO 312 312 312 PRO PRO A . n A 1 313 GLU 313 313 313 GLU GLU A . n A 1 314 LEU 314 314 314 LEU LEU A . n A 1 315 PHE 315 315 315 PHE PHE A . n A 1 316 ASP 316 316 316 ASP ASP A . n A 1 317 PRO 317 317 317 PRO PRO A . n A 1 318 ALA 318 318 318 ALA ALA A . n A 1 319 THR 319 319 319 THR THR A . n A 1 320 GLY 320 320 320 GLY GLY A . n A 1 321 SER 321 321 321 SER SER A . n A 1 322 PHE 322 322 322 PHE PHE A . n A 1 323 THR 323 323 323 THR THR A . n A 1 324 PRO 324 324 324 PRO PRO A . n A 1 325 THR 325 325 325 THR THR A . n A 1 326 THR 326 326 326 THR THR A . n A 1 327 PRO 327 327 327 PRO PRO A . n A 1 328 HIS 328 328 328 HIS HIS A . n A 1 329 THR 329 329 329 THR THR A . n A 1 330 VAL 330 330 330 VAL VAL A . n A 1 331 PRO 331 331 331 PRO PRO A . n A 1 332 ARG 332 332 332 ARG ARG A . n A 1 333 ASN 333 333 333 ASN ASN A . n A 1 334 TYR 334 334 334 TYR TYR A . n A 1 335 HIS 335 335 335 HIS HIS A . n A 1 336 SER 336 336 336 SER SER A . n A 1 337 THR 337 337 337 THR THR A . n A 1 338 ALA 338 338 338 ALA ALA A . n A 1 339 LEU 339 339 339 LEU LEU A . n A 1 340 LEU 340 340 340 LEU LEU A . n A 1 341 MET 341 341 341 MET MET A . n A 1 342 ALA 342 342 342 ALA ALA A . n A 1 343 ASP 343 343 343 ASP ASP A . n A 1 344 ALA 344 344 344 ALA ALA A . n A 1 345 THR 345 345 345 THR THR A . n A 1 346 ILE 346 346 346 ILE ILE A . n A 1 347 TRP 347 347 347 TRP TRP A . n A 1 348 SER 348 348 348 SER SER A . n A 1 349 GLY 349 349 349 GLY GLY A . n A 1 350 GLY 350 350 350 GLY GLY A . n A 1 351 GLY 351 351 351 GLY GLY A . n A 1 352 GLY 352 352 352 GLY GLY A . n A 1 353 LEU 353 353 353 LEU LEU A . n A 1 354 CYS 354 354 354 CYS CYS A . n A 1 355 GLY 355 355 355 GLY GLY A . n A 1 356 ALA 356 356 356 ALA ALA A . n A 1 357 ASN 357 357 357 ASN ASN A . n A 1 358 CYS 358 358 358 CYS CYS A . n A 1 359 LYS 359 359 359 LYS LYS A . n A 1 360 GLU 360 360 360 GLU GLU A . n A 1 361 ASN 361 361 361 ASN ASN A . n A 1 362 HIS 362 362 362 HIS HIS A . n A 1 363 PHE 363 363 363 PHE PHE A . n A 1 364 ASP 364 364 364 ASP ASP A . n A 1 365 GLY 365 365 365 GLY GLY A . n A 1 366 GLN 366 366 366 GLN GLN A . n A 1 367 PHE 367 367 367 PHE PHE A . n A 1 368 TRP 368 368 368 TRP TRP A . n A 1 369 SER 369 369 369 SER SER A . n A 1 370 PRO 370 370 370 PRO PRO A . n A 1 371 PRO 371 371 371 PRO PRO A . n A 1 372 TYR 372 372 372 TYR TYR A . n A 1 373 LEU 373 373 373 LEU LEU A . n A 1 374 PHE 374 374 374 PHE PHE A . n A 1 375 GLU 375 375 375 GLU GLU A . n A 1 