data_5JG8 # _entry.id 5JG8 # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 5JG8 WWPDB D_1000219679 # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 5JG8 _pdbx_database_status.recvd_initial_deposition_date 2016-04-19 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Xiong, Z.J.' 1 'Prive, G.G.' 2 # _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 J.Mol.Biol. _citation.journal_id_ASTM JMOBAK _citation.journal_id_CSD 0070 _citation.journal_id_ISSN 1089-8638 _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 428 _citation.language ? _citation.page_first 3026 _citation.page_last 3042 _citation.title 'Structure of Human Acid Sphingomyelinase Reveals the Role of the Saposin Domain in Activating Substrate Hydrolysis.' _citation.year 2016 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.1016/j.jmb.2016.06.012 _citation.pdbx_database_id_PubMed 27349982 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Xiong, Z.J.' 1 primary 'Huang, J.' 2 primary 'Poda, G.' 3 primary 'Pomes, R.' 4 primary 'Prive, G.G.' 5 # _cell.length_a 69.531 _cell.length_b 143.658 _cell.length_c 193.620 _cell.angle_alpha 90.000 _cell.angle_beta 90.000 _cell.angle_gamma 90.000 _cell.entry_id 5JG8 _cell.Z_PDB 8 _cell.pdbx_unique_axis ? # _symmetry.space_group_name_H-M 'P 21 21 21' _symmetry.entry_id 5JG8 _symmetry.Int_Tables_number 19 _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? # 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 'Sphingomyelin phosphodiesterase' 65323.453 2 3.1.4.12 ? 'UNP residues 47-629' ? 2 non-polymer syn 'ZINC ION' 65.409 4 ? ? ? ? 3 non-polymer syn 'ACETATE ION' 59.044 2 ? ? ? ? 4 non-polymer syn N-ACETYL-D-GLUCOSAMINE 221.208 19 ? ? ? ? 5 non-polymer man ALPHA-D-MANNOSE 180.156 2 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'Acid sphingomyelinase,aSMase' # _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 ;GAPLSDSRVLWAPAEAHPLSPQGHPARLHRIVPRLRDVFGWGNLTCPICKGLFTAINLGLKKEPNVARVGSVAIKLCNLL KIAPPAVCQSIVHLFEDDMVEVWRRSVLSPSEACGLLLGSTCGHWDIFSSWNISLPTVPKPPPKPPSPPAPGAPVSRILF LTDLHWDHDYLEGTDPDCADPLCCRRGSGLPPASRPGAGYWGEYSKCDLPLRTLESLLSGLGPAGPFDMVYWTGDIPAHD VWHQTRQDQLRALTTVTALVRKFLGPVPVYPAVGNHESTPVNSFPPPFIEGNHSSRWLYEAMAKAWEPWLPAEALRTLRI GGFYALSPYPGLRLISLNMNFCSRENFWLLINSTDPAGQLQWLVGELQAAEDRGDKVHIIGHIPPGHCLKSWSWNYYRIV ARYENTLAAQFFGHTHVDEFEVFYDEETLSRPLAVAFLAPSATTYIGLNPGYRVYQIDGNYSGSSHVVLDHETYILNLTQ ANIPGAIPHWQLLYRARETYGLPNTLPTAWHNLVYRMRGDMQLFQTFWFLYHKGHPPSEPCGTPCRLATLCAQLSARADS PALCRHLMPDGSLPEAQSLWPRPLFS ; _entity_poly.pdbx_seq_one_letter_code_can ;GAPLSDSRVLWAPAEAHPLSPQGHPARLHRIVPRLRDVFGWGNLTCPICKGLFTAINLGLKKEPNVARVGSVAIKLCNLL KIAPPAVCQSIVHLFEDDMVEVWRRSVLSPSEACGLLLGSTCGHWDIFSSWNISLPTVPKPPPKPPSPPAPGAPVSRILF LTDLHWDHDYLEGTDPDCADPLCCRRGSGLPPASRPGAGYWGEYSKCDLPLRTLESLLSGLGPAGPFDMVYWTGDIPAHD VWHQTRQDQLRALTTVTALVRKFLGPVPVYPAVGNHESTPVNSFPPPFIEGNHSSRWLYEAMAKAWEPWLPAEALRTLRI GGFYALSPYPGLRLISLNMNFCSRENFWLLINSTDPAGQLQWLVGELQAAEDRGDKVHIIGHIPPGHCLKSWSWNYYRIV ARYENTLAAQFFGHTHVDEFEVFYDEETLSRPLAVAFLAPSATTYIGLNPGYRVYQIDGNYSGSSHVVLDHETYILNLTQ ANIPGAIPHWQLLYRARETYGLPNTLPTAWHNLVYRMRGDMQLFQTFWFLYHKGHPPSEPCGTPCRLATLCAQLSARADS PALCRHLMPDGSLPEAQSLWPRPLFS ; _entity_poly.pdbx_strand_id A,B _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 GLY n 1 2 ALA n 1 3 PRO n 1 4 LEU n 1 5 SER n 1 6 ASP n 1 7 SER n 1 8 ARG n 1 9 VAL n 1 10 LEU n 1 11 TRP n 1 12 ALA n 1 13 PRO n 1 14 ALA n 1 15 GLU n 1 16 ALA n 1 17 HIS n 1 18 PRO n 1 19 LEU n 1 20 SER n 1 21 PRO n 1 22 GLN n 1 23 GLY n 1 24 HIS n 1 25 PRO n 1 26 ALA n 1 27 ARG n 1 28 LEU n 1 29 HIS n 1 30 ARG n 1 31 ILE n 1 32 VAL n 1 33 PRO n 1 34 ARG n 1 35 LEU n 1 36 ARG n 1 37 ASP n 1 38 VAL n 1 39 PHE n 1 40 GLY n 1 41 TRP n 1 42 GLY n 1 43 ASN n 1 44 LEU n 1 45 THR n 1 46 CYS n 1 47 PRO n 1 48 ILE n 1 49 CYS n 1 50 LYS n 1 51 GLY n 1 52 LEU n 1 53 PHE n 1 54 THR n 1 55 ALA n 1 56 ILE n 1 57 ASN n 1 58 LEU n 1 59 GLY n 1 60 LEU n 1 61 LYS n 1 62 LYS n 1 63 GLU n 1 64 PRO n 1 65 ASN n 1 66 VAL n 1 67 ALA n 1 68 ARG n 1 69 VAL n 1 70 GLY n 1 71 SER n 1 72 VAL n 1 73 ALA n 1 74 ILE n 1 75 LYS n 1 76 LEU n 1 77 CYS n 1 78 ASN n 1 79 LEU n 1 80 LEU n 1 81 LYS n 1 82 ILE n 1 83 ALA n 1 84 PRO n 1 85 PRO n 1 86 ALA n 1 87 VAL n 1 88 CYS n 1 89 GLN n 1 90 SER n 1 91 ILE n 1 92 VAL n 1 93 HIS n 1 94 LEU n 1 95 PHE n 1 96 GLU n 1 97 ASP n 1 98 ASP n 1 99 MET n 1 100 VAL n 1 101 GLU n 1 102 VAL n 1 103 TRP n 1 104 ARG n 1 105 ARG n 1 106 SER n 1 107 VAL n 1 108 LEU n 1 109 SER n 1 110 PRO n 1 111 SER n 1 112 GLU n 1 113 ALA n 1 114 CYS n 1 115 GLY n 1 116 LEU n 1 117 LEU n 1 118 LEU n 1 119 GLY n 1 120 SER n 1 121 THR n 1 122 CYS n 1 123 GLY n 1 124 HIS n 1 125 TRP n 1 126 ASP n 1 127 ILE n 1 128 PHE n 1 129 SER n 1 130 SER n 1 131 TRP n 1 132 ASN n 1 133 ILE n 1 134 SER n 1 135 LEU n 1 136 PRO n 1 137 THR n 1 138 VAL n 1 139 PRO n 1 140 LYS n 1 141 PRO n 1 142 PRO n 1 143 PRO n 1 144 LYS n 1 145 PRO n 1 146 PRO n 1 147 SER n 1 148 PRO n 1 149 PRO n 1 150 ALA n 1 151 PRO n 1 152 GLY n 1 153 ALA n 1 154 PRO n 1 155 VAL n 1 156 SER n 1 157 ARG n 1 158 ILE n 1 159 LEU n 1 160 PHE n 1 161 LEU n 1 162 THR n 1 163 ASP n 1 164 LEU n 1 165 HIS n 1 166 TRP n 1 167 ASP n 1 168 HIS n 1 169 ASP n 1 170 TYR n 1 171 LEU n 1 172 GLU n 1 173 GLY n 1 174 THR n 1 175 ASP n 1 176 PRO n 1 177 ASP n 1 178 CYS n 1 179 ALA n 1 180 ASP n 1 181 PRO n 1 182 LEU n 1 183 CYS n 1 184 CYS n 1 185 ARG n 1 186 ARG n 1 187 GLY n 1 188 SER n 1 189 GLY n 1 190 LEU n 1 191 PRO n 1 192 PRO n 1 193 ALA n 1 194 SER n 1 195 ARG n 1 196 PRO n 1 197 GLY n 1 198 ALA n 1 199 GLY n 1 200 TYR n 1 201 TRP n 1 202 GLY n 1 203 GLU n 1 204 TYR n 1 205 SER n 1 206 LYS n 1 207 CYS n 1 208 ASP n 1 209 LEU n 1 210 PRO n 1 211 LEU n 1 212 ARG n 1 213 THR n 1 214 LEU n 1 215 GLU n 1 216 SER n 1 217 LEU n 1 218 LEU n 1 219 SER n 1 220 GLY n 1 221 LEU n 1 222 GLY n 1 223 PRO n 1 224 ALA n 1 225 GLY n 1 226 PRO n 1 227 PHE n 1 228 ASP n 1 229 MET n 1 230 VAL n 1 231 TYR n 1 232 TRP n 1 233 THR n 1 234 GLY n 1 235 ASP n 1 236 ILE n 1 237 PRO n 1 238 ALA n 1 239 HIS n 1 240 ASP n 1 241 VAL n 1 242 TRP n 1 243 HIS n 1 244 GLN n 1 245 THR n 1 246 ARG n 1 247 GLN n 1 248 ASP n 1 249 GLN n 1 250 LEU n 1 251 ARG n 1 252 ALA n 1 253 LEU n 1 254 THR n 1 255 THR n 1 256 VAL n 1 257 THR n 1 258 ALA n 1 259 LEU n 1 260 VAL n 1 261 ARG n 1 262 LYS n 1 263 PHE n 1 264 LEU n 1 265 GLY n 1 266 PRO n 1 267 VAL n 1 268 PRO n 1 269 VAL n 1 270 TYR n 1 271 PRO n 1 272 ALA n 1 273 VAL n 1 274 GLY n 1 275 ASN n 1 276 HIS n 1 277 GLU n 1 278 SER n 1 279 THR n 1 280 PRO n 1 281 VAL n 1 282 ASN n 1 283 SER n 1 284 PHE n 1 285 PRO n 1 286 PRO n 1 287 PRO n 1 288 PHE n 1 289 ILE n 1 290 GLU n 1 291 GLY n 1 292 ASN n 1 293 HIS n 1 294 SER n 1 295 SER n 1 296 ARG n 1 297 TRP n 1 298 LEU n 1 299 TYR n 1 300 GLU n 1 301 ALA n 1 302 MET n 1 303 ALA n 1 304 LYS n 1 305 ALA n 1 306 TRP n 1 307 GLU n 1 308 PRO n 1 309 TRP n 1 310 LEU n 1 311 PRO n 1 312 ALA n 1 313 GLU n 1 314 ALA n 1 315 LEU n 1 316 ARG n 1 317 THR n 1 318 LEU n 1 319 ARG n 1 320 ILE n 1 321 GLY n 1 322 GLY n 1 323 PHE n 1 324 TYR n 1 325 ALA n 1 326 LEU n 1 327 SER n 1 328 PRO n 1 329 TYR n 1 330 PRO n 1 331 GLY n 1 332 LEU n 1 333 ARG n 1 334 LEU n 1 335 ILE n 1 336 SER n 1 337 LEU n 1 338 ASN n 1 339 MET n 1 340 ASN n 1 341 PHE n 1 342 CYS n 1 343 SER n 1 344 ARG n 1 345 GLU n 1 346 ASN n 1 347 PHE n 1 348 TRP n 1 349 LEU n 1 350 LEU n 1 351 ILE n 1 352 ASN n 1 353 SER n 1 354 THR n 1 355 ASP n 1 356 PRO n 1 357 ALA n 1 358 GLY n 1 359 GLN n 1 360 LEU n 1 361 GLN n 1 362 TRP n 1 363 LEU n 1 364 VAL n 1 365 GLY n 1 366 GLU n 1 367 LEU n 1 368 GLN n 1 369 ALA n 1 370 ALA n 1 371 GLU n 1 372 ASP n 1 373 ARG n 1 374 GLY n 1 375 ASP n 1 376 LYS n 1 377 VAL n 1 378 HIS n 1 379 ILE n 1 380 ILE n 1 381 GLY n 1 382 HIS n 1 383 ILE n 1 384 PRO n 1 385 PRO n 1 386 GLY n 1 387 HIS n 1 388 CYS n 1 389 LEU n 1 390 LYS n 1 391 SER n 1 392 TRP n 1 393 SER n 1 394 TRP n 1 395 ASN n 1 396 TYR n 1 397 TYR n 1 398 ARG n 1 399 ILE n 1 400 VAL n 1 401 ALA n 1 402 ARG n 1 403 TYR n 1 404 GLU n 1 405 ASN n 1 406 THR n 1 407 LEU n 1 408 ALA n 1 409 ALA n 1 410 GLN n 1 411 PHE n 1 412 PHE n 1 413 GLY n 1 414 HIS n 1 415 THR n 1 416 HIS n 1 417 VAL n 1 418 ASP n 1 419 GLU n 1 420 PHE n 1 421 GLU n 1 422 VAL n 1 423 PHE n 1 424 TYR n 1 425 ASP n 1 426 GLU n 1 427 GLU n 1 428 THR n 1 429 LEU n 1 430 SER n 1 431 ARG n 1 432 PRO n 1 433 LEU n 1 434 ALA n 1 435 VAL n 1 436 ALA n 1 437 PHE n 1 438 LEU n 1 439 ALA n 1 440 PRO n 1 441 SER n 1 442 ALA n 1 443 THR n 1 444 THR n 1 445 TYR n 1 446 ILE n 1 447 GLY n 1 448 LEU n 1 449 ASN n 1 450 PRO n 1 451 GLY n 1 452 TYR n 1 453 ARG n 1 454 VAL n 1 455 TYR n 1 456 GLN n 1 457 ILE n 1 458 ASP n 1 459 GLY n 1 460 ASN n 1 461 TYR n 1 462 SER n 1 463 GLY n 1 464 SER n 1 465 SER n 1 466 HIS n 1 467 VAL n 1 468 VAL n 1 469 LEU n 1 470 ASP n 1 471 HIS n 1 472 GLU n 1 473 THR n 1 474 TYR n 1 475 ILE n 1 476 LEU n 1 477 ASN n 1 478 LEU n 1 479 THR n 1 480 GLN n 1 481 ALA n 1 482 ASN n 1 483 ILE n 1 484 PRO n 1 485 GLY n 1 486 ALA n 1 487 ILE n 1 488 PRO n 1 489 HIS n 1 490 TRP n 1 491 GLN n 1 492 LEU n 1 493 LEU n 1 494 TYR n 1 495 ARG n 1 496 ALA n 1 497 ARG n 1 498 GLU n 1 499 THR n 1 500 TYR n 1 501 GLY n 1 502 LEU n 1 503 PRO n 1 504 ASN n 1 505 THR n 1 506 LEU n 1 507 PRO n 1 508 THR n 1 509 ALA n 1 510 TRP n 1 511 HIS n 1 512 ASN n 1 513 LEU n 1 514 VAL n 1 515 TYR n 1 516 ARG n 1 517 MET n 1 518 ARG n 1 519 GLY n 1 520 ASP n 1 521 MET n 1 522 GLN n 1 523 LEU n 1 524 PHE n 1 525 GLN n 1 526 THR n 1 527 PHE n 1 528 TRP n 1 529 PHE n 1 530 LEU n 1 531 TYR n 1 532 HIS n 1 533 LYS n 1 534 GLY n 1 535 HIS n 1 536 PRO n 1 537 PRO n 1 538 SER n 1 539 GLU n 1 540 PRO n 1 541 CYS n 1 542 GLY n 1 543 THR n 1 544 PRO n 1 545 CYS n 1 546 ARG n 1 547 LEU n 1 548 ALA n 1 549 THR n 1 550 LEU n 1 551 CYS n 1 552 ALA n 1 553 GLN n 1 554 LEU n 1 555 SER n 1 556 ALA n 1 557 ARG n 1 558 ALA n 1 559 ASP n 1 560 SER n 1 561 PRO n 1 562 ALA n 1 563 LEU n 1 564 CYS n 1 565 ARG n 1 566 HIS n 1 567 LEU n 1 568 MET n 1 569 PRO n 1 570 ASP n 1 571 GLY n 1 572 SER n 1 573 LEU n 1 574 PRO n 1 575 GLU n 1 576 ALA n 1 577 GLN n 1 578 SER n 1 579 LEU n 1 580 TRP n 1 581 PRO n 1 582 ARG n 1 583 PRO n 1 584 LEU n 1 585 PHE n 1 586 SER 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 586 _entity_src_gen.gene_src_common_name Human _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene 'SMPD1, ASM' _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 'Homo sapiens' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606 _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 Human _entity_src_gen.pdbx_host_org_scientific_name 'Homo sapiens' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 9606 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code ASM_HUMAN _struct_ref.pdbx_db_accession P17405 _struct_ref.pdbx_db_isoform ? _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;LSDSRVLWAPAEAHPLSPQGHPARLHRIVPRLRDVFGWGNLTCPICKGLFTAINLGLKKEPNVARVGSVAIKLCNLLKIA PPAVCQSIVHLFEDDMVEVWRRSVLSPSEACGLLLGSTCGHWDIFSSWNISLPTVPKPPPKPPSPPAPGAPVSRILFLTD LHWDHDYLEGTDPDCADPLCCRRGSGLPPASRPGAGYWGEYSKCDLPLRTLESLLSGLGPAGPFDMVYWTGDIPAHDVWH QTRQDQLRALTTVTALVRKFLGPVPVYPAVGNHESTPVNSFPPPFIEGNHSSRWLYEAMAKAWEPWLPAEALRTLRIGGF YALSPYPGLRLISLNMNFCSRENFWLLINSTDPAGQLQWLVGELQAAEDRGDKVHIIGHIPPGHCLKSWSWNYYRIVARY ENTLAAQFFGHTHVDEFEVFYDEETLSRPLAVAFLAPSATTYIGLNPGYRVYQIDGNYSGSSHVVLDHETYILNLTQANI PGAIPHWQLLYRARETYGLPNTLPTAWHNLVYRMRGDMQLFQTFWFLYHKGHPPSEPCGTPCRLATLCAQLSARADSPAL CRHLMPDGSLPEAQSLWPRPLFC ; _struct_ref.pdbx_align_begin 47 # loop_ _struct_ref_seq.align_id _struct_ref_seq.ref_id _struct_ref_seq.pdbx_PDB_id_code _struct_ref_seq.pdbx_strand_id _struct_ref_seq.seq_align_beg _struct_ref_seq.pdbx_seq_align_beg_ins_code _struct_ref_seq.seq_align_end _struct_ref_seq.pdbx_seq_align_end_ins_code _struct_ref_seq.pdbx_db_accession _struct_ref_seq.db_align_beg _struct_ref_seq.pdbx_db_align_beg_ins_code _struct_ref_seq.db_align_end _struct_ref_seq.pdbx_db_align_end_ins_code _struct_ref_seq.pdbx_auth_seq_align_beg _struct_ref_seq.pdbx_auth_seq_align_end 1 1 5JG8 A 4 ? 586 ? P17405 47 ? 629 ? 47 629 2 1 5JG8 B 4 ? 586 ? P17405 47 ? 629 ? 47 629 # 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 5JG8 GLY A 1 ? UNP P17405 ? ? 'expression tag' 44 1 1 5JG8 ALA A 2 ? UNP P17405 ? ? 'expression tag' 45 2 1 5JG8 PRO A 3 ? UNP P17405 ? ? 'expression tag' 46 3 1 5JG8 SER A 586 ? UNP P17405 CYS 629 'engineered mutation' 629 4 2 5JG8 GLY B 1 ? UNP P17405 ? ? 'expression tag' 44 5 2 5JG8 ALA B 2 ? UNP P17405 ? ? 'expression tag' 45 6 2 5JG8 PRO B 3 ? UNP P17405 ? ? 'expression tag' 46 7 2 5JG8 SER B 586 ? UNP P17405 CYS 629 'engineered mutation' 629 8 # 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 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 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MAN D-saccharide . ALPHA-D-MANNOSE ? 'C6 H12 O6' 180.156 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 ZN non-polymer . 'ZINC ION' ? 'Zn 2' 65.409 # _exptl.absorpt_coefficient_mu ? _exptl.absorpt_correction_T_max ? _exptl.absorpt_correction_T_min ? _exptl.absorpt_correction_type ? _exptl.absorpt_process_details ? _exptl.entry_id 5JG8 _exptl.crystals_number 1 _exptl.details ? _exptl.method 'X-RAY DIFFRACTION' _exptl.method_details ? # _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 3.70 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 70 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.id 1 _exptl_crystal.preparation ? _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.colour_lustre ? _exptl_crystal.colour_modifier ? _exptl_crystal.colour_primary ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_esd ? _exptl_crystal.density_meas_gt ? _exptl_crystal.density_meas_lt ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_meas_temp_esd ? _exptl_crystal.density_meas_temp_gt ? _exptl_crystal.density_meas_temp_lt ? _exptl_crystal.pdbx_crystal_image_url ? _exptl_crystal.pdbx_crystal_image_format ? _exptl_crystal.pdbx_mosaicity ? _exptl_crystal.pdbx_mosaicity_esd ? # _exptl_crystal_grow.apparatus ? _exptl_crystal_grow.atmosphere ? _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.details ? _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.method_ref ? _exptl_crystal_grow.pH 6 _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 'PEG8000, sodium potassium tartrate, sodium acetate, sodium cacodylate, MES, pH 6' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.ambient_environment ? _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.ambient_temp_esd ? _diffrn.crystal_id 1 _diffrn.crystal_support ? _diffrn.crystal_treatment ? _diffrn.details ? _diffrn.id 1 _diffrn.ambient_pressure ? _diffrn.ambient_pressure_esd ? _diffrn.ambient_pressure_gt ? _diffrn.ambient_pressure_lt ? _diffrn.ambient_temp_gt ? _diffrn.ambient_temp_lt ? # _diffrn_detector.details ? _diffrn_detector.detector CCD _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'ADSC QUANTUM 210' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2015-06-26 # _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 0.63 _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 'CHESS BEAMLINE A1' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 0.63 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline A1 _diffrn_source.pdbx_synchrotron_site CHESS # _reflns.d_resolution_high 2.800 _reflns.d_resolution_low 29.440 _reflns.pdbx_number_measured_all 177605 _reflns.number_obs 45859 _reflns.pdbx_scaling_rejects 71 _reflns.pdbx_Rmerge_I_obs 0.207 _reflns.pdbx_netI_over_sigmaI 5.000 _reflns.pdbx_redundancy 3.900 _reflns.percent_possible_obs 94.100 _reflns.pdbx_Rrim_I_all 0.236 _reflns.pdbx_Rpim_I_all 0.111 _reflns.pdbx_CC_half 0.989 _reflns.B_iso_Wilson_estimate 59.860 _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.entry_id 5JG8 _reflns.observed_criterion_sigma_I ? _reflns.observed_criterion_sigma_F ? _reflns.number_all ? _reflns.pdbx_Rsym_value ? # loop_ _reflns_shell.pdbx_diffrn_id _reflns_shell.pdbx_ordinal _reflns_shell.d_res_high _reflns_shell.d_res_low _reflns_shell.number_measured_obs _reflns_shell.number_measured_all _reflns_shell.number_unique_obs _reflns_shell.pdbx_rejects _reflns_shell.Rmerge_I_obs _reflns_shell.meanI_over_sigI_obs _reflns_shell.pdbx_Rsym_value _reflns_shell.pdbx_chi_squared _reflns_shell.pdbx_redundancy _reflns_shell.percent_possible_obs _reflns_shell.pdbx_netI_over_sigmaI_obs _reflns_shell.number_possible _reflns_shell.number_unique_all _reflns_shell.Rmerge_F_all _reflns_shell.Rmerge_F_obs _reflns_shell.Rmerge_I_all _reflns_shell.meanI_over_sigI_all _reflns_shell.percent_possible_all _reflns_shell.pdbx_Rrim_I_all _reflns_shell.pdbx_Rpim_I_all _reflns_shell.pdbx_CC_half 1 1 2.800 2.900 ? 9578 ? 0 2.209 ? ? ? 2.700 ? 0.600 ? 3489 ? ? ? ? 73.300 2.604 1.343 0.256 1 2 10.840 29.440 ? 2970 ? 0 0.044 ? ? ? 3.600 ? 18.300 ? 830 ? ? ? ? 86.600 0.052 0.026 0.995 # _refine.entry_id 5JG8 _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_d_res_high 2.8000 _refine.ls_d_res_low 26.7610 _refine.pdbx_ls_sigma_F 1.350 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_percent_reflns_obs 93.7500 _refine.ls_number_reflns_obs 45556 _refine.ls_number_reflns_all ? _refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' _refine.ls_matrix_type ? _refine.pdbx_R_Free_selection_details ? _refine.details ;THE X-RAY DIFFRACTION DATA EXHIBITED STRONG ANISOTROPY, WITH CC1/2 VALUES FALLING TO 50% AT RESOLUTIONS OF 1/3.4, 1/3.0 AND 1/2.8 A IN A*, B* AND C*, RESPECTIVELY. DATA REDUCTION STATISTICS FOR AN ELLIPTICALLY TRUNCATED DATASET ARE INCLUDED IN TABLE 1 OF XIONG ET AL., JMB (2016). AN ELLIPTICALLY TRUNCATED DATASET WAS NOT USED IN REFINEMENT, HOWEVER, AS RECOMMENDED BY THE AUTHORS OF PHENIX. ; _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.2318 _refine.ls_R_factor_R_work 0.2296 _refine.ls_wR_factor_R_work ? _refine.ls_R_factor_R_free 0.2793 _refine.ls_wR_factor_R_free ? _refine.ls_percent_reflns_R_free 4.3400 _refine.ls_number_reflns_R_free 1975 _refine.ls_number_reflns_R_work 43581 _refine.ls_R_factor_R_free_error ? _refine.B_iso_mean 61.9809 _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.pdbx_isotropic_thermal_model ? _refine.aniso_B[1][1] ? _refine.aniso_B[2][2] ? _refine.aniso_B[3][3] ? _refine.aniso_B[1][2] ? _refine.aniso_B[1][3] ? _refine.aniso_B[2][3] ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.overall_SU_R_free ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.4600 _refine.overall_SU_B ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.pdbx_solvent_vdw_probe_radii 1.1100 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.9000 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.pdbx_starting_model 5EBE _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.overall_FOM_work_R_set ? _refine.B_iso_max 194.450 _refine.B_iso_min 18.540 _refine.pdbx_overall_phase_error 33.1600 _refine.occupancy_max ? _refine.occupancy_min ? _refine.pdbx_diffrn_id 1 _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_R_factor_R_free_error_details ? # _refine_hist.cycle_id final _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.d_res_high 2.8000 _refine_hist.d_res_low 26.7610 _refine_hist.pdbx_number_atoms_ligand 335 _refine_hist.number_atoms_solvent 0 _refine_hist.number_atoms_total 8678 _refine_hist.pdbx_number_residues_total 1059 _refine_hist.pdbx_B_iso_mean_ligand 104.37 _refine_hist.pdbx_number_atoms_protein 8343 _refine_hist.pdbx_number_atoms_nucleic_acid 0 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.type _refine_ls_restr.number _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' f_bond_d 8967 0.004 ? ? ? 'X-RAY DIFFRACTION' f_angle_d 12330 0.929 ? ? ? 'X-RAY DIFFRACTION' f_chiral_restr 1366 0.051 ? ? ? 'X-RAY DIFFRACTION' f_plane_restr 1567 0.016 ? ? ? 'X-RAY DIFFRACTION' f_dihedral_angle_d 3275 12.667 ? ? ? # loop_ _refine_ls_restr_ncs.pdbx_ordinal _refine_ls_restr_ncs.pdbx_refine_id _refine_ls_restr_ncs.pdbx_ens_id _refine_ls_restr_ncs.dom_id _refine_ls_restr_ncs.pdbx_type _refine_ls_restr_ncs.pdbx_auth_asym_id _refine_ls_restr_ncs.pdbx_number _refine_ls_restr_ncs.pdbx_rms _refine_ls_restr_ncs.weight_position _refine_ls_restr_ncs.ncs_model_details _refine_ls_restr_ncs.rms_dev_position _refine_ls_restr_ncs.rms_dev_B_iso _refine_ls_restr_ncs.weight_B_iso 1 'X-RAY DIFFRACTION' 1 1 TORSIONAL A 5017 6.880 ? ? ? ? ? 2 'X-RAY DIFFRACTION' 1 2 TORSIONAL B 5017 6.880 ? ? ? ? ? # loop_ _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.percent_reflns_obs _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_all _refine_ls_shell.R_factor_R_work _refine_ls_shell.R_factor_R_free _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.number_reflns_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.pdbx_refine_id _refine_ls_shell.R_factor_obs 2.8000 2.8700 14 70.0000 2309 . 0.3718 0.4102 . 104 . 2413 . 'X-RAY DIFFRACTION' . 2.8700 2.9475 14 85.0000 2785 . 0.3714 0.3965 . 126 . 2911 . 'X-RAY DIFFRACTION' . 2.9475 3.0341 14 93.0000 3032 . 0.3487 0.4161 . 138 . 3170 . 'X-RAY DIFFRACTION' . 3.0341 3.1319 14 97.0000 3210 . 0.3303 0.3341 . 145 . 3355 . 'X-RAY DIFFRACTION' . 3.1319 3.2436 14 98.0000 3162 . 0.2948 0.3793 . 144 . 3306 . 'X-RAY DIFFRACTION' . 3.2436 3.3733 14 98.0000 3217 . 0.2806 0.3281 . 145 . 3362 . 'X-RAY DIFFRACTION' . 3.3733 3.5265 14 98.0000 3249 . 0.2721 0.3397 . 148 . 3397 . 'X-RAY DIFFRACTION' . 3.5265 3.7119 14 98.0000 3236 . 0.2413 0.2978 . 147 . 3383 . 'X-RAY DIFFRACTION' . 3.7119 3.9438 14 97.0000 3191 . 0.2352 0.2873 . 144 . 3335 . 'X-RAY DIFFRACTION' . 3.9438 4.2472 14 96.0000 3202 . 0.2117 0.3068 . 145 . 3347 . 'X-RAY DIFFRACTION' . 4.2472 4.6726 14 96.0000 3220 . 0.1864 0.2192 . 145 . 3365 . 'X-RAY DIFFRACTION' . 4.6726 5.3441 14 96.0000 3222 . 0.1698 0.2123 . 148 . 3370 . 'X-RAY DIFFRACTION' . 5.3441 6.7153 14 96.0000 3242 . 0.2053 0.2389 . 147 . 3389 . 'X-RAY DIFFRACTION' . 6.7153 26.7619 14 93.0000 3304 . 0.1781 0.2244 . 149 . 3453 . 'X-RAY DIFFRACTION' . # loop_ _struct_ncs_dom.pdbx_ens_id _struct_ncs_dom.id _struct_ncs_dom.details 1 1 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; 1 2 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; # loop_ _struct_ncs_dom_lim.pdbx_ens_id _struct_ncs_dom_lim.dom_id _struct_ncs_dom_lim.pdbx_component_id _struct_ncs_dom_lim.pdbx_refine_code _struct_ncs_dom_lim.beg_auth_asym_id _struct_ncs_dom_lim.beg_auth_seq_id _struct_ncs_dom_lim.end_auth_asym_id _struct_ncs_dom_lim.end_auth_seq_id _struct_ncs_dom_lim.selection_details _struct_ncs_dom_lim.beg_label_asym_id _struct_ncs_dom_lim.beg_label_comp_id _struct_ncs_dom_lim.beg_label_seq_id _struct_ncs_dom_lim.beg_label_alt_id _struct_ncs_dom_lim.end_label_asym_id _struct_ncs_dom_lim.end_label_comp_id _struct_ncs_dom_lim.end_label_seq_id _struct_ncs_dom_lim.end_label_alt_id 1 1 1 ? A 83 A 95 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 2 ? A 96 A 96 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 3 ? A 83 A 611 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 4 ? A 83 A 611 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 5 ? A 83 A 611 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 6 ? A 83 A 611 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 7 ? A 83 A 611 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 8 ? A 83 A 611 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 9 ? A 83 A 611 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 1 10 ? A 83 A 611 ;(chain A and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 1 ? B 83 B 95 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 2 ? B 96 B 96 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 3 ? B 82 B 611 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 4 ? B 82 B 611 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 5 ? B 82 B 611 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 6 ? B 82 B 611 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 7 ? B 82 B 611 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 8 ? B 82 B 611 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 9 ? B 82 B 611 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? 1 2 10 ? B 82 B 611 ;(chain B and (resseq 83:95 or (resid 96 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 97:177 or (resid 178 and (name N or name CA or name C or name O or name CB or name CG or name CD2)) or resseq 179:186 or resseq 188:219 or (resid 220 and (name N or name CA or name C or name O or name CB or name CG or name OD1)) or resseq 221:228 or resseq 230:338 or resseq 340:355 or resseq 357:439 or (resid 440 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 441:494 or (resid 495 and (name N or name CA or name C or name O or name CB or name CG or name CD2 or name CE2 or name CZ or name OH )) or resseq 496:503 or (resid 504 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ or name OH )) or resseq 505:560 or resseq 562 or (resid 563 and (name N or name CA or name C or name O or name CB or name CG or name OD2)) or resseq 564:571 or (resid 572 and (name N or name CA or name C or name O or name CB or name CG or name CD1 or name CE1 or name CZ )) or resseq 573:611 or resseq 701:703 or resseq 706:707)) ; ? ? ? ? ? ? ? ? # _struct_ncs_ens.id 1 _struct_ncs_ens.details ? # _struct.entry_id 5JG8 _struct.title 'Crystal structure of human acid sphingomyelinase' _struct.pdbx_descriptor 'Sphingomyelin phosphodiesterase (E.C.3.1.4.12)' _struct.pdbx_model_details ? _struct.pdbx_formula_weight ? _struct.pdbx_formula_weight_method ? _struct.pdbx_model_type_details ? _struct.pdbx_CASP_flag N # _struct_keywords.entry_id 5JG8 _struct_keywords.text 'Lysosomal hydrolase, Neimann-Pick disease, Sphingolipid, Saposin, HYDROLASE' _struct_keywords.pdbx_keywords HYDROLASE # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 1 ? C N N 2 ? D N N 2 ? E N N 3 ? F N N 4 ? G N N 4 ? H N N 4 ? I N N 4 ? J N N 4 ? K N N 4 ? L N N 4 ? M N N 4 ? N N N 4 ? O N N 2 ? P N N 2 ? Q N N 3 ? R N N 4 ? S N N 4 ? T N N 4 ? U N N 4 ? V N N 5 ? W N N 4 ? X N N 4 ? Y N N 5 ? Z N N 4 ? AA N N 4 ? BA N N 4 ? CA N N 4 ? # 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 GLY A 40 ? ASN A 43 ? GLY A 83 ASN A 86 5 ? 4 HELX_P HELX_P2 AA2 LEU A 44 ? LYS A 61 ? LEU A 87 LYS A 104 1 ? 18 HELX_P HELX_P3 AA3 LYS A 62 ? LYS A 81 ? LYS A 105 LYS A 124 1 ? 20 HELX_P HELX_P4 AA4 PRO A 84 ? SER A 106 ? PRO A 127 SER A 149 1 ? 23 HELX_P HELX_P5 AA5 GLU A 112 ? LEU A 118 ? GLU A 155 LEU A 161 1 ? 7 HELX_P HELX_P6 AA6 PRO A 210 ? GLY A 220 ? PRO A 253 GLY A 263 1 ? 11 HELX_P HELX_P7 AA7 THR A 245 ? GLY A 265 ? THR A 288 GLY A 308 1 ? 21 HELX_P HELX_P8 AA8 SER A 295 ? MET A 302 ? SER A 338 MET A 345 1 ? 8 HELX_P HELX_P9 AA9 PRO A 311 ? GLY A 321 ? PRO A 354 GLY A 364 1 ? 11 HELX_P HELX_P10 AB1 ASN A 338 ? SER A 343 ? ASN A 381 SER A 386 5 ? 6 HELX_P HELX_P11 AB2 ASN A 346 ? ILE A 351 ? ASN A 389 ILE A 394 5 ? 6 HELX_P HELX_P12 AB3 ASP A 355 ? ALA A 357 ? ASP A 398 ALA A 400 5 ? 3 HELX_P HELX_P13 AB4 GLY A 358 ? ASP A 372 ? GLY A 401 ASP A 415 1 ? 15 HELX_P HELX_P14 AB5 ARG A 373 ? ASP A 375 ? ARG A 416 ASP A 418 5 ? 3 HELX_P HELX_P15 AB6 LYS A 390 ? TYR A 403 ? LYS A 433 TYR A 446 1 ? 14 HELX_P HELX_P16 AB7 ASN A 477 ? ASN A 482 ? ASN A 520 ASN A 525 1 ? 6 HELX_P HELX_P17 AB8 ARG A 495 ? GLY A 501 ? ARG A 538 GLY A 544 1 ? 7 HELX_P HELX_P18 AB9 LEU A 506 ? ASP A 520 ? LEU A 549 ASP A 563 1 ? 15 HELX_P HELX_P19 AC1 ASP A 520 ? HIS A 532 ? ASP A 563 HIS A 575 1 ? 13 HELX_P HELX_P20 AC2 GLY A 542 ? SER A 555 ? GLY A 585 SER A 598 1 ? 14 HELX_P HELX_P21 AC3 SER A 560 ? ARG A 565 ? SER A 603 ARG A 608 5 ? 6 HELX_P HELX_P22 AC4 GLY B 40 ? ASN B 43 ? GLY B 83 ASN B 86 5 ? 4 HELX_P HELX_P23 AC5 LEU B 44 ? LYS B 61 ? LEU B 87 LYS B 104 1 ? 18 HELX_P HELX_P24 AC6 LYS B 62 ? LYS B 81 ? LYS B 105 LYS B 124 1 ? 20 HELX_P HELX_P25 AC7 PRO B 84 ? SER B 106 ? PRO B 127 SER B 149 1 ? 23 HELX_P HELX_P26 AC8 GLU B 112 ? LEU B 118 ? GLU B 155 LEU B 161 1 ? 7 HELX_P HELX_P27 AC9 PRO B 210 ? GLY B 220 ? PRO B 253 GLY B 263 1 ? 11 HELX_P HELX_P28 AD1 THR B 245 ? GLY B 265 ? THR B 288 GLY B 308 1 ? 21 HELX_P HELX_P29 AD2 SER B 295 ? MET B 302 ? SER B 338 MET B 345 1 ? 8 HELX_P HELX_P30 AD3 PRO B 311 ? GLY B 321 ? PRO B 354 GLY B 364 1 ? 11 HELX_P HELX_P31 AD4 ASN B 338 ? SER B 343 ? ASN B 381 SER B 386 5 ? 6 HELX_P HELX_P32 AD5 ASN B 346 ? ILE B 351 ? ASN B 389 ILE B 394 5 ? 6 HELX_P HELX_P33 AD6 ASP B 355 ? ALA B 357 ? ASP B 398 ALA B 400 5 ? 3 HELX_P HELX_P34 AD7 GLY B 358 ? GLY B 374 ? GLY B 401 GLY B 417 1 ? 17 HELX_P HELX_P35 AD8 LYS B 390 ? TYR B 403 ? LYS B 433 TYR B 446 1 ? 14 HELX_P HELX_P36 AD9 ASN B 477 ? ASN B 482 ? ASN B 520 ASN B 525 1 ? 6 HELX_P HELX_P37 AE1 ARG B 495 ? GLY B 501 ? ARG B 538 GLY B 544 1 ? 7 HELX_P HELX_P38 AE2 LEU B 506 ? ASP B 520 ? LEU B 549 ASP B 563 1 ? 15 HELX_P HELX_P39 AE3 ASP B 520 ? HIS B 532 ? ASP B 563 HIS B 575 1 ? 13 HELX_P HELX_P40 AE4 GLY B 542 ? SER B 555 ? GLY B 585 SER B 598 1 ? 14 HELX_P HELX_P41 AE5 SER B 560 ? MET B 568 ? SER B 603 MET B 611 5 ? 9 # _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 46 SG ? ? ? 1_555 A CYS 122 SG ? ? A CYS 89 A CYS 165 1_555 ? ? ? ? ? ? ? 2.034 ? disulf2 disulf ? ? A CYS 49 SG ? ? ? 1_555 A CYS 114 SG ? ? A CYS 92 A CYS 157 1_555 ? ? ? ? ? ? ? 2.034 ? disulf3 disulf ? ? A CYS 77 SG ? ? ? 1_555 A CYS 88 SG ? ? A CYS 120 A CYS 131 1_555 ? ? ? ? ? ? ? 2.039 ? disulf4 disulf ? ? A CYS 178 SG ? ? ? 1_555 A CYS 183 SG ? ? A CYS 221 A CYS 226 1_555 ? ? ? ? ? ? ? 2.036 ? disulf5 disulf ? ? A CYS 184 SG ? ? ? 1_555 A CYS 207 SG ? ? A CYS 227 A CYS 250 1_555 ? ? ? ? ? ? ? 2.019 ? disulf6 disulf ? ? A CYS 342 SG ? ? ? 1_555 A CYS 388 SG ? ? A CYS 385 A CYS 431 1_555 ? ? ? ? ? ? ? 2.026 ? disulf7 disulf ? ? A CYS 541 SG ? ? ? 1_555 A CYS 545 SG ? ? A CYS 584 A CYS 588 1_555 ? ? ? ? ? ? ? 2.036 ? disulf8 disulf ? ? A CYS 551 SG ? ? ? 1_555 A CYS 564 SG ? ? A CYS 594 A CYS 607 1_555 ? ? ? ? ? ? ? 2.029 ? disulf9 disulf ? ? B CYS 46 SG ? ? ? 1_555 B CYS 122 SG ? ? B CYS 89 B CYS 165 1_555 ? ? ? ? ? ? ? 2.032 ? disulf10 disulf ? ? B CYS 49 SG ? ? ? 1_555 B CYS 114 SG ? ? B CYS 92 B CYS 157 1_555 ? ? ? ? ? ? ? 2.036 ? disulf11 disulf ? ? B CYS 77 SG ? ? ? 1_555 B CYS 88 SG ? ? B CYS 120 B CYS 131 1_555 ? ? ? ? ? ? ? 2.037 ? disulf12 disulf ? ? B CYS 178 SG ? ? ? 1_555 B CYS 183 SG ? ? B CYS 221 B CYS 226 1_555 ? ? ? ? ? ? ? 2.038 ? disulf13 disulf ? ? B CYS 184 SG ? ? ? 1_555 B CYS 207 SG ? ? B CYS 227 B CYS 250 1_555 ? ? ? ? ? ? ? 2.030 ? disulf14 disulf ? ? B CYS 342 SG ? ? ? 1_555 B CYS 388 SG ? ? B CYS 385 B CYS 431 1_555 ? ? ? ? ? ? ? 2.023 ? disulf15 disulf ? ? B CYS 541 SG ? ? ? 1_555 B CYS 545 SG ? ? B CYS 584 B CYS 588 1_555 ? ? ? ? ? ? ? 2.037 ? disulf16 disulf ? ? B CYS 551 SG ? ? ? 1_555 B CYS 564 SG ? ? B CYS 594 B CYS 607 1_555 ? ? ? ? ? ? ? 2.033 ? covale1 covale one ? A ASN 43 ND2 ? ? ? 1_555 F NAG . C1 ? ? A ASN 86 A NAG 704 1_555 ? ? ? ? ? ? ? 1.437 ? covale2 covale one ? A ASN 132 ND2 ? ? ? 1_555 G NAG . C1 ? ? A ASN 175 A NAG 705 1_555 ? ? ? ? ? ? ? 1.449 ? metalc1 metalc ? ? A ASP 163 OD2 ? ? ? 1_555 C ZN . ZN ? ? A ASP 206 A ZN 701 1_555 ? ? ? ? ? ? ? 1.763 ? metalc2 metalc ? ? A HIS 165 NE2 ? ? ? 1_555 C ZN . ZN ? ? A HIS 208 A ZN 701 1_555 ? ? ? ? ? ? ? 2.034 ? metalc3 metalc ? ? A ASP 235 OD1 ? ? ? 1_555 D ZN . ZN ? ? A ASP 278 A ZN 702 1_555 ? ? ? ? ? ? ? 2.581 ? metalc4 metalc ? ? A ASP 235 OD2 ? ? ? 1_555 C ZN . ZN ? ? A ASP 278 A ZN 701 1_555 ? ? ? ? ? ? ? 1.989 ? metalc5 metalc ? ? A ASP 235 OD2 ? ? ? 1_555 D ZN . ZN ? ? A ASP 278 A ZN 702 1_555 ? ? ? ? ? ? ? 1.878 ? metalc6 metalc ? ? A ASN 275 OD1 ? ? ? 1_555 D ZN . ZN ? ? A ASN 318 A ZN 702 1_555 ? ? ? ? ? ? ? 1.795 ? covale3 covale one ? A ASN 292 ND2 ? ? ? 1_555 L NAG . C1 ? ? A ASN 335 A NAG 710 1_555 ? ? ? ? ? ? ? 1.443 ? covale4 covale one ? A ASN 352 ND2 ? ? ? 1_555 N NAG . C1 ? ? A ASN 395 A NAG 712 1_555 ? ? ? ? ? ? ? 1.440 ? metalc7 metalc ? ? A HIS 382 NE2 ? ? ? 1_555 D ZN . ZN ? ? A HIS 425 A ZN 702 1_555 ? ? ? ? ? ? ? 1.805 ? metalc8 metalc ? ? A HIS 414 ND1 ? ? ? 1_555 D ZN . ZN ? ? A HIS 457 A ZN 702 1_555 ? ? ? ? ? ? ? 2.507 ? metalc9 metalc ? ? A HIS 416 NE2 ? ? ? 1_555 C ZN . ZN ? ? A HIS 459 A ZN 701 1_555 ? ? ? ? ? ? ? 1.920 ? covale5 covale one ? A ASN 460 ND2 ? ? ? 1_555 J NAG . C1 ? ? A ASN 503 A NAG 708 1_555 ? ? ? ? ? ? ? 1.445 ? covale6 covale one ? A ASN 477 ND2 ? ? ? 1_555 H NAG . C1 ? ? A ASN 520 A NAG 706 1_555 ? ? ? ? ? ? ? 1.445 ? covale7 covale one ? B ASN 43 ND2 ? ? ? 1_555 R NAG . C1 ? ? B ASN 86 B NAG 704 1_555 ? ? ? ? ? ? ? 1.444 ? covale8 covale one ? B ASN 132 ND2 ? ? ? 1_555 S NAG . C1 ? ? B ASN 175 B NAG 705 1_555 ? ? ? ? ? ? ? 1.443 ? metalc10 metalc ? ? B ASP 163 OD2 ? ? ? 1_555 O ZN . ZN ? ? B ASP 206 B ZN 701 1_555 ? ? ? ? ? ? ? 1.735 ? metalc11 metalc ? ? B HIS 165 NE2 ? ? ? 1_555 O ZN . ZN ? ? B HIS 208 B ZN 701 1_555 ? ? ? ? ? ? ? 2.129 ? metalc12 metalc ? ? B ASP 235 OD2 ? ? ? 1_555 P ZN . ZN ? ? B ASP 278 B ZN 702 1_555 ? ? ? ? ? ? ? 1.768 ? metalc13 metalc ? ? B ASP 235 OD2 ? ? ? 1_555 O ZN . ZN ? ? B ASP 278 B ZN 701 1_555 ? ? ? ? ? ? ? 2.225 ? metalc14 metalc ? ? B ASN 275 OD1 ? ? ? 1_555 P ZN . ZN ? ? B ASN 318 B ZN 702 1_555 ? ? ? ? ? ? ? 1.986 ? covale9 covale one ? B ASN 292 ND2 ? ? ? 1_555 W NAG . C1 ? ? B ASN 335 B NAG 709 1_555 ? ? ? ? ? ? ? 1.442 ? covale10 covale one ? B ASN 352 ND2 ? ? ? 1_555 Z NAG . C1 ? ? B ASN 395 B NAG 712 1_555 ? ? ? ? ? ? ? 1.443 ? metalc15 metalc ? ? B HIS 382 NE2 ? ? ? 1_555 P ZN . ZN ? ? B HIS 425 B ZN 702 1_555 ? ? ? ? ? ? ? 1.805 ? metalc16 metalc ? ? B HIS 414 ND1 ? ? ? 1_555 P ZN . ZN ? ? B HIS 457 B ZN 702 1_555 ? ? ? ? ? ? ? 2.355 ? metalc17 metalc ? ? B HIS 416 NE2 ? ? ? 1_555 O ZN . ZN ? ? B HIS 459 B ZN 701 1_555 ? ? ? ? ? ? ? 1.790 ? covale11 covale one ? B ASN 460 ND2 ? ? ? 1_555 BA NAG . C1 ? ? B ASN 503 B NAG 714 1_555 ? ? ? ? ? ? ? 1.441 ? covale12 covale one ? B ASN 477 ND2 ? ? ? 1_555 T NAG . C1 ? ? B ASN 520 B NAG 706 1_555 ? ? ? ? ? ? ? 1.446 ? metalc18 metalc ? ? C ZN . ZN ? ? ? 1_555 E ACT . O ? ? A ZN 701 A ACT 703 1_555 ? ? ? ? ? ? ? 2.122 ? metalc19 metalc ? ? D ZN . ZN ? ? ? 1_555 E ACT . O ? ? A ZN 702 A ACT 703 1_555 ? ? ? ? ? ? ? 2.526 ? covale13 covale both ? H NAG . O4 ? ? ? 1_555 I NAG . C1 ? ? A NAG 706 A NAG 707 1_555 ? ? ? ? ? ? ? 1.443 ? covale14 covale both ? J NAG . O4 ? ? ? 1_555 K NAG . C1 ? ? A NAG 708 A NAG 709 1_555 ? ? ? ? ? ? ? 1.446 ? covale15 covale one ? L NAG . O3 ? ? ? 1_555 M NAG . C1 ? ? A NAG 710 A NAG 711 1_555 ? ? ? ? ? ? ? 1.445 ? metalc20 metalc ? ? O ZN . ZN ? ? ? 1_555 Q ACT . OXT ? ? B ZN 701 B ACT 703 1_555 ? ? ? ? ? ? ? 1.941 ? metalc21 metalc ? ? P ZN . ZN ? ? ? 1_555 Q ACT . OXT ? ? B ZN 702 B ACT 703 1_555 ? ? ? ? ? ? ? 1.958 ? covale16 covale both ? T NAG . O4 ? ? ? 1_555 U NAG . C1 ? ? B NAG 706 B NAG 707 1_555 ? ? ? ? ? ? ? 1.440 ? covale17 covale both ? U NAG . O4 ? ? ? 1_555 V MAN . C1 ? ? B NAG 707 B MAN 708 1_555 ? ? ? ? ? ? ? 1.440 ? covale18 covale both ? W NAG . O4 ? ? ? 1_555 X NAG . C1 ? ? B NAG 709 B NAG 710 1_555 ? ? ? ? ? ? ? 1.444 ? covale19 covale both ? X NAG . O4 ? ? ? 1_555 Y MAN . C1 ? ? B NAG 710 B MAN 711 1_555 ? ? ? ? ? ? ? 1.451 ? covale20 covale both ? Z NAG . O4 ? ? ? 1_555 AA NAG . C1 ? ? B NAG 712 B NAG 713 1_555 ? ? ? ? ? ? ? 1.444 ? covale21 covale both ? BA NAG . O4 ? ? ? 1_555 CA NAG . C1 ? ? B NAG 714 B NAG 715 1_555 ? ? ? ? ? ? ? 1.446 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 ILE 82 A . ? ILE 125 A ALA 83 A ? ALA 126 A 1 26.70 2 PRO 110 A . ? PRO 153 A SER 111 A ? SER 154 A 1 -13.97 3 SER 111 A . ? SER 154 A GLU 112 A ? GLU 155 A 1 -7.20 4 PRO 223 A . ? PRO 266 A ALA 224 A ? ALA 267 A 1 1.78 5 ALA 224 A . ? ALA 267 A GLY 225 A ? GLY 268 A 1 -9.84 6 GLY 225 A . ? GLY 268 A PRO 226 A ? PRO 269 A 1 -13.16 7 THR 279 A . ? THR 322 A PRO 280 A ? PRO 323 A 1 -0.53 8 GLY 291 A . ? GLY 334 A ASN 292 A ? ASN 335 A 1 9.33 9 ILE 82 B . ? ILE 125 B ALA 83 B ? ALA 126 B 1 27.57 10 PRO 110 B . ? PRO 153 B SER 111 B ? SER 154 B 1 -6.46 11 SER 111 B . ? SER 154 B GLU 112 B ? GLU 155 B 1 -3.19 12 PRO 223 B . ? PRO 266 B ALA 224 B ? ALA 267 B 1 8.09 13 ALA 224 B . ? ALA 267 B GLY 225 B ? GLY 268 B 1 -10.19 14 THR 279 B . ? THR 322 B PRO 280 B ? PRO 323 B 1 -1.59 15 GLY 291 B . ? GLY 334 B ASN 292 B ? ASN 335 B 1 9.69 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 6 ? AA2 ? 6 ? AA3 ? 6 ? AA4 ? 6 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense AA1 1 2 ? parallel AA1 2 3 ? parallel AA1 3 4 ? anti-parallel AA1 4 5 ? anti-parallel AA1 5 6 ? anti-parallel AA2 1 2 ? anti-parallel AA2 2 3 ? parallel AA2 3 4 ? parallel AA2 4 5 ? parallel AA2 5 6 ? anti-parallel AA3 1 2 ? parallel AA3 2 3 ? parallel AA3 3 4 ? anti-parallel AA3 4 5 ? anti-parallel AA3 5 6 ? anti-parallel AA4 1 2 ? anti-parallel AA4 2 3 ? parallel AA4 3 4 ? parallel AA4 4 5 ? parallel AA4 5 6 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id AA1 1 VAL A 269 ? PRO A 271 ? VAL A 312 PRO A 314 AA1 2 MET A 229 ? TRP A 232 ? MET A 272 TRP A 275 AA1 3 VAL A 155 ? LEU A 161 ? VAL A 198 LEU A 204 AA1 4 GLY A 451 ? ASP A 458 ? GLY A 494 ASP A 501 AA1 5 VAL A 468 ? LEU A 476 ? VAL A 511 LEU A 519 AA1 6 TRP A 490 ? GLN A 491 ? TRP A 533 GLN A 534 AA2 1 TYR A 324 ? LEU A 326 ? TYR A 367 LEU A 369 AA2 2 LEU A 332 ? SER A 336 ? LEU A 375 SER A 379 AA2 3 LYS A 376 ? GLY A 381 ? LYS A 419 GLY A 424 AA2 4 LEU A 407 ? HIS A 416 ? LEU A 450 HIS A 459 AA2 5 PRO A 432 ? PRO A 440 ? PRO A 475 PRO A 483 AA2 6 GLU A 419 ? TYR A 424 ? GLU A 462 TYR A 467 AA3 1 VAL B 269 ? PRO B 271 ? VAL B 312 PRO B 314 AA3 2 MET B 229 ? TRP B 232 ? MET B 272 TRP B 275 AA3 3 VAL B 155 ? LEU B 161 ? VAL B 198 LEU B 204 AA3 4 GLY B 451 ? ASP B 458 ? GLY B 494 ASP B 501 AA3 5 VAL B 468 ? LEU B 476 ? VAL B 511 LEU B 519 AA3 6 TRP B 490 ? GLN B 491 ? TRP B 533 GLN B 534 AA4 1 TYR B 324 ? LEU B 326 ? TYR B 367 LEU B 369 AA4 2 LEU B 332 ? SER B 336 ? LEU B 375 SER B 379 AA4 3 LYS B 376 ? GLY B 381 ? LYS B 419 GLY B 424 AA4 4 LEU B 407 ? HIS B 416 ? LEU B 450 HIS B 459 AA4 5 PRO B 432 ? PRO B 440 ? PRO B 475 PRO B 483 AA4 6 GLU B 419 ? TYR B 424 ? GLU B 462 TYR B 467 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id AA1 1 2 O TYR A 270 ? O TYR A 313 N VAL A 230 ? N VAL A 273 AA1 2 3 O TYR A 231 ? O TYR A 274 N LEU A 159 ? N LEU A 202 AA1 3 4 N SER A 156 ? N SER A 199 O ILE A 457 ? O ILE A 500 AA1 4 5 N GLN A 456 ? N GLN A 499 O LEU A 469 ? O LEU A 512 AA1 5 6 N ILE A 475 ? N ILE A 518 O GLN A 491 ? O GLN A 534 AA2 1 2 N TYR A 324 ? N TYR A 367 O SER A 336 ? O SER A 379 AA2 2 3 N ILE A 335 ? N ILE A 378 O HIS A 378 ? O HIS A 421 AA2 3 4 N ILE A 379 ? N ILE A 422 O PHE A 411 ? O PHE A 454 AA2 4 5 N GLN A 410 ? N GLN A 453 O PHE A 437 ? O PHE A 480 AA2 5 6 O ALA A 434 ? O ALA A 477 N PHE A 423 ? N PHE A 466 AA3 1 2 O TYR B 270 ? O TYR B 313 N VAL B 230 ? N VAL B 273 AA3 2 3 O TYR B 231 ? O TYR B 274 N LEU B 161 ? N LEU B 204 AA3 3 4 N PHE B 160 ? N PHE B 203 O ARG B 453 ? O ARG B 496 AA3 4 5 N GLN B 456 ? N GLN B 499 O LEU B 469 ? O LEU B 512 AA3 5 6 N ILE B 475 ? N ILE B 518 O GLN B 491 ? O GLN B 534 AA4 1 2 N TYR B 324 ? N TYR B 367 O SER B 336 ? O SER B 379 AA4 2 3 N ILE B 335 ? N ILE B 378 O HIS B 378 ? O HIS B 421 AA4 3 4 N ILE B 379 ? N ILE B 422 O PHE B 411 ? O PHE B 454 AA4 4 5 N PHE B 412 ? N PHE B 455 O PHE B 437 ? O PHE B 480 AA4 5 6 O ALA B 434 ? O ALA B 477 N PHE B 423 ? N PHE B 466 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software A ZN 701 ? 6 'binding site for residue ZN A 701' AC2 Software A ZN 702 ? 7 'binding site for residue ZN A 702' AC3 Software A ACT 703 ? 8 'binding site for residue ACT A 703' AC4 Software B ZN 701 ? 6 'binding site for residue ZN B 701' AC5 Software B ZN 702 ? 7 'binding site for residue ZN B 702' AC6 Software B ACT 703 ? 9 'binding site for residue ACT B 703' AC7 Software A NAG 704 ? 2 'binding site for Mono-Saccharide NAG A 704 bound to ASN A 86' AC8 Software A NAG 705 ? 4 'binding site for Mono-Saccharide NAG A 705 bound to ASN A 175' AC9 Software A ASN 335 ? 3 'binding site for Poly-Saccharide residues NAG A 710 through NAG A 711 bound to ASN A 335' AD1 Software A NAG 712 ? 1 'binding site for Mono-Saccharide NAG A 712 bound to ASN A 395' AD2 Software A ASN 503 ? 3 'binding site for Poly-Saccharide residues NAG A 708 through NAG A 709 bound to ASN A 503' AD3 Software A ASN 520 ? 3 'binding site for Poly-Saccharide residues NAG A 706 through NAG A 707 bound to ASN A 520' AD4 Software B NAG 704 ? 3 'binding site for Mono-Saccharide NAG B 704 bound to ASN B 86' AD5 Software B NAG 705 ? 1 'binding site for Mono-Saccharide NAG B 705 bound to ASN B 175' AD6 Software B ASN 335 ? 4 'binding site for Poly-Saccharide residues NAG B 709 through MAN B 711 bound to ASN B 335' AD7 Software B ASN 395 ? 1 'binding site for Poly-Saccharide residues NAG B 712 through NAG B 713 bound to ASN B 395' AD8 Software B ASN 503 ? 2 'binding site for Poly-Saccharide residues NAG B 714 through NAG B 715 bound to ASN B 503' AD9 Software B ASN 520 ? 5 'binding site for Poly-Saccharide residues NAG B 706 through MAN B 708 bound to ASN B 520' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 6 ASP A 163 ? ASP A 206 . ? 1_555 ? 2 AC1 6 HIS A 165 ? HIS A 208 . ? 1_555 ? 3 AC1 6 ASP A 235 ? ASP A 278 . ? 1_555 ? 4 AC1 6 HIS A 416 ? HIS A 459 . ? 1_555 ? 5 AC1 6 ZN D . ? ZN A 702 . ? 1_555 ? 6 AC1 6 ACT E . ? ACT A 703 . ? 1_555 ? 7 AC2 7 ASP A 163 ? ASP A 206 . ? 1_555 ? 8 AC2 7 ASP A 235 ? ASP A 278 . ? 1_555 ? 9 AC2 7 ASN A 275 ? ASN A 318 . ? 1_555 ? 10 AC2 7 HIS A 382 ? HIS A 425 . ? 1_555 ? 11 AC2 7 HIS A 414 ? HIS A 457 . ? 1_555 ? 12 AC2 7 ZN C . ? ZN A 701 . ? 1_555 ? 13 AC2 7 ACT E . ? ACT A 703 . ? 1_555 ? 14 AC3 8 ASP A 163 ? ASP A 206 . ? 1_555 ? 15 AC3 8 ASP A 235 ? ASP A 278 . ? 1_555 ? 16 AC3 8 ASN A 275 ? ASN A 318 . ? 1_555 ? 17 AC3 8 HIS A 276 ? HIS A 319 . ? 1_555 ? 18 AC3 8 HIS A 414 ? HIS A 457 . ? 1_555 ? 19 AC3 8 HIS A 416 ? HIS A 459 . ? 1_555 ? 20 AC3 8 ZN C . ? ZN A 701 . ? 1_555 ? 21 AC3 8 ZN D . ? ZN A 702 . ? 1_555 ? 22 AC4 6 ASP B 163 ? ASP B 206 . ? 1_555 ? 23 AC4 6 HIS B 165 ? HIS B 208 . ? 1_555 ? 24 AC4 6 ASP B 235 ? ASP B 278 . ? 1_555 ? 25 AC4 6 HIS B 416 ? HIS B 459 . ? 1_555 ? 26 AC4 6 ZN P . ? ZN B 702 . ? 1_555 ? 27 AC4 6 ACT Q . ? ACT B 703 . ? 1_555 ? 28 AC5 7 ASP B 163 ? ASP B 206 . ? 1_555 ? 29 AC5 7 ASP B 235 ? ASP B 278 . ? 1_555 ? 30 AC5 7 ASN B 275 ? ASN B 318 . ? 1_555 ? 31 AC5 7 HIS B 382 ? HIS B 425 . ? 1_555 ? 32 AC5 7 HIS B 414 ? HIS B 457 . ? 1_555 ? 33 AC5 7 ZN O . ? ZN B 701 . ? 1_555 ? 34 AC5 7 ACT Q . ? ACT B 703 . ? 1_555 ? 35 AC6 9 ASP B 163 ? ASP B 206 . ? 1_555 ? 36 AC6 9 HIS B 165 ? HIS B 208 . ? 1_555 ? 37 AC6 9 ASP B 235 ? ASP B 278 . ? 1_555 ? 38 AC6 9 HIS B 239 ? HIS B 282 . ? 1_555 ? 39 AC6 9 ASN B 275 ? ASN B 318 . ? 1_555 ? 40 AC6 9 HIS B 414 ? HIS B 457 . ? 1_555 ? 41 AC6 9 HIS B 416 ? HIS B 459 . ? 1_555 ? 42 AC6 9 ZN O . ? ZN B 701 . ? 1_555 ? 43 AC6 9 ZN P . ? ZN B 702 . ? 1_555 ? 44 AC7 2 ASN A 43 ? ASN A 86 . ? 1_555 ? 45 AC7 2 ILE B 82 ? ILE B 125 . ? 1_555 ? 46 AC8 4 SER A 130 ? SER A 173 . ? 1_555 ? 47 AC8 4 TRP A 131 ? TRP A 174 . ? 1_555 ? 48 AC8 4 ASN A 132 ? ASN A 175 . ? 1_555 ? 49 AC8 4 SER A 391 ? SER A 434 . ? 1_555 ? 50 AC9 3 ARG A 246 ? ARG A 289 . ? 1_555 ? 51 AC9 3 ASN A 292 ? ASN A 335 . ? 1_555 ? 52 AC9 3 HIS A 293 ? HIS A 336 . ? 1_555 ? 53 AD1 1 ASN A 352 ? ASN A 395 . ? 1_555 ? 54 AD2 3 PRO A 328 ? PRO A 371 . ? 1_555 ? 55 AD2 3 TYR A 329 ? TYR A 372 . ? 1_555 ? 56 AD2 3 ASN A 460 ? ASN A 503 . ? 1_555 ? 57 AD3 3 ASN A 477 ? ASN A 520 . ? 1_555 ? 58 AD3 3 GLN A 480 ? GLN A 523 . ? 1_555 ? 59 AD3 3 GLN A 491 ? GLN A 534 . ? 1_555 ? 60 AD4 3 ILE A 82 ? ILE A 125 . ? 1_555 ? 61 AD4 3 PHE B 39 ? PHE B 82 . ? 1_555 ? 62 AD4 3 ASN B 43 ? ASN B 86 . ? 1_555 ? 63 AD5 1 ASN B 132 ? ASN B 175 . ? 1_555 ? 64 AD6 4 LEU B 94 ? LEU B 137 . ? 1_555 ? 65 AD6 4 THR B 245 ? THR B 288 . ? 1_555 ? 66 AD6 4 ARG B 246 ? ARG B 289 . ? 1_555 ? 67 AD6 4 ASN B 292 ? ASN B 335 . ? 1_555 ? 68 AD7 1 ASN B 352 ? ASN B 395 . ? 1_555 ? 69 AD8 2 TYR B 329 ? TYR B 372 . ? 1_555 ? 70 AD8 2 ASN B 460 ? ASN B 503 . ? 1_555 ? 71 AD9 5 ARG A 516 ? ARG A 559 . ? 2_565 ? 72 AD9 5 ASN B 477 ? ASN B 520 . ? 1_555 ? 73 AD9 5 GLN B 480 ? GLN B 523 . ? 1_555 ? 74 AD9 5 GLN B 491 ? GLN B 534 . ? 1_555 ? 