376 ALA 376 376 376 ALA ALA A . n A 1 377 ASP 377 377 377 ASP ASP A . n A 1 378 GLY 378 378 378 GLY GLY A . n A 1 379 VAL 379 379 379 VAL VAL A . n A 1 380 THR 380 380 380 THR THR A . n A 1 381 PRO 381 381 381 PRO PRO A . n A 1 382 ALA 382 382 382 ALA ALA A . n A 1 383 LYS 383 383 383 LYS LYS A . n A 1 384 ARG 384 384 384 ARG ARG A . n A 1 385 PRO 385 385 385 PRO PRO A . n A 1 386 VAL 386 386 386 VAL VAL A . n A 1 387 ILE 387 387 387 ILE ILE A . n A 1 388 GLN 388 388 388 GLN GLN A . n A 1 389 SER 389 389 389 SER SER A . n A 1 390 LEU 390 390 390 LEU LEU A . n A 1 391 SER 391 391 391 SER SER A . n A 1 392 ASP 392 392 392 ASP ASP A . n A 1 393 THR 393 393 393 THR THR A . n A 1 394 ALA 394 394 394 ALA ALA A . n A 1 395 VAL 395 395 395 VAL VAL A . n A 1 396 ARG 396 396 396 ARG ARG A . n A 1 397 ALA 397 397 397 ALA ALA A . n A 1 398 GLY 398 398 398 GLY GLY A . n A 1 399 ALA 399 399 399 ALA ALA A . n A 1 400 PRO 400 400 400 PRO PRO A . n A 1 401 ILE 401 401 401 ILE ILE A . n A 1 402 THR 402 402 402 THR THR A . n A 1 403 ILE 403 403 403 ILE ILE A . n A 1 404 THR 404 404 404 THR THR A . n A 1 405 MET 405 405 405 MET MET A . n A 1 406 GLN 406 406 406 GLN GLN A . n A 1 407 ASP 407 407 407 ASP ASP A . n A 1 408 ALA 408 408 408 ALA ALA A . n A 1 409 GLY 409 409 409 GLY GLY A . n A 1 410 ALA 410 410 410 ALA ALA A . n A 1 411 TYR 411 411 411 TYR TYR A . n A 1 412 THR 412 412 412 THR THR A . n A 1 413 PHE 413 413 413 PHE PHE A . n A 1 414 SER 414 414 414 SER SER A . n A 1 415 MET 415 415 415 MET MET A . n A 1 416 ILE 416 416 416 ILE ILE A . n A 1 417 ARG 417 417 417 ARG ARG A . n A 1 418 VAL 418 418 418 VAL VAL A . n A 1 419 SER 419 419 419 SER SER A . n A 1 420 ALA 420 420 420 ALA ALA A . n A 1 421 THR 421 421 421 THR THR A . n A 1 422 THR 422 422 422 THR THR A . n A 1 423 HIS 423 423 423 HIS HIS A . n A 1 424 THR 424 424 424 THR THR A . n A 1 425 VAL 425 425 425 VAL VAL A . n A 1 426 ASN 426 426 426 ASN ASN A . n A 1 427 THR 427 427 427 THR THR A . n A 1 428 ASP 428 428 428 ASP ASP A . n A 1 429 GLN 429 429 429 GLN GLN A . n A 1 430 ARG 430 430 430 ARG ARG A . n A 1 431 ARG 431 431 431 ARG ARG A . n A 1 432 ILE 432 432 432 ILE ILE A . n A 1 433 PRO 433 433 433 PRO PRO A . n A 1 434 LEU 434 434 434 LEU LEU A . n A 1 435 ASP 435 435 435 ASP ASP A . n A 1 436 GLY 436 436 436 GLY GLY A . n A 1 437 GLN 437 437 437 GLN GLN A . n A 1 438 ASP 438 438 438 ASP ASP A . n A 1 439 GLY 439 439 439 GLY GLY A . n A 1 440 GLY 440 440 440 GLY GLY A . n A 1 441 ASP 441 441 441 ASP ASP A . n A 1 442 GLY 442 442 442 GLY GLY A . n A 1 443 LYS 443 443 443 LYS LYS A . n A 1 444 SER 444 444 444 SER SER A . n A 1 445 PHE 445 445 445 PHE PHE A . n A 1 446 THR 446 446 446 THR THR A . n A 1 447 VAL 447 447 447 VAL VAL A . n A 1 448 ASN 448 448 448 ASN ASN A . n A 1 449 VAL 449 449 449 VAL VAL A . n A 1 450 PRO 450 450 450 PRO PRO A . n A 1 451 ASN 451 451 451 ASN ASN A . n A 1 452 ASP 452 452 452 ASP ASP A . n A 1 453 TYR 453 453 453 TYR TYR A . n A 1 454 GLY 454 454 454 GLY GLY A . n A 1 455 VAL 455 455 455 VAL VAL A . n A 1 456 ALA 456 456 456 ALA ALA A . n A 1 457 ILE 457 457 457 ILE ILE A . n A 1 458 PRO 458 458 458 PRO PRO A . n A 1 459 GLY 459 459 459 GLY GLY A . n A 1 460 TYR 460 460 460 TYR TYR A . n A 1 461 TYR 461 461 461 TYR TYR A . n A 1 462 MET 462 462 462 MET MET A . n A 1 463 LEU 463 463 463 LEU LEU A . n A 1 464 PHE 464 464 464 PHE PHE A . n A 1 465 ALA 465 465 465 ALA ALA A . n A 1 466 MET 466 466 466 MET MET A . n A 1 467 ASN 467 467 467 ASN ASN A . n A 1 468 GLU 468 468 468 GLU GLU A . n A 1 469 ALA 469 469 469 ALA ALA A . n A 1 470 GLY 470 470 470 GLY GLY A . n A 1 471 VAL 471 471 471 VAL VAL A . n A 1 472 PRO 472 472 472 PRO PRO A . n A 1 473 CYS 473 473 473 CYS CYS A . n A 1 474 VAL 474 474 474 VAL VAL A . n A 1 475 ALA 475 475 475 ALA ALA A . n A 1 476 GLN 476 476 476 GLN GLN A . n A 1 477 PHE 477 477 477 PHE PHE A . n A 1 478 PHE 478 478 478 PHE PHE A . n A 1 479 LYS 479 479 479 LYS LYS A . n A 1 480 VAL 480 480 480 VAL VAL A . n A 1 481 THR 481 481 481 THR THR A . n A 1 482 LEU 482 482 482 LEU LEU A . n A 1 483 HIS 483 483 ? ? ? A . n A 1 484 HIS 484 484 ? ? ? A . n A 1 485 HIS 485 485 ? ? ? A . n A 1 486 HIS 486 486 ? ? ? A . n A 1 487 HIS 487 487 ? ? ? A . n A 1 488 HIS 488 488 ? ? ? A . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code B 2 NAG 1 501 1 NAG NAG A . C 2 NAG 1 502 2 NAG NAG A . D 3 CU1 1 503 1 CU1 CU1 A . E 4 ACT 1 504 1 ACT ACT A . F 5 HOH 1 601 112 HOH HOH A . F 5 HOH 2 602 260 HOH HOH A . F 5 HOH 3 603 99 HOH HOH A . F 5 HOH 4 604 233 HOH HOH A . F 5 HOH 5 605 119 HOH HOH A . F 5 HOH 6 606 225 HOH HOH A . F 5 HOH 7 607 222 HOH HOH A . F 5 HOH 8 608 71 HOH HOH A . F 5 HOH 9 609 224 HOH HOH A . F 5 HOH 10 610 121 HOH HOH A . F 5 HOH 11 611 256 HOH HOH A . F 5 HOH 12 612 80 HOH HOH A . F 5 HOH 13 613 3 HOH HOH A . F 5 HOH 14 614 56 HOH HOH A . F 5 HOH 