75 AD9 5 GLY B 534 ? GLY B 577 . ? 1_555 ? # _atom_sites.entry_id 5JG8 _atom_sites.fract_transf_matrix[1][1] 0.014382 _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] 0.006961 _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] 0.005165 _atom_sites.fract_transf_vector[1] 0.000000 _atom_sites.fract_transf_vector[2] 0.000000 _atom_sites.fract_transf_vector[3] 0.000000 # loop_ _atom_type.symbol AS C H N O S ZN # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . GLY A 1 40 ? 15.132 60.383 93.717 1.00 71.97 ? 83 GLY A N 1 ATOM 2 C CA . GLY A 1 40 ? 13.990 60.522 92.829 1.00 120.40 ? 83 GLY A CA 1 ATOM 3 C C . GLY A 1 40 ? 13.713 59.303 91.966 1.00 112.53 ? 83 GLY A C 1 ATOM 4 O O . GLY A 1 40 ? 14.595 58.472 91.749 1.00 99.73 ? 83 GLY A O 1 ATOM 5 N N . TRP A 1 41 ? 12.476 59.197 91.473 1.00 96.02 ? 84 TRP A N 1 ATOM 6 C CA . TRP A 1 41 ? 12.079 58.042 90.674 1.00 118.98 ? 84 TRP A CA 1 ATOM 7 C C . TRP A 1 41 ? 12.539 58.134 89.223 1.00 122.81 ? 84 TRP A C 1 ATOM 8 O O . TRP A 1 41 ? 12.707 57.098 88.568 1.00 114.56 ? 84 TRP A O 1 ATOM 9 C CB . TRP A 1 41 ? 10.561 57.859 90.711 1.00 132.53 ? 84 TRP A CB 1 ATOM 10 C CG . TRP A 1 41 ? 10.069 56.874 89.681 1.00 133.78 ? 84 TRP A CG 1 ATOM 11 C CD1 . TRP A 1 41 ? 10.189 55.513 89.723 1.00 119.96 ? 84 TRP A CD1 1 ATOM 12 C CD2 . TRP A 1 41 ? 9.392 57.178 88.453 1.00 127.53 ? 84 TRP A CD2 1 ATOM 13 N NE1 . TRP A 1 41 ? 9.625 54.952 88.602 1.00 111.19 ? 84 TRP A NE1 1 ATOM 14 C CE2 . TRP A 1 41 ? 9.128 55.952 87.807 1.00 128.52 ? 84 TRP A CE2 1 ATOM 15 C CE3 . TRP A 1 41 ? 8.980 58.366 87.840 1.00 120.49 ? 84 TRP A CE3 1 ATOM 16 C CZ2 . TRP A 1 41 ? 8.472 55.881 86.578 1.00 119.04 ? 84 TRP A CZ2 1 ATOM 17 C CZ3 . TRP A 1 41 ? 8.329 58.293 86.621 1.00 117.15 ? 84 TRP A CZ3 1 ATOM 18 C CH2 . TRP A 1 41 ? 8.082 57.060 86.003 1.00 107.90 ? 84 TRP A CH2 1 ATOM 19 N N . GLY A 1 42 ? 12.744 59.345 88.702 1.00 124.84 ? 85 GLY A N 1 ATOM 20 C CA . GLY A 1 42 ? 13.046 59.493 87.286 1.00 112.90 ? 85 GLY A CA 1 ATOM 21 C C . GLY A 1 42 ? 14.183 58.608 86.817 1.00 89.33 ? 85 GLY A C 1 ATOM 22 O O . GLY A 1 42 ? 14.252 58.249 85.639 1.00 90.41 ? 85 GLY A O 1 ATOM 23 N N . ASN A 1 43 ? 15.086 58.243 87.728 1.00 88.47 ? 86 ASN A N 1 ATOM 24 C CA . ASN A 1 43 ? 16.213 57.382 87.391 1.00 91.66 ? 86 ASN A CA 1 ATOM 25 C C . ASN A 1 43 ? 15.811 55.926 87.196 1.00 90.27 ? 86 ASN A C 1 ATOM 26 O O . ASN A 1 43 ? 16.571 55.164 86.588 1.00 77.32 ? 86 ASN A O 1 ATOM 27 C CB . ASN A 1 43 ? 17.271 57.474 88.487 1.00 116.41 ? 86 ASN A CB 1 ATOM 28 C CG . ASN A 1 43 ? 17.849 58.861 88.615 1.00 121.72 ? 86 ASN A CG 1 ATOM 29 O OD1 . ASN A 1 43 ? 17.597 59.570 89.589 1.00 127.65 ? 86 ASN A OD1 1 ATOM 30 N ND2 . ASN A 1 43 ? 18.632 59.256 87.623 1.00 129.40 ? 86 ASN A ND2 1 ATOM 31 N N . LEU A 1 44 ? 14.653 55.514 87.715 1.00 93.97 ? 87 LEU A N 1 ATOM 32 C CA . LEU A 1 44 ? 14.261 54.113 87.645 1.00 87.66 ? 87 LEU A CA 1 ATOM 33 C C . LEU A 1 44 ? 13.659 53.719 86.303 1.00 83.51 ? 87 LEU A C 1 ATOM 34 O O . LEU A 1 44 ? 13.701 52.536 85.947 1.00 87.01 ? 87 LEU A O 1 ATOM 35 C CB . LEU A 1 44 ? 13.248 53.799 88.747 1.00 79.37 ? 87 LEU A CB 1 ATOM 36 C CG . LEU A 1 44 ? 13.787 53.623 90.163 1.00 73.95 ? 87 LEU A CG 1 ATOM 37 C CD1 . LEU A 1 44 ? 12.708 53.023 91.048 1.00 75.15 ? 87 LEU A CD1 1 ATOM 38 C CD2 . LEU A 1 44 ? 15.041 52.763 90.165 1.00 55.34 ? 87 LEU A CD2 1 ATOM 39 N N . THR A 1 45 ? 13.109 54.677 85.553 1.00 85.39 ? 88 THR A N 1 ATOM 40 C CA . THR A 1 45 ? 12.405 54.347 84.317 1.00 87.44 ? 88 THR A CA 1 ATOM 41 C C . THR A 1 45 ? 13.261 53.483 83.397 1.00 77.14 ? 88 THR A C 1 ATOM 42 O O . THR A 1 45 ? 12.811 52.441 82.907 1.00 67.33 ? 88 THR A O 1 ATOM 43 C CB . THR A 1 45 ? 11.978 55.631 83.607 1.00 95.20 ? 88 THR A CB 1 ATOM 44 O OG1 . THR A 1 45 ? 13.123 56.472 83.415 1.00 96.40 ? 88 THR A OG1 1 ATOM 45 C CG2 . THR A 1 45 ? 10.942 56.374 84.438 1.00 90.55 ? 88 THR A CG2 1 ATOM 46 N N . CYS A 1 46 ? 14.509 53.899 83.160 1.00 79.18 ? 89 CYS A N 1 ATOM 47 C CA . CYS A 1 46 ? 15.392 53.141 82.275 1.00 73.67 ? 89 CYS A CA 1 ATOM 48 C C . CYS A 1 46 ? 15.647 51.730 82.785 1.00 67.74 ? 89 CYS A C 1 ATOM 49 O O . CYS A 1 46 ? 15.379 50.764 82.048 1.00 63.78 ? 89 CYS A O 1 ATOM 50 C CB . CYS A 1 46 ? 16.693 53.921 82.070 1.00 70.58 ? 89 CYS A CB 1 ATOM 51 S SG . CYS A 1 46 ? 17.923 53.090 81.029 1.00 123.36 ? 89 CYS A SG 1 ATOM 52 N N . PRO A 1 47 ? 16.163 51.531 84.002 1.00 72.57 ? 90 PRO A N 1 ATOM 53 C CA . PRO A 1 47 ? 16.383 50.155 84.477 1.00 67.41 ? 90 PRO A CA 1 ATOM 54 C C . PRO A 1 47 ? 15.128 49.304 84.459 1.00 63.38 ? 90 PRO A C 1 ATOM 55 O O . PRO A 1 47 ? 15.190 48.131 84.070 1.00 69.93 ? 90 PRO A O 1 ATOM 56 C CB . PRO A 1 47 ? 16.914 50.366 85.901 1.00 56.72 ? 90 PRO A CB 1 ATOM 57 C CG . PRO A 1 47 ? 17.556 51.712 85.855 1.00 61.60 ? 90 PRO A CG 1 ATOM 58 C CD . PRO A 1 47 ? 16.689 52.532 84.944 1.00 73.58 ? 90 PRO A CD 1 ATOM 59 N N . ILE A 1 48 ? 13.984 49.857 84.868 1.00 56.26 ? 91 ILE A N 1 ATOM 60 C CA . ILE A 1 48 ? 12.744 49.090 84.810 1.00 42.60 ? 91 ILE A CA 1 ATOM 61 C C . ILE A 1 48 ? 12.423 48.703 83.374 1.00 56.30 ? 91 ILE A C 1 ATOM 62 O O . ILE A 1 48 ? 11.896 47.616 83.113 1.00 73.97 ? 91 ILE A O 1 ATOM 63 C CB . ILE A 1 48 ? 11.589 49.873 85.457 1.00 60.37 ? 91 ILE A CB 1 ATOM 64 C CG1 . ILE A 1 48 ? 11.757 49.889 86.975 1.00 67.71 ? 91 ILE A CG1 1 ATOM 65 C CG2 . ILE A 1 48 ? 10.255 49.248 85.088 1.00 47.79 ? 91 ILE A CG2 1 ATOM 66 C CD1 . ILE A 1 48 ? 11.890 48.510 87.583 1.00 47.82 ? 91 ILE A CD1 1 ATOM 67 N N . CYS A 1 49 ? 12.729 49.584 82.419 1.00 67.13 ? 92 CYS A N 1 ATOM 68 C CA . CYS A 1 49 ? 12.501 49.248 81.017 1.00 59.60 ? 92 CYS A CA 1 ATOM 69 C C . CYS A 1 49 ? 13.392 48.088 80.585 1.00 59.34 ? 92 CYS A C 1 ATOM 70 O O . CYS A 1 49 ? 12.905 47.071 80.073 1.00 58.44 ? 92 CYS A O 1 ATOM 71 C CB . CYS A 1 49 ? 12.734 50.478 80.134 1.00 49.79 ? 92 CYS A CB 1 ATOM 72 S SG . CYS A 1 49 ? 12.355 50.211 78.381 1.00 84.60 ? 92 CYS A SG 1 ATOM 73 N N . LYS A 1 50 ? 14.705 48.218 80.799 1.00 43.42 ? 93 LYS A N 1 ATOM 74 C CA . LYS A 1 50 ? 15.631 47.174 80.370 1.00 44.76 ? 93 LYS A CA 1 ATOM 75 C C . LYS A 1 50 ? 15.281 45.831 81.000 1.00 57.80 ? 93 LYS A C 1 ATOM 76 O O . LYS A 1 50 ? 15.236 44.804 80.314 1.00 54.68 ? 93 LYS A O 1 ATOM 77 C CB . LYS A 1 50 ? 17.069 47.568 80.708 1.00 35.31 ? 93 LYS A CB 1 ATOM 78 C CG . LYS A 1 50 ? 17.629 48.672 79.837 1.00 72.47 ? 93 LYS A CG 1 ATOM 79 C CD . LYS A 1 50 ? 19.150 48.677 79.870 1.00 85.76 ? 93 LYS A CD 1 ATOM 80 C CE . LYS A 1 50 ? 19.718 49.654 78.852 1.00 82.55 ? 93 LYS A CE 1 ATOM 81 N NZ . LYS A 1 50 ? 21.205 49.602 78.800 1.00 87.22 1 93 LYS A NZ 1 ATOM 82 N N . GLY A 1 51 ? 15.032 45.816 82.309 1.00 60.49 ? 94 GLY A N 1 ATOM 83 C CA . GLY A 1 51 ? 14.597 44.582 82.943 1.00 59.41 ? 94 GLY A CA 1 ATOM 84 C C . GLY A 1 51 ? 13.301 44.060 82.354 1.00 67.25 ? 94 GLY A C 1 ATOM 85 O O . GLY A 1 51 ? 13.141 42.854 82.142 1.00 74.00 ? 94 GLY A O 1 ATOM 86 N N . LEU A 1 52 ? 12.360 44.963 82.078 1.00 49.63 ? 95 LEU A N 1 ATOM 87 C CA . LEU A 1 52 ? 11.084 44.569 81.491 1.00 57.49 ? 95 LEU A CA 1 ATOM 88 C C . LEU A 1 52 ? 11.290 43.808 80.185 1.00 67.48 ? 95 LEU A C 1 ATOM 89 O O . LEU A 1 52 ? 10.709 42.734 79.974 1.00 64.10 ? 95 LEU A O 1 ATOM 90 C CB . LEU A 1 52 ? 10.217 45.811 81.278 1.00 56.47 ? 95 LEU A CB 1 ATOM 91 C CG . LEU A 1 52 ? 8.707 45.636 81.432 1.00 62.85 ? 95 LEU A CG 1 ATOM 92 C CD1 . LEU A 1 52 ? 8.389 44.891 82.709 1.00 57.50 ? 95 LEU A CD1 1 ATOM 93 C CD2 . LEU A 1 52 ? 8.032 46.997 81.437 1.00 69.48 ? 95 LEU A CD2 1 ATOM 94 N N . PHE A 1 53 ? 12.112 44.351 79.288 1.00 64.95 ? 96 PHE A N 1 ATOM 95 C CA . PHE A 1 53 ? 12.322 43.680 78.012 1.00 63.03 ? 96 PHE A CA 1 ATOM 96 C C . PHE A 1 53 ? 13.279 42.503 78.115 1.00 60.45 ? 96 PHE A C 1 ATOM 97 O O . PHE A 1 53 ? 13.302 41.670 77.207 1.00 78.79 ? 96 PHE A O 1 ATOM 98 C CB . PHE A 1 53 ? 12.801 44.680 76.960 1.00 62.99 ? 96 PHE A CB 1 ATOM 99 C CG . PHE A 1 53 ? 11.702 45.553 76.433 1.00 63.72 ? 96 PHE A CG 1 ATOM 100 C CD1 . PHE A 1 53 ? 10.879 45.108 75.414 1.00 50.83 ? 96 PHE A CD1 1 ATOM 101 C CD2 . PHE A 1 53 ? 11.463 46.798 76.984 1.00 62.55 ? 96 PHE A CD2 1 ATOM 102 C CE1 . PHE A 1 53 ? 9.854 45.900 74.936 1.00 62.79 ? 96 PHE A CE1 1 ATOM 103 C CE2 . PHE A 1 53 ? 10.438 47.593 76.511 1.00 60.85 ? 96 PHE A CE2 1 ATOM 104 C CZ . PHE A 1 53 ? 9.633 47.144 75.486 1.00 45.26 ? 96 PHE A CZ 1 ATOM 105 N N . THR A 1 54 ? 14.077 42.418 79.180 1.00 59.33 ? 97 THR A N 1 ATOM 106 C CA . THR A 1 54 ? 14.808 41.182 79.441 1.00 68.67 ? 97 THR A CA 1 ATOM 107 C C . THR A 1 54 ? 13.840 40.059 79.793 1.00 63.14 ? 97 THR A C 1 ATOM 108 O O . THR A 1 54 ? 13.950 38.936 79.280 1.00 57.78 ? 97 THR A O 1 ATOM 109 C CB . THR A 1 54 ? 15.823 41.390 80.565 1.00 48.82 ? 97 THR A CB 1 ATOM 110 O OG1 . THR A 1 54 ? 16.800 42.356 80.160 1.00 54.75 ? 97 THR A OG1 1 ATOM 111 C CG2 . THR A 1 54 ? 16.523 40.082 80.895 1.00 64.22 ? 97 THR A CG2 1 ATOM 112 N N . ALA A 1 55 ? 12.872 40.358 80.663 1.00 57.19 ? 98 ALA A N 1 ATOM 113 C CA . ALA A 1 55 ? 11.853 39.375 81.009 1.00 73.02 ? 98 ALA A CA 1 ATOM 114 C C . ALA A 1 55 ? 11.010 39.004 79.796 1.00 68.13 ? 98 ALA A C 1 ATOM 115 O O . ALA A 1 55 ? 10.630 37.840 79.629 1.00 66.88 ? 98 ALA A O 1 ATOM 116 C CB . ALA A 1 55 ? 10.968 39.911 82.134 1.00 59.43 ? 98 ALA A CB 1 ATOM 117 N N . ILE A 1 56 ? 10.691 39.983 78.946 1.00 71.07 ? 99 ILE A N 1 ATOM 118 C CA . ILE A 1 56 ? 9.953 39.683 77.721 1.00 67.01 ? 99 ILE A CA 1 ATOM 119 C C . ILE A 1 56 ? 10.786 38.793 76.805 1.00 64.68 ? 99 ILE A C 1 ATOM 120 O O . ILE A 1 56 ? 10.311 37.771 76.292 1.00 54.39 ? 99 ILE A O 1 ATOM 121 C CB . ILE A 1 56 ? 9.541 40.987 77.015 1.00 56.40 ? 99 ILE A CB 1 ATOM 122 C CG1 . ILE A 1 56 ? 8.689 41.848 77.947 1.00 72.49 ? 99 ILE A CG1 1 ATOM 123 C CG2 . ILE A 1 56 ? 8.789 40.682 75.734 1.00 61.82 ? 99 ILE A CG2 1 ATOM 124 C CD1 . ILE A 1 56 ? 8.279 43.172 77.351 1.00 66.41 ? 99 ILE A CD1 1 ATOM 125 N N . ASN A 1 57 ? 12.045 39.174 76.593 1.00 65.35 ? 100 ASN A N 1 ATOM 126 C CA . ASN A 1 57 ? 12.979 38.439 75.752 1.00 67.79 ? 100 ASN A CA 1 ATOM 127 C C . ASN A 1 57 ? 13.052 36.975 76.167 1.00 74.88 ? 100 ASN A C 1 ATOM 128 O O . ASN A 1 57 ? 12.622 36.092 75.416 1.00 74.98 ? 100 ASN A O 1 ATOM 129 C CB . ASN A 1 57 ? 14.362 39.097 75.819 1.00 75.30 ? 100 ASN A CB 1 ATOM 130 C CG . ASN A 1 57 ? 15.359 38.471 74.865 1.00 92.18 ? 100 ASN A CG 1 ATOM 131 O OD1 . ASN A 1 57 ? 15.893 37.389 75.123 1.00 86.46 ? 100 ASN A OD1 1 ATOM 132 N ND2 . ASN A 1 57 ? 15.618 39.151 73.752 1.00 80.08 ? 100 ASN A ND2 1 ATOM 133 N N . LEU A 1 58 ? 13.578 36.700 77.365 1.00 89.36 ? 101 LEU A N 1 ATOM 134 C CA . LEU A 1 58 ? 13.643 35.314 77.821 1.00 78.63 ? 101 LEU A CA 1 ATOM 135 C C . LEU A 1 58 ? 12.264 34.676 77.931 1.00 69.54 ? 101 LEU A C 1 ATOM 136 O O . LEU A 1 58 ? 12.155 33.446 77.879 1.00 75.71 ? 101 LEU A O 1 ATOM 137 C CB . LEU A 1 58 ? 14.369 35.220 79.164 1.00 71.48 ? 101 LEU A CB 1 ATOM 138 C CG . LEU A 1 58 ? 15.893 35.372 79.115 1.00 91.91 ? 101 LEU A CG 1 ATOM 139 C CD1 . LEU A 1 58 ? 16.297 36.808 78.791 1.00 86.98 ? 101 LEU A CD1 1 ATOM 140 C CD2 . LEU A 1 58 ? 16.529 34.905 80.418 1.00 60.27 ? 101 LEU A CD2 1 ATOM 141 N N . GLY A 1 59 ? 11.212 35.481 78.078 1.00 78.19 ? 102 GLY A N 1 ATOM 142 C CA . GLY A 1 59 ? 9.882 34.924 78.268 1.00 73.11 ? 102 GLY A CA 1 ATOM 143 C C . GLY A 1 59 ? 9.317 34.291 77.011 1.00 73.52 ? 102 GLY A C 1 ATOM 144 O O . GLY A 1 59 ? 8.780 33.180 77.051 1.00 77.62 ? 102 GLY A O 1 ATOM 145 N N . LEU A 1 60 ? 9.413 34.991 75.881 1.00 86.37 ? 103 LEU A N 1 ATOM 146 C CA . LEU A 1 60 ? 8.900 34.462 74.623 1.00 81.87 ? 103 LEU A CA 1 ATOM 147 C C . LEU A 1 60 ? 9.898 33.567 73.898 1.00 84.25 ? 103 LEU A C 1 ATOM 148 O O . LEU A 1 60 ? 9.593 33.084 72.802 1.00 88.32 ? 103 LEU A O 1 ATOM 149 C CB . LEU A 1 60 ? 8.452 35.604 73.700 1.00 69.52 ? 103 LEU A CB 1 ATOM 150 C CG . LEU A 1 60 ? 9.442 36.691 73.278 1.00 67.16 ? 103 LEU A CG 1 ATOM 151 C CD1 . LEU A 1 60 ? 10.484 36.160 72.307 1.00 56.35 ? 103 LEU A CD1 1 ATOM 152 C CD2 . LEU A 1 60 ? 8.684 37.856 72.667 1.00 56.45 ? 103 LEU A CD2 1 ATOM 153 N N . LYS A 1 61 ? 11.081 33.345 74.470 1.00 79.91 ? 104 LYS A N 1 ATOM 154 C CA . LYS A 1 61 ? 11.995 32.337 73.946 1.00 82.51 ? 104 LYS A CA 1 ATOM 155 C C . LYS A 1 61 ? 11.463 30.920 74.143 1.00 99.09 ? 104 LYS A C 1 ATOM 156 O O . LYS A 1 61 ? 12.047 29.973 73.604 1.00 87.51 ? 104 LYS A O 1 ATOM 157 C CB . LYS A 1 61 ? 13.368 32.506 74.606 1.00 77.26 ? 104 LYS A CB 1 ATOM 158 C CG . LYS A 1 61 ? 14.485 31.644 74.036 1.00 83.77 ? 104 LYS A CG 1 ATOM 159 C CD . LYS A 1 61 ? 15.826 32.040 74.649 1.00 81.77 ? 104 LYS A CD 1 ATOM 160 C CE . LYS A 1 61 ? 16.945 31.091 74.242 1.00 96.37 ? 104 LYS A CE 1 ATOM 161 N NZ . LYS A 1 61 ? 17.198 31.101 72.774 1.00 102.68 1 104 LYS A NZ 1 ATOM 162 N N . LYS A 1 62 ? 10.378 30.758 74.903 1.00 98.16 ? 105 LYS A N 1 ATOM 163 C CA . LYS A 1 62 ? 9.732 29.472 75.133 1.00 88.96 ? 105 LYS A CA 1 ATOM 164 C C . LYS A 1 62 ? 8.577 29.277 74.155 1.00 106.45 ? 105 LYS A C 1 ATOM 165 O O . LYS A 1 62 ? 7.871 30.229 73.813 1.00 111.94 ? 105 LYS A O 1 ATOM 166 C CB . LYS A 1 62 ? 9.219 29.373 76.571 1.00 87.69 ? 105 LYS A CB 1 ATOM 167 C CG . LYS A 1 62 ? 10.260 28.898 77.574 1.00 98.99 ? 105 LYS A CG 1 ATOM 168 C CD . LYS A 1 62 ? 11.354 29.932 77.790 1.00 90.97 ? 105 LYS A CD 1 ATOM 169 C CE . LYS A 1 62 ? 12.292 29.506 78.911 1.00 109.44 ? 105 LYS A CE 1 ATOM 170 N NZ . LYS A 1 62 ? 13.363 30.508 79.165 1.00 103.81 1 105 LYS A NZ 1 ATOM 171 N N . GLU A 1 63 ? 8.383 28.032 73.716 1.00 104.99 ? 106 GLU A N 1 ATOM 172 C CA . GLU A 1 63 ? 7.443 27.692 72.652 1.00 105.28 ? 106 GLU A CA 1 ATOM 173 C C . GLU A 1 63 ? 5.968 27.947 72.971 1.00 111.16 ? 106 GLU A C 1 ATOM 174 O O . GLU A 1 63 ? 5.236 28.426 72.096 1.00 113.92 ? 106 GLU A O 1 ATOM 175 C CB . GLU A 1 63 ? 7.625 26.225 72.260 1.00 107.36 ? 106 GLU A CB 1 ATOM 176 C CG . GLU A 1 63 ? 8.663 25.998 71.175 1.00 130.57 ? 106 GLU A CG 1 ATOM 177 C CD . GLU A 1 63 ? 8.138 26.320 69.787 1.00 146.43 ? 106 GLU A CD 1 ATOM 178 O OE1 . GLU A 1 63 ? 6.915 26.197 69.567 1.00 150.09 ? 106 GLU A OE1 1 ATOM 179 O OE2 . GLU A 1 63 ? 8.951 26.697 68.916 1.00 155.97 -1 106 GLU A OE2 1 ATOM 180 N N . PRO A 1 64 ? 5.479 27.635 74.180 1.00 109.43 ? 107 PRO A N 1 ATOM 181 C CA . PRO A 1 64 ? 4.030 27.795 74.433 1.00 112.73 ? 107 PRO A CA 1 ATOM 182 C C . PRO A 1 64 ? 3.501 29.187 74.112 1.00 116.39 ? 107 PRO A C 1 ATOM 183 O O . PRO A 1 64 ? 2.460 29.328 73.447 1.00 109.70 ? 107 PRO A O 1 ATOM 184 C CB . PRO A 1 64 ? 3.901 27.455 75.925 1.00 110.90 ? 107 PRO A CB 1 ATOM 185 C CG . PRO A 1 64 ? 5.075 26.587 76.220 1.00 104.24 ? 107 PRO A CG 1 ATOM 186 C CD . PRO A 1 64 ? 6.188 27.092 75.353 1.00 105.05 ? 107 PRO A CD 1 ATOM 187 N N . ASN A 1 65 ? 4.210 30.229 74.549 1.00 110.71 ? 108 ASN A N 1 ATOM 188 C CA . ASN A 1 65 ? 3.796 31.583 74.203 1.00 103.32 ? 108 ASN A CA 1 ATOM 189 C C . ASN A 1 65 ? 3.807 31.779 72.694 1.00 85.99 ? 108 ASN A C 1 ATOM 190 O O . ASN A 1 65 ? 2.922 32.442 72.142 1.00 86.97 ? 108 ASN A O 1 ATOM 191 C CB . ASN A 1 65 ? 4.693 32.610 74.899 1.00 115.69 ? 108 ASN A CB 1 ATOM 192 C CG . ASN A 1 65 ? 4.596 32.545 76.418 1.00 109.13 ? 108 ASN A CG 1 ATOM 193 O OD1 . ASN A 1 65 ? 3.571 32.139 76.969 1.00 99.33 ? 108 ASN A OD1 1 ATOM 194 N ND2 . ASN A 1 65 ? 5.659 32.961 77.098 1.00 88.46 ? 108 ASN A ND2 1 ATOM 195 N N . VAL A 1 66 ? 4.799 31.206 72.007 1.00 83.21 ? 109 VAL A N 1 ATOM 196 C CA . VAL A 1 66 ? 4.820 31.258 70.547 1.00 100.61 ? 109 VAL A CA 1 ATOM 197 C C . VAL A 1 66 ? 3.529 30.684 69.973 1.00 91.02 ? 109 VAL A C 1 ATOM 198 O O . VAL A 1 66 ? 2.943 31.243 69.035 1.00 86.66 ? 109 VAL A O 1 ATOM 199 C CB . VAL A 1 66 ? 6.059 30.522 70.003 1.00 96.47 ? 109 VAL A CB 1 ATOM 200 C CG1 . VAL A 1 66 ? 6.115 30.620 68.486 1.00 75.99 ? 109 VAL A CG1 1 ATOM 201 C CG2 . VAL A 1 66 ? 7.326 31.082 70.629 1.00 88.67 ? 109 VAL A CG2 1 ATOM 202 N N . ALA A 1 67 ? 3.064 29.562 70.524 1.00 85.31 ? 110 ALA A N 1 ATOM 203 C CA . ALA A 1 67 ? 1.777 29.021 70.100 1.00 73.95 ? 110 ALA A CA 1 ATOM 204 C C . ALA A 1 67 ? 0.658 30.028 70.335 1.00 80.96 ? 110 ALA A C 1 ATOM 205 O O . ALA A 1 67 ? -0.209 30.217 69.472 1.00 78.93 ? 110 ALA A O 1 ATOM 206 C CB . ALA A 1 67 ? 1.486 27.712 70.833 1.00 96.08 ? 110 ALA A CB 1 ATOM 207 N N . ARG A 1 68 ? 0.667 30.694 71.494 1.00 93.06 ? 111 ARG A N 1 ATOM 208 C CA . ARG A 1 68 ? -0.376 31.676 71.786 1.00 79.98 ? 111 ARG A CA 1 ATOM 209 C C . ARG A 1 68 ? -0.391 32.791 70.746 1.00 76.47 ? 111 ARG A C 1 ATOM 210 O O . ARG A 1 68 ? -1.447 33.131 70.193 1.00 78.16 ? 111 ARG A O 1 ATOM 211 C CB . ARG A 1 68 ? -0.173 32.261 73.183 1.00 87.17 ? 111 ARG A CB 1 ATOM 212 C CG . ARG A 1 68 ? -0.467 31.301 74.315 1.00 104.70 ? 111 ARG A CG 1 ATOM 213 C CD . ARG A 1 68 ? -0.337 31.996 75.657 1.00 99.79 ? 111 ARG A CD 1 ATOM 214 N NE . ARG A 1 68 ? -0.556 31.071 76.761 1.00 110.44 ? 111 ARG A NE 1 ATOM 215 C CZ . ARG A 1 68 ? 0.383 30.268 77.252 1.00 127.90 ? 111 ARG A CZ 1 ATOM 216 N NH1 . ARG A 1 68 ? 1.603 30.282 76.733 1.00 109.24 1 111 ARG A NH1 1 ATOM 217 N NH2 . ARG A 1 68 ? 0.103 29.453 78.260 1.00 147.60 ? 111 ARG A NH2 1 ATOM 218 N N . VAL A 1 69 ? 0.777 33.379 70.471 1.00 68.20 ? 112 VAL A N 1 ATOM 219 C CA . VAL A 1 69 ? 0.858 34.416 69.449 1.00 79.60 ? 112 VAL A CA 1 ATOM 220 C C . VAL A 1 69 ? 0.336 33.883 68.124 1.00 72.86 ? 112 VAL A C 1 ATOM 221 O O . VAL A 1 69 ? -0.388 34.577 67.400 1.00 64.99 ? 112 VAL A O 1 ATOM 222 C CB . VAL A 1 69 ? 2.301 34.944 69.322 1.00 75.38 ? 112 VAL A CB 1 ATOM 223 C CG1 . VAL A 1 69 ? 2.890 35.226 70.697 1.00 66.10 ? 112 VAL A CG1 1 ATOM 224 C CG2 . VAL A 1 69 ? 3.172 33.976 68.540 1.00 64.58 ? 112 VAL A CG2 1 ATOM 225 N N . GLY A 1 70 ? 0.682 32.638 67.792 1.00 73.01 ? 113 GLY A N 1 ATOM 226 C CA . GLY A 1 70 ? 0.181 32.053 66.560 1.00 53.44 ? 113 GLY A CA 1 ATOM 227 C C . GLY A 1 70 ? -1.334 32.038 66.496 1.00 63.14 ? 113 GLY A C 1 ATOM 228 O O . GLY A 1 70 ? -1.930 32.465 65.503 1.00 62.00 ? 113 GLY A O 1 ATOM 229 N N . SER A 1 71 ? -1.984 31.565 67.565 1.00 56.12 ? 114 SER A N 1 ATOM 230 C CA . SER A 1 71 ? -3.439 31.432 67.527 1.00 61.19 ? 114 SER A CA 1 ATOM 231 C C . SER A 1 71 ? -4.132 32.793 67.516 1.00 70.39 ? 114 SER A C 1 ATOM 232 O O . SER A 1 71 ? -5.091 33.000 66.759 1.00 70.11 ? 114 SER A O 1 ATOM 233 C CB . SER A 1 71 ? -3.928 30.589 68.706 1.00 56.15 ? 114 SER A CB 1 ATOM 234 O OG . SER A 1 71 ? -3.563 31.165 69.947 1.00 66.57 ? 114 SER A OG 1 ATOM 235 N N . VAL A 1 72 ? -3.663 33.736 68.341 1.00 66.83 ? 115 VAL A N 1 ATOM 236 C CA . VAL A 1 72 ? -4.245 35.078 68.315 1.00 64.98 ? 115 VAL A CA 1 ATOM 237 C C . VAL A 1 72 ? -4.092 35.697 66.933 1.00 69.07 ? 115 VAL A C 1 ATOM 238 O O . VAL A 1 72 ? -5.039 36.278 66.380 1.00 64.34 ? 115 VAL A O 1 ATOM 239 C CB . VAL A 1 72 ? -3.611 35.965 69.402 1.00 61.78 ? 115 VAL A CB 1 ATOM 240 C CG1 . VAL A 1 72 ? -4.263 37.336 69.403 1.00 62.82 ? 115 VAL A CG1 1 ATOM 241 C CG2 . VAL A 1 72 ? -3.742 35.308 70.767 1.00 69.94 ? 115 VAL A CG2 1 ATOM 242 N N . ALA A 1 73 ? -2.900 35.567 66.345 1.00 73.91 ? 116 ALA A N 1 ATOM 243 C CA . ALA A 1 73 ? -2.688 36.075 64.996 1.00 58.76 ? 116 ALA A CA 1 ATOM 244 C C . ALA A 1 73 ? -3.641 35.412 64.014 1.00 60.64 ? 116 ALA A C 1 ATOM 245 O O . ALA A 1 73 ? -4.121 36.057 63.076 1.00 64.79 ? 116 ALA A O 1 ATOM 246 C CB . ALA A 1 73 ? -1.237 35.861 64.567 1.00 37.01 ? 116 ALA A CB 1 ATOM 247 N N . ILE A 1 74 ? -3.937 34.126 64.215 1.00 63.07 ? 117 ILE A N 1 ATOM 248 C CA . ILE A 1 74 ? -4.878 33.443 63.332 1.00 56.33 ? 117 ILE A CA 1 ATOM 249 C C . ILE A 1 74 ? -6.258 34.076 63.440 1.00 63.25 ? 117 ILE A C 1 ATOM 250 O O . ILE A 1 74 ? -6.911 34.358 62.429 1.00 71.81 ? 117 ILE A O 1 ATOM 251 C CB . ILE A 1 74 ? -4.925 31.938 63.642 1.00 58.52 ? 117 ILE A CB 1 ATOM 252 C CG1 . ILE A 1 74 ? -3.557 31.304 63.403 1.00 53.70 ? 117 ILE A CG1 1 ATOM 253 C CG2 . ILE A 1 74 ? -5.978 31.258 62.783 1.00 49.15 ? 117 ILE A CG2 1 ATOM 254 C CD1 . ILE A 1 74 ? -3.586 29.791 63.322 1.00 52.81 ? 117 ILE A CD1 1 ATOM 255 N N . LYS A 1 75 ? -6.730 34.305 64.669 1.00 69.02 ? 118 LYS A N 1 ATOM 256 C CA . LYS A 1 75 ? -8.042 34.929 64.824 1.00 72.16 ? 118 LYS A CA 1 ATOM 257 C C . LYS A 1 75 ? -8.082 36.304 64.163 1.00 66.69 ? 118 LYS A C 1 ATOM 258 O O . LYS A 1 75 ? -9.073 36.657 63.507 1.00 64.10 ? 118 LYS A O 1 ATOM 259 C CB . LYS A 1 75 ? -8.419 35.019 66.304 1.00 70.61 ? 118 LYS A CB 1 ATOM 260 C CG . LYS A 1 75 ? -8.516 33.667 66.994 1.00 83.76 ? 118 LYS A CG 1 ATOM 261 C CD . LYS A 1 75 ? -9.124 33.773 68.387 1.00 95.34 ? 118 LYS A CD 1 ATOM 262 C CE . LYS A 1 75 ? -9.322 32.389 68.996 1.00 101.09 ? 118 LYS A CE 1 ATOM 263 N NZ . LYS A 1 75 ? -10.001 32.431 70.322 1.00 96.57 1 118 LYS A NZ 1 ATOM 264 N N . LEU A 1 76 ? -7.008 37.088 64.300 1.00 65.80 ? 119 LEU A N 1 ATOM 265 C CA . LEU A 1 76 ? -6.982 38.395 63.646 1.00 77.16 ? 119 LEU A CA 1 ATOM 266 C C . LEU A 1 76 ? -6.997 38.254 62.126 1.00 81.38 ? 119 LEU A C 1 ATOM 267 O O . LEU A 1 76 ? -7.717 38.984 61.433 1.00 72.28 ? 119 LEU A O 1 ATOM 268 C CB . LEU A 1 76 ? -5.767 39.200 64.108 1.00 78.00 ? 119 LEU A CB 1 ATOM 269 C CG . LEU A 1 76 ? -5.767 39.614 65.581 1.00 80.02 ? 119 LEU A CG 1 ATOM 270 C CD1 . LEU A 1 76 ? -4.445 40.263 65.955 1.00 81.84 ? 119 LEU A CD1 1 ATOM 271 C CD2 . LEU A 1 76 ? -6.930 40.553 65.872 1.00 81.49 ? 119 LEU A CD2 1 ATOM 272 N N . CYS A 1 77 ? -6.201 37.325 61.588 1.00 75.67 ? 120 CYS A N 1 ATOM 273 C CA . CYS A 1 77 ? -6.238 37.038 60.158 1.00 67.92 ? 120 CYS A CA 1 ATOM 274 C C . CYS A 1 77 ? -7.666 36.759 59.713 1.00 69.48 ? 120 CYS A C 1 ATOM 275 O O . CYS A 1 77 ? -8.143 37.314 58.717 1.00 80.87 ? 120 CYS A O 1 ATOM 276 C CB . CYS A 1 77 ? -5.319 35.852 59.839 1.00 57.94 ? 120 CYS A CB 1 ATOM 277 S SG . CYS A 1 77 ? -5.043 35.477 58.072 1.00 118.36 ? 120 CYS A SG 1 ATOM 278 N N . ASN A 1 78 ? -8.368 35.902 60.458 1.00 64.93 ? 121 ASN A N 1 ATOM 279 C CA . ASN A 1 78 ? -9.771 35.642 60.160 1.00 73.08 ? 121 ASN A CA 1 ATOM 280 C C . ASN A 1 78 ? -10.596 36.922 60.200 1.00 90.14 ? 121 ASN A C 1 ATOM 281 O O . ASN A 1 78 ? -11.564 37.057 59.443 1.00 97.21 ? 121 ASN A O 1 ATOM 282 C CB . ASN A 1 78 ? -10.332 34.613 61.140 1.00 75.43 ? 121 ASN A CB 1 ATOM 283 C CG . ASN A 1 78 ? -9.630 33.269 61.041 1.00 84.89 ? 121 ASN A CG 1 ATOM 284 O OD1 . ASN A 1 78 ? -9.131 32.892 59.980 1.00 85.26 ? 121 ASN A OD1 1 ATOM 285 N ND2 . ASN A 1 78 ? -9.588 32.540 62.151 1.00 83.17 ? 121 ASN A ND2 1 ATOM 286 N N . LEU A 1 79 ? -10.231 37.874 61.065 1.00 96.15 ? 122 LEU A N 1 ATOM 287 C CA . LEU A 1 79 ? -10.973 39.132 61.122 1.00 93.95 ? 122 LEU A CA 1 ATOM 288 C C . LEU A 1 79 ? -10.759 39.965 59.861 1.00 92.19 ? 122 LEU A C 1 ATOM 289 O O . LEU A 1 79 ? -11.719 40.480 59.277 1.00 90.16 ? 122 LEU A O 1 ATOM 290 C CB . LEU A 1 79 ? -10.582 39.926 62.370 1.00 91.05 ? 122 LEU A CB 1 ATOM 291 C CG . LEU A 1 79 ? -11.164 39.438 63.699 1.00 100.64 ? 122 LEU A CG 1 ATOM 292 C CD1 . LEU A 1 79 ? -10.720 40.331 64.850 1.00 102.11 ? 122 LEU A CD1 1 ATOM 293 C CD2 . LEU A 1 79 ? -12.684 39.381 63.624 1.00 89.56 ? 122 LEU A CD2 1 ATOM 294 N N . LEU A 1 80 ? -9.505 40.114 59.427 1.00 92.47 ? 123 LEU A N 1 ATOM 295 C CA . LEU A 1 80 ? -9.216 40.868 58.210 1.00 99.93 ? 123 LEU A CA 1 ATOM 296 C C . LEU A 1 80 ? -9.649 40.134 56.945 1.00 95.77 ? 123 LEU A C 1 ATOM 297 O O . LEU A 1 80 ? -9.556 40.704 55.853 1.00 104.93 ? 123 LEU A O 1 ATOM 298 C CB . LEU A 1 80 ? -7.722 41.193 58.141 1.00 95.39 ? 123 LEU A CB 1 ATOM 299 C CG . LEU A 1 80 ? -7.169 42.000 59.321 1.00 106.25 ? 123 LEU A CG 1 ATOM 300 C CD1 . LEU A 1 80 ? -5.697 42.337 59.113 1.00 96.34 ? 123 LEU A CD1 1 ATOM 301 C CD2 . LEU A 1 80 ? -7.987 43.263 59.555 1.00 90.36 ? 123 LEU A CD2 1 ATOM 302 N N . LYS A 1 81 ? -10.116 38.900 57.073 1.00 98.14 ? 124 LYS A N 1 ATOM 303 C CA . LYS A 1 81 ? -10.485 37.989 55.986 1.00 103.34 ? 124 LYS A CA 1 ATOM 304 C C . LYS A 1 81 ? -9.289 37.843 55.042 1.00 111.30 ? 124 LYS A C 1 ATOM 305 O O . LYS A 1 81 ? -8.138 37.968 55.475 1.00 111.58 ? 124 LYS A O 1 ATOM 306 C CB . LYS A 1 81 ? -11.760 38.488 55.322 1.00 93.60 ? 124 LYS A CB 1 ATOM 307 C CG . LYS A 1 81 ? -12.966 38.576 56.252 1.00 93.97 ? 124 LYS A CG 1 ATOM 308 C CD . LYS A 1 81 ? -13.979 39.613 55.772 1.00 104.66 ? 124 LYS A CD 1 ATOM 309 C CE . LYS A 1 81 ? -13.421 41.028 55.831 1.00 102.99 ? 124 LYS A CE 1 ATOM 310 N NZ . LYS A 1 81 ? -14.419 42.041 55.373 1.00 75.89 1 124 LYS A NZ 1 ATOM 311 N N . ILE A 1 82 ? -9.550 37.622 53.750 1.00 107.17 ? 125 ILE A N 1 ATOM 312 C CA . ILE A 1 82 ? -8.515 37.633 52.712 1.00 106.54 ? 125 ILE A CA 1 ATOM 313 C C . ILE A 1 82 ? -7.222 36.991 53.233 1.00 99.66 ? 125 ILE A C 1 ATOM 314 O O . ILE A 1 82 ? -6.265 37.708 53.531 1.00 87.41 ? 125 ILE A O 1 ATOM 315 C CB . ILE A 1 82 ? -8.272 39.066 52.174 1.00 122.24 ? 125 ILE A CB 1 ATOM 316 C CG1 . ILE A 1 82 ? -7.319 39.038 50.975 1.00 133.21 ? 125 ILE A CG1 1 ATOM 317 C CG2 . ILE A 1 82 ? -7.773 39.997 53.274 1.00 101.97 ? 125 ILE A CG2 1 ATOM 318 C CD1 . ILE A 1 82 ? -7.847 38.251 49.786 1.00 99.93 ? 125 ILE A CD1 1 ATOM 319 N N . ALA A 1 83 ? -7.166 35.665 53.364 1.00 95.01 ? 126 ALA A N 1 ATOM 320 C CA . ALA A 1 83 ? -7.952 34.709 52.587 1.00 85.03 ? 126 ALA A CA 1 ATOM 321 C C . ALA A 1 83 ? -8.595 33.627 53.476 1.00 91.60 ? 126 ALA A C 1 ATOM 322 O O . ALA A 1 83 ? -8.559 33.740 54.700 1.00 102.50 ? 126 ALA A O 1 ATOM 323 C CB . ALA A 1 83 ? -7.060 34.079 51.522 1.00 82.84 ? 126 ALA A CB 1 ATOM 324 N N . PRO A 1 84 ? -9.193 32.600 52.867 1.00 82.55 ? 127 PRO A N 1 ATOM 325 C CA . PRO A 1 84 ? -9.938 31.590 53.641 1.00 74.39 ? 127 PRO A CA 1 ATOM 326 C C . PRO A 1 84 ? -9.145 31.054 54.820 1.00 78.71 ? 127 PRO A C 1 ATOM 327 O O . PRO A 1 84 ? -7.905 30.997 54.785 1.00 71.44 ? 127 PRO A O 1 ATOM 328 C CB . PRO A 1 84 ? -10.203 30.489 52.607 1.00 66.77 ? 127 PRO A CB 1 ATOM 329 C CG . PRO A 1 84 ? -10.341 31.235 51.338 1.00 82.24 ? 127 PRO A CG 1 ATOM 330 C CD . PRO A 1 84 ? -9.370 32.391 51.417 1.00 76.81 ? 127 PRO A CD 1 ATOM 331 N N . PRO A 1 85 ? -9.844 30.635 55.882 1.00 69.87 ? 128 PRO A N 1 ATOM 332 C CA . PRO A 1 85 ? -9.180 30.351 57.169 1.00 70.37 ? 128 PRO A CA 1 ATOM 333 C C . PRO A 1 85 ? -8.029 29.358 57.111 1.00 69.05 ? 128 PRO A C 1 ATOM 334 O O . PRO A 1 85 ? -7.014 29.574 57.784 1.00 72.28 ? 128 PRO A O 1 ATOM 335 C CB . PRO A 1 85 ? -10.331 29.810 58.028 1.00 62.48 ? 128 PRO A CB 1 ATOM 336 C CG . PRO A 1 85 ? -11.565 30.380 57.413 1.00 64.40 ? 128 PRO A CG 1 ATOM 337 C CD . PRO A 1 85 ? -11.300 30.433 55.948 1.00 68.35 ? 128 PRO A CD 1 ATOM 338 N N . ALA A 1 86 ? -8.163 28.259 56.364 1.00 60.66 ? 129 ALA A N 1 ATOM 339 C CA . ALA A 1 86 ? -7.087 27.272 56.321 1.00 70.39 ? 129 ALA A CA 1 ATOM 340 C C . ALA A 1 86 ? -5.775 27.909 55.878 1.00 69.05 ? 129 ALA A C 1 ATOM 341 O O . ALA A 1 86 ? -4.696 27.541 56.366 1.00 63.04 ? 129 ALA A O 1 ATOM 342 C CB . ALA A 1 86 ? -7.470 26.116 55.399 1.00 62.43 ? 129 ALA A CB 1 ATOM 343 N N . VAL A 1 87 ? -5.848 28.869 54.957 1.00 53.44 ? 130 VAL A N 1 ATOM 344 C CA . VAL A 1 87 ? -4.645 29.564 54.517 1.00 68.32 ? 130 VAL A CA 1 ATOM 345 C C . VAL A 1 87 ? -4.054 30.369 55.669 1.00 65.40 ? 130 VAL A C 1 ATOM 346 O O . VAL A 1 87 ? -2.845 30.322 55.922 1.00 62.31 ? 130 VAL A O 1 ATOM 347 C CB . VAL A 1 87 ? -4.948 30.450 53.296 1.00 78.64 ? 130 VAL A CB 1 ATOM 348 C CG1 . VAL A 1 87 ? -3.658 31.024 52.728 1.00 58.63 ? 130 VAL A CG1 1 ATOM 349 C CG2 . VAL A 1 87 ? -5.690 29.649 52.235 1.00 67.09 ? 130 VAL A CG2 1 ATOM 350 N N . CYS A 1 88 ? -4.896 31.121 56.384 1.00 74.92 ? 131 CYS A N 1 ATOM 351 C CA . CYS A 1 88 ? -4.431 31.821 57.579 1.00 59.84 ? 131 CYS A CA 1 ATOM 352 C C . CYS A 1 88 ? -3.693 30.866 58.509 1.00 65.69 ? 131 CYS A C 1 ATOM 353 O O . CYS A 1 88 ? -2.536 31.101 58.878 1.00 61.29 ? 131 CYS A O 1 ATOM 354 C CB . CYS A 1 88 ? -5.612 32.463 58.314 1.00 54.44 ? 131 CYS A CB 1 ATOM 355 S SG . CYS A 1 88 ? -6.319 33.965 57.580 1.00 87.29 ? 131 CYS A SG 1 ATOM 356 N N . GLN A 1 89 ? -4.350 29.763 58.875 1.00 50.34 ? 132 GLN A N 1 ATOM 357 C CA . GLN A 1 89 ? -3.769 28.804 59.808 1.00 55.51 ? 132 GLN A CA 1 ATOM 358 C C . GLN A 1 89 ? -2.400 28.330 59.337 1.00 60.81 ? 132 GLN A C 1 ATOM 359 O O . GLN A 1 89 ? -1.406 28.433 60.067 1.00 66.33 ? 132 GLN A O 1 ATOM 360 C CB . GLN A 1 89 ? -4.725 27.621 59.975 1.00 58.47 ? 132 GLN A CB 1 ATOM 361 C CG . GLN A 1 89 ? -4.421 26.708 61.149 1.00 79.53 ? 132 GLN A CG 1 ATOM 362 C CD . GLN A 1 89 ? -5.631 25.894 61.567 1.00 96.02 ? 132 GLN A CD 1 ATOM 363 O OE1 . GLN A 1 89 ? -6.761 26.195 61.174 1.00 79.20 ? 132 GLN A OE1 1 ATOM 364 N NE2 . GLN A 1 89 ? -5.403 24.862 62.375 1.00 95.96 ? 132 GLN A NE2 1 ATOM 365 N N . SER A 1 90 ? -2.326 27.816 58.108 1.00 70.20 ? 133 SER A N 1 ATOM 366 C CA . SER A 1 90 ? -1.068 27.255 57.624 1.00 65.34 ? 133 SER A CA 1 ATOM 367 C C . SER A 1 90 ? 0.020 28.321 57.556 1.00 60.52 ? 133 SER A C 1 ATOM 368 O O . SER A 1 90 ? 1.151 28.104 58.011 1.00 61.23 ? 133 SER A O 1 ATOM 369 C CB . SER A 1 90 ? -1.284 26.605 56.258 1.00 66.25 ? 133 SER A CB 1 ATOM 370 O OG . SER A 1 90 ? -2.263 25.584 56.339 1.00 77.62 ? 133 SER A OG 1 ATOM 371 N N . ILE A 1 91 ? -0.309 29.487 56.997 1.00 48.85 ? 134 ILE A N 1 ATOM 372 C CA . ILE A 1 91 ? 0.694 30.529 56.794 1.00 54.17 ? 134 ILE A CA 1 ATOM 373 C C . ILE A 1 91 ? 1.257 30.996 58.132 1.00 66.61 ? 134 ILE A C 1 ATOM 374 O O . ILE A 1 91 ? 2.479 31.072 58.319 1.00 63.70 ? 134 ILE A O 1 ATOM 375 C CB . ILE A 1 91 ? 0.098 31.695 55.980 1.00 50.12 ? 134 ILE A CB 1 ATOM 376 C CG1 . ILE A 1 91 ? 1.182 32.707 55.601 1.00 54.18 ? 134 ILE A CG1 1 ATOM 377 C CG2 . ILE A 1 91 ? -1.046 32.360 56.728 1.00 50.36 ? 134 ILE A CG2 1 ATOM 378 C CD1 . ILE A 1 91 ? 2.087 32.246 54.479 1.00 59.11 ? 134 ILE A CD1 1 ATOM 379 N N . VAL A 1 92 ? 0.378 31.299 59.092 1.00 57.39 ? 135 VAL A N 1 ATOM 380 C CA . VAL A 1 92 ? 0.849 31.770 60.393 1.00 54.29 ? 135 VAL A CA 1 ATOM 381 C C . VAL A 1 92 ? 1.648 30.685 61.102 1.00 61.57 ? 135 VAL A C 1 ATOM 382 O O . VAL A 1 92 ? 2.670 30.965 61.742 1.00 57.06 ? 135 VAL A O 1 ATOM 383 C CB . VAL A 1 92 ? -0.328 32.253 61.257 1.00 44.78 ? 135 VAL A CB 1 ATOM 384 C CG1 . VAL A 1 92 ? -1.378 31.181 61.337 1.00 61.98 ? 135 VAL A CG1 1 ATOM 385 C CG2 . VAL A 1 92 ? 0.166 32.611 62.649 1.00 59.15 ? 135 VAL A CG2 1 ATOM 386 N N . HIS A 1 93 ? 1.192 29.431 61.019 1.00 55.55 ? 136 HIS A N 1 ATOM 387 C CA . HIS A 1 93 ? 1.979 28.349 61.603 1.00 56.14 ? 136 HIS A CA 1 ATOM 388 C C . HIS A 1 93 ? 3.363 28.276 60.975 1.00 62.65 ? 136 HIS A C 1 ATOM 389 O O . HIS A 1 93 ? 4.333 27.911 61.650 1.00 54.61 ? 136 HIS A O 1 ATOM 390 C CB . HIS A 1 93 ? 1.251 27.013 61.455 1.00 54.54 ? 136 HIS A CB 1 ATOM 391 C CG . HIS A 1 93 ? 0.277 26.731 62.557 1.00 75.48 ? 136 HIS A CG 1 ATOM 392 N ND1 . HIS A 1 93 ? -1.061 27.047 62.467 1.00 80.22 ? 136 HIS A ND1 1 ATOM 393 C CD2 . HIS A 1 93 ? 0.452 26.177 63.780 1.00 72.95 ? 136 HIS A CD2 1 ATOM 394 C CE1 . HIS A 1 93 ? -1.672 26.690 63.583 1.00 67.75 ? 136 HIS A CE1 1 ATOM 395 N NE2 . HIS A 1 93 ? -0.776 26.161 64.396 1.00 77.45 ? 136 HIS A NE2 1 ATOM 396 N N . LEU A 1 94 ? 3.479 28.648 59.698 1.00 61.79 ? 137 LEU A N 1 ATOM 397 C CA . LEU A 1 94 ? 4.766 28.628 59.010 1.00 58.71 ? 137 LEU A CA 1 ATOM 398 C C . LEU A 1 94 ? 5.655 29.794 59.429 1.00 63.57 ? 137 LEU A C 1 ATOM 399 O O . LEU A 1 94 ? 6.879 29.644 59.521 1.00 56.45 ? 137 LEU A O 1 ATOM 400 C CB . LEU A 1 94 ? 4.542 28.650 57.497 1.00 60.77 ? 137 LEU A CB 1 ATOM 401 C CG . LEU A 1 94 ? 5.757 28.580 56.567 1.00 62.08 ? 137 LEU A CG 1 ATOM 402 C CD1 . LEU A 1 94 ? 6.545 27.292 56.745 1.00 41.06 ? 137 LEU A CD1 1 ATOM 403 C CD2 . LEU A 1 94 ? 5.318 28.751 55.122 1.00 53.20 ? 137 LEU A CD2 1 ATOM 404 N N . PHE A 1 95 ? 5.061 30.967 59.654 1.00 61.95 ? 138 PHE A N 1 ATOM 405 C CA . PHE A 1 95 ? 5.838 32.167 59.953 1.00 69.06 ? 138 PHE A CA 1 ATOM 406 C C . PHE A 1 95 ? 6.235 32.281 61.424 1.00 68.70 ? 138 PHE A C 1 ATOM 407 O O . PHE A 1 95 ? 7.307 32.824 61.728 1.00 83.68 ? 138 PHE A O 1 ATOM 408 C CB . PHE A 1 95 ? 5.040 33.405 59.541 1.00 82.05 ? 138 PHE A CB 1 ATOM 409 C CG . PHE A 1 95 ? 4.922 33.586 58.053 1.00 83.03 ? 138 PHE A CG 1 ATOM 410 C CD1 . PHE A 1 95 ? 5.700 32.841 57.183 1.00 80.16 ? 138 PHE A CD1 1 ATOM 411 C CD2 . PHE A 1 95 ? 4.027 34.500 57.525 1.00 89.49 ? 138 PHE A CD2 1 ATOM 412 C CE1 . PHE A 1 95 ? 5.586 33.007 55.814 1.00 76.49 ? 138 PHE A CE1 1 ATOM 413 C CE2 . PHE A 1 95 ? 3.911 34.669 56.158 1.00 84.18 ? 138 PHE A CE2 1 ATOM 414 C CZ . PHE A 1 95 ? 4.693 33.922 55.302 1.00 78.24 ? 138 PHE A CZ 1 ATOM 415 N N . GLU A 1 96 ? 5.396 31.787 62.340 1.00 67.34 ? 139 GLU A N 1 ATOM 416 C CA . GLU A 1 96 ? 5.491 32.180 63.747 1.00 70.85 ? 139 GLU A CA 1 ATOM 417 C C . GLU A 1 96 ? 6.906 32.021 64.298 1.00 65.64 ? 139 GLU A C 1 ATOM 418 O O . GLU A 1 96 ? 7.473 32.964 64.863 1.00 67.51 ? 139 GLU A O 1 ATOM 419 C CB . GLU A 1 96 ? 4.493 31.377 64.586 1.00 77.39 ? 139 GLU A CB 1 ATOM 420 C CG . GLU A 1 96 ? 4.706 29.871 64.554 1.00 90.16 ? 139 GLU A CG 1 ATOM 421 C CD . GLU A 1 96 ? 3.724 29.125 65.436 1.00 82.33 ? 139 GLU A CD 1 ATOM 422 O OE1 . GLU A 1 96 ? 2.859 29.781 66.055 1.00 86.51 ? 139 GLU A OE1 1 ATOM 423 O OE2 . GLU A 1 96 ? 3.818 27.882 65.512 1.00 95.58 -1 139 GLU A OE2 1 ATOM 424 N N . ASP A 1 97 ? 7.489 30.830 64.154 1.00 68.23 ? 140 ASP A N 1 ATOM 425 C CA . ASP A 1 97 ? 8.809 30.546 64.712 1.00 73.36 ? 140 ASP A CA 1 ATOM 426 C C . ASP A 1 97 ? 9.821 31.632 64.364 1.00 73.68 ? 140 ASP A C 1 ATOM 427 O O . ASP A 1 97 ? 10.258 32.391 65.238 1.00 80.45 ? 140 ASP A O 1 ATOM 428 C CB . ASP A 1 97 ? 9.315 29.186 64.221 1.00 81.14 ? 140 ASP A CB 1 ATOM 429 C CG . ASP A 1 97 ? 8.423 28.037 64.655 1.00 104.92 ? 140 ASP A CG 1 ATOM 430 O OD1 . ASP A 1 97 ? 7.954 28.050 65.814 1.00 100.03 ? 140 ASP A OD1 1 ATOM 431 O OD2 . ASP A 1 97 ? 8.196 27.118 63.839 1.00 98.00 -1 140 ASP A OD2 1 ATOM 432 N N . ASP A 1 98 ? 10.191 31.717 63.086 1.00 79.99 ? 141 ASP A N 1 ATOM 433 C CA . ASP A 1 98 ? 11.247 32.639 62.682 1.00 74.49 ? 141 ASP A CA 1 ATOM 434 C C . ASP A 1 98 ? 10.850 34.091 62.920 1.00 68.71 ? 141 ASP A C 1 ATOM 435 O O . ASP A 1 98 ? 11.705 34.921 63.258 1.00 75.20 ? 141 ASP A O 1 ATOM 436 C CB . ASP A 1 98 ? 11.604 32.400 61.215 1.00 88.09 ? 141 ASP A CB 1 ATOM 437 C CG . ASP A 1 98 ? 11.941 30.942 60.927 1.00 92.39 ? 141 ASP A CG 1 ATOM 438 O OD1 . ASP A 1 98 ? 12.506 30.270 61.820 1.00 98.34 ? 141 ASP A OD1 1 ATOM 439 O OD2 . ASP A 1 98 ? 11.640 30.466 59.813 1.00 71.15 -1 141 ASP A OD2 1 ATOM 440 N N . MET A 1 99 ? 9.565 34.418 62.759 1.00 67.79 ? 142 MET A N 1 ATOM 441 C CA . MET A 1 99 ? 9.104 35.772 63.049 1.00 64.30 ? 142 MET A CA 1 ATOM 442 C C . MET A 1 99 ? 9.446 36.170 64.483 1.00 73.16 ? 142 MET A C 1 ATOM 443 O O . MET A 1 99 ? 10.215 37.113 64.724 1.00 61.80 ? 142 MET A O 1 ATOM 444 C CB . MET A 1 99 ? 7.595 35.865 62.811 1.00 61.16 ? 142 MET A CB 1 ATOM 445 C CG . MET A 1 99 ? 7.058 37.284 62.727 1.00 84.17 ? 142 MET A CG 1 ATOM 446 S SD . MET A 1 99 ? 7.658 38.139 61.263 1.00 133.81 ? 142 MET A SD 1 ATOM 447 C CE . MET A 1 99 ? 7.080 37.025 59.980 1.00 98.72 ? 142 MET A CE 1 ATOM 448 N N . VAL A 1 100 ? 8.880 35.446 65.454 1.00 59.21 ? 143 VAL A N 1 ATOM 449 C CA . VAL A 1 100 ? 9.163 35.717 66.860 1.00 57.24 ? 143 VAL A CA 1 ATOM 450 C C . VAL A 1 100 ? 10.662 35.711 67.121 1.00 52.23 ? 143 VAL A C 1 ATOM 451 O O . VAL A 1 100 ? 11.175 36.533 67.888 1.00 63.67 ? 143 VAL A O 1 ATOM 452 C CB . VAL A 1 100 ? 8.430 34.705 67.758 1.00 65.37 ? 143 VAL A CB 1 ATOM 453 C CG1 . VAL A 1 100 ? 9.017 34.720 69.156 1.00 57.49 ? 143 VAL A CG1 1 ATOM 454 C CG2 . VAL A 1 100 ? 6.942 35.020 67.798 1.00 67.53 ? 143 VAL A CG2 1 ATOM 455 N N . GLU A 1 101 ? 11.390 34.782 66.500 1.00 50.63 ? 144 GLU A N 1 ATOM 456 C CA . GLU A 1 101 ? 12.841 34.764 66.666 1.00 49.38 ? 144 GLU A CA 1 ATOM 457 C C . GLU A 1 101 ? 13.449 36.124 66.343 1.00 55.37 ? 144 GLU A C 1 ATOM 458 O O . GLU A 1 101 ? 14.193 36.697 67.151 1.00 65.82 ? 144 GLU A O 1 ATOM 459 C CB . GLU A 1 101 ? 13.461 33.680 65.784 1.00 62.18 ? 144 GLU A CB 1 ATOM 460 C CG . GLU A 1 101 ? 14.985 33.705 65.760 1.00 71.61 ? 144 GLU A CG 1 ATOM 461 C CD . GLU A 1 101 ? 15.606 33.065 66.986 1.00 78.63 ? 144 GLU A CD 1 ATOM 462 O OE1 . GLU A 1 101 ? 14.854 32.495 67.803 1.00 79.94 ? 144 GLU A OE1 1 ATOM 463 O OE2 . GLU A 1 101 ? 16.845 33.139 67.135 1.00 84.17 -1 144 GLU A OE2 1 ATOM 464 N N . VAL A 1 102 ? 13.135 36.665 65.164 1.00 59.83 ? 145 VAL A N 1 ATOM 465 C CA . VAL A 1 102 ? 13.788 37.901 64.743 1.00 62.29 ? 145 VAL A CA 1 ATOM 466 C C . VAL A 1 102 ? 13.328 39.071 65.604 1.00 57.90 ? 145 VAL A C 1 ATOM 467 O O . VAL A 1 102 ? 14.145 39.890 66.043 1.00 54.10 ? 145 VAL A O 1 ATOM 468 C CB . VAL A 1 102 ? 13.552 38.162 63.243 1.00 51.78 ? 145 VAL A CB 1 ATOM 469 C CG1 . VAL A 1 102 ? 13.933 36.933 62.431 1.00 50.91 ? 145 VAL A CG1 1 ATOM 470 C CG2 . VAL A 1 102 ? 12.114 38.578 62.977 1.00 48.76 ? 145 VAL A CG2 1 ATOM 471 N N . TRP A 1 103 ? 12.022 39.176 65.865 1.00 53.04 ? 146 TRP A N 1 ATOM 472 C CA . TRP A 1 103 ? 11.549 40.271 66.708 1.00 50.36 ? 146 TRP A CA 1 ATOM 473 C C . TRP A 1 103 ? 12.241 40.239 68.064 1.00 55.84 ? 146 TRP A C 1 ATOM 474 O O . TRP A 1 103 ? 12.741 41.261 68.547 1.00 59.13 ? 146 TRP A O 1 ATOM 475 C CB . TRP A 1 103 ? 10.031 40.199 66.869 1.00 48.65 ? 146 TRP A CB 1 ATOM 476 C CG . TRP A 1 103 ? 9.293 40.817 65.727 1.00 61.33 ? 146 TRP A CG 1 ATOM 477 C CD1 . TRP A 1 103 ? 9.385 40.469 64.413 1.00 67.20 ? 146 TRP A CD1 1 ATOM 478 C CD2 . TRP A 1 103 ? 8.342 41.886 65.794 1.00 63.53 ? 146 TRP A CD2 1 ATOM 479 N NE1 . TRP A 1 103 ? 8.557 41.260 63.655 1.00 70.00 ? 146 TRP A NE1 1 ATOM 480 C CE2 . TRP A 1 103 ? 7.904 42.137 64.480 1.00 62.22 ? 146 TRP A CE2 1 ATOM 481 C CE3 . TRP A 1 103 ? 7.819 42.656 66.836 1.00 55.66 ? 146 TRP A CE3 1 ATOM 482 C CZ2 . TRP A 1 103 ? 6.968 43.123 64.181 1.00 50.58 ? 146 TRP A CZ2 1 ATOM 483 C CZ3 . TRP A 1 103 ? 6.888 43.636 66.535 1.00 53.64 ? 146 TRP A CZ3 1 ATOM 484 C CH2 . TRP A 1 103 ? 6.473 43.859 65.219 1.00 53.87 ? 146 TRP A CH2 1 ATOM 485 N N . ARG A 1 104 ? 12.295 39.060 68.685 1.00 63.38 ? 147 ARG A N 1 ATOM 486 C CA . ARG A 1 104 ? 13.007 38.914 69.950 1.00 59.10 ? 147 ARG A CA 1 ATOM 487 C C . ARG A 1 104 ? 14.454 39.370 69.823 1.00 53.38 ? 147 ARG A C 1 ATOM 488 O O . ARG A 1 104 ? 14.992 40.007 70.736 1.00 74.27 ? 147 ARG A O 1 ATOM 489 C CB . ARG A 1 104 ? 12.942 37.463 70.424 1.00 53.19 ? 147 ARG A CB 1 ATOM 490 C CG . ARG A 1 104 ? 13.696 37.205 71.712 1.00 57.71 ? 147 ARG A CG 1 ATOM 491 C CD . ARG A 1 104 ? 13.631 35.740 72.100 1.00 69.32 ? 147 ARG A CD 1 ATOM 492 N NE . ARG A 1 104 ? 14.275 34.888 71.105 1.00 65.22 ? 147 ARG A NE 1 ATOM 493 C CZ . ARG A 1 104 ? 15.586 34.685 71.036 1.00 75.25 ? 147 ARG A CZ 1 ATOM 494 N NH1 . ARG A 1 104 ? 16.399 35.276 71.901 1.00 71.57 1 147 ARG A NH1 1 ATOM 495 N NH2 . ARG A 1 104 ? 16.088 33.893 70.099 1.00 82.00 ? 147 ARG A NH2 1 ATOM 496 N N . ARG A 1 105 ? 15.110 39.042 68.708 1.00 44.87 ? 148 ARG A N 1 ATOM 497 C CA . ARG A 1 105 ? 16.507 39.425 68.555 1.00 42.76 ? 148 ARG A CA 1 ATOM 498 C C . ARG A 1 105 ? 16.679 40.844 68.033 1.00 48.43 ? 148 ARG A C 1 ATOM 499 O O . ARG A 1 105 ? 17.807 41.348 68.026 1.00 54.45 ? 148 ARG A O 1 ATOM 500 C CB . ARG A 1 105 ? 17.241 38.453 67.626 1.00 49.71 ? 148 ARG A CB 1 ATOM 501 C CG . ARG A 1 105 ? 17.350 37.038 68.160 1.00 62.18 ? 148 ARG A CG 1 ATOM 502 C CD . ARG A 1 105 ? 18.132 36.140 67.213 1.00 68.43 ? 148 ARG A CD 1 ATOM 503 N NE . ARG A 1 105 ? 19.470 36.662 66.944 1.00 70.45 ? 148 ARG A NE 1 ATOM 504 C CZ . ARG A 1 105 ? 20.465 35.940 66.437 1.00 76.53 ? 148 ARG A CZ 1 ATOM 505 N NH1 . ARG A 1 105 ? 20.278 34.657 66.153 1.00 51.34 1 148 ARG A NH1 1 ATOM 506 N NH2 . ARG A 1 105 ? 21.651 36.499 66.223 1.00 54.53 ? 148 ARG A NH2 1 ATOM 507 N N . SER A 1 106 ? 15.606 41.495 67.585 1.00 47.49 ? 149 SER A N 1 ATOM 508 C CA . SER A 1 106 ? 15.743 42.836 67.031 1.00 48.65 ? 149 SER A CA 1 ATOM 509 C C . SER A 1 106 ? 14.849 43.857 67.722 1.00 55.63 ? 149 SER A C 1 ATOM 510 O O . SER A 1 106 ? 15.309 44.637 68.563 1.00 49.20 ? 149 SER A O 1 ATOM 511 C CB . SER A 1 106 ? 15.408 42.826 65.541 1.00 58.97 ? 149 SER A CB 1 ATOM 512 O OG . SER A 1 106 ? 14.016 42.622 65.354 1.00 53.10 ? 149 SER A OG 1 ATOM 513 N N . VAL A 1 107 ? 13.557 43.835 67.383 1.00 58.77 ? 150 VAL A N 1 ATOM 514 C CA . VAL A 1 107 ? 12.663 44.909 67.806 1.00 59.63 ? 150 VAL A CA 1 ATOM 515 C C . VAL A 1 107 ? 12.532 44.940 69.320 1.00 55.69 ? 150 VAL A C 1 ATOM 516 O O . VAL A 1 107 ? 12.576 46.011 69.937 1.00 63.80 ? 150 VAL A O 1 ATOM 517 C CB . VAL A 1 107 ? 11.288 44.762 67.130 1.00 69.63 ? 150 VAL A CB 1 ATOM 518 C CG1 . VAL A 1 107 ? 10.321 45.802 67.677 1.00 49.64 ? 150 VAL A CG1 1 ATOM 519 C CG2 . VAL A 1 107 ? 11.420 44.886 65.618 1.00 77.49 ? 150 VAL A CG2 1 ATOM 520 N N . LEU A 1 108 ? 12.376 43.776 69.946 1.00 60.58 ? 151 LEU A N 1 ATOM 521 C CA . LEU A 1 108 ? 12.109 43.729 71.374 1.00 42.61 ? 151 LEU A CA 1 ATOM 522 C C . LEU A 1 108 ? 13.360 43.542 72.215 1.00 52.10 ? 151 LEU A C 1 ATOM 523 O O . LEU A 1 108 ? 13.264 43.550 73.445 1.00 72.63 ? 151 LEU A O 1 ATOM 524 C CB . LEU A 1 108 ? 11.119 42.602 71.677 1.00 50.67 ? 151 LEU A CB 1 ATOM 525 C CG . LEU A 1 108 ? 9.850 42.556 70.826 1.00 44.08 ? 151 LEU A CG 1 ATOM 526 C CD1 . LEU A 1 108 ? 9.079 41.280 71.113 1.00 61.54 ? 151 LEU A CD1 1 ATOM 527 C CD2 . LEU A 1 108 ? 8.980 43.777 71.078 1.00 47.96 ? 151 LEU A CD2 1 ATOM 528 N N . SER A 1 109 ? 14.518 43.353 71.597 1.00 49.96 ? 152 SER A N 1 ATOM 529 C CA . SER A 1 109 ? 15.731 43.123 72.365 1.00 60.87 ? 152 SER A CA 1 ATOM 530 C C . SER A 1 109 ? 15.967 44.345 73.240 1.00 75.00 ? 152 SER A C 1 ATOM 531 O O . SER A 1 109 ? 16.130 45.449 72.699 1.00 59.44 ? 152 SER A O 1 ATOM 532 C CB . SER A 1 109 ? 16.933 42.885 71.456 1.00 68.64 ? 152 SER A CB 1 ATOM 533 O OG . SER A 1 109 ? 17.136 43.981 70.580 1.00 66.44 ? 152 SER A OG 1 ATOM 534 N N . PRO A 1 110 ? 15.954 44.229 74.574 1.00 83.10 ? 153 PRO A N 1 ATOM 535 C CA . PRO A 1 110 ? 16.351 45.542 75.066 1.00 79.61 ? 153 PRO A CA 1 ATOM 536 C C . PRO A 1 110 ? 17.851 45.746 74.906 1.00 88.65 ? 153 PRO A C 1 ATOM 537 O O . PRO A 1 110 ? 18.611 44.856 75.294 1.00 88.14 ? 153 PRO A O 1 ATOM 538 C CB . PRO A 1 110 ? 15.964 45.477 76.540 1.00 71.03 ? 153 PRO A CB 1 ATOM 539 C CG . PRO A 1 110 ? 16.231 44.025 76.895 1.00 61.58 ? 153 PRO A CG 1 ATOM 540 C CD . PRO A 1 110 ? 15.885 43.221 75.647 1.00 71.88 ? 153 PRO A CD 1 ATOM 541 N N . SER A 1 111 ? 18.280 46.882 74.364 1.00 68.39 ? 154 SER A N 1 ATOM 542 C CA . SER A 1 111 ? 17.419 47.821 73.647 1.00 70.73 ? 154 SER A CA 1 ATOM 543 C C . SER A 1 111 ? 18.362 48.576 72.715 1.00 63.75 ? 154 SER A C 1 ATOM 544 O O . SER A 1 111 ? 19.553 48.649 73.020 1.00 61.66 ? 154 SER A O 1 ATOM 545 C CB . SER A 1 111 ? 16.684 48.760 74.602 1.00 88.25 ? 154 SER A CB 1 ATOM 546 O OG . SER A 1 111 ? 15.496 48.164 75.099 1.00 88.40 ? 154 SER A OG 1 ATOM 547 N N . GLU A 1 112 ? 17.907 49.104 71.575 1.00 64.47 ? 155 GLU A N 1 ATOM 548 C CA . GLU A 1 112 ? 16.576 48.940 70.980 1.00 59.43 ? 155 GLU A CA 1 ATOM 549 C C . GLU A 1 112 ? 15.394 49.490 71.774 1.00 55.80 ? 155 GLU A C 1 ATOM 550 O O . GLU A 1 112 ? 15.365 50.677 72.090 1.00 74.15 ? 155 GLU A O 1 ATOM 551 C CB . GLU A 1 112 ? 16.333 47.467 70.657 1.00 77.55 ? 155 GLU A CB 1 ATOM 552 C CG . GLU A 1 112 ? 17.365 46.882 69.693 1.00 83.13 ? 155 GLU A CG 1 ATOM 553 C CD . GLU A 1 112 ? 17.680 47.812 68.527 1.00 83.59 ? 155 GLU A CD 1 ATOM 554 O OE1 . GLU A 1 112 ? 16.798 48.606 68.135 1.00 79.53 ? 155 GLU A OE1 1 ATOM 555 O OE2 . GLU A 1 112 ? 18.814 47.751 68.006 1.00 87.15 -1 155 GLU A OE2 1 ATOM 556 N N . ALA A 1 113 ? 14.430 48.621 72.090 1.00 69.17 ? 156 ALA A N 1 ATOM 557 C CA . ALA A 1 113 ? 13.089 49.074 72.464 1.00 72.25 ? 156 ALA A CA 1 ATOM 558 C C . ALA A 1 113 ? 13.130 50.231 73.457 1.00 63.61 ? 156 ALA A C 1 ATOM 559 O O . ALA A 1 113 ? 12.465 51.255 73.262 1.00 61.11 ? 156 ALA A O 1 ATOM 560 C CB . ALA A 1 113 ? 12.287 47.904 73.037 1.00 57.46 ? 156 ALA A CB 1 ATOM 561 N N . CYS A 1 114 ? 13.912 50.091 74.527 1.00 65.73 ? 157 CYS A N 1 ATOM 562 C CA . CYS A 1 114 ? 14.040 51.194 75.472 1.00 65.95 ? 157 CYS A CA 1 ATOM 563 C C . CYS A 1 114 ? 14.665 52.411 74.800 1.00 70.77 ? 