15 615 46 HOH HOH A . F 5 HOH 16 616 240 HOH HOH A . F 5 HOH 17 617 201 HOH HOH A . F 5 HOH 18 618 202 HOH HOH A . F 5 HOH 19 619 90 HOH HOH A . F 5 HOH 20 620 21 HOH HOH A . F 5 HOH 21 621 2 HOH HOH A . F 5 HOH 22 622 205 HOH HOH A . F 5 HOH 23 623 191 HOH HOH A . F 5 HOH 24 624 183 HOH HOH A . F 5 HOH 25 625 208 HOH HOH A . F 5 HOH 26 626 178 HOH HOH A . F 5 HOH 27 627 48 HOH HOH A . F 5 HOH 28 628 180 HOH HOH A . F 5 HOH 29 629 139 HOH HOH A . F 5 HOH 30 630 102 HOH HOH A . F 5 HOH 31 631 166 HOH HOH A . F 5 HOH 32 632 196 HOH HOH A . F 5 HOH 33 633 13 HOH HOH A . F 5 HOH 34 634 83 HOH HOH A . F 5 HOH 35 635 105 HOH HOH A . F 5 HOH 36 636 15 HOH HOH A . F 5 HOH 37 637 25 HOH HOH A . F 5 HOH 38 638 190 HOH HOH A . F 5 HOH 39 639 150 HOH HOH A . F 5 HOH 40 640 134 HOH HOH A . F 5 HOH 41 641 40 HOH HOH A . F 5 HOH 42 642 188 HOH HOH A . F 5 HOH 43 643 43 HOH HOH A . F 5 HOH 44 644 123 HOH HOH A . F 5 HOH 45 645 61 HOH HOH A . F 5 HOH 46 646 29 HOH HOH A . F 5 HOH 47 647 28 HOH HOH A . F 5 HOH 48 648 243 HOH HOH A . F 5 HOH 49 649 101 HOH HOH A . F 5 HOH 50 650 147 HOH HOH A . F 5 HOH 51 651 249 HOH HOH A . F 5 HOH 52 652 14 HOH HOH A . F 5 HOH 53 653 34 HOH HOH A . F 5 HOH 54 654 57 HOH HOH A . F 5 HOH 55 655 49 HOH HOH A . F 5 HOH 56 656 17 HOH HOH A . F 5 HOH 57 657 148 HOH HOH A . F 5 HOH 58 658 217 HOH HOH A . F 5 HOH 59 659 245 HOH HOH A . F 5 HOH 60 660 67 HOH HOH A . F 5 HOH 61 661 65 HOH HOH A . F 5 HOH 62 662 19 HOH HOH A . F 5 HOH 63 663 92 HOH HOH A . F 5 HOH 64 664 91 HOH HOH A . F 5 HOH 65 665 96 HOH HOH A . F 5 HOH 66 666 104 HOH HOH A . F 5 HOH 67 667 52 HOH HOH A . F 5 HOH 68 668 45 HOH HOH A . F 5 HOH 69 669 39 HOH HOH A . F 5 HOH 70 670 63 HOH HOH A . F 5 HOH 71 671 30 HOH HOH A . F 5 HOH 72 672 89 HOH HOH A . F 5 HOH 73 673 167 HOH HOH A . F 5 HOH 74 674 1 HOH HOH A . F 5 HOH 75 675 87 HOH HOH A . F 5 HOH 76 676 244 HOH HOH A . F 5 HOH 77 677 31 HOH HOH A . F 5 HOH 78 678 88 HOH HOH A . F 5 HOH 79 679 247 HOH HOH A . F 5 HOH 80 680 252 HOH HOH A . F 5 HOH 81 681 146 HOH HOH A . F 5 HOH 82 682 16 HOH HOH A . F 5 HOH 83 683 53 HOH HOH A . F 5 HOH 84 684 58 HOH HOH A . F 5 HOH 85 685 185 HOH HOH A . F 5 HOH 86 686 255 HOH HOH A . F 5 HOH 87 687 77 HOH HOH A . F 5 HOH 88 688 73 HOH HOH A . F 5 HOH 89 689 135 HOH HOH A . F 5 HOH 90 690 78 HOH HOH A . F 5 HOH 91 691 111 HOH HOH A . F 5 HOH 92 692 181 HOH HOH A . F 5 HOH 93 693 95 HOH HOH A . F 5 HOH 94 694 93 HOH HOH A . F 5 HOH 95 695 84 HOH HOH A . F 5 HOH 96 696 113 HOH HOH A . F 5 HOH 97 697 32 HOH HOH A . F 5 HOH 98 698 50 HOH HOH A . F 5 HOH 99 699 248 HOH HOH A . F 5 HOH 100 700 70 HOH HOH A . F 5 HOH 101 701 24 HOH HOH A . F 5 HOH 102 702 151 HOH HOH A . F 5 HOH 103 703 23 HOH HOH A . F 5 HOH 104 704 97 HOH HOH A . F 5 HOH 105 705 154 HOH HOH A . F 5 HOH 106 706 223 HOH HOH A . F 5 HOH 107 707 47 HOH HOH A . F 5 HOH 108 708 262 HOH HOH A . F 5 HOH 109 709 55 HOH HOH A . F 5 HOH 110 710 211 HOH HOH A . F 5 HOH 111 711 8 HOH HOH A . F 5 HOH 112 712 241 HOH HOH A . F 5 HOH 113 713 118 HOH HOH A . F 5 HOH 114 714 12 HOH HOH A . F 5 HOH 115 715 22 HOH HOH A . F 5 HOH 116 716 81 HOH HOH A . F 5 HOH 117 717 98 HOH HOH A . F 5 HOH 118 718 122 HOH HOH A . F 5 HOH 119 719 136 HOH HOH A . F 5 HOH 120 720 36 HOH HOH A . F 5 HOH 121 721 250 HOH HOH A . F 5 HOH 122 722 114 HOH HOH A . F 5 HOH 123 723 7 HOH HOH A . F 5 HOH 124 724 231 HOH HOH A . F 5 HOH 125 725 94 HOH HOH A . F 5 HOH 126 726 62 HOH HOH A . F 5 HOH 127 727 42 HOH HOH A . F 5 HOH 128 728 213 HOH HOH A . F 5 HOH 129 729 161 HOH HOH A . F 5 HOH 130 730 6 HOH HOH A . F 5 HOH 131 731 142 HOH HOH A . F 5 HOH 132 732 38 HOH HOH A . F 5 HOH 133 733 251 HOH HOH A . F 5 HOH 134 734 227 HOH HOH A . F 5 HOH 135 735 163 HOH HOH A . F 5 HOH 136 736 144 HOH HOH A . F 5 HOH 137 737 106 HOH HOH A . F 5 HOH 138 738 159 HOH HOH A . F 5 HOH 139 739 100 HOH HOH A . F 5 HOH 140 740 33 HOH HOH A . F 5 HOH 141 741 131 HOH HOH A . F 5 HOH 142 742 9 HOH HOH A . F 5 HOH 143 743 184 HOH HOH A . F 5 HOH 144 744 115 HOH HOH A . F 5 HOH 145 745 10 HOH HOH A . F 5 HOH 146 746 198 HOH HOH A . F 5 HOH 147 747 186 HOH HOH A . F 5 HOH 148 748 242 HOH HOH A . F 5 HOH 149 749 137 HOH HOH A . F 5 HOH 150 750 41 HOH HOH A . F 5 HOH 151 751 129 HOH HOH A . F 5 HOH 152 752 60 HOH HOH A . F 5 HOH 153 753 51 HOH HOH A . F 5 HOH 154 754 59 HOH HOH A . F 5 HOH 155 755 257 HOH HOH A . F 5 HOH 156 756 20 HOH HOH A . F 5 HOH 157 757 156 HOH HOH A . F 5 HOH 158 758 246 HOH HOH A . F 5 HOH 159 759 158 HOH HOH A . F 5 HOH 160 760 5 HOH HOH A . F 5 HOH 161 761 108 HOH HOH A . F 5 HOH 162 762 66 HOH HOH A . F 5 HOH 163 763 253 HOH HOH A . F 5 HOH 164 764 230 HOH HOH A . F 5 HOH 165 765 254 HOH HOH A . F 5 HOH 166 766 187 HOH HOH A . F 5 HOH 167 767 69 HOH HOH A . F 5 HOH 168 768 82 HOH HOH A . F 5 HOH 169 769 117 HOH HOH A . F 5 HOH 170 770 157 HOH HOH A . F 5 HOH 171 771 11 HOH HOH A . F 5 