157 CYS A C 1 ATOM 564 O O . CYS A 1 114 ? 14.202 53.541 74.991 1.00 75.39 ? 157 CYS A O 1 ATOM 565 C CB . CYS A 1 114 ? 14.851 50.748 76.688 1.00 55.05 ? 157 CYS A CB 1 ATOM 566 S SG . CYS A 1 114 ? 14.048 49.401 77.598 1.00 87.26 ? 157 CYS A SG 1 ATOM 567 N N . GLY A 1 115 ? 15.703 52.198 73.987 1.00 67.87 ? 158 GLY A N 1 ATOM 568 C CA . GLY A 1 115 ? 16.238 53.277 73.176 1.00 66.58 ? 158 GLY A CA 1 ATOM 569 C C . GLY A 1 115 ? 15.220 53.903 72.246 1.00 52.58 ? 158 GLY A C 1 ATOM 570 O O . GLY A 1 115 ? 15.412 55.039 71.800 1.00 59.91 ? 158 GLY A O 1 ATOM 571 N N . LEU A 1 116 ? 14.149 53.178 71.918 1.00 54.34 ? 159 LEU A N 1 ATOM 572 C CA . LEU A 1 116 ? 13.071 53.769 71.134 1.00 54.10 ? 159 LEU A CA 1 ATOM 573 C C . LEU A 1 116 ? 12.161 54.625 72.003 1.00 58.66 ? 159 LEU A C 1 ATOM 574 O O . LEU A 1 116 ? 11.841 55.765 71.647 1.00 60.97 ? 159 LEU A O 1 ATOM 575 C CB . LEU A 1 116 ? 12.253 52.679 70.443 1.00 54.19 ? 159 LEU A CB 1 ATOM 576 C CG . LEU A 1 116 ? 11.192 53.224 69.482 1.00 60.83 ? 159 LEU A CG 1 ATOM 577 C CD1 . LEU A 1 116 ? 11.814 53.534 68.126 1.00 51.07 ? 159 LEU A CD1 1 ATOM 578 C CD2 . LEU A 1 116 ? 10.000 52.288 69.344 1.00 50.95 ? 159 LEU A CD2 1 ATOM 579 N N . LEU A 1 117 ? 11.739 54.091 73.153 1.00 63.28 ? 160 LEU A N 1 ATOM 580 C CA . LEU A 1 117 ? 10.777 54.795 73.995 1.00 64.00 ? 160 LEU A CA 1 ATOM 581 C C . LEU A 1 117 ? 11.432 55.901 74.815 1.00 67.20 ? 160 LEU A C 1 ATOM 582 O O . LEU A 1 117 ? 10.769 56.883 75.166 1.00 71.19 ? 160 LEU A O 1 ATOM 583 C CB . LEU A 1 117 ? 10.067 53.808 74.920 1.00 60.89 ? 160 LEU A CB 1 ATOM 584 C CG . LEU A 1 117 ? 9.342 52.659 74.216 1.00 56.54 ? 160 LEU A CG 1 ATOM 585 C CD1 . LEU A 1 117 ? 9.999 51.332 74.557 1.00 51.72 ? 160 LEU A CD1 1 ATOM 586 C CD2 . LEU A 1 117 ? 7.869 52.642 74.583 1.00 44.55 ? 160 LEU A CD2 1 ATOM 587 N N . LEU A 1 118 ? 12.715 55.755 75.138 1.00 64.53 ? 161 LEU A N 1 ATOM 588 C CA . LEU A 1 118 ? 13.466 56.782 75.839 1.00 60.20 ? 161 LEU A CA 1 ATOM 589 C C . LEU A 1 118 ? 14.534 57.391 74.940 1.00 78.63 ? 161 LEU A C 1 ATOM 590 O O . LEU A 1 118 ? 14.465 58.581 74.613 1.00 107.83 ? 161 LEU A O 1 ATOM 591 C CB . LEU A 1 118 ? 14.089 56.203 77.117 1.00 69.52 ? 161 LEU A CB 1 ATOM 592 C CG . LEU A 1 118 ? 13.177 55.300 77.964 1.00 64.72 ? 161 LEU A CG 1 ATOM 593 C CD1 . LEU A 1 118 ? 13.827 54.957 79.297 1.00 71.40 ? 161 LEU A CD1 1 ATOM 594 C CD2 . LEU A 1 118 ? 11.797 55.920 78.181 1.00 41.92 ? 161 LEU A CD2 1 ATOM 595 N N . GLY A 1 119 ? 15.519 56.605 74.521 1.00 65.01 ? 162 GLY A N 1 ATOM 596 C CA . GLY A 1 119 ? 16.467 57.045 73.520 1.00 71.45 ? 162 GLY A CA 1 ATOM 597 C C . GLY A 1 119 ? 17.692 57.694 74.136 1.00 78.69 ? 162 GLY A C 1 ATOM 598 O O . GLY A 1 119 ? 17.670 58.194 75.260 1.00 95.23 ? 162 GLY A O 1 ATOM 599 N N . SER A 1 120 ? 18.787 57.691 73.371 1.00 70.29 ? 163 SER A N 1 ATOM 600 C CA . SER A 1 120 ? 19.963 58.397 73.858 1.00 89.84 ? 163 SER A CA 1 ATOM 601 C C . SER A 1 120 ? 20.339 57.841 75.224 1.00 100.13 ? 163 SER A C 1 ATOM 602 O O . SER A 1 120 ? 20.902 56.746 75.321 1.00 100.51 ? 163 SER A O 1 ATOM 603 C CB . SER A 1 120 ? 19.711 59.904 73.913 1.00 127.67 ? 163 SER A CB 1 ATOM 604 O OG . SER A 1 120 ? 19.610 60.444 72.606 1.00 105.61 ? 163 SER A OG 1 ATOM 605 N N . THR A 1 121 ? 20.055 58.607 76.278 1.00 91.09 ? 164 THR A N 1 ATOM 606 C CA . THR A 1 121 ? 20.418 58.243 77.641 1.00 86.21 ? 164 THR A CA 1 ATOM 607 C C . THR A 1 121 ? 20.166 56.768 77.934 1.00 94.45 ? 164 THR A C 1 ATOM 608 O O . THR A 1 121 ? 20.978 56.120 78.602 1.00 96.14 ? 164 THR A O 1 ATOM 609 C CB . THR A 1 121 ? 19.619 59.090 78.637 1.00 96.46 ? 164 THR A CB 1 ATOM 610 O OG1 . THR A 1 121 ? 18.218 58.842 78.455 1.00 91.55 ? 164 THR A OG1 1 ATOM 611 C CG2 . THR A 1 121 ? 19.886 60.570 78.422 1.00 95.13 ? 164 THR A CG2 1 ATOM 612 N N . CYS A 1 122 ? 19.050 56.224 77.449 1.00 89.00 ? 165 CYS A N 1 ATOM 613 C CA . CYS A 1 122 ? 18.706 54.820 77.657 1.00 84.49 ? 165 CYS A CA 1 ATOM 614 C C . CYS A 1 122 ? 18.532 54.147 76.300 1.00 99.78 ? 165 CYS A C 1 ATOM 615 O O . CYS A 1 122 ? 17.589 54.461 75.566 1.00 109.40 ? 165 CYS A O 1 ATOM 616 C CB . CYS A 1 122 ? 17.439 54.701 78.503 1.00 84.87 ? 165 CYS A CB 1 ATOM 617 S SG . CYS A 1 122 ? 17.087 53.059 79.175 1.00 123.37 ? 165 CYS A SG 1 ATOM 618 N N . GLY A 1 123 ? 19.438 53.227 75.966 1.00 94.02 ? 166 GLY A N 1 ATOM 619 C CA . GLY A 1 123 ? 19.336 52.451 74.741 1.00 91.21 ? 166 GLY A CA 1 ATOM 620 C C . GLY A 1 123 ? 19.624 53.201 73.453 1.00 84.32 ? 166 GLY A C 1 ATOM 621 O O . GLY A 1 123 ? 19.705 54.434 73.445 1.00 87.79 ? 166 GLY A O 1 ATOM 622 N N . HIS A 1 124 ? 19.781 52.461 72.355 1.00 73.98 ? 167 HIS A N 1 ATOM 623 C CA . HIS A 1 124 ? 20.020 53.036 71.035 1.00 88.22 ? 167 HIS A CA 1 ATOM 624 C C . HIS A 1 124 ? 19.249 52.242 69.990 1.00 71.91 ? 167 HIS A C 1 ATOM 625 O O . HIS A 1 124 ? 19.418 51.023 69.892 1.00 78.59 ? 167 HIS A O 1 ATOM 626 C CB . HIS A 1 124 ? 21.516 53.036 70.698 1.00 85.51 ? 167 HIS A CB 1 ATOM 627 C CG . HIS A 1 124 ? 21.833 53.631 69.362 1.00 98.81 ? 167 HIS A CG 1 ATOM 628 N ND1 . HIS A 1 124 ? 22.732 53.061 68.486 1.00 102.99 ? 167 HIS A ND1 1 ATOM 629 C CD2 . HIS A 1 124 ? 21.378 54.754 68.755 1.00 92.70 ? 167 HIS A CD2 1 ATOM 630 C CE1 . HIS A 1 124 ? 22.812 53.802 67.395 1.00 100.96 ? 167 HIS A CE1 1 ATOM 631 N NE2 . HIS A 1 124 ? 22.001 54.835 67.534 1.00 100.99 ? 167 HIS A NE2 1 ATOM 632 N N . TRP A 1 125 ? 18.429 52.929 69.193 1.00 64.59 ? 168 TRP A N 1 ATOM 633 C CA . TRP A 1 125 ? 17.596 52.286 68.177 1.00 72.86 ? 168 TRP A CA 1 ATOM 634 C C . TRP A 1 125 ? 18.254 52.489 66.814 1.00 75.42 ? 168 TRP A C 1 ATOM 635 O O . TRP A 1 125 ? 18.194 53.578 66.239 1.00 79.33 ? 168 TRP A O 1 ATOM 636 C CB . TRP A 1 125 ? 16.187 52.871 68.224 1.00 62.73 ? 168 TRP A CB 1 ATOM 637 C CG . TRP A 1 125 ? 15.304 52.528 67.061 1.00 78.21 ? 168 TRP A CG 1 ATOM 638 C CD1 . TRP A 1 125 ? 15.323 53.099 65.821 1.00 81.47 ? 168 TRP A CD1 1 ATOM 639 C CD2 . TRP A 1 125 ? 14.241 51.565 67.040 1.00 76.43 ? 168 TRP A CD2 1 ATOM 640 N NE1 . TRP A 1 125 ? 14.353 52.539 65.026 1.00 82.82 ? 168 TRP A NE1 1 ATOM 641 C CE2 . TRP A 1 125 ? 13.674 51.596 65.752 1.00 72.11 ? 168 TRP A CE2 1 ATOM 642 C CE3 . TRP A 1 125 ? 13.720 50.676 67.983 1.00 80.47 ? 168 TRP A CE3 1 ATOM 643 C CZ2 . TRP A 1 125 ? 12.614 50.772 65.383 1.00 59.23 ? 168 TRP A CZ2 1 ATOM 644 C CZ3 . TRP A 1 125 ? 12.667 49.858 67.613 1.00 71.61 ? 168 TRP A CZ3 1 ATOM 645 C CH2 . TRP A 1 125 ? 12.126 49.912 66.326 1.00 51.26 ? 168 TRP A CH2 1 ATOM 646 N N . ASP A 1 126 ? 18.885 51.431 66.301 1.00 80.13 ? 169 ASP A N 1 ATOM 647 C CA . ASP A 1 126 ? 19.585 51.452 65.021 1.00 85.03 ? 169 ASP A CA 1 ATOM 648 C C . ASP A 1 126 ? 18.829 50.789 63.870 1.00 80.01 ? 169 ASP A C 1 ATOM 649 O O . ASP A 1 126 ? 19.379 50.703 62.768 1.00 83.63 ? 169 ASP A O 1 ATOM 650 C CB . ASP A 1 126 ? 20.965 50.803 65.176 1.00 86.05 ? 169 ASP A CB 1 ATOM 651 C CG . ASP A 1 126 ? 20.896 49.419 65.787 1.00 88.31 ? 169 ASP A CG 1 ATOM 652 O OD1 . ASP A 1 126 ? 19.833 48.771 65.684 1.00 101.14 ? 169 ASP A OD1 1 ATOM 653 O OD2 . ASP A 1 126 ? 21.908 48.981 66.375 1.00 71.52 -1 169 ASP A OD2 1 ATOM 654 N N . ILE A 1 127 ? 17.604 50.301 64.090 1.00 81.16 ? 170 ILE A N 1 ATOM 655 C CA . ILE A 1 127 ? 16.938 49.470 63.089 1.00 65.61 ? 170 ILE A CA 1 ATOM 656 C C . ILE A 1 127 ? 16.880 50.194 61.750 1.00 69.31 ? 170 ILE A C 1 ATOM 657 O O . ILE A 1 127 ? 16.375 51.317 61.653 1.00 68.56 ? 170 ILE A O 1 ATOM 658 C CB . ILE A 1 127 ? 15.529 49.076 63.566 1.00 68.62 ? 170 ILE A CB 1 ATOM 659 C CG1 . ILE A 1 127 ? 15.606 48.146 64.782 1.00 73.50 ? 170 ILE A CG1 1 ATOM 660 C CG2 . ILE A 1 127 ? 14.751 48.424 62.431 1.00 63.27 ? 170 ILE A CG2 1 ATOM 661 C CD1 . ILE A 1 127 ? 16.511 46.949 64.591 1.00 71.44 ? 170 ILE A CD1 1 ATOM 662 N N . PHE A 1 128 ? 17.377 49.530 60.703 1.00 66.31 ? 171 PHE A N 1 ATOM 663 C CA . PHE A 1 128 ? 17.415 50.092 59.350 1.00 59.21 ? 171 PHE A CA 1 ATOM 664 C C . PHE A 1 128 ? 18.160 51.425 59.317 1.00 65.54 ? 171 PHE A C 1 ATOM 665 O O . PHE A 1 128 ? 17.777 52.356 58.607 1.00 56.21 ? 171 PHE A O 1 ATOM 666 C CB . PHE A 1 128 ? 16.008 50.240 58.769 1.00 43.69 ? 171 PHE A CB 1 ATOM 667 C CG . PHE A 1 128 ? 15.364 48.935 58.407 1.00 56.61 ? 171 PHE A CG 1 ATOM 668 C CD1 . PHE A 1 128 ? 16.135 47.855 58.007 1.00 54.79 ? 171 PHE A CD1 1 ATOM 669 C CD2 . PHE A 1 128 ? 13.988 48.785 58.465 1.00 67.49 ? 171 PHE A CD2 1 ATOM 670 C CE1 . PHE A 1 128 ? 15.544 46.648 57.672 1.00 55.01 ? 171 PHE A CE1 1 ATOM 671 C CE2 . PHE A 1 128 ? 13.391 47.580 58.132 1.00 59.04 ? 171 PHE A CE2 1 ATOM 672 C CZ . PHE A 1 128 ? 14.170 46.511 57.736 1.00 47.22 ? 171 PHE A CZ 1 ATOM 673 N N . SER A 1 129 ? 19.240 51.512 60.085 1.00 69.84 ? 172 SER A N 1 ATOM 674 C CA . SER A 1 129 ? 20.048 52.719 60.115 1.00 70.46 ? 172 SER A CA 1 ATOM 675 C C . SER A 1 129 ? 20.881 52.838 58.841 1.00 66.06 ? 172 SER A C 1 ATOM 676 O O . SER A 1 129 ? 21.078 51.873 58.099 1.00 63.23 ? 172 SER A O 1 ATOM 677 C CB . SER A 1 129 ? 20.963 52.727 61.339 1.00 77.87 ? 172 SER A CB 1 ATOM 678 O OG . SER A 1 129 ? 21.981 51.748 61.222 1.00 84.45 ? 172 SER A OG 1 ATOM 679 N N . SER A 1 130 ? 21.346 54.056 58.580 1.00 70.99 ? 173 SER A N 1 ATOM 680 C CA . SER A 1 130 ? 22.199 54.311 57.429 1.00 58.61 ? 173 SER A CA 1 ATOM 681 C C . SER A 1 130 ? 23.552 53.619 57.578 1.00 54.81 ? 173 SER A C 1 ATOM 682 O O . SER A 1 130 ? 24.033 53.374 58.687 1.00 84.12 ? 173 SER A O 1 ATOM 683 C CB . SER A 1 130 ? 22.401 55.816 57.256 1.00 59.17 ? 173 SER A CB 1 ATOM 684 O OG . SER A 1 130 ? 23.564 56.098 56.502 1.00 91.06 ? 173 SER A OG 1 ATOM 685 N N . TRP A 1 131 ? 24.166 53.305 56.437 1.00 60.92 ? 174 TRP A N 1 ATOM 686 C CA . TRP A 1 131 ? 25.508 52.737 56.396 1.00 62.52 ? 174 TRP A CA 1 ATOM 687 C C . TRP A 1 131 ? 26.105 52.988 55.016 1.00 78.64 ? 174 TRP A C 1 ATOM 688 O O . TRP A 1 131 ? 25.384 53.257 54.051 1.00 67.43 ? 174 TRP A O 1 ATOM 689 C CB . TRP A 1 131 ? 25.499 51.243 56.736 1.00 52.90 ? 174 TRP A CB 1 ATOM 690 C CG . TRP A 1 131 ? 24.385 50.474 56.092 1.00 63.81 ? 174 TRP A CG 1 ATOM 691 C CD1 . TRP A 1 131 ? 23.110 50.331 56.560 1.00 60.77 ? 174 TRP A CD1 1 ATOM 692 C CD2 . TRP A 1 131 ? 24.444 49.743 54.861 1.00 66.10 ? 174 TRP A CD2 1 ATOM 693 N NE1 . TRP A 1 131 ? 22.373 49.555 55.698 1.00 57.34 ? 174 TRP A NE1 1 ATOM 694 C CE2 . TRP A 1 131 ? 23.169 49.182 54.647 1.00 67.58 ? 174 TRP A CE2 1 ATOM 695 C CE3 . TRP A 1 131 ? 25.452 49.508 53.921 1.00 54.93 ? 174 TRP A CE3 1 ATOM 696 C CZ2 . TRP A 1 131 ? 22.876 48.401 53.531 1.00 64.36 ? 174 TRP A CZ2 1 ATOM 697 C CZ3 . TRP A 1 131 ? 25.160 48.733 52.814 1.00 53.71 ? 174 TRP A CZ3 1 ATOM 698 C CH2 . TRP A 1 131 ? 23.882 48.188 52.629 1.00 55.68 ? 174 TRP A CH2 1 ATOM 699 N N . ASN A 1 132 ? 27.436 52.905 54.935 1.00 67.82 ? 175 ASN A N 1 ATOM 700 C CA . ASN A 1 132 ? 28.155 53.176 53.696 1.00 68.89 ? 175 ASN A CA 1 ATOM 701 C C . ASN A 1 132 ? 29.283 52.163 53.524 1.00 64.25 ? 175 ASN A C 1 ATOM 702 O O . ASN A 1 132 ? 29.859 51.686 54.504 1.00 69.41 ? 175 ASN A O 1 ATOM 703 C CB . ASN A 1 132 ? 28.676 54.622 53.689 1.00 86.34 ? 175 ASN A CB 1 ATOM 704 C CG . ASN A 1 132 ? 27.590 55.619 54.070 1.00 99.10 ? 175 ASN A CG 1 ATOM 705 O OD1 . ASN A 1 132 ? 27.438 55.961 55.244 1.00 107.45 ? 175 ASN A OD1 1 ATOM 706 N ND2 . ASN A 1 132 ? 26.820 56.076 53.085 1.00 99.87 ? 175 ASN A ND2 1 ATOM 707 N N . ILE A 1 133 ? 29.580 51.824 52.264 1.00 74.17 ? 176 ILE A N 1 ATOM 708 C CA . ILE A 1 133 ? 30.472 50.703 51.959 1.00 76.14 ? 176 ILE A CA 1 ATOM 709 C C . ILE A 1 133 ? 31.936 51.087 51.718 1.00 86.31 ? 176 ILE A C 1 ATOM 710 O O . ILE A 1 133 ? 32.788 50.185 51.652 1.00 87.03 ? 176 ILE A O 1 ATOM 711 C CB . ILE A 1 133 ? 29.943 49.897 50.753 1.00 95.85 ? 176 ILE A CB 1 ATOM 712 C CG1 . ILE A 1 133 ? 30.726 48.592 50.610 1.00 80.20 ? 176 ILE A CG1 1 ATOM 713 C CG2 . ILE A 1 133 ? 30.015 50.728 49.476 1.00 89.85 ? 176 ILE A CG2 1 ATOM 714 C CD1 . ILE A 1 133 ? 30.784 47.787 51.891 1.00 77.60 ? 176 ILE A CD1 1 ATOM 715 N N . SER A 1 134 ? 32.263 52.374 51.587 1.00 78.61 ? 177 SER A N 1 ATOM 716 C CA . SER A 1 134 ? 33.669 52.772 51.488 1.00 83.71 ? 177 SER A CA 1 ATOM 717 C C . SER A 1 134 ? 34.426 52.176 50.297 1.00 79.81 ? 177 SER A C 1 ATOM 718 O O . SER A 1 134 ? 35.178 51.209 50.456 1.00 88.48 ? 177 SER A O 1 ATOM 719 C CB . SER A 1 134 ? 34.409 52.410 52.779 1.00 92.53 ? 177 SER A CB 1 ATOM 720 O OG . SER A 1 134 ? 34.579 51.009 52.900 1.00 97.55 ? 177 SER A OG 1 ATOM 721 N N . LEU A 1 135 ? 34.205 52.718 49.096 1.00 77.82 ? 178 LEU A N 1 ATOM 722 C CA . LEU A 1 135 ? 34.958 52.303 47.914 1.00 77.06 ? 178 LEU A CA 1 ATOM 723 C C . LEU A 1 135 ? 36.466 52.440 48.138 1.00 75.10 ? 178 LEU A C 1 ATOM 724 O O . LEU A 1 135 ? 36.913 53.216 48.987 1.00 89.69 ? 178 LEU A O 1 ATOM 725 C CB . LEU A 1 135 ? 34.551 53.139 46.703 1.00 41.30 ? 178 LEU A CB 1 ATOM 726 C CG . LEU A 1 135 ? 33.056 53.409 46.556 1.00 47.66 ? 178 LEU A CG 1 ATOM 727 C CD1 . LEU A 1 135 ? 32.787 54.396 45.437 1.00 48.19 ? 178 LEU A CD1 1 ATOM 728 C CD2 . LEU A 1 135 ? 32.314 52.103 46.322 1.00 67.64 ? 178 LEU A CD2 1 ATOM 729 N N . PRO A 1 136 ? 37.271 51.698 47.377 1.00 71.60 ? 179 PRO A N 1 ATOM 730 C CA . PRO A 1 136 ? 38.728 51.797 47.517 1.00 65.62 ? 179 PRO A CA 1 ATOM 731 C C . PRO A 1 136 ? 39.253 53.144 47.042 1.00 72.99 ? 179 PRO A C 1 ATOM 732 O O . PRO A 1 136 ? 38.579 53.900 46.339 1.00 79.03 ? 179 PRO A O 1 ATOM 733 C CB . PRO A 1 136 ? 39.249 50.662 46.632 1.00 72.53 ? 179 PRO A CB 1 ATOM 734 C CG . PRO A 1 136 ? 38.198 50.504 45.592 1.00 58.36 ? 179 PRO A CG 1 ATOM 735 C CD . PRO A 1 136 ? 36.884 50.794 46.280 1.00 71.55 ? 179 PRO A CD 1 ATOM 736 N N . THR A 1 137 ? 40.492 53.432 47.440 1.00 79.87 ? 180 THR A N 1 ATOM 737 C CA . THR A 1 137 ? 41.115 54.729 47.203 1.00 87.55 ? 180 THR A CA 1 ATOM 738 C C . THR A 1 137 ? 41.597 54.930 45.770 1.00 78.25 ? 180 THR A C 1 ATOM 739 O O . THR A 1 137 ? 42.045 56.034 45.440 1.00 85.16 ? 180 THR A O 1 ATOM 740 C CB . THR A 1 137 ? 42.297 54.920 48.158 1.00 94.04 ? 180 THR A CB 1 ATOM 741 O OG1 . THR A 1 137 ? 43.234 53.850 47.979 1.00 90.38 ? 180 THR A OG1 1 ATOM 742 C CG2 . THR A 1 137 ? 41.819 54.936 49.603 1.00 69.06 ? 180 THR A CG2 1 ATOM 743 N N . VAL A 1 138 ? 41.530 53.907 44.922 1.00 65.91 ? 181 VAL A N 1 ATOM 744 C CA . VAL A 1 138 ? 42.017 54.050 43.543 1.00 74.21 ? 181 VAL A CA 1 ATOM 745 C C . VAL A 1 138 ? 41.291 55.204 42.859 1.00 64.53 ? 181 VAL A C 1 ATOM 746 O O . VAL A 1 138 ? 40.045 55.265 42.898 1.00 59.44 ? 181 VAL A O 1 ATOM 747 C CB . VAL A 1 138 ? 41.820 52.740 42.763 1.00 68.75 ? 181 VAL A CB 1 ATOM 748 C CG1 . VAL A 1 138 ? 42.414 52.861 41.369 1.00 58.70 ? 181 VAL A CG1 1 ATOM 749 C CG2 . VAL A 1 138 ? 42.440 51.576 43.520 1.00 60.09 ? 181 VAL A CG2 1 ATOM 750 N N . PRO A 1 139 ? 41.997 56.131 42.213 1.00 62.13 ? 182 PRO A N 1 ATOM 751 C CA . PRO A 1 139 ? 41.311 57.264 41.580 1.00 66.31 ? 182 PRO A CA 1 ATOM 752 C C . PRO A 1 139 ? 40.495 56.813 40.379 1.00 60.35 ? 182 PRO A C 1 ATOM 753 O O . PRO A 1 139 ? 40.925 55.967 39.591 1.00 61.30 ? 182 PRO A O 1 ATOM 754 C CB . PRO A 1 139 ? 42.461 58.185 41.160 1.00 75.63 ? 182 PRO A CB 1 ATOM 755 C CG . PRO A 1 139 ? 43.620 57.259 40.972 1.00 72.72 ? 182 PRO A CG 1 ATOM 756 C CD . PRO A 1 139 ? 43.455 56.181 42.010 1.00 52.94 ? 182 PRO A CD 1 ATOM 757 N N . LYS A 1 140 ? 39.311 57.391 40.245 1.00 50.65 ? 183 LYS A N 1 ATOM 758 C CA . LYS A 1 140 ? 38.393 56.971 39.196 1.00 55.02 ? 183 LYS A CA 1 ATOM 759 C C . LYS A 1 140 ? 38.947 57.339 37.825 1.00 61.78 ? 183 LYS A C 1 ATOM 760 O O . LYS A 1 140 ? 39.303 58.501 37.597 1.00 65.38 ? 183 LYS A O 1 ATOM 761 C CB . LYS A 1 140 ? 37.026 57.617 39.393 1.00 49.76 ? 183 LYS A CB 1 ATOM 762 C CG . LYS A 1 140 ? 36.017 57.271 38.317 1.00 47.14 ? 183 LYS A CG 1 ATOM 763 C CD . LYS A 1 140 ? 34.682 57.939 38.600 1.00 56.22 ? 183 LYS A CD 1 ATOM 764 C CE . LYS A 1 140 ? 33.652 57.601 37.538 1.00 59.35 ? 183 LYS A CE 1 ATOM 765 N NZ . LYS A 1 140 ? 32.358 58.280 37.808 1.00 58.46 1 183 LYS A NZ 1 ATOM 766 N N . PRO A 1 141 ? 39.046 56.389 36.893 1.00 71.53 ? 184 PRO A N 1 ATOM 767 C CA . PRO A 1 141 ? 39.478 56.743 35.546 1.00 63.96 ? 184 PRO A CA 1 ATOM 768 C C . PRO A 1 141 ? 38.455 57.642 34.881 1.00 72.35 ? 184 PRO A C 1 ATOM 769 O O . PRO A 1 141 ? 37.256 57.596 35.210 1.00 64.41 ? 184 PRO A O 1 ATOM 770 C CB . PRO A 1 141 ? 39.579 55.380 34.837 1.00 53.23 ? 184 PRO A CB 1 ATOM 771 C CG . PRO A 1 141 ? 38.691 54.474 35.621 1.00 55.61 ? 184 PRO A CG 1 ATOM 772 C CD . PRO A 1 141 ? 38.784 54.947 37.041 1.00 70.82 ? 184 PRO A CD 1 ATOM 773 N N . PRO A 1 142 ? 38.875 58.484 33.942 1.00 74.30 ? 185 PRO A N 1 ATOM 774 C CA . PRO A 1 142 ? 37.935 59.401 33.285 1.00 82.93 ? 185 PRO A CA 1 ATOM 775 C C . PRO A 1 142 ? 36.903 58.633 32.481 1.00 91.45 ? 185 PRO A C 1 ATOM 776 O O . PRO A 1 142 ? 37.244 57.679 31.764 1.00 67.32 ? 185 PRO A O 1 ATOM 777 C CB . PRO A 1 142 ? 38.841 60.243 32.376 1.00 71.12 ? 185 PRO A CB 1 ATOM 778 C CG . PRO A 1 142 ? 40.027 59.372 32.122 1.00 79.17 ? 185 PRO A CG 1 ATOM 779 C CD . PRO A 1 142 ? 40.236 58.588 33.387 1.00 69.19 ? 185 PRO A CD 1 ATOM 780 N N . PRO A 1 143 ? 35.628 59.011 32.573 1.00 94.62 ? 186 PRO A N 1 ATOM 781 C CA . PRO A 1 143 ? 34.589 58.255 31.861 1.00 82.07 ? 186 PRO A CA 1 ATOM 782 C C . PRO A 1 143 ? 34.809 58.301 30.356 1.00 77.01 ? 186 PRO A C 1 ATOM 783 O O . PRO A 1 143 ? 34.923 59.374 29.762 1.00 81.58 ? 186 PRO A O 1 ATOM 784 C CB . PRO A 1 143 ? 33.293 58.969 32.263 1.00 81.56 ? 186 PRO A CB 1 ATOM 785 C CG . PRO A 1 143 ? 33.629 59.687 33.539 1.00 75.43 ? 186 PRO A CG 1 ATOM 786 C CD . PRO A 1 143 ? 35.064 60.093 33.398 1.00 80.03 ? 186 PRO A CD 1 ATOM 787 N N . LYS A 1 144 ? 34.876 57.119 29.745 1.00 83.21 ? 187 LYS A N 1 ATOM 788 C CA . LYS A 1 144 ? 34.908 56.967 28.293 1.00 66.76 ? 187 LYS A CA 1 ATOM 789 C C . LYS A 1 144 ? 33.728 56.116 27.842 1.00 69.93 ? 187 LYS A C 1 ATOM 790 O O . LYS A 1 144 ? 33.642 54.938 28.231 1.00 84.76 ? 187 LYS A O 1 ATOM 791 C CB . LYS A 1 144 ? 36.225 56.344 27.823 1.00 61.28 ? 187 LYS A CB 1 ATOM 792 C CG . LYS A 1 144 ? 36.472 54.930 28.318 1.00 70.20 ? 187 LYS A CG 1 ATOM 793 C CD . LYS A 1 144 ? 37.241 54.130 27.283 1.00 75.34 ? 187 LYS A CD 1 ATOM 794 C CE . LYS A 1 144 ? 38.363 54.955 26.674 1.00 62.59 ? 187 LYS A CE 1 ATOM 795 N NZ . LYS A 1 144 ? 39.067 54.215 25.590 1.00 75.28 1 187 LYS A NZ 1 ATOM 796 N N . PRO A 1 145 ? 32.800 56.638 27.037 1.00 78.23 ? 188 PRO A N 1 ATOM 797 C CA . PRO A 1 145 ? 31.711 55.796 26.547 1.00 77.82 ? 188 PRO A CA 1 ATOM 798 C C . PRO A 1 145 ? 32.224 54.759 25.563 1.00 69.91 ? 188 PRO A C 1 ATOM 799 O O . PRO A 1 145 ? 33.232 54.983 24.872 1.00 78.33 ? 188 PRO A O 1 ATOM 800 C CB . PRO A 1 145 ? 30.764 56.801 25.868 1.00 74.59 ? 188 PRO A CB 1 ATOM 801 C CG . PRO A 1 145 ? 31.660 57.915 25.445 1.00 65.58 ? 188 PRO A CG 1 ATOM 802 C CD . PRO A 1 145 ? 32.720 58.014 26.515 1.00 71.24 ? 188 PRO A CD 1 ATOM 803 N N . PRO A 1 146 ? 31.564 53.605 25.469 1.00 55.43 ? 189 PRO A N 1 ATOM 804 C CA . PRO A 1 146 ? 31.997 52.575 24.515 1.00 75.05 ? 189 PRO A CA 1 ATOM 805 C C . PRO A 1 146 ? 31.689 52.943 23.069 1.00 78.17 ? 189 PRO A C 1 ATOM 806 O O . PRO A 1 146 ? 30.717 53.640 22.768 1.00 75.48 ? 189 PRO A O 1 ATOM 807 C CB . PRO A 1 146 ? 31.206 51.334 24.947 1.00 64.73 ? 189 PRO A CB 1 ATOM 808 C CG . PRO A 1 146 ? 30.011 51.872 25.656 1.00 57.96 ? 189 PRO A CG 1 ATOM 809 C CD . PRO A 1 146 ? 30.415 53.176 26.283 1.00 56.57 ? 189 PRO A CD 1 ATOM 810 N N . SER A 1 147 ? 32.575 52.452 22.139 1.00 72.56 ? 190 SER A N 1 ATOM 811 C CA . SER A 1 147 ? 32.515 52.653 20.698 1.00 68.81 ? 190 SER A CA 1 ATOM 812 C C . SER A 1 147 ? 31.727 51.536 20.011 1.00 65.03 ? 190 SER A C 1 ATOM 813 O O . SER A 1 147 ? 31.736 50.386 20.465 1.00 57.17 ? 190 SER A O 1 ATOM 814 C CB . SER A 1 147 ? 33.922 52.723 20.115 1.00 76.98 ? 190 SER A CB 1 ATOM 815 O OG . SER A 1 147 ? 34.628 53.834 20.640 1.00 82.30 ? 190 SER A OG 1 ATOM 816 N N . PRO A 1 148 ? 31.045 51.857 18.914 1.00 53.75 ? 191 PRO A N 1 ATOM 817 C CA . PRO A 1 148 ? 30.293 50.838 18.163 1.00 42.95 ? 191 PRO A CA 1 ATOM 818 C C . PRO A 1 148 ? 31.187 49.688 17.735 1.00 55.09 ? 191 PRO A C 1 ATOM 819 O O . PRO A 1 148 ? 32.352 49.897 17.361 1.00 53.45 ? 191 PRO A O 1 ATOM 820 C CB . PRO A 1 148 ? 29.765 51.615 16.948 1.00 49.37 ? 191 PRO A CB 1 ATOM 821 C CG . PRO A 1 148 ? 29.721 53.036 17.407 1.00 69.30 ? 191 PRO A CG 1 ATOM 822 C CD . PRO A 1 148 ? 30.893 53.200 18.329 1.00 66.79 ? 191 PRO A CD 1 ATOM 823 N N . PRO A 1 149 ? 30.681 48.455 17.783 1.00 48.65 ? 192 PRO A N 1 ATOM 824 C CA . PRO A 1 149 ? 31.511 47.300 17.417 1.00 44.91 ? 192 PRO A CA 1 ATOM 825 C C . PRO A 1 149 ? 31.967 47.365 15.967 1.00 45.13 ? 192 PRO A C 1 ATOM 826 O O . PRO A 1 149 ? 31.214 47.752 15.072 1.00 49.18 ? 192 PRO A O 1 ATOM 827 C CB . PRO A 1 149 ? 30.580 46.105 17.655 1.00 47.50 ? 192 PRO A CB 1 ATOM 828 C CG . PRO A 1 149 ? 29.517 46.618 18.579 1.00 40.97 ? 192 PRO A CG 1 ATOM 829 C CD . PRO A 1 149 ? 29.332 48.054 18.216 1.00 42.00 ? 192 PRO A CD 1 ATOM 830 N N . ALA A 1 150 ? 33.214 46.948 15.742 1.00 56.76 ? 193 ALA A N 1 ATOM 831 C CA . ALA A 1 150 ? 33.780 46.945 14.404 1.00 57.08 ? 193 ALA A CA 1 ATOM 832 C C . ALA A 1 150 ? 32.969 46.031 13.487 1.00 55.81 ? 193 ALA A C 1 ATOM 833 O O . ALA A 1 150 ? 32.284 45.115 13.949 1.00 53.20 ? 193 ALA A O 1 ATOM 834 C CB . ALA A 1 150 ? 35.239 46.494 14.441 1.00 42.66 ? 193 ALA A CB 1 ATOM 835 N N . PRO A 1 151 ? 33.014 46.278 12.179 1.00 74.54 ? 194 PRO A N 1 ATOM 836 C CA . PRO A 1 151 ? 32.287 45.409 11.245 1.00 77.73 ? 194 PRO A CA 1 ATOM 837 C C . PRO A 1 151 ? 32.804 43.981 11.313 1.00 70.62 ? 194 PRO A C 1 ATOM 838 O O . PRO A 1 151 ? 34.000 43.739 11.489 1.00 65.69 ? 194 PRO A O 1 ATOM 839 C CB . PRO A 1 151 ? 32.563 46.043 9.877 1.00 63.04 ? 194 PRO A CB 1 ATOM 840 C CG . PRO A 1 151 ? 33.812 46.848 10.072 1.00 68.40 ? 194 PRO A CG 1 ATOM 841 C CD . PRO A 1 151 ? 33.765 47.339 11.487 1.00 68.18 ? 194 PRO A CD 1 ATOM 842 N N . GLY A 1 152 ? 31.882 43.029 11.193 1.00 60.45 ? 195 GLY A N 1 ATOM 843 C CA . GLY A 1 152 ? 32.248 41.633 11.287 1.00 56.24 ? 195 GLY A CA 1 ATOM 844 C C . GLY A 1 152 ? 32.665 41.168 12.661 1.00 66.21 ? 195 GLY A C 1 ATOM 845 O O . GLY A 1 152 ? 33.170 40.048 12.790 1.00 73.79 ? 195 GLY A O 1 ATOM 846 N N . ALA A 1 153 ? 32.482 41.988 13.692 1.00 49.45 ? 196 ALA A N 1 ATOM 847 C CA . ALA A 1 153 ? 32.858 41.572 15.027 1.00 49.53 ? 196 ALA A CA 1 ATOM 848 C C . ALA A 1 153 ? 31.910 40.485 15.522 1.00 63.21 ? 196 ALA A C 1 ATOM 849 O O . ALA A 1 153 ? 30.763 40.394 15.076 1.00 51.15 ? 196 ALA A O 1 ATOM 850 C CB . ALA A 1 153 ? 32.843 42.759 15.985 1.00 41.71 ? 196 ALA A CB 1 ATOM 851 N N . PRO A 1 154 ? 32.368 39.653 16.456 1.00 61.46 ? 197 PRO A N 1 ATOM 852 C CA . PRO A 1 154 ? 31.525 38.566 16.961 1.00 50.56 ? 197 PRO A CA 1 ATOM 853 C C . PRO A 1 154 ? 30.406 39.093 17.845 1.00 53.75 ? 197 PRO A C 1 ATOM 854 O O . PRO A 1 154 ? 30.440 40.219 18.345 1.00 62.96 ? 197 PRO A O 1 ATOM 855 C CB . PRO A 1 154 ? 32.500 37.694 17.762 1.00 54.45 ? 197 PRO A CB 1 ATOM 856 C CG . PRO A 1 154 ? 33.874 38.139 17.339 1.00 45.21 ? 197 PRO A CG 1 ATOM 857 C CD . PRO A 1 154 ? 33.734 39.586 16.999 1.00 47.96 ? 197 PRO A CD 1 ATOM 858 N N . VAL A 1 155 ? 29.398 38.249 18.034 1.00 46.57 ? 198 VAL A N 1 ATOM 859 C CA . VAL A 1 155 ? 28.248 38.583 18.863 1.00 42.02 ? 198 VAL A CA 1 ATOM 860 C C . VAL A 1 155 ? 27.915 37.385 19.738 1.00 57.20 ? 198 VAL A C 1 ATOM 861 O O . VAL A 1 155 ? 27.941 36.236 19.282 1.00 65.70 ? 198 VAL A O 1 ATOM 862 C CB . VAL A 1 155 ? 27.031 39.004 18.018 1.00 41.98 ? 198 VAL A CB 1 ATOM 863 C CG1 . VAL A 1 155 ? 25.783 39.065 18.883 1.00 42.03 ? 198 VAL A CG1 1 ATOM 864 C CG2 . VAL A 1 155 ? 27.291 40.349 17.368 1.00 41.00 ? 198 VAL A CG2 1 ATOM 865 N N . SER A 1 156 ? 27.604 37.662 20.998 1.00 54.12 ? 199 SER A N 1 ATOM 866 C CA . SER A 1 156 ? 27.269 36.657 21.994 1.00 55.59 ? 199 SER A CA 1 ATOM 867 C C . SER A 1 156 ? 25.773 36.729 22.270 1.00 46.16 ? 199 SER A C 1 ATOM 868 O O . SER A 1 156 ? 25.272 37.759 22.738 1.00 50.82 ? 199 SER A O 1 ATOM 869 C CB . SER A 1 156 ? 28.080 36.886 23.272 1.00 60.06 ? 199 SER A CB 1 ATOM 870 O OG . SER A 1 156 ? 27.656 36.044 24.326 1.00 72.75 ? 199 SER A OG 1 ATOM 871 N N . ARG A 1 157 ? 25.066 35.648 21.956 1.00 43.03 ? 200 ARG A N 1 ATOM 872 C CA . ARG A 1 157 ? 23.639 35.542 22.221 1.00 43.43 ? 200 ARG A CA 1 ATOM 873 C C . ARG A 1 157 ? 23.442 34.896 23.585 1.00 49.68 ? 200 ARG A C 1 ATOM 874 O O . ARG A 1 157 ? 24.013 33.837 23.864 1.00 52.40 ? 200 ARG A O 1 ATOM 875 C CB . ARG A 1 157 ? 22.944 34.726 21.129 1.00 54.19 ? 200 ARG A CB 1 ATOM 876 C CG . ARG A 1 157 ? 22.949 35.396 19.758 1.00 84.82 ? 200 ARG A CG 1 ATOM 877 C CD . ARG A 1 157 ? 22.304 34.520 18.687 1.00 91.53 ? 200 ARG A CD 1 ATOM 878 N NE . ARG A 1 157 ? 20.943 34.114 19.030 1.00 86.93 ? 200 ARG A NE 1 ATOM 879 C CZ . ARG A 1 157 ? 19.852 34.807 18.719 1.00 82.15 ? 200 ARG A CZ 1 ATOM 880 N NH1 . ARG A 1 157 ? 19.957 35.953 18.057 1.00 71.97 1 200 ARG A NH1 1 ATOM 881 N NH2 . ARG A 1 157 ? 18.655 34.352 19.073 1.00 57.05 ? 200 ARG A NH2 1 ATOM 882 N N . ILE A 1 158 ? 22.639 35.535 24.432 1.00 49.67 ? 201 ILE A N 1 ATOM 883 C CA . ILE A 1 158 ? 22.441 35.088 25.804 1.00 32.00 ? 201 ILE A CA 1 ATOM 884 C C . ILE A 1 158 ? 20.950 34.932 26.062 1.00 35.94 ? 201 ILE A C 1 ATOM 885 O O . ILE A 1 158 ? 20.178 35.870 25.841 1.00 31.98 ? 201 ILE A O 1 ATOM 886 C CB . ILE A 1 158 ? 23.069 36.076 26.806 1.00 35.66 ? 201 ILE A CB 1 ATOM 887 C CG1 . ILE A 1 158 ? 24.587 36.109 26.619 1.00 31.12 ? 201 ILE A CG1 1 ATOM 888 C CG2 . ILE A 1 158 ? 22.699 35.707 28.232 1.00 37.04 ? 201 ILE A CG2 1 ATOM 889 C CD1 . ILE A 1 158 ? 25.317 36.935 27.648 1.00 49.39 ? 201 ILE A CD1 1 ATOM 890 N N . LEU A 1 159 ? 20.547 33.755 26.537 1.00 36.09 ? 202 LEU A N 1 ATOM 891 C CA . LEU A 1 159 ? 19.150 33.510 26.875 1.00 31.11 ? 202 LEU A CA 1 ATOM 892 C C . LEU A 1 159 ? 18.891 33.933 28.313 1.00 42.65 ? 202 LEU A C 1 ATOM 893 O O . LEU A 1 159 ? 19.605 33.510 29.221 1.00 47.18 ? 202 LEU A O 1 ATOM 894 C CB . LEU A 1 159 ? 18.796 32.035 26.700 1.00 27.14 ? 202 LEU A CB 1 ATOM 895 C CG . LEU A 1 159 ? 17.449 31.657 27.321 1.00 38.21 ? 202 LEU A CG 1 ATOM 896 C CD1 . LEU A 1 159 ? 16.296 32.256 26.532 1.00 31.61 ? 202 LEU A CD1 1 ATOM 897 C CD2 . LEU A 1 159 ? 17.304 30.148 27.449 1.00 36.61 ? 202 LEU A CD2 1 ATOM 898 N N . PHE A 1 160 ? 17.862 34.746 28.523 1.00 42.27 ? 203 PHE A N 1 ATOM 899 C CA . PHE A 1 160 ? 17.519 35.231 29.855 1.00 27.76 ? 203 PHE A CA 1 ATOM 900 C C . PHE A 1 160 ? 16.165 34.668 30.269 1.00 28.82 ? 203 PHE A C 1 ATOM 901 O O . PHE A 1 160 ? 15.121 35.051 29.711 1.00 36.32 ? 203 PHE A O 1 ATOM 902 C CB . PHE A 1 160 ? 17.514 36.754 29.924 1.00 27.87 ? 203 PHE A CB 1 ATOM 903 C CG . PHE A 1 160 ? 17.481 37.274 31.328 1.00 44.50 ? 203 PHE A CG 1 ATOM 904 C CD1 . PHE A 1 160 ? 18.656 37.503 32.024 1.00 45.51 ? 203 PHE A CD1 1 ATOM 905 C CD2 . PHE A 1 160 ? 16.274 37.486 31.972 1.00 45.54 ? 203 PHE A CD2 1 ATOM 906 C CE1 . PHE A 1 160 ? 18.627 37.967 33.324 1.00 46.05 ? 203 PHE A CE1 1 ATOM 907 C CE2 . PHE A 1 160 ? 16.236 37.945 33.271 1.00 37.28 ? 203 PHE A CE2 1 ATOM 908 C CZ . PHE A 1 160 ? 17.415 38.190 33.948 1.00 51.27 ? 203 PHE A CZ 1 ATOM 909 N N . LEU A 1 161 ? 16.202 33.771 31.255 1.00 34.22 ? 204 LEU A N 1 ATOM 910 C CA . LEU A 1 161 ? 15.025 33.186 31.879 1.00 39.09 ? 204 LEU A CA 1 ATOM 911 C C . LEU A 1 161 ? 14.892 33.710 33.300 1.00 45.32 ? 204 LEU A C 1 ATOM 912 O O . LEU A 1 161 ? 15.882 33.790 34.034 1.00 51.18 ? 204 LEU A O 1 ATOM 913 C CB . LEU A 1 161 ? 15.122 31.660 31.927 1.00 36.96 ? 204 LEU A CB 1 ATOM 914 C CG . LEU A 1 161 ? 15.498 30.902 30.661 1.00 41.24 ? 204 LEU A CG 1 ATOM 915 C CD1 . LEU A 1 161 ? 15.666 29.430 30.996 1.00 45.18 ? 204 LEU A CD1 1 ATOM 916 C CD2 . LEU A 1 161 ? 14.442 31.099 29.588 1.00 31.67 ? 204 LEU A CD2 1 ATOM 917 N N . THR A 1 162 ? 13.668 34.036 33.698 1.00 41.50 ? 205 THR A N 1 ATOM 918 C CA . THR A 1 162 ? 13.434 34.509 35.050 1.00 42.31 ? 205 THR A CA 1 ATOM 919 C C . THR A 1 162 ? 11.998 34.216 35.450 1.00 39.43 ? 205 THR A C 1 ATOM 920 O O . THR A 1 162 ? 11.103 34.144 34.604 1.00 45.59 ? 205 THR A O 1 ATOM 921 C CB . THR A 1 162 ? 13.718 36.010 35.169 1.00 47.12 ? 205 THR A CB 1 ATOM 922 O OG1 . THR A 1 162 ? 13.613 36.411 36.539 1.00 52.44 ? 205 THR A OG1 1 ATOM 923 C CG2 . THR A 1 162 ? 12.722 36.802 34.332 1.00 45.04 ? 205 THR A CG2 1 ATOM 924 N N . ASP A 1 163 ? 11.789 34.058 36.751 1.00 38.19 ? 206 ASP A N 1 ATOM 925 C CA . ASP A 1 163 ? 10.456 33.922 37.325 1.00 47.04 ? 206 ASP A CA 1 ATOM 926 C C . ASP A 1 163 ? 9.645 32.856 36.594 1.00 40.17 ? 206 ASP A C 1 ATOM 927 O O . ASP A 1 163 ? 8.588 33.118 36.020 1.00 39.66 ? 206 ASP A O 1 ATOM 928 C CB . ASP A 1 163 ? 9.734 35.267 37.311 1.00 48.10 ? 206 ASP A CB 1 ATOM 929 C CG . ASP A 1 163 ? 10.356 36.266 38.260 1.00 49.34 ? 206 ASP A CG 1 ATOM 930 O OD1 . ASP A 1 163 ? 11.336 36.938 37.873 1.00 55.58 -1 206 ASP A OD1 1 ATOM 931 O OD2 . ASP A 1 163 ? 9.842 36.400 39.387 1.00 45.73 ? 206 ASP A OD2 1 ATOM 932 N N . LEU A 1 164 ? 10.144 31.623 36.661 1.00 41.18 ? 207 LEU A N 1 ATOM 933 C CA . LEU A 1 164 ? 9.447 30.525 36.006 1.00 38.62 ? 207 LEU A CA 1 ATOM 934 C C . LEU A 1 164 ? 8.229 30.089 36.810 1.00 46.16 ? 207 LEU A C 1 ATOM 935 O O . LEU A 1 164 ? 7.170 29.818 36.233 1.00 55.61 ? 207 LEU A O 1 ATOM 936 C CB . LEU A 1 164 ? 10.412 29.362 35.772 1.00 38.77 ? 207 LEU A CB 1 ATOM 937 C CG . LEU A 1 164 ? 11.422 29.589 34.637 1.00 32.29 ? 207 LEU A CG 1 ATOM 938 C CD1 . LEU A 1 164 ? 12.355 30.747 34.940 1.00 57.20 ? 207 LEU A CD1 1 ATOM 939 C CD2 . LEU A 1 164 ? 12.229 28.323 34.376 1.00 43.27 ? 207 LEU A CD2 1 ATOM 940 N N . HIS A 1 165 ? 8.353 30.039 38.135 1.00 51.66 ? 208 HIS A N 1 ATOM 941 C CA . HIS A 1 165 ? 7.218 29.833 39.035 1.00 47.64 ? 208 HIS A CA 1 ATOM 942 C C . HIS A 1 165 ? 6.422 28.582 38.655 1.00 45.91 ? 208 HIS A C 1 ATOM 943 O O . HIS A 1 165 ? 5.283 28.642 38.191 1.00 45.30 ? 208 HIS A O 1 ATOM 944 C CB . HIS A 1 165 ? 6.315 31.070 39.051 1.00 48.25 ? 208 HIS A CB 1 ATOM 945 C CG . HIS A 1 165 ? 6.892 32.227 39.801 1.00 53.86 ? 208 HIS A CG 1 ATOM 946 N ND1 . HIS A 1 165 ? 7.051 32.211 41.168 1.00 58.65 ? 208 HIS A ND1 1 ATOM 947 C CD2 . HIS A 1 165 ? 7.347 33.433 39.383 1.00 63.05 ? 208 HIS A CD2 1 ATOM 948 C CE1 . HIS A 1 165 ? 7.572 33.359 41.562 1.00 65.49 ? 208 HIS A CE1 1 ATOM 949 N NE2 . HIS A 1 165 ? 7.767 34.120 40.498 1.00 56.68 ? 208 HIS A NE2 1 ATOM 950 N N . TRP A 1 166 ? 7.054 27.438 38.893 1.00 44.44 ? 209 TRP A N 1 ATOM 951 C CA . TRP A 1 166 ? 6.454 26.152 38.563 1.00 47.33 ? 209 TRP A CA 1 ATOM 952 C C . TRP A 1 166 ? 5.538 25.703 39.695 1.00 50.10 ? 209 TRP A C 1 ATOM 953 O O . TRP A 1 166 ? 5.993 25.503 40.826 1.00 70.26 ? 209 TRP A O 1 ATOM 954 C CB . TRP A 1 166 ? 7.545 25.119 38.300 1.00 46.14 ? 209 TRP A CB 1 ATOM 955 C CG . TRP A 1 166 ? 7.036 23.725 38.253 1.00 63.02 ? 209 TRP A CG 1 ATOM 956 C CD1 . TRP A 1 166 ? 5.973 23.264 37.535 1.00 55.72 ? 209 TRP A CD1 1 ATOM 957 C CD2 . TRP A 1 166 ? 7.565 22.599 38.961 1.00 64.99 ? 209 TRP A CD2 1 ATOM 958 N NE1 . TRP A 1 166 ? 5.807 21.918 37.753 1.00 68.89 ? 209 TRP A NE1 1 ATOM 959 C CE2 . TRP A 1 166 ? 6.773 21.486 38.624 1.00 56.47 ? 209 TRP A CE2 1 ATOM 960 C CE3 . TRP A 1 166 ? 8.634 22.424 39.846 1.00 47.98 ? 209 TRP A CE3 1 ATOM 961 C CZ2 . TRP A 1 166 ? 7.014 20.216 39.140 1.00 61.97 ? 209 TRP A CZ2 1 ATOM 962 C CZ3 . TRP A 1 166 ? 8.872 21.163 40.357 1.00 61.89 ? 209 TRP A CZ3 1 ATOM 963 C CH2 . TRP A 1 166 ? 8.066 20.075 40.003 1.00 61.31 ? 209 TRP A CH2 1 ATOM 964 N N . ASP A 1 167 ? 4.249 25.535 39.386 1.00 50.27 ? 210 ASP A N 1 ATOM 965 C CA . ASP A 1 167 ? 3.251 25.229 40.409 1.00 54.96 ? 210 ASP A CA 1 ATOM 966 C C . ASP A 1 167 ? 3.327 23.773 40.860 1.00 73.50 ? 210 ASP A C 1 ATOM 967 O O . ASP A 1 167 ? 3.382 23.490 42.062 1.00 82.42 ? 210 ASP A O 1 ATOM 968 C CB . ASP A 1 167 ? 1.853 25.551 39.870 1.00 61.14 ? 210 ASP A CB 1 ATOM 969 C CG . ASP A 1 167 ? 0.817 25.719 40.971 1.00 63.00 ? 210 ASP A CG 1 ATOM 970 O OD1 . ASP A 1 167 ? 0.946 25.052 42.019 1.00 62.27 ? 210 ASP A OD1 1 ATOM 971 O OD2 . ASP A 1 167 ? -0.131 26.516 40.780 1.00 50.88 -1 210 ASP A OD2 1 ATOM 972 N N . HIS A 1 168 ? 3.320 22.843 39.906 1.00 70.73 ? 211 HIS A N 1 ATOM 973 C CA . HIS A 1 168 ? 3.312 21.404 40.163 1.00 77.32 ? 211 HIS A CA 1 ATOM 974 C C . HIS A 1 168 ? 1.944 20.924 40.629 1.00 66.44 ? 211 HIS A C 1 ATOM 975 O O . HIS A 1 168 ? 1.620 19.738 40.500 1.00 81.73 ? 211 HIS A O 1 ATOM 976 C CB . HIS A 1 168 ? 4.371 21.030 41.210 1.00 75.80 ? 211 HIS A CB 1 ATOM 977 C CG . HIS A 1 168 ? 4.227 19.636 41.746 1.00 77.17 ? 211 HIS A CG 1 ATOM 978 N ND1 . HIS A 1 168 ? 3.258 19.286 42.663 1.00 72.17 ? 211 HIS A ND1 1 ATOM 979 C CD2 . HIS A 1 168 ? 4.932 18.507 41.497 1.00 71.86 ? 211 HIS A CD2 1 ATOM 980 C CE1 . HIS A 1 168 ? 3.368 18.001 42.950 1.00 55.47 ? 211 HIS A CE1 1 ATOM 981 N NE2 . HIS A 1 168 ? 4.377 17.505 42.257 1.00 53.92 ? 211 HIS A NE2 1 ATOM 982 N N . ASP A 1 169 ? 1.127 21.832 41.153 1.00 59.55 ? 212 ASP A N 1 ATOM 983 C CA . ASP A 1 169 ? -0.262 21.538 41.466 1.00 58.30 ? 212 ASP A CA 1 ATOM 984 C C . ASP A 1 169 ? -1.226 22.077 40.421 1.00 69.90 ? 212 ASP A C 1 ATOM 985 O O . ASP A 1 169 ? -2.442 21.934 40.587 1.00 64.89 ? 212 ASP A O 1 ATOM 986 C CB . ASP A 1 169 ? -0.620 22.094 42.845 1.00 62.34 ? 212 ASP A CB 1 ATOM 987 C CG . ASP A 1 169 ? -0.122 21.210 43.967 1.00 90.34 ? 212 ASP A CG 1 ATOM 988 O OD1 . ASP A 1 169 ? 0.057 19.995 43.730 1.00 90.34 ? 212 ASP A OD1 1 ATOM 989 O OD2 . ASP A 1 169 ? 0.093 21.727 45.084 1.00 108.16 -1 212 ASP A OD2 1 ATOM 990 N N . TYR A 1 170 ? -0.717 22.699 39.361 1.00 62.34 ? 213 TYR A N 1 ATOM 991 C CA . TYR A 1 170 ? -1.592 23.226 38.327 1.00 46.58 ? 213 TYR A CA 1 ATOM 992 C C . TYR A 1 170 ? -2.437 22.106 37.743 1.00 51.61 ? 213 TYR A C 1 ATOM 993 O O . TYR A 1 170 ? -1.920 21.047 37.376 1.00 66.32 ? 213 TYR A O 1 ATOM 994 C CB . TYR A 1 170 ? -0.773 23.901 37.229 1.00 53.45 ? 213 TYR A CB 1 ATOM 995 C CG . TYR A 1 170 ? -1.628 24.617 36.211 1.00 55.45 ? 213 TYR A CG 1 ATOM 996 C CD1 . TYR A 1 170 ? -2.129 23.949 35.102 1.00 55.54 ? 213 TYR A CD1 1 ATOM 997 C CD2 . TYR A 1 170 ? -1.941 25.959 36.362 1.00 52.25 ? 213 TYR A CD2 1 ATOM 998 C CE1 . TYR A 1 170 ? -2.916 24.599 34.176 1.00 53.68 ? 213 TYR A CE1 1 ATOM 999 C CE2 . TYR A 1 170 ? -2.727 26.618 35.439 1.00 49.76 ? 213 TYR A CE2 1 ATOM 1000 C CZ . TYR A 1 170 ? -3.211 25.933 34.349 1.00 49.36 ? 213 TYR A CZ 1 ATOM 1001 O OH . TYR A 1 170 ? -3.996 26.582 33.426 1.00 54.11 ? 213 TYR A OH 1 ATOM 1002 N N . LEU A 1 171 ? -3.744 22.337 37.667 1.00 45.91 ? 214 LEU A N 1 ATOM 1003 C CA . LEU A 1 171 ? -4.671 21.355 37.121 1.00 44.03 ? 214 LEU A CA 1 ATOM 1004 C C . LEU A 1 171 ? -5.644 22.070 36.201 1.00 60.88 ? 214 LEU A C 1 ATOM 1005 O O . LEU A 1 171 ? -6.423 22.914 36.654 1.00 62.74 ? 214 LEU A O 1 ATOM 1006 C CB . LEU A 1 171 ? -5.421 20.619 38.233 1.00 65.25 ? 214 LEU A CB 1 ATOM 1007 C CG . LEU A 1 171 ? -6.319 19.463 37.792 1.00 68.42 ? 214 LEU A CG 1 ATOM 1008 C CD1 . LEU A 1 171 ? -5.500 18.364 37.134 1.00 76.38 ? 214 LEU A CD1 1 ATOM 1009 C CD2 . LEU A 1 171 ? -7.100 18.917 38.978 1.00 70.25 ? 214 LEU A CD2 1 ATOM 1010 N N . GLU A 1 172 ? -5.616 21.712 34.921 1.00 66.39 ? 215 GLU A N 1 ATOM 1011 C CA . GLU A 1 172 ? -6.542 22.295 33.965 1.00 56.94 ? 215 GLU A CA 1 ATOM 1012 C C . GLU A 1 172 ? -7.977 21.985 34.376 1.00 69.44 ? 215 GLU A C 1 ATOM 1013 O O . GLU A 1 172 ? -8.261 20.964 35.008 1.00 73.53 ? 215 GLU A O 1 ATOM 1014 C CB . GLU A 1 172 ? -6.253 21.766 32.556 1.00 66.85 ? 215 GLU A CB 1 ATOM 1015 C CG . GLU A 1 172 ? -6.251 20.242 32.432 1.00 108.25 ? 215 GLU A CG 1 ATOM 1016 C CD . GLU A 1 172 ? -5.009 19.587 33.029 1.00 101.37 ? 215 GLU A CD 1 ATOM 1017 O OE1 . GLU A 1 172 ? -4.222 20.288 33.702 1.00 80.82 ? 215 GLU A OE1 1 ATOM 1018 O OE2 . GLU A 1 172 ? -4.823 18.368 32.826 1.00 102.62 -1 215 GLU A OE2 1 ATOM 1019 N N . GLY A 1 173 ? -8.888 22.891 34.028 1.00 70.24 ? 216 GLY A N 1 ATOM 1020 C CA . GLY A 1 173 ? -10.280 22.753 34.385 1.00 67.12 ? 216 GLY A CA 1 ATOM 1021 C C . GLY A 1 173 ? -10.652 23.334 35.733 1.00 68.24 ? 216 GLY A C 1 ATOM 1022 O O . GLY A 1 173 ? -11.841 23.550 35.992 1.00 75.51 ? 216 GLY A O 1 ATOM 1023 N N . THR A 1 174 ? -9.672 23.598 36.595 1.00 62.87 ? 217 THR A N 1 ATOM 1024 C CA . THR A 1 174 ? -9.947 24.134 37.918 1.00 61.63 ? 217 THR A CA 1 ATOM 1025 C C . THR A 1 174 ? -10.407 25.587 37.814 1.00 66.14 ? 217 THR A C 1 ATOM 1026 O O . THR A 1 174 ? -10.542 26.156 36.726 1.00 80.94 ? 217 THR A O 1 ATOM 1027 C CB . THR A 1 174 ? -8.709 24.027 38.804 1.00 67.82 ? 217 THR A CB 1 ATOM 1028 O OG1 . THR A 1 174 ? -7.599 24.662 38.155 1.00 53.76 ? 217 THR A OG1 1 ATOM 1029 C CG2 . THR A 1 174 ? -8.369 22.569 39.082 1.00 61.75 ? 217 THR A CG2 1 ATOM 1030 N N . ASP A 1 175 ? -10.658 26.190 38.970 1.00 62.62 ? 218 ASP A N 1 ATOM 1031 C CA . ASP A 1 175 ? -11.200 27.542 39.021 1.00 67.59 ? 218 ASP A CA 1 ATOM 1032 C C . ASP A 1 175 ? -10.077 28.560 38.855 1.00 79.17 ? 218 ASP A C 1 ATOM 1033 O O . ASP A 1 175 ? -9.169 28.605 39.694 1.00 65.05 ? 218 ASP A O 1 ATOM 1034 C CB . ASP A 1 175 ? -11.923 27.766 40.342 1.00 65.37 ? 218 ASP A CB 1 ATOM 1035 C CG . ASP A 1 175 ? -12.813 28.992 40.319 1.00 87.53 ? 218 ASP A CG 1 ATOM 1036 O OD1 . ASP A 1 175 ? -12.676 29.814 39.388 1.00 84.80 ? 218 ASP A OD1 1 ATOM 1037 O OD2 . ASP A 1 175 ? -13.649 29.134 41.237 1.00 92.13 -1 218 ASP A OD2 1 ATOM 1038 N N . PRO A 1 176 ? -10.089 29.383 37.800 1.00 81.94 ? 219 PRO A N 1 ATOM 1039 C CA . PRO A 1 176 ? -9.039 30.407 37.679 1.00 62.82 ? 219 PRO A CA 1 ATOM 1040 C C . PRO A 1 176 ? -9.166 31.504 38.718 1.00 85.44 ? 219 PRO A C 1 ATOM 1041 O O . PRO A 1 176 ? -8.150 31.978 39.240 1.00 95.10 ? 219 PRO A O 1 ATOM 1042 C CB . PRO A 1 176 ? -9.236 30.939 36.256 1.00 67.43 ? 219 PRO A CB 1 ATOM 1043 C CG . PRO A 1 176 ? -10.696 30.758 36.007 1.00 84.23 ? 219 PRO A CG 1 ATOM 1044 C CD . PRO A 1 176 ? -11.083 29.481 36.717 1.00 78.66 ? 219 PRO A CD 1 ATOM 1045 N N . ASP A 1 177 ? -10.389 31.922 39.037 1.00 84.66 ? 220 ASP A N 1 ATOM 1046 C CA . ASP A 1 177 ? -10.630 32.934 40.058 1.00 73.30 ? 220 ASP A CA 1 ATOM 1047 C C . ASP A 1 177 ? -11.263 32.233 41.250 1.00 87.02 ? 220 ASP A C 1 ATOM 1048 O O . ASP A 1 177 ? -12.449 31.888 41.220 1.00 95.73 ? 220 ASP A O 1 ATOM 1049 C CB . ASP A 1 177 ? -11.533 34.046 39.529 1.00 87.98 ? 220 ASP A CB 1 ATOM 1050 C CG . ASP A 1 177 ? -11.040 34.623 38.215 1.00 110.55 ? 220 ASP A CG 1 ATOM 1051 O OD1 . ASP A 1 177 ? -9.809 34.688 38.015 1.00 114.94 ? 220 ASP A OD1 1 ATOM 1052 O OD2 . ASP A 1 177 ? -11.886 35.008 37.379 1.00 121.43 -1 220 ASP A OD2 1 ATOM 1053 N N . CYS A 1 178 ? -10.478 32.049 42.305 1.00 89.10 ? 221 CYS A N 1 ATOM 1054 C CA . CYS A 1 178 ? -10.912 31.357 43.505 1.00 77.85 ? 221 CYS A CA 1 ATOM 1055 C C . CYS A 1 178 ? -10.487 32.187 44.704 1.00 79.45 ? 221 CYS A C 1 ATOM 1056 O O . CYS A 1 178 ? -9.706 33.134 44.580 1.00 80.97 ? 221 CYS A O 1 ATOM 1057 C CB . CYS A 1 178 ? -10.327 29.933 43.582 1.00 77.98 ? 221 CYS A CB 1 ATOM 1058 S SG . CYS A 1 178 ? -8.544 29.798 43.989 1.00 81.70 ? 221 CYS A SG 1 ATOM 1059 N N . ALA A 1 179 ? -10.998 31.832 45.879 1.00 86.93 ? 222 ALA A N 1 ATOM 1060 C CA . ALA A 1 179 ? -10.562 32.493 47.100 1.00 86.91 ? 222 ALA A CA 1 ATOM 1061 C C . ALA A 1 179 ? -9.384 31.692 47.630 1.00 80.70 ? 222 ALA A C 1 ATOM 1062 O O . ALA A 1 179 ? -9.555 30.595 48.171 1.00 84.69 ? 222 ALA A O 1 ATOM 1063 C CB . ALA A 1 179 ? -11.693 32.577 48.120 1.00 87.86 ? 222 ALA A CB 1 ATOM 1064 N N . ASP A 1 180 ? -8.196 32.248 47.462 1.00 75.24 ? 223 ASP A N 1 ATOM 1065 C CA . ASP A 1 180 ? -6.909 31.630 47.729 1.00 65.23 ? 223 ASP A CA 1 ATOM 1066 C C . ASP A 1 180 ? -5.868 32.563 47.130 1.00 70.23 ? 223 ASP A C 1 ATOM 1067 O O . ASP A 1 180 ? -6.143 33.214 46.115 1.00 77.50 ? 223 ASP A O 1 ATOM 1068 C CB . ASP A 1 180 ? -6.811 30.229 47.120 1.00 81.90 ? 223 ASP A CB 1 ATOM 1069 C CG . ASP A 1 180 ? -7.213 29.131 48.093 1.00 85.66 ? 223 ASP A CG 1 ATOM 1070 O OD1 . ASP A 1 180 ? -7.268 29.397 49.311 1.00 92.69 ? 223 ASP A OD1 1 ATOM 1071 O OD2 . ASP A 1 180 ? -7.473 27.996 47.639 1.00 95.14 -1 223 ASP A OD2 1 ATOM 1072 N N . PRO A 1 181 ? -4.674 32.667 47.710 1.00 72.96 ? 224 PRO A N 1 ATOM 1073 C CA . PRO A 1 181 ? -3.628 33.473 47.063 1.00 78.93 ? 224 PRO A CA 1 ATOM 1074 C C . PRO A 1 181 ? -3.265 32.985 45.671 1.00 72.72 ? 224 PRO A C 1 ATOM 1075 O O . PRO A 1 181 ? -2.718 33.765 44.882 1.00 65.33 ? 224 PRO A O 1 ATOM 1076 C CB . PRO A 1 181 ? -2.443 33.352 48.030 1.00 84.86 ? 224 PRO A CB 1 ATOM 1077 C CG . PRO A 1 181 ? -3.070 33.031 49.350 1.00 76.16 ? 224 PRO A CG 1 ATOM 1078 C CD . PRO A 1 181 ? -4.252 32.164 49.026 1.00 74.63 ? 224 PRO A CD 1 ATOM 1079 N N . LEU A 1 182 ? -3.550 31.725 45.344 1.00 65.11 ? 225 LEU A N 1 ATOM 1080 C CA . LEU A 1 182 ? -3.201 31.157 44.049 1.00 59.83 ? 225 LEU A CA 1 ATOM 1081 C C . LEU A 1 182 ? -4.276 30.160 43.635 1.00 72.13 ? 225 LEU A C 1 ATOM 1082 O O . LEU A 1 182 ? -4.798 29.418 44.471 1.00 68.76 ? 225 LEU A O 1 ATOM 1083 C CB . LEU A 1 182 ? -1.825 30.481 44.093 1.00 56.70 ? 225 LEU A CB 1 ATOM 1084 C CG . LEU A 1 182 ? -1.203 30.127 42.742 1.00 59.87 ? 225 LEU A CG 1 ATOM 1085 C CD1 . LEU A 1 182 ? -1.019 31.380 41.903 1.00 58.46 ? 225 LEU A CD1 1 ATOM 1086 C CD2 . LEU A 1 182 ? 0.126 29.408 42.925 1.00 43.94 ? 225 LEU A CD2 1 ATOM 1087 N N . CYS A 1 183 ? -4.604 30.151 42.342 1.00 75.70 ? 226 CYS A N 1 ATOM 1088 C CA . CYS A 1 183 ? -5.663 29.286 41.829 1.00 74.00 ? 226 CYS A CA 1 ATOM 1089 C C . CYS A 1 183 ? -5.187 28.431 40.658 1.00 70.91 ? 226 CYS A C 1 ATOM 1090 O O . CYS A 1 183 ? -3.988 28.374 40.362 1.00 67.28 ? 226 CYS A O 1 ATOM 1091 C CB . CYS A 1 183 ? -6.884 30.118 41.423 1.00 67.23 ? 226 CYS A CB 1 ATOM 1092 S SG . CYS A 1 183 ? -7.600 31.117 42.759 1.00 97.02 ? 226 CYS A SG 1 ATOM 1093 N N . CYS A 1 184 ? -6.125 27.747 40.000 1.00 62.19 ? 227 CYS A N 1 ATOM 1094 C CA . CYS A 1 184 ? -5.866 26.829 38.893 1.00 51.87 ? 227 CYS A CA 1 ATOM 1095 C C . CYS A 1 184 ? -5.101 25.588 39.321 1.00 59.23 ? 227 CYS A C 1 ATOM 1096 O O . CYS A 1 184 ? -4.429 24.963 38.497 1.00 57.95 ? 227 CYS A O 1 ATOM 1097 C CB . CYS A 1 184 ? -5.099 27.503 37.749 1.00 44.95 ? 227 CYS A CB 1 ATOM 1098 S SG . CYS A 1 184 ? -5.808 29.022 37.116 1.00 59.13 ? 227 CYS A SG 1 ATOM 1099 N N . ARG A 1 185 ? -5.181 25.207 40.590 1.00 58.74 ? 228 ARG A N 1 ATOM 1100 C CA . ARG A 1 185 ? -4.397 24.095 41.098 1.00 52.03 ? 228 ARG A CA 1 ATOM 1101 C C . ARG A 1 185 ? -5.297 23.175 41.908 1.00 69.82 ? 228 ARG A C 1 ATOM 1102 O O . ARG A 1 185 ? -6.445 23.505 42.218 1.00 68.89 ? 228 ARG A O 1 ATOM 1103 C CB . ARG A 1 185 ? -3.206 24.592 41.929 1.00 59.55 ? 228 ARG A CB 1 ATOM 1104 C CG . ARG A 1 185 ? -3.542 25.667 42.941 1.00 53.29 ? 228 ARG A CG 1 ATOM 1105 C CD . ARG A 1 185 ? -2.277 26.353 43.445 1.00 57.47 ? 228 ARG A CD 1 ATOM 1106 N NE . ARG A 1 185 ? -1.349 25.440 44.104 1.00 45.39 ? 228 ARG A NE 1 ATOM 1107 C CZ . ARG A 1 185 ? -1.544 24.905 45.304 1.00 64.10 ? 228 ARG A CZ 1 ATOM 1108 N NH1 . ARG A 1 185 ? -2.648 25.177 45.986 1.00 61.02 1 228 ARG A NH1 1 ATOM 1109 N NH2 . ARG A 1 185 ? -0.635 24.091 45.818 1.00 80.21 ? 228 ARG A NH2 1 ATOM 1110 N N . ARG A 1 186 ? -4.764 22.001 42.240 1.00 74.80 ? 229 ARG A N 1 ATOM 1111 C CA . ARG A 1 186 ? -5.502 21.048 43.056 1.00 69.76 ? 229 ARG A CA 1 ATOM 1112 C C . ARG A 1 186 ? -6.042 21.729 44.305 1.00 69.74 ? 229 ARG A C 1 ATOM 1113 O O . ARG A 1 186 ? -5.308 22.410 45.026 1.00 60.60 ? 229 ARG A O 1 ATOM 1114 C CB . ARG A 1 186 ? -4.597 19.881 43.451 1.00 85.89 ? 229 ARG A CB 1 ATOM 1115 C CG . ARG A 1 186 ? -4.605 18.705 42.493 1.00 89.65 ? 229 ARG A CG 1 ATOM 1116 C CD . ARG A 1 186 ? -3.897 17.512 43.120 1.00 99.50 ? 229 ARG A CD 1 ATOM 1117 N NE . ARG A 1 186 ? -4.447 17.181 44.435 1.00 113.16 ? 229 ARG A NE 1 ATOM 1118 C CZ . ARG A 1 186 ? -3.979 17.655 45.586 1.00 104.52 ? 229 ARG A CZ 1 ATOM 1119 N NH1 . ARG A 1 186 ? -2.944 18.486 45.592 1.00 94.32 1 229 ARG A NH1 1 ATOM 1120 N NH2 . ARG A 1 186 ? -4.545 17.301 46.734 1.00 86.74 ? 229 ARG A NH2 1 ATOM 1121 N N . GLY A 1 187 ? -7.334 21.542 44.556 1.00 71.38 ? 230 GLY A N 1 ATOM 1122 C CA . GLY A 1 187 ? -7.978 22.149 45.698 1.00 65.57 ? 230 GLY A CA 1 ATOM 1123 C C . GLY A 1 187 ? -8.622 23.491 45.438 1.00 66.12 ? 230 GLY A C 1 ATOM 1124 O O . GLY A 1 187 ? -9.138 24.104 46.381 1.00 80.77 ? 230 GLY A O 1 ATOM 1125 N N . SER A 1 188 ? -8.604 23.976 44.199 1.00 59.06 ? 231 SER A N 1 ATOM 1126 C CA . SER A 1 188 ? -9.295 25.209 43.851 1.00 63.40 ? 231 SER A CA 1 ATOM 1127 C C . SER A 1 188 ? -10.752 24.986 43.467 1.00 63.18 ? 231 SER A C 1 ATOM 1128 O O . SER A 1 188 ? -11.496 25.961 43.327 1.00 72.39 ? 231 SER A O 1 ATOM 1129 C CB . SER A 1 188 ? -8.567 25.915 42.702 1.00 60.17 ? 231 SER A CB 1 ATOM 1130 O OG . SER A 1 188 ? -7.241 26.250 43.071 1.00 83.59 ? 231 SER A OG 1 ATOM 1131 N N . GLY A 1 189 ? -11.175 23.737 43.304 1.00 55.97 ? 232 GLY A N 1 ATOM 1132 C CA . GLY A 1 189 ? -12.545 23.453 42.932 1.00 55.28 ? 232 GLY A CA 1 ATOM 1133 C C . GLY A 1 189 ? -12.782 23.653 41.445 1.00 63.52 ? 232 GLY A C 1 ATOM 1134 O O . GLY A 1 189 ? -11.850 23.724 40.637 1.00 62.86 ? 232 GLY A O 1 ATOM 1135 N N . LEU A 1 190 ? -14.060 23.756 41.087 1.00 64.07 ? 233 LEU A N 1 ATOM 1136 C CA . LEU A 1 190 ? -14.461 23.952 39.704 1.00 56.43 ? 233 LEU A CA 1 ATOM 1137 C C . LEU A 1 190 ? -15.199 25.274 39.526 1.00 64.86 ? 233 LEU A C 1 ATOM 1138 O O . LEU A 1 190 ? -15.897 25.732 40.436 1.00 74.16 ? 233 LEU A O 1 ATOM 1139 C CB . LEU A 1 190 ? -15.357 22.805 39.222 1.00 71.20 ? 233 LEU A CB 1 ATOM 1140 C CG . LEU A 1 190 ? -14.738 21.407 39.213 1.00 67.17 ? 233 LEU A CG 1 ATOM 1141 C CD1 . LEU A 1 190 ? -15.757 20.379 38.749 1.00 61.57 ? 233 LEU A CD1 1 ATOM 1142 C CD2 . LEU A 1 190 ? -13.513 21.385 38.313 1.00 68.00 ? 233 LEU A CD2 1 ATOM 1143 N N . PRO A 1 191 ? -15.067 25.904 38.364 1.00 68.75 ? 234 PRO A N 1 ATOM 1144 C CA . PRO A 1 191 ? -15.779 27.159 38.106 1.00 78.85 ? 234 PRO A CA 1 ATOM 1145 C C . PRO A 1 191 ? -17.270 26.922 37.946 1.00 85.70 ? 234 PRO A C 1 ATOM 1146 O O . PRO A 1 191 ? -17.691 25.962 37.284 1.00 91.66 ? 234 PRO A O 1 ATOM 1147 C CB . PRO A 1 191 ? -15.150 27.656 36.797 1.00 87.16 ? 234 PRO A CB 1 ATOM 1148 C CG . PRO A 1 191 ? -14.691 26.413 36.117 1.00 88.60 ? 234 PRO A CG 1 ATOM 1149 C CD . PRO A 1 191 ? -14.241 25.487 37.219 1.00 72.25 ? 234 PRO A CD 1 ATOM 1150 N N . PRO A 1 192 ? -18.101 27.763 38.551 1.00 95.26 ? 235 PRO A N 1 ATOM 1151 C CA . PRO A 1 192 ? -19.548 27.627 38.377 1.00 100.98 ? 235 PRO A CA 1 ATOM 1152 C C . PRO A 1 192 ? -20.014 28.157 37.031 1.00 115.45 ? 235 PRO A C 1 ATOM 1153 O O . PRO A 1 192 ? -19.483 29.131 36.494 1.00 109.73 ? 235 PRO A O 1 ATOM 1154 C CB . PRO A 1 192 ? -20.116 28.473 39.524 1.00 104.61 ? 235 PRO A CB 1 ATOM 1155 C CG . PRO A 1 192 ? -19.082 29.524 39.739 1.00 107.74 ? 235 PRO A CG 1 ATOM 1156 C CD . PRO A 1 192 ? -17.753 28.863 39.469 1.00 101.29 ? 235 PRO A CD 1 ATOM 1157 N N . ALA A 1 193 ? -21.030 27.486 36.488 1.00 118.53 ? 236 ALA A N 1 ATOM 1158 C CA . ALA A 1 193 ? -21.791 27.993 35.353 1.00 114.06 ? 236 ALA A CA 1 ATOM 1159 C C . ALA A 1 193 ? -20.905 28.327 34.157 1.00 109.90 ? 236 ALA A C 1 ATOM 1160 O O . ALA A 1 193 ? -20.147 27.481 33.680 1.00 90.17 ? 236 ALA A O 1 ATOM 1161 C CB . ALA A 1 193 ? -22.599 29.225 35.774 1.00 106.68 ? 236 ALA A CB 1 ATOM 1162 N N . SER A 1 194 ? -20.991 29.569 33.685 1.00 118.08 ? 237 SER A N 1 ATOM 1163 C CA . SER A 1 194 ? -20.469 29.937 32.377 1.00 122.93 ? 237 SER A CA 1 ATOM 1164 C C . SER A 1 194 ? -18.989 30.293 32.390 1.00 128.96 ? 237 SER A C 1 ATOM 1165 O O . SER A 1 194 ? -18.384 30.379 31.318 1.00 123.21 ? 237 SER A O 1 ATOM 1166 C CB . SER A 1 194 ? -21.272 31.113 31.806 1.00 105.51 ? 237 SER A CB 1 ATOM 1167 O OG . SER A 1 194 ? -20.822 31.452 30.505 1.00 97.91 ? 237 SER A OG 1 ATOM 1168 N N . ARG A 1 195 ? -18.394 30.497 33.558 1.00 123.52 ? 238 ARG A N 1 ATOM 1169 C CA . ARG A 1 195 ? -16.981 30.853 33.596 1.00 116.03 ? 238 ARG A CA 1 ATOM 1170 C C . ARG A 1 195 ? -16.146 29.617 33.285 1.00 108.50 ? 238 ARG A C 1 ATOM 1171 O O . ARG A 1 195 ? -16.295 28.589 33.962 1.00 87.47 ? 238 ARG A O 1 ATOM 1172 C CB . ARG A 1 195 ? -16.601 31.439 34.954 1.00 104.90 ? 238 ARG A CB 1 ATOM 1173 C CG . ARG A 1 195 ? -15.176 31.970 35.008 1.00 104.36 ? 238 ARG A CG 1 ATOM 1174 C CD . ARG A 1 195 ? -14.938 32.837 36.235 1.00 114.60 ? 238 ARG A CD 1 ATOM 1175 N NE . ARG A 1 195 ? -14.936 32.065 37.475 1.00 120.35 ? 238 ARG A NE 1 ATOM 1176 C CZ . ARG A 1 195 ? -15.978 31.955 38.292 1.00 119.28 ? 238 ARG A CZ 1 ATOM 1177 N NH1 . ARG A 1 195 ? -17.120 32.567 38.005 1.00 120.82 1 238 ARG A NH1 1 ATOM 1178 N NH2 . ARG A 1 195 ? -15.879 31.233 39.400 1.00 105.73 ? 238 ARG A NH2 1 ATOM 1179 N N . PRO A 1 196 ? -15.269 29.665 32.288 1.00 100.48 ? 239 PRO A N 1 ATOM 1180 C CA . PRO A 1 196 ? -14.477 28.482 31.938 1.00 84.97 ? 239 PRO A CA 1 ATOM 1181 C C . PRO A 1 196 ? -13.391 28.195 32.962 1.00 83.24 ? 239 PRO A C 1 ATOM 1182 O O . PRO A 1 196 ? -13.036 29.032 33.794 1.00 93.40 ? 239 PRO A O 1 ATOM 1183 C CB . PRO A 1 196 ? -13.869 28.856 30.582 1.00 96.63 ? 239 PRO A CB 1 ATOM 1184 C CG . PRO A 1 196 ? -13.796 30.349 30.612 1.00 90.12 ? 239 PRO A CG 1 ATOM 1185 C CD . PRO A 1 196 ? -14.994 30.806 31.397 1.00 99.22 ? 239 PRO A CD 1 ATOM 1186 N N . GLY A 1 197 ? -12.869 26.973 32.889 1.00 72.13 ? 240 GLY A N 1 ATOM 1187 C CA . GLY A 1 197 ? -11.790 26.542 33.749 1.00 57.12 ? 240 GLY A CA 1 ATOM 1188 C C . GLY A 1 197 ? -10.455 27.103 33.294 1.00 60.39 ? 240 GLY A C 1 ATOM 1189 O O . GLY A 1 197 ? -10.370 28.008 32.462 1.00 81.53 ? 240 GLY A O 1 ATOM 1190 N N . ALA A 1 198 ? -9.389 26.548 33.861 1.00 51.97 ? 241 ALA A N 1 ATOM 1191 C CA . ALA A 1 198 ? -8.047 26.999 33.526 1.00 57.24 ? 241 ALA A CA 1 ATOM 1192 C C . ALA A 1 198 ? -7.583 26.371 32.216 1.00 63.34 ? 241 ALA A C 1 ATOM 1193 O O . ALA A 1 198 ? -7.898 25.219 31.906 1.00 54.20 ? 241 ALA A O 1 ATOM 1194 C CB . ALA A 1 198 ? -7.067 26.658 34.647 1.00 42.37 ? 241 ALA A CB 1 ATOM 1195 N N . GLY A 1 199 ? -6.815 27.144 31.451 1.00 57.43 ? 242 GLY A N 1 ATOM 1196 C CA . GLY A 1 199 ? -6.333 26.671 30.170 1.00 57.30 ? 242 GLY A CA 1 ATOM 1197 C C . GLY A 1 199 ? -5.332 25.540 30.303 1.00 48.45 ? 242 GLY A C 1 ATOM 1198 O O . GLY A 1 199 ? -4.736 25.311 31.353 1.00 46.74 ? 242 GLY A O 1 ATOM 1199 N N . TYR A 1 200 ? -5.141 24.821 29.195 1.00 50.70 ? 243 TYR A N 1 ATOM 1200 C CA . TYR A 1 200 ? -4.223 23.686 29.209 1.00 55.36 ? 243 TYR A CA 1 ATOM 1201 C C . TYR A 1 200 ? -2.795 24.134 29.489 1.00 44.64 ? 243 TYR A C 1 ATOM 1202 O O . TYR A 1 200 ? -2.044 23.446 30.189 1.00 41.33 ? 243 TYR A O 1 ATOM 1203 C CB . TYR A 1 200 ? -4.303 22.930 27.879 1.00 55.11 ? 243 TYR A CB 1 ATOM 1204 C CG . TYR A 1 200 ? -3.407 21.709 27.811 1.00 52.46 ? 243 TYR A CG 1 ATOM 1205 C CD1 . TYR A 1 200 ? -3.780 20.519 28.423 1.00 44.76 ? 243 TYR A CD1 1 ATOM 1206 C CD2 . TYR A 1 200 ? -2.198 21.743 27.125 1.00 41.14 ? 243 TYR A CD2 1 ATOM 1207 C CE1 . TYR A 1 200 ? -2.969 19.402 28.372 1.00 53.83 ? 243 TYR A CE1 1 ATOM 1208 C CE2 . TYR A 1 200 ? -1.380 20.627 27.066 1.00 47.76 ? 243 TYR A CE2 1 ATOM 1209 C CZ . TYR A 1 200 ? -1.772 19.459 27.690 1.00 61.06 ? 243 TYR A CZ 1 ATOM 1210 O OH . TYR A 1 200 ? -0.967 18.344 27.632 1.00 65.29 ? 243 TYR A OH 1 ATOM 1211 N N . TRP A 1 201 ? -2.397 25.274 28.934 1.00 40.93 ? 244 TRP A N 1 ATOM 1212 C CA . TRP A 1 201 ? -1.043 25.789 29.063 1.00 44.82 ? 244 TRP A CA 1 ATOM 1213 C C . TRP A 1 201 ? -0.898 26.794 30.203 1.00 49.83 ? 244 TRP A C 1 ATOM 1214 O O . TRP A 1 201 ? 0.163 27.412 30.341 1.00 42.82 ? 244 TRP A O 1 ATOM 1215 C CB . TRP A 1 201 ? -0.597 26.395 27.732 1.00 48.50 ? 244 TRP A CB 1 ATOM 1216 C CG . TRP A 1 201 ? -0.527 25.354 26.648 1.00 50.56 ? 244 TRP A CG 1 ATOM 1217 C CD1 . TRP A 1 201 ? -1.438 25.145 25.654 1.00 49.45 ? 244 TRP A CD1 1 ATOM 1218 C CD2 . TRP A 1 201 ? 0.503 24.374 26.458 1.00 37.12 ? 244 TRP A CD2 1 ATOM 1219 N NE1 . TRP A 1 201 ? -1.041 24.099 24.858 1.00 61.97 ? 244 TRP A NE1 1 ATOM 1220 C CE2 . TRP A 1 201 ? 0.148 23.608 25.331 1.00 43.85 ? 244 TRP A CE2 1 ATOM 1221 C CE3 . TRP A 1 201 ? 1.692 24.072 27.131 1.00 46.15 ? 244 TRP A CE3 1 ATOM 1222 C CZ2 . TRP A 1 201 ? 0.937 22.560 24.861 1.00 38.17 ? 244 TRP A CZ2 1 ATOM 1223 C CZ3 . TRP A 1 201 ? 2.475 23.032 26.662 1.00 45.94 ? 244 TRP A CZ3 1 ATOM 1224 C CH2 . TRP A 1 201 ? 2.094 22.289 25.538 1.00 43.60 ? 244 TRP A CH2 1 ATOM 1225 N N . GLY A 1 202 ? -1.919 26.951 31.032 1.00 46.19 ? 245 GLY A N 1 ATOM 1226 C CA . GLY A 1 202 ? -1.969 27.999 32.031 1.00 57.29 ? 245 GLY A CA 1 ATOM 1227 C C . GLY A 1 202 ? -3.063 29.012 31.736 1.00 55.82 ? 245 GLY A C 1 ATOM 1228 O O . GLY A 1 202 ? -3.677 29.026 30.669 1.00 41.80 ? 245 GLY A O 1 ATOM 1229 N N . GLU A 1 203 ? -3.320 29.858 32.735 1.00 57.75 ? 246 GLU A N 1 ATOM 1230 C CA . GLU A 1 203 ? -4.487 30.728 32.725 1.00 49.72 ? 246 GLU A CA 1 ATOM 1231 C C . GLU A 1 203 ? -4.078 32.178 32.962 1.00 56.42 ? 246 GLU A C 1 ATOM 1232 O O . GLU A 1 203 ? -2.972 32.473 33.421 1.00 63.59 ? 246 GLU A O 1 ATOM 1233 C CB . GLU A 1 203 ? -5.518 30.292 33.776 1.00 59.10 ? 246 GLU A CB 1 ATOM 1234 C CG . GLU A 1 203 ? -6.860 30.985 33.634 1.00 63.74 ? 246 GLU A CG 1 ATOM 1235 C CD . GLU A 1 203 ? -7.397 30.910 32.218 1.00 69.41 ? 246 GLU A CD 1 ATOM 1236 O OE1 . GLU A 1 203 ? -7.507 29.786 31.685 1.00 65.62 ? 246 GLU A OE1 1 ATOM 1237 O OE2 . GLU A 1 203 ? -7.692 31.976 31.633 1.00 69.93 -1 246 GLU A OE2 1 ATOM 1238 N N . TYR A 1 204 ? -5.013 33.076 32.657 1.00 61.95 ? 247 TYR A N 1 ATOM 1239 C CA . TYR A 1 204 ? -4.819 34.522 32.650 1.00 60.27 ? 247 TYR A CA 1 ATOM 1240 C C . TYR A 1 204 ? -5.132 35.194 33.986 1.00 67.44 ? 247 TYR A C 1 ATOM 1241 O O . TYR A 1 204 ? -5.252 36.422 34.032 1.00 86.17 ? 247 TYR A O 1 ATOM 1242 C CB . TYR A 1 204 ? -5.641 35.154 31.526 1.00 57.69 ? 247 TYR A CB 1 ATOM 1243 C CG . TYR A 1 204 ? -4.871 35.253 30.227 1.00 59.02 ? 247 TYR A CG 1 ATOM 1244 C CD1 . TYR A 1 204 ? -3.555 35.698 30.215 1.00 61.58 ? 247 TYR A CD1 1 ATOM 1245 C CD2 . TYR A 1 204 ? -5.448 34.889 29.018 1.00 56.04 ? 247 TYR A CD2 1 ATOM 1246 C CE1 . TYR A 1 204 ? -2.840 35.793 29.039 1.00 48.05 ? 247 TYR A CE1 1 ATOM 1247 C CE2 . TYR A 1 204 ? -4.739 34.977 27.834 1.00 55.31 ? 247 TYR A CE2 1 ATOM 1248 C CZ . TYR A 1 204 ? -3.436 35.429 27.850 1.00 58.56 ? 247 TYR A CZ 1 ATOM 1249 O OH . TYR A 1 204 ? -2.727 35.516 26.672 1.00 51.60 ? 247 TYR A OH 1 ATOM 1250 N N . SER A 1 205 ? -5.328 34.422 35.051 1.00 54.02 ? 248 SER A N 1 ATOM 1251 C CA . SER A 1 205 ? -5.546 34.945 36.395 1.00 63.97 ? 248 SER A CA 1 ATOM 1252 C C . SER A 1 205 ? -4.678 34.156 37.362 1.00 65.62 ? 248 SER A C 1 ATOM 1253 O O . SER A 1 205 ? -4.720 32.926 37.349 1.00 90.59 ? 248 SER A O 1 ATOM 1254 C CB . SER A 1 205 ? -7.021 34.841 36.795 1.00 76.05 ? 248 SER A CB 1 ATOM 1255 O OG . SER A 1 205 ? -7.182 34.940 38.199 1.00 88.92 ? 248 SER A OG 1 ATOM 1256 N N . LYS A 1 206 ? -3.886 34.854 38.184 1.00 63.13 ? 249 LYS A N 1 ATOM 1257 C CA . LYS A 1 206 ? -3.078 34.226 39.257 1.00 69.15 ? 249 LYS A CA 1 ATOM 1258 C C . LYS A 1 206 ? -2.343 33.055 38.605 1.00 78.47 ? 249 LYS A C 1 ATOM 1259 O O . LYS A 1 206 ? -1.723 33.243 37.549 1.00 85.34 ? 249 LYS A O 1 ATOM 1260 C CB . LYS A 1 206 ? -3.964 33.845 40.437 1.00 53.22 ? 249 LYS A CB 1 ATOM 1261 C CG . LYS A 1 206 ? -4.826 34.945 41.041 1.00 64.93 ? 249 LYS A CG 1 ATOM 1262 C CD . LYS A 1 206 ? -5.642 34.347 42.191 1.00 82.92 ? 249 LYS A CD 1 ATOM 1263 C CE . LYS A 1 206 ? -6.470 35.380 42.933 1.00 84.94 ? 249 LYS A CE 1 ATOM 1264 N NZ . LYS A 1 206 ? -7.144 34.780 44.122 1.00 54.95 1 249 LYS A NZ 1 ATOM 1265 N N . CYS A 1 207 ? -2.355 31.860 39.197 1.00 57.15 ? 250 CYS A N 1 ATOM 1266 C CA . CYS A 1 207 ? -2.046 30.665 38.422 1.00 45.06 ? 250 CYS A CA 1 ATOM 1267 C C . CYS A 1 207 ? -0.672 30.634 37.758 1.00 48.79 ? 250 CYS A C 1 ATOM 1268 O O . CYS A 1 207 ? -0.531 31.049 36.605 1.00 87.39 ? 250 CYS A O 1 ATOM 1269 C CB . CYS A 1 207 ? -3.148 30.472 37.383 1.00 50.14 ? 250 CYS A CB 1 ATOM 1270 S SG . CYS A 1 207 ? -4.780 30.414 38.156 1.00 76.60 ? 250 CYS A SG 1 ATOM 1271 N N . ASP A 1 208 ? 0.347 30.167 38.473 1.00 49.23 ? 251 ASP A N 1 ATOM 1272 C CA . ASP A 1 208 ? 1.663 29.968 37.876 1.00 50.64 ? 251 ASP A CA 1 ATOM 1273 C C . ASP A 1 208 ? 1.591 28.812 36.873 1.00 60.43 ? 251 ASP A C 1 ATOM 1274 O O . ASP A 1 208 ? 0.522 28.272 36.573 1.00 55.13 ? 251 ASP A O 1 ATOM 1275 C CB . ASP A 1 208 ? 2.710 29.704 38.954 1.00 52.58 ? 251 ASP A CB 1 ATOM 1276 C CG . ASP A 1 208 ? 3.060 30.946 39.751 1.00 71.76 ? 251 ASP A CG 1 ATOM 1277 O OD1 . ASP A 1 208 ? 3.202 32.026 39.139 1.00 71.80 ? 251 ASP A OD1 1 ATOM 1278 O OD2 . ASP A 1 208 ? 3.189 30.840 40.990 1.00 64.63 -1 251 ASP A OD2 1 ATOM 1279 N N . LEU A 1 209 ? 2.787 28.415 36.309 1.00 52.05 ? 252 LEU A N 1 ATOM 1280 C CA . LEU A 1 209 ? 2.884 27.518 35.161 1.00 47.05 ? 252 LEU A CA 1 ATOM 1281 C C . LEU A 1 209 ? 2.934 26.054 35.589 1.00 58.10 ? 252 LEU A C 1 ATOM 1282 O O . LEU A 1 209 ? 3.571 25.718 36.592 1.00 63.34 ? 252 LEU A O 1 ATOM 1283 C CB . LEU A 1 209 ? 4.131 27.829 34.340 1.00 38.82 ? 252 LEU A CB 1 ATOM 1284 C CG . LEU A 1 209 ? 4.205 29.178 33.630 1.00 51.24 ? 252 LEU A CG 1 ATOM 1285 C CD1 . LEU A 1 209 ? 5.548 29.330 32.932 1.00 43.50 ? 252 LEU A CD1 1 ATOM 1286 C CD2 . LEU A 1 209 ? 3.061 29.318 32.640 1.00 40.59 ? 252 LEU A CD2 1 ATOM 1287 N N . PRO A 1 210 ? 2.265 25.185 34.836 1.00 55.97 ? 253 PRO A N 1 ATOM 1288 C CA . PRO A 1 210 ? 2.528 23.750 34.950 1.00 32.95 ? 253 PRO A CA 1 ATOM 1289 C C . PRO A 1 210 ? 3.825 23.386 34.246 1.00 39.62 ? 253 PRO A C 1 ATOM 1290 O O . PRO A 1 210 ? 4.241 24.033 33.283 1.00 52.72 ? 253 PRO A O 1 ATOM 1291 C CB . PRO A 1 210 ? 1.320 23.118 34.251 1.00 37.25 ? 253 PRO A CB 1 ATOM 1292 C CG . PRO A 1 210 ? 0.912 24.138 33.245 1.00 38.04 ? 253 PRO A CG 1 ATOM 1293 C CD . PRO A 1 210 ? 1.173 25.473 33.888 1.00 52.37 ? 253 PRO A CD 1 ATOM 1294 N N . LEU A 1 211 ? 4.463 22.321 34.738 1.00 48.36 ? 254 LEU A N 1 ATOM 1295 C CA . LEU A 1 211 ? 5.782 21.946 34.236 1.00 42.44 ? 254 LEU A CA 1 ATOM 1296 C C . LEU A 1 211 ? 5.794 21.784 32.721 1.00 44.18 ? 254 LEU A C 1 ATOM 1297 O O . LEU A 1 211 ? 6.811 22.063 32.066 1.00 53.06 ? 254 LEU A O 1 ATOM 1298 C CB . LEU A 1 211 ? 6.245 20.655 34.917 1.00 44.83 ? 254 LEU A CB 1 ATOM 1299 C CG . LEU A 1 211 ? 7.643 20.115 34.603 1.00 31.50 ? 254 LEU A CG 1 ATOM 1300 C CD1 . LEU A 1 211 ? 8.708 21.111 35.015 1.00 32.70 ? 254 LEU A CD1 1 ATOM 1301 C CD2 . LEU A 1 211 ? 7.871 18.778 35.294 1.00 29.69 ? 254 LEU A CD2 1 ATOM 1302 N N . ARG A 1 212 ? 4.672 21.355 32.141 1.00 51.42 ? 255 ARG A N 1 ATOM 1303 C CA . ARG A 1 212 ? 4.641 21.106 30.705 1.00 42.92 ? 255 ARG A CA 1 ATOM 1304 C C . ARG A 1 212 ? 4.920 22.376 29.910 1.00 46.26 ? 255 ARG A C 1 ATOM 1305 O O . ARG A 1 212 ? 5.573 22.323 28.864 1.00 45.79 ? 255 ARG A O 1 ATOM 1306 C CB . ARG A 1 212 ? 3.296 20.507 30.299 1.00 34.20 ? 255 ARG A CB 1 ATOM 1307 C CG . ARG A 1 212 ? 2.172 21.514 30.160 1.00 38.67 ? 255 ARG A CG 1 ATOM 1308 C CD . ARG A 1 212 ? 0.869 20.811 29.828 1.00 42.82 ? 255 ARG A CD 1 ATOM 1309 N NE . ARG A 1 212 ? 0.265 20.185 30.998 1.00 46.22 ? 255 ARG A NE 1 ATOM 1310 C CZ . ARG A 1 212 ? -0.858 20.611 31.565 1.00 51.99 ? 255 ARG A CZ 1 ATOM 1311 N NH1 . ARG A 1 212 ? -1.498 21.652 31.053 1.00 50.62 1 255 ARG A NH1 1 ATOM 1312 N NH2 . ARG A 1 212 ? -1.347 19.991 32.632 1.00 47.23 ? 255 ARG A NH2 1 ATOM 1313 N N . THR A 1 213 ? 4.446 23.530 30.390 1.00 46.38 ? 256 THR A N 1 ATOM 1314 C CA . THR A 1 213 ? 4.677 24.774 29.658 1.00 37.78 ? 256 THR A CA 1 ATOM 1315 C C . THR A 1 213 ? 6.140 25.201 29.708 1.00 37.63 ? 256 THR A C 1 ATOM 1316 O O . THR A 1 213 ? 6.638 25.820 28.759 1.00 41.50 ? 256 THR A O 1 ATOM 1317 C CB . THR A 1 213 ? 3.787 25.889 30.203 1.00 35.72 ? 256 THR A CB 1 ATOM 1318 O OG1 . THR A 1 213 ? 2.412 25.548 29.987 1.00 48.19 ? 256 THR A OG1 1 ATOM 1319 C CG2 . THR A 1 213 ? 4.090 27.196 29.491 1.00 31.67 ? 256 THR A CG2 1 ATOM 1320 N N . LEU A 1 214 ? 6.838 24.897 30.801 1.00 42.76 ? 257 LEU A N 1 ATOM 1321 C CA . LEU A 1 214 ? 8.281 25.097 30.824 1.00 33.12 ? 257 LEU A CA 1 ATOM 1322 C C . LEU A 1 214 ? 8.970 24.158 29.843 1.00 46.75 ? 257 LEU A C 1 ATOM 1323 O O . LEU A 1 214 ? 9.916 24.556 29.149 1.00 51.76 ? 257 LEU A O 1 ATOM 1324 C CB . LEU A 1 214 ? 8.815 24.887 32.240 1.00 43.38 ? 257 LEU A CB 1 ATOM 1325 C CG . LEU A 1 214 ? 8.220 25.766 33.343 1.00 47.65 ? 257 LEU A CG 1 ATOM 1326 C CD1 . LEU A 1 214 ? 8.784 25.367 34.697 1.00 53.69 ? 257 LEU A CD1 1 ATOM 1327 C CD2 . LEU A 1 214 ? 8.484 27.240 33.070 1.00 37.95 ? 257 LEU A CD2 1 ATOM 1328 N N . GLU A 1 215 ? 8.504 22.905 29.765 1.00 51.30 ? 258 GLU A N 1 ATOM 1329 C CA . GLU A 1 215 ? 9.042 21.994 28.759 1.00 53.35 ? 258 GLU A CA 1 ATOM 1330 C C . GLU A 1 215 ? 8.832 22.555 27.355 1.00 51.27 ? 258 GLU A C 1 ATOM 1331 O O . GLU A 1 215 ? 9.742 22.520 26.520 1.00 51.86 ? 258 GLU A O 1 ATOM 1332 C CB . GLU A 1 215 ? 8.403 20.609 28.909 1.00 57.81 ? 258 GLU A CB 1 ATOM 1333 C CG . GLU A 1 215 ? 8.963 19.532 27.977 1.00 72.07 ? 258 GLU A CG 1 ATOM 1334 C CD . GLU A 1 215 ? 8.189 18.215 28.055 1.00 93.83 ? 258 GLU A CD 1 ATOM 1335 O OE1 . GLU A 1 215 ? 7.197 18.149 28.814 1.00 74.52 ? 258 GLU A OE1 1 ATOM 1336 O OE2 . GLU A 1 215 ? 8.589 17.236 27.381 1.00 61.76 -1 258 GLU A OE2 1 ATOM 1337 N N . SER A 1 216 ? 7.646 23.104 27.086 1.00 42.09 ? 259 SER A N 1 ATOM 1338 C CA . SER A 1 216 ? 7.380 23.709 25.785 1.00 45.23 ? 259 SER A CA 1 ATOM 1339 C C . SER A 1 216 ? 8.336 24.860 25.522 1.00 44.43 ? 259 SER A C 1 ATOM 1340 O O . SER A 1 216 ? 8.931 24.960 24.442 1.00 51.88 ? 259 SER A O 1 ATOM 1341 C CB . SER A 1 216 ? 5.931 24.190 25.715 1.00 32.03 ? 259 SER A CB 1 ATOM 1342 O OG . SER A 1 216 ? 5.655 24.772 24.453 1.00 46.72 ? 259 SER A OG 1 ATOM 1343 N N . LEU A 1 217 ? 8.497 25.742 26.509 1.00 44.44 ? 260 LEU A N 1 ATOM 1344 C CA . LEU A 1 217 ? 9.406 26.868 26.351 1.00 46.99 ? 260 LEU A CA 1 ATOM 1345 C C . LEU A 1 217 ? 10.796 26.379 25.967 1.00 44.86 ? 260 LEU A C 1 ATOM 1346 O O . LEU A 1 217 ? 11.423 26.908 25.043 1.00 47.93 ? 260 LEU A O 1 ATOM 1347 C CB . LEU A 1 217 ? 9.450 27.690 27.642 1.00 43.65 ? 260 LEU A CB 1 ATOM 1348 C CG . LEU A 1 217 ? 10.132 29.062 27.624 1.00 42.06 ? 260 LEU A CG 1 ATOM 1349 C CD1 . LEU A 1 217 ? 9.864 29.798 28.931 1.00 29.54 ? 260 LEU A CD1 1 ATOM 1350 C CD2 . LEU A 1 217 ? 11.630 28.951 27.378 1.00 33.01 ? 260 LEU A CD2 1 ATOM 1351 N N . LEU A 1 218 ? 11.293 25.358 26.667 1.00 38.90 ? 261 LEU A N 1 ATOM 1352 C CA . LEU A 1 218 ? 12.657 24.908 26.419 1.00 45.91 ? 261 LEU A CA 1 ATOM 1353 C C . LEU A 1 218 ? 12.781 24.143 25.103 1.00 57.92 ? 261 LEU A C 1 ATOM 1354 O O . LEU A 1 218 ? 13.852 24.155 24.485 1.00 66.03 ? 261 LEU A O 1 ATOM 1355 C CB . LEU A 1 218 ? 13.133 24.056 27.590 1.00 59.84 ? 261 LEU A CB 1 ATOM 1356 C CG . LEU A 1 218 ? 13.227 24.859 28.890 1.00 43.69 ? 261 LEU A CG 1 ATOM 1357 C CD1 . LEU A 1 218 ? 13.251 23.947 30.105 1.00 39.75 ? 261 LEU A CD1 1 ATOM 1358 C CD2 . LEU A 1 218 ? 14.447 25.770 28.869 1.00 46.48 ? 261 LEU A CD2 1 ATOM 1359 N N . SER A 1 219 ? 11.711 23.482 24.654 1.00 52.54 ? 262 SER A N 1 ATOM 1360 C CA . SER A 1 219 ? 11.770 22.770 23.379 1.00 57.30 ? 262 SER A CA 1 ATOM 1361 C C . SER A 1 219 ? 11.733 23.736 22.201 1.00 47.39 ? 262 SER A C 1 ATOM 1362 O O . SER A 1 219 ? 12.460 23.553 21.219 1.00 65.76 ? 262 SER A O 1 ATOM 1363 C CB . SER A 1 219 ? 10.627 21.761 23.272 1.00 63.43 ? 262 SER A CB 1 ATOM 1364 O OG . SER A 1 219 ? 10.860 20.631 24.092 1.00 73.74 ? 262 SER A OG 1 ATOM 1365 N N . GLY A 1 220 ? 10.905 24.777 22.283 1.00 51.17 ? 263 GLY A N 1 ATOM 1366 C CA . GLY A 1 220 ? 10.784 25.712 21.185 1.00 41.19 ? 263 GLY A CA 1 ATOM 1367 C C . GLY A 1 220 ? 11.911 26.708 21.042 1.00 48.08 ? 263 GLY A C 1 ATOM 1368 O O . GLY A 1 220 ? 11.787 27.665 20.273 1.00 64.65 ? 263 GLY A O 1 ATOM 1369 N N . LEU A 1 221 ? 13.023 26.502 21.747 1.00 43.87 ? 264 LEU A N 1 ATOM 1370 C CA . LEU A 1 221 ? 14.121 27.460 21.747 1.00 49.37 ? 264 LEU A CA 1 ATOM 1371 C C . LEU A 1 221 ? 14.904 27.491 20.444 1.00 52.98 ? 264 LEU A C 1 ATOM 1372 O O . LEU A 1 221 ? 15.751 28.375 20.276 1.00 56.37 ? 264 LEU A O 1 ATOM 1373 C CB . LEU A 1 221 ? 15.082 27.153 22.892 1.00 54.46 ? 264 LEU A CB 1 ATOM 1374 C CG . LEU A 1 221 ? 14.564 27.517 24.276 1.00 50.88 ? 264 LEU A CG 1 ATOM 1375 C CD1 . LEU A 1 221 ? 15.548 27.074 25.339 1.00 44.78 ? 264 LEU A CD1 1 ATOM 1376 C CD2 . LEU A 1 221 ? 14.335 29.015 24.332 1.00 46.07 ? 264 LEU A CD2 1 ATOM 1377 N N . GLY A 1 222 ? 14.640 26.577 19.520 1.00 52.36 ? 265 GLY A N 1 ATOM 1378 C CA . GLY A 1 222 ? 15.484 26.437 18.362 1.00 55.29 ? 265 GLY A CA 1 ATOM 1379 C C . GLY A 1 222 ? 15.651 27.715 17.566 1.00 54.04 ? 265 GLY A C 1 ATOM 1380 O O . GLY A 1 222 ? 16.771 28.196 17.367 1.00 54.80 ? 265 GLY A O 1 ATOM 1381 N N . PRO A 1 223 ? 14.537 28.289 17.079 1.00 55.68 ? 266 PRO A N 1 ATOM 1382 C CA . PRO A 1 223 ? 14.524 29.512 16.269 1.00 40.59 ? 266 PRO A CA 1 ATOM 1383 C C . PRO A 1 223 ? 14.243 30.827 16.997 1.00 55.17 ? 266 PRO A C 1 ATOM 1384 O O . PRO A 1 223 ? 13.151 31.356 16.794 1.00 81.19 ? 266 PRO A O 1 ATOM 1385 C CB . PRO A 1 223 ? 13.382 29.234 15.298 1.00 65.49 ? 266 PRO A CB 1 ATOM 1386 C CG . PRO A 1 223 ? 12.383 28.521 16.170 1.00 49.30 ? 266 PRO A CG 1 ATOM 1387 C CD . PRO A 1 223 ? 13.193 27.688 17.153 1.00 57.74 ? 266 PRO A CD 1 ATOM 1388 N N . ALA A 1 224 ? 15.160 31.367 17.793 1.00 62.31 ? 267 ALA A N 1 ATOM 1389 C CA . ALA A 1 224 ? 16.484 30.819 18.023 1.00 71.22 ? 267 ALA A CA 1 ATOM 1390 C C . ALA A 1 224 ? 17.072 31.611 19.194 1.00 52.23 ? 267 ALA A C 1 ATOM 1391 O O . ALA A 1 224 ? 16.382 32.481 19.729 1.00 37.18 ? 267 ALA A O 1 ATOM 1392 C CB . ALA A 1 224 ? 17.332 30.933 16.771 1.00 70.22 ? 267 ALA A CB 1 ATOM 1393 N N . GLY A 1 225 ? 18.313 31.351 19.606 1.00 41.12 ? 268 GLY A N 1 ATOM 1394 C CA . GLY A 1 225 ? 19.127 30.226 19.175 1.00 45.23 ? 268 GLY A CA 1 ATOM 1395 C C . GLY A 1 225 ? 20.160 30.543 18.109 1.00 64.12 ? 268 GLY A C 1 ATOM 1396 O O . GLY A 1 225 ? 19.927 31.377 17.233 1.00 70.95 ? 268 GLY A O 1 ATOM 1397 N N . PRO A 1 226 ? 21.330 29.892 18.182 1.00 56.60 ? 269 PRO A N 1 ATOM 1398 C CA . PRO A 1 226 ? 21.861 29.102 19.298 1.00 51.03 ? 269 PRO A CA 1 ATOM 1399 C C . PRO A 1 226 ? 22.376 30.021 20.406 1.00 52.83 ? 269 PRO A C 1 ATOM 1400 O O . PRO A 1 226 ? 22.767 31.147 20.101 1.00 62.65 ? 269 PRO A O 1 ATOM 1401 C CB . PRO A 1 226 ? 22.999 28.317 18.655 1.00 56.13 ? 269 PRO A CB 1 ATOM 1402 C CG . PRO A 1 226 ? 23.507 29.244 17.612 1.00 58.39 ? 269 PRO A CG 1 ATOM 1403 C CD . PRO A 1 226 ? 22.301 29.979 17.078 1.00 50.68 ? 269 PRO A CD 1 ATOM 1404 N N . PHE A 1 227 ? 22.391 29.565 21.655 1.00 55.72 ? 270 PHE A N 1 ATOM 1405 C CA . PHE A 1 227 ? 22.788 30.407 22.776 1.00 40.51 ? 270 PHE A CA 1 ATOM 1406 C C . PHE A 1 227 ? 24.207 30.077 23.216 1.00 46.47 ? 270 PHE A C 1 ATOM 1407 O O . PHE A 1 227 ? 24.601 28.907 23.255 1.00 60.17 ? 270 PHE A O 1 ATOM 1408 C CB . PHE A 1 227 ? 21.848 30.217 23.966 1.00 32.18 ? 270 PHE A CB 1 ATOM 1409 C CG . PHE A 1 227 ? 20.396 30.343 23.624 1.00 38.81 ? 270 PHE A CG 1 ATOM 1410 C CD1 . PHE A 1 227 ? 19.851 31.569 23.284 1.00 38.84 ? 270 PHE A CD1 1 ATOM 1411 C CD2 . PHE A 1 227 ? 19.570 29.232 23.662 1.00 44.75 ? 270 PHE A CD2 1 ATOM 1412 C CE1 . PHE A 1 227 ? 18.508 31.681 22.975 1.00 40.99 ? 270 PHE A CE1 1 ATOM 1413 C CE2 . PHE A 1 227 ? 18.228 29.336 23.356 1.00 45.45 ? 270 PHE A CE2 1 ATOM 1414 C CZ . PHE A 1 227 ? 17.695 30.561 23.011 1.00 43.93 ? 270 PHE A CZ 1 ATOM 1415 N N . ASP A 1 228 ? 24.977 31.120 23.536 1.00 45.45 ? 271 ASP A N 1 ATOM 1416 C CA . ASP A 1 228 ? 26.285 30.925 24.150 1.00 45.58 ? 271 ASP A CA 1 ATOM 1417 C C . ASP A 1 228 ? 26.178 30.690 25.650 1.00 51.23 ? 271 ASP A C 1 ATOM 1418 O O . ASP A 1 228 ? 26.973 29.929 26.212 1.00 56.68 ? 271 ASP A O 1 ATOM 1419 C CB . ASP A 1 228 ? 27.188 32.130 23.880 1.00 53.91 ? 271 ASP A CB 1 ATOM 1420 C CG . ASP A 1 228 ? 27.584 32.250 22.422 1.00 74.79 ? 271 ASP A CG 1 ATOM 1421 O OD1 . ASP A 1 228 ? 26.703 32.542 21.585 1.00 87.29 ? 271 ASP A OD1 1 ATOM 1422 O OD2 . ASP A 1 228 ? 28.778 32.051 22.113 1.00 86.62 -1 271 ASP A OD2 1 ATOM 1423 N N . MET A 1 229 ? 25.214 31.330 26.308 1.00 49.98 ? 272 MET A N 1 ATOM 1424 C CA . MET A 1 229 ? 25.040 31.204 27.749 1.00 52.71 ? 272 MET A CA 1 ATOM 1425 C C . MET A 1 229 ? 23.597 31.524 28.100 1.00 38.11 ? 272 MET A C 1 ATOM 1426 O O . MET A 1 229 ? 22.837 32.068 27.292 1.00 40.95 ? 272 MET A O 1 ATOM 1427 C CB . MET A 1 229 ? 25.993 32.118 28.526 1.00 43.83 ? 272 MET A CB 1 ATOM 1428 C CG . MET A 1 229 ? 27.451 31.761 28.364 1.00 56.20 ? 272 MET A CG 1 ATOM 1429 S SD . MET A 1 229 ? 28.474 33.217 28.099 1.00 77.91 ? 272 MET A SD 1 ATOM 1430 C CE . MET A 1 229 ? 30.002 32.433 27.585 1.00 68.52 ? 272 MET A CE 1 ATOM 1431 N N . VAL A 1 230 ? 23.231 31.184 29.328 1.00 36.51 ? 273 VAL A N 1 ATOM 1432 C CA . VAL A 1 230 ? 21.895 31.440 29.841 1.00 40.72 ? 273 VAL A CA 1 ATOM 1433 C C . VAL A 1 230 ? 22.027 32.084 31.211 1.00 44.86 ? 273 VAL A C 1 ATOM 1434 O O . VAL A 1 230 ? 22.756 31.581 32.070 1.00 55.04 ? 273 VAL A O 1 ATOM 1435 C CB . VAL A 1 230 ? 21.059 30.151 29.921 1.00 38.03 ? 273 VAL A CB 1 ATOM 1436 C CG1 . VAL A 1 230 ? 19.624 30.469 30.311 1.00 42.63 ? 273 VAL A CG1 1 ATOM 1437 C CG2 . VAL A 1 230 ? 21.106 29.432 28.596 1.00 36.32 ? 273 VAL A CG2 1 ATOM 1438 N N . TYR A 1 231 ? 21.347 33.207 31.399 1.00 39.04 ? 274 TYR A N 1 ATOM 1439 C CA . TYR A 1 231 ? 21.229 33.870 32.686 1.00 30.37 ? 274 TYR A CA 1 ATOM 1440 C C . TYR A 1 231 ? 19.869 33.507 33.264 1.00 37.54 ? 274 TYR A C 1 ATOM 1441 O O . TYR A 1 231 ? 18.832 33.739 32.626 1.00 38.51 ? 274 TYR A O 1 ATOM 1442 C CB . TYR A 1 231 ? 21.387 35.384 32.537 1.00 33.56 ? 274 TYR A CB 1 ATOM 1443 C CG . TYR A 1 231 ? 22.753 35.810 32.040 1.00 32.05 ? 274 TYR A CG 1 ATOM 1444 C CD1 . TYR A 1 231 ? 23.781 34.888 31.898 1.00 30.90 ? 274 TYR A CD1 1 ATOM 1445 C CD2 . TYR A 1 231 ? 23.020 37.137 31.733 1.00 30.36 ? 274 TYR A CD2 1 ATOM 1446 C CE1 . TYR A 1 231 ? 25.030 35.274 31.454 1.00 35.52 ? 274 TYR A CE1 1 ATOM 1447 C CE2 . TYR A 1 231 ? 24.266 37.531 31.288 1.00 32.33 ? 274 TYR A CE2 1 ATOM 1448 C CZ . TYR A 1 231 ? 25.267 36.596 31.152 1.00 30.08 ? 274 TYR A CZ 1 ATOM 1449 O OH . TYR A 1 231 ? 26.511 36.983 30.712 1.00 33.03 ? 274 TYR A OH 1 ATOM 1450 N N . TRP A 1 232 ? 19.877 32.913 34.456 1.00 39.62 ? 275 TRP A N 1 ATOM 1451 C CA . TRP A 1 232 ? 18.667 32.389 35.080 1.00 48.85 ? 275 TRP A CA 1 ATOM 1452 C C . TRP A 1 232 ? 18.509 33.043 36.448 1.00 51.52 ? 275 TRP A C 1 ATOM 1453 O O . TRP A 1 232 ? 19.321 32.809 37.350 1.00 54.48 ? 275 TRP A O 1 ATOM 1454 C CB . TRP A 1 232 ? 18.747 30.868 35.191 1.00 39.06 ? 275 TRP A CB 1 ATOM 1455 C CG . TRP A 1 232 ? 17.520 30.245 35.735 1.00 32.06 ? 275 TRP A CG 1 ATOM 1456 C CD1 . TRP A 1 232 ? 16.301 30.833 35.891 1.00 43.71 ? 275 TRP A CD1 1 ATOM 1457 C CD2 . TRP A 1 232 ? 17.386 28.906 36.211 1.00 30.21 ? 275 TRP A CD2 1 ATOM 1458 N NE1 . TRP A 1 232 ? 15.411 29.939 36.431 1.00 57.73 ? 275 TRP A NE1 1 ATOM 1459 C CE2 . TRP A 1 232 ? 16.053 28.746 36.635 1.00 43.43 ? 275 TRP A CE2 1 ATOM 1460 C CE3 . TRP A 1 232 ? 18.265 27.825 36.321 1.00 35.16 ? 275 TRP A CE3 1 ATOM 1461 C CZ2 . TRP A 1 232 ? 15.578 27.550 37.162 1.00 56.59 ? 275 TRP A CZ2 1 ATOM 1462 C CZ3 . TRP A 1 232 ? 17.792 26.637 36.842 1.00 51.77 ? 275 TRP A CZ3 1 ATOM 1463 C CH2 . TRP A 1 232 ? 16.460 26.508 37.257 1.00 60.16 ? 275 TRP A CH2 1 ATOM 1464 N N . THR A 1 233 ? 17.464 33.860 36.601 1.00 40.18 ? 276 THR A N 1 ATOM 1465 C CA . THR A 1 233 ? 17.380 34.740 37.763 1.00 44.59 ? 276 THR A CA 1 ATOM 1466 C C . THR A 1 233 ? 16.891 34.033 39.025 1.00 54.84 ? 276 THR A C 1 ATOM 1467 O O . THR A 1 233 ? 17.532 34.132 40.074 1.00 80.92 ? 276 THR A O 1 ATOM 1468 C CB . THR A 1 233 ? 16.475 35.930 37.454 1.00 56.45 ? 276 THR A CB 1 ATOM 1469 O OG1 . THR A 1 233 ? 17.093 36.752 36.457 1.00 42.73 ? 276 THR A OG1 1 ATOM 1470 C CG2 . THR A 1 233 ? 16.237 36.744 38.713 1.00 63.84 ? 276 THR A CG2 1 ATOM 1471 N N . GLY A 1 234 ? 15.757 33.340 38.956 1.00 54.46 ? 277 GLY A N 1 ATOM 1472 C CA . GLY A 1 234 ? 15.243 32.671 40.142 1.00 51.07 ? 277 GLY A CA 1 ATOM 1473 C C . GLY A 1 234 ? 13.732 32.543 40.235 1.00 44.88 ? 277 GLY A C 1 ATOM 1474 O O . GLY A 1 234 ? 13.038 32.481 39.219 1.00 70.91 ? 277 GLY A O 1 ATOM 1475 N N . ASP A 1 235 ? 13.224 32.501 41.466 1.00 60.15 ? 278 ASP A N 1 ATOM 1476 C CA . ASP A 1 235 ? 11.789 32.369 41.719 1.00 67.33 ? 278 ASP A CA 1 ATOM 1477 C C . ASP A 1 235 ? 11.225 31.080 41.128 1.00 63.96 ? 278 ASP A C 1 ATOM 1478 O O . ASP A 1 235 ? 10.124 31.061 40.578 1.00 60.15 ? 278 ASP A O 1 ATOM 1479 C CB . ASP A 1 235 ? 11.034 33.577 41.160 1.00 50.09 ? 278 ASP A CB 1 ATOM 1480 C CG . ASP A 1 235 ? 10.726 34.613 42.223 1.00 69.23 ? 278 ASP A CG 1 ATOM 1481 O OD1 . ASP A 1 235 ? 11.432 34.639 43.253 1.00 75.07 ? 278 ASP A OD1 1 ATOM 1482 O OD2 . ASP A 1 235 ? 9.778 35.403 42.028 1.00 72.06 -1 278 ASP A OD2 1 ATOM 1483 N N . ILE A 1 236 ? 11.998 30.007 41.248 1.00 50.18 ? 279 ILE A N 1 ATOM 1484 C CA . ILE A 1 236 ? 11.619 28.698 40.725 1.00 44.73 ? 279 ILE A CA 1 ATOM 1485 C C . ILE A 1 236 ? 10.334 28.108 41.311 1.00 44.37 ? 279 ILE A C 1 ATOM 1486 O O . ILE A 1 236 ? 9.538 27.523 40.576 1.00 45.60 ? 279 ILE A O 1 ATOM 1487 C CB . ILE A 1 236 ? 12.758 27.675 40.906 1.00 32.59 ? 279 ILE A CB 1 ATOM 1488 C CG1 . ILE A 1 236 ? 14.068 28.229 40.345 1.00 39.67 ? 279 ILE A CG1 1 ATOM 1489 C CG2 . ILE A 1 236 ? 12.400 26.357 40.236 1.00 29.62 ? 279 ILE A CG2 1 ATOM 1490 C CD1 . ILE A 1 236 ? 15.267 27.342 40.602 1.00 43.96 ? 279 ILE A CD1 1 ATOM 1491 N N . PRO A 1 237 ? 10.121 28.244 42.619 1.00 42.29 ? 280 PRO A N 1 ATOM 1492 C CA . PRO A 1 237 ? 8.907 27.677 43.217 1.00 42.76 ? 280 PRO A CA 1 ATOM 1493 C C . PRO A 1 237 ? 7.695 28.552 42.946 1.00 48.34 ? 280 PRO A C 1 ATOM 1494 O O . PRO A 1 237 ? 7.805 29.727 42.590 1.00 53.44 ? 280 PRO A O 1 ATOM 1495 C CB . PRO A 1 237 ? 9.227 27.626 44.717 1.00 40.66 ? 280 PRO A CB 1 ATOM 1496 C CG . PRO A 1 237 ? 10.718 27.768 44.808 1.00 50.85 ? 280 PRO A CG 1 ATOM 1497 C CD . PRO A 1 237 ? 11.105 28.628 43.642 1.00 58.45 ? 280 PRO A CD 1 ATOM 1498 N N . ALA A 1 238 ? 6.519 27.945 43.089 1.00 49.54 ? 281 ALA A N 1 ATOM 1499 C CA . ALA A 1 238 ? 5.271 28.629 42.797 1.00 47.30 ? 281 ALA A CA 1 ATOM 1500 C C . ALA A 1 238 ? 4.913 29.615 43.910 1.00 59.60 ? 281 ALA A C 1 ATOM 1501 O O . ALA A 1 238 ? 5.639 29.791 44.893 1.00 53.62 ? 281 ALA A O 1 ATOM 1502 C CB . ALA A 1 238 ? 4.149 27.616 42.585 1.00 52.82 ? 281 ALA A CB 1 ATOM 1503 N N . HIS A 1 239 ? 3.753 30.250 43.755 1.00 70.38 ? 282 HIS A N 1 ATOM 1504 C CA . HIS A 1 239 ? 3.274 31.307 44.636 1.00 44.89 ? 282 HIS A CA 1 ATOM 1505 C C . HIS A 1 239 ? 2.442 30.792 45.797 1.00 61.09 ? 282 HIS A C 1 ATOM 1506 O O . HIS A 1 239 ? 1.823 31.598 46.498 1.00 72.05 ? 282 HIS A O 1 ATOM 1507 C CB . HIS A 1 239 ? 2.464 32.340 43.851 1.00 50.19 ? 282 HIS A CB 1 ATOM 1508 C CG . HIS A 1 239 ? 3.294 33.444 43.275 1.00 64.64 ? 282 HIS A CG 1 ATOM 1509 N ND1 . HIS A 1 239 ? 4.048 33.292 42.132 1.00 60.75 ? 282 HIS A ND1 1 ATOM 1510 C CD2 . HIS A 1 239 ? 3.490 34.718 43.689 1.00 61.75 ? 282 HIS A CD2 1 ATOM 1511 C CE1 . HIS A 1 239 ? 4.667 34.428 41.862 1.00 65.87 ? 282 HIS A CE1 1 ATOM 1512 N NE2 . HIS A 1 239 ? 4.350 35.307 42.794 1.00 64.22 ? 282 HIS A NE2 1 ATOM 1513 N N . ASP A 1 240 ? 2.393 29.483 46.024 1.00 57.87 ? 283 ASP A N 1 ATOM 1514 C CA . ASP A 1 240 ? 1.642 28.979 47.167 1.00 67.08 ? 283 ASP A CA 1 ATOM 1515 C C . ASP A 1 240 ? 2.610 29.052 48.336 1.00 71.93 ? 283 ASP A C 1 ATOM 1516 O O . ASP A 1 240 ? 3.482 28.195 48.503 1.00 70.62 ? 283 ASP A O 1 ATOM 1517 C CB . ASP A 1 240 ? 1.158 27.556 46.912 1.00 76.87 ? 283 ASP A CB 1 ATOM 1518 C CG . ASP A 1 240 ? 2.304 26.593 46.612 1.00 70.45 ? 283 ASP A CG 1 ATOM 1519 O OD1 . ASP A 1 240 ? 3.244 26.993 45.891 1.00 67.43 ? 283 ASP A OD1 1 ATOM 1520 O OD2 . ASP A 1 240 ? 2.272 25.443 47.100 1.00 57.67 -1 283 ASP A OD2 1 ATOM 1521 N N . VAL A 1 241 ? 2.446 30.092 49.156 1.00 73.71 ? 284 VAL A N 1 ATOM 1522 C CA . VAL A 1 241 ? 3.416 30.400 50.197 1.00 72.80 ? 284 VAL A CA 1 ATOM 1523 C C . VAL A 1 241 ? 2.974 29.968 51.583 1.00 66.24 ? 284 VAL A C 1 ATOM 1524 O O . VAL A 1 241 ? 3.772 30.069 52.528 1.00 69.82 ? 284 VAL A O 1 ATOM 1525 C CB . VAL A 1 241 ? 3.746 31.908 50.205 1.00 65.62 ? 284 VAL A CB 1 ATOM 1526 C CG1 . VAL A 1 241 ? 4.571 32.273 48.981 1.00 59.08 ? 284 VAL A CG1 1 ATOM 1527 C CG2 . VAL A 1 241 ? 2.466 32.726 50.247 1.00 65.16 ? 284 VAL A CG2 1 ATOM 1528 N N . TRP A 1 242 ? 1.740 29.489 51.745 1.00 54.91 ? 285 TRP A N 1 ATOM 1529 C CA . TRP A 1 242 ? 1.278 29.171 53.091 1.00 71.09 ? 285 TRP A CA 1 ATOM 1530 C C . TRP A 1 242 ? 1.743 27.788 53.544 1.00 75.11 ? 285 TRP A C 1 ATOM 1531 O O . TRP A 1 242 ? 2.205 27.628 54.679 1.00 68.26 ? 285 TRP A O 1 ATOM 1532 C CB . TRP A 1 242 ? -0.245 29.306 53.177 1.00 57.77 ? 285 TRP A CB 1 ATOM 1533 C CG . TRP A 1 242 ? -1.005 28.546 52.151 1.00 67.19 ? 285 TRP A CG 1 ATOM 1534 C CD1 . TRP A 1 242 ? -1.596 27.327 52.306 1.00 66.53 ? 285 TRP A CD1 1 ATOM 1535 C CD2 . TRP A 1 242 ? -1.270 28.953 50.804 1.00 80.55 ? 285 TRP A CD2 1 ATOM 1536 N NE1 . TRP A 1 242 ? -2.214 26.949 51.140 1.00 64.02 ? 285 TRP A NE1 1 ATOM 1537 C CE2 . TRP A 1 242 ? -2.026 27.929 50.201 1.00 72.87 ? 285 TRP A CE2 1 ATOM 1538 C CE3 . TRP A 1 242 ? -0.938 30.082 50.049 1.00 75.62 ? 285 TRP A CE3 1 ATOM 1539 C CZ2 . TRP A 1 242 ? -2.456 27.999 48.878 1.00 69.52 ? 285 TRP A CZ2 1 ATOM 1540 C CZ3 . TRP A 1 242 ? -1.368 30.152 48.735 1.00 69.24 ? 285 TRP A CZ3 1 ATOM 1541 C CH2 . TRP A 1 242 ? -2.118 29.116 48.164 1.00 76.27 ? 285 TRP A CH2 1 ATOM 1542 N N . HIS A 1 243 ? 1.607 26.774 52.689 1.00 71.09 ? 286 HIS A N 1 ATOM 1543 C CA . HIS A 1 243 ? 1.984 25.409 53.044 1.00 83.48 ? 286 HIS A CA 1 ATOM 1544 C C . HIS A 1 243 ? 3.348 24.975 52.503 1.00 83.22 ? 286 HIS A C 1 ATOM 1545 O O . HIS A 1 243 ? 3.687 23.792 52.610 1.00 89.01 ? 286 HIS A O 1 ATOM 1546 C CB . HIS A 1 243 ? 0.892 24.416 52.628 1.00 70.73 ? 286 HIS A CB 1 ATOM 1547 C CG . HIS A 1 243 ? 0.651 24.336 51.154 1.00 81.69 ? 286 HIS A CG 1 ATOM 1548 N ND1 . HIS A 1 243 ? -0.537 24.732 50.578 1.00 89.91 ? 286 HIS A ND1 1 ATOM 1549 C CD2 . HIS A 1 243 ? 1.426 23.877 50.144 1.00 93.63 ? 286 HIS A CD2 1 ATOM 1550 C CE1 . HIS A 1 243 ? -0.478 24.533 49.274 1.00 98.93 ? 286 HIS A CE1 1 ATOM 1551 N NE2 . HIS A 1 243 ? 0.702 24.016 48.984 1.00 100.27 ? 286 HIS A NE2 1 ATOM 1552 N N . GLN A 1 244 ? 4.128 25.882 51.910 1.00 66.69 ? 287 GLN A N 1 ATOM 1553 C CA . GLN A 1 244 ? 5.416 25.494 51.338 1.00 72.32 ? 287 GLN A CA 1 ATOM 1554 C C . GLN A 1 244 ? 6.272 24.751 52.359 1.00 69.29 ? 287 GLN A C 1 ATOM 1555 O O . GLN A 1 244 ? 6.229 25.029 53.561 1.00 81.10 ? 287 GLN A O 1 ATOM 1556 C CB . GLN A 1 244 ? 6.176 26.723 50.831 1.00 70.04 ? 287 GLN A CB 1 ATOM 1557 C CG . GLN A 1 244 ? 5.892 27.086 49.385 1.00 77.75 ? 287 GLN A CG 1 ATOM 1558 C CD . GLN A 1 244 ? 6.509 28.413 48.987 1.00 78.06 ? 287 GLN A CD 1 ATOM 1559 O OE1 . GLN A 1 244 ? 7.000 29.161 49.833 1.00 100.67 ? 287 GLN A OE1 1 ATOM 1560 N NE2 . GLN A 1 244 ? 6.486 28.712 47.694 1.00 69.07 ? 287 GLN A NE2 1 ATOM 1561 N N . THR A 1 245 ? 7.062 23.795 51.863 1.00 73.58 ? 288 THR A N 1 ATOM 1562 C CA . THR A 1 245 ? 7.968 23.003 52.683 1.00 60.64 ? 288 THR A CA 1 ATOM 1563 C C . THR A 1 245 ? 9.353 22.967 52.054 1.00 60.87 ? 288 THR A C 1 ATOM 1564 O O . THR A 1 245 ? 9.500 23.051 50.831 1.00 70.77 ? 288 THR A O 1 ATOM 1565 C CB . THR A 1 245 ? 7.450 21.563 52.851 1.00 57.31 ? 288 THR A CB 1 ATOM 1566 O OG1 . THR A 1 245 ? 6.294 21.562 53.697 1.00 80.20 ? 288 THR A OG1 1 ATOM 1567 C CG2 . THR A 1 245 ? 8.518 20.662 53.450 1.00 70.99 ? 288 THR A CG2 1 ATOM 1568 N N . ARG A 1 246 ? 10.372 22.830 52.905 1.00 43.63 ? 289 ARG A N 1 ATOM 1569 C CA . ARG A 1 246 ? 11.741 22.721 52.411 1.00 54.09 ? 289 ARG A CA 1 ATOM 1570 C C . ARG A 1 246 ? 11.870 21.613 51.371 1.00 54.77 ? 289 ARG A C 1 ATOM 1571 O O . ARG A 1 246 ? 12.538 21.785 50.343 1.00 63.82 ? 289 ARG A O 1 ATOM 1572 C CB . ARG A 1 246 ? 12.699 22.478 53.577 1.00 56.16 ? 289 ARG A CB 1 ATOM 1573 C CG . ARG A 1 246 ? 12.786 23.637 54.552 1.00 56.57 ? 289 ARG A CG 1 ATOM 1574 C CD . ARG A 1 246 ? 13.996 23.502 55.451 1.00 55.50 ? 289 ARG A CD 1 ATOM 1575 N NE . ARG A 1 246 ? 14.146 24.645 56.346 1.00 59.79 ? 289 ARG A NE 1 ATOM 1576 C CZ . ARG A 1 246 ? 15.182 24.816 57.162 1.00 78.67 ? 289 ARG A CZ 1 ATOM 1577 N NH1 . ARG A 1 246 ? 16.156 23.915 57.194 1.00 79.54 1 289 ARG A NH1 1 ATOM 1578 N NH2 . ARG A 1 246 ? 15.248 25.887 57.943 1.00 65.63 ? 289 ARG A NH2 1 ATOM 1579 N N . GLN A 1 247 ? 11.235 20.467 51.622 1.00 51.43 ? 290 GLN A N 1 ATOM 1580 C CA . GLN A 1 247 ? 11.291 19.371 50.661 1.00 73.61 ? 290 GLN A CA 1 ATOM 1581 C C . GLN A 1 247 ? 10.719 19.793 49.314 1.00 73.80 ? 290 GLN A C 1 ATOM 1582 O O . GLN A 1 247 ? 11.265 19.446 48.260 1.00 66.25 ? 290 GLN A O 1 ATOM 1583 C CB . GLN A 1 247 ? 10.532 18.160 51.201 1.00 87.92 ? 290 GLN A CB 1 ATOM 1584 C CG . GLN A 1 247 ? 10.542 16.968 50.261 1.00 84.60 ? 290 GLN A CG 1 ATOM 1585 C CD . GLN A 1 247 ? 9.734 15.804 50.790 1.00 84.45 ? 290 GLN A CD 1 ATOM 1586 O OE1 . GLN A 1 247 ? 9.655 15.584 52.000 1.00 80.76 ? 290 GLN A OE1 1 ATOM 1587 N NE2 . GLN A 1 247 ? 9.123 15.050 49.882 1.00 101.85 ? 290 GLN A NE2 1 ATOM 1588 N N . ASP A 1 248 ? 9.620 20.550 49.333 1.00 73.64 ? 291 ASP A N 1 ATOM 1589 C CA . ASP A 1 248 ? 8.990 20.988 48.092 1.00 68.75 ? 291 ASP A CA 1 ATOM 1590 C C . ASP A 1 248 ? 9.868 21.992 47.358 1.00 60.33 ? 291 ASP A C 1 ATOM 1591 O O . ASP A 1 248 ? 10.081 21.876 46.146 1.00 59.79 ? 291 ASP A O 1 ATOM 1592 C CB . ASP A 1 248 ? 7.616 21.584 48.392 1.00 76.38 ? 291 ASP A CB 1 ATOM 1593 C CG . ASP A 1 248 ? 6.654 20.563 48.967 1.00 90.22 ? 291 ASP A CG 1 ATOM 1594 O OD1 . ASP A 1 248 ? 6.795 19.364 48.639 1.00 82.88 ? 291 ASP A OD1 1 ATOM 1595 O OD2 . ASP A 1 248 ? 5.766 20.960 49.754 1.00 85.77 -1 291 ASP A OD2 1 ATOM 1596 N N . GLN A 1 249 ? 10.377 22.994 48.077 1.00 51.28 ? 292 GLN A N 1 ATOM 1597 C CA . GLN A 1 249 ? 11.275 23.959 47.454 1.00 56.23 ? 292 GLN A CA 1 ATOM 1598 C C . GLN A 1 249 ? 12.446 23.249 46.787 1.00 54.26 ? 292 GLN A C 1 ATOM 1599 O O . GLN A 1 249 ? 12.811 23.559 45.644 1.00 58.34 ? 292 GLN A O 1 ATOM 1600 C CB . GLN A 1 249 ? 11.782 24.959 48.498 1.00 52.31 ? 292 GLN A CB 1 ATOM 1601 C CG . GLN A 1 249 ? 10.703 25.577 49.388 1.00 56.42 ? 292 GLN A CG 1 ATOM 1602 C CD . GLN A 1 249 ? 9.646 26.343 48.615 1.00 58.09 ? 292 GLN A CD 1 ATOM 1603 O OE1 . GLN A 1 249 ? 8.635 25.779 48.198 1.00 63.23 ? 292 GLN A OE1 1 ATOM 1604 N NE2 . GLN A 1 249 ? 9.869 27.637 48.432 1.00 54.81 ? 292 GLN A NE2 1 ATOM 1605 N N . LEU A 1 250 ? 13.036 22.273 47.482 1.00 53.93 ? 293 LEU A N 1 ATOM 1606 C CA . LEU A 1 250 ? 14.141 21.526 46.892 1.00 58.77 ? 293 LEU A CA 1 ATOM 1607 C C . LEU A 1 250 ? 13.682 20.743 45.669 1.00 66.01 ? 293 LEU A C 1 ATOM 1608 O O . LEU A 1 250 ? 14.417 20.635 44.679 1.00 61.81 ? 293 LEU A O 1 ATOM 1609 C CB . LEU A 1 250 ? 14.749 20.593 47.937 1.00 71.67 ? 293 LEU A CB 1 ATOM 1610 C CG . LEU A 1 250 ? 15.486 21.328 49.057 1.00 65.84 ? 293 LEU A CG 1 ATOM 1611 C CD1 . LEU A 1 250 ? 16.322 20.365 49.882 1.00 85.09 ? 293 LEU A CD1 1 ATOM 1612 C CD2 . LEU A 1 250 ? 16.344 22.445 48.482 1.00 63.54 ? 293 LEU A CD2 1 ATOM 1613 N N . ARG A 1 251 ? 12.462 20.204 45.713 1.00 69.01 ? 294 ARG A N 1 ATOM 1614 C CA . ARG A 1 251 ? 11.894 19.554 44.536 1.00 54.54 ? 294 ARG A CA 1 ATOM 1615 C C . ARG A 1 251 ? 11.894 20.503 43.344 1.00 61.07 ? 294 ARG A C 1 ATOM 1616 O O . ARG A 1 251 ? 12.464 20.200 42.289 1.00 62.51 ? 294 ARG A O 1 ATOM 1617 C CB . ARG A 1 251 ? 10.477 19.066 44.844 1.00 55.48 ? 294 ARG A CB 1 ATOM 1618 C CG . ARG A 1 251 ? 9.728 18.501 43.649 1.00 50.40 ? 294 ARG A CG 1 ATOM 1619 C CD . ARG A 1 251 ? 8.338 18.019 44.049 1.00 59.15 ? 294 ARG A CD 1 ATOM 1620 N NE . ARG A 1 251 ? 7.485 19.102 44.534 1.00 68.40 ? 294 ARG A NE 1 ATOM 1621 C CZ . ARG A 1 251 ? 6.251 18.930 44.999 1.00 70.74 ? 294 ARG A CZ 1 ATOM 1622 N NH1 . ARG A 1 251 ? 5.722 17.715 45.047 1.00 67.23 1 294 ARG A NH1 1 ATOM 1623 N NH2 . ARG A 1 251 ? 5.545 19.970 45.422 1.00 65.17 ? 294 ARG A NH2 1 ATOM 1624 N N . ALA A 1 252 ? 11.269 21.671 43.504 1.00 55.46 ? 295 ALA A N 1 ATOM 1625 C CA . ALA A 1 252 ? 11.236 22.650 42.424 1.00 53.15 ? 295 ALA A CA 1 ATOM 1626 C C . ALA A 1 252 ? 12.636 22.939 41.899 1.00 48.74 ? 295 ALA A C 1 ATOM 1627 O O . ALA A 1 252 ? 12.903 22.814 40.696 1.00 50.90 ? 295 ALA A O 1 ATOM 1628 C CB . ALA A 1 252 ? 10.569 23.938 42.913 1.00 34.04 ? 295 ALA A CB 1 ATOM 1629 N N . LEU A 1 253 ? 13.552 23.302 42.798 1.00 43.20 ? 296 LEU A N 1 ATOM 1630 C CA . LEU A 1 253 ? 14.903 23.664 42.379 1.00 49.16 ? 296 LEU A CA 1 ATOM 1631 C C . LEU A 1 253 ? 15.551 22.553 41.556 1.00 59.94 ? 296 LEU A C 1 ATOM 1632 O O . LEU A 1 253 ? 16.026 22.790 40.436 1.00 55.09 ? 296 LEU A O 1 ATOM 1633 C CB . LEU A 1 253 ? 15.747 24.012 43.607 1.00 56.68 ? 296 LEU A CB 1 ATOM 1634 C CG . LEU A 1 253 ? 17.209 24.415 43.411 1.00 54.35 ? 296 LEU A CG 1 ATOM 1635 C CD1 . LEU A 1 253 ? 17.635 25.383 44.499 1.00 63.27 ? 296 LEU A CD1 1 ATOM 1636 C CD2 . LEU A 1 253 ? 18.099 23.186 43.435 1.00 65.03 ? 296 LEU A CD2 1 ATOM 1637 N N . THR A 1 254 ? 15.559 21.324 42.083 1.00 56.19 ? 297 THR A N 1 ATOM 1638 C CA . THR A 1 254 ? 16.312 20.253 41.433 1.00 59.59 ? 297 THR A CA 1 ATOM 1639 C C . THR A 1 254 ? 15.657 19.808 40.131 1.00 64.08 ? 297 THR A C 1 ATOM 1640 O O . THR A 1 254 ? 16.352 19.566 39.138 1.00 60.72 ? 297 THR A O 1 ATOM 1641 C CB . THR A 1 254 ? 16.459 19.058 42.372 1.00 54.45 ? 297 THR A CB 1 ATOM 1642 O OG1 . THR A 1 254 ? 15.173 18.695 42.886 1.00 60.86 ? 297 THR A OG1 1 ATOM 1643 C CG2 . THR A 1 254 ? 17.385 19.403 43.525 1.00 66.15 ? 297 THR A CG2 1 ATOM 1644 N N . THR A 1 255 ? 14.327 19.679 40.111 1.00 50.00 ? 298 THR A N 1 ATOM 1645 C CA . THR A 1 255 ? 13.673 19.185 38.902 1.00 46.60 ? 298 THR A CA 1 ATOM 1646 C C . THR A 1 255 ? 13.710 20.221 37.787 1.00 54.28 ? 298 THR A C 1 ATOM 1647 O O . THR A 1 255 ? 13.967 19.879 36.626 1.00 53.54 ? 298 THR A O 1 ATOM 1648 C CB . THR A 1 255 ? 12.232 18.770 39.196 1.00 48.63 ? 298 THR A CB 1 ATOM 1649 O OG1 . THR A 1 255 ? 11.408 19.936 39.310 1.00 56.61 ? 298 THR A OG1 1 ATOM 1650 C CG2 . THR A 1 255 ? 12.159 17.954 40.482 1.00 61.99 ? 298 THR A CG2 1 ATOM 1651 N N . VAL A 1 256 ? 13.468 21.493 38.110 1.00 43.21 ? 299 VAL A N 1 ATOM 1652 C CA . VAL A 1 256 ? 13.513 22.507 37.061 1.00 45.37 ? 299 VAL A CA 1 ATOM 1653 C C . VAL A 1 256 ? 14.943 22.697 36.574 1.00 52.43 ? 299 VAL A C 1 ATOM 1654 O O . VAL A 1 256 ? 15.188 22.880 35.371 1.00 52.19 ? 299 VAL A O 1 ATOM 1655 C CB . VAL A 1 256 ? 12.889 23.825 37.550 1.00 37.69 ? 299 VAL A CB 1 ATOM 1656 C CG1 . VAL A 1 256 ? 12.936 24.864 36.449 1.00 30.40 ? 299 VAL A CG1 1 ATOM 1657 C CG2 . VAL A 1 256 ? 11.453 23.593 37.988 1.00 39.83 ? 299 VAL A CG2 1 ATOM 1658 N N . THR A 1 257 ? 15.913 22.649 37.492 1.00 45.41 ? 300 THR A N 1 ATOM 1659 C CA . THR A 1 257 ? 17.306 22.664 37.063 1.00 43.34 ? 300 THR A CA 1 ATOM 1660 C C . THR A 1 257 ? 17.593 21.503 36.119 1.00 52.05 ? 300 THR A C 1 ATOM 1661 O O . THR A 1 257 ? 18.257 21.677 35.090 1.00 54.03 ? 300 THR A O 1 ATOM 1662 C CB . THR A 1 257 ? 18.237 22.610 38.273 1.00 44.10 ? 300 THR A CB 1 ATOM 1663 O OG1 . THR A 1 257 ? 17.957 23.710 39.148 1.00 58.07 ? 300 THR A OG1 1 ATOM 1664 C CG2 . THR A 1 257 ? 19.688 22.681 37.827 1.00 52.32 ? 300 THR A CG2 1 ATOM 1665 N N . ALA A 1 258 ? 17.090 20.312 36.449 1.00 48.21 ? 301 ALA A N 1 ATOM 1666 C CA . ALA A 1 258 ? 17.314 19.150 35.595 1.00 54.92 ? 301 ALA A CA 1 ATOM 1667 C C . ALA A 1 258 ? 16.679 19.341 34.224 1.00 52.83 ? 301 ALA A C 1 ATOM 1668 O O . ALA A 1 258 ? 17.237 18.912 33.210 1.00 54.44 ? 301 ALA A O 1 ATOM 1669 C CB . ALA A 1 258 ? 16.773 17.889 36.267 1.00 48.38 ? 301 ALA A CB 1 ATOM 1670 N N . LEU A 1 259 ? 15.505 19.971 34.176 1.00 48.29 ? 302 LEU A N 1 ATOM 1671 C CA . LEU A 1 259 ? 14.850 20.227 32.897 1.00 52.34 ? 302 LEU A CA 1 ATOM 1672 C C . LEU A 1 259 ? 15.693 21.159 32.034 1.00 47.17 ? 302 LEU A C 1 ATOM 1673 O O . LEU A 1 259 ? 16.038 20.835 30.883 1.00 56.55 ? 