HOH 172 772 76 HOH HOH A . F 5 HOH 173 773 79 HOH HOH A . F 5 HOH 174 774 204 HOH HOH A . F 5 HOH 175 775 74 HOH HOH A . F 5 HOH 176 776 189 HOH HOH A . F 5 HOH 177 777 209 HOH HOH A . F 5 HOH 178 778 37 HOH HOH A . F 5 HOH 179 779 212 HOH HOH A . F 5 HOH 180 780 214 HOH HOH A . F 5 HOH 181 781 125 HOH HOH A . F 5 HOH 182 782 4 HOH HOH A . F 5 HOH 183 783 162 HOH HOH A . F 5 HOH 184 784 218 HOH HOH A . F 5 HOH 185 785 155 HOH HOH A . F 5 HOH 186 786 35 HOH HOH A . F 5 HOH 187 787 26 HOH HOH A . F 5 HOH 188 788 234 HOH HOH A . F 5 HOH 189 789 86 HOH HOH A . F 5 HOH 190 790 229 HOH HOH A . F 5 HOH 191 791 153 HOH HOH A . F 5 HOH 192 792 85 HOH HOH A . F 5 HOH 193 793 110 HOH HOH A . F 5 HOH 194 794 124 HOH HOH A . F 5 HOH 195 795 143 HOH HOH A . F 5 HOH 196 796 18 HOH HOH A . F 5 HOH 197 797 54 HOH HOH A . F 5 HOH 198 798 128 HOH HOH A . F 5 HOH 199 799 177 HOH HOH A . F 5 HOH 200 800 68 HOH HOH A . F 5 HOH 201 801 168 HOH HOH A . F 5 HOH 202 802 75 HOH HOH A . F 5 HOH 203 803 226 HOH HOH A . F 5 HOH 204 804 193 HOH HOH A . F 5 HOH 205 805 27 HOH HOH A . F 5 HOH 206 806 44 HOH HOH A . F 5 HOH 207 807 127 HOH HOH A . F 5 HOH 208 808 259 HOH HOH A . F 5 HOH 209 809 176 HOH HOH A . F 5 HOH 210 810 164 HOH HOH A . F 5 HOH 211 811 132 HOH HOH A . F 5 HOH 212 812 172 HOH HOH A . F 5 HOH 213 813 169 HOH HOH A . F 5 HOH 214 814 220 HOH HOH A . F 5 HOH 215 815 149 HOH HOH A . F 5 HOH 216 816 261 HOH HOH A . F 5 HOH 217 817 174 HOH HOH A . F 5 HOH 218 818 145 HOH HOH A . F 5 HOH 219 819 130 HOH HOH A . F 5 HOH 220 820 207 HOH HOH A . F 5 HOH 221 821 107 HOH HOH A . F 5 HOH 222 822 126 HOH HOH A . F 5 HOH 223 823 64 HOH HOH A . F 5 HOH 224 824 238 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 # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 720 ? 1 MORE -8 ? 1 'SSA (A^2)' 16310 ? # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 OH ? A TYR 120 ? A TYR 120 ? 1_555 CU ? D CU1 . ? A CU1 503 ? 1_555 NE2 ? A HIS 335 ? A HIS 335 ? 1_555 160.3 ? 2 OH ? A TYR 120 ? A TYR 120 ? 1_555 CU ? D CU1 . ? A CU1 503 ? 1_555 NE2 ? A HIS 423 ? A HIS 423 ? 1_555 107.5 ? 3 NE2 ? A HIS 335 ? A HIS 335 ? 1_555 CU ? D CU1 . ? A CU1 503 ? 1_555 NE2 ? A HIS 423 ? A HIS 423 ? 