302 LEU A O 1 ATOM 1674 C CB . LEU A 1 259 ? 13.463 20.817 33.145 1.00 38.30 ? 302 LEU A CB 1 ATOM 1675 C CG . LEU A 1 259 ? 12.448 20.727 32.013 1.00 31.61 ? 302 LEU A CG 1 ATOM 1676 C CD1 . LEU A 1 259 ? 12.300 19.284 31.585 1.00 56.34 ? 302 LEU A CD1 1 ATOM 1677 C CD2 . LEU A 1 259 ? 11.111 21.285 32.471 1.00 32.92 ? 302 LEU A CD2 1 ATOM 1678 N N . VAL A 1 260 ? 16.044 22.325 32.584 1.00 46.22 ? 303 VAL A N 1 ATOM 1679 C CA . VAL A 1 260 ? 16.911 23.253 31.862 1.00 47.11 ? 303 VAL A CA 1 ATOM 1680 C C . VAL A 1 260 ? 18.147 22.523 31.357 1.00 47.49 ? 303 VAL A C 1 ATOM 1681 O O . VAL A 1 260 ? 18.502 22.599 30.175 1.00 47.51 ? 303 VAL A O 1 ATOM 1682 C CB . VAL A 1 260 ? 17.299 24.437 32.764 1.00 37.37 ? 303 VAL A CB 1 ATOM 1683 C CG1 . VAL A 1 260 ? 18.382 25.271 32.097 1.00 33.94 ? 303 VAL A CG1 1 ATOM 1684 C CG2 . VAL A 1 260 ? 16.081 25.274 33.103 1.00 39.62 ? 303 VAL A CG2 1 ATOM 1685 N N . ARG A 1 261 ? 18.806 21.783 32.249 1.00 55.73 ? 304 ARG A N 1 ATOM 1686 C CA . ARG A 1 261 ? 20.030 21.081 31.881 1.00 51.41 ? 304 ARG A CA 1 ATOM 1687 C C . ARG A 1 261 ? 19.783 20.093 30.750 1.00 48.74 ? 304 ARG A C 1 ATOM 1688 O O . ARG A 1 261 ? 20.626 19.935 29.859 1.00 58.33 ? 304 ARG A O 1 ATOM 1689 C CB . ARG A 1 261 ? 20.597 20.372 33.110 1.00 65.00 ? 304 ARG A CB 1 ATOM 1690 C CG . ARG A 1 261 ? 22.012 19.851 32.959 1.00 65.98 ? 304 ARG A CG 1 ATOM 1691 C CD . ARG A 1 261 ? 22.613 19.583 34.331 1.00 80.68 ? 304 ARG A CD 1 ATOM 1692 N NE . ARG A 1 261 ? 23.875 18.856 34.253 1.00 98.42 ? 304 ARG A NE 1 ATOM 1693 C CZ . ARG A 1 261 ? 23.979 17.536 34.371 1.00 104.14 ? 304 ARG A CZ 1 ATOM 1694 N NH1 . ARG A 1 261 ? 22.893 16.802 34.578 1.00 89.15 1 304 ARG A NH1 1 ATOM 1695 N NH2 . ARG A 1 261 ? 25.166 16.949 34.289 1.00 96.24 ? 304 ARG A NH2 1 ATOM 1696 N N . LYS A 1 262 ? 18.626 19.430 30.758 1.00 47.48 ? 305 LYS A N 1 ATOM 1697 C CA . LYS A 1 262 ? 18.318 18.482 29.695 1.00 46.99 ? 305 LYS A CA 1 ATOM 1698 C C . LYS A 1 262 ? 18.255 19.186 28.350 1.00 53.22 ? 305 LYS A C 1 ATOM 1699 O O . LYS A 1 262 ? 18.851 18.729 27.368 1.00 60.43 ? 305 LYS A O 1 ATOM 1700 C CB . LYS A 1 262 ? 17.000 17.757 29.973 1.00 58.86 ? 305 LYS A CB 1 ATOM 1701 C CG . LYS A 1 262 ? 16.508 16.947 28.772 1.00 62.39 ? 305 LYS A CG 1 ATOM 1702 C CD . LYS A 1 262 ? 15.250 16.147 29.073 1.00 52.05 ? 305 LYS A CD 1 ATOM 1703 C CE . LYS A 1 262 ? 14.002 17.003 28.950 1.00 59.77 ? 305 LYS A CE 1 ATOM 1704 N NZ . LYS A 1 262 ? 12.764 16.216 29.223 1.00 74.91 1 305 LYS A NZ 1 ATOM 1705 N N . PHE A 1 263 ? 17.525 20.300 28.281 1.00 54.83 ? 306 PHE A N 1 ATOM 1706 C CA . PHE A 1 263 ? 17.308 20.908 26.973 1.00 44.76 ? 306 PHE A CA 1 ATOM 1707 C C . PHE A 1 263 ? 18.491 21.744 26.488 1.00 51.99 ? 306 PHE A C 1 ATOM 1708 O O . PHE A 1 263 ? 18.727 21.816 25.277 1.00 65.72 ? 306 PHE A O 1 ATOM 1709 C CB . PHE A 1 263 ? 16.039 21.757 26.994 1.00 47.74 ? 306 PHE A CB 1 ATOM 1710 C CG . PHE A 1 263 ? 14.779 20.947 26.944 1.00 49.96 ? 306 PHE A CG 1 ATOM 1711 C CD1 . PHE A 1 263 ? 14.293 20.476 25.738 1.00 50.31 ? 306 PHE A CD1 1 ATOM 1712 C CD2 . PHE A 1 263 ? 14.081 20.655 28.102 1.00 46.61 ? 306 PHE A CD2 1 ATOM 1713 C CE1 . PHE A 1 263 ? 13.135 19.726 25.687 1.00 54.12 ? 306 PHE A CE1 1 ATOM 1714 C CE2 . PHE A 1 263 ? 12.918 19.910 28.057 1.00 54.46 ? 306 PHE A CE2 1 ATOM 1715 C CZ . PHE A 1 263 ? 12.446 19.444 26.849 1.00 62.47 ? 306 PHE A CZ 1 ATOM 1716 N N . LEU A 1 264 ? 19.236 22.388 27.384 1.00 46.83 ? 307 LEU A N 1 ATOM 1717 C CA . LEU A 1 264 ? 20.325 23.253 26.940 1.00 52.67 ? 307 LEU A CA 1 ATOM 1718 C C . LEU A 1 264 ? 21.690 22.575 26.877 1.00 61.07 ? 307 LEU A C 1 ATOM 1719 O O . LEU A 1 264 ? 22.615 23.152 26.293 1.00 46.57 ? 307 LEU A O 1 ATOM 1720 C CB . LEU A 1 264 ? 20.411 24.488 27.837 1.00 29.34 ? 307 LEU A CB 1 ATOM 1721 C CG . LEU A 1 264 ? 19.318 25.494 27.484 1.00 35.43 ? 307 LEU A CG 1 ATOM 1722 C CD1 . LEU A 1 264 ? 18.130 25.399 28.428 1.00 32.38 ? 307 LEU A CD1 1 ATOM 1723 C CD2 . LEU A 1 264 ? 19.887 26.893 27.438 1.00 34.71 ? 307 LEU A CD2 1 ATOM 1724 N N . GLY A 1 265 ? 21.846 21.382 27.441 1.00 59.70 ? 308 GLY A N 1 ATOM 1725 C CA . GLY A 1 265 ? 23.076 20.638 27.296 1.00 55.94 ? 308 GLY A CA 1 ATOM 1726 C C . GLY A 1 265 ? 24.317 21.411 27.702 1.00 57.47 ? 308 GLY A C 1 ATOM 1727 O O . GLY A 1 265 ? 24.431 21.916 28.824 1.00 62.24 ? 308 GLY A O 1 ATOM 1728 N N . PRO A 1 266 ? 25.284 21.505 26.781 1.00 54.15 ? 309 PRO A N 1 ATOM 1729 C CA . PRO A 1 266 ? 26.593 22.085 27.133 1.00 50.35 ? 309 PRO A CA 1 ATOM 1730 C C . PRO A 1 266 ? 26.583 23.586 27.384 1.00 65.63 ? 309 PRO A C 1 ATOM 1731 O O . PRO A 1 266 ? 27.544 24.094 27.977 1.00 62.78 ? 309 PRO A O 1 ATOM 1732 C CB . PRO A 1 266 ? 27.466 21.735 25.922 1.00 27.45 ? 309 PRO A CB 1 ATOM 1733 C CG . PRO A 1 266 ? 26.501 21.610 24.797 1.00 48.56 ? 309 PRO A CG 1 ATOM 1734 C CD . PRO A 1 266 ? 25.240 21.040 25.385 1.00 45.58 ? 309 PRO A CD 1 ATOM 1735 N N . VAL A 1 267 ? 25.564 24.319 26.946 1.00 58.42 ? 310 VAL A N 1 ATOM 1736 C CA . VAL A 1 267 ? 25.605 25.771 27.160 1.00 56.74 ? 310 VAL A CA 1 ATOM 1737 C C . VAL A 1 267 ? 25.564 26.063 28.657 1.00 55.74 ? 310 VAL A C 1 ATOM 1738 O O . VAL A 1 267 ? 24.737 25.476 29.385 1.00 62.13 ? 310 VAL A O 1 ATOM 1739 C CB . VAL A 1 267 ? 24.444 26.466 26.428 1.00 52.01 ? 310 VAL A CB 1 ATOM 1740 C CG1 . VAL A 1 267 ? 24.571 26.266 24.930 1.00 51.55 ? 310 VAL A CG1 1 ATOM 1741 C CG2 . VAL A 1 267 ? 23.108 25.943 26.926 1.00 61.54 ? 310 VAL A CG2 1 ATOM 1742 N N . PRO A 1 268 ? 26.428 26.933 29.176 1.00 59.89 ? 311 PRO A N 1 ATOM 1743 C CA . PRO A 1 268 ? 26.428 27.190 30.621 1.00 53.25 ? 311 PRO A CA 1 ATOM 1744 C C . PRO A 1 268 ? 25.215 28.002 31.048 1.00 45.64 ? 311 PRO A C 1 ATOM 1745 O O . PRO A 1 268 ? 24.790 28.935 30.361 1.00 53.86 ? 311 PRO A O 1 ATOM 1746 C CB . PRO A 1 268 ? 27.731 27.971 30.846 1.00 41.95 ? 311 PRO A CB 1 ATOM 1747 C CG . PRO A 1 268 ? 28.543 27.771 29.590 1.00 40.96 ? 311 PRO A CG 1 ATOM 1748 C CD . PRO A 1 268 ? 27.543 27.607 28.494 1.00 52.51 ? 311 PRO A CD 1 ATOM 1749 N N . VAL A 1 269 ? 24.673 27.649 32.210 1.00 44.82 ? 312 VAL A N 1 ATOM 1750 C CA . VAL A 1 269 ? 23.561 28.366 32.822 1.00 41.89 ? 312 VAL A CA 1 ATOM 1751 C C . VAL A 1 269 ? 24.057 28.942 34.141 1.00 51.49 ? 312 VAL A C 1 ATOM 1752 O O . VAL A 1 269 ? 24.491 28.196 35.027 1.00 58.68 ? 312 VAL A O 1 ATOM 1753 C CB . VAL A 1 269 ? 22.342 27.456 33.046 1.00 48.36 ? 312 VAL A CB 1 ATOM 1754 C CG1 . VAL A 1 269 ? 21.211 28.233 33.708 1.00 35.41 ? 312 VAL A CG1 1 ATOM 1755 C CG2 . VAL A 1 269 ? 21.885 26.837 31.731 1.00 42.30 ? 312 VAL A CG2 1 ATOM 1756 N N . TYR A 1 270 ? 23.994 30.264 34.269 1.00 48.41 ? 313 TYR A N 1 ATOM 1757 C CA . TYR A 1 270 ? 24.399 30.975 35.477 1.00 34.64 ? 313 TYR A CA 1 ATOM 1758 C C . TYR A 1 270 ? 23.162 31.438 36.235 1.00 40.91 ? 313 TYR A C 1 ATOM 1759 O O . TYR A 1 270 ? 22.456 32.350 35.766 1.00 41.19 ? 313 TYR A O 1 ATOM 1760 C CB . TYR A 1 270 ? 25.285 32.166 35.117 1.00 35.69 ? 313 TYR A CB 1 ATOM 1761 C CG . TYR A 1 270 ? 26.470 31.809 34.242 1.00 40.89 ? 313 TYR A CG 1 ATOM 1762 C CD1 . TYR A 1 270 ? 27.068 30.559 34.318 1.00 44.85 ? 313 TYR A CD1 1 ATOM 1763 C CD2 . TYR A 1 270 ? 26.990 32.724 33.341 1.00 48.29 ? 313 TYR A CD2 1 ATOM 1764 C CE1 . TYR A 1 270 ? 28.153 30.237 33.521 1.00 50.62 ? 313 TYR A CE1 1 ATOM 1765 C CE2 . TYR A 1 270 ? 28.074 32.411 32.542 1.00 44.58 ? 313 TYR A CE2 1 ATOM 1766 C CZ . TYR A 1 270 ? 28.651 31.169 32.635 1.00 40.89 ? 313 TYR A CZ 1 ATOM 1767 O OH . TYR A 1 270 ? 29.730 30.862 31.838 1.00 43.79 ? 313 TYR A OH 1 ATOM 1768 N N . PRO A 1 271 ? 22.834 30.830 37.375 1.00 41.28 ? 314 PRO A N 1 ATOM 1769 C CA . PRO A 1 271 ? 21.611 31.223 38.086 1.00 42.49 ? 314 PRO A CA 1 ATOM 1770 C C . PRO A 1 271 ? 21.830 32.317 39.117 1.00 47.81 ? 314 PRO A C 1 ATOM 1771 O O . PRO A 1 271 ? 22.960 32.727 39.403 1.00 44.20 ? 314 PRO A O 1 ATOM 1772 C CB . PRO A 1 271 ? 21.163 29.920 38.765 1.00 32.17 ? 314 PRO A CB 1 ATOM 1773 C CG . PRO A 1 271 ? 22.116 28.841 38.268 1.00 40.55 ? 314 PRO A CG 1 ATOM 1774 C CD . PRO A 1 271 ? 23.363 29.557 37.876 1.00 40.37 ? 314 PRO A CD 1 ATOM 1775 N N . ALA A 1 272 ? 20.725 32.759 39.707 1.00 44.03 ? 315 ALA A N 1 ATOM 1776 C CA . ALA A 1 272 ? 20.716 33.695 40.817 1.00 36.81 ? 315 ALA A CA 1 ATOM 1777 C C . ALA A 1 272 ? 19.599 33.268 41.753 1.00 52.35 ? 315 ALA A C 1 ATOM 1778 O O . ALA A 1 272 ? 18.739 32.459 41.393 1.00 62.19 ? 315 ALA A O 1 ATOM 1779 C CB . ALA A 1 272 ? 20.528 35.142 40.344 1.00 42.41 ? 315 ALA A CB 1 ATOM 1780 N N . VAL A 1 273 ? 19.610 33.800 42.967 1.00 51.51 ? 316 VAL A N 1 ATOM 1781 C CA . VAL A 1 273 ? 18.654 33.385 43.985 1.00 46.03 ? 316 VAL A CA 1 ATOM 1782 C C . VAL A 1 273 ? 17.467 34.336 43.972 1.00 39.08 ? 316 VAL A C 1 ATOM 1783 O O . VAL A 1 273 ? 17.625 35.546 44.172 1.00 50.27 ? 316 VAL A O 1 ATOM 1784 C CB . VAL A 1 273 ? 19.305 33.326 45.372 1.00 50.29 ? 316 VAL A CB 1 ATOM 1785 C CG1 . VAL A 1 273 ? 18.325 32.758 46.378 1.00 56.54 ? 316 VAL A CG1 1 ATOM 1786 C CG2 . VAL A 1 273 ? 20.566 32.474 45.318 1.00 44.51 ? 316 VAL A CG2 1 ATOM 1787 N N . GLY A 1 274 ? 16.281 33.790 43.718 1.00 36.01 ? 317 GLY A N 1 ATOM 1788 C CA . GLY A 1 274 ? 15.066 34.572 43.736 1.00 45.67 ? 317 GLY A CA 1 ATOM 1789 C C . GLY A 1 274 ? 14.501 34.714 45.138 1.00 51.87 ? 317 GLY A C 1 ATOM 1790 O O . GLY A 1 274 ? 15.077 34.267 46.129 1.00 59.35 ? 317 GLY A O 1 ATOM 1791 N N . ASN A 1 275 ? 13.347 35.370 45.213 1.00 45.34 ? 318 ASN A N 1 ATOM 1792 C CA . ASN A 1 275 ? 12.721 35.662 46.494 1.00 44.71 ? 318 ASN A CA 1 ATOM 1793 C C . ASN A 1 275 ? 11.751 34.583 46.972 1.00 54.31 ? 318 ASN A C 1 ATOM 1794 O O . ASN A 1 275 ? 11.365 34.605 48.147 1.00 49.28 ? 318 ASN A O 1 ATOM 1795 C CB . ASN A 1 275 ? 12.013 37.026 46.420 1.00 41.30 ? 318 ASN A CB 1 ATOM 1796 C CG . ASN A 1 275 ? 10.742 37.002 45.571 1.00 61.98 ? 318 ASN A CG 1 ATOM 1797 O OD1 . ASN A 1 275 ? 10.776 36.873 44.329 1.00 71.71 ? 318 ASN A OD1 1 ATOM 1798 N ND2 . ASN A 1 275 ? 9.608 37.186 46.238 1.00 52.24 ? 318 ASN A ND2 1 ATOM 1799 N N . HIS A 1 276 ? 11.464 33.607 46.133 1.00 53.71 ? 319 HIS A N 1 ATOM 1800 C CA . HIS A 1 276 ? 10.589 32.508 46.499 1.00 63.01 ? 319 HIS A CA 1 ATOM 1801 C C . HIS A 1 276 ? 11.275 31.188 46.640 1.00 63.43 ? 319 HIS A C 1 ATOM 1802 O O . HIS A 1 276 ? 10.645 30.189 46.846 1.00 59.07 ? 319 HIS A O 1 ATOM 1803 C CB . HIS A 1 276 ? 9.496 32.337 45.496 1.00 49.33 ? 319 HIS A CB 1 ATOM 1804 C CG . HIS A 1 276 ? 8.482 33.399 45.570 1.00 39.96 ? 319 HIS A CG 1 ATOM 1805 N ND1 . HIS A 1 276 ? 7.154 33.137 45.735 1.00 51.72 ? 319 HIS A ND1 1 ATOM 1806 C CD2 . HIS A 1 276 ? 8.600 34.735 45.527 1.00 45.49 ? 319 HIS A CD2 1 ATOM 1807 C CE1 . HIS A 1 276 ? 6.487 34.268 45.778 1.00 51.90 ? 319 HIS A CE1 1 ATOM 1808 N NE2 . HIS A 1 276 ? 7.344 35.254 45.658 1.00 48.86 ? 319 HIS A NE2 1 ATOM 1809 N N . GLU A 1 277 ? 12.571 31.176 46.510 1.00 55.60 ? 320 GLU A N 1 ATOM 1810 C CA . GLU A 1 277 ? 13.317 29.931 46.683 1.00 59.90 ? 320 GLU A CA 1 ATOM 1811 C C . GLU A 1 277 ? 13.182 29.385 48.101 1.00 63.40 ? 320 GLU A C 1 ATOM 1812 O O . GLU A 1 277 ? 12.735 28.251 48.306 1.00 56.23 ? 320 GLU A O 1 ATOM 1813 C CB . GLU A 1 277 ? 14.784 30.155 46.319 1.00 53.04 ? 320 GLU A CB 1 ATOM 1814 C CG . GLU A 1 277 ? 15.114 29.707 44.917 1.00 62.74 ? 320 GLU A CG 1 ATOM 1815 C CD . GLU A 1 277 ? 14.532 30.642 43.875 1.00 61.70 ? 320 GLU A CD 1 ATOM 1816 O OE1 . GLU A 1 277 ? 14.081 31.744 44.254 1.00 72.75 ? 320 GLU A OE1 1 ATOM 1817 O OE2 . GLU A 1 277 ? 14.521 30.278 42.680 1.00 66.74 -1 320 GLU A OE2 1 ATOM 1818 N N . SER A 1 278 ? 13.593 30.173 49.090 1.00 63.95 ? 321 SER A N 1 ATOM 1819 C CA . SER A 1 278 ? 13.527 29.756 50.482 1.00 55.71 ? 321 SER A CA 1 ATOM 1820 C C . SER A 1 278 ? 12.091 29.753 51.005 1.00 54.96 ? 321 SER A C 1 ATOM 1821 O O . SER A 1 278 ? 11.188 30.380 50.444 1.00 50.78 ? 321 SER A O 1 ATOM 1822 C CB . SER A 1 278 ? 14.387 30.674 51.351 1.00 60.12 ? 321 SER A CB 1 ATOM 1823 O OG . SER A 1 278 ? 14.166 30.427 52.729 1.00 52.99 ? 321 SER A OG 1 ATOM 1824 N N . THR A 1 279 ? 11.892 29.024 52.099 1.00 63.94 ? 322 THR A N 1 ATOM 1825 C CA . THR A 1 279 ? 10.638 29.067 52.841 1.00 69.31 ? 322 THR A CA 1 ATOM 1826 C C . THR A 1 279 ? 10.939 29.344 54.314 1.00 60.32 ? 322 THR A C 1 ATOM 1827 O O . THR A 1 279 ? 11.901 28.807 54.863 1.00 62.11 ? 322 THR A O 1 ATOM 1828 C CB . THR A 1 279 ? 9.842 27.754 52.709 1.00 67.86 ? 322 THR A CB 1 ATOM 1829 O OG1 . THR A 1 279 ? 8.638 27.844 53.480 1.00 66.88 ? 322 THR A OG1 1 ATOM 1830 C CG2 . THR A 1 279 ? 10.668 26.577 53.201 1.00 61.57 ? 322 THR A CG2 1 ATOM 1831 N N . PRO A 1 280 ? 10.115 30.182 54.960 1.00 61.28 ? 323 PRO A N 1 ATOM 1832 C CA . PRO A 1 280 ? 8.961 30.854 54.352 1.00 52.73 ? 323 PRO A CA 1 ATOM 1833 C C . PRO A 1 280 ? 9.385 31.817 53.254 1.00 67.39 ? 323 PRO A C 1 ATOM 1834 O O . PRO A 1 280 ? 10.560 32.184 53.190 1.00 61.55 ? 323 PRO A O 1 ATOM 1835 C CB . PRO A 1 280 ? 8.337 31.623 55.522 1.00 50.30 ? 323 PRO A CB 1 ATOM 1836 C CG . PRO A 1 280 ? 8.920 31.016 56.759 1.00 82.61 ? 323 PRO A CG 1 ATOM 1837 C CD . PRO A 1 280 ? 10.289 30.562 56.371 1.00 71.34 ? 323 PRO A CD 1 ATOM 1838 N N . VAL A 1 281 ? 8.441 32.221 52.402 1.00 72.42 ? 324 VAL A N 1 ATOM 1839 C CA . VAL A 1 281 ? 8.779 33.112 51.301 1.00 61.47 ? 324 VAL A CA 1 ATOM 1840 C C . VAL A 1 281 ? 9.447 34.362 51.851 1.00 50.66 ? 324 VAL A C 1 ATOM 1841 O O . VAL A 1 281 ? 8.960 34.980 52.805 1.00 43.92 ? 324 VAL A O 1 ATOM 1842 C CB . VAL A 1 281 ? 7.523 33.457 50.487 1.00 53.51 ? 324 VAL A CB 1 ATOM 1843 C CG1 . VAL A 1 281 ? 6.567 34.302 51.317 1.00 61.50 ? 324 VAL A CG1 1 ATOM 1844 C CG2 . VAL A 1 281 ? 7.903 34.174 49.202 1.00 49.60 ? 324 VAL A CG2 1 ATOM 1845 N N . ASN A 1 282 ? 10.575 34.738 51.252 1.00 57.25 ? 325 ASN A N 1 ATOM 1846 C CA . ASN A 1 282 ? 11.329 35.950 51.555 1.00 48.97 ? 325 ASN A CA 1 ATOM 1847 C C . ASN A 1 282 ? 12.259 35.783 52.752 1.00 58.41 ? 325 ASN A C 1 ATOM 1848 O O . ASN A 1 282 ? 12.956 36.742 53.099 1.00 67.24 ? 325 ASN A O 1 ATOM 1849 C CB . ASN A 1 282 ? 10.430 37.172 51.792 1.00 50.10 ? 325 ASN A CB 1 ATOM 1850 C CG . ASN A 1 282 ? 9.824 37.703 50.508 1.00 53.62 ? 325 ASN A CG 1 ATOM 1851 O OD1 . ASN A 1 282 ? 10.535 38.208 49.641 1.00 67.96 ? 325 ASN A OD1 1 ATOM 1852 N ND2 . ASN A 1 282 ? 8.505 37.606 50.387 1.00 51.76 ? 325 ASN A ND2 1 ATOM 1853 N N . SER A 1 283 ? 12.308 34.618 53.393 1.00 60.45 ? 326 SER A N 1 ATOM 1854 C CA . SER A 1 283 ? 13.126 34.441 54.588 1.00 50.96 ? 326 SER A CA 1 ATOM 1855 C C . SER A 1 283 ? 14.524 34.014 54.160 1.00 51.06 ? 326 SER A C 1 ATOM 1856 O O . SER A 1 283 ? 14.737 32.873 53.737 1.00 52.54 ? 326 SER A O 1 ATOM 1857 C CB . SER A 1 283 ? 12.505 33.404 55.520 1.00 60.89 ? 326 SER A CB 1 ATOM 1858 O OG . SER A 1 283 ? 13.493 32.798 56.336 1.00 51.13 ? 326 SER A OG 1 ATOM 1859 N N . PHE A 1 284 ? 15.483 34.921 54.315 1.00 48.00 ? 327 PHE A N 1 ATOM 1860 C CA . PHE A 1 284 ? 16.870 34.686 53.917 1.00 60.23 ? 327 PHE A CA 1 ATOM 1861 C C . PHE A 1 284 ? 17.783 35.199 55.013 1.00 66.89 ? 327 PHE A C 1 ATOM 1862 O O . PHE A 1 284 ? 18.341 36.300 54.922 1.00 55.39 ? 327 PHE A O 1 ATOM 1863 C CB . PHE A 1 284 ? 17.188 35.356 52.577 1.00 69.91 ? 327 PHE A CB 1 ATOM 1864 C CG . PHE A 1 284 ? 16.539 34.691 51.402 1.00 55.27 ? 327 PHE A CG 1 ATOM 1865 C CD1 . PHE A 1 284 ? 15.250 35.024 51.023 1.00 48.77 ? 327 PHE A CD1 1 ATOM 1866 C CD2 . PHE A 1 284 ? 17.218 33.719 50.683 1.00 51.73 ? 327 PHE A CD2 1 ATOM 1867 C CE1 . PHE A 1 284 ? 14.652 34.403 49.945 1.00 50.76 ? 327 PHE A CE1 1 ATOM 1868 C CE2 . PHE A 1 284 ? 16.627 33.096 49.609 1.00 46.12 ? 327 PHE A CE2 1 ATOM 1869 C CZ . PHE A 1 284 ? 15.342 33.438 49.238 1.00 55.32 ? 327 PHE A CZ 1 ATOM 1870 N N . PRO A 1 285 ? 17.951 34.428 56.082 1.00 74.78 ? 328 PRO A N 1 ATOM 1871 C CA . PRO A 1 285 ? 18.869 34.826 57.143 1.00 48.78 ? 328 PRO A CA 1 ATOM 1872 C C . PRO A 1 285 ? 20.273 34.994 56.593 1.00 50.39 ? 328 PRO A C 1 ATOM 1873 O O . PRO A 1 285 ? 20.769 34.124 55.861 1.00 68.67 ? 328 PRO A O 1 ATOM 1874 C CB . PRO A 1 285 ? 18.792 33.654 58.132 1.00 62.31 ? 328 PRO A CB 1 ATOM 1875 C CG . PRO A 1 285 ? 18.297 32.500 57.312 1.00 53.72 ? 328 PRO A CG 1 ATOM 1876 C CD . PRO A 1 285 ? 17.348 33.110 56.335 1.00 53.76 ? 328 PRO A CD 1 ATOM 1877 N N . PRO A 1 286 ? 20.946 36.091 56.921 1.00 44.17 ? 329 PRO A N 1 ATOM 1878 C CA . PRO A 1 286 ? 22.318 36.288 56.446 1.00 40.97 ? 329 PRO A CA 1 ATOM 1879 C C . PRO A 1 286 ? 23.237 35.214 56.996 1.00 55.95 ? 329 PRO A C 1 ATOM 1880 O O . PRO A 1 286 ? 22.810 34.366 57.795 1.00 65.59 ? 329 PRO A O 1 ATOM 1881 C CB . PRO A 1 286 ? 22.687 37.675 56.991 1.00 49.28 ? 329 PRO A CB 1 ATOM 1882 C CG . PRO A 1 286 ? 21.370 38.357 57.197 1.00 54.27 ? 329 PRO A CG 1 ATOM 1883 C CD . PRO A 1 286 ? 20.421 37.277 57.616 1.00 42.78 ? 329 PRO A CD 1 ATOM 1884 N N . PRO A 1 287 ? 24.509 35.218 56.600 1.00 58.84 ? 330 PRO A N 1 ATOM 1885 C CA . PRO A 1 287 ? 25.415 34.151 57.053 1.00 69.41 ? 330 PRO A CA 1 ATOM 1886 C C . PRO A 1 287 ? 25.646 34.129 58.555 1.00 76.29 ? 330 PRO A C 1 ATOM 1887 O O . PRO A 1 287 ? 26.081 33.094 59.076 1.00 83.48 ? 330 PRO A O 1 ATOM 1888 C CB . PRO A 1 287 ? 26.714 34.449 56.292 1.00 65.00 ? 330 PRO A CB 1 ATOM 1889 C CG . PRO A 1 287 ? 26.278 35.230 55.094 1.00 62.67 ? 330 PRO A CG 1 ATOM 1890 C CD . PRO A 1 287 ? 25.126 36.069 55.570 1.00 54.81 ? 330 PRO A CD 1 ATOM 1891 N N . PHE A 1 288 ? 25.368 35.221 59.273 1.00 74.90 ? 331 PHE A N 1 ATOM 1892 C CA . PHE A 1 288 ? 25.613 35.214 60.713 1.00 74.02 ? 331 PHE A CA 1 ATOM 1893 C C . PHE A 1 288 ? 24.577 34.407 61.488 1.00 56.56 ? 331 PHE A C 1 ATOM 1894 O O . PHE A 1 288 ? 24.765 34.188 62.689 1.00 52.34 ? 331 PHE A O 1 ATOM 1895 C CB . PHE A 1 288 ? 25.705 36.650 61.256 1.00 71.61 ? 331 PHE A CB 1 ATOM 1896 C CG . PHE A 1 288 ? 24.395 37.399 61.289 1.00 70.87 ? 331 PHE A CG 1 ATOM 1897 C CD1 . PHE A 1 288 ? 23.519 37.255 62.354 1.00 71.69 ? 331 PHE A CD1 1 ATOM 1898 C CD2 . PHE A 1 288 ? 24.064 38.286 60.277 1.00 71.26 ? 331 PHE A CD2 1 ATOM 1899 C CE1 . PHE A 1 288 ? 22.324 37.959 62.393 1.00 68.86 ? 331 PHE A CE1 1 ATOM 1900 C CE2 . PHE A 1 288 ? 22.871 38.992 60.311 1.00 69.22 ? 331 PHE A CE2 1 ATOM 1901 C CZ . PHE A 1 288 ? 22.002 38.828 61.370 1.00 65.01 ? 331 PHE A CZ 1 ATOM 1902 N N . ILE A 1 289 ? 23.512 33.951 60.837 1.00 54.03 ? 332 ILE A N 1 ATOM 1903 C CA . ILE A 1 289 ? 22.583 32.994 61.425 1.00 44.30 ? 332 ILE A CA 1 ATOM 1904 C C . ILE A 1 289 ? 23.031 31.593 61.032 1.00 64.20 ? 332 ILE A C 1 ATOM 1905 O O . ILE A 1 289 ? 23.329 31.332 59.860 1.00 68.61 ? 332 ILE A O 1 ATOM 1906 C CB . ILE A 1 289 ? 21.144 33.263 60.954 1.00 54.20 ? 332 ILE A CB 1 ATOM 1907 C CG1 . ILE A 1 289 ? 20.742 34.717 61.226 1.00 48.25 ? 332 ILE A CG1 1 ATOM 1908 C CG2 . ILE A 1 289 ? 20.176 32.286 61.603 1.00 67.05 ? 332 ILE A CG2 1 ATOM 1909 C CD1 . ILE A 1 289 ? 20.712 35.087 62.691 1.00 49.97 ? 332 ILE A CD1 1 ATOM 1910 N N . GLU A 1 290 ? 23.085 30.688 62.005 1.00 76.43 ? 333 GLU A N 1 ATOM 1911 C CA . GLU A 1 290 ? 23.564 29.334 61.772 1.00 81.60 ? 333 GLU A CA 1 ATOM 1912 C C . GLU A 1 290 ? 22.438 28.330 61.988 1.00 82.88 ? 333 GLU A C 1 ATOM 1913 O O . GLU A 1 290 ? 21.532 28.552 62.799 1.00 64.87 ? 333 GLU A O 1 ATOM 1914 C CB . GLU A 1 290 ? 24.763 29.013 62.670 1.00 61.08 ? 333 GLU A CB 1 ATOM 1915 C CG . GLU A 1 290 ? 25.944 29.955 62.442 1.00 81.39 ? 333 GLU A CG 1 ATOM 1916 C CD . GLU A 1 290 ? 27.238 29.466 63.072 1.00 117.35 ? 333 GLU A CD 1 ATOM 1917 O OE1 . GLU A 1 290 ? 27.192 28.923 64.196 1.00 123.40 ? 333 GLU A OE1 1 ATOM 1918 O OE2 . GLU A 1 290 ? 28.304 29.626 62.436 1.00 89.48 -1 333 GLU A OE2 1 ATOM 1919 N N . GLY A 1 291 ? 22.518 27.212 61.268 1.00 87.11 ? 334 GLY A N 1 ATOM 1920 C CA . GLY A 1 291 ? 21.431 26.248 61.194 1.00 67.19 ? 334 GLY A CA 1 ATOM 1921 C C . GLY A 1 291 ? 21.023 25.735 62.558 1.00 98.08 ? 334 GLY A C 1 ATOM 1922 O O . GLY A 1 291 ? 21.730 25.971 63.540 1.00 107.83 ? 334 GLY A O 1 ATOM 1923 N N . ASN A 1 292 ? 19.893 25.035 62.643 1.00 100.96 ? 335 ASN A N 1 ATOM 1924 C CA . ASN A 1 292 ? 19.124 24.563 61.491 1.00 84.43 ? 335 ASN A CA 1 ATOM 1925 C C . ASN A 1 292 ? 18.392 25.671 60.723 1.00 77.61 ? 335 ASN A C 1 ATOM 1926 O O . ASN A 1 292 ? 18.313 25.633 59.494 1.00 79.54 ? 335 ASN A O 1 ATOM 1927 C CB . ASN A 1 292 ? 18.118 23.500 61.966 1.00 73.94 ? 335 ASN A CB 1 ATOM 1928 C CG . ASN A 1 292 ? 17.198 23.011 60.860 1.00 72.05 ? 335 ASN A CG 1 ATOM 1929 O OD1 . ASN A 1 292 ? 17.635 22.751 59.738 1.00 79.68 ? 335 ASN A OD1 1 ATOM 1930 N ND2 . ASN A 1 292 ? 15.911 22.875 61.179 1.00 63.93 ? 335 ASN A ND2 1 ATOM 1931 N N . HIS A 1 293 ? 17.877 26.666 61.447 1.00 81.77 ? 336 HIS A N 1 ATOM 1932 C CA . HIS A 1 293 ? 16.982 27.658 60.856 1.00 79.92 ? 336 HIS A CA 1 ATOM 1933 C C . HIS A 1 293 ? 17.683 28.605 59.884 1.00 76.85 ? 336 HIS A C 1 ATOM 1934 O O . HIS A 1 293 ? 17.017 29.481 59.319 1.00 53.92 ? 336 HIS A O 1 ATOM 1935 C CB . HIS A 1 293 ? 16.273 28.455 61.956 1.00 82.43 ? 336 HIS A CB 1 ATOM 1936 C CG . HIS A 1 293 ? 17.194 29.015 62.994 1.00 74.32 ? 336 HIS A CG 1 ATOM 1937 N ND1 . HIS A 1 293 ? 17.791 30.251 62.872 1.00 67.46 ? 336 HIS A ND1 1 ATOM 1938 C CD2 . HIS A 1 293 ? 17.625 28.504 64.172 1.00 100.13 ? 336 HIS A CD2 1 ATOM 1939 C CE1 . HIS A 1 293 ? 18.545 30.482 63.931 1.00 68.32 ? 336 HIS A CE1 1 ATOM 1940 N NE2 . HIS A 1 293 ? 18.463 29.437 64.735 1.00 120.02 ? 336 HIS A NE2 1 ATOM 1941 N N . SER A 1 294 ? 18.994 28.477 59.694 1.00 71.77 ? 337 SER A N 1 ATOM 1942 C CA . SER A 1 294 ? 19.692 29.278 58.700 1.00 64.93 ? 337 SER A CA 1 ATOM 1943 C C . SER A 1 294 ? 19.310 28.811 57.293 1.00 61.60 ? 337 SER A C 1 ATOM 1944 O O . SER A 1 294 ? 18.479 27.918 57.105 1.00 64.85 ? 337 SER A O 1 ATOM 1945 C CB . SER A 1 294 ? 21.202 29.197 58.914 1.00 62.42 ? 337 SER A CB 1 ATOM 1946 O OG . SER A 1 294 ? 21.725 27.975 58.423 1.00 51.84 ? 337 SER A OG 1 ATOM 1947 N N . SER A 1 295 ? 19.928 29.431 56.288 1.00 67.27 ? 338 SER A N 1 ATOM 1948 C CA . SER A 1 295 ? 19.694 29.094 54.888 1.00 68.80 ? 338 SER A CA 1 ATOM 1949 C C . SER A 1 295 ? 20.632 28.011 54.370 1.00 60.92 ? 338 SER A C 1 ATOM 1950 O O . SER A 1 295 ? 20.608 27.715 53.173 1.00 58.17 ? 338 SER A O 1 ATOM 1951 C CB . SER A 1 295 ? 19.827 30.341 54.005 1.00 55.79 ? 338 SER A CB 1 ATOM 1952 O OG . SER A 1 295 ? 18.604 31.051 53.923 1.00 61.40 ? 338 SER A OG 1 ATOM 1953 N N . ARG A 1 296 ? 21.456 27.418 55.240 1.00 63.79 ? 339 ARG A N 1 ATOM 1954 C CA . ARG A 1 296 ? 22.427 26.422 54.794 1.00 54.96 ? 339 ARG A CA 1 ATOM 1955 C C . ARG A 1 296 ? 21.786 25.383 53.880 1.00 60.90 ? 339 ARG A C 1 ATOM 1956 O O . ARG A 1 296 ? 22.389 24.958 52.885 1.00 61.16 ? 339 ARG A O 1 ATOM 1957 C CB . ARG A 1 296 ? 23.068 25.741 56.007 1.00 65.84 ? 339 ARG A CB 1 ATOM 1958 C CG . ARG A 1 296 ? 24.268 24.855 55.677 1.00 91.80 ? 339 ARG A CG 1 ATOM 1959 C CD . ARG A 1 296 ? 24.575 23.874 56.809 1.00 103.23 ? 339 ARG A CD 1 ATOM 1960 N NE . ARG A 1 296 ? 25.800 23.112 56.567 1.00 117.78 ? 339 ARG A NE 1 ATOM 1961 C CZ . ARG A 1 296 ? 26.185 22.060 57.286 1.00 115.63 ? 339 ARG A CZ 1 ATOM 1962 N NH1 . ARG A 1 296 ? 25.438 21.632 58.295 1.00 109.92 1 339 ARG A NH1 1 ATOM 1963 N NH2 . ARG A 1 296 ? 27.316 21.432 56.994 1.00 104.66 ? 339 ARG A NH2 1 ATOM 1964 N N . TRP A 1 297 ? 20.557 24.969 54.194 1.00 45.00 ? 340 TRP A N 1 ATOM 1965 C CA . TRP A 1 297 ? 19.918 23.904 53.427 1.00 48.19 ? 340 TRP A CA 1 ATOM 1966 C C . TRP A 1 297 ? 19.740 24.306 51.967 1.00 58.56 ? 340 TRP A C 1 ATOM 1967 O O . TRP A 1 297 ? 20.077 23.543 51.054 1.00 63.20 ? 340 TRP A O 1 ATOM 1968 C CB . TRP A 1 297 ? 18.572 23.544 54.061 1.00 41.07 ? 340 TRP A CB 1 ATOM 1969 C CG . TRP A 1 297 ? 17.578 24.664 54.052 1.00 46.60 ? 340 TRP A CG 1 ATOM 1970 C CD1 . TRP A 1 297 ? 17.481 25.685 54.950 1.00 61.50 ? 340 TRP A CD1 1 ATOM 1971 C CD2 . TRP A 1 297 ? 16.531 24.871 53.096 1.00 61.67 ? 340 TRP A CD2 1 ATOM 1972 N NE1 . TRP A 1 297 ? 16.443 26.520 54.611 1.00 50.99 ? 340 TRP A NE1 1 ATOM 1973 C CE2 . TRP A 1 297 ? 15.843 26.041 53.476 1.00 64.55 ? 340 TRP A CE2 1 ATOM 1974 C CE3 . TRP A 1 297 ? 16.113 24.185 51.952 1.00 57.01 ? 340 TRP A CE3 1 ATOM 1975 C CZ2 . TRP A 1 297 ? 14.758 26.537 52.755 1.00 55.72 ? 340 TRP A CZ2 1 ATOM 1976 C CZ3 . TRP A 1 297 ? 15.036 24.677 51.239 1.00 58.88 ? 340 TRP A CZ3 1 ATOM 1977 C CH2 . TRP A 1 297 ? 14.370 25.842 51.643 1.00 52.15 ? 340 TRP A CH2 1 ATOM 1978 N N . LEU A 1 298 ? 19.241 25.520 51.729 1.00 64.36 ? 341 LEU A N 1 ATOM 1979 C CA . LEU A 1 298 ? 18.979 25.962 50.363 1.00 51.73 ? 341 LEU A CA 1 ATOM 1980 C C . LEU A 1 298 ? 20.277 26.191 49.602 1.00 46.46 ? 341 LEU A C 1 ATOM 1981 O O . LEU A 1 298 ? 20.421 25.751 48.456 1.00 58.38 ? 341 LEU A O 1 ATOM 1982 C CB . LEU A 1 298 ? 18.132 27.233 50.388 1.00 48.68 ? 341 LEU A CB 1 ATOM 1983 C CG . LEU A 1 298 ? 17.624 27.801 49.066 1.00 44.80 ? 341 LEU A CG 1 ATOM 1984 C CD1 . LEU A 1 298 ? 16.758 26.789 48.345 1.00 43.44 ? 341 LEU A CD1 1 ATOM 1985 C CD2 . LEU A 1 298 ? 16.848 29.083 49.326 1.00 59.61 ? 341 LEU A CD2 1 ATOM 1986 N N . TYR A 1 299 ? 21.243 26.863 50.228 1.00 47.62 ? 342 TYR A N 1 ATOM 1987 C CA . TYR A 1 299 ? 22.491 27.154 49.532 1.00 52.56 ? 342 TYR A CA 1 ATOM 1988 C C . TYR A 1 299 ? 23.273 25.885 49.222 1.00 57.59 ? 342 TYR A C 1 ATOM 1989 O O . TYR A 1 299 ? 23.987 25.838 48.214 1.00 67.13 ? 342 TYR A O 1 ATOM 1990 C CB . TYR A 1 299 ? 23.344 28.133 50.338 1.00 63.56 ? 342 TYR A CB 1 ATOM 1991 C CG . TYR A 1 299 ? 22.702 29.494 50.510 1.00 66.03 ? 342 TYR A CG 1 ATOM 1992 C CD1 . TYR A 1 299 ? 21.604 29.866 49.746 1.00 57.57 ? 342 TYR A CD1 1 ATOM 1993 C CD2 . TYR A 1 299 ? 23.207 30.412 51.421 1.00 70.58 ? 342 TYR A CD2 1 ATOM 1994 C CE1 . TYR A 1 299 ? 21.018 31.105 49.894 1.00 67.45 ? 342 TYR A CE1 1 ATOM 1995 C CE2 . TYR A 1 299 ? 22.627 31.657 51.575 1.00 74.35 ? 342 TYR A CE2 1 ATOM 1996 C CZ . TYR A 1 299 ? 21.533 31.998 50.808 1.00 75.87 ? 342 TYR A CZ 1 ATOM 1997 O OH . TYR A 1 299 ? 20.949 33.235 50.956 1.00 79.04 ? 342 TYR A OH 1 ATOM 1998 N N . GLU A 1 300 ? 23.185 24.860 50.074 1.00 66.92 ? 343 GLU A N 1 ATOM 1999 C CA . GLU A 1 300 ? 23.859 23.611 49.740 1.00 66.72 ? 343 GLU A CA 1 ATOM 2000 C C . GLU A 1 300 ? 23.052 22.734 48.791 1.00 57.18 ? 343 GLU A C 1 ATOM 2001 O O . GLU A 1 300 ? 23.644 21.898 48.101 1.00 60.25 ? 343 GLU A O 1 ATOM 2002 C CB . GLU A 1 300 ? 24.209 22.823 51.004 1.00 71.61 ? 343 GLU A CB 1 ATOM 2003 C CG . GLU A 1 300 ? 25.452 23.347 51.709 1.00 93.12 ? 343 GLU A CG 1 ATOM 2004 C CD . GLU A 1 300 ? 25.847 22.512 52.912 1.00 117.99 ? 343 GLU A CD 1 ATOM 2005 O OE1 . GLU A 1 300 ? 25.145 21.521 53.211 1.00 116.13 ? 343 GLU A OE1 1 ATOM 2006 O OE2 . GLU A 1 300 ? 26.869 22.841 53.551 1.00 124.69 -1 343 GLU A OE2 1 ATOM 2007 N N . ALA A 1 301 ? 21.727 22.902 48.729 1.00 52.19 ? 344 ALA A N 1 ATOM 2008 C CA . ALA A 1 301 ? 20.958 22.244 47.676 1.00 51.85 ? 344 ALA A CA 1 ATOM 2009 C C . ALA A 1 301 ? 21.308 22.828 46.313 1.00 69.80 ? 344 ALA A C 1 ATOM 2010 O O . ALA A 1 301 ? 21.506 22.093 45.336 1.00 56.47 ? 344 ALA A O 1 ATOM 2011 C CB . ALA A 1 301 ? 19.460 22.367 47.954 1.00 51.77 ? 344 ALA A CB 1 ATOM 2012 N N . MET A 1 302 ? 21.374 24.154 46.227 1.00 67.48 ? 345 MET A N 1 ATOM 2013 C CA . MET A 1 302 ? 22.080 24.790 45.132 1.00 55.97 ? 345 MET A CA 1 ATOM 2014 C C . MET A 1 302 ? 23.564 24.449 45.239 1.00 51.04 ? 345 MET A C 1 ATOM 2015 O O . MET A 1 302 ? 24.068 24.082 46.303 1.00 62.89 ? 345 MET A O 1 ATOM 2016 C CB . MET A 1 302 ? 21.878 26.306 45.176 1.00 50.56 ? 345 MET A CB 1 ATOM 2017 C CG . MET A 1 302 ? 20.427 26.742 45.324 1.00 44.25 ? 345 MET A CG 1 ATOM 2018 S SD . MET A 1 302 ? 20.270 28.477 45.799 1.00 54.20 ? 345 MET A SD 1 ATOM 2019 C CE . MET A 1 302 ? 18.491 28.641 45.945 1.00 39.18 ? 345 MET A CE 1 ATOM 2020 N N . ALA A 1 303 ? 24.257 24.519 44.109 1.00 49.63 ? 346 ALA A N 1 ATOM 2021 C CA . ALA A 1 303 ? 25.679 24.198 44.076 1.00 69.55 ? 346 ALA A CA 1 ATOM 2022 C C . ALA A 1 303 ? 25.883 22.694 44.203 1.00 76.88 ? 346 ALA A C 1 ATOM 2023 O O . ALA A 1 303 ? 26.950 22.171 43.864 1.00 89.11 ? 346 ALA A O 1 ATOM 2024 C CB . ALA A 1 303 ? 26.433 24.935 45.184 1.00 70.61 ? 346 ALA A CB 1 ATOM 2025 N N . LYS A 1 304 ? 24.866 21.995 44.707 1.00 59.97 ? 347 LYS A N 1 ATOM 2026 C CA . LYS A 1 304 ? 24.749 20.568 44.447 1.00 61.95 ? 347 LYS A CA 1 ATOM 2027 C C . LYS A 1 304 ? 24.083 20.342 43.099 1.00 58.70 ? 347 LYS A C 1 ATOM 2028 O O . LYS A 1 304 ? 24.507 19.476 42.326 1.00 62.04 ? 347 LYS A O 1 ATOM 2029 C CB . LYS A 1 304 ? 23.966 19.880 45.565 1.00 67.45 ? 347 LYS A CB 1 ATOM 2030 C CG . LYS A 1 304 ? 23.991 18.363 45.476 1.00 73.09 ? 347 LYS A CG 1 ATOM 2031 C CD . LYS A 1 304 ? 23.117 17.717 46.539 1.00 81.70 ? 347 LYS A CD 1 ATOM 2032 C CE . LYS A 1 304 ? 23.235 16.201 46.485 1.00 101.98 ? 347 LYS A CE 1 ATOM 2033 N NZ . LYS A 1 304 ? 23.022 15.676 45.105 1.00 81.07 1 347 LYS A NZ 1 ATOM 2034 N N . ALA A 1 305 ? 23.043 21.129 42.806 1.00 48.95 ? 348 ALA A N 1 ATOM 2035 C CA . ALA A 1 305 ? 22.379 21.078 41.511 1.00 48.64 ? 348 ALA A CA 1 ATOM 2036 C C . ALA A 1 305 ? 23.145 21.844 40.442 1.00 48.08 ? 348 ALA A C 1 ATOM 2037 O O . ALA A 1 305 ? 23.129 21.443 39.274 1.00 52.39 ? 348 ALA A O 1 ATOM 2038 C CB . ALA A 1 305 ? 20.957 21.629 41.625 1.00 30.57 ? 348 ALA A CB 1 ATOM 2039 N N . TRP A 1 306 ? 23.812 22.937 40.811 1.00 38.19 ? 349 TRP A N 1 ATOM 2040 C CA . TRP A 1 306 ? 24.506 23.792 39.856 1.00 43.36 ? 349 TRP A CA 1 ATOM 2041 C C . TRP A 1 306 ? 25.986 23.457 39.724 1.00 49.58 ? 349 TRP A C 1 ATOM 2042 O O . TRP A 1 306 ? 26.722 24.204 39.071 1.00 46.94 ? 349 TRP A O 1 ATOM 2043 C CB . TRP A 1 306 ? 24.323 25.261 40.235 1.00 47.03 ? 349 TRP A CB 1 ATOM 2044 C CG . TRP A 1 306 ? 22.883 25.661 40.266 1.00 42.90 ? 349 TRP A CG 1 ATOM 2045 C CD1 . TRP A 1 306 ? 21.837 24.991 39.704 1.00 39.64 ? 349 TRP A CD1 1 ATOM 2046 C CD2 . TRP A 1 306 ? 22.324 26.815 40.903 1.00 42.75 ? 349 TRP A CD2 1 ATOM 2047 N NE1 . TRP A 1 306 ? 20.660 25.654 39.952 1.00 44.30 ? 349 TRP A NE1 1 ATOM 2048 C CE2 . TRP A 1 306 ? 20.932 26.778 40.686 1.00 41.51 ? 349 TRP A CE2 1 ATOM 2049 C CE3 . TRP A 1 306 ? 22.865 27.875 41.637 1.00 41.18 ? 349 TRP A CE3 1 ATOM 2050 C CZ2 . TRP A 1 306 ? 20.074 27.762 41.172 1.00 50.30 ? 349 TRP A CZ2 1 ATOM 2051 C CZ3 . TRP A 1 306 ? 22.011 28.849 42.122 1.00 47.20 ? 349 TRP A CZ3 1 ATOM 2052 C CH2 . TRP A 1 306 ? 20.631 28.787 41.885 1.00 52.16 ? 349 TRP A CH2 1 ATOM 2053 N N . GLU A 1 307 ? 26.443 22.378 40.352 1.00 56.13 ? 350 GLU A N 1 ATOM 2054 C CA . GLU A 1 307 ? 27.846 21.985 40.243 1.00 66.47 ? 350 GLU A CA 1 ATOM 2055 C C . GLU A 1 307 ? 28.354 21.916 38.807 1.00 65.96 ? 350 GLU A C 1 ATOM 2056 O O . GLU A 1 307 ? 29.481 22.378 38.561 1.00 61.08 ? 350 GLU A O 1 ATOM 2057 C CB . GLU A 1 307 ? 28.044 20.634 40.949 1.00 74.91 ? 350 GLU A CB 1 ATOM 2058 C CG . GLU A 1 307 ? 29.486 20.128 40.993 1.00 92.85 ? 350 GLU A CG 1 ATOM 2059 C CD . GLU A 1 307 ? 29.895 19.374 39.735 1.00 97.99 ? 350 GLU A CD 1 ATOM 2060 O OE1 . GLU A 1 307 ? 29.001 18.890 39.008 1.00 87.30 ? 350 GLU A OE1 1 ATOM 2061 O OE2 . GLU A 1 307 ? 31.113 19.257 39.480 1.00 100.85 -1 350 GLU A OE2 1 ATOM 2062 N N . PRO A 1 308 ? 27.612 21.377 37.835 1.00 61.32 ? 351 PRO A N 1 ATOM 2063 C CA . PRO A 1 308 ? 28.158 21.308 36.467 1.00 71.78 ? 351 PRO A CA 1 ATOM 2064 C C . PRO A 1 308 ? 28.443 22.669 35.858 1.00 67.18 ? 351 PRO A C 1 ATOM 2065 O O . PRO A 1 308 ? 29.422 22.820 35.117 1.00 65.09 ? 351 PRO A O 1 ATOM 2066 C CB . PRO A 1 308 ? 27.065 20.558 35.690 1.00 64.00 ? 351 PRO A CB 1 ATOM 2067 C CG . PRO A 1 308 ? 26.280 19.828 36.733 1.00 71.11 ? 351 PRO A CG 1 ATOM 2068 C CD . PRO A 1 308 ? 26.306 20.706 37.944 1.00 61.78 ? 351 PRO A CD 1 ATOM 2069 N N . TRP A 1 309 ? 27.603 23.665 36.143 1.00 62.05 ? 352 TRP A N 1 ATOM 2070 C CA . TRP A 1 309 ? 27.733 24.973 35.509 1.00 49.79 ? 352 TRP A CA 1 ATOM 2071 C C . TRP A 1 309 ? 28.839 25.810 36.141 1.00 51.57 ? 352 TRP A C 1 ATOM 2072 O O . TRP A 1 309 ? 29.679 26.378 35.434 1.00 49.10 ? 352 TRP A O 1 ATOM 2073 C CB . TRP A 1 309 ? 26.398 25.712 35.581 1.00 43.12 ? 352 TRP A CB 1 ATOM 2074 C CG . TRP A 1 309 ? 25.326 25.061 34.775 1.00 48.96 ? 352 TRP A CG 1 ATOM 2075 C CD1 . TRP A 1 309 ? 25.475 24.427 33.577 1.00 44.03 ? 352 TRP A CD1 1 ATOM 2076 C CD2 . TRP A 1 309 ? 23.937 24.964 35.111 1.00 48.95 ? 352 TRP A CD2 1 ATOM 2077 N NE1 . TRP A 1 309 ? 24.265 23.951 33.139 1.00 48.76 ? 352 TRP A NE1 1 ATOM 2078 C CE2 . TRP A 1 309 ? 23.304 24.265 34.064 1.00 49.56 ? 352 TRP A CE2 1 ATOM 2079 C CE3 . TRP A 1 309 ? 23.166 25.404 36.190 1.00 46.40 ? 352 TRP A CE3 1 ATOM 2080 C CZ2 . TRP A 1 309 ? 21.936 23.996 34.065 1.00 43.37 ? 352 TRP A CZ2 1 ATOM 2081 C CZ3 . TRP A 1 309 ? 21.807 25.135 36.189 1.00 41.72 ? 352 TRP A CZ3 1 ATOM 2082 C CH2 . TRP A 1 309 ? 21.208 24.438 35.135 1.00 40.38 ? 352 TRP A CH2 1 ATOM 2083 N N . LEU A 1 310 ? 28.850 25.900 37.450 1.00 62.55 ? 353 LEU A N 1 ATOM 2084 C CA . LEU A 1 310 ? 29.708 26.823 38.175 1.00 55.41 ? 353 LEU A CA 1 ATOM 2085 C C . LEU A 1 310 ? 31.037 26.170 38.546 1.00 59.19 ? 353 LEU A C 1 ATOM 2086 O O . LEU A 1 310 ? 31.091 24.967 38.823 1.00 61.19 ? 353 LEU A O 1 ATOM 2087 C CB . LEU A 1 310 ? 29.003 27.306 39.435 1.00 53.22 ? 353 LEU A CB 1 ATOM 2088 C CG . LEU A 1 310 ? 27.579 27.792 39.150 1.00 47.02 ? 353 LEU A CG 1 ATOM 2089 C CD1 . LEU A 1 310 ? 26.851 28.182 40.430 1.00 52.09 ? 353 LEU A CD1 1 ATOM 2090 C CD2 . LEU A 1 310 ? 27.600 28.942 38.157 1.00 57.12 ? 353 LEU A CD2 1 ATOM 2091 N N . PRO A 1 311 ? 32.127 26.943 38.548 1.00 57.42 ? 354 PRO A N 1 ATOM 2092 C CA . PRO A 1 311 ? 33.423 26.390 38.962 1.00 73.29 ? 354 PRO A CA 1 ATOM 2093 C C . PRO A 1 311 ? 33.534 26.258 40.475 1.00 73.44 ? 354 PRO A C 1 ATOM 2094 O O . PRO A 1 311 ? 32.561 26.497 41.197 1.00 71.26 ? 354 PRO A O 1 ATOM 2095 C CB . PRO A 1 311 ? 34.424 27.409 38.409 1.00 60.85 ? 354 PRO A CB 1 ATOM 2096 C CG . PRO A 1 311 ? 33.674 28.698 38.448 1.00 59.23 ? 354 PRO A CG 1 ATOM 2097 C CD . PRO A 1 311 ? 32.238 28.350 38.124 1.00 72.64 ? 354 PRO A CD 1 ATOM 2098 N N . ALA A 1 312 ? 34.720 25.889 40.965 1.00 73.26 ? 355 ALA A N 1 ATOM 2099 C CA . ALA A 1 312 ? 34.890 25.616 42.390 1.00 70.04 ? 355 ALA A CA 1 ATOM 2100 C C . ALA A 1 312 ? 34.629 26.861 43.232 1.00 76.92 ? 355 ALA A C 1 ATOM 2101 O O . ALA A 1 312 ? 33.773 26.855 44.124 1.00 68.72 ? 355 ALA A O 1 ATOM 2102 C CB . ALA A 1 312 ? 36.292 25.065 42.654 1.00 59.25 ? 355 ALA A CB 1 ATOM 2103 N N . GLU A 1 313 ? 35.370 27.942 42.967 1.00 68.15 ? 356 GLU A N 1 ATOM 2104 C CA . GLU A 1 313 ? 35.218 29.161 43.758 1.00 70.17 ? 356 GLU A CA 1 ATOM 2105 C C . GLU A 1 313 ? 33.763 29.614 43.801 1.00 78.56 ? 356 GLU A C 1 ATOM 2106 O O . GLU A 1 313 ? 33.216 29.904 44.875 1.00 87.38 ? 356 GLU A O 1 ATOM 2107 C CB . GLU A 1 313 ? 36.112 30.266 43.189 1.00 76.90 ? 356 GLU A CB 1 ATOM 2108 C CG . GLU A 1 313 ? 35.791 31.664 43.705 1.00 92.70 ? 356 GLU A CG 1 ATOM 2109 C CD . GLU A 1 313 ? 36.009 31.809 45.201 1.00 102.47 ? 356 GLU A CD 1 ATOM 2110 O OE1 . GLU A 1 313 ? 36.485 30.840 45.832 1.00 99.81 ? 356 GLU A OE1 1 ATOM 2111 O OE2 . GLU A 1 313 ? 35.703 32.893 45.744 1.00 95.57 -1 356 GLU A OE2 1 ATOM 2112 N N . ALA A 1 314 ? 33.119 29.674 42.633 1.00 63.24 ? 357 ALA A N 1 ATOM 2113 C CA . ALA A 1 314 ? 31.716 30.063 42.573 1.00 69.67 ? 357 ALA A CA 1 ATOM 2114 C C . ALA A 1 314 ? 30.885 29.260 43.564 1.00 62.91 ? 357 ALA A C 1 ATOM 2115 O O . ALA A 1 314 ? 30.111 29.822 44.348 1.00 56.00 ? 357 ALA A O 1 ATOM 2116 C CB . ALA A 1 314 ? 31.187 29.882 41.149 1.00 75.66 ? 357 ALA A CB 1 ATOM 2117 N N . LEU A 1 315 ? 31.053 27.937 43.559 1.00 59.33 ? 358 LEU A N 1 ATOM 2118 C CA . LEU A 1 315 ? 30.312 27.100 44.495 1.00 56.70 ? 358 LEU A CA 1 ATOM 2119 C C . LEU A 1 315 ? 30.666 27.442 45.935 1.00 67.87 ? 358 LEU A C 1 ATOM 2120 O O . LEU A 1 315 ? 29.787 27.484 46.805 1.00 53.28 ? 358 LEU A O 1 ATOM 2121 C CB . LEU A 1 315 ? 30.579 25.625 44.202 1.00 52.44 ? 358 LEU A CB 1 ATOM 2122 C CG . LEU A 1 315 ? 30.145 25.155 42.814 1.00 61.15 ? 358 LEU A CG 1 ATOM 2123 C CD1 . LEU A 1 315 ? 30.477 23.690 42.602 1.00 73.67 ? 358 LEU A CD1 1 ATOM 2124 C CD2 . LEU A 1 315 ? 28.654 25.393 42.638 1.00 57.10 ? 358 LEU A CD2 1 ATOM 2125 N N . ARG A 1 316 ? 31.949 27.696 46.208 1.00 60.68 ? 359 ARG A N 1 ATOM 2126 C CA . ARG A 1 316 ? 32.360 28.007 47.573 1.00 59.41 ? 359 ARG A CA 1 ATOM 2127 C C . ARG A 1 316 ? 31.604 29.219 48.099 1.00 65.07 ? 359 ARG A C 1 ATOM 2128 O O . ARG A 1 316 ? 30.990 29.167 49.172 1.00 64.24 ? 359 ARG A O 1 ATOM 2129 C CB . ARG A 1 316 ? 33.868 28.243 47.638 1.00 69.40 ? 359 ARG A CB 1 ATOM 2130 C CG . ARG A 1 316 ? 34.451 28.028 49.030 1.00 84.17 ? 359 ARG A CG 1 ATOM 2131 C CD . ARG A 1 316 ? 35.838 28.631 49.179 1.00 85.11 ? 359 ARG A CD 1 ATOM 2132 N NE . ARG A 1 316 ? 35.796 30.089 49.129 1.00 97.56 ? 359 ARG A NE 1 ATOM 2133 C CZ . ARG A 1 316 ? 35.519 30.861 50.176 1.00 92.54 ? 359 ARG A CZ 1 ATOM 2134 N NH1 . ARG A 1 316 ? 35.257 30.313 51.357 1.00 85.43 1 359 ARG A NH1 1 ATOM 2135 N NH2 . ARG A 1 316 ? 35.501 32.181 50.044 1.00 85.10 ? 359 ARG A NH2 1 ATOM 2136 N N . THR A 1 317 ? 31.631 30.324 47.349 1.00 67.94 ? 360 THR A N 1 ATOM 2137 C CA . THR A 1 317 ? 30.949 31.533 47.806 1.00 63.50 ? 360 THR A CA 1 ATOM 2138 C C . THR A 1 317 ? 29.432 31.370 47.791 1.00 65.17 ? 360 THR A C 1 ATOM 2139 O O . THR A 1 317 ? 28.734 32.004 48.591 1.00 53.86 ? 360 THR A O 1 ATOM 2140 C CB . THR A 1 317 ? 31.367 32.723 46.946 1.00 55.22 ? 360 THR A CB 1 ATOM 2141 O OG1 . THR A 1 317 ? 30.985 32.487 45.584 1.00 76.11 ? 360 THR A OG1 1 ATOM 2142 C CG2 . THR A 1 317 ? 32.874 32.922 47.018 1.00 59.56 ? 360 THR A CG2 1 ATOM 2143 N N . LEU A 1 318 ? 28.908 30.541 46.886 1.00 63.97 ? 361 LEU A N 1 ATOM 2144 C CA . LEU A 1 318 ? 27.472 30.285 46.839 1.00 59.98 ? 361 LEU A CA 1 ATOM 2145 C C . LEU A 1 318 ? 26.988 29.518 48.064 1.00 66.03 ? 361 LEU A C 1 ATOM 2146 O O . LEU A 1 318 ? 25.852 29.717 48.510 1.00 59.19 ? 361 LEU A O 1 ATOM 2147 C CB . LEU A 1 318 ? 27.126 29.511 45.565 1.00 54.37 ? 361 LEU A CB 1 ATOM 2148 C CG . LEU A 1 318 ? 25.727 28.900 45.442 1.00 49.29 ? 361 LEU A CG 1 ATOM 2149 C CD1 . LEU A 1 318 ? 24.653 29.975 45.347 1.00 59.60 ? 361 LEU A CD1 1 ATOM 2150 C CD2 . LEU A 1 318 ? 25.659 27.951 44.256 1.00 49.29 ? 361 LEU A CD2 1 ATOM 2151 N N . ARG A 1 319 ? 27.827 28.634 48.612 1.00 69.27 ? 362 ARG A N 1 ATOM 2152 C CA . ARG A 1 319 ? 27.437 27.855 49.784 1.00 71.65 ? 362 ARG A CA 1 ATOM 2153 C C . ARG A 1 319 ? 27.259 28.731 51.020 1.00 69.89 ? 362 ARG A C 1 ATOM 2154 O O . ARG A 1 319 ? 26.470 28.394 51.911 1.00 57.22 ? 362 ARG A O 1 ATOM 2155 C CB . ARG A 1 319 ? 28.481 26.771 50.053 1.00 56.37 ? 362 ARG A CB 1 ATOM 2156 C CG . ARG A 1 319 ? 28.650 25.785 48.912 1.00 62.71 ? 362 ARG A CG 1 ATOM 2157 C CD . ARG A 1 319 ? 29.680 24.712 49.234 1.00 58.40 ? 362 ARG A CD 1 ATOM 2158 N NE . ARG A 1 319 ? 29.923 23.837 48.090 1.00 64.40 ? 362 ARG A NE 1 ATOM 2159 C CZ . ARG A 1 319 ? 29.197 22.762 47.796 1.00 92.71 ? 362 ARG A CZ 1 ATOM 2160 N NH1 . ARG A 1 319 ? 28.170 22.418 48.564 1.00 89.99 1 362 ARG A NH1 1 ATOM 2161 N NH2 . ARG A 1 319 ? 29.495 22.030 46.729 1.00 78.80 ? 362 ARG A NH2 1 ATOM 2162 N N . ILE A 1 320 ? 27.978 29.847 51.094 1.00 60.66 ? 363 ILE A N 1 ATOM 2163 C CA . ILE A 1 320 ? 27.907 30.741 52.243 1.00 46.72 ? 363 ILE A CA 1 ATOM 2164 C C . ILE A 1 320 ? 26.744 31.711 52.077 1.00 71.78 ? 363 ILE A C 1 ATOM 2165 O O . ILE A 1 320 ? 25.748 31.633 52.805 1.00 64.18 ? 363 ILE A O 1 ATOM 2166 C CB . ILE A 1 320 ? 29.237 31.492 52.422 1.00 57.60 ? 363 ILE A CB 1 ATOM 2167 C CG1 . ILE A 1 320 ? 30.395 30.492 52.486 1.00 42.90 ? 363 ILE A CG1 1 ATOM 2168 C CG2 . ILE A 1 320 ? 29.193 32.383 53.656 1.00 60.02 ? 363 ILE A CG2 1 ATOM 2169 C CD1 . ILE A 1 320 ? 31.764 31.133 52.499 1.00 56.05 ? 363 ILE A CD1 1 ATOM 2170 N N . GLY A 1 321 ? 26.865 32.631 51.119 1.00 76.51 ? 364 GLY A N 1 ATOM 2171 C CA . GLY A 1 321 ? 25.907 33.708 50.966 1.00 71.66 ? 364 GLY A CA 1 ATOM 2172 C C . GLY A 1 321 ? 24.906 33.583 49.832 1.00 68.56 ? 364 GLY A C 1 ATOM 2173 O O . GLY A 1 321 ? 23.927 34.335 49.792 1.00 66.45 ? 364 GLY A O 1 ATOM 2174 N N . GLY A 1 322 ? 25.125 32.655 48.904 1.00 66.29 ? 365 GLY A N 1 ATOM 2175 C CA . GLY A 1 322 ? 24.247 32.558 47.752 1.00 60.35 ? 365 GLY A CA 1 ATOM 2176 C C . GLY A 1 322 ? 24.521 33.552 46.644 1.00 57.10 ? 365 GLY A C 1 ATOM 2177 O O . GLY A 1 322 ? 23.583 34.002 45.980 1.00 55.40 ? 365 GLY A O 1 ATOM 2178 N N . PHE A 1 323 ? 25.785 33.914 46.431 1.00 63.46 ? 366 PHE A N 1 ATOM 2179 C CA . PHE A 1 323 ? 26.193 34.806 45.354 1.00 43.13 ? 366 PHE A CA 1 ATOM 2180 C C . PHE A 1 323 ? 27.604 34.417 44.940 1.00 43.67 ? 366 PHE A C 1 ATOM 2181 O O . PHE A 1 323 ? 28.346 33.817 45.720 1.00 65.63 ? 366 PHE A O 1 ATOM 2182 C CB . PHE A 1 323 ? 26.144 36.270 45.798 1.00 45.67 ? 366 PHE A CB 1 ATOM 2183 C CG . PHE A 1 323 ? 26.964 36.547 47.023 1.00 58.16 ? 366 PHE A CG 1 ATOM 2184 C CD1 . PHE A 1 323 ? 28.311 36.850 46.917 1.00 46.32 ? 366 PHE A CD1 1 ATOM 2185 C CD2 . PHE A 1 323 ? 26.394 36.471 48.285 1.00 64.24 ? 366 PHE A CD2 1 ATOM 2186 C CE1 . PHE A 1 323 ? 29.069 37.094 48.046 1.00 64.98 ? 366 PHE A CE1 1 ATOM 2187 C CE2 . PHE A 1 323 ? 27.145 36.712 49.418 1.00 50.71 ? 366 PHE A CE2 1 ATOM 2188 C CZ . PHE A 1 323 ? 28.485 37.024 49.300 1.00 57.52 ? 366 PHE A CZ 1 ATOM 2189 N N . TYR A 1 324 ? 27.980 34.753 43.710 1.00 51.25 ? 367 TYR A N 1 ATOM 2190 C CA . TYR A 1 324 ? 29.268 34.279 43.211 1.00 44.08 ? 367 TYR A CA 1 ATOM 2191 C C . TYR A 1 324 ? 29.745 35.168 42.070 1.00 48.74 ? 367 TYR A C 1 ATOM 2192 O O . TYR A 1 324 ? 29.072 36.118 41.665 1.00 53.07 ? 367 TYR A O 1 ATOM 2193 C CB . TYR A 1 324 ? 29.171 32.824 42.759 1.00 45.07 ? 367 TYR A CB 1 ATOM 2194 C CG . TYR A 1 324 ? 28.121 32.616 41.700 1.00 44.98 ? 367 TYR A CG 1 ATOM 2195 C CD1 . TYR A 1 324 ? 26.780 32.519 42.040 1.00 54.21 ? 367 TYR A CD1 1 ATOM 2196 C CD2 . TYR A 1 324 ? 28.467 32.524 40.361 1.00 46.91 ? 367 TYR A CD2 1 ATOM 2197 C CE1 . TYR A 1 324 ? 25.812 32.335 41.078 1.00 52.13 ? 367 TYR A CE1 1 ATOM 2198 C CE2 . TYR A 1 324 ? 27.504 32.340 39.388 1.00 47.49 ? 367 TYR A CE2 1 ATOM 2199 C CZ . TYR A 1 324 ? 26.177 32.246 39.754 1.00 51.05 ? 367 TYR A CZ 1 ATOM 2200 O OH . TYR A 1 324 ? 25.207 32.061 38.797 1.00 54.31 ? 367 TYR A OH 1 ATOM 2201 N N . ALA A 1 325 ? 30.927 34.837 41.552 1.00 48.90 ? 368 ALA A N 1 ATOM 2202 C CA . ALA A 1 325 ? 31.514 35.512 40.405 1.00 42.80 ? 368 ALA A CA 1 ATOM 2203 C C . ALA A 1 325 ? 32.296 34.491 39.593 1.00 46.20 ? 368 ALA A C 1 ATOM 2204 O O . ALA A 1 325 ? 32.873 33.553 40.148 1.00 49.93 ? 368 ALA A O 1 ATOM 2205 C CB . ALA A 1 325 ? 32.426 36.665 40.833 1.00 38.14 ? 368 ALA A CB 1 ATOM 2206 N N . LEU A 1 326 ? 32.314 34.677 38.274 1.00 51.65 ? 369 LEU A N 1 ATOM 2207 C CA . LEU A 1 326 ? 33.035 33.761 37.394 1.00 43.32 ? 369 LEU A CA 1 ATOM 2208 C C . LEU A 1 326 ? 33.354 34.487 36.094 1.00 42.83 ? 369 LEU A C 1 ATOM 2209 O O . LEU A 1 326 ? 33.010 35.656 35.917 1.00 55.38 ? 369 LEU A O 1 ATOM 2210 C CB . LEU A 1 326 ? 32.231 32.480 37.148 1.00 45.42 ? 369 LEU A CB 1 ATOM 2211 C CG . LEU A 1 326 ? 30.832 32.653 36.555 1.00 51.31 ? 369 LEU A CG 1 ATOM 2212 C CD1 . LEU A 1 326 ? 30.911 32.886 35.055 1.00 56.61 ? 369 LEU A CD1 1 ATOM 2213 C CD2 . LEU A 1 326 ? 29.951 31.457 36.873 1.00 54.33 ? 369 LEU A CD2 1 ATOM 2214 N N . SER A 1 327 ? 34.023 33.783 35.179 1.00 42.04 ? 370 SER A N 1 ATOM 2215 C CA . SER A 1 327 ? 34.510 34.374 33.931 1.00 56.77 ? 370 SER A CA 1 ATOM 2216 C C . SER A 1 327 ? 34.054 33.553 32.732 1.00 51.39 ? 370 SER A C 1 ATOM 2217 O O . SER A 1 327 ? 34.751 32.623 32.301 1.00 51.29 ? 370 SER A O 1 ATOM 2218 C CB . SER A 1 327 ? 36.033 34.498 33.944 1.00 65.61 ? 370 SER A CB 1 ATOM 2219 O OG . SER A 1 327 ? 36.469 35.450 34.899 1.00 55.90 ? 370 SER A OG 1 ATOM 2220 N N . PRO A 1 328 ? 32.894 33.877 32.152 1.00 60.50 ? 371 PRO A N 1 ATOM 2221 C CA . PRO A 1 328 ? 32.458 33.133 30.955 1.00 59.89 ? 371 PRO A CA 1 ATOM 2222 C C . PRO A 1 328 ? 33.424 33.266 29.791 1.00 59.82 ? 371 PRO A C 1 ATOM 2223 O O . PRO A 1 328 ? 33.765 32.265 29.147 1.00 72.98 ? 371 PRO A O 1 ATOM 2224 C CB . PRO A 1 328 ? 31.089 33.755 30.638 1.00 42.56 ? 371 PRO A CB 1 ATOM 2225 C CG . PRO A 1 328 ? 30.665 34.445 31.894 1.00 48.67 ? 371 PRO A CG 1 ATOM 2226 C CD . PRO A 1 328 ? 31.927 34.913 32.544 1.00 50.32 ? 371 PRO A CD 1 ATOM 2227 N N . TYR A 1 329 ? 33.879 34.483 29.507 1.00 58.69 ? 372 TYR A N 1 ATOM 2228 C CA . TYR A 1 329 ? 34.840 34.766 28.456 1.00 64.22 ? 372 TYR A CA 1 ATOM 2229 C C . TYR A 1 329 ? 36.090 35.391 29.058 1.00 68.93 ? 372 TYR A C 1 ATOM 2230 O O . TYR A 1 329 ? 36.019 36.036 30.110 1.00 58.15 ? 372 TYR A O 1 ATOM 2231 C CB . TYR A 1 329 ? 34.280 35.738 27.409 1.00 71.92 ? 372 TYR A CB 1 ATOM 2232 C CG . TYR A 1 329 ? 33.101 35.240 26.611 1.00 56.77 ? 372 TYR A CG 1 ATOM 2233 C CD1 . TYR A 1 329 ? 33.119 33.997 26.002 1.00 61.67 ? 372 TYR A CD1 1 ATOM 2234 C CD2 . TYR A 1 329 ? 31.975 36.035 26.446 1.00 50.21 ? 372 TYR A CD2 1 ATOM 2235 C CE1 . TYR A 1 329 ? 32.040 33.552 25.265 1.00 74.66 ? 372 TYR A CE1 1 ATOM 2236 C CE2 . TYR A 1 329 ? 30.897 35.603 25.714 1.00 55.58 ? 372 TYR A CE2 1 ATOM 2237 C CZ . TYR A 1 329 ? 30.931 34.361 25.124 1.00 71.83 ? 372 TYR A CZ 1 ATOM 2238 O OH . TYR A 1 329 ? 29.848 33.928 24.390 1.00 89.05 ? 372 TYR A OH 1 ATOM 2239 N N . PRO A 1 330 ? 37.241 35.246 28.407 1.00 63.19 ? 373 PRO A N 1 ATOM 2240 C CA . PRO A 1 330 ? 38.393 36.075 28.777 1.00 58.65 ? 373 PRO A CA 1 ATOM 2241 C C . PRO A 1 330 ? 38.076 37.546 28.552 1.00 54.01 ? 373 PRO A C 1 ATOM 2242 O O . PRO A 1 330 ? 37.621 37.944 27.477 1.00 65.41 ? 373 PRO A O 1 ATOM 2243 C CB . PRO A 1 330 ? 39.507 35.577 27.847 1.00 54.87 ? 373 PRO A CB 1 ATOM 2244 C CG . PRO A 1 330 ? 38.794 34.891 26.720 1.00 71.11 ? 373 PRO A CG 1 ATOM 2245 C CD . PRO A 1 330 ? 37.555 34.303 27.321 1.00 59.53 ? 373 PRO A CD 1 ATOM 2246 N N . GLY A 1 331 ? 38.315 38.354 29.581 1.00 60.17 ? 374 GLY A N 1 ATOM 2247 C CA . GLY A 1 331 ? 37.968 39.759 29.540 1.00 59.63 ? 374 GLY A CA 1 ATOM 2248 C C . GLY A 1 331 ? 36.571 40.092 30.010 1.00 54.90 ? 374 GLY A C 1 ATOM 2249 O O . GLY A 1 331 ? 36.167 41.258 29.918 1.00 66.44 ? 374 GLY A O 1 ATOM 2250 N N . LEU A 1 332 ? 35.822 39.115 30.517 1.00 54.52 ? 375 LEU A N 1 ATOM 2251 C CA . LEU A 1 332 ? 34.473 39.328 31.014 1.00 47.07 ? 375 LEU A CA 1 ATOM 2252 C C . LEU A 1 332 ? 34.330 38.670 32.379 1.00 56.44 ? 375 LEU A C 1 ATOM 2253 O O . LEU A 1 332 ? 34.924 37.622 32.648 1.00 56.69 ? 375 LEU A O 1 ATOM 2254 C CB . LEU A 1 332 ? 33.422 38.760 30.047 1.00 47.80 ? 375 LEU A CB 1 ATOM 2255 C CG . LEU A 1 332 ? 31.951 38.829 30.463 1.00 44.15 ? 375 LEU A CG 1 ATOM 2256 C CD1 . LEU A 1 332 ? 31.400 40.236 30.312 1.00 51.10 ? 375 LEU A CD1 1 ATOM 2257 C CD2 . LEU A 1 332 ? 31.121 37.832 29.667 1.00 47.89 ? 375 LEU A CD2 1 ATOM 2258 N N . ARG A 1 333 ? 33.542 39.302 33.245 1.00 54.60 ? 376 ARG A N 1 ATOM 2259 C CA . ARG A 1 333 ? 33.315 38.800 34.595 1.00 49.12 ? 376 ARG A CA 1 ATOM 2260 C C . ARG A 1 333 ? 31.831 38.906 34.904 1.00 47.54 ? 376 ARG A C 1 ATOM 2261 O O . ARG A 1 333 ? 31.257 39.997 34.833 1.00 46.69 ? 376 ARG A O 1 ATOM 2262 C CB . ARG A 1 333 ? 34.144 39.585 35.619 1.00 43.47 ? 376 ARG A CB 1 ATOM 2263 C CG . ARG A 1 333 ? 34.166 38.985 37.014 1.00 54.20 ? 376 ARG A CG 1 ATOM 2264 C CD . ARG A 1 333 ? 35.033 37.734 37.094 1.00 56.59 ? 376 ARG A CD 1 ATOM 2265 N NE . ARG A 1 333 ? 35.070 37.202 38.455 1.00 68.39 ? 376 ARG A NE 1 ATOM 2266 C CZ . ARG A 1 333 ? 35.670 36.069 38.807 1.00 66.23 ? 376 ARG A CZ 1 ATOM 2267 N NH1 . ARG A 1 333 ? 36.290 35.329 37.898 1.00 57.43 1 376 ARG A NH1 1 ATOM 2268 N NH2 . ARG A 1 333 ? 35.645 35.673 40.073 1.00 75.78 ? 376 ARG A NH2 1 ATOM 2269 N N . LEU A 1 334 ? 31.213 37.784 35.248 1.00 45.85 ? 377 LEU A N 1 ATOM 2270 C CA . LEU A 1 334 ? 29.813 37.758 35.637 1.00 44.86 ? 377 LEU A CA 1 ATOM 2271 C C . LEU A 1 334 ? 29.710 37.698 37.154 1.00 52.40 ? 377 LEU A C 1 ATOM 2272 O O . LEU A 1 334 ? 30.340 36.846 37.797 1.00 50.18 ? 377 LEU A O 1 ATOM 2273 C CB . LEU A 1 334 ? 29.078 36.576 35.006 1.00 37.20 ? 377 LEU A CB 1 ATOM 2274 C CG . LEU A 1 334 ? 27.552 36.705 35.049 1.00 37.30 ? 377 LEU A CG 1 ATOM 2275 C CD1 . LEU A 1 334 ? 26.907 35.784 34.034 1.00 44.00 ? 377 LEU A CD1 1 ATOM 2276 C CD2 . LEU A 1 334 ? 27.008 36.422 36.438 1.00 41.88 ? 377 LEU A CD2 1 ATOM 2277 N N . ILE A 1 335 ? 28.910 38.603 37.713 1.00 40.53 ? 378 ILE A N 1 ATOM 2278 C CA . ILE A 1 335 ? 28.622 38.656 39.137 1.00 31.65 ? 378 ILE A CA 1 ATOM 2279 C C . ILE A 1 335 ? 27.160 38.276 39.317 1.00 38.30 ? 378 ILE A C 1 ATOM 2280 O O . ILE A 1 335 ? 26.278 38.858 38.675 1.00 37.15 ? 378 ILE A O 1 ATOM 2281 C CB . ILE A 1 335 ? 28.882 40.058 39.717 1.00 40.22 ? 378 ILE A CB 1 ATOM 2282 C CG1 . ILE A 1 335 ? 30.289 40.555 39.369 1.00 32.22 ? 378 ILE A CG1 1 ATOM 2283 C CG2 . ILE A 1 335 ? 28.694 40.043 41.227 1.00 37.42 ? 378 ILE A CG2 1 ATOM 2284 C CD1 . ILE A 1 335 ? 31.381 39.983 40.224 1.00 42.60 ? 378 ILE A CD1 1 ATOM 2285 N N . SER A 1 336 ? 26.904 37.299 40.176 1.00 44.84 ? 379 SER A N 1 ATOM 2286 C CA . SER A 1 336 ? 25.549 36.887 40.515 1.00 36.47 ? 379 SER A CA 1 ATOM 2287 C C . SER A 1 336 ? 25.315 37.286 41.963 1.00 41.03 ? 379 SER A C 1 ATOM 2288 O O . SER A 1 336 ? 25.901 36.692 42.878 1.00 59.55 ? 379 SER A O 1 ATOM 2289 C CB . SER A 1 336 ? 25.352 35.388 40.309 1.00 47.89 ? 379 SER A CB 1 ATOM 2290 O OG . SER A 1 336 ? 24.042 34.994 40.677 1.00 53.10 ? 379 SER A OG 1 ATOM 2291 N N . LEU A 1 337 ? 24.468 38.291 42.163 1.00 38.95 ? 380 LEU A N 1 ATOM 2292 C CA . LEU A 1 337 ? 24.196 38.846 43.479 1.00 40.02 ? 380 LEU A CA 1 ATOM 2293 C C . LEU A 1 337 ? 22.944 38.215 44.067 1.00 55.99 ? 380 LEU A C 1 ATOM 2294 O O . LEU A 1 337 ? 21.976 37.939 43.350 1.00 31.91 ? 380 LEU A O 1 ATOM 2295 C CB . LEU A 1 337 ? 24.006 40.362 43.415 1.00 30.40 ? 380 LEU A CB 1 ATOM 2296 C CG . LEU A 1 337 ? 25.089 41.227 42.775 1.00 38.78 ? 380 LEU A CG 1 ATOM 2297 C CD1 . LEU A 1 337 ? 24.651 42.682 42.793 1.00 32.29 ? 380 LEU A CD1 1 ATOM 2298 C CD2 . LEU A 1 337 ? 26.426 41.044 43.465 1.00 39.00 ? 380 LEU A CD2 1 ATOM 2299 N N . ASN A 1 338 ? 22.958 38.015 45.382 1.00 58.81 ? 381 ASN A N 1 ATOM 2300 C CA . ASN A 1 338 ? 21.766 37.584 46.098 1.00 47.00 ? 381 ASN A CA 1 ATOM 2301 C C . ASN A 1 338 ? 21.057 38.844 46.567 1.00 47.30 ? 381 ASN A C 1 ATOM 2302 O O . ASN A 1 338 ? 21.501 39.500 47.514 1.00 53.43 ? 381 ASN A O 1 ATOM 2303 C CB . ASN A 1 338 ? 22.129 36.683 47.273 1.00 48.37 ? 381 ASN A CB 1 ATOM 2304 C CG . ASN A 1 338 ? 20.910 36.155 47.998 1.00 59.05 ? 381 ASN A CG 1 ATOM 2305 O OD1 . ASN A 1 338 ? 19.821 36.728 47.909 1.00 48.00 ? 381 ASN A OD1 1 ATOM 2306 N ND2 . ASN A 1 338 ? 21.087 35.062 48.734 1.00 58.78 ? 381 ASN A ND2 1 ATOM 2307 N N . MET A 1 339 ? 19.940 39.165 45.923 1.00 56.13 ? 382 MET A N 1 ATOM 2308 C CA . MET A 1 339 ? 19.262 40.428 46.164 1.00 43.42 ? 382 MET A CA 1 ATOM 2309 C C . MET A 1 339 ? 18.313 40.372 47.351 1.00 57.51 ? 382 MET A C 1 ATOM 2310 O O . MET A 1 339 ? 17.673 41.382 47.659 1.00 64.50 ? 382 MET A O 1 ATOM 2311 C CB . MET A 1 339 ? 18.507 40.868 44.907 1.00 40.02 ? 382 MET A CB 1 ATOM 2312 C CG . MET A 1 339 ? 19.414 41.031 43.696 1.00 52.74 ? 382 MET A CG 1 ATOM 2313 S SD . MET A 1 339 ? 20.778 42.183 43.960 1.00 45.27 ? 382 MET A SD 1 ATOM 2314 C CE . MET A 1 339 ? 19.935 43.760 43.837 1.00 43.65 ? 382 MET A CE 1 ATOM 2315 N N . ASN A 1 340 ? 18.205 39.224 48.026 1.00 55.12 ? 383 ASN A N 1 ATOM 2316 C CA . ASN A 1 340 ? 17.316 39.148 49.179 1.00 47.64 ? 383 ASN A CA 1 ATOM 2317 C C . ASN A 1 340 ? 17.899 39.884 50.375 1.00 54.67 ? 383 ASN A C 1 ATOM 2318 O O . ASN A 1 340 ? 17.149 40.472 51.162 1.00 66.10 ? 383 ASN A O 1 ATOM 2319 C CB . ASN A 1 340 ? 17.018 37.692 49.526 1.00 51.20 ? 383 ASN A CB 1 ATOM 2320 C CG . ASN A 1 340 ? 16.297 36.970 48.411 1.00 49.54 ? 383 ASN A CG 1 ATOM 2321 O OD1 . ASN A 1 340 ? 15.154 37.295 48.088 1.00 51.37 ? 383 ASN A OD1 1 ATOM 2322 N ND2 . ASN A 1 340 ? 16.960 35.987 47.811 1.00 52.30 ? 383 ASN A ND2 1 ATOM 2323 N N . PHE A 1 341 ? 19.228 39.894 50.514 1.00 46.53 ? 384 PHE A N 1 ATOM 2324 C CA . PHE A 1 341 ? 19.851 40.791 51.479 1.00 56.58 ? 384 PHE A CA 1 ATOM 2325 C C . PHE A 1 341 ? 19.589 42.251 51.132 1.00 51.54 ? 384 PHE A C 1 ATOM 2326 O O . PHE A 1 341 ? 19.850 43.134 51.957 1.00 65.52 ? 384 PHE A O 1 ATOM 2327 C CB . PHE A 1 341 ? 21.356 40.513 51.562 1.00 48.55 ? 384 PHE A CB 1 ATOM 2328 C CG . PHE A 1 341 ? 21.697 39.067 51.822 1.00 60.53 ? 384 PHE A CG 1 ATOM 2329 C CD1 . PHE A 1 341 ? 20.885 38.279 52.626 1.00 55.48 ? 384 PHE A CD1 1 ATOM 2330 C CD2 . PHE A 1 341 ? 22.832 38.497 51.264 1.00 62.17 ? 384 PHE A CD2 1 ATOM 2331 C CE1 . PHE A 1 341 ? 21.199 36.949 52.869 1.00 45.39 ? 384 PHE A CE1 1 ATOM 2332 C CE2 . PHE A 1 341 ? 23.151 37.168 51.501 1.00 60.39 ? 384 PHE A CE2 1 ATOM 2333 C CZ . PHE A 1 341 ? 22.334 36.394 52.305 1.00 47.77 ? 384 PHE A CZ 1 ATOM 2334 N N . CYS A 1 342 ? 19.107 42.510 49.917 1.00 66.28 ? 385 CYS A N 1 ATOM 2335 C CA . CYS A 1 342 ? 18.613 43.806 49.476 1.00 49.37 ? 385 CYS A CA 1 ATOM 2336 C C . CYS A 1 342 ? 17.172 44.053 49.900 1.00 50.65 ? 385 CYS A C 1 ATOM 2337 O O . CYS A 1 342 ? 16.755 45.211 49.997 1.00 45.05 ? 385 CYS A O 1 ATOM 2338 C CB . CYS A 1 342 ? 18.709 43.863 47.950 1.00 55.61 ? 385 CYS A CB 1 ATOM 2339 S SG . CYS A 1 342 ? 19.108 45.432 47.173 1.00 101.76 ? 385 CYS A SG 1 ATOM 2340 N N . SER A 1 343 ? 16.419 42.990 50.170 1.00 46.68 ? 386 SER A N 1 ATOM 2341 C CA . SER A 1 343 ? 14.966 43.024 50.076 1.00 47.40 ? 386 SER A CA 1 ATOM 2342 C C . SER A 1 343 ? 14.325 43.801 51.221 1.00 53.97 ? 386 SER A C 1 ATOM 2343 O O . SER A 1 343 ? 14.816 43.813 52.353 1.00 67.19 ? 386 SER A O 1 ATOM 2344 C CB . SER A 1 343 ? 14.414 41.599 50.051 1.00 49.90 ? 386 SER A CB 1 ATOM 2345 O OG . SER A 1 343 ? 12.998 41.592 50.106 1.00 52.72 ? 386 SER A OG 1 ATOM 2346 N N . ARG A 1 344 ? 13.203 44.457 50.907 1.00 56.44 ? 387 ARG A N 1 ATOM 2347 C CA . ARG A 1 344 ? 12.375 45.054 51.949 1.00 48.49 ? 387 ARG A CA 1 ATOM 2348 C C . ARG A 1 344 ? 11.595 43.990 52.709 1.00 59.96 ? 387 ARG A C 1 ATOM 2349 O O . ARG A 1 344 ? 11.377 44.124 53.918 1.00 78.62 ? 387 ARG A O 1 ATOM 2350 C CB . ARG A 1 344 ? 11.398 46.063 51.344 1.00 47.55 ? 387 ARG A CB 1 ATOM 2351 C CG . ARG A 1 344 ? 12.037 47.238 50.623 1.00 69.19 ? 387 ARG A CG 1 ATOM 2352 C CD . ARG A 1 344 ? 10.970 48.154 50.033 1.00 56.71 ? 387 ARG A CD 1 ATOM 2353 N NE . ARG A 1 344 ? 11.549 49.212 49.210 1.00 72.55 ? 387 ARG A NE 1 ATOM 2354 C CZ . ARG A 1 344 ? 11.736 50.466 49.611 1.00 74.53 ? 387 ARG A CZ 1 ATOM 2355 N NH1 . ARG A 1 344 ? 11.383 50.838 50.834 1.00 77.82 1 387 ARG A NH1 1 ATOM 2356 N NH2 . ARG A 1 344 ? 12.274 51.350 48.782 1.00 75.42 ? 387 ARG A NH2 1 ATOM 2357 N N . GLU A 1 345 ? 11.181 42.929 52.023 1.00 65.28 ? 388 GLU A N 1 ATOM 2358 C CA . GLU A 1 345 ? 10.330 41.898 52.599 1.00 76.90 ? 388 GLU A CA 1 ATOM 2359 C C . GLU A 1 345 ? 11.109 40.810 53.328 1.00 67.56 ? 388 GLU A C 1 ATOM 2360 O O . GLU A 1 345 ? 10.496 39.859 53.823 1.00 61.17 ? 388 GLU A O 1 ATOM 2361 C CB . GLU A 1 345 ? 9.451 41.273 51.511 1.00 68.00 ? 388 GLU A CB 1 ATOM 2362 C CG . GLU A 1 345 ? 8.519 42.268 50.835 1.00 64.41 ? 388 GLU A CG 1 ATOM 2363 C CD . GLU A 1 345 ? 7.910 41.730 49.551 1.00 112.84 ? 388 GLU A CD 1 ATOM 2364 O OE1 . GLU A 1 345 ? 7.753 40.495 49.433 1.00 111.28 ? 388 GLU A OE1 1 ATOM 2365 O OE2 . GLU A 1 345 ? 7.587 42.544 48.660 1.00 118.02 -1 388 GLU A OE2 1 ATOM 2366 N N . ASN A 1 346 ? 12.432 40.921 53.414 1.00 47.19 ? 389 ASN A N 1 ATOM 2367 C CA . ASN A 1 346 ? 13.232 39.950 54.151 1.00 43.13 ? 389 ASN A CA 1 ATOM 2368 C C . ASN A 1 346 ? 13.347 40.464 55.580 1.00 58.63 ? 389 ASN A C 1 ATOM 2369 O O . ASN A 1 346 ? 14.079 41.423 55.847 1.00 61.34 ? 389 ASN A O 1 ATOM 2370 C CB . ASN A 1 346 ? 14.605 39.782 53.502 1.00 40.95 ? 389 ASN A CB 1 ATOM 2371 C CG . ASN A 1 346 ? 15.517 38.846 54.279 1.00 54.39 ? 389 ASN A CG 1 ATOM 2372 O OD1 . ASN A 1 346 ? 15.087 38.165 55.207 1.00 58.91 ? 389 ASN A OD1 1 ATOM 2373 N ND2 . ASN A 1 346 ? 16.790 38.818 53.903 1.00 49.71 ? 389 ASN A ND2 1 ATOM 2374 N N . PHE A 1 347 ? 12.649 39.804 56.506 1.00 47.89 ? 390 PHE A N 1 ATOM 2375 C CA . PHE A 1 347 ? 12.539 40.321 57.862 1.00 53.80 ? 390 PHE A CA 1 ATOM 2376 C C . PHE A 1 347 ? 13.791 40.086 58.689 1.00 48.78 ? 390 PHE A C 1 ATOM 2377 O O . PHE A 1 347 ? 14.003 40.797 59.677 1.00 49.89 ? 390 PHE A O 1 ATOM 2378 C CB . PHE A 1 347 ? 11.323 39.708 58.559 1.00 50.92 ? 390 PHE A CB 1 ATOM 2379 C CG . PHE A 1 347 ? 11.193 38.230 58.358 1.00 60.35 ? 390 PHE A CG 1 ATOM 2380 C CD1 . PHE A 1 347 ? 11.980 37.346 59.076 1.00 60.29 ? 390 PHE A CD1 1 ATOM 2381 C CD2 . PHE A 1 347 ? 10.273 37.723 57.454 1.00 71.06 ? 390 PHE A CD2 1 ATOM 2382 C CE1 . PHE A 1 347 ? 11.857 35.980 58.890 1.00 77.19 ? 390 PHE A CE1 1 ATOM 2383 C CE2 . PHE A 1 347 ? 10.145 36.362 57.261 1.00 77.10 ? 390 PHE A CE2 1 ATOM 2384 C CZ . PHE A 1 347 ? 10.938 35.488 57.980 1.00 89.15 ? 390 PHE A CZ 1 ATOM 2385 N N . TRP A 1 348 ? 14.642 39.142 58.291 1.00 55.05 ? 391 TRP A N 1 ATOM 2386 C CA . TRP A 1 348 ? 15.885 38.924 59.018 1.00 54.84 ? 391 TRP A CA 1 ATOM 2387 C C . TRP A 1 348 ? 16.754 40.172 59.046 1.00 55.06 ? 391 TRP A C 1 ATOM 2388 O O . TRP A 1 348 ? 17.665 40.265 59.876 1.00 58.28 ? 391 TRP A O 1 ATOM 2389 C CB . TRP A 1 348 ? 16.654 37.756 58.399 1.00 53.97 ? 391 TRP A CB 1 ATOM 2390 C CG . TRP A 1 348 ? 15.995 36.438 58.636 1.00 53.64 ? 391 TRP A CG 1 ATOM 2391 C CD1 . TRP A 1 348 ? 15.071 35.831 57.840 1.00 57.42 ? 391 TRP A CD1 1 ATOM 2392 C CD2 . TRP A 1 348 ? 16.199 35.566 59.753 1.00 59.54 ? 391 TRP A CD2 1 ATOM 2393 N NE1 . TRP A 1 348 ? 14.689 34.632 58.388 1.00 57.48 ? 391 TRP A NE1 1 ATOM 2394 C CE2 . TRP A 1 348 ? 15.367 34.446 59.563 1.00 64.54 ? 391 TRP A CE2 1 ATOM 2395 C CE3 . TRP A 1 348 ? 17.007 35.621 60.892 1.00 53.45 ? 391 TRP A CE3 1 ATOM 2396 C CZ2 . TRP A 1 348 ? 15.320 33.391 60.469 1.00 55.24 ? 391 TRP A CZ2 1 ATOM 2397 C CZ3 . TRP A 1 348 ? 16.959 34.573 61.789 1.00 52.60 ? 391 TRP A CZ3 1 ATOM 2398 C CH2 . TRP A 1 348 ? 16.121 33.474 61.574 1.00 54.79 ? 391 TRP A CH2 1 ATOM 2399 N N . LEU A 1 349 ? 16.491 41.136 58.163 1.00 56.83 ? 392 LEU A N 1 ATOM 2400 C CA . LEU A 1 349 ? 17.278 42.359 58.149 1.00 55.76 ? 392 LEU A CA 1 ATOM 2401 C C . LEU A 1 349 ? 16.934 43.276 59.316 1.00 61.26 ? 392 LEU A C 1 ATOM 2402 O O . LEU A 1 349 ? 17.727 44.170 59.634 1.00 57.45 ? 392 LEU A O 1 ATOM 2403 C CB . LEU A 1 349 ? 17.086 43.084 56.817 1.00 64.65 ? 392 LEU A CB 1 ATOM 2404 C CG . LEU A 1 349 ? 17.394 42.240 55.575 1.00 60.00 ? 392 LEU A CG 1 ATOM 2405 C CD1 . LEU A 1 349 ? 17.087 43.019 54.306 1.00 58.51 ? 392 LEU A CD1 1 ATOM 2406 C CD2 . LEU A 1 349 ? 18.842 41.754 55.573 1.00 43.66 ? 392 LEU A CD2 1 ATOM 2407 N N . LEU A 1 350 ? 15.774 43.082 59.955 1.00 61.19 ? 393 LEU A N 1 ATOM 2408 C CA . LEU A 1 350 ? 15.482 43.812 61.186 1.00 54.13 ? 393 LEU A CA 1 ATOM 2409 C C . LEU A 1 350 ? 16.627 43.674 62.177 1.00 54.06 ? 393 LEU A C 1 ATOM 2410 O O . LEU A 1 350 ? 17.026 44.650 62.822 1.00 58.84 ? 393 LEU A O 1 ATOM 2411 C CB . LEU A 1 350 ? 14.185 43.305 61.822 1.00 45.41 ? 393 LEU A CB 1 ATOM 2412 C CG . LEU A 1 350 ? 12.833 43.710 61.236 1.00 48.72 ? 393 LEU A CG 1 ATOM 2413 C CD1 . LEU A 1 350 ? 11.719 42.865 61.845 1.00 57.60 ? 393 LEU A CD1 1 ATOM 2414 C CD2 . LEU A 1 350 ? 12.574 45.182 61.473 1.00 59.65 ? 393 LEU A CD2 1 ATOM 2415 N N . ILE A 1 351 ? 17.166 42.464 62.310 1.00 46.36 ? 394 ILE A N 1 ATOM 2416 C CA . ILE A 1 351 ? 18.296 42.200 63.190 1.00 48.53 ? 394 ILE A CA 1 ATOM 2417 C C . ILE A 1 351 ? 19.459 43.104 62.800 1.00 47.42 ? 394 ILE A C 1 ATOM 2418 O O . ILE A 1 351 ? 19.805 44.035 63.535 1.00 64.65 ? 394 ILE A O 1 ATOM 2419 C CB . ILE A 1 351 ? 18.687 40.712 63.135 1.00 50.76 ? 394 ILE A CB 1 ATOM 2420 C CG1 . ILE A 1 351 ? 17.520 39.848 63.619 1.00 45.05 ? 394 ILE A CG1 1 ATOM 2421 C CG2 . ILE A 1 351 ? 19.938 40.453 63.955 1.00 38.82 ? 394 ILE A CG2 1 ATOM 2422 C CD1 . ILE A 1 351 ? 17.775 38.360 63.534 1.00 58.50 ? 394 ILE A CD1 1 ATOM 2423 N N . ASN A 1 352 ? 20.067 42.843 61.644 1.00 67.05 ? 395 ASN A N 1 ATOM 2424 C CA . ASN A 1 352 ? 21.144 43.682 61.127 1.00 62.72 ? 395 ASN A CA 1 ATOM 2425 C C . ASN A 1 352 ? 20.927 43.885 59.636 1.00 71.84 ? 395 ASN A C 1 ATOM 2426 O O . ASN A 1 352 ? 20.962 42.916 58.872 1.00 78.76 ? 395 ASN A O 1 ATOM 2427 C CB . ASN A 1 352 ? 22.511 43.042 61.388 1.00 54.05 ? 395 ASN A CB 1 ATOM 2428 C CG . ASN A 1 352 ? 23.643 44.043 61.328 1.00 69.10 ? 395 ASN A CG 1 ATOM 2429 O OD1 . ASN A 1 352 ? 23.414 45.247 61.220 1.00 84.56 ? 395 ASN A OD1 1 ATOM 2430 N ND2 . ASN A 1 352 ? 24.875 43.553 61.406 1.00 67.99 ? 395 ASN A ND2 1 ATOM 2431 N N . SER A 1 353 ? 20.705 45.132 59.220 1.00 60.24 ? 396 SER A N 1 ATOM 2432 C CA . SER A 1 353 ? 20.526 45.457 57.810 1.00 59.42 ? 396 SER A CA 1 ATOM 2433 C C . SER A 1 353 ? 21.798 45.980 57.149 1.00 57.95 ? 396 SER A C 1 ATOM 2434 O O . SER A 1 353 ? 21.750 46.391 55.987 1.00 58.61 ? 396 SER A O 1 ATOM 2435 C CB . SER A 1 353 ? 19.386 46.464 57.621 1.00 46.20 ? 396 SER A CB 1 ATOM 2436 O OG . SER A 1 353 ? 19.786 47.778 57.968 1.00 84.39 ? 396 SER A OG 1 ATOM 2437 N N . THR A 1 354 ? 22.929 45.986 57.854 1.00 63.06 ? 397 THR A N 1 ATOM 2438 C CA . THR A 1 354 ? 24.127 46.653 57.350 1.00 66.59 ? 397 THR A CA 1 ATOM 2439 C C . THR A 1 354 ? 24.891 45.706 56.432 1.00 67.37 ? 397 THR A C 1 ATOM 2440 O O . THR A 1 354 ? 25.442 44.699 56.888 1.00 64.72 ? 397 THR A O 1 ATOM 2441 C CB . THR A 1 354 ? 25.008 47.107 58.512 1.00 60.68 ? 397 THR A CB 1 ATOM 2442 O OG1 . THR A 1 354 ? 24.268 47.995 59.358 1.00 70.90 ? 397 THR A OG1 1 ATOM 2443 C CG2 . THR A 1 354 ? 26.253 47.815 58.000 1.00 49.82 ? 397 THR A CG2 1 ATOM 2444 N N . ASP A 1 355 ? 24.948 46.055 55.137 1.00 68.00 ? 398 ASP A N 1 ATOM 2445 C CA . ASP A 1 355 ? 25.640 45.326 54.076 1.00 64.90 ? 398 ASP A CA 1 ATOM 2446 C C . ASP A 1 355 ? 25.619 43.825 54.341 1.00 60.82 ? 398 ASP A C 1 ATOM 2447 O O . ASP A 1 355 ? 26.682 43.207 54.494 1.00 36.83 ? 398 ASP A O 1 ATOM 2448 C CB . ASP A 1 355 ? 27.081 45.815 53.922 1.00 58.25 ? 398 ASP A CB 1 ATOM 2449 C CG . ASP A 1 355 ? 27.792 45.163 52.749 1.00 65.79 ? 398 ASP A CG 1 ATOM 2450 O OD1 . ASP A 1 355 ? 27.101 44.676 51.828 1.00 67.31 ? 398 ASP A OD1 1 ATOM 2451 O OD2 . ASP A 1 355 ? 29.040 45.131 52.750 1.00 74.13 -1 398 ASP A OD2 1 ATOM 2452 N N . PRO A 1 356 ? 24.442 43.203 54.376 1.00 49.59 ? 399 PRO A N 1 ATOM 2453 C CA . PRO A 1 356 ? 24.367 41.783 54.737 1.00 34.47 ? 399 PRO A CA 1 ATOM 2454 C C . PRO A 1 356 ? 25.353 40.927 53.951 1.00 43.75 ? 399 PRO A C 1 ATOM 2455 O O . PRO A 1 356 ? 25.679 41.203 52.790 1.00 65.89 ? 399 PRO A O 1 ATOM 2456 C CB . PRO A 1 356 ? 22.913 41.422 54.426 1.00 51.70 ? 399 PRO A CB 1 ATOM 2457 C CG . PRO A 1 356 ? 22.177 42.709 54.674 1.00 57.28 ? 399 PRO A CG 1 ATOM 2458 C CD . PRO A 1 356 ? 23.106 43.800 54.199 1.00 47.33 ? 399 PRO A CD 1 ATOM 2459 N N . ALA A 1 357 ? 25.900 39.930 54.644 1.00 55.04 ? 400 ALA A N 1 ATOM 2460 C CA . ALA A 1 357 ? 26.905 39.017 54.103 1.00 37.26 ? 400 ALA A CA 1 ATOM 2461 C C . ALA A 1 357 ? 28.094 39.782 53.541 1.00 43.86 ? 400 ALA A C 1 ATOM 2462 O O . ALA A 1 357 ? 28.899 39.228 52.787 1.00 53.24 ? 400 ALA A O 1 ATOM 2463 C CB . ALA A 1 357 ? 26.304 38.098 53.036 1.00 46.53 ? 400 ALA A CB 1 ATOM 2464 N N . GLY A 1 358 ? 28.234 41.044 53.942 1.00 61.82 ? 401 GLY A N 1 ATOM 2465 C CA . GLY A 1 358 ? 29.258 41.912 53.405 1.00 57.94 ? 401 GLY A CA 1 ATOM 2466 C C . GLY A 1 358 ? 29.340 41.797 51.899 1.00 57.79 ? 401 GLY A C 1 ATOM 2467 O O . GLY A 1 358 ? 30.434 41.869 51.330 1.00 51.68 ? 401 GLY A O 1 ATOM 2468 N N . GLN A 1 359 ? 28.195 41.620 51.232 1.00 64.69 ? 402 GLN A N 1 ATOM 2469 C CA . GLN A 1 359 ? 28.269 41.268 49.817 1.00 66.87 ? 402 GLN A CA 1 ATOM 2470 C C . GLN A 1 359 ? 28.570 42.485 48.949 1.00 64.83 ? 402 GLN A C 1 ATOM 2471 O O . GLN A 1 359 ? 29.386 42.397 48.022 1.00 56.33 ? 402 GLN A O 1 ATOM 2472 C CB . GLN A 1 359 ? 26.984 40.558 49.378 1.00 61.90 ? 402 GLN A CB 1 ATOM 2473 C CG . GLN A 1 359 ? 26.014 41.373 48.551 1.00 57.84 ? 402 GLN A CG 1 ATOM 2474 C CD . GLN A 1 359 ? 25.026 40.487 47.811 1.00 50.35 ? 402 GLN A CD 1 ATOM 2475 O OE1 . GLN A 1 359 ? 25.417 39.647 46.995 1.00 47.90 ? 402 GLN A OE1 1 ATOM 2476 N NE2 . GLN A 1 359 ? 23.741 40.656 48.104 1.00 40.44 ? 402 GLN A NE2 1 ATOM 2477 N N . LEU A 1 360 ? 27.963 43.637 49.248 1.00 55.94 ? 403 LEU A N 1 ATOM 2478 C CA . LEU A 1 360 ? 28.286 44.839 48.486 1.00 52.77 ? 403 LEU A CA 1 ATOM 2479 C C . LEU A 1 360 ? 29.788 45.090 48.486 1.00 53.32 ? 403 LEU A C 1 ATOM 2480 O O . LEU A 1 360 ? 30.406 45.226 47.424 1.00 58.68 ? 403 LEU A O 1 ATOM 2481 C CB . LEU A 1 360 ? 27.529 46.048 49.043 1.00 43.16 ? 403 LEU A CB 1 ATOM 2482 C CG . LEU A 1 360 ? 26.099 46.208 48.520 1.00 43.08 ? 403 LEU A CG 1 ATOM 2483 C CD1 . LEU A 1 360 ? 25.416 47.435 49.107 1.00 47.11 ? 403 LEU A CD1 1 ATOM 2484 C CD2 . LEU A 1 360 ? 26.117 46.279 47.005 1.00 51.02 ? 403 LEU A CD2 1 ATOM 2485 N N . GLN A 1 361 ? 30.402 45.111 49.670 1.00 58.65 ? 404 GLN A N 1 ATOM 2486 C CA . GLN A 1 361 ? 31.854 45.233 49.732 1.00 67.40 ? 404 GLN A CA 1 ATOM 2487 C C . GLN A 1 361 ? 32.525 44.204 48.830 1.00 63.50 ? 404 GLN A C 1 ATOM 2488 O O . GLN A 1 361 ? 33.385 44.546 48.009 1.00 61.29 ? 404 GLN A O 1 ATOM 2489 C CB . GLN A 1 361 ? 32.340 45.092 51.175 1.00 58.10 ? 404 GLN A CB 1 ATOM 2490 C CG . GLN A 1 361 ? 33.831 45.341 51.322 1.00 68.84 ? 404 GLN A CG 1 ATOM 2491 C CD . GLN A 1 361 ? 34.256 46.658 50.697 1.00 80.35 ? 404 GLN A CD 1 ATOM 2492 O OE1 . GLN A 1 361 ? 33.864 47.735 51.156 1.00 69.02 ? 404 GLN A OE1 1 ATOM 2493 N NE2 . GLN A 1 361 ? 35.054 46.578 49.635 1.00 73.47 ? 404 GLN A NE2 1 ATOM 2494 N N . TRP A 1 362 ? 32.128 42.934 48.960 1.00 65.97 ? 405 TRP A N 1 ATOM 2495 C CA . TRP A 1 362 ? 32.669 41.899 48.086 1.00 67.72 ? 405 TRP A CA 1 ATOM 2496 C C . TRP A 1 362 ? 32.543 42.308 46.625 1.00 63.10 ? 405 TRP A C 1 ATOM 2497 O O . TRP A 1 362 ? 33.527 42.297 45.875 1.00 59.31 ? 405 TRP A O 1 ATOM 2498 C CB . TRP A 1 362 ? 31.951 40.572 48.348 1.00 62.09 ? 405 TRP A CB 1 ATOM 2499 C CG . TRP A 1 362 ? 32.258 39.492 47.354 1.00 55.86 ? 405 TRP A CG 1 ATOM 2500 C CD1 . TRP A 1 362 ? 33.369 38.700 47.318 1.00 54.26 ? 405 TRP A CD1 1 ATOM 2501 C CD2 . TRP A 1 362 ? 31.430 39.072 46.263 1.00 63.57 ? 405 TRP A CD2 1 ATOM 2502 N NE1 . TRP A 1 362 ? 33.287 37.819 46.266 1.00 74.39 ? 405 TRP A NE1 1 ATOM 2503 C CE2 . TRP A 1 362 ? 32.106 38.027 45.603 1.00 63.85 ? 405 TRP A CE2 1 ATOM 2504 C CE3 . TRP A 1 362 ? 30.185 39.482 45.777 1.00 55.51 ? 405 TRP A CE3 1 ATOM 2505 C CZ2 . TRP A 1 362 ? 31.579 37.386 44.485 1.00 57.28 ? 405 TRP A CZ2 1 ATOM 2506 C CZ3 . TRP A 1 362 ? 29.663 38.845 44.667 1.00 57.60 ? 405 TRP A CZ3 1 ATOM 2507 C CH2 . TRP A 1 362 ? 30.359 37.809 44.033 1.00 60.62 ? 405 TRP A CH2 1 ATOM 2508 N N . LEU A 1 363 ? 31.336 42.714 46.218 1.00 53.92 ? 406 LEU A N 1 ATOM 2509 C CA . LEU A 1 363 ? 31.126 43.184 44.853 1.00 60.88 ? 406 LEU A CA 1 ATOM 2510 C C . LEU A 1 363 ? 32.168 44.228 44.474 1.00 63.01 ? 406 LEU A C 1 ATOM 2511 O O . LEU A 1 363 ? 32.795 44.142 43.412 1.00 57.02 ? 406 LEU A O 1 ATOM 2512 C CB . LEU A 1 363 ? 29.713 43.748 44.708 1.00 51.05 ? 406 LEU A CB 1 ATOM 2513 C CG . LEU A 1 363 ? 29.373 44.430 43.384 1.00 43.25 ? 406 LEU A CG 1 ATOM 2514 C CD1 . LEU A 1 363 ? 29.607 43.481 42.223 1.00 43.56 ? 406 LEU A CD1 1 ATOM 2515 C CD2 . LEU A 1 363 ? 27.935 44.918 43.400 1.00 36.55 ? 406 LEU A CD2 1 ATOM 2516 N N . VAL A 1 364 ? 32.375 45.219 45.346 1.00 52.08 ? 407 VAL A N 1 ATOM 2517 C CA . VAL A 1 364 ? 33.382 46.240 45.078 1.00 51.39 ? 407 VAL A CA 1 ATOM 2518 C C . VAL A 1 364 ? 34.735 45.589 44.824 1.00 50.81 ? 407 VAL A C 1 ATOM 2519 O O . VAL A 1 364 ? 35.375 45.826 43.792 1.00 54.04 ? 407 VAL A O 1 ATOM 2520 C CB . VAL A 1 364 ? 33.450 47.247 46.236 1.00 41.56 ? 407 VAL A CB 1 ATOM 2521 C CG1 . VAL A 1 364 ? 34.478 48.323 45.930 1.00 35.63 ? 407 VAL A CG1 1 ATOM 2522 C CG2 . VAL A 1 364 ? 32.080 47.861 46.475 1.00 42.85 ? 407 VAL A CG2 1 ATOM 2523 N N . GLY A 1 365 ? 35.177 44.736 45.748 1.00 49.01 ? 408 GLY A N 1 ATOM 2524 C CA . GLY A 1 365 ? 36.440 44.052 45.543 1.00 54.56 ? 408 GLY A CA 1 ATOM 2525 C C . GLY A 1 365 ? 36.512 43.406 44.177 1.00 56.24 ? 408 GLY A C 1 ATOM 2526 O O . GLY A 1 365 ? 37.558 43.417 43.526 1.00 58.39 ? 408 GLY A O 1 ATOM 2527 N N . GLU A 1 366 ? 35.388 42.854 43.716 1.00 59.20 ? 409 GLU A N 1 ATOM 2528 C CA . GLU A 1 366 ? 35.333 42.263 42.385 1.00 61.62 ? 409 GLU A CA 1 ATOM 2529 C C . GLU A 1 366 ? 35.388 43.337 41.305 1.00 59.79 ? 409 GLU A C 1 ATOM 2530 O O . GLU A 1 366 ? 36.209 43.261 40.383 1.00 54.73 ? 409 GLU A O 1 ATOM 2531 C CB . GLU A 1 366 ? 34.065 41.423 42.246 1.00 61.82 ? 409 GLU A CB 1 ATOM 2532 C CG . GLU A 1 366 ? 34.159 40.056 42.898 1.00 68.66 ? 409 GLU A CG 1 ATOM 2533 C CD . GLU A 1 366 ? 34.984 39.082 42.079 1.00 85.28 ? 409 GLU A CD 1 ATOM 2534 O OE1 . GLU A 1 366 ? 35.356 39.434 40.936 1.00 67.11 ? 409 GLU A OE1 1 ATOM 2535 O OE2 . GLU A 1 366 ? 35.259 37.969 42.580 1.00 83.10 -1 409 GLU A OE2 1 ATOM 2536 N N . LEU A 1 367 ? 34.521 44.349 41.404 1.00 59.33 ? 410 LEU A N 1 ATOM 2537 C CA . LEU A 1 367 ? 34.484 45.389 40.378 1.00 62.48 ? 410 LEU A CA 1 ATOM 2538 C C . LEU A 1 367 ? 35.834 46.079 40.252 1.00 59.81 ? 410 LEU A C 1 ATOM 2539 O O . LEU A 1 367 ? 36.338 46.284 39.142 1.00 58.03 ? 410 LEU A O 1 ATOM 2540 C CB . LEU A 1 367 ? 33.381 46.404 40.683 1.00 57.40 ? 410 LEU A CB 1 ATOM 2541 C CG . LEU A 1 367 ? 31.955 45.857 40.663 1.00 54.49 ? 410 LEU A CG 1 ATOM 2542 C CD1 . LEU A 1 367 ? 30.976 46.906 41.153 1.00 46.92 ? 410 LEU A CD1 1 ATOM 2543 C CD2 . LEU A 1 367 ? 31.591 45.397 39.262 1.00 46.96 ? 410 LEU A CD2 1 ATOM 2544 N N . GLN A 1 368 ? 36.427 46.467 41.382 1.00 63.47 ? 411 GLN A N 1 ATOM 2545 C CA . GLN A 1 368 ? 37.791 46.981 41.343 1.00 61.04 ? 411 GLN A CA 1 ATOM 2546 C C . GLN A 1 368 ? 38.730 45.944 40.744 1.00 56.95 ? 411 GLN A C 1 ATOM 2547 O O . GLN A 1 368 ? 39.555 46.257 39.878 1.00 61.42 ? 411 GLN A O 1 ATOM 2548 C CB . GLN A 1 368 ? 38.244 47.393 42.743 1.00 47.76 ? 411 GLN A CB 1 ATOM 2549 C CG . GLN A 1 368 ? 39.571 48.119 42.742 1.00 58.84 ? 411 GLN A CG 1 ATOM 2550 C CD . GLN A 1 368 ? 39.594 49.267 41.752 1.00 66.41 ? 411 GLN A CD 1 ATOM 2551 O OE1 . GLN A 1 368 ? 38.808 50.210 41.857 1.00 65.94 ? 411 GLN A OE1 1 ATOM 2552 N NE2 . GLN A 1 368 ? 40.493 49.187 40.776 1.00 49.25 ? 411 GLN A NE2 1 ATOM 2553 N N . ALA A 1 369 ? 38.603 44.690 41.187 1.00 54.13 ? 412 ALA A N 1 ATOM 2554 C CA . ALA A 1 369 ? 39.374 43.612 40.584 1.00 49.17 ? 412 ALA A CA 1 ATOM 2555 C C . ALA A 1 369 ? 39.189 43.595 39.078 1.00 61.51 ? 412 ALA A C 1 ATOM 2556 O O . ALA A 1 369 ? 40.108 43.222 38.341 1.00 67.21 ? 412 ALA A O 1 ATOM 2557 C CB . ALA A 1 369 ? 38.964 42.268 41.185 1.00 62.36 ? 412 ALA A CB 1 ATOM 2558 N N . ALA A 1 370 ? 38.004 43.993 38.606 1.00 65.82 ? 413 ALA A N 1 ATOM 2559 C CA . ALA A 1 370 ? 37.744 44.067 37.174 1.00 59.85 ? 413 ALA A CA 1 ATOM 2560 C C . ALA A 1 370 ? 38.374 45.309 36.555 1.00 53.92 ? 413 ALA A C 1 ATOM 2561 O O . ALA A 1 370 ? 38.921 45.235 35.449 1.00 66.77 ? 413 ALA A O 1 ATOM 2562 C CB . ALA A 1 370 ? 36.238 44.044 36.910 1.00 53.19 ? 413 ALA A CB 1 ATOM 2563 N N . GLU A 1 371 ? 38.311 46.457 37.239 1.00 66.90 ? 414 GLU A N 1 ATOM 2564 C CA . GLU A 1 371 ? 38.960 47.651 36.706 1.00 59.49 ? 414 GLU A CA 1 ATOM 2565 C C . GLU A 1 371 ? 40.433 47.364 36.463 1.00 56.02 ? 414 GLU A C 1 ATOM 2566 O O . GLU A 1 371 ? 40.929 47.451 35.333 1.00 64.89 ? 414 GLU A O 1 ATOM 2567 C CB . GLU A 1 371 ? 38.784 48.826 37.670 1.00 51.44 ? 414 GLU A CB 1 ATOM 2568 C CG . GLU A 1 371 ? 39.018 50.190 37.038 1.00 56.03 ? 414 GLU A CG 1 ATOM 2569 C CD . GLU A 1 371 ? 39.160 51.302 38.066 1.00 77.80 ? 414 GLU A CD 1 ATOM 2570 O OE1 . GLU A 1 371 ? 40.267 51.459 38.624 1.00 83.11 ? 414 GLU A OE1 1 ATOM 2571 O OE2 . GLU A 1 371 ? 38.168 52.020 38.316 1.00 70.40 -1 414 GLU A OE2 1 ATOM 2572 N N . ASP A 1 372 ? 41.137 46.961 37.514 1.00 63.30 ? 415 ASP A N 1 ATOM 2573 C CA . ASP A 1 372 ? 42.432 46.342 37.318 1.00 58.53 ? 415 ASP A CA 1 ATOM 2574 C C . ASP A 1 372 ? 42.222 45.131 36.422 1.00 73.60 ? 415 ASP A C 1 ATOM 2575 O O . ASP A 1 372 ? 41.137 44.545 36.394 1.00 79.43 ? 415 ASP A O 1 ATOM 2576 C CB . ASP A 1 372 ? 43.039 45.921 38.659 1.00 73.68 ? 415 ASP A CB 1 ATOM 2577 C CG . ASP A 1 372 ? 42.817 46.955 39.759 1.00 81.97 ? 415 ASP A CG 1 ATOM 2578 O OD1 . ASP A 1 372 ? 42.670 48.155 39.439 1.00 82.35 ? 415 ASP A OD1 1 ATOM 2579 O OD2 . ASP A 1 372 ? 42.795 46.564 40.949 1.00 59.98 -1 415 ASP A OD2 1 ATOM 2580 N N . ARG A 1 373 ? 43.245 44.779 35.649 1.00 69.39 ? 416 ARG A N 1 ATOM 2581 C CA . ARG A 1 373 ? 43.105 43.681 34.700 1.00 64.08 ? 416 ARG A CA 1 ATOM 2582 C C . ARG A 1 373 ? 42.376 44.132 33.439 1.00 74.56 ? 416 ARG A C 1 ATOM 2583 O O . ARG A 1 373 ? 42.411 43.435 32.420 1.00 72.23 ? 416 ARG A O 1 ATOM 2584 C CB . ARG A 1 373 ? 42.335 42.520 35.341 1.00 65.03 ? 416 ARG A CB 1 ATOM 2585 C CG . ARG A 1 373 ? 42.330 41.206 34.581 1.00 82.32 ? 416 ARG A CG 1 ATOM 2586 C CD . ARG A 1 373 ? 41.264 40.280 35.168 1.00 74.14 ? 416 ARG A CD 1 ATOM 2587 N NE . ARG A 1 373 ? 41.235 40.317 36.628 1.00 79.00 ? 416 ARG A NE 1 ATOM 2588 C CZ . ARG A 1 373 ? 40.167 40.013 37.361 1.00 75.40 ? 416 ARG A CZ 1 ATOM 2589 N NH1 . ARG A 1 373 ? 39.036 39.653 36.769 1.00 78.15 1 416 ARG A NH1 1 ATOM 2590 N NH2 . ARG A 1 373 ? 40.225 40.076 38.685 1.00 73.92 ? 416 ARG A NH2 1 ATOM 2591 N N . GLY A 1 374 ? 41.717 45.290 33.482 1.00 82.66 ? 417 GLY A N 1 ATOM 2592 C CA . GLY A 1 374 ? 41.084 45.780 32.272 1.00 70.73 ? 417 GLY A CA 1 ATOM 2593 C C . GLY A 1 374 ? 39.927 44.943 31.769 1.00 73.88 ? 417 GLY A C 1 ATOM 2594 O O . GLY A 1 374 ? 39.665 44.932 30.562 1.00 78.48 ? 417 GLY A O 1 ATOM 2595 N N . ASP A 1 375 ? 39.231 44.231 32.654 1.00 67.78 ? 418 ASP A N 1 ATOM 2596 C CA . ASP A 1 375 ? 38.097 43.411 32.258 1.00 63.53 ? 418 ASP A CA 1 ATOM 2597 C C . ASP A 1 375 ? 36.781 44.158 32.460 1.00 57.95 ? 418 ASP A C 1 ATOM 2598 O O . ASP A 1 375 ? 36.738 45.285 32.960 1.00 65.86 ? 418 ASP A O 1 ATOM 2599 C CB . ASP A 1 375 ? 38.086 42.102 33.054 1.00 68.42 ? 418 ASP A CB 1 ATOM 2600 C CG . ASP A 1 375 ? 39.122 41.108 32.563 1.00 89.24 ? 418 ASP A CG 1 ATOM 2601 O OD1 . ASP A 1 375 ? 39.977 41.493 31.734 1.00 71.87 ? 418 ASP A OD1 1 ATOM 2602 O OD2 . ASP A 1 375 ? 39.079 39.941 33.013 1.00 79.26 -1 418 ASP A OD2 1 ATOM 2603 N N . LYS A 1 376 ? 35.688 43.510 32.054 1.00 52.70 ? 419 LYS A N 1 ATOM 2604 C CA . LYS A 1 376 ? 34.352 44.082 32.133 1.00 55.80 ? 419 LYS A CA 1 ATOM 2605 C C . LYS A 1 376 ? 33.415 43.094 32.814 1.00 56.86 ? 419 LYS A C 1 ATOM 2606 O O . LYS A 1 376 ? 33.622 41.878 32.756 1.00 48.58 ? 419 LYS A O 1 ATOM 2607 C CB . LYS A 1 376 ? 33.828 44.463 30.743 1.00 47.93 ? 419 LYS A CB 1 ATOM 2608 C CG . LYS A 1 376 ? 34.790 45.358 29.978 1.00 41.07 ? 419 LYS A CG 1 ATOM 2609 C CD . LYS A 1 376 ? 34.058 46.454 29.229 1.00 42.34 ? 419 LYS A CD 1 ATOM 2610 C CE . LYS A 1 376 ? 35.039 47.469 28.679 1.00 55.35 ? 419 LYS A CE 1 ATOM 2611 N NZ . LYS A 1 376 ? 35.912 48.005 29.761 1.00 36.89 1 419 LYS A NZ 1 ATOM 2612 N N . VAL A 1 377 ? 32.370 43.624 33.446 1.00 46.64 ? 420 VAL A N 1 ATOM 2613 C CA . VAL A 1 377 ? 31.541 42.856 34.367 1.00 55.99 ? 420 VAL A CA 1 ATOM 2614 C C . VAL A 1 377 ? 30.084 42.875 33.919 1.00 51.94 ? 420 VAL A C 1 ATOM 2615 O O . VAL A 1 377 ? 29.556 43.919 33.519 1.00 51.78 ? 420 VAL A O 1 ATOM 2616 C CB . VAL A 1 377 ? 31.673 43.391 35.808 1.00 51.50 ? 420 VAL A CB 1 ATOM 2617 C CG1 . VAL A 1 377 ? 30.783 42.599 36.753 1.00 39.81 ? 420 VAL A CG1 1 ATOM 2618 C CG2 . VAL A 1 377 ? 33.126 43.330 36.257 1.00 46.52 ? 420 VAL A CG2 1 ATOM 2619 N N . HIS A 1 378 ? 29.440 41.713 33.995 1.00 48.44 ? 421 HIS A N 1 ATOM 2620 C CA . HIS A 1 378 ? 27.989 41.587 33.924 1.00 47.99 ? 421 HIS A CA 1 ATOM 2621 C C . HIS A 1 378 ? 27.460 41.265 35.313 1.00 53.06 ? 421 HIS A C 1 ATOM 2622 O O . HIS A 1 378 ? 27.956 40.343 35.969 1.00 51.61 ? 421 HIS A O 1 ATOM 2623 C CB . HIS A 1 378 ? 27.550 40.479 32.961 1.00 51.40 ? 421 HIS A CB 1 ATOM 2624 C CG . HIS A 1 378 ? 27.619 40.853 31.515 1.00 54.15 ? 421 HIS A CG 1 ATOM 2625 N ND1 . HIS A 1 378 ? 27.347 39.953 30.508 1.00 33.11 ? 421 HIS A ND1 1 ATOM 2626 C CD2 . HIS A 1 378 ? 27.920 42.024 30.905 1.00 58.17 ? 421 HIS A CD2 1 ATOM 2627 C CE1 . HIS A 1 378 ? 27.481 40.553 29.339 1.00 52.79 ? 421 HIS A CE1 1 ATOM 2628 N NE2 . HIS A 1 378 ? 27.829 41.810 29.552 1.00 45.43 ? 421 HIS A NE2 1 ATOM 2629 N N . ILE A 1 379 ? 26.455 42.012 35.756 1.00 36.26 ? 422 ILE A N 1 ATOM 2630 C CA . ILE A 1 379 ? 25.788 41.751 37.025 1.00 35.01 ? 422 ILE A CA 1 ATOM 2631 C C . ILE A 1 379 ? 24.403 41.200 36.732 1.00 38.26 ? 422 ILE A C 1 ATOM 2632 O O . ILE A 1 379 ? 23.705 41.684 35.833 1.00 41.14 ? 422 ILE A O 1 ATOM 2633 C CB . ILE A 1 379 ? 25.690 43.002 37.919 1.00 39.65 ? 422 ILE A CB 1 ATOM 2634 C CG1 . ILE A 1 379 ? 27.079 43.551 38.237 1.00 46.97 ? 422 ILE A CG1 1 ATOM 2635 C CG2 . ILE A 1 379 ? 24.951 42.671 39.202 1.00 35.41 ? 422 ILE A CG2 1 ATOM 2636 C CD1 . ILE A 1 379 ? 27.047 44.825 39.063 1.00 51.91 ? 422 ILE A CD1 1 ATOM 2637 N N . ILE A 1 380 ? 24.012 40.178 37.487 1.00 46.51 ? 423 ILE A N 1 ATOM 2638 C CA . ILE A 1 380 ? 22.691 39.580 37.372 1.00 34.21 ? 423 ILE A CA 1 ATOM 2639 C C . ILE A 1 380 ? 22.129 39.415 38.776 1.00 46.32 ? 423 ILE A C 1 ATOM 2640 O O . ILE A 1 380 ? 22.870 39.184 39.737 1.00 50.46 ? 423 ILE A O 1 ATOM 2641 C CB . ILE A 1 380 ? 22.742 38.224 36.642 1.00 30.29 ? 423 ILE A CB 1 ATOM 2642 C CG1 . ILE A 1 380 ? 23.456 37.188 37.501 1.00 34.44 ? 423 ILE A CG1 1 ATOM 2643 C CG2 . ILE A 1 380 ? 23.501 38.355 35.338 1.00 41.24 ? 423 ILE A CG2 1 ATOM 2644 C CD1 . ILE A 1 380 ? 23.580 35.839 36.830 1.00 38.62 ? 423 ILE A CD1 1 ATOM 2645 N N . GLY A 1 381 ? 20.812 39.543 38.894 1.00 37.92 ? 424 GLY A N 1 ATOM 2646 C CA . GLY A 1 381 ? 20.160 39.401 40.185 1.00 31.32 ? 424 GLY A CA 1 ATOM 2647 C C . GLY A 1 381 ? 18.659 39.402 40.014 1.00 41.16 ? 424 GLY A C 1 ATOM 2648 O O . GLY A 1 381 ? 18.131 39.772 38.962 1.00 52.09 ? 424 GLY A O 1 ATOM 2649 N N . HIS A 1 382 ? 17.969 38.992 41.079 1.00 39.23 ? 425 HIS A N 1 ATOM 2650 C CA . HIS A 1 382 ? 16.513 38.869 41.007 1.00 41.29 ? 425 HIS A CA 1 ATOM 2651 C C . HIS A 1 382 ? 15.837 40.220 41.210 1.00 41.63 ? 425 HIS A C 1 ATOM 2652 O O . HIS A 1 382 ? 15.229 40.767 40.287 1.00 57.48 ? 425 HIS A O 1 ATOM 2653 C CB . HIS A 1 382 ? 16.000 37.853 42.032 1.00 38.78 ? 425 HIS A CB 1 ATOM 2654 C CG . HIS A 1 382 ? 14.534 37.584 41.908 1.00 37.88 ? 425 HIS A CG 1 ATOM 2655 N ND1 . HIS A 1 382 ? 13.983 37.080 40.754 1.00 50.31 ? 425 HIS A ND1 1 ATOM 2656 C CD2 . HIS A 1 382 ? 13.504 37.759 42.774 1.00 52.93 ? 425 HIS A CD2 1 ATOM 2657 C CE1 . HIS A 1 382 ? 12.679 36.955 40.910 1.00 64.56 ? 425 HIS A CE1 1 ATOM 2658 N NE2 . HIS A 1 382 ? 12.359 37.350 42.132 1.00 57.69 ? 425 HIS A NE2 1 ATOM 2659 N N . ILE A 1 383 ? 15.912 40.755 42.419 1.00 47.61 ? 426 ILE A N 1 ATOM 2660 C CA . ILE A 1 383 ? 15.228 42.012 42.728 1.00 49.42 ? 426 ILE A CA 1 ATOM 2661 C C . ILE A 1 383 ? 16.051 43.167 42.166 1.00 42.71 ? 426 ILE A C 1 ATOM 2662 O O . ILE A 1 383 ? 17.261 43.239 42.430 1.00 48.50 ? 426 ILE A O 1 ATOM 2663 C CB . ILE A 1 383 ? 15.026 42.158 44.232 1.00 49.97 ? 426 ILE A CB 1 ATOM 2664 C CG1 . ILE A 1 383 ? 14.211 40.984 44.774 1.00 44.40 ? 426 ILE A CG1 1 ATOM 2665 C CG2 . ILE A 1 383 ? 14.296 43.450 44.546 1.00 46.30 ? 426 ILE A CG2 1 ATOM 2666 C CD1 . ILE A 1 383 ? 13.968 41.042 46.260 1.00 53.18 ? 426 ILE A CD1 1 ATOM 2667 N N . PRO A 1 384 ? 15.446 44.077 41.402 1.00 37.38 ? 427 PRO A N 1 ATOM 2668 C CA . PRO A 1 384 ? 16.221 45.171 40.823 1.00 50.08 ? 427 PRO A CA 1 ATOM 2669 C C . PRO A 1 384 ? 16.558 46.219 41.873 1.00 53.55 ? 427 PRO A C 1 ATOM 2670 O O . PRO A 1 384 ? 15.772 46.458 42.803 1.00 42.30 ? 427 PRO A O 1 ATOM 2671 C CB . PRO A 1 384 ? 15.285 45.739 39.744 1.00 44.45 ? 427 PRO A CB 1 ATOM 2672 C CG . PRO A 1 384 ? 13.917 45.412 40.240 1.00 48.89 ? 427 PRO A CG 1 ATOM 2673 C CD . PRO A 1 384 ? 14.035 44.100 40.979 1.00 35.55 ? 427 PRO A CD 1 ATOM 2674 N N . PRO A 1 385 ? 17.716 46.864 41.759 1.00 49.00 ? 428 PRO A N 1 ATOM 2675 C CA . PRO A 1 385 ? 18.009 47.987 42.655 1.00 37.17 ? 428 PRO A CA 1 ATOM 2676 C C . PRO A 1 385 ? 17.059 49.131 42.354 1.00 47.50 ? 428 PRO A C 1 ATOM 2677 O O . PRO A 1 385 ? 16.808 49.462 41.193 1.00 70.79 ? 428 PRO A O 1 ATOM 2678 C CB . PRO A 1 385 ? 19.459 48.345 42.316 1.00 41.93 ? 428 PRO A CB 1 ATOM 2679 C CG . PRO A 1 385 ? 19.610 47.931 40.887 1.00 44.45 ? 428 PRO A CG 1 ATOM 2680 C CD . PRO A 1 385 ? 18.737 46.710 40.709 1.00 52.96 ? 428 PRO A CD 1 ATOM 2681 N N . GLY A 1 386 ? 16.530 49.737 43.405 1.00 39.43 ? 429 GLY A N 1 ATOM 2682 C CA . GLY A 1 386 ? 15.429 50.664 43.290 1.00 50.61 ? 429 GLY A CA 1 ATOM 2683 C C . GLY A 1 386 ? 14.119 50.081 43.758 1.00 51.86 ? 429 GLY A C 1 ATOM 2684 O O . GLY A 1 386 ? 13.154 50.830 43.961 1.00 54.20 ? 429 GLY A O 1 ATOM 2685 N N . HIS A 1 387 ? 14.051 48.759 43.891 1.00 47.45 ? 430 HIS A N 1 ATOM 2686 C CA . HIS A 1 387 ? 13.064 48.088 44.722 1.00 46.58 ? 430 HIS A CA 1 ATOM 2687 C C . HIS A 1 387 ? 13.598 47.781 46.113 1.00 49.42 ? 430 HIS A C 1 ATOM 2688 O O . HIS A 1 387 ? 12.862 47.230 46.937 1.00 49.87 ? 430 HIS A O 1 ATOM 2689 C CB . HIS A 1 387 ? 12.603 46.790 44.051 1.00 42.88 ? 430 HIS A CB 1 ATOM 2690 C CG . HIS A 1 387 ? 11.609 46.996 42.951 1.00 57.08 ? 430 HIS A CG 1 ATOM 2691 N ND1 . HIS A 1 387 ? 11.802 47.904 41.932 1.00 54.17 ? 430 HIS A ND1 1 ATOM 2692 C CD2 . HIS A 1 387 ? 10.416 46.403 42.708 1.00 54.99 ? 430 HIS A CD2 1 ATOM 2693 C CE1 . HIS A 1 387 ? 10.765 47.870 41.114 1.00 56.18 ? 430 HIS A CE1 1 ATOM 2694 N NE2 . HIS A 1 387 ? 9.911 46.966 41.561 1.00 63.56 ? 430 HIS A NE2 1 ATOM 2695 N N . CYS A 1 388 ? 14.849 48.140 46.392 1.00 40.02 ? 431 CYS A N 1 ATOM 2696 C CA . CYS A 1 388 ? 15.512 47.772 47.631 1.00 51.44 ? 431 CYS A CA 1 ATOM 2697 C C . CYS A 1 388 ? 15.285 48.834 48.704 1.00 57.86 ? 431 CYS A C 1 ATOM 2698 O O . CYS A 1 388 ? 14.619 49.848 48.483 1.00 55.29 ? 431 CYS A O 1 ATOM 2699 C CB . CYS A 1 388 ? 16.997 47.547 47.382 1.00 59.79 ? 431 CYS A CB 1 ATOM 2700 S SG . CYS A 1 388 ? 17.343 46.079 46.417 1.00 48.30 ? 431 CYS A SG 1 ATOM 2701 N N . LEU A 1 389 ? 15.838 48.589 49.894 1.00 52.76 ? 432 LEU A N 1 ATOM 2702 C CA . LEU A 1 389 ? 15.415 49.332 51.074 1.00 63.56 ? 432 LEU A CA 1 ATOM 2703 C C . LEU A 1 389 ? 15.643 50.837 50.984 1.00 75.37 ? 432 LEU A C 1 ATOM 2704 O O . LEU A 1 389 ? 14.764 51.586 50.547 1.00 85.48 ? 432 LEU A O 1 ATOM 2705 C CB . LEU A 1 389 ? 16.178 48.803 52.291 1.00 64.88 ? 432 LEU A CB 1 ATOM 2706 C CG . LEU A 1 389 ? 15.909 47.390 52.801 1.00 44.15 ? 432 LEU A CG 1 ATOM 2707 C CD1 . LEU A 1 389 ? 17.092 46.926 53.637 1.00 35.55 ? 432 LEU A CD1 1 ATOM 2708 C CD2 . LEU A 1 389 ? 14.630 47.350 53.609 1.00 40.11 ? 432 LEU A CD2 1 ATOM 2709 N N . LYS A 1 390 ? 16.825 51.285 51.408 1.00 62.81 ? 433 LYS A N 1 ATOM 2710 C CA . LYS A 1 390 ? 17.262 52.670 51.275 1.00 52.80 ? 433 LYS A CA 1 ATOM 2711 C C . LYS A 1 390 ? 18.767 52.718 51.056 1.00 54.89 ? 433 LYS A C 1 ATOM 2712 O O . LYS A 1 390 ? 19.256 53.109 49.992 1.00 73.61 ? 433 LYS A O 1 ATOM 2713 C CB . LYS A 1 390 ? 16.863 53.482 52.507 1.00 80.61 ? 433 LYS A CB 1 ATOM 2714 C CG . LYS A 1 390 ? 17.455 54.887 52.575 1.00 96.41 ? 433 LYS A CG 1 ATOM 2715 C CD . LYS A 1 390 ? 16.746 55.854 51.638 1.00 90.93 ? 433 LYS A CD 1 ATOM 2716 C CE . LYS A 1 390 ? 17.006 57.306 52.035 1.00 80.89 ? 433 LYS A CE 1 ATOM 2717 N NZ . LYS A 1 390 ? 18.459 57.639 52.104 1.00 84.52 1 433 LYS A NZ 1 ATOM 2718 N N . SER A 1 391 ? 19.497 52.321 52.102 1.00 60.88 ? 434 SER A N 1 ATOM 2719 C CA . SER A 1 391 ? 20.952 52.412 52.103 1.00 71.24 ? 434 SER A CA 1 ATOM 2720 C C . SER A 1 391 ? 21.566 51.449 51.099 1.00 59.13 ? 434 SER A C 1 ATOM 2721 O O . SER A 1 391 ? 22.507 51.809 50.382 1.00 65.63 ? 434 SER A O 1 ATOM 2722 C CB . SER A 1 391 ? 21.483 52.134 53.510 1.00 70.54 ? 434 SER A CB 1 ATOM 2723 O OG . SER A 1 391 ? 20.840 52.956 54.470 1.00 58.59 ? 434 SER A OG 1 ATOM 2724 N N . TRP A 1 392 ? 21.062 50.215 51.046 1.00 51.52 ? 435 TRP A N 1 ATOM 2725 C CA . TRP A 1 392 ? 21.553 49.261 50.059 1.00 52.70 ? 435 TRP A CA 1 ATOM 2726 C C . TRP A 1 392 ? 21.464 49.847 48.658 1.00 54.80 ? 435 TRP A C 1 ATOM 2727 O O . TRP A 1 392 ? 22.446 49.855 47.907 1.00 52.50 ? 435 TRP A O 1 ATOM 2728 C CB . TRP A 1 392 ? 20.759 47.959 50.152 1.00 57.93 ? 435 TRP A CB 1 ATOM 2729 C CG . TRP A 1 392 ? 21.538 46.745 49.756 1.00 54.21 ? 435 TRP A CG 1 ATOM 2730 C CD1 . TRP A 1 392 ? 21.956 45.742 50.577 1.00 54.71 ? 435 TRP A CD1 1 ATOM 2731 C CD2 . TRP A 1 392 ? 21.985 46.397 48.439 1.00 69.74 ? 435 TRP A CD2 1 ATOM 2732 N NE1 . TRP A 1 392 ? 22.640 44.794 49.859 1.00 62.80 ? 435 TRP A NE1 1 ATOM 2733 C CE2 . TRP A 1 392 ? 22.671 45.171 48.543 1.00 58.58 ? 435 TRP A CE2 1 ATOM 2734 C CE3 . TRP A 1 392 ? 21.870 47.002 47.182 1.00 73.60 ? 435 TRP A CE3 1 ATOM 2735 C CZ2 . TRP A 1 392 ? 23.241 44.538 47.441 1.00 51.45 ? 435 TRP A CZ2 1 ATOM 2736 C CZ3 . TRP A 1 392 ? 22.434 46.368 46.086 1.00 61.44 ? 435 TRP A CZ3 1 ATOM 2737 C CH2 . TRP A 1 392 ? 23.112 45.150 46.224 1.00 52.16 ? 435 TRP A CH2 1 ATOM 2738 N N . SER A 1 393 ? 20.289 50.370 48.302 1.00 57.66 ? 436 SER A N 1 ATOM 2739 C CA . SER A 1 393 ? 20.088 50.924 46.968 1.00 44.59 ? 436 SER A CA 1 ATOM 2740 C C . SER A 1 393 ? 21.079 52.047 46.688 1.00 50.72 ? 436 SER A C 1 ATOM 2741 O O . SER A 1 393 ? 21.723 52.074 45.632 1.00 60.98 ? 436 SER A O 1 ATOM 2742 C CB . SER A 1 393 ? 18.648 51.416 46.823 1.00 46.02 ? 436 SER A CB 1 ATOM 2743 O OG . SER A 1 393 ? 18.408 51.933 45.527 1.00 61.20 ? 436 SER A OG 1 ATOM 2744 N N . TRP A 1 394 ? 21.220 52.983 47.631 1.00 55.50 ? 437 TRP A N 1 ATOM 2745 C CA . TRP A 1 394 ? 22.117 54.117 47.427 1.00 44.64 ? 437 TRP A CA 1 ATOM 2746 C C . TRP A 1 394 ? 23.563 53.669 47.274 1.00 48.66 ? 437 TRP A C 1 ATOM 2747 O O . TRP A 1 394 ? 24.316 54.240 46.477 1.00 63.35 ? 437 TRP A O 1 ATOM 2748 C CB . TRP A 1 394 ? 21.995 55.099 48.589 1.00 55.46 ? 437 TRP A CB 1 ATOM 2749 C CG . TRP A 1 394 ? 20.833 56.028 48.484 1.00 66.53 ? 437 TRP A CG 1 ATOM 2750 C CD1 . TRP A 1 394 ? 19.508 55.701 48.533 1.00 65.22 ? 437 TRP A CD1 1 ATOM 2751 C CD2 . TRP A 1 394 ? 20.891 57.450 48.337 1.00 57.82 ? 437 TRP A CD2 1 ATOM 2752 N NE1 . TRP A 1 394 ? 18.737 56.833 48.412 1.00 64.60 ? 437 TRP A NE1 1 ATOM 2753 C CE2 . TRP A 1 394 ? 19.563 57.921 48.292 1.00 58.29 ? 437 TRP A CE2 1 ATOM 2754 C CE3 . TRP A 1 394 ? 21.938 58.372 48.233 1.00 50.42 ? 437 TRP A CE3 1 ATOM 2755 C CZ2 . TRP A 1 394 ? 19.254 59.272 48.148 1.00 54.81 ? 437 TRP A CZ2 1 ATOM 2756 C CZ3 . TRP A 1 394 ? 21.630 59.713 48.089 1.00 42.86 ? 437 TRP A CZ3 1 ATOM 2757 C CH2 . TRP A 1 394 ? 20.298 60.150 48.048 1.00 45.70 ? 437 TRP A CH2 1 ATOM 2758 N N . ASN A 1 395 ? 23.977 52.661 48.041 1.00 43.96 ? 438 ASN A N 1 ATOM 2759 C CA . ASN A 1 395 ? 25.338 52.157 47.903 1.00 45.19 ? 438 ASN A CA 1 ATOM 2760 C C . ASN A 1 395 ? 25.538 51.479 46.556 1.00 51.69 ? 438 ASN A C 1 ATOM 2761 O O . ASN A 1 395 ? 26.591 51.635 45.925 1.00 54.00 ? 438 ASN A O 1 ATOM 2762 C CB . ASN A 1 395 ? 25.658 51.201 49.049 1.00 67.87 ? 438 ASN A CB 1 ATOM 2763 C CG . ASN A 1 395 ? 25.879 51.926 50.359 1.00 63.70 ? 438 ASN A CG 1 ATOM 2764 O OD1 . ASN A 1 395 ? 27.008 52.270 50.710 1.00 75.22 ? 438 ASN A OD1 1 ATOM 2765 N ND2 . ASN A 1 395 ? 24.797 52.172 51.087 1.00 60.12 ? 438 ASN A ND2 1 ATOM 2766 N N . TYR A 1 396 ? 24.533 50.738 46.085 1.00 55.30 ? 439 TYR A N 1 ATOM 2767 C CA . TYR A 1 396 ? 24.634 50.155 44.754 1.00 54.45 ? 439 TYR A CA 1 ATOM 2768 C C . TYR A 1 396 ? 24.792 51.248 43.707 1.00 48.92 ? 439 TYR A C 1 ATOM 2769 O O . TYR A 1 396 ? 25.748 51.241 42.923 1.00 42.55 ? 439 TYR A O 1 ATOM 2770 C CB . TYR A 1 396 ? 23.408 49.293 44.453 1.00 46.03 ? 439 TYR A CB 1 ATOM 2771 C CG . TYR A 1 396 ? 23.595 48.431 43.229 1.00 51.64 ? 439 TYR A CG 1 ATOM 2772 C CD1 . TYR A 1 396 ? 24.348 47.268 43.292 1.00 36.04 ? 439 TYR A CD1 1 ATOM 2773 C CD2 . TYR A 1 396 ? 23.038 48.789 42.006 1.00 46.88 ? 439 TYR A CD2 1 ATOM 2774 C CE1 . TYR A 1 396 ? 24.535 46.478 42.178 1.00 49.58 ? 439 TYR A CE1 1 ATOM 2775 C CE2 . TYR A 1 396 ? 23.219 48.003 40.882 1.00 44.45 ? 439 TYR A CE2 1 ATOM 2776 C CZ . TYR A 1 396 ? 