1_555 92.1 ? # 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 2015-07-08 2 'Structure model' 1 1 2016-01-13 3 'Structure model' 1 2 2017-08-30 # _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' Advisory 3 3 'Structure model' 'Author supporting evidence' 4 3 'Structure model' 'Derived calculations' # loop_ _pdbx_audit_revision_category.ordinal _pdbx_audit_revision_category.revision_ordinal _pdbx_audit_revision_category.data_content_type _pdbx_audit_revision_category.category 1 3 'Structure model' pdbx_audit_support 2 3 'Structure model' pdbx_validate_close_contact 3 3 'Structure model' struct_conn # _pdbx_audit_revision_item.ordinal 1 _pdbx_audit_revision_item.revision_ordinal 3 _pdbx_audit_revision_item.data_content_type 'Structure model' _pdbx_audit_revision_item.item '_pdbx_audit_support.funding_organization' # 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 ? ? ? ? ? ? ? ? ? ? ? REFMAC ? ? ? 5.8.0123 1 ? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? XDS ? ? ? . 2 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? . 3 ? phasing ? ? ? ? ? ? ? ? ? ? ? MOLREP ? ? ? . 4 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 GLU A 24 ? ? 79.08 -55.88 2 1 SER A 32 ? ? -110.67 -76.22 3 1 SER A 33 ? ? -176.74 -159.72 4 1 TRP A 184 ? ? -142.74 -159.53 5 1 THR A 307 ? ? 28.46 52.11 6 1 ASN A 333 ? ? -104.54 -132.03 7 1 LEU A 353 ? ? 71.70 59.01 8 1 THR A 424 ? ? 79.44 -4.82 9 1 LYS A 443 ? ? -147.73 -48.32 10 1 ASN A 467 ? ? -76.52 -165.15 # _pdbx_validate_peptide_omega.id 1 _pdbx_validate_peptide_omega.PDB_model_num 1 _pdbx_validate_peptide_omega.auth_comp_id_1 CYS _pdbx_validate_peptide_omega.auth_asym_id_1 A _pdbx_validate_peptide_omega.auth_seq_id_1 223 _pdbx_validate_peptide_omega.PDB_ins_code_1 ? _pdbx_validate_peptide_omega.label_alt_id_1 ? _pdbx_validate_peptide_omega.auth_comp_id_2 GLY _pdbx_validate_peptide_omega.auth_asym_id_2 A _pdbx_validate_peptide_omega.auth_seq_id_2 224 _pdbx_validate_peptide_omega.PDB_ins_code_2 ? _pdbx_validate_peptide_omega.label_alt_id_2 ? _pdbx_validate_peptide_omega.omega 148.46 # 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 GLN 1 ? A GLN 1 2 1 Y 1 A HIS 483 ? A HIS 483 3 1 Y 1 A HIS 484 ? A HIS 484 4 1 Y 1 A HIS 485 ? A HIS 485 5 1 Y 1 A HIS 486 ? A HIS 486 6 1 Y 1 A HIS 487 ? A HIS 487 7 1 Y 1 A HIS 488 ? A HIS 488 # _pdbx_audit_support.funding_organization 'Biotechnology and Biological Sciences Research Council' _pdbx_audit_support.country 'United Kingdom' _pdbx_audit_support.grant_number BB/I014802/1 _pdbx_audit_support.ordinal 1 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 'COPPER (I) ION' CU1 4 'ACETATE ION' ACT 5 water HOH #