23.971 46.849 40.975 1.00 53.32 ? 439 TYR A CZ 1 ATOM 2777 O OH . TYR A 1 396 ? 24.163 46.058 39.865 1.00 37.94 ? 439 TYR A OH 1 ATOM 2778 N N . TYR A 1 397 ? 23.872 52.216 43.708 1.00 36.44 ? 440 TYR A N 1 ATOM 2779 C CA . TYR A 1 397 ? 23.960 53.356 42.802 1.00 50.26 ? 440 TYR A CA 1 ATOM 2780 C C . TYR A 1 397 ? 25.358 53.964 42.826 1.00 54.85 ? 440 TYR A C 1 ATOM 2781 O O . TYR A 1 397 ? 25.979 54.182 41.779 1.00 49.70 ? 440 TYR A O 1 ATOM 2782 C CB . TYR A 1 397 ? 22.912 54.395 43.200 1.00 38.57 ? 440 TYR A CB 1 ATOM 2783 C CG . TYR A 1 397 ? 22.314 55.165 42.051 1.00 43.96 ? 440 TYR A CG 1 ATOM 2784 C CD1 . TYR A 1 397 ? 22.917 56.318 41.576 1.00 46.15 ? 440 TYR A CD1 1 ATOM 2785 C CD2 . TYR A 1 397 ? 21.135 54.747 41.452 1.00 50.74 ? 440 TYR A CD2 1 ATOM 2786 C CE1 . TYR A 1 397 ? 22.370 57.030 40.528 1.00 53.29 ? 440 TYR A CE1 1 ATOM 2787 C CE2 . TYR A 1 397 ? 20.579 55.450 40.403 1.00 59.03 ? 440 TYR A CE2 1 ATOM 2788 C CZ . TYR A 1 397 ? 21.201 56.593 39.945 1.00 66.62 ? 440 TYR A CZ 1 ATOM 2789 O OH . TYR A 1 397 ? 20.653 57.302 38.900 1.00 79.81 ? 440 TYR A OH 1 ATOM 2790 N N . ARG A 1 398 ? 25.872 54.228 44.029 1.00 57.50 ? 441 ARG A N 1 ATOM 2791 C CA . ARG A 1 398 ? 27.213 54.786 44.168 1.00 56.04 ? 441 ARG A CA 1 ATOM 2792 C C . ARG A 1 398 ? 28.252 53.902 43.489 1.00 47.90 ? 441 ARG A C 1 ATOM 2793 O O . ARG A 1 398 ? 29.192 54.402 42.855 1.00 50.89 ? 441 ARG A O 1 ATOM 2794 C CB . ARG A 1 398 ? 27.533 54.962 45.652 1.00 51.50 ? 441 ARG A CB 1 ATOM 2795 C CG . ARG A 1 398 ? 28.942 55.419 45.957 1.00 61.63 ? 441 ARG A CG 1 ATOM 2796 C CD . ARG A 1 398 ? 29.000 56.086 47.318 1.00 64.08 ? 441 ARG A CD 1 ATOM 2797 N NE . ARG A 1 398 ? 30.352 56.089 47.867 1.00 85.53 ? 441 ARG A NE 1 ATOM 2798 C CZ . ARG A 1 398 ? 30.757 55.288 48.848 1.00 91.14 ? 441 ARG A CZ 1 ATOM 2799 N NH1 . ARG A 1 398 ? 29.912 54.422 49.393 1.00 84.48 1 441 ARG A NH1 1 ATOM 2800 N NH2 . ARG A 1 398 ? 32.007 55.353 49.289 1.00 80.23 ? 441 ARG A NH2 1 ATOM 2801 N N . ILE A 1 399 ? 28.086 52.584 43.595 1.00 52.75 ? 442 ILE A N 1 ATOM 2802 C CA . ILE A 1 399 ? 29.067 51.662 43.031 1.00 55.70 ? 442 ILE A CA 1 ATOM 2803 C C . ILE A 1 399 ? 29.017 51.685 41.507 1.00 52.01 ? 442 ILE A C 1 ATOM 2804 O O . ILE A 1 399 ? 30.039 51.886 40.839 1.00 45.80 ? 442 ILE A O 1 ATOM 2805 C CB . ILE A 1 399 ? 28.843 50.247 43.589 1.00 53.77 ? 442 ILE A CB 1 ATOM 2806 C CG1 . ILE A 1 399 ? 28.973 50.270 45.113 1.00 34.17 ? 442 ILE A CG1 1 ATOM 2807 C CG2 . ILE A 1 399 ? 29.837 49.276 42.978 1.00 47.02 ? 442 ILE A CG2 1 ATOM 2808 C CD1 . ILE A 1 399 ? 28.718 48.947 45.770 1.00 45.12 ? 442 ILE A CD1 1 ATOM 2809 N N . VAL A 1 400 ? 27.831 51.479 40.928 1.00 46.70 ? 443 VAL A N 1 ATOM 2810 C CA . VAL A 1 400 ? 27.729 51.487 39.472 1.00 49.46 ? 443 VAL A CA 1 ATOM 2811 C C . VAL A 1 400 ? 28.246 52.806 38.920 1.00 54.73 ? 443 VAL A C 1 ATOM 2812 O O . VAL A 1 400 ? 28.999 52.832 37.938 1.00 54.27 ? 443 VAL A O 1 ATOM 2813 C CB . VAL A 1 400 ? 26.280 51.211 39.020 1.00 47.73 ? 443 VAL A CB 1 ATOM 2814 C CG1 . VAL A 1 400 ? 25.705 50.016 39.764 1.00 49.76 ? 443 VAL A CG1 1 ATOM 2815 C CG2 . VAL A 1 400 ? 25.408 52.440 39.218 1.00 59.58 ? 443 VAL A CG2 1 ATOM 2816 N N . ALA A 1 401 ? 27.886 53.920 39.564 1.00 58.26 ? 444 ALA A N 1 ATOM 2817 C CA . ALA A 1 401 ? 28.385 55.213 39.112 1.00 43.49 ? 444 ALA A CA 1 ATOM 2818 C C . ALA A 1 401 ? 29.907 55.252 39.142 1.00 48.19 ? 444 ALA A C 1 ATOM 2819 O O . ALA A 1 401 ? 30.541 55.716 38.188 1.00 56.64 ? 444 ALA A O 1 ATOM 2820 C CB . ALA A 1 401 ? 27.794 56.335 39.965 1.00 46.46 ? 444 ALA A CB 1 ATOM 2821 N N . ARG A 1 402 ? 30.517 54.759 40.222 1.00 55.01 ? 445 ARG A N 1 ATOM 2822 C CA . ARG A 1 402 ? 31.975 54.763 40.279 1.00 60.37 ? 445 ARG A CA 1 ATOM 2823 C C . ARG A 1 402 ? 32.570 53.880 39.189 1.00 53.68 ? 445 ARG A C 1 ATOM 2824 O O . ARG A 1 402 ? 33.598 54.220 38.593 1.00 56.00 ? 445 ARG A O 1 ATOM 2825 C CB . ARG A 1 402 ? 32.449 54.305 41.659 1.00 51.42 ? 445 ARG A CB 1 ATOM 2826 C CG . ARG A 1 402 ? 33.904 53.845 41.713 1.00 53.93 ? 445 ARG A CG 1 ATOM 2827 C CD . ARG A 1 402 ? 34.872 54.985 41.432 1.00 40.79 ? 445 ARG A CD 1 ATOM 2828 N NE . ARG A 1 402 ? 36.265 54.555 41.535 1.00 43.92 ? 445 ARG A NE 1 ATOM 2829 C CZ . ARG A 1 402 ? 36.950 53.976 40.553 1.00 61.92 ? 445 ARG A CZ 1 ATOM 2830 N NH1 . ARG A 1 402 ? 36.373 53.752 39.381 1.00 62.20 1 445 ARG A NH1 1 ATOM 2831 N NH2 . ARG A 1 402 ? 38.214 53.619 40.742 1.00 56.89 ? 445 ARG A NH2 1 ATOM 2832 N N . TYR A 1 403 ? 31.935 52.742 38.919 1.00 52.33 ? 446 TYR A N 1 ATOM 2833 C CA . TYR A 1 403 ? 32.471 51.675 38.083 1.00 56.44 ? 446 TYR A CA 1 ATOM 2834 C C . TYR A 1 403 ? 31.958 51.689 36.640 1.00 59.10 ? 446 TYR A C 1 ATOM 2835 O O . TYR A 1 403 ? 32.055 50.664 35.954 1.00 47.22 ? 446 TYR A O 1 ATOM 2836 C CB . TYR A 1 403 ? 32.252 50.328 38.767 1.00 55.16 ? 446 TYR A CB 1 ATOM 2837 C CG . TYR A 1 403 ? 33.233 50.198 39.908 1.00 63.89 ? 446 TYR A CG 1 ATOM 2838 C CD1 . TYR A 1 403 ? 34.583 49.998 39.651 1.00 60.13 ? 446 TYR A CD1 1 ATOM 2839 C CD2 . TYR A 1 403 ? 32.832 50.352 41.230 1.00 65.24 ? 446 TYR A CD2 1 ATOM 2840 C CE1 . TYR A 1 403 ? 35.501 49.911 40.674 1.00 71.75 ? 446 TYR A CE1 1 ATOM 2841 C CE2 . TYR A 1 403 ? 33.748 50.268 42.266 1.00 49.72 ? 446 TYR A CE2 1 ATOM 2842 C CZ . TYR A 1 403 ? 35.081 50.046 41.979 1.00 62.14 ? 446 TYR A CZ 1 ATOM 2843 O OH . TYR A 1 403 ? 36.005 49.958 42.992 1.00 59.39 ? 446 TYR A OH 1 ATOM 2844 N N . GLU A 1 404 ? 31.377 52.805 36.183 1.00 61.89 ? 447 GLU A N 1 ATOM 2845 C CA . GLU A 1 404 ? 30.734 52.874 34.871 1.00 52.39 ? 447 GLU A CA 1 ATOM 2846 C C . GLU A 1 404 ? 31.510 52.130 33.787 1.00 52.96 ? 447 GLU A C 1 ATOM 2847 O O . GLU A 1 404 ? 31.013 51.161 33.205 1.00 58.79 ? 447 GLU A O 1 ATOM 2848 C CB . GLU A 1 404 ? 30.584 54.336 34.429 1.00 47.04 ? 447 GLU A CB 1 ATOM 2849 C CG . GLU A 1 404 ? 29.884 55.281 35.379 1.00 73.06 ? 447 GLU A CG 1 ATOM 2850 C CD . GLU A 1 404 ? 29.954 56.727 34.891 1.00 78.53 ? 447 GLU A CD 1 ATOM 2851 O OE1 . GLU A 1 404 ? 30.615 56.978 33.860 1.00 77.82 ? 447 GLU A OE1 1 ATOM 2852 O OE2 . GLU A 1 404 ? 29.351 57.612 35.535 1.00 74.61 -1 447 GLU A OE2 1 ATOM 2853 N N . ASN A 1 405 ? 32.726 52.595 33.486 1.00 54.49 ? 448 ASN A N 1 ATOM 2854 C CA . ASN A 1 405 ? 33.489 52.017 32.382 1.00 59.31 ? 448 ASN A CA 1 ATOM 2855 C C . ASN A 1 405 ? 33.664 50.509 32.524 1.00 54.85 ? 448 ASN A C 1 ATOM 2856 O O . ASN A 1 405 ? 33.747 49.801 31.514 1.00 58.16 ? 448 ASN A O 1 ATOM 2857 C CB . ASN A 1 405 ? 34.853 52.699 32.272 1.00 67.46 ? 448 ASN A CB 1 ATOM 2858 C CG . ASN A 1 405 ? 34.741 54.165 31.904 1.00 71.81 ? 448 ASN A CG 1 ATOM 2859 O OD1 . ASN A 1 405 ? 33.750 54.593 31.313 1.00 70.62 ? 448 ASN A OD1 1 ATOM 2860 N ND2 . ASN A 1 405 ? 35.762 54.943 32.249 1.00 75.40 ? 448 ASN A ND2 1 ATOM 2861 N N . THR A 1 406 ? 33.737 49.999 33.755 1.00 70.88 ? 449 THR A N 1 ATOM 2862 C CA . THR A 1 406 ? 33.959 48.567 33.934 1.00 60.75 ? 449 THR A CA 1 ATOM 2863 C C . THR A 1 406 ? 32.674 47.761 33.778 1.00 49.41 ? 449 THR A C 1 ATOM 2864 O O . THR A 1 406 ? 32.687 46.689 33.163 1.00 48.37 ? 449 THR A O 1 ATOM 2865 C CB . THR A 1 406 ? 34.583 48.289 35.302 1.00 53.89 ? 449 THR A CB 1 ATOM 2866 O OG1 . THR A 1 406 ? 35.838 48.970 35.404 1.00 63.62 ? 449 THR A OG1 1 ATOM 2867 C CG2 . THR A 1 406 ? 34.813 46.798 35.480 1.00 50.71 ? 449 THR A CG2 1 ATOM 2868 N N . LEU A 1 407 ? 31.558 48.251 34.315 1.00 49.66 ? 450 LEU A N 1 ATOM 2869 C CA . LEU A 1 407 ? 30.315 47.488 34.287 1.00 54.72 ? 450 LEU A CA 1 ATOM 2870 C C . LEU A 1 407 ? 29.648 47.624 32.920 1.00 47.43 ? 450 LEU A C 1 ATOM 2871 O O . LEU A 1 407 ? 29.224 48.719 32.531 1.00 45.70 ? 450 LEU A O 1 ATOM 2872 C CB . LEU A 1 407 ? 29.387 47.957 35.406 1.00 43.95 ? 450 LEU A CB 1 ATOM 2873 C CG . LEU A 1 407 ? 27.943 47.455 35.391 1.00 55.30 ? 450 LEU A CG 1 ATOM 2874 C CD1 . LEU A 1 407 ? 27.370 47.454 36.792 1.00 46.63 ? 450 LEU A CD1 1 ATOM 2875 C CD2 . LEU A 1 407 ? 27.082 48.320 34.475 1.00 65.79 ? 450 LEU A CD2 1 ATOM 2876 N N . ALA A 1 408 ? 29.540 46.502 32.204 1.00 39.85 ? 451 ALA A N 1 ATOM 2877 C CA . ALA A 1 408 ? 29.010 46.505 30.844 1.00 48.86 ? 451 ALA A CA 1 ATOM 2878 C C . ALA A 1 408 ? 27.486 46.438 30.803 1.00 54.58 ? 451 ALA A C 1 ATOM 2879 O O . ALA A 1 408 ? 26.858 47.117 29.983 1.00 57.77 ? 451 ALA A O 1 ATOM 2880 C CB . ALA A 1 408 ? 29.610 45.345 30.051 1.00 55.15 ? 451 ALA A CB 1 ATOM 2881 N N . ALA A 1 409 ? 26.874 45.607 31.644 1.00 57.67 ? 452 ALA A N 1 ATOM 2882 C CA . ALA A 1 409 ? 25.427 45.437 31.602 1.00 59.02 ? 452 ALA A CA 1 ATOM 2883 C C . ALA A 1 409 ? 24.942 44.887 32.934 1.00 56.95 ? 452 ALA A C 1 ATOM 2884 O O . ALA A 1 409 ? 25.719 44.349 33.728 1.00 55.12 ? 452 ALA A O 1 ATOM 2885 C CB . ALA A 1 409 ? 25.002 44.516 30.453 1.00 46.21 ? 452 ALA A CB 1 ATOM 2886 N N . GLN A 1 410 ? 23.635 45.013 33.157 1.00 41.17 ? 453 GLN A N 1 ATOM 2887 C CA . GLN A 1 410 ? 22.993 44.531 34.369 1.00 31.16 ? 453 GLN A CA 1 ATOM 2888 C C . GLN A 1 410 ? 21.629 43.959 34.023 1.00 36.80 ? 453 GLN A C 1 ATOM 2889 O O . GLN A 1 410 ? 20.870 44.563 33.260 1.00 43.27 ? 453 GLN A O 1 ATOM 2890 C CB . GLN A 1 410 ? 22.828 45.656 35.393 1.00 44.94 ? 453 GLN A CB 1 ATOM 2891 C CG . GLN A 1 410 ? 24.121 46.309 35.826 1.00 35.92 ? 453 GLN A CG 1 ATOM 2892 C CD . GLN A 1 410 ? 23.871 47.586 36.597 1.00 41.39 ? 453 GLN A CD 1 ATOM 2893 O OE1 . GLN A 1 410 ? 23.144 47.594 37.589 1.00 54.21 ? 453 GLN A OE1 1 ATOM 2894 N NE2 . GLN A 1 410 ? 24.465 48.679 36.136 1.00 46.02 ? 453 GLN A NE2 1 ATOM 2895 N N . PHE A 1 411 ? 21.305 42.817 34.619 1.00 35.50 ? 454 PHE A N 1 ATOM 2896 C CA . PHE A 1 411 ? 20.072 42.110 34.313 1.00 50.18 ? 454 PHE A CA 1 ATOM 2897 C C . PHE A 1 411 ? 19.365 41.746 35.610 1.00 45.33 ? 454 PHE A C 1 ATOM 2898 O O . PHE A 1 411 ? 20.001 41.295 36.568 1.00 36.94 ? 454 PHE A O 1 ATOM 2899 C CB . PHE A 1 411 ? 20.354 40.850 33.474 1.00 43.05 ? 454 PHE A CB 1 ATOM 2900 C CG . PHE A 1 411 ? 21.240 41.100 32.282 1.00 40.01 ? 454 PHE A CG 1 ATOM 2901 C CD1 . PHE A 1 411 ? 22.620 41.089 32.409 1.00 39.24 ? 454 PHE A CD1 1 ATOM 2902 C CD2 . PHE A 1 411 ? 20.691 41.355 31.036 1.00 47.99 ? 454 PHE A CD2 1 ATOM 2903 C CE1 . PHE A 1 411 ? 23.437 41.325 31.310 1.00 44.86 ? 454 PHE A CE1 1 ATOM 2904 C CE2 . PHE A 1 411 ? 21.501 41.589 29.936 1.00 35.16 ? 454 PHE A CE2 1 ATOM 2905 C CZ . PHE A 1 411 ? 22.876 41.577 30.075 1.00 31.56 ? 454 PHE A CZ 1 ATOM 2906 N N . PHE A 1 412 ? 18.048 41.948 35.639 1.00 41.28 ? 455 PHE A N 1 ATOM 2907 C CA . PHE A 1 412 ? 17.274 41.684 36.842 1.00 41.22 ? 455 PHE A CA 1 ATOM 2908 C C . PHE A 1 412 ? 15.878 41.216 36.460 1.00 56.82 ? 455 PHE A C 1 ATOM 2909 O O . PHE A 1 412 ? 15.325 41.624 35.435 1.00 61.45 ? 455 PHE A O 1 ATOM 2910 C CB . PHE A 1 412 ? 17.174 42.924 37.737 1.00 42.66 ? 455 PHE A CB 1 ATOM 2911 C CG . PHE A 1 412 ? 18.478 43.328 38.359 1.00 47.37 ? 455 PHE A CG 1 ATOM 2912 C CD1 . PHE A 1 412 ? 18.954 42.680 39.484 1.00 54.58 ? 455 PHE A CD1 1 ATOM 2913 C CD2 . PHE A 1 412 ? 19.223 44.366 37.824 1.00 46.10 ? 455 PHE A CD2 1 ATOM 2914 C CE1 . PHE A 1 412 ? 20.155 43.053 40.058 1.00 53.48 ? 455 PHE A CE1 1 ATOM 2915 C CE2 . PHE A 1 412 ? 20.423 44.745 38.394 1.00 39.92 ? 455 PHE A CE2 1 ATOM 2916 C CZ . PHE A 1 412 ? 20.889 44.088 39.512 1.00 45.75 ? 455 PHE A CZ 1 ATOM 2917 N N . GLY A 1 413 ? 15.330 40.333 37.289 1.00 52.30 ? 456 GLY A N 1 ATOM 2918 C CA . GLY A 1 413 ? 13.974 39.847 37.134 1.00 49.53 ? 456 GLY A CA 1 ATOM 2919 C C . GLY A 1 413 ? 13.001 40.366 38.173 1.00 41.27 ? 456 GLY A C 1 ATOM 2920 O O . GLY A 1 413 ? 13.112 41.498 38.650 1.00 59.87 ? 456 GLY A O 1 ATOM 2921 N N . HIS A 1 414 ? 12.113 39.557 38.578 1.00 45.95 ? 457 HIS A N 1 ATOM 2922 C CA . HIS A 1 414 ? 11.208 39.871 39.646 1.00 47.78 ? 457 HIS A CA 1 ATOM 2923 C C . HIS A 1 414 ? 9.996 40.660 39.359 1.00 48.86 ? 457 HIS A C 1 ATOM 2924 O O . HIS A 1 414 ? 8.977 40.430 39.917 1.00 31.94 ? 457 HIS A O 1 ATOM 2925 C CB . HIS A 1 414 ? 11.994 40.560 40.739 1.00 52.04 ? 457 HIS A CB 1 ATOM 2926 C CG . HIS A 1 414 ? 11.278 40.605 42.041 1.00 73.52 ? 457 HIS A CG 1 ATOM 2927 N ND1 . HIS A 1 414 ? 10.686 39.496 42.596 1.00 70.73 ? 457 HIS A ND1 1 ATOM 2928 C CD2 . HIS A 1 414 ? 11.039 41.626 42.884 1.00 56.07 ? 457 HIS A CD2 1 ATOM 2929 C CE1 . HIS A 1 414 ? 10.107 39.842 43.728 1.00 65.15 ? 457 HIS A CE1 1 ATOM 2930 N NE2 . HIS A 1 414 ? 10.306 41.129 43.922 1.00 43.37 ? 457 HIS A NE2 1 ATOM 2931 N N . THR A 1 415 ? 10.112 41.575 38.525 1.00 52.05 ? 458 THR A N 1 ATOM 2932 C CA . THR A 1 415 ? 8.963 42.422 38.233 1.00 37.83 ? 458 THR A CA 1 ATOM 2933 C C . THR A 1 415 ? 7.873 41.630 37.532 1.00 50.75 ? 458 THR A C 1 ATOM 2934 O O . THR A 1 415 ? 6.687 41.955 37.663 1.00 50.48 ? 458 THR A O 1 ATOM 2935 C CB . THR A 1 415 ? 9.379 43.617 37.377 1.00 52.93 ? 458 THR A CB 1 ATOM 2936 O OG1 . THR A 1 415 ? 10.142 43.158 36.251 1.00 57.16 ? 458 THR A OG1 1 ATOM 2937 C CG2 . THR A 1 415 ? 10.209 44.596 38.191 1.00 44.82 ? 458 THR A CG2 1 ATOM 2938 N N . HIS A 1 416 ? 8.255 40.578 36.808 1.00 42.24 ? 459 HIS A N 1 ATOM 2939 C CA . HIS A 1 416 ? 7.397 39.783 35.940 1.00 41.53 ? 459 HIS A CA 1 ATOM 2940 C C . HIS A 1 416 ? 6.930 40.582 34.724 1.00 53.71 ? 459 HIS A C 1 ATOM 2941 O O . HIS A 1 416 ? 6.253 40.024 33.853 1.00 55.53 ? 459 HIS A O 1 ATOM 2942 C CB . HIS A 1 416 ? 6.188 39.201 36.693 1.00 27.30 ? 459 HIS A CB 1 ATOM 2943 C CG . HIS A 1 416 ? 6.547 38.185 37.742 1.00 28.00 ? 459 HIS A CG 1 ATOM 2944 N ND1 . HIS A 1 416 ? 5.629 37.297 38.260 1.00 31.15 ? 459 HIS A ND1 1 ATOM 2945 C CD2 . HIS A 1 416 ? 7.719 37.917 38.372 1.00 42.01 ? 459 HIS A CD2 1 ATOM 2946 C CE1 . HIS A 1 416 ? 6.217 36.528 39.161 1.00 46.88 ? 459 HIS A CE1 1 ATOM 2947 N NE2 . HIS A 1 416 ? 7.487 36.883 39.253 1.00 46.03 ? 459 HIS A NE2 1 ATOM 2948 N N . VAL A 1 417 ? 7.283 41.867 34.626 1.00 36.87 ? 460 VAL A N 1 ATOM 2949 C CA . VAL A 1 417 ? 6.902 42.722 33.511 1.00 35.10 ? 460 VAL A CA 1 ATOM 2950 C C . VAL A 1 417 ? 8.163 43.247 32.837 1.00 41.75 ? 460 VAL A C 1 ATOM 2951 O O . VAL A 1 417 ? 9.269 43.176 33.378 1.00 49.40 ? 460 VAL A O 1 ATOM 2952 C CB . VAL A 1 417 ? 5.997 43.892 33.943 1.00 35.52 ? 460 VAL A CB 1 ATOM 2953 C CG1 . VAL A 1 417 ? 4.649 43.371 34.411 1.00 39.62 ? 460 VAL A CG1 1 ATOM 2954 C CG2 . VAL A 1 417 ? 6.673 44.713 35.025 1.00 39.14 ? 460 VAL A CG2 1 ATOM 2955 N N . ASP A 1 418 ? 7.981 43.763 31.624 1.00 44.56 ? 461 ASP A N 1 ATOM 2956 C CA . ASP A 1 418 ? 9.086 44.176 30.765 1.00 45.42 ? 461 ASP A CA 1 ATOM 2957 C C . ASP A 1 418 ? 9.341 45.668 30.948 1.00 47.01 ? 461 ASP A C 1 ATOM 2958 O O . ASP A 1 418 ? 8.527 46.498 30.533 1.00 58.46 ? 461 ASP A O 1 ATOM 2959 C CB . ASP A 1 418 ? 8.765 43.850 29.308 1.00 53.28 ? 461 ASP A CB 1 ATOM 2960 C CG . ASP A 1 418 ? 9.906 44.173 28.365 1.00 59.00 ? 461 ASP A CG 1 ATOM 2961 O OD1 . ASP A 1 418 ? 10.849 44.885 28.777 1.00 48.58 ? 461 ASP A OD1 1 ATOM 2962 O OD2 . ASP A 1 418 ? 9.864 43.697 27.209 1.00 48.60 -1 461 ASP A OD2 1 ATOM 2963 N N . GLU A 1 419 ? 10.479 46.009 31.545 1.00 39.31 ? 462 GLU A N 1 ATOM 2964 C CA . GLU A 1 419 ? 10.834 47.401 31.797 1.00 42.42 ? 462 GLU A CA 1 ATOM 2965 C C . GLU A 1 419 ? 12.346 47.477 31.984 1.00 43.37 ? 462 GLU A C 1 ATOM 2966 O O . GLU A 1 419 ? 13.061 46.484 31.810 1.00 43.21 ? 462 GLU A O 1 ATOM 2967 C CB . GLU A 1 419 ? 10.073 47.952 33.007 1.00 37.44 ? 462 GLU A CB 1 ATOM 2968 C CG . GLU A 1 419 ? 10.267 47.144 34.284 1.00 48.66 ? 462 GLU A CG 1 ATOM 2969 C CD . GLU A 1 419 ? 9.509 47.722 35.474 1.00 77.14 ? 462 GLU A CD 1 ATOM 2970 O OE1 . GLU A 1 419 ? 9.111 48.910 35.421 1.00 61.07 ? 462 GLU A OE1 1 ATOM 2971 O OE2 . GLU A 1 419 ? 9.319 46.983 36.467 1.00 69.09 -1 462 GLU A OE2 1 ATOM 2972 N N . PHE A 1 420 ? 12.834 48.659 32.352 1.00 28.20 ? 463 PHE A N 1 ATOM 2973 C CA . PHE A 1 420 ? 14.260 48.881 32.543 1.00 33.68 ? 463 PHE A CA 1 ATOM 2974 C C . PHE A 1 420 ? 14.445 49.969 33.591 1.00 38.18 ? 463 PHE A C 1 ATOM 2975 O O . PHE A 1 420 ? 13.477 50.562 34.074 1.00 40.10 ? 463 PHE A O 1 ATOM 2976 C CB . PHE A 1 420 ? 14.926 49.268 31.224 1.00 28.30 ? 463 PHE A CB 1 ATOM 2977 C CG . PHE A 1 420 ? 14.291 50.457 30.564 1.00 47.67 ? 463 PHE A CG 1 ATOM 2978 C CD1 . PHE A 1 420 ? 13.196 50.301 29.729 1.00 42.57 ? 463 PHE A CD1 1 ATOM 2979 C CD2 . PHE A 1 420 ? 14.774 51.735 30.794 1.00 51.14 ? 463 PHE A CD2 1 ATOM 2980 C CE1 . PHE A 1 420 ? 12.603 51.397 29.131 1.00 33.72 ? 463 PHE A CE1 1 ATOM 2981 C CE2 . PHE A 1 420 ? 14.185 52.831 30.198 1.00 33.01 ? 463 PHE A CE2 1 ATOM 2982 C CZ . PHE A 1 420 ? 13.098 52.662 29.366 1.00 31.59 ? 463 PHE A CZ 1 ATOM 2983 N N . GLU A 1 421 ? 15.705 50.244 33.928 1.00 46.51 ? 464 GLU A N 1 ATOM 2984 C CA . GLU A 1 421 ? 16.044 51.291 34.886 1.00 50.26 ? 464 GLU A CA 1 ATOM 2985 C C . GLU A 1 421 ? 17.339 51.964 34.467 1.00 50.80 ? 464 GLU A C 1 ATOM 2986 O O . GLU A 1 421 ? 18.312 51.282 34.131 1.00 57.67 ? 464 GLU A O 1 ATOM 2987 C CB . GLU A 1 421 ? 16.193 50.726 36.302 1.00 40.69 ? 464 GLU A CB 1 ATOM 2988 C CG . GLU A 1 421 ? 14.887 50.361 36.971 1.00 44.94 ? 464 GLU A CG 1 ATOM 2989 C CD . GLU A 1 421 ? 15.099 49.876 38.384 1.00 59.20 ? 464 GLU A CD 1 ATOM 2990 O OE1 . GLU A 1 421 ? 16.266 49.601 38.737 1.00 49.47 ? 464 GLU A OE1 1 ATOM 2991 O OE2 . GLU A 1 421 ? 14.109 49.780 39.141 1.00 58.67 -1 464 GLU A OE2 1 ATOM 2992 N N . VAL A 1 422 ? 17.358 53.294 34.519 1.00 40.12 ? 465 VAL A N 1 ATOM 2993 C CA . VAL A 1 422 ? 18.493 54.087 34.066 1.00 38.87 ? 465 VAL A CA 1 ATOM 2994 C C . VAL A 1 422 ? 19.219 54.645 35.282 1.00 49.13 ? 465 VAL A C 1 ATOM 2995 O O . VAL A 1 422 ? 18.591 55.198 36.193 1.00 66.36 ? 465 VAL A O 1 ATOM 2996 C CB . VAL A 1 422 ? 18.050 55.216 33.121 1.00 46.06 ? 465 VAL A CB 1 ATOM 2997 C CG1 . VAL A 1 422 ? 19.264 55.881 32.490 1.00 40.94 ? 465 VAL A CG1 1 ATOM 2998 C CG2 . VAL A 1 422 ? 17.113 54.678 32.055 1.00 44.40 ? 465 VAL A CG2 1 ATOM 2999 N N . PHE A 1 423 ? 20.541 54.514 35.283 1.00 48.46 ? 466 PHE A N 1 ATOM 3000 C CA . PHE A 1 423 ? 21.395 55.032 36.341 1.00 45.04 ? 466 PHE A CA 1 ATOM 3001 C C . PHE A 1 423 ? 22.047 56.320 35.867 1.00 46.92 ? 466 PHE A C 1 ATOM 3002 O O . PHE A 1 423 ? 22.430 56.434 34.701 1.00 52.62 ? 466 PHE A O 1 ATOM 3003 C CB . PHE A 1 423 ? 22.482 54.019 36.711 1.00 56.33 ? 466 PHE A CB 1 ATOM 3004 C CG . PHE A 1 423 ? 21.955 52.744 37.304 1.00 55.77 ? 466 PHE A CG 1 ATOM 3005 C CD1 . PHE A 1 423 ? 21.249 51.843 36.526 1.00 59.49 ? 466 PHE A CD1 1 ATOM 3006 C CD2 . PHE A 1 423 ? 22.185 52.437 38.633 1.00 43.50 ? 466 PHE A CD2 1 ATOM 3007 C CE1 . PHE A 1 423 ? 20.768 50.667 37.069 1.00 63.31 ? 466 PHE A CE1 1 ATOM 3008 C CE2 . PHE A 1 423 ? 21.710 51.266 39.179 1.00 38.30 ? 466 PHE A CE2 1 ATOM 3009 C CZ . PHE A 1 423 ? 21.000 50.380 38.398 1.00 53.35 ? 466 PHE A CZ 1 ATOM 3010 N N . TYR A 1 424 ? 22.164 57.293 36.764 1.00 62.16 ? 467 TYR A N 1 ATOM 3011 C CA . TYR A 1 424 ? 22.792 58.560 36.426 1.00 49.28 ? 467 TYR A CA 1 ATOM 3012 C C . TYR A 1 424 ? 24.026 58.780 37.290 1.00 44.83 ? 467 TYR A C 1 ATOM 3013 O O . TYR A 1 424 ? 24.309 58.020 38.220 1.00 62.39 ? 467 TYR A O 1 ATOM 3014 C CB . TYR A 1 424 ? 21.806 59.718 36.597 1.00 42.80 ? 467 TYR A CB 1 ATOM 3015 C CG . TYR A 1 424 ? 20.614 59.629 35.678 1.00 46.01 ? 467 TYR A CG 1 ATOM 3016 C CD1 . TYR A 1 424 ? 19.506 58.866 36.021 1.00 51.35 ? 467 TYR A CD1 1 ATOM 3017 C CD2 . TYR A 1 424 ? 20.599 60.297 34.462 1.00 52.81 ? 467 TYR A CD2 1 ATOM 3018 C CE1 . TYR A 1 424 ? 18.413 58.781 35.181 1.00 61.13 ? 467 TYR A CE1 1 ATOM 3019 C CE2 . TYR A 1 424 ? 19.512 60.217 33.614 1.00 55.44 ? 467 TYR A CE2 1 ATOM 3020 C CZ . TYR A 1 424 ? 18.422 59.458 33.978 1.00 55.62 ? 467 TYR A CZ 1 ATOM 3021 O OH . TYR A 1 424 ? 17.338 59.375 33.137 1.00 54.61 ? 467 TYR A OH 1 ATOM 3022 N N . ASP A 1 425 ? 24.745 59.858 36.991 1.00 43.30 ? 468 ASP A N 1 ATOM 3023 C CA . ASP A 1 425 ? 25.908 60.217 37.789 1.00 59.23 ? 468 ASP A CA 1 ATOM 3024 C C . ASP A 1 425 ? 25.450 60.712 39.153 1.00 63.09 ? 468 ASP A C 1 ATOM 3025 O O . ASP A 1 425 ? 24.414 61.373 39.278 1.00 52.27 ? 468 ASP A O 1 ATOM 3026 C CB . ASP A 1 425 ? 26.742 61.285 37.083 1.00 56.53 ? 468 ASP A CB 1 ATOM 3027 C CG . ASP A 1 425 ? 25.982 62.579 36.883 1.00 66.17 ? 468 ASP A CG 1 ATOM 3028 O OD1 . ASP A 1 425 ? 25.118 62.638 35.983 1.00 70.74 ? 468 ASP A OD1 1 ATOM 3029 O OD2 . ASP A 1 425 ? 26.254 63.544 37.627 1.00 64.95 -1 468 ASP A OD2 1 ATOM 3030 N N . GLU A 1 426 ? 26.228 60.385 40.184 1.00 69.22 ? 469 GLU A N 1 ATOM 3031 C CA . GLU A 1 426 ? 25.773 60.621 41.548 1.00 71.51 ? 469 GLU A CA 1 ATOM 3032 C C . GLU A 1 426 ? 25.745 62.103 41.908 1.00 57.22 ? 469 GLU A C 1 ATOM 3033 O O . GLU A 1 426 ? 25.070 62.476 42.873 1.00 63.30 ? 469 GLU A O 1 ATOM 3034 C CB . GLU A 1 426 ? 26.652 59.834 42.525 1.00 62.32 ? 469 GLU A CB 1 ATOM 3035 C CG . GLU A 1 426 ? 25.913 59.344 43.763 1.00 74.71 ? 469 GLU A CG 1 ATOM 3036 C CD . GLU A 1 426 ? 26.758 58.417 44.628 1.00 89.90 ? 469 GLU A CD 1 ATOM 3037 O OE1 . GLU A 1 426 ? 27.933 58.171 44.273 1.00 76.59 ? 469 GLU A OE1 1 ATOM 3038 O OE2 . GLU A 1 426 ? 26.237 57.922 45.653 1.00 79.61 -1 469 GLU A OE2 1 ATOM 3039 N N . GLU A 1 427 ? 26.435 62.956 41.147 1.00 67.34 ? 470 GLU A N 1 ATOM 3040 C CA . GLU A 1 427 ? 26.517 64.376 41.495 1.00 60.65 ? 470 GLU A CA 1 ATOM 3041 C C . GLU A 1 427 ? 25.309 65.157 40.980 1.00 60.55 ? 470 GLU A C 1 ATOM 3042 O O . GLU A 1 427 ? 24.452 65.583 41.760 1.00 74.46 ? 470 GLU A O 1 ATOM 3043 C CB . GLU A 1 427 ? 27.820 64.978 40.954 1.00 58.05 ? 470 GLU A CB 1 ATOM 3044 C CG . GLU A 1 427 ? 29.094 64.311 41.460 1.00 80.31 ? 470 GLU A CG 1 ATOM 3045 C CD . GLU A 1 427 ? 29.489 63.086 40.651 1.00 88.93 ? 470 GLU A CD 1 ATOM 3046 O OE1 . GLU A 1 427 ? 28.697 62.653 39.787 1.00 80.88 ? 470 GLU A OE1 1 ATOM 3047 O OE2 . GLU A 1 427 ? 30.600 62.560 40.877 1.00 88.86 -1 470 GLU A OE2 1 ATOM 3048 N N . THR A 1 428 ? 25.237 65.370 39.666 1.00 62.85 ? 471 THR A N 1 ATOM 3049 C CA . THR A 1 428 ? 24.159 66.154 39.074 1.00 63.62 ? 471 THR A CA 1 ATOM 3050 C C . THR A 1 428 ? 22.958 65.320 38.642 1.00 62.52 ? 471 THR A C 1 ATOM 3051 O O . THR A 1 428 ? 21.898 65.893 38.366 1.00 69.06 ? 471 THR A O 1 ATOM 3052 C CB . THR A 1 428 ? 24.680 66.939 37.865 1.00 60.51 ? 471 THR A CB 1 ATOM 3053 O OG1 . THR A 1 428 ? 24.904 66.042 36.772 1.00 49.43 ? 471 THR A OG1 1 ATOM 3054 C CG2 . THR A 1 428 ? 25.987 67.636 38.207 1.00 73.92 ? 471 THR A CG2 1 ATOM 3055 N N . LEU A 1 429 ? 23.092 63.995 38.565 1.00 56.14 ? 472 LEU A N 1 ATOM 3056 C CA . LEU A 1 429 ? 22.002 63.126 38.112 1.00 56.04 ? 472 LEU A CA 1 ATOM 3057 C C . LEU A 1 429 ? 21.474 63.541 36.740 1.00 60.87 ? 472 LEU A C 1 ATOM 3058 O O . LEU A 1 429 ? 20.305 63.314 36.419 1.00 57.57 ? 472 LEU A O 1 ATOM 3059 C CB . LEU A 1 429 ? 20.854 63.085 39.125 1.00 42.43 ? 472 LEU A CB 1 ATOM 3060 C CG . LEU A 1 429 ? 21.064 62.347 40.447 1.00 45.33 ? 472 LEU A CG 1 ATOM 3061 C CD1 . LEU A 1 429 ? 22.158 62.991 41.282 1.00 65.68 ? 472 LEU A CD1 1 ATOM 3062 C CD2 . LEU A 1 429 ? 19.752 62.288 41.219 1.00 34.03 ? 472 LEU A CD2 1 ATOM 3063 N N . SER A 1 430 ? 22.309 64.196 35.936 1.00 58.15 ? 473 SER A N 1 ATOM 3064 C CA . SER A 1 430 ? 21.912 64.587 34.590 1.00 51.29 ? 473 SER A CA 1 ATOM 3065 C C . SER A 1 430 ? 22.382 63.639 33.491 1.00 48.61 ? 473 SER A C 1 ATOM 3066 O O . SER A 1 430 ? 21.868 63.725 32.372 1.00 63.12 ? 473 SER A O 1 ATOM 3067 C CB . SER A 1 430 ? 22.437 65.994 34.288 1.00 63.70 ? 473 SER A CB 1 ATOM 3068 O OG . SER A 1 430 ? 23.854 66.017 34.341 1.00 70.23 ? 473 SER A OG 1 ATOM 3069 N N . ARG A 1 431 ? 23.316 62.731 33.774 1.00 55.58 ? 474 ARG A N 1 ATOM 3070 C CA . ARG A 1 431 ? 23.995 61.956 32.733 1.00 51.07 ? 474 ARG A CA 1 ATOM 3071 C C . ARG A 1 431 ? 23.741 60.462 32.892 1.00 50.07 ? 474 ARG A C 1 ATOM 3072 O O . ARG A 1 431 ? 24.157 59.879 33.908 1.00 56.20 ? 474 ARG A O 1 ATOM 3073 C CB . ARG A 1 431 ? 25.502 62.240 32.763 1.00 42.41 ? 474 ARG A CB 1 ATOM 3074 C CG . ARG A 1 431 ? 26.310 61.429 31.762 1.00 45.80 ? 474 ARG A CG 1 ATOM 3075 C CD . ARG A 1 431 ? 27.786 61.826 31.751 1.00 33.74 ? 474 ARG A CD 1 ATOM 3076 N NE . ARG A 1 431 ? 28.460 61.545 33.017 1.00 58.78 ? 474 ARG A NE 1 ATOM 3077 C CZ . ARG A 1 431 ? 29.094 60.409 33.295 1.00 63.06 ? 474 ARG A CZ 1 ATOM 3078 N NH1 . ARG A 1 431 ? 29.143 59.433 32.398 1.00 63.42 1 474 ARG A NH1 1 ATOM 3079 N NH2 . ARG A 1 431 ? 29.681 60.248 34.474 1.00 66.58 ? 474 ARG A NH2 1 ATOM 3080 N N . PRO A 1 432 ? 23.074 59.793 31.949 1.00 51.45 ? 475 PRO A N 1 ATOM 3081 C CA . PRO A 1 432 ? 22.932 58.329 32.050 1.00 57.62 ? 475 PRO A CA 1 ATOM 3082 C C . PRO A 1 432 ? 24.286 57.642 31.920 1.00 48.46 ? 475 PRO A C 1 ATOM 3083 O O . PRO A 1 432 ? 24.979 57.802 30.914 1.00 46.62 ? 475 PRO A O 1 ATOM 3084 C CB . PRO A 1 432 ? 22.007 57.978 30.876 1.00 52.77 ? 475 PRO A CB 1 ATOM 3085 C CG . PRO A 1 432 ? 21.442 59.292 30.393 1.00 45.67 ? 475 PRO A CG 1 ATOM 3086 C CD . PRO A 1 432 ? 22.457 60.328 30.727 1.00 46.50 ? 475 PRO A CD 1 ATOM 3087 N N . LEU A 1 433 ? 24.659 56.873 32.947 1.00 46.13 ? 476 LEU A N 1 ATOM 3088 C CA . LEU A 1 433 ? 25.883 56.082 32.933 1.00 53.42 ? 476 LEU A CA 1 ATOM 3089 C C . LEU A 1 433 ? 25.673 54.582 32.764 1.00 55.87 ? 476 LEU A C 1 ATOM 3090 O O . LEU A 1 433 ? 26.663 53.851 32.637 1.00 46.85 ? 476 LEU A O 1 ATOM 3091 C CB . LEU A 1 433 ? 26.679 56.339 34.220 1.00 59.63 ? 476 LEU A CB 1 ATOM 3092 C CG . LEU A 1 433 ? 25.913 56.135 35.527 1.00 47.10 ? 476 LEU A CG 1 ATOM 3093 C CD1 . LEU A 1 433 ? 25.815 54.661 35.901 1.00 61.23 ? 476 LEU A CD1 1 ATOM 3094 C CD2 . LEU A 1 433 ? 26.555 56.947 36.643 1.00 59.96 ? 476 LEU A CD2 1 ATOM 3095 N N . ALA A 1 434 ? 24.434 54.099 32.764 1.00 47.27 ? 477 ALA A N 1 ATOM 3096 C CA . ALA A 1 434 ? 24.202 52.664 32.671 1.00 39.11 ? 477 ALA A CA 1 ATOM 3097 C C . ALA A 1 434 ? 22.709 52.402 32.787 1.00 45.51 ? 477 ALA A C 1 ATOM 3098 O O . ALA A 1 434 ? 21.948 53.247 33.266 1.00 40.41 ? 477 ALA A O 1 ATOM 3099 C CB . ALA A 1 434 ? 24.962 51.891 33.749 1.00 38.67 ? 477 ALA A CB 1 ATOM 3100 N N . VAL A 1 435 ? 22.304 51.212 32.354 1.00 37.50 ? 478 VAL A N 1 ATOM 3101 C CA . VAL A 1 435 ? 20.912 50.790 32.416 1.00 33.93 ? 478 VAL A CA 1 ATOM 3102 C C . VAL A 1 435 ? 20.861 49.323 32.809 1.00 40.92 ? 478 VAL A C 1 ATOM 3103 O O . VAL A 1 435 ? 21.726 48.531 32.419 1.00 54.10 ? 478 VAL A O 1 ATOM 3104 C CB . VAL A 1 435 ? 20.178 51.027 31.080 1.00 31.35 ? 478 VAL A CB 1 ATOM 3105 C CG1 . VAL A 1 435 ? 20.925 50.364 29.941 1.00 34.05 ? 478 VAL A CG1 1 ATOM 3106 C CG2 . VAL A 1 435 ? 18.754 50.498 31.168 1.00 39.51 ? 478 VAL A CG2 1 ATOM 3107 N N . ALA A 1 436 ? 19.863 48.971 33.610 1.00 41.89 ? 479 ALA A N 1 ATOM 3108 C CA . ALA A 1 436 ? 19.581 47.591 33.966 1.00 46.44 ? 479 ALA A CA 1 ATOM 3109 C C . ALA A 1 436 ? 18.322 47.141 33.243 1.00 46.54 ? 479 ALA A C 1 ATOM 3110 O O . ALA A 1 436 ? 17.336 47.884 33.178 1.00 46.04 ? 479 ALA A O 1 ATOM 3111 C CB . ALA A 1 436 ? 19.402 47.433 35.478 1.00 59.76 ? 479 ALA A CB 1 ATOM 3112 N N . PHE A 1 437 ? 18.360 45.935 32.685 1.00 42.31 ? 480 PHE A N 1 ATOM 3113 C CA . PHE A 1 437 ? 17.229 45.391 31.944 1.00 50.22 ? 480 PHE A CA 1 ATOM 3114 C C . PHE A 1 437 ? 16.435 44.464 32.858 1.00 42.04 ? 480 PHE A C 1 ATOM 3115 O O . PHE A 1 437 ? 16.978 43.487 33.387 1.00 41.71 ? 480 PHE A O 1 ATOM 3116 C CB . PHE A 1 437 ? 17.696 44.666 30.682 1.00 32.85 ? 480 PHE A CB 1 ATOM 3117 C CG . PHE A 1 437 ? 18.445 45.549 29.726 1.00 34.95 ? 480 PHE A CG 1 ATOM 3118 C CD1 . PHE A 1 437 ? 17.768 46.423 28.893 1.00 37.22 ? 480 PHE A CD1 1 ATOM 3119 C CD2 . PHE A 1 437 ? 19.829 45.516 29.669 1.00 43.59 ? 480 PHE A CD2 1 ATOM 3120 C CE1 . PHE A 1 437 ? 18.457 47.242 28.020 1.00 37.04 ? 480 PHE A CE1 1 ATOM 3121 C CE2 . PHE A 1 437 ? 20.523 46.333 28.794 1.00 34.60 ? 480 PHE A CE2 1 ATOM 3122 C CZ . PHE A 1 437 ? 19.837 47.195 27.971 1.00 25.59 ? 480 PHE A CZ 1 ATOM 3123 N N . LEU A 1 438 ? 15.156 44.779 33.042 1.00 31.53 ? 481 LEU A N 1 ATOM 3124 C CA . LEU A 1 438 ? 14.252 43.972 33.849 1.00 32.55 ? 481 LEU A CA 1 ATOM 3125 C C . LEU A 1 438 ? 13.375 43.155 32.910 1.00 43.76 ? 481 LEU A C 1 ATOM 3126 O O . LEU A 1 438 ? 12.478 43.698 32.254 1.00 46.62 ? 481 LEU A O 1 ATOM 3127 C CB . LEU A 1 438 ? 13.410 44.855 34.766 1.00 44.52 ? 481 LEU A CB 1 ATOM 3128 C CG . LEU A 1 438 ? 14.114 45.487 35.973 1.00 38.04 ? 481 LEU A CG 1 ATOM 3129 C CD1 . LEU A 1 438 ? 15.294 46.351 35.551 1.00 38.79 ? 481 LEU A CD1 1 ATOM 3130 C CD2 . LEU A 1 438 ? 13.124 46.306 36.785 1.00 62.21 ? 481 LEU A CD2 1 ATOM 3131 N N . ALA A 1 439 ? 13.624 41.849 32.867 1.00 55.14 ? 482 ALA A N 1 ATOM 3132 C CA . ALA A 1 439 ? 12.994 40.952 31.916 1.00 42.43 ? 482 ALA A CA 1 ATOM 3133 C C . ALA A 1 439 ? 11.636 40.477 32.425 1.00 38.99 ? 482 ALA A C 1 ATOM 3134 O O . ALA A 1 439 ? 11.440 40.313 33.632 1.00 61.58 ? 482 ALA A O 1 ATOM 3135 C CB . ALA A 1 439 ? 13.891 39.751 31.654 1.00 41.86 ? 482 ALA A CB 1 ATOM 3136 N N . PRO A 1 440 ? 10.679 40.268 31.525 1.00 45.19 ? 483 PRO A N 1 ATOM 3137 C CA . PRO A 1 440 ? 9.373 39.748 31.943 1.00 54.77 ? 483 PRO A CA 1 ATOM 3138 C C . PRO A 1 440 ? 9.461 38.289 32.368 1.00 54.23 ? 483 PRO A C 1 ATOM 3139 O O . PRO A 1 440 ? 10.412 37.569 32.053 1.00 49.77 ? 483 PRO A O 1 ATOM 3140 C CB . PRO A 1 440 ? 8.503 39.914 30.692 1.00 45.93 ? 483 PRO A CB 1 ATOM 3141 C CG . PRO A 1 440 ? 9.470 39.920 29.561 1.00 47.90 ? 483 PRO A CG 1 ATOM 3142 C CD . PRO A 1 440 ? 10.728 40.557 30.081 1.00 41.75 ? 483 PRO A CD 1 ATOM 3143 N N . SER A 1 441 ? 8.438 37.856 33.100 1.00 43.68 ? 484 SER A N 1 ATOM 3144 C CA . SER A 1 441 ? 8.454 36.536 33.712 1.00 45.50 ? 484 SER A CA 1 ATOM 3145 C C . SER A 1 441 ? 8.057 35.460 32.712 1.00 41.78 ? 484 SER A C 1 ATOM 3146 O O . SER A 1 441 ? 7.136 35.642 31.911 1.00 39.98 ? 484 SER A O 1 ATOM 3147 C CB . SER A 1 441 ? 7.502 36.487 34.907 1.00 41.20 ? 484 SER A CB 1 ATOM 3148 O OG . SER A 1 441 ? 6.155 36.632 34.488 1.00 42.61 ? 484 SER A OG 1 ATOM 3149 N N . ALA A 1 442 ? 8.759 34.327 32.771 1.00 39.76 ? 485 ALA A N 1 ATOM 3150 C CA . ALA A 1 442 ? 8.260 33.127 32.113 1.00 41.51 ? 485 ALA A CA 1 ATOM 3151 C C . ALA A 1 442 ? 6.897 32.730 32.662 1.00 34.43 ? 485 ALA A C 1 ATOM 3152 O O . ALA A 1 442 ? 6.062 32.193 31.926 1.00 48.30 ? 485 ALA A O 1 ATOM 3153 C CB . ALA A 1 442 ? 9.255 31.979 32.276 1.00 40.04 ? 485 ALA A CB 1 ATOM 3154 N N . THR A 1 443 ? 6.653 32.984 33.943 1.00 44.50 ? 486 THR A N 1 ATOM 3155 C CA . THR A 1 443 ? 5.374 32.634 34.535 1.00 49.39 ? 486 THR A CA 1 ATOM 3156 C C . THR A 1 443 ? 4.277 33.573 34.048 1.00 48.48 ? 486 THR A C 1 ATOM 3157 O O . THR A 1 443 ? 4.527 34.685 33.575 1.00 50.76 ? 486 THR A O 1 ATOM 3158 C CB . THR A 1 443 ? 5.433 32.690 36.059 1.00 49.24 ? 486 THR A CB 1 ATOM 3159 O OG1 . THR A 1 443 ? 4.133 32.403 36.586 1.00 47.41 ? 486 THR A OG1 1 ATOM 3160 C CG2 . THR A 1 443 ? 5.857 34.076 36.521 1.00 38.79 ? 486 THR A CG2 1 ATOM 3161 N N . THR A 1 444 ? 3.044 33.110 34.193 1.00 48.04 ? 487 THR A N 1 ATOM 3162 C CA . THR A 1 444 ? 1.865 33.862 33.801 1.00 44.88 ? 487 THR A CA 1 ATOM 3163 C C . THR A 1 444 ? 1.293 34.688 34.943 1.00 68.33 ? 487 THR A C 1 ATOM 3164 O O . THR A 1 444 ? 0.270 35.352 34.752 1.00 67.12 ? 487 THR A O 1 ATOM 3165 C CB . THR A 1 444 ? 0.792 32.905 33.270 1.00 43.24 ? 487 THR A CB 1 ATOM 3166 O OG1 . THR A 1 444 ? -0.460 33.590 33.162 1.00 63.05 ? 487 THR A OG1 1 ATOM 3167 C CG2 . THR A 1 444 ? 0.630 31.722 34.207 1.00 48.34 ? 487 THR A CG2 1 ATOM 3168 N N . TYR A 1 445 ? 1.952 34.698 36.101 1.00 77.44 ? 488 TYR A N 1 ATOM 3169 C CA . TYR A 1 445 ? 1.321 35.132 37.343 1.00 59.75 ? 488 TYR A CA 1 ATOM 3170 C C . TYR A 1 445 ? 0.697 36.513 37.213 1.00 55.29 ? 488 TYR A C 1 ATOM 3171 O O . TYR A 1 445 ? 1.378 37.496 36.907 1.00 41.24 ? 488 TYR A O 1 ATOM 3172 C CB . TYR A 1 445 ? 2.345 35.123 38.481 1.00 65.11 ? 488 TYR A CB 1 ATOM 3173 C CG . TYR A 1 445 ? 1.745 35.437 39.838 1.00 69.65 ? 488 TYR A CG 1 ATOM 3174 C CD1 . TYR A 1 445 ? 0.780 34.615 40.406 1.00 59.47 ? 488 TYR A CD1 1 ATOM 3175 C CD2 . TYR A 1 445 ? 2.144 36.562 40.549 1.00 69.74 ? 488 TYR A CD2 1 ATOM 3176 C CE1 . TYR A 1 445 ? 0.230 34.908 41.641 1.00 64.38 ? 488 TYR A CE1 1 ATOM 3177 C CE2 . TYR A 1 445 ? 1.602 36.862 41.783 1.00 50.76 ? 488 TYR A CE2 1 ATOM 3178 C CZ . TYR A 1 445 ? 0.646 36.033 42.326 1.00 62.84 ? 488 TYR A CZ 1 ATOM 3179 O OH . TYR A 1 445 ? 0.104 36.329 43.559 1.00 63.51 ? 488 TYR A OH 1 ATOM 3180 N N . ILE A 1 446 ? -0.599 36.574 37.521 1.00 70.24 ? 489 ILE A N 1 ATOM 3181 C CA . ILE A 1 446 ? -1.441 37.758 37.387 1.00 48.91 ? 489 ILE A CA 1 ATOM 3182 C C . ILE A 1 446 ? -1.558 38.199 35.931 1.00 56.46 ? 489 ILE A C 1 ATOM 3183 O O . ILE A 1 446 ? -1.114 39.291 35.559 1.00 49.23 ? 489 ILE A O 1 ATOM 3184 C CB . ILE A 1 446 ? -0.915 38.898 38.275 1.00 56.10 ? 489 ILE A CB 1 ATOM 3185 C CG1 . ILE A 1 446 ? -0.763 38.400 39.714 1.00 49.57 ? 489 ILE A CG1 1 ATOM 3186 C CG2 . ILE A 1 446 ? -1.861 40.083 38.231 1.00 93.16 ? 489 ILE A CG2 1 ATOM 3187 C CD1 . ILE A 1 446 ? -2.033 37.823 40.298 1.00 39.14 ? 489 ILE A CD1 1 ATOM 3188 N N . GLY A 1 447 ? -2.176 37.354 35.111 1.00 49.63 ? 490 GLY A N 1 ATOM 3189 C CA . GLY A 1 447 ? -2.715 37.742 33.815 1.00 45.07 ? 490 GLY A CA 1 ATOM 3190 C C . GLY A 1 447 ? -1.747 38.104 32.708 1.00 50.50 ? 490 GLY A C 1 ATOM 3191 O O . GLY A 1 447 ? -2.034 39.014 31.920 1.00 46.46 ? 490 GLY A O 1 ATOM 3192 N N . LEU A 1 448 ? -0.622 37.404 32.606 1.00 51.48 ? 491 LEU A N 1 ATOM 3193 C CA . LEU A 1 448 ? 0.373 37.698 31.586 1.00 55.30 ? 491 LEU A CA 1 ATOM 3194 C C . LEU A 1 448 ? 0.567 36.502 30.666 1.00 50.25 ? 491 LEU A C 1 ATOM 3195 O O . LEU A 1 448 ? 0.424 35.348 31.081 1.00 64.67 ? 491 LEU A O 1 ATOM 3196 C CB . LEU A 1 448 ? 1.725 38.069 32.207 1.00 60.65 ? 491 LEU A CB 1 ATOM 3197 C CG . LEU A 1 448 ? 1.779 39.289 33.120 1.00 60.99 ? 491 LEU A CG 1 ATOM 3198 C CD1 . LEU A 1 448 ? 3.152 39.404 33.753 1.00 49.78 ? 491 LEU A CD1 1 ATOM 3199 C CD2 . LEU A 1 448 ? 1.451 40.540 32.319 1.00 36.99 ? 491 LEU A CD2 1 ATOM 3200 N N . ASN A 1 449 ? 0.883 36.786 29.408 1.00 53.97 ? 492 ASN A N 1 ATOM 3201 C CA . ASN A 1 449 ? 1.408 35.744 28.546 1.00 44.98 ? 492 ASN A CA 1 ATOM 3202 C C . ASN A 1 449 ? 2.793 35.337 29.042 1.00 42.10 ? 492 ASN A C 1 ATOM 3203 O O . ASN A 1 449 ? 3.585 36.195 29.446 1.00 43.41 ? 492 ASN A O 1 ATOM 3204 C CB . ASN A 1 449 ? 1.498 36.221 27.094 1.00 46.79 ? 492 ASN A CB 1 ATOM 3205 C CG . ASN A 1 449 ? 0.143 36.304 26.417 1.00 47.92 ? 492 ASN A CG 1 ATOM 3206 O OD1 . ASN A 1 449 ? -0.680 35.399 26.541 1.00 45.57 ? 492 ASN A OD1 1 ATOM 3207 N ND2 . ASN A 1 449 ? -0.091 37.389 25.686 1.00 41.43 ? 492 ASN A ND2 1 ATOM 3208 N N . PRO A 1 450 ? 3.115 34.048 29.034 1.00 39.50 ? 493 PRO A N 1 ATOM 3209 C CA . PRO A 1 450 ? 4.490 33.637 29.337 1.00 35.97 ? 493 PRO A CA 1 ATOM 3210 C C . PRO A 1 450 ? 5.470 34.217 28.326 1.00 37.18 ? 493 PRO A C 1 ATOM 3211 O O . PRO A 1 450 ? 5.127 34.474 27.169 1.00 37.19 ? 493 PRO A O 1 ATOM 3212 C CB . PRO A 1 450 ? 4.430 32.108 29.254 1.00 38.37 ? 493 PRO A CB 1 ATOM 3213 C CG . PRO A 1 450 ? 2.985 31.775 29.476 1.00 44.34 ? 493 PRO A CG 1 ATOM 3214 C CD . PRO A 1 450 ? 2.204 32.901 28.882 1.00 34.57 ? 493 PRO A CD 1 ATOM 3215 N N . GLY A 1 451 ? 6.708 34.413 28.771 1.00 33.39 ? 494 GLY A N 1 ATOM 3216 C CA . GLY A 1 451 ? 7.727 34.967 27.900 1.00 31.36 ? 494 GLY A CA 1 ATOM 3217 C C . GLY A 1 451 ? 9.124 34.727 28.424 1.00 28.41 ? 494 GLY A C 1 ATOM 3218 O O . GLY A 1 451 ? 9.325 34.412 29.601 1.00 46.42 ? 494 GLY A O 1 ATOM 3219 N N . TYR A 1 452 ? 10.091 34.854 27.519 1.00 18.54 ? 495 TYR A N 1 ATOM 3220 C CA . TYR A 1 452 ? 11.508 34.843 27.858 1.00 29.79 ? 495 TYR A CA 1 ATOM 3221 C C . TYR A 1 452 ? 12.225 35.876 27.004 1.00 36.96 ? 495 TYR A C 1 ATOM 3222 O O . TYR A 1 452 ? 11.656 36.437 26.059 1.00 39.03 ? 495 TYR A O 1 ATOM 3223 C CB . TYR A 1 452 ? 12.135 33.451 27.690 1.00 23.86 ? 495 TYR A CB 1 ATOM 3224 C CG . TYR A 1 452 ? 11.883 32.767 26.358 1.00 53.77 ? 495 TYR A CG 1 ATOM 3225 C CD1 . TYR A 1 452 ? 10.749 31.986 26.166 1.00 52.22 ? 495 TYR A CD1 1 ATOM 3226 C CD2 . TYR A 1 452 ? 12.786 32.873 25.307 1.00 36.79 ? 495 TYR A CD2 1 ATOM 3227 C CE1 . TYR A 1 452 ? 10.508 31.348 24.972 1.00 43.85 ? 495 TYR A CE1 1 ATOM 3228 C CE2 . TYR A 1 452 ? 12.553 32.234 24.100 1.00 45.74 ? 495 TYR A CE2 1 ATOM 3229 C CZ . TYR A 1 452 ? 11.411 31.470 23.939 1.00 60.75 ? 495 TYR A CZ 1 ATOM 3230 O OH . TYR A 1 452 ? 11.166 30.821 22.747 1.00 51.75 ? 495 TYR A OH 1 ATOM 3231 N N . ARG A 1 453 ? 13.488 36.139 27.341 1.00 32.86 ? 496 ARG A N 1 ATOM 3232 C CA . ARG A 1 453 ? 14.226 37.176 26.636 1.00 31.27 ? 496 ARG A CA 1 ATOM 3233 C C . ARG A 1 453 ? 15.519 36.618 26.064 1.00 32.69 ? 496 ARG A C 1 ATOM 3234 O O . ARG A 1 453 ? 16.024 35.588 26.509 1.00 42.36 ? 496 ARG A O 1 ATOM 3235 C CB . ARG A 1 453 ? 14.528 38.372 27.549 1.00 40.74 ? 496 ARG A CB 1 ATOM 3236 C CG . ARG A 1 453 ? 15.513 39.362 26.958 1.00 41.56 ? 496 ARG A CG 1 ATOM 3237 C CD . ARG A 1 453 ? 15.248 40.748 27.473 1.00 39.09 ? 496 ARG A CD 1 ATOM 3238 N NE . ARG A 1 453 ? 13.910 41.192 27.110 1.00 37.58 ? 496 ARG A NE 1 ATOM 3239 C CZ . ARG A 1 453 ? 13.299 42.232 27.662 1.00 53.05 ? 496 ARG A CZ 1 ATOM 3240 N NH1 . ARG A 1 453 ? 13.907 42.933 28.612 1.00 45.97 1 496 ARG A NH1 1 ATOM 3241 N NH2 . ARG A 1 453 ? 12.078 42.565 27.269 1.00 35.24 ? 496 ARG A NH2 1 ATOM 3242 N N . VAL A 1 454 ? 16.027 37.292 25.034 1.00 34.64 ? 497 VAL A N 1 ATOM 3243 C CA . VAL A 1 454 ? 17.316 36.957 24.438 1.00 31.24 ? 497 VAL A CA 1 ATOM 3244 C C . VAL A 1 454 ? 18.070 38.247 24.169 1.00 39.36 ? 497 VAL A C 1 ATOM 3245 O O . VAL A 1 454 ? 17.523 39.176 23.570 1.00 47.66 ? 497 VAL A O 1 ATOM 3246 C CB . VAL A 1 454 ? 17.160 36.154 23.134 1.00 31.01 ? 497 VAL A CB 1 ATOM 3247 C CG1 . VAL A 1 454 ? 18.510 35.997 22.456 1.00 44.24 ? 497 VAL A CG1 1 ATOM 3248 C CG2 . VAL A 1 454 ? 16.541 34.795 23.423 1.00 41.97 ? 497 VAL A CG2 1 ATOM 3249 N N . TYR A 1 455 ? 19.324 38.305 24.597 1.00 33.63 ? 498 TYR A N 1 ATOM 3250 C CA . TYR A 1 455 ? 20.155 39.484 24.410 1.00 37.56 ? 498 TYR A CA 1 ATOM 3251 C C . TYR A 1 455 ? 21.201 39.213 23.343 1.00 36.50 ? 498 TYR A C 1 ATOM 3252 O O . TYR A 1 455 ? 21.832 38.149 23.337 1.00 48.66 ? 498 TYR A O 1 ATOM 3253 C CB . TYR A 1 455 ? 20.832 39.898 25.720 1.00 33.29 ? 498 TYR A CB 1 ATOM 3254 C CG . TYR A 1 455 ? 19.855 40.408 26.747 1.00 35.50 ? 498 TYR A CG 1 ATOM 3255 C CD1 . TYR A 1 455 ? 19.382 41.708 26.689 1.00 35.93 ? 498 TYR A CD1 1 ATOM 3256 C CD2 . TYR A 1 455 ? 19.400 39.593 27.767 1.00 35.97 ? 498 TYR A CD2 1 ATOM 3257 C CE1 . TYR A 1 455 ? 18.485 42.177 27.617 1.00 38.86 ? 498 TYR A CE1 1 ATOM 3258 C CE2 . TYR A 1 455 ? 18.503 40.057 28.701 1.00 36.22 ? 498 TYR A CE2 1 ATOM 3259 C CZ . TYR A 1 455 ? 18.051 41.351 28.623 1.00 24.65 ? 498 TYR A CZ 1 ATOM 3260 O OH . TYR A 1 455 ? 17.149 41.821 29.549 1.00 42.85 ? 498 TYR A OH 1 ATOM 3261 N N . GLN A 1 456 ? 21.368 40.172 22.442 1.00 31.17 ? 499 GLN A N 1 ATOM 3262 C CA . GLN A 1 456 ? 22.524 40.233 21.564 1.00 42.58 ? 499 GLN A CA 1 ATOM 3263 C C . GLN A 1 456 ? 23.527 41.175 22.207 1.00 34.60 ? 499 GLN A C 1 ATOM 3264 O O . GLN A 1 456 ? 23.242 42.369 22.377 1.00 40.87 ? 499 GLN A O 1 ATOM 3265 C CB . GLN A 1 456 ? 22.132 40.710 20.167 1.00 47.27 ? 499 GLN A CB 1 ATOM 3266 C CG . GLN A 1 456 ? 21.456 39.640 19.341 1.00 40.34 ? 499 GLN A CG 1 ATOM 3267 C CD . GLN A 1 456 ? 19.987 39.501 19.684 1.00 57.61 ? 499 GLN A CD 1 ATOM 3268 O OE1 . GLN A 1 456 ? 19.350 40.457 20.125 1.00 60.11 ? 499 GLN A OE1 1 ATOM 3269 N NE2 . GLN A 1 456 ? 19.444 38.301 19.499 1.00 70.71 ? 499 GLN A NE2 1 ATOM 3270 N N . ILE A 1 457 ? 24.697 40.636 22.546 1.00 39.37 ? 500 ILE A N 1 ATOM 3271 C CA . ILE A 1 457 ? 25.715 41.336 23.315 1.00 44.24 ? 500 ILE A CA 1 ATOM 3272 C C . ILE A 1 457 ? 27.019 41.317 22.538 1.00 43.60 ? 500 ILE A C 1 ATOM 3273 O O . ILE A 1 457 ? 27.304 40.374 21.798 1.00 54.03 ? 500 ILE A O 1 ATOM 3274 C CB . ILE A 1 457 ? 25.901 40.683 24.701 1.00 41.01 ? 500 ILE A CB 1 ATOM 3275 C CG1 . ILE A 1 457 ? 24.552 40.568 25.412 1.00 44.89 ? 500 ILE A CG1 1 ATOM 3276 C CG2 . ILE A 1 457 ? 26.893 41.467 25.540 1.00 47.03 ? 500 ILE A CG2 1 ATOM 3277 C CD1 . ILE A 1 457 ? 24.599 39.747 26.664 1.00 42.48 ? 500 ILE A CD1 1 ATOM 3278 N N . ASP A 1 458 ? 27.822 42.362 22.714 1.00 40.49 ? 501 ASP A N 1 ATOM 3279 C CA . ASP A 1 458 ? 29.130 42.395 22.077 1.00 39.93 ? 501 ASP A CA 1 ATOM 3280 C C . ASP A 1 458 ? 29.941 41.170 22.498 1.00 44.93 ? 501 ASP A C 1 ATOM 3281 O O . ASP A 1 458 ? 30.133 40.917 23.690 1.00 43.57 ? 501 ASP A O 1 ATOM 3282 C CB . ASP A 1 458 ? 29.849 43.691 22.447 1.00 42.60 ? 501 ASP A CB 1 ATOM 3283 C CG . ASP A 1 458 ? 30.861 44.115 21.405 1.00 49.59 ? 501 ASP A CG 1 ATOM 3284 O OD1 . ASP A 1 458 ? 30.866 43.520 20.306 1.00 53.59 ? 501 ASP A OD1 1 ATOM 3285 O OD2 . ASP A 1 458 ? 31.631 45.061 21.677 1.00 47.94 -1 501 ASP A OD2 1 ATOM 3286 N N . GLY A 1 459 ? 30.437 40.428 21.507 1.00 48.78 ? 502 GLY A N 1 ATOM 3287 C CA . GLY A 1 459 ? 30.871 39.056 21.690 1.00 52.23 ? 502 GLY A CA 1 ATOM 3288 C C . GLY A 1 459 ? 32.231 38.884 22.339 1.00 60.44 ? 502 GLY A C 1 ATOM 3289 O O . GLY A 1 459 ? 32.773 39.787 22.982 1.00 51.55 ? 502 GLY A O 1 ATOM 3290 N N . ASN A 1 460 ? 32.793 37.687 22.145 1.00 50.60 ? 503 ASN A N 1 ATOM 3291 C CA . ASN A 1 460 ? 34.006 37.254 22.835 1.00 55.30 ? 503 ASN A CA 1 ATOM 3292 C C . ASN A 1 460 ? 35.220 37.548 21.960 1.00 51.71 ? 503 ASN A C 1 ATOM 3293 O O . ASN A 1 460 ? 35.421 36.904 20.925 1.00 59.99 ? 503 ASN A O 1 ATOM 3294 C CB . ASN A 1 460 ? 33.927 35.764 23.165 1.00 58.59 ? 503 ASN A CB 1 ATOM 3295 C CG . ASN A 1 460 ? 35.284 35.165 23.515 1.00 66.00 ? 503 ASN A CG 1 ATOM 3296 O OD1 . ASN A 1 460 ? 36.149 35.839 24.082 1.00 54.53 ? 503 ASN A OD1 1 ATOM 3297 N ND2 . ASN A 1 460 ? 35.477 33.891 23.164 1.00 61.70 ? 503 ASN A ND2 1 ATOM 3298 N N . TYR A 1 461 ? 36.037 38.506 22.389 1.00 55.53 ? 504 TYR A N 1 ATOM 3299 C CA . TYR A 1 461 ? 37.265 38.898 21.710 1.00 51.13 ? 504 TYR A CA 1 ATOM 3300 C C . TYR A 1 461 ? 37.858 40.071 22.477 1.00 50.94 ? 504 TYR A C 1 ATOM 3301 O O . TYR A 1 461 ? 37.169 40.722 23.267 1.00 63.87 ? 504 TYR A O 1 ATOM 3302 C CB . TYR A 1 461 ? 37.013 39.282 20.251 1.00 57.68 ? 504 TYR A CB 1 ATOM 3303 C CG . TYR A 1 461 ? 36.092 40.466 20.111 1.00 57.80 ? 504 TYR A CG 1 ATOM 3304 C CD1 . TYR A 1 461 ? 34.714 40.296 20.071 1.00 52.94 ? 504 TYR A CD1 1 ATOM 3305 C CD2 . TYR A 1 461 ? 36.597 41.757 20.029 1.00 59.00 ? 504 TYR A CD2 1 ATOM 3306 C CE1 . TYR A 1 461 ? 33.865 41.378 19.949 1.00 44.89 ? 504 TYR A CE1 1 ATOM 3307 C CE2 . TYR A 1 461 ? 35.756 42.847 19.908 1.00 44.59 ? 504 TYR A CE2 1 ATOM 3308 C CZ . TYR A 1 461 ? 34.391 42.650 19.869 1.00 41.19 ? 504 TYR A CZ 1 ATOM 3309 O OH . TYR A 1 461 ? 33.549 43.728 19.751 1.00 46.55 ? 504 TYR A OH 1 ATOM 3310 N N . SER A 1 462 ? 39.130 40.356 22.212 1.00 50.14 ? 505 SER A N 1 ATOM 3311 C CA . SER A 1 462 ? 39.811 41.419 22.939 1.00 62.94 ? 505 SER A CA 1 ATOM 3312 C C . SER A 1 462 ? 39.254 42.778 22.538 1.00 58.37 ? 505 SER A C 1 ATOM 3313 O O . SER A 1 462 ? 38.977 43.033 21.364 1.00 80.82 ? 505 SER A O 1 ATOM 3314 C CB . SER A 1 462 ? 41.317 41.375 22.681 1.00 55.48 ? 505 SER A CB 1 ATOM 3315 O OG . SER A 1 462 ? 41.640 41.976 21.440 1.00 72.90 ? 505 SER A OG 1 ATOM 3316 N N . GLY A 1 463 ? 39.084 43.653 23.529 1.00 55.08 ? 506 GLY A N 1 ATOM 3317 C CA . GLY A 1 463 ? 38.537 44.973 23.305 1.00 55.17 ? 506 GLY A CA 1 ATOM 3318 C C . GLY A 1 463 ? 37.028 45.046 23.266 1.00 55.69 ? 506 GLY A C 1 ATOM 3319 O O . GLY A 1 463 ? 36.478 46.154 23.184 1.00 58.93 ? 506 GLY A O 1 ATOM 3320 N N . SER A 1 464 ? 36.339 43.910 23.328 1.00 49.91 ? 507 SER A N 1 ATOM 3321 C CA . SER A 1 464 ? 34.884 43.910 23.307 1.00 44.85 ? 507 SER A CA 1 ATOM 3322 C C . SER A 1 464 ? 34.334 44.750 24.449 1.00 50.16 ? 507 SER A C 1 ATOM 3323 O O . SER A 1 464 ? 34.858 44.731 25.566 1.00 62.54 ? 507 SER A O 1 ATOM 3324 C CB . SER A 1 464 ? 34.360 42.476 23.406 1.00 50.06 ? 507 SER A CB 1 ATOM 3325 O OG . SER A 1 464 ? 32.951 42.446 23.555 1.00 49.71 ? 507 SER A OG 1 ATOM 3326 N N . SER A 1 465 ? 33.263 45.495 24.163 1.00 42.32 ? 508 SER A N 1 ATOM 3327 C CA . SER A 1 465 ? 32.589 46.266 25.199 1.00 48.98 ? 508 SER A CA 1 ATOM 3328 C C . SER A 1 465 ? 31.713 45.398 26.090 1.00 53.95 ? 508 SER A C 1 ATOM 3329 O O . SER A 1 465 ? 31.453 45.775 27.239 1.00 66.04 ? 508 SER A O 1 ATOM 3330 C CB . SER A 1 465 ? 31.735 47.370 24.574 1.00 56.57 ? 508 SER A CB 1 ATOM 3331 O OG . SER A 1 465 ? 30.608 46.823 23.912 1.00 58.59 ? 508 SER A OG 1 ATOM 3332 N N . HIS A 1 466 ? 31.247 44.255 25.585 1.00 46.87 ? 509 HIS A N 1 ATOM 3333 C CA . HIS A 1 466 ? 30.397 43.341 26.347 1.00 48.23 ? 509 HIS A CA 1 ATOM 3334 C C . HIS A 1 466 ? 29.095 44.004 26.778 1.00 41.29 ? 509 HIS A C 1 ATOM 3335 O O . HIS A 1 466 ? 28.531 43.669 27.822 1.00 59.22 ? 509 HIS A O 1 ATOM 3336 C CB . HIS A 1 466 ? 31.139 42.779 27.562 1.00 40.50 ? 509 HIS A CB 1 ATOM 3337 C CG . HIS A 1 466 ? 32.334 41.950 27.209 1.00 44.68 ? 509 HIS A CG 1 ATOM 3338 N ND1 . HIS A 1 466 ? 32.234 40.634 26.810 1.00 43.54 ? 509 HIS A ND1 1 ATOM 3339 C CD2 . HIS A 1 466 ? 33.654 42.250 27.188 1.00 39.85 ? 509 HIS A CD2 1 ATOM 3340 C CE1 . HIS A 1 466 ? 33.442 40.158 26.566 1.00 57.08 ? 509 HIS A CE1 1 ATOM 3341 N NE2 . HIS A 1 466 ? 34.321 41.118 26.788 1.00 44.11 ? 509 HIS A NE2 1 ATOM 3342 N N . VAL A 1 467 ? 28.599 44.935 25.972 1.00 41.18 ? 510 VAL A N 1 ATOM 3343 C CA . VAL A 1 467 ? 27.389 45.684 26.283 1.00 51.03 ? 510 VAL A CA 1 ATOM 3344 C C . VAL A 1 467 ? 26.260 45.175 25.403 1.00 41.25 ? 510 VAL A C 1 ATOM 3345 O O . VAL A 1 467 ? 26.481 44.737 24.269 1.00 48.36 ? 510 VAL A O 1 ATOM 3346 C CB . VAL A 1 467 ? 27.600 47.200 26.091 1.00 46.63 ? 510 VAL A CB 1 ATOM 3347 C CG1 . VAL A 1 467 ? 28.750 47.688 26.959 1.00 45.76 ? 510 VAL A CG1 1 ATOM 3348 C CG2 . VAL A 1 467 ? 27.862 47.513 24.630 1.00 45.94 ? 510 VAL A CG2 1 ATOM 3349 N N . VAL A 1 468 ? 25.038 45.233 25.932 1.00 35.52 ? 511 VAL A N 1 ATOM 3350 C CA . VAL A 1 468 ? 23.886 44.750 25.179 1.00 36.20 ? 511 VAL A CA 1 ATOM 3351 C C . VAL A 1 468 ? 23.774 45.532 23.879 1.00 40.55 ? 511 VAL A C 1 ATOM 3352 O O . VAL A 1 468 ? 23.670 46.764 23.885 1.00 51.01 ? 511 VAL A O 1 ATOM 3353 C CB . VAL A 1 468 ? 22.606 44.877 26.011 1.00 42.01 ? 511 VAL A CB 1 ATOM 3354 C CG1 . VAL A 1 468 ? 21.383 44.597 25.152 1.00 38.82 ? 511 VAL A CG1 1 ATOM 3355 C CG2 . VAL A 1 468 ? 22.653 43.939 27.208 1.00 41.20 ? 511 VAL A CG2 1 ATOM 3356 N N . LEU A 1 469 ? 23.804 44.816 22.752 1.00 45.26 ? 512 LEU A N 1 ATOM 3357 C CA . LEU A 1 469 ? 23.541 45.441 21.459 1.00 32.25 ? 512 LEU A CA 1 ATOM 3358 C C . LEU A 1 469 ? 22.049 45.524 21.169 1.00 41.14 ? 512 LEU A C 1 ATOM 3359 O O . LEU A 1 469 ? 21.583 46.505 20.578 1.00 41.36 ? 512 LEU A O 1 ATOM 3360 C CB . LEU A 1 469 ? 24.258 44.685 20.344 1.00 30.07 ? 512 LEU A CB 1 ATOM 3361 C CG . LEU A 1 469 ? 25.769 44.540 20.505 1.00 39.44 ? 512 LEU A CG 1 ATOM 3362 C CD1 . LEU A 1 469 ? 26.340 43.620 19.435 1.00 41.74 ? 512 LEU A CD1 1 ATOM 3363 C CD2 . LEU A 1 469 ? 26.419 45.908 20.444 1.00 34.69 ? 512 LEU A CD2 1 ATOM 3364 N N . ASP A 1 470 ? 21.290 44.503 21.552 1.00 40.45 ? 513 ASP A N 1 ATOM 3365 C CA . ASP A 1 470 ? 19.850 44.501 21.304 1.00 33.75 ? 513 ASP A CA 1 ATOM 3366 C C . ASP A 1 470 ? 19.238 43.405 22.166 1.00 37.26 ? 513 ASP A C 1 ATOM 3367 O O . ASP A 1 470 ? 19.950 42.659 22.844 1.00 43.87 ? 513 ASP A O 1 ATOM 3368 C CB . ASP A 1 470 ? 19.552 44.293 19.817 1.00 42.68 ? 513 ASP A CB 1 ATOM 3369 C CG . ASP A 1 470 ? 18.142 44.704 19.431 1.00 53.23 ? 513 ASP A CG 1 ATOM 3370 O OD1 . ASP A 1 470 ? 17.283 44.819 20.328 1.00 51.29 ? 513 ASP A OD1 1 ATOM 3371 O OD2 . ASP A 1 470 ? 17.892 44.908 18.221 1.00 70.42 -1 513 ASP A OD2 1 ATOM 3372 N N . HIS A 1 471 ? 17.911 43.303 22.136 1.00 31.66 ? 514 HIS A N 1 ATOM 3373 C CA . HIS A 1 471 ? 17.257 42.188 22.802 1.00 37.90 ? 514 HIS A CA 1 ATOM 3374 C C . HIS A 1 471 ? 15.907 41.915 22.153 1.00 44.77 ? 514 HIS A C 1 ATOM 3375 O O . HIS A 1 471 ? 15.282 42.805 21.572 1.00 44.01 ? 514 HIS A O 1 ATOM 3376 C CB . HIS A 1 471 ? 17.118 42.431 24.316 1.00 42.37 ? 514 HIS A CB 1 ATOM 3377 C CG . HIS A 1 471 ? 16.084 43.448 24.696 1.00 51.00 ? 514 HIS A CG 1 ATOM 3378 N ND1 . HIS A 1 471 ? 16.403 44.623 25.343 1.00 41.67 ? 514 HIS A ND1 1 ATOM 3379 C CD2 . HIS A 1 471 ? 14.735 43.444 24.569 1.00 43.03 ? 514 HIS A CD2 1 ATOM 3380 C CE1 . HIS A 1 471 ? 15.299 45.310 25.576 1.00 31.68 ? 514 HIS A CE1 1 ATOM 3381 N NE2 . HIS A 1 471 ? 14.273 44.617 25.116 1.00 36.05 ? 514 HIS A NE2 1 ATOM 3382 N N . GLU A 1 472 ? 15.470 40.665 22.274 1.00 42.15 ? 515 GLU A N 1 ATOM 3383 C CA . GLU A 1 472 ? 14.221 40.173 21.719 1.00 37.87 ? 515 GLU A CA 1 ATOM 3384 C C . GLU A 1 472 ? 13.429 39.504 22.831 1.00 41.35 ? 515 GLU A C 1 ATOM 3385 O O . GLU A 1 472 ? 14.001 39.000 23.802 1.00 51.75 ? 515 GLU A O 1 ATOM 3386 C CB . GLU A 1 472 ? 14.482 39.178 20.586 1.00 47.27 ? 515 GLU A CB 1 ATOM 3387 C CG . GLU A 1 472 ? 15.707 39.515 19.750 1.00 49.52 ? 515 GLU A CG 1 ATOM 3388 C CD . GLU A 1 472 ? 16.039 38.433 18.738 1.00 69.98 ? 515 GLU A CD 1 ATOM 3389 O OE1 . GLU A 1 472 ? 15.955 37.236 19.096 1.00 50.28 ? 515 GLU A OE1 1 ATOM 3390 O OE2 . GLU A 1 472 ? 16.387 38.780 17.588 1.00 90.01 -1 515 GLU A OE2 1 ATOM 3391 N N . THR A 1 473 ? 12.110 39.475 22.670 1.00 41.65 ? 516 THR A N 1 ATOM 3392 C CA . THR A 1 473 ? 11.215 38.959 23.699 1.00 43.19 ? 516 THR A CA 1 ATOM 3393 C C . THR A 1 473 ? 10.217 38.003 23.067 1.00 40.69 ? 516 THR A C 1 ATOM 3394 O O . THR A 1 473 ? 9.420 38.410 22.216 1.00 48.53 ? 516 THR A O 1 ATOM 3395 C CB . THR A 1 473 ? 10.483 40.103 24.402 1.00 49.93 ? 516 THR A CB 1 ATOM 3396 O OG1 . THR A 1 473 ? 11.440 41.055 24.884 1.00 46.04 ? 516 THR A OG1 1 ATOM 3397 C CG2 . THR A 1 473 ? 9.664 39.574 25.569 1.00 31.68 ? 516 THR A CG2 1 ATOM 3398 N N . TYR A 1 474 ? 10.247 36.747 23.493 1.00 42.69 ? 517 TYR A N 1 ATOM 3399 C CA . TYR A 1 474 ? 9.318 35.743 22.999 1.00 32.19 ? 517 TYR A CA 1 ATOM 3400 C C . TYR A 1 474 ? 8.221 35.505 24.027 1.00 48.34 ? 517 TYR A C 1 ATOM 3401 O O . TYR A 1 474 ? 8.452 35.581 25.238 1.00 43.84 ? 517 TYR A O 1 ATOM 3402 C CB . TYR A 1 474 ? 10.055 34.439 22.685 1.00 35.69 ? 517 TYR A CB 1 ATOM 3403 C CG . TYR A 1 474 ? 11.125 34.634 21.641 1.00 44.28 ? 517 TYR A CG 1 ATOM 3404 C CD1 . TYR A 1 474 ? 12.401 35.042 22.004 1.00 43.35 ? 517 TYR A CD1 1 ATOM 3405 C CD2 . TYR A 1 474 ? 10.858 34.439 20.291 1.00 56.27 ? 517 TYR A CD2 1 ATOM 3406 C CE1 . TYR A 1 474 ? 13.385 35.240 21.058 1.00 46.81 ? 517 TYR A CE1 1 ATOM 3407 C CE2 . TYR A 1 474 ? 11.840 34.633 19.334 1.00 44.02 ? 517 TYR A CE2 1 ATOM 3408 C CZ . TYR A 1 474 ? 13.101 35.035 19.726 1.00 41.94 ? 517 TYR A CZ 1 ATOM 3409 O OH . TYR A 1 474 ? 14.085 35.234 18.788 1.00 32.33 ? 517 TYR A OH 1 ATOM 3410 N N . ILE A 1 475 ? 7.010 35.242 23.534 1.00 34.15 ? 518 ILE A N 1 ATOM 3411 C CA . ILE A 1 475 ? 5.859 35.010 24.397 1.00 33.79 ? 518 ILE A CA 1 ATOM 3412 C C . ILE A 1 475 ? 5.020 33.885 23.810 1.00 43.64 ? 518 ILE A C 1 ATOM 3413 O O . ILE A 1 475 ? 5.094 33.575 22.620 1.00 51.34 ? 518 ILE A O 1 ATOM 3414 C CB . ILE A 1 475 ? 4.994 36.278 24.574 1.00 36.88 ? 518 ILE A CB 1 ATOM 3415 C CG1 . ILE A 1 475 ? 4.304 36.652 23.261 1.00 42.08 ? 518 ILE A CG1 1 ATOM 3416 C CG2 . ILE A 1 475 ? 5.847 37.440 25.055 1.00 28.44 ? 518 ILE A CG2 1 ATOM 3417 C CD1 . ILE A 1 475 ? 2.938 36.012 23.080 1.00 34.08 ? 518 ILE A CD1 1 ATOM 3418 N N . LEU A 1 476 ? 4.215 33.271 24.671 1.00 45.99 ? 519 LEU A N 1 ATOM 3419 C CA . LEU A 1 476 ? 3.243 32.257 24.273 1.00 44.13 ? 519 LEU A CA 1 ATOM 3420 C C . LEU A 1 476 ? 1.852 32.861 24.429 1.00 40.92 ? 519 LEU A C 1 ATOM 3421 O O . LEU A 1 476 ? 1.398 33.099 25.552 1.00 43.63 ? 519 LEU A O 1 ATOM 3422 C CB . LEU A 1 476 ? 3.390 30.990 25.115 1.00 42.19 ? 519 LEU A CB 1 ATOM 3423 C CG . LEU A 1 476 ? 2.413 29.848 24.819 1.00 37.72 ? 519 LEU A CG 1 ATOM 3424 C CD1 . LEU A 1 476 ? 2.773 29.128 23.529 1.00 35.70 ? 519 LEU A CD1 1 ATOM 3425 C CD2 . LEU A 1 476 ? 2.354 28.877 25.988 1.00 51.82 ? 519 LEU A CD2 1 ATOM 3426 N N . ASN A 1 477 ? 1.170 33.099 23.312 1.00 44.33 ? 520 ASN A N 1 ATOM 3427 C CA . ASN A 1 477 ? -0.148 33.718 23.370 1.00 34.70 ? 520 ASN A CA 1 ATOM 3428 C C . ASN A 1 477 ? -1.140 32.645 23.788 1.00 40.23 ? 520 ASN A C 1 ATOM 3429 O O . ASN A 1 477 ? -1.410 31.708 23.031 1.00 48.47 ? 520 ASN A O 1 ATOM 3430 C CB . ASN A 1 477 ? -0.504 34.323 22.013 1.00 37.96 ? 520 ASN A CB 1 ATOM 3431 C CG . ASN A 1 477 ? -1.832 35.060 22.016 1.00 39.18 ? 520 ASN A CG 1 ATOM 3432 O OD1 . ASN A 1 477 ? -2.676 34.850 22.885 1.00 40.33 ? 520 ASN A OD1 1 ATOM 3433 N ND2 . ASN A 1 477 ? -2.015 35.941 21.026 1.00 48.68 ? 520 ASN A ND2 1 ATOM 3434 N N . LEU A 1 478 ? -1.719 32.804 24.978 1.00 44.01 ? 521 LEU A N 1 ATOM 3435 C CA . LEU A 1 478 ? -2.556 31.751 25.536 1.00 44.30 ? 521 LEU A CA 1 ATOM 3436 C C . LEU A 1 478 ? -3.919 31.701 24.865 1.00 48.78 ? 521 LEU A C 1 ATOM 3437 O O . LEU A 1 478 ? -4.520 30.625 24.774 1.00 48.17 ? 521 LEU A O 1 ATOM 3438 C CB . LEU A 1 478 ? -2.706 31.943 27.046 1.00 43.95 ? 521 LEU A CB 1 ATOM 3439 C CG . LEU A 1 478 ? -1.482 31.564 27.886 1.00 42.02 ? 521 LEU A CG 1 ATOM 3440 C CD1 . LEU A 1 478 ? -1.678 31.965 29.336 1.00 42.42 ? 521 LEU A CD1 1 ATOM 3441 C CD2 . LEU A 1 478 ? -1.196 30.077 27.776 1.00 44.73 ? 521 LEU A CD2 1 ATOM 3442 N N . THR A 1 479 ? -4.421 32.845 24.397 1.00 43.56 ? 522 THR A N 1 ATOM 3443 C CA . THR A 1 479 ? -5.686 32.853 23.676 1.00 48.83 ? 522 THR A CA 1 ATOM 3444 C C . THR A 1 479 ? -5.655 31.875 22.508 1.00 60.79 ? 522 THR A C 1 ATOM 3445 O O . THR A 1 479 ? -6.647 31.192 22.230 1.00 76.38 ? 522 THR A O 1 ATOM 3446 C CB . THR A 1 479 ? -5.993 34.268 23.180 1.00 60.11 ? 522 THR A CB 1 ATOM 3447 O OG1 . THR A 1 479 ? -6.083 35.163 24.296 1.00 46.85 ? 522 THR A OG1 1 ATOM 3448 C CG2 . THR A 1 479 ? -7.301 34.292 22.409 1.00 60.75 ? 522 THR A CG2 1 ATOM 3449 N N . GLN A 1 480 ? -4.521 31.806 21.804 1.00 43.17 ? 523 GLN A N 1 ATOM 3450 C CA . GLN A 1 480 ? -4.366 30.866 20.697 1.00 54.06 ? 523 GLN A CA 1 ATOM 3451 C C . GLN A 1 480 ? -3.965 29.472 21.171 1.00 51.98 ? 523 GLN A C 1 ATOM 3452 O O . GLN A 1 480 ? -4.511 28.472 20.690 1.00 55.37 ? 523 GLN A O 1 ATOM 3453 C CB . GLN A 1 480 ? -3.335 31.410 19.706 1.00 44.37 ? 523 GLN A CB 1 ATOM 3454 C CG . GLN A 1 480 ? -3.806 32.634 18.938 1.00 32.98 ? 523 GLN A CG 1 ATOM 3455 C CD . GLN A 1 480 ? -2.662 33.384 18.288 1.00 48.67 ? 523 GLN A CD 1 ATOM 3456 O OE1 . GLN A 1 480 ? -1.495 33.026 18.452 1.00 44.66 ? 523 GLN A OE1 1 ATOM 3457 N NE2 . GLN A 1 480 ? -2.991 34.437 17.547 1.00 51.90 ? 523 GLN A NE2 1 ATOM 3458 N N . ALA A 1 481 ? -3.026 29.386 22.118 1.00 42.83 ? 524 ALA A N 1 ATOM 3459 C CA . ALA A 1 481 ? -2.443 28.093 22.467 1.00 38.33 ? 524 ALA A CA 1 ATOM 3460 C C . ALA A 1 481 ? -3.426 27.201 23.212 1.00 51.92 ? 524 ALA A C 1 ATOM 3461 O O . ALA A 1 481 ? -3.340 25.971 23.115 1.00 58.30 ? 524 ALA A O 1 ATOM 3462 C CB . ALA A 1 481 ? -1.176 28.290 23.297 1.00 32.55 ? 524 ALA A CB 1 ATOM 3463 N N . ASN A 1 482 ? -4.355 27.788 23.961 1.00 49.90 ? 525 ASN A N 1 ATOM 3464 C CA . ASN A 1 482 ? -5.303 26.997 24.731 1.00 49.26 ? 525 ASN A CA 1 ATOM 3465 C C . ASN A 1 482 ? -6.490 26.520 23.908 1.00 57.02 ? 525 ASN A C 1 ATOM 3466 O O . ASN A 1 482 ? -7.333 25.791 24.440 1.00 72.34 ? 525 ASN A O 1 ATOM 3467 C CB . ASN A 1 482 ? -5.806 27.798 25.934 1.00 48.31 ? 525 ASN A CB 1 ATOM 3468 C CG . ASN A 1 482 ? -4.791 27.859 27.058 1.00 52.26 ? 525 ASN A CG 1 ATOM 3469 O OD1 . ASN A 1 482 ? -4.008 26.927 27.255 1.00 46.06 ? 525 ASN A OD1 1 ATOM 3470 N ND2 . ASN A 1 482 ? -4.794 28.963 27.800 1.00 47.88 ? 525 ASN A ND2 1 ATOM 3471 N N . ILE A 1 483 ? -6.587 26.904 22.642 1.00 53.99 ? 526 ILE A N 1 ATOM 3472 C CA . ILE A 1 483 ? -7.686 26.389 21.819 1.00 55.87 ? 526 ILE A CA 1 ATOM 3473 C C . ILE A 1 483 ? -7.450 24.907 21.549 1.00 56.92 ? 526 ILE A C 1 ATOM 3474 O O . ILE A 1 483 ? -6.335 24.522 21.153 1.00 52.57 ? 526 ILE A O 1 ATOM 3475 C CB . ILE A 1 483 ? -7.791 27.175 20.516 1.00 47.86 ? 526 ILE A CB 1 ATOM 3476 C CG1 . ILE A 1 483 ? -8.207 28.616 20.804 1.00 46.69 ? 526 ILE A CG1 1 ATOM 3477 C CG2 . ILE A 1 483 ? -8.798 26.516 19.589 1.00 51.77 ? 526 ILE A CG2 1 ATOM 3478 C CD1 . ILE A 1 483 ? -9.481 28.719 21.606 1.00 40.48 ? 526 ILE A CD1 1 ATOM 3479 N N . PRO A 1 484 ? -8.455 24.050 21.717 1.00 62.79 ? 527 PRO A N 1 ATOM 3480 C CA . PRO A 1 484 ? -8.259 22.622 21.443 1.00 56.94 ? 527 PRO A CA 1 ATOM 3481 C C . PRO A 1 484 ? -7.777 22.414 20.016 1.00 53.42 ? 527 PRO A C 1 ATOM 3482 O O . PRO A 1 484 ? -8.357 22.941 19.063 1.00 54.33 ? 527 PRO A O 1 ATOM 3483 C CB . PRO A 1 484 ? -9.651 22.020 21.670 1.00 46.64 ? 527 PRO A CB 1 ATOM 3484 C CG . PRO A 1 484 ? -10.348 22.997 22.560 1.00 46.07 ? 527 PRO A CG 1 ATOM 3485 C CD . PRO A 1 484 ? -9.821 24.348 22.181 1.00 54.18 ? 527 PRO A CD 1 ATOM 3486 N N . GLY A 1 485 ? -6.705 21.640 19.872 1.00 57.58 ? 528 GLY A N 1 ATOM 3487 C CA . GLY A 1 485 ? -6.108 21.414 18.577 1.00 61.75 ? 528 GLY A CA 1 ATOM 3488 C C . GLY A 1 485 ? -5.040 22.410 18.191 1.00 61.85 ? 528 GLY A C 1 ATOM 3489 O O . GLY A 1 485 ? -4.350 22.197 17.186 1.00 70.85 ? 528 GLY A O 1 ATOM 3490 N N . ALA A 1 486 ? -4.872 23.484 18.956 1.00 55.26 ? 529 ALA A N 1 ATOM 3491 C CA . ALA A 1 486 ? -3.873 24.483 18.621 1.00 52.63 ? 529 ALA A CA 1 ATOM 3492 C C . ALA A 1 486 ? -2.472 23.895 18.749 1.00 56.17 ? 529 ALA A C 1 ATOM 3493 O O . ALA A 1 486 ? -2.248 22.885 19.422 1.00 65.00 ? 529 ALA A O 1 ATOM 3494 C CB . ALA A 1 486 ? -4.013 25.705 19.527 1.00 56.66 ? 529 ALA A CB 1 ATOM 3495 N N . ILE A 1 487 ? -1.524 24.538 18.085 1.00 52.42 ? 530 ILE A N 1 ATOM 3496 C CA . ILE A 1 487 ? -0.130 24.109 18.088 1.00 56.34 ? 530 ILE A CA 1 ATOM 3497 C C . ILE A 1 487 ? 0.658 25.129 18.899 1.00 53.91 ? 530 ILE A C 1 ATOM 3498 O O . ILE A 1 487 ? 0.705 26.306 18.519 1.00 64.97 ? 530 ILE A O 1 ATOM 3499 C CB . ILE A 1 487 ? 0.431 23.989 16.662 1.00 46.79 ? 530 ILE A CB 1 ATOM 3500 C CG1 . ILE A 1 487 ? -0.413 23.017 15.838 1.00 68.04 ? 530 ILE A CG1 1 ATOM 3501 C CG2 . ILE A 1 487 ? 1.885 23.547 16.691 1.00 29.28 ? 530 ILE A CG2 1 ATOM 3502 C CD1 . ILE A 1 487 ? 0.058 22.864 14.405 1.00 62.88 ? 530 ILE A CD1 1 ATOM 3503 N N . PRO A 1 488 ? 1.290 24.733 20.001 1.00 51.80 ? 531 PRO A N 1 ATOM 3504 C CA . PRO A 1 488 ? 2.022 25.713 20.811 1.00 51.65 ? 531 PRO A CA 1 ATOM 3505 C C . PRO A 1 488 ? 3.111 26.382 19.990 1.00 53.03 ? 531 PRO A C 1 ATOM 3506 O O . PRO A 1 488 ? 3.942 25.717 19.368 1.00 77.78 ? 531 PRO A O 1 ATOM 3507 C CB . PRO A 1 488 ? 2.604 24.866 21.949 1.00 49.82 ? 531 PRO A CB 1 ATOM 3508 C CG . PRO A 1 488 ? 2.678 23.479 21.381 1.00 60.57 ? 531 PRO A CG 1 ATOM 3509 C CD . PRO A 1 488 ? 1.480 23.356 20.485 1.00 51.74 ? 531 PRO A CD 1 ATOM 3510 N N . HIS A 1 489 ? 3.103 27.710 19.996 1.00 43.15 ? 532 HIS A N 1 ATOM 3511 C CA . HIS A 1 489 ? 4.086 28.486 19.256 1.00 45.14 ? 532 HIS A CA 1 ATOM 3512 C C . HIS A 1 489 ? 4.582 29.631 20.121 1.00 49.84 ? 532 HIS A C 1 ATOM 3513 O O . HIS A 1 489 ? 3.777 30.394 20.665 1.00 41.85 ? 532 HIS A O 1 ATOM 3514 C CB . HIS A 1 489 ? 3.496 29.029 17.949 1.00 56.99 ? 532 HIS A CB 1 ATOM 3515 C CG . HIS A 1 489 ? 4.418 29.949 17.210 1.00 70.84 ? 532 HIS A CG 1 ATOM 3516 N ND1 . HIS A 1 489 ? 5.740 29.642 16.968 1.00 79.41 ? 532 HIS A ND1 1 ATOM 3517 C CD2 . HIS A 1 489 ? 4.211 31.173 16.670 1.00 55.06 ? 532 HIS A CD2 1 ATOM 3518 C CE1 . HIS A 1 489 ? 6.308 30.638 16.311 1.00 56.09 ? 532 HIS A CE1 1 ATOM 3519 N NE2 . HIS A 1 489 ? 5.402 31.579 16.117 1.00 58.40 ? 532 HIS A NE2 1 ATOM 3520 N N . TRP A 1 490 ? 5.897 29.772 20.219 1.00 51.77 ? 533 TRP A N 1 ATOM 3521 C CA . TRP A 1 490 ? 6.503 30.860 20.978 1.00 46.01 ? 533 TRP A CA 1 ATOM 3522 C C . TRP A 1 490 ? 6.903 31.912 19.956 1.00 47.71 ? 533 TRP A C 1 ATOM 3523 O O . TRP A 1 490 ? 7.918 31.773 19.269 1.00 52.68 ? 533 TRP A O 1 ATOM 3524 C CB . TRP A 1 490 ? 7.697 30.369 21.784 1.00 48.83 ? 533 TRP A CB 1 ATOM 3525 C CG . TRP A 1 490 ? 7.335 29.383 22.848 1.00 54.49 ? 533 TRP A CG 1 ATOM 3526 C CD1 . TRP A 1 490 ? 7.237 28.031 22.715 1.00 57.15 ? 533 TRP A CD1 1 ATOM 3527 C CD2 . TRP A 1 490 ? 7.014 29.677 24.212 1.00 60.27 ? 533 TRP A CD2 1 ATOM 3528 N NE1 . TRP A 1 490 ? 6.876 27.461 23.912 1.00 49.59 ? 533 TRP A NE1 1 ATOM 3529 C CE2 . TRP A 1 490 ? 6.733 28.452 24.848 1.00 56.22 ? 533 TRP A CE2 1 ATOM 3530 C CE3 . TRP A 1 490 ? 6.941 30.856 24.958 1.00 52.28 ? 533 TRP A CE3 1 ATOM 3531 C CZ2 . TRP A 1 490 ? 6.386 28.373 26.195 1.00 59.32 ? 533 TRP A CZ2 1 ATOM 3532 C CZ3 . TRP A 1 490 ? 6.595 30.776 26.292 1.00 56.40 ? 533 TRP A CZ3 1 ATOM 3533 C CH2 . TRP A 1 490 ? 6.321 29.544 26.897 1.00 56.17 ? 533 TRP A CH2 1 ATOM 3534 N N . GLN A 1 491 ? 6.133 32.993 19.897 1.00 47.98 ? 534 GLN A N 1 ATOM 3535 C CA . GLN A 1 491 ? 6.286 33.971 18.837 1.00 40.60 ? 534 GLN A CA 1 ATOM 3536 C C . GLN A 1 491 ? 7.320 35.016 19.246 1.00 41.91 ? 534 GLN A C 1 ATOM 3537 O O . GLN A 1 491 ? 7.849 35.002 20.360 1.00 55.30 ? 534 GLN A O 1 ATOM 3538 C CB . GLN A 1 491 ? 4.933 34.596 18.506 1.00 32.35 ? 534 GLN A CB 1 ATOM 3539 C CG . GLN A 1 491 ? 4.273 35.314 19.662 1.00 43.96 ? 534 GLN A CG 1 ATOM 3540 C CD . GLN A 1 491 ? 2.851 35.749 19.344 1.00 60.26 ? 534 GLN A CD 1 ATOM 3541 O OE1 . GLN A 1 491 ? 1.943 34.918 19.241 1.00 55.06 ? 534 GLN A OE1 1 ATOM 3542 N NE2 . GLN A 1 491 ? 2.653 37.056 19.178 1.00 32.20 ? 534 GLN A NE2 1 ATOM 3543 N N . LEU A 1 492 ? 7.624 35.935 18.329 1.00 50.39 ? 535 LEU A N 1 ATOM 3544 C CA . LEU A 1 492 ? 8.717 36.871 18.547 1.00 31.31 ? 535 LEU A CA 1 ATOM 3545 C C . LEU A 1 492 ? 8.298 38.147 19.260 1.00 49.81 ? 535 LEU A C 1 ATOM 3546 O O . LEU A 1 492 ? 9.171 38.870 19.751 1.00 75.44 ? 535 LEU A O 1 ATOM 3547 C CB . LEU A 1 492 ? 9.376 37.251 17.218 1.00 35.59 ? 535 LEU A CB 1 ATOM 3548 C CG . LEU A 1 492 ? 10.557 38.215 17.366 1.00 32.66 ? 535 LEU A CG 1 ATOM 3549 C CD1 . LEU A 1 492 ? 11.666 37.570 18.172 1.00 46.41 ? 535 LEU A CD1 1 ATOM 3550 C CD2 . LEU A 1 492 ? 11.076 38.693 16.026 1.00 35.59 ? 535 LEU A CD2 1 ATOM 3551 N N . LEU A 1 493 ? 7.002 38.445 19.343 1.00 52.71 ? 536 LEU A N 1 ATOM 3552 C CA . LEU A 1 493 ? 6.595 39.706 19.953 1.00 51.13 ? 536 LEU A CA 1 ATOM 3553 C C . LEU A 1 493 ? 7.335 40.860 19.287 1.00 48.01 ? 536 LEU A C 1 ATOM 3554 O O . LEU A 1 493 ? 7.082 41.169 18.118 1.00 87.01 ? 536 LEU A O 1 ATOM 3555 C CB . LEU A 1 493 ? 6.837 39.717 21.460 1.00 30.78 ? 536 LEU A CB 1 ATOM 3556 C CG . LEU A 1 493 ? 5.887 40.715 22.134 1.00 52.54 ? 536 LEU A CG 1 ATOM 3557 C CD1 . LEU A 1 493 ? 4.438 40.322 21.865 1.00 38.13 ? 536 LEU A CD1 1 ATOM 3558 C CD2 . LEU A 1 493 ? 6.147 40.863 23.623 1.00 39.01 ? 536 LEU A CD2 1 ATOM 3559 N N . TYR A 1 494 ? 8.229 41.520 20.021 1.00 25.99 ? 537 TYR A N 1 ATOM 3560 C CA . TYR A 1 494 ? 8.936 42.681 19.506 1.00 42.92 ? 537 TYR A CA 1 ATOM 3561 C C . TYR A 1 494 ? 10.450 42.489 19.550 1.00 39.49 ? 537 TYR A C 1 ATOM 3562 O O . TYR A 1 494 ? 10.974 41.603 20.232 1.00 42.07 ? 537 TYR A O 1 ATOM 3563 C CB . TYR A 1 494 ? 8.567 43.941 20.299 1.00 63.84 ? 537 TYR A CB 1 ATOM 3564 C CG . TYR A 1 494 ? 9.299 44.079 21.617 1.00 40.94 ? 537 TYR A CG 1 ATOM 3565 C CD1 . TYR A 1 494 ? 8.945 43.313 22.719 1.00 43.13 ? 537 TYR A CD1 1 ATOM 3566 C CD2 . TYR A 1 494 ? 10.345 44.983 21.755 1.00 32.75 ? 537 TYR A CD2 1 ATOM 3567 C CE1 . TYR A 1 494 ? 9.616 43.445 23.924 1.00 58.61 ? 537 TYR A CE1 1 ATOM 3568 C CE2 . TYR A 1 494 ? 11.018 45.121 22.951 1.00 41.02 ? 537 TYR A CE2 1 ATOM 3569 C CZ . TYR A 1 494 ? 10.651 44.352 24.033 1.00 47.54 ? 537 TYR A CZ 1 ATOM 3570 O OH . TYR A 1 494 ? 11.325 44.494 25.223 1.00 41.46 ? 537 TYR A OH 1 ATOM 3571 N N . ARG A 1 495 ? 11.142 43.343 18.795 1.00 38.39 ? 538 ARG A N 1 ATOM 3572 C CA . ARG A 1 495 ? 12.571 43.590 18.941 1.00 34.88 ? 538 ARG A CA 1 ATOM 3573 C C . ARG A 1 495 ? 12.784 45.033 19.385 1.00 49.78 ? 538 ARG A C 1 ATOM 3574 O O . ARG A 1 495 ? 12.115 45.947 18.892 1.00 51.25 ? 538 ARG A O 1 ATOM 3575 C CB . ARG A 1 495 ? 13.320 43.345 17.631 1.00 53.91 ? 538 ARG A CB 1 ATOM 3576 C CG . ARG A 1 495 ? 13.807 41.923 17.423 1.00 66.66 ? 538 ARG A CG 1 ATOM 3577 C CD . ARG A 1 495 ? 14.823 41.866 16.291 1.00 68.84 ? 538 ARG A CD 1 ATOM 3578 N NE . ARG A 1 495 ? 14.823 40.569 15.625 1.00 64.49 ? 538 ARG A NE 1 ATOM 3579 C CZ . ARG A 1 495 ? 14.077 40.282 14.564 1.00 73.30 ? 538 ARG A CZ 1 ATOM 3580 N NH1 . ARG A 1 495 ? 13.274 41.205 14.048 1.00 54.40 1 538 ARG A NH1 1 ATOM 3581 N NH2 . ARG A 1 495 ? 14.133 39.074 14.019 1.00 65.08 ? 538 ARG A NH2 1 ATOM 3582 N N . ALA A 1 496 ? 13.718 45.234 20.314 1.00 42.49 ? 539 ALA A N 1 ATOM 3583 C CA . ALA A 1 496 ? 13.902 46.532 20.955 1.00 41.83 ? 539 ALA A CA 1 ATOM 3584 C C . ALA A 1 496 ? 14.213 47.657 19.971 1.00 51.39 ? 539 ALA A C 1 ATOM 3585 O O . ALA A 1 496 ? 13.373 48.536 19.733 1.00 52.82 ? 539 ALA A O 1 ATOM 3586 C CB . ALA A 1 496 ? 15.014 46.441 22.001 1.00 37.93 ? 539 ALA A CB 1 ATOM 3587 N N . ARG A 1 497 ? 15.422 47.638 19.401 1.00 37.77 ? 540 ARG A N 1 ATOM 3588 C CA . ARG A 1 497 ? 15.847 48.720 18.516 1.00 47.64 ? 540 ARG A CA 1 ATOM 3589 C C . ARG A 1 497 ? 14.827 48.950 17.409 1.00 53.21 ? 540 ARG A C 1 ATOM 3590 O O . ARG A 1 497 ? 14.463 50.091 17.101 1.00 42.49 ? 540 ARG A O 1 ATOM 3591 C CB . ARG A 1 497 ? 17.220 48.410 17.921 1.00 37.03 ? 540 ARG A CB 1 ATOM 3592 C CG . ARG A 1 497 ? 18.343 48.370 18.925 1.00 39.28 ? 540 ARG A CG 1 ATOM 3593 C CD . ARG A 1 497 ? 19.685 48.410 18.223 1.00 40.37 ? 540 ARG A CD 1 ATOM 3594 N NE . ARG A 1 497 ? 19.749 49.526 17.284 1.00 50.20 ? 540 ARG A NE 1 ATOM 3595 C CZ . ARG A 1 497 ? 20.783 49.778 16.489 1.00 61.56 ? 540 ARG A CZ 1 ATOM 3596 N NH1 . ARG A 1 497 ? 21.848 48.989 16.521 1.00 76.52 1 540 ARG A NH1 1 ATOM 3597 N NH2 . ARG A 1 497 ? 20.752 50.817 15.663 1.00 34.66 ? 540 ARG A NH2 1 ATOM 3598 N N . GLU A 1 498 ? 14.355 47.864 16.802 1.00 54.57 ? 541 GLU A N 1 ATOM 3599 C CA . GLU A 1 498 ? 13.384 47.971 15.721 1.00 41.20 ? 541 GLU A CA 1 ATOM 3600 C C . GLU A 1 498 ? 12.126 48.695 16.182 1.00 48.40 ? 541 GLU A C 1 ATOM 3601 O O . GLU A 1 498 ? 11.566 49.516 15.445 1.00 60.94 ? 541 GLU A O 1 ATOM 3602 C CB . GLU A 1 498 ? 13.042 46.570 15.220 1.00 35.28 ? 541 GLU A CB 1 ATOM 3603 C CG . GLU A 1 498 ? 12.279 46.508 13.924 1.00 71.61 ? 541 GLU A CG 1 ATOM 3604 C CD . GLU A 1 498 ? 12.187 45.088 13.409 1.00 91.90 ? 541 GLU A CD 1 ATOM 3605 O OE1 . GLU A 1 498 ? 12.483 44.164 14.200 1.00 57.68 ? 541 GLU A OE1 1 ATOM 3606 O OE2 . GLU A 1 498 ? 11.825 44.898 12.227 1.00 99.33 -1 541 GLU A OE2 1 ATOM 3607 N N . THR A 1 499 ? 11.665 48.405 17.400 1.00 46.87 ? 542 THR A N 1 ATOM 3608 C CA . THR A 1 499 ? 10.391 48.947 17.860 1.00 43.65 ? 542 THR A CA 1 ATOM 3609 C C . THR A 1 499 ? 10.505 50.413 18.257 1.00 49.62 ? 542 THR A C 1 ATOM 3610 O O . THR A 1 499 ? 9.664 51.234 17.877 1.00 57.47 ? 542 THR A O 1 ATOM 3611 C CB . THR A 1 499 ? 9.867 48.139 19.049 1.00 37.50 ? 542 THR A CB 1 ATOM 3612 O OG1 . THR A 1 499 ? 9.284 46.913 18.593 1.00 44.13 ? 542 THR A OG1 1 ATOM 3613 C CG2 . THR A 1 499 ? 8.816 48.940 19.802 1.00 45.24 ? 542 THR A CG2 1 ATOM 3614 N N . TYR A 1 500 ? 11.544 50.763 19.014 1.00 50.12 ? 543 TYR A N 1 ATOM 3615 C CA . TYR A 1 500 ? 11.654 52.106 19.567 1.00 39.35 ? 543 TYR A CA 1 ATOM 3616 C C . TYR A 1 500 ? 12.547 53.032 18.754 1.00 45.35 ? 543 TYR A C 1 ATOM 3617 O O . TYR A 1 500 ? 12.738 54.186 19.150 1.00 46.77 ? 543 TYR A O 1 ATOM 3618 C CB . TYR A 1 500 ? 12.146 52.041 21.016 1.00 47.10 ? 543 TYR A CB 1 ATOM 3619 C CG . TYR A 1 500 ? 11.227 51.248 21.921 1.00 39.54 ? 543 TYR A CG 1 ATOM 3620 C CD1 . TYR A 1 500 ? 9.906 51.634 22.112 1.00 35.81 ? 543 TYR A CD1 1 ATOM 3621 C CD2 . TYR A 1 500 ? 11.684 50.129 22.601 1.00 46.02 ? 543 TYR A CD2 1 ATOM 3622 C CE1 . TYR A 1 500 ? 9.063 50.916 22.933 1.00 36.31 ? 543 TYR A CE1 1 ATOM 3623 C CE2 . TYR A 1 500 ? 10.846 49.406 23.430 1.00 42.66 ? 543 TYR A CE2 1 ATOM 3624 C CZ . TYR A 1 500 ? 9.538 49.805 23.592 1.00 35.54 ? 543 TYR A CZ 1 ATOM 3625 O OH . TYR A 1 500 ? 8.699 49.092 24.415 1.00 42.44 ? 543 TYR A OH 1 ATOM 3626 N N . GLY A 1 501 ? 13.103 52.564 17.642 1.00 49.91 ? 544 GLY A N 1 ATOM 3627 C CA . GLY A 1 501 ? 13.986 53.397 16.852 1.00 34.82 ? 544 GLY A CA 1 ATOM 3628 C C . GLY A 1 501 ? 15.169 53.905 17.645 1.00 31.05 ? 544 GLY A C 1 ATOM 3629 O O . GLY A 1 501 ? 15.450 55.105 17.656 1.00 46.38 ? 544 GLY A O 1 ATOM 3630 N N . LEU A 1 502 ? 15.867 53.004 18.307 1.00 41.34 ? 545 LEU A N 1 ATOM 3631 C CA . LEU A 1 502 ? 17.039 53.389 19.085 1.00 42.63 ? 545 LEU A CA 1 ATOM 3632 C C . LEU A 1 502 ? 18.295 53.219 18.240 1.00 47.00 ? 545 LEU A C 1 ATOM 3633 O O . LEU A 1 502 ? 18.467 52.172 17.604 1.00 43.53 ? 545 LEU A O 1 ATOM 3634 C CB . LEU A 1 502 ? 17.158 52.536 20.340 1.00 41.56 ? 545 LEU A CB 1 ATOM 3635 C CG . LEU A 1 502 ? 15.857 52.121 21.027 1.00 40.61 ? 545 LEU A CG 1 ATOM 3636 C CD1 . LEU A 1 502 ? 16.145 51.166 22.170 1.00 33.39 ? 545 LEU A CD1 1 ATOM 3637 C CD2 . LEU A 1 502 ? 15.104 53.341 21.523 1.00 51.19 ? 545 LEU A CD2 1 ATOM 3638 N N . PRO A 1 503 ? 19.186 54.210 18.204 1.00 43.87 ? 546 PRO A N 1 ATOM 3639 C CA . PRO A 1 503 ? 20.464 54.010 17.507 1.00 33.46 ? 546 PRO A CA 1 ATOM 3640 C C . PRO A 1 503 ? 21.318 52.942 18.152 1.00 50.33 ? 546 PRO A C 1 ATOM 3641 O O . PRO A 1 503 ? 22.209 52.391 17.492 1.00 59.09 ? 546 PRO A O 1 ATOM 3642 C CB . PRO A 1 503 ? 21.125 55.391 17.584 1.00 37.12 ? 546 PRO A CB 1 ATOM 3643 C CG . PRO A 1 503 ? 20.552 55.998 18.818 1.00 47.57 ? 546 PRO A CG 1 ATOM 3644 C CD . PRO A 1 503 ? 19.122 55.518 18.876 1.00 50.02 ? 546 PRO A CD 1 ATOM 3645 N N . ASN A 1 504 ? 21.078 52.640 19.423 1.00 46.96 ? 547 ASN A N 1 ATOM 3646 C CA . ASN A 1 504 ? 21.769 51.579 20.146 1.00 47.47 ? 547 ASN A CA 1 ATOM 3647 C C . ASN A 1 504 ? 21.024 51.362 21.457 1.00 49.36 ? 547 ASN A C 1 ATOM 3648 O O . ASN A 1 504 ? 20.037 52.044 21.752 1.00 54.48 ? 547 ASN A O 1 ATOM 3649 C CB . ASN A 1 504 ? 23.236 51.926 20.384 1.00 39.81 ? 547 ASN A CB 1 ATOM 3650 C CG . ASN A 1 504 ? 23.414 53.323 20.929 1.00 42.81 ? 547 ASN A CG 1 ATOM 3651 O OD1 . ASN A 1 504 ? 23.391 53.537 22.141 1.00 55.53 ? 547 ASN A OD1 1 ATOM 3652 N ND2 . ASN A 1 504 ? 23.594 54.288 20.034 1.00 64.02 ? 547 ASN A ND2 1 ATOM 3653 N N . THR A 1 505 ? 21.491 50.388 22.234 1.00 37.28 ? 548 THR A N 1 ATOM 3654 C CA . THR A 1 505 ? 20.891 50.040 23.514 1.00 39.04 ? 548 THR A CA 1 ATOM 3655 C C . THR A 1 505 ? 21.615 50.660 24.707 1.00 48.29 ? 548 THR A C 1 ATOM 3656 O O . THR A 1 505 ? 21.317 50.306 25.852 1.00 35.45 ? 548 THR A O 1 ATOM 3657 C CB . THR A 1 505 ? 20.818 48.521 23.660 1.00 41.07 ? 548 THR A CB 1 ATOM 3658 O OG1 . THR A 1 505 ? 22.069 47.942 23.271 1.00 63.10 ? 548 THR A OG1 1 ATOM 3659 C CG2 . THR A 1 505 ? 19.709 47.971 22.779 1.00 40.79 ? 548 THR A CG2 1 ATOM 3660 N N . LEU A 1 506 ? 22.583 51.544 24.469 1.00 42.03 ? 549 LEU A N 1 ATOM 3661 C CA . LEU A 1 506 ? 23.287 52.201 25.558 1.00 43.23 ? 549 LEU A CA 1 ATOM 3662 C C . LEU A 1 506 ? 22.330 53.107 26.334 1.00 46.41 ? 549 LEU A C 1 ATOM 3663 O O . LEU A 1 506 ? 21.228 53.414 25.873 1.00 41.98 ? 549 LEU A O 1 ATOM 3664 C CB . LEU A 1 506 ? 24.486 52.983 25.025 1.00 41.17 ? 549 LEU A CB 1 ATOM 3665 C CG . LEU A 1 506 ? 25.708 52.146 24.629 1.00 34.08 ? 549 LEU A CG 1 ATOM 3666 C CD1 . LEU A 1 506 ? 25.345 51.086 23.600 1.00 63.63 ? 549 LEU A CD1 1 ATOM 3667 C CD2 . LEU A 1 506 ? 26.831 53.030 24.107 1.00 34.89 ? 549 LEU A CD2 1 ATOM 3668 N N . PRO A 1 507 ? 22.729 53.537 27.535 1.00 38.97 ? 550 PRO A N 1 ATOM 3669 C CA . PRO A 1 507 ? 21.774 54.216 28.433 1.00 34.86 ? 550 PRO A CA 1 ATOM 3670 C C . PRO A 1 507 ? 21.152 55.474 27.851 1.00 42.21 ? 550 PRO A C 1 ATOM 3671 O O . PRO A 1 507 ? 19.943 55.694 28.017 1.00 44.70 ? 550 PRO A O 1 ATOM 3672 C CB . PRO A 1 507 ? 22.630 54.532 29.666 1.00 46.79 ? 550 PRO A CB 1 ATOM 3673 C CG . PRO A 1 507 ? 23.767 53.560 29.603 1.00 43.16 ? 550 PRO A CG 1 ATOM 3674 C CD . PRO A 1 507 ? 24.053 53.371 28.153 1.00 47.76 ? 550 PRO A CD 1 ATOM 3675 N N . THR A 1 508 ? 21.950 56.328 27.206 1.00 27.92 ? 551 THR A N 1 ATOM 3676 C CA . THR A 1 508 ? 21.415 57.561 26.634 1.00 29.66 ? 551 THR A CA 1 ATOM 3677 C C . THR A 1 508 ? 20.189 57.292 25.766 1.00 40.48 ? 551 THR A C 1 ATOM 3678 O O . THR A 1 508 ? 19.218 58.059 25.788 1.00 43.69 ? 551 THR A O 1 ATOM 3679 C CB . THR A 1 508 ? 22.500 58.269 25.823 1.00 40.94 ? 551 THR A CB 1 ATOM 3680 O OG1 . THR A 1 508 ? 23.695 58.368 26.608 1.00 49.52 ? 551 THR A OG1 1 ATOM 3681 C CG2 . THR A 1 508 ? 22.046 59.667 25.437 1.00 43.55 ? 551 THR A CG2 1 ATOM 3682 N N . ALA A 1 509 ? 20.217 56.204 24.992 1.00 42.51 ? 552 ALA A N 1 ATOM 3683 C CA . ALA A 1 509 ? 19.083 55.866 24.138 1.00 37.77 ? 552 ALA A CA 1 ATOM 3684 C C . ALA A 1 509 ? 17.826 55.595 24.956 1.00 39.25 ? 552 ALA A C 1 ATOM 3685 O O . ALA A 1 509 ? 16.725 56.010 24.574 1.00 41.03 ? 552 ALA A O 1 ATOM 3686 C CB . ALA A 1 509 ? 19.428 54.657 23.273 1.00 42.09 ? 552 ALA A CB 1 ATOM 3687 N N . TRP A 1 510 ? 17.966 54.895 26.083 1.00 42.47 ? 553 TRP A N 1 ATOM 3688 C CA . TRP A 1 510 ? 16.801 54.588 26.908 1.00 44.69 ? 553 TRP A CA 1 ATOM 3689 C C . TRP A 1 510 ? 16.291 55.837 27.614 1.00 54.34 ? 553 TRP A C 1 ATOM 3690 O O . TRP A 1 510 ? 15.078 56.013 27.790 1.00 46.61 ? 553 TRP A O 1 ATOM 3691 C CB . TRP A 1 510 ? 17.153 53.492 27.913 1.00 34.38 ? 553 TRP A CB 1 ATOM 3692 C CG . TRP A 1 510 ? 17.514 52.204 27.247 1.00 39.95 ? 553 TRP A CG 1 ATOM 3693 C CD1 . TRP A 1 510 ? 18.769 51.703 27.060 1.00 36.92 ? 553 TRP A CD1 1 ATOM 3694 C CD2 . TRP A 1 510 ? 16.613 51.260 26.657 1.00 36.92 ? 553 TRP A CD2 1 ATOM 3695 N NE1 . TRP A 1 510 ? 18.705 50.502 26.397 1.00 39.74 ? 553 TRP A NE1 1 ATOM 3696 C CE2 . TRP A 1 510 ? 17.392 50.208 26.137 1.00 35.14 ? 553 TRP A CE2 1 ATOM 3697 C CE3 . TRP A 1 510 ? 15.222 51.200 26.522 1.00 38.78 ? 553 TRP A CE3 1 ATOM 3698 C CZ2 . TRP A 1 510 ? 16.828 49.108 25.496 1.00 32.92 ? 553 TRP A CZ2 1 ATOM 3699 C CZ3 . TRP A 1 510 ? 14.663 50.108 25.882 1.00 34.14 ? 553 TRP A CZ3 1 ATOM 3700 C CH2 . TRP A 1 510 ? 15.464 49.076 25.381 1.00 31.22 ? 553 TRP A CH2 1 ATOM 3701 N N . HIS A 1 511 ? 17.205 56.715 28.022 1.00 38.20 ? 554 HIS A N 1 ATOM 3702 C CA . HIS A 1 511 ? 16.818 58.016 28.553 1.00 36.54 ? 554 HIS A CA 1 ATOM 3703 C C . HIS A 1 511 ? 15.956 58.772 27.545 1.00 50.19 ? 554 HIS A C 1 ATOM 3704 O O . HIS A 1 511 ? 14.803 59.144 27.827 1.00 48.11 ? 554 HIS A O 1 ATOM 3705 C CB . HIS A 1 511 ? 18.089 58.796 28.892 1.00 44.45 ? 554 HIS A CB 1 ATOM 3706 C CG . HIS A 1 511 ? 17.847 60.180 29.403 1.00 45.49 ? 554 HIS A CG 1 ATOM 3707 N ND1 . HIS A 1 511 ? 17.930 60.499 30.740 1.00 48.67 ? 554 HIS A ND1 1 ATOM 3708 C CD2 . HIS A 1 511 ? 17.537 61.329 28.758 1.00 42.77 ? 554 HIS A CD2 1 ATOM 3709 C CE1 . HIS A 1 511 ? 17.684 61.787 30.897 1.00 70.80 ? 554 HIS A CE1 1 ATOM 3710 N NE2 . HIS A 1 511 ? 17.436 62.313 29.710 1.00 58.46 ? 554 HIS A NE2 1 ATOM 3711 N N . ASN A 1 512 ? 16.504 58.986 26.342 1.00 45.09 ? 555 ASN A N 1 ATOM 3712 C CA . ASN A 1 512 ? 15.757 59.657 25.286 1.00 37.49 ? 555 ASN A CA 1 ATOM 3713 C C . ASN A 1 512 ? 14.437 58.956 25.002 1.00 40.82 ? 555 ASN A C 1 ATOM 3714 O O . ASN A 1 512 ? 13.457 59.610 24.633 1.00 38.11 ? 555 ASN A O 1 ATOM 3715 C CB . ASN A 1 512 ? 16.604 59.747 24.016 1.00 46.04 ? 555 ASN A CB 1 ATOM 3716 C CG . ASN A 1 512 ? 17.853 60.583 24.208 1.00 43.30 ? 555 ASN A CG 1 ATOM 3717 O OD1 . ASN A 1 512 ? 17.835 61.584 24.920 1.00 39.31 ? 555 ASN A OD1 1 ATOM 3718 N ND2 . ASN A 1 512 ? 18.945 60.177 23.573 1.00 45.63 ? 555 ASN A ND2 1 ATOM 3719 N N . LEU A 1 513 ? 14.391 57.632 25.146 1.00 43.76 ? 556 LEU A N 1 ATOM 3720 C CA . LEU A 1 513 ? 13.126 56.933 24.951 1.00 39.69 ? 556 LEU A CA 1 ATOM 3721 C C . LEU A 1 513 ? 12.122 57.306 26.036 1.00 42.50 ? 556 LEU A C 1 ATOM 3722 O O . LEU A 1 513 ? 10.931 57.480 25.753 1.00 41.82 ? 556 LEU A O 1 ATOM 3723 C CB . LEU A 1 513 ? 13.354 55.421 24.910 1.00 40.28 ? 556 LEU A CB 1 ATOM 3724 C CG . LEU A 1 513 ? 12.093 54.558 24.814 1.00 40.17 ? 556 LEU A CG 1 ATOM 3725 C CD1 . LEU A 1 513 ? 11.270 54.932 23.593 1.00 35.96 ? 556 LEU A CD1 1 ATOM 3726 C CD2 . LEU A 1 513 ? 12.458 53.082 24.783 1.00 48.91 ? 556 LEU A CD2 1 ATOM 3727 N N . VAL A 1 514 ? 12.579 57.429 27.286 1.00 40.99 ? 557 VAL A N 1 ATOM 3728 C CA . VAL A 1 514 ? 11.665 57.789 28.369 1.00 45.37 ? 557 VAL A CA 1 ATOM 3729 C C . VAL A 1 514 ? 11.075 59.171 28.123 1.00 55.74 ? 557 VAL A C 1 ATOM 3730 O O . VAL A 1 514 ? 9.848 59.351 28.095 1.00 51.92 ? 557 VAL A O 1 ATOM 3731 C CB . VAL A 1 514 ? 12.383 57.729 29.730 1.00 42.85 ? 557 VAL A CB 1 ATOM 3732 C CG1 . VAL A 1 514 ? 11.414 58.082 30.850 1.00 32.06 ? 557 VAL A CG1 1 ATOM 3733 C CG2 . VAL A 1 514 ? 12.996 56.361 29.957 1.00 54.86 ? 557 VAL A CG2 1 ATOM 3734 N N . TYR A 1 515 ? 11.938 60.170 27.917 1.00 42.81 ? 558 TYR A N 1 ATOM 3735 C CA . TYR A 1 515 ? 11.400 61.516 27.743 1.00 38.86 ? 558 TYR A CA 1 ATOM 3736 C C . TYR A 1 515 ? 10.627 61.639 26.437 1.00 47.35 ? 558 TYR A C 1 ATOM 3737 O O . TYR A 1 515 ? 9.695 62.445 26.340 1.00 49.58 ? 558 TYR A O 1 ATOM 3738 C CB . TYR A 1 515 ? 12.522 62.545 27.843 1.00 42.94 ? 558 TYR A CB 1 ATOM 3739 C CG . TYR A 1 515 ? 13.007 62.697 29.266 1.00 45.42 ? 558 TYR A CG 1 ATOM 3740 C CD1 . TYR A 1 515 ? 12.265 63.409 30.201 1.00 38.88 ? 558 TYR A CD1 1 ATOM 3741 C CD2 . TYR A 1 515 ? 14.183 62.097 29.685 1.00 38.62 ? 558 TYR A CD2 1 ATOM 3742 C CE1 . TYR A 1 515 ? 12.694 63.535 31.509 1.00 49.52 ? 558 TYR A CE1 1 ATOM 3743 C CE2 . TYR A 1 515 ? 14.616 62.216 30.990 1.00 57.72 ? 558 TYR A CE2 1 ATOM 3744 C CZ . TYR A 1 515 ? 13.873 62.938 31.898 1.00 60.74 ? 558 TYR A CZ 1 ATOM 3745 O OH . TYR A 1 515 ? 14.314 63.053 33.198 1.00 62.16 ? 558 TYR A OH 1 ATOM 3746 N N . ARG A 1 516 ? 10.999 60.846 25.432 1.00 54.22 ? 559 ARG A N 1 ATOM 3747 C CA . ARG A 1 516 ? 10.232 60.779 24.193 1.00 46.75 ? 559 ARG A CA 1 ATOM 3748 C C . ARG A 1 516 ? 8.827 60.234 24.435 1.00 47.77 ? 559 ARG A C 1 ATOM 3749 O O . ARG A 1 516 ? 7.867 60.664 23.785 1.00 46.74 ? 559 ARG A O 1 ATOM 3750 C CB . ARG A 1 516 ? 10.988 59.920 23.180 1.00 46.14 ? 559 ARG A CB 1 ATOM 3751 C CG . ARG A 1 516 ? 10.604 60.127 21.730 1.00 53.55 ? 559 ARG A CG 1 ATOM 3752 C CD . ARG A 1 516 ? 11.218 59.027 20.879 1.00 41.28 ? 559 ARG A CD 1 ATOM 3753 N NE . ARG A 1 516 ? 12.590 58.739 21.296 1.00 39.97 ? 559 ARG A NE 1 ATOM 3754 C CZ . ARG A 1 516 ? 13.267 57.650 20.947 1.00 41.20 ? 559 ARG A CZ 1 ATOM 3755 N NH1 . ARG A 1 516 ? 12.700 56.736 20.173 1.00 35.88 1 559 ARG A NH1 1 ATOM 3756 N NH2 . ARG A 1 516 ? 14.511 57.473 21.377 1.00 38.53 ? 559 ARG A NH2 1 ATOM 3757 N N . MET A 1 517 ? 8.685 59.275 25.355 1.00 46.42 ? 560 MET A N 1 ATOM 3758 C CA . MET A 1 517 ? 7.356 58.751 25.658 1.00 48.39 ? 560 MET A CA 1 ATOM 3759 C C . MET A 1 517 ? 6.539 59.709 26.512 1.00 57.40 ? 560 MET A C 1 ATOM 3760 O O . MET A 1 517 ? 5.308 59.736 26.396 1.00 45.46 ? 560 MET A O 1 ATOM 3761 C CB . MET A 1 517 ? 7.440 57.398 26.361 1.00 47.81 ? 560 MET A CB 1 ATOM 3762 C CG . MET A 1 517 ? 7.477 56.204 25.432 1.00 46.00 ? 560 MET A CG 1 ATOM 3763 S SD . MET A 1 517 ? 7.752 54.669 26.335 1.00 60.78 ? 560 MET A SD 1 ATOM 3764 C CE . MET A 1 517 ? 9.452 54.881 26.858 1.00 53.42 ? 560 MET A CE 1 ATOM 3765 N N . ARG A 1 518 ? 7.191 60.479 27.386 1.00 55.49 ? 561 ARG A N 1 ATOM 3766 C CA . ARG A 1 518 ? 6.464 61.516 28.109 1.00 46.17 ? 561 ARG A CA 1 ATOM 3767 C C . ARG A 1 518 ? 5.614 62.347 27.153 1.00 61.43 ? 561 ARG A C 1 ATOM 3768 O O . ARG A 1 518 ? 4.457 62.667 27.453 1.00 66.23 ? 561 ARG A O 1 ATOM 3769 C CB . ARG A 1 518 ? 7.451 62.399 28.876 1.00 51.16 ? 561 ARG A CB 1 ATOM 3770 C CG . ARG A 1 518 ? 6.855 63.639 29.521 1.00 47.10 ? 561 ARG A CG 1 ATOM 3771 C CD . ARG A 1 518 ? 7.968 64.520 30.072 1.00 57.31 ? 561 ARG A CD 1 ATOM 3772 N NE . ARG A 1 518 ? 7.565 65.917 30.206 1.00 86.40 ? 561 ARG A NE 1 ATOM 3773 C CZ . ARG A 1 518 ? 8.416 66.923 30.390 1.00 92.77 ? 561 ARG A CZ 1 ATOM 3774 N NH1 . ARG A 1 518 ? 9.719 66.687 30.457 1.00 76.38 1 561 ARG A NH1 1 ATOM 3775 N NH2 . ARG A 1 518 ? 7.965 68.165 30.501 1.00 108.88 ? 561 ARG A NH2 1 ATOM 3776 N N . GLY A 1 519 ? 6.172 62.696 25.993 1.00 57.82 ? 562 GLY A N 1 ATOM 3777 C CA . GLY A 1 519 ? 5.471 63.450 24.968 1.00 53.84 ? 562 GLY A CA 1 ATOM 3778 C C . GLY A 1 519 ? 4.491 62.692 24.089 1.00 66.33 ? 562 GLY A C 1 ATOM 3779 O O . GLY A 1 519 ? 3.361 63.149 23.888 1.00 78.33 ? 562 GLY A O 1 ATOM 3780 N N . ASP A 1 520 ? 4.901 61.541 23.551 1.00 51.85 ? 563 ASP A N 1 ATOM 3781 C CA . ASP A 1 520 ? 4.133 60.825 22.533 1.00 54.42 ? 563 ASP A CA 1 ATOM 3782 C C . ASP A 1 520 ? 3.338 59.703 23.194 1.00 58.33 ? 563 ASP A C 1 ATOM 3783 O O . ASP A 1 520 ? 3.918 58.729 23.686 1.00 58.78 ? 563 ASP A O 1 ATOM 3784 C CB . ASP A 1 520 ? 5.056 60.271 21.448 1.00 70.77 ? 563 ASP A CB 1 ATOM 3785 C CG . ASP A 1 520 ? 4.294 59.612 20.310 1.00 73.98 ? 563 ASP A CG 1 ATOM 3786 O OD1 . ASP A 1 520 ? 3.864 58.451 20.480 1.00 72.47 -1 563 ASP A OD1 1 ATOM 3787 O OD2 . ASP A 1 520 ? 4.132 60.250 19.246 1.00 71.10 ? 563 ASP A OD2 1 ATOM 3788 N N . MET A 1 521 ? 2.007 59.825 23.172 1.00 57.39 ? 564 MET A N 1 ATOM 3789 C CA . MET A 1 521 ? 1.166 58.854 23.867 1.00 49.21 ? 564 MET A CA 1 ATOM 3790 C C . MET A 1 521 ? 1.076 57.526 23.121 1.00 54.87 ? 564 MET A C 1 ATOM 3791 O O . MET A 1 521 ? 0.975 56.473 23.758 1.00 55.17 ? 564 MET A O 1 ATOM 3792 C CB . MET A 1 521 ? -0.229 59.433 24.096 1.00 42.19 ? 564 MET A CB 1 ATOM 3793 C CG . MET A 1 521 ? -1.154 58.502 24.867 1.00 52.97 ? 564 MET A CG 1 ATOM 3794 S SD . MET A 1 521 ? -0.519 58.040 26.497 1.00 87.53 ? 564 MET A SD 1 ATOM 3795 C CE . MET A 1 521 ? -0.961 59.481 27.464 1.00 70.26 ? 564 MET A CE 1 ATOM 3796 N N . GLN A 1 522 ? 1.086 57.547 21.785 1.00 61.93 ? 565 GLN A N 1 ATOM 3797 C CA . GLN A 1 522 ? 1.058 56.296 21.030 1.00 48.55 ? 565 GLN A CA 1 ATOM 3798 C C . GLN A 1 522 ? 2.269 55.434 21.360 1.00 53.07 ? 565 GLN A C 1 ATOM 3799 O O . GLN A 1 522 ? 2.143 54.231 21.627 1.00 58.35 ? 565 GLN A O 1 ATOM 3800 C CB . GLN A 1 522 ? 1.008 56.584 19.529 1.00 63.67 ? 565 GLN A CB 1 ATOM 3801 C CG . GLN A 1 522 ? 1.061 55.334 18.661 1.00 79.51 ? 565 GLN A CG 1 ATOM 3802 C CD . GLN A 1 522 ? 1.022 55.647 17.174 1.00 109.43 ? 565 GLN A CD 1 ATOM 3803 O OE1 . GLN A 1 522 ? 0.896 56.805 16.773 1.00 116.78 ? 565 GLN A OE1 1 ATOM 3804 N NE2 . GLN A 1 522 ? 1.141 54.611 16.347 1.00 119.73 ? 565 GLN A NE2 1 ATOM 3805 N N . LEU A 1 523 ? 3.457 56.042 21.354 1.00 51.34 ? 566 LEU A N 1 ATOM 3806 C CA . LEU A 1 523 ? 4.670 55.305 21.686 1.00 44.55 ? 566 LEU A CA 1 ATOM 3807 C C . LEU A 1 523 ? 4.555 54.658 23.059 1.00 45.70 ? 566 LEU A C 1 ATOM 3808 O O . LEU A 1 523 ? 4.818 53.459 23.221 1.00 41.77 ? 566 LEU A O 1 ATOM 3809 C CB . LEU A 1 523 ? 5.876 56.242 21.629 1.00 34.44 ? 566 LEU A CB 1 ATOM 3810 C CG . LEU A 1 523 ? 7.254 55.582 21.601 1.00 35.87 ? 566 LEU A CG 1 ATOM 3811 C CD1 . LEU A 1 523 ? 7.409 54.735 20.351 1.00 44.75 ? 566 LEU A CD1 1 ATOM 3812 C CD2 . LEU A 1 523 ? 8.347 56.636 21.676 1.00 48.79 ? 566 LEU A CD2 1 ATOM 3813 N N . PHE A 1 524 ? 4.145 55.435 24.064 1.00 46.88 ? 567 PHE A N 1 ATOM 3814 C CA . PHE A 1 524 ? 3.976 54.847 25.384 1.00 41.98 ? 567 PHE A CA 1 ATOM 3815 C C . PHE A 1 524 ? 2.952 53.724 25.353 1.00 41.02 ? 567 PHE A C 1 ATOM 3816 O O . PHE A 1 524 ? 3.084 52.744 26.087 1.00 52.58 ? 567 PHE A O 1 ATOM 3817 C CB . PHE A 1 524 ? 3.572 55.894 26.418 1.00 52.20 ? 567 PHE A CB 1 ATOM 3818 C CG . PHE A 1 524 ? 3.222 55.295 27.748 1.00 41.21 ? 567 PHE A CG 1 ATOM 3819 C CD1 . PHE A 1 524 ? 4.216 54.961 28.649 1.00 34.10 ? 567 PHE A CD1 1 ATOM 3820 C CD2 . PHE A 1 524 ? 1.904 55.027 28.079 1.00 41.37 ? 567 PHE A CD2 1 ATOM 3821 C CE1 . PHE A 1 524 ? 3.904 54.389 29.863 1.00 35.33 ? 567 PHE A CE1 1 ATOM 3822 C CE2 . PHE A 1 524 ? 1.586 54.456 29.292 1.00 46.66 ? 567 PHE A CE2 1 ATOM 3823 C CZ . PHE A 1 524 ? 2.587 54.138 30.186 1.00 43.09 ? 567 PHE A CZ 1 ATOM 3824 N N . GLN A 1 525 ? 1.905 53.859 24.537 1.00 37.20 ? 568 GLN A N 1 ATOM 3825 C CA . GLN A 1 525 ? 0.957 52.759 24.403 1.00 42.97 ? 568 GLN A CA 1 ATOM 3826 C C . GLN A 1 525 ? 1.657 51.499 23.918 1.00 50.11 ? 568 GLN A C 1 ATOM 3827 O O . GLN A 1 525 ? 1.358 50.393 24.386 1.00 36.82 ? 568 GLN A O 1 ATOM 3828 C CB . GLN A 1 525 ? -0.183 53.147 23.464 1.00 50.68 ? 568 GLN A CB 1 ATOM 3829 C CG . GLN A 1 525 ? -1.218 54.019 24.132 1.00 61.56 ? 568 GLN A CG 1 ATOM 3830 C CD . GLN A 1 525 ? -1.673 53.433 25.452 1.00 85.24 ? 568 GLN A CD 1 ATOM 3831 O OE1 . GLN A 1 525 ? -1.839 52.218 25.577 1.00 87.03 ? 568 GLN A OE1 1 ATOM 3832 N NE2 . GLN A 1 525 ? -1.860 54.290 26.451 1.00 79.17 ? 568 GLN A NE2 1 ATOM 3833 N N . THR A 1 526 ? 2.599 51.646 22.983 1.00 51.58 ? 569 THR A N 1 ATOM 3834 C CA . THR A 1 526 ? 3.410 50.503 22.572 1.00 46.82 ? 569 THR A CA 1 ATOM 3835 C C . THR A 1 526 ? 4.183 49.931 23.754 1.00 48.45 ? 569 THR A C 1 ATOM 3836 O O . THR A 1 526 ? 4.094 48.731 24.052 1.00 57.71 ? 569 THR A O 1 ATOM 3837 C CB . THR A 1 526 ? 4.368 50.913 21.452 1.00 46.55 ? 569 THR A CB 1 ATOM 3838 O OG1 . THR A 1 526 ? 3.618 51.343 20.309 1.00 54.36 ? 569 THR A OG1 1 ATOM 3839 C CG2 . THR A 1 526 ? 5.262 49.751 21.062 1.00 32.94 ? 569 THR A CG2 1 ATOM 3840 N N . PHE A 1 527 ? 4.948 50.782 24.445 1.00 51.27 ? 570 PHE A N 1 ATOM 3841 C CA . PHE A 1 527 ? 5.744 50.312 25.577 1.00 57.17 ? 570 PHE A CA 1 ATOM 3842 C C . PHE A 1 527 ? 4.883 49.649 26.646 1.00 44.51 ? 570 PHE A C 1 ATOM 3843 O O . PHE A 1 527 ? 5.367 48.786 27.384 1.00 37.64 ? 570 PHE A O 1 ATOM 3844 C CB . PHE A 1 527 ? 6.531 51.473 26.184 1.00 44.92 ? 570 PHE A CB 1 ATOM 3845 C CG . PHE A 1 527 ? 7.164 51.145 27.502 1.00 39.80 ? 570 PHE A CG 1 ATOM 3846 C CD1 . PHE A 1 527 ? 8.418 50.560 27.557 1.00 44.44 ? 570 PHE A CD1 1 ATOM 3847 C CD2 . PHE A 1 527 ? 6.502 51.417 28.688 1.00 37.22 ? 570 PHE A CD2 1 ATOM 3848 C CE1 . PHE A 1 527 ? 9.001 50.251 28.772 1.00 43.21 ? 570 PHE A CE1 1 ATOM 3849 C CE2 . PHE A 1 527 ? 7.078 51.111 29.902 1.00 37.41 ? 570 PHE A CE2 1 ATOM 3850 C CZ . PHE A 1 527 ? 8.330 50.528 29.945 1.00 42.29 ? 570 PHE A CZ 1 ATOM 3851 N N . TRP A 1 528 ? 3.624 50.061 26.761 1.00 42.93 ? 571 TRP A N 1 ATOM 3852 C CA . TRP A 1 528 ? 2.696 49.504 27.738 1.00 39.00 ? 571 TRP A CA 1 ATOM 3853 C C . TRP A 1 528 ? 2.195 48.143 27.281 1.00 40.68 ? 571 TRP A C 1 ATOM 3854 O O . TRP A 1 528 ? 2.103 47.206 28.082 1.00 50.11 ? 571 TRP A O 1 ATOM 3855 C CB . TRP A 1 528 ? 1.542 50.491 27.943 1.00 41.64 ? 571 TRP A CB 1 ATOM 3856 C CG . TRP A 1 528 ? 0.504 50.131 28.972 1.00 43.49 ? 571 TRP A CG 1 ATOM 3857 C CD1 . TRP A 1 528 ? -0.776 49.720 28.730 1.00 41.64 ? 571 TRP A CD1 1 ATOM 3858 C CD2 . TRP A 1 528 ? 0.638 50.198 30.397 1.00 41.41 ? 571 TRP A CD2 1 ATOM 3859 N NE1 . TRP A 1 528 ? -1.440 49.510 29.913 1.00 40.18 ? 571 TRP A NE1 1 ATOM 3860 C CE2 . TRP A 1 528 ? -0.594 49.796 30.952 1.00 47.71 ? 571 TRP A CE2 1 ATOM 3861 C CE3 . TRP A 1 528 ? 1.683 50.548 31.257 1.00 47.30 ? 571 TRP A CE3 1 ATOM 3862 C CZ2 . TRP A 1 528 ? -0.809 49.732 32.328 1.00 43.27 ? 571 TRP A CZ2 1 ATOM 3863 C CZ3 . TRP A 1 528 ? 1.467 50.483 32.623 1.00 53.89 ? 571 TRP A CZ3 1 ATOM 3864 C CH2 . TRP A 1 528 ? 0.231 50.077 33.144 1.00 43.64 ? 571 TRP A CH2 1 ATOM 3865 N N . PHE A 1 529 ? 1.885 48.022 25.990 1.00 47.21 ? 572 PHE A N 1 ATOM 3866 C CA . PHE A 1 529 ? 1.517 46.730 25.422 1.00 46.20 ? 572 PHE A CA 1 ATOM 3867 C C . PHE A 1 529 ? 2.626 45.705 25.633 1.00 47.20 ? 572 PHE A C 1 ATOM 3868 O O . PHE A 1 529 ? 2.374 44.582 26.085 1.00 39.93 ? 572 PHE A O 1 ATOM 3869 C CB . PHE A 1 529 ? 1.204 46.901 23.935 1.00 44.52 ? 572 PHE A CB 1 ATOM 3870 C CG . PHE A 1 529 ? 0.991 45.613 23.205 1.00 43.89 ? 572 PHE A CG 1 ATOM 3871 C CD1 . PHE A 1 529 ? -0.199 44.919 23.328 1.00 46.57 ? 572 PHE A CD1 1 ATOM 3872 C CD2 . PHE A 1 529 ? 1.980 45.100 22.384 1.00 42.65 ? 572 PHE A CD2 1 ATOM 3873 C CE1 . PHE A 1 529 ? -0.397 43.731 22.654 1.00 44.41 ? 572 PHE A CE1 1 ATOM 3874 C CE2 . PHE A 1 529 ? 1.788 43.912 21.708 1.00 45.00 ? 572 PHE A CE2 1 ATOM 3875 C CZ . PHE A 1 529 ? 0.598 43.227 21.843 1.00 47.86 ? 572 PHE A CZ 1 ATOM 3876 N N . LEU A 1 530 ? 3.869 46.079 25.322 1.00 46.37 ? 573 LEU A N 1 ATOM 3877 C CA . LEU A 1 530 ? 4.980 45.155 25.529 1.00 34.69 ? 573 LEU A CA 1 ATOM 3878 C C . LEU A 1 530 ? 5.278 44.957 27.011 1.00 41.62 ? 573 LEU A C 1 ATOM 3879 O O . LEU A 1 530 ? 5.723 43.878 27.417 1.00 43.88 ? 573 LEU A O 1 ATOM 3880 C CB . LEU A 1 530 ? 6.213 45.671 24.792 1.00 36.14 ? 573 LEU A CB 1 ATOM 3881 C CG . LEU A 1 530 ? 5.994 45.816 23.285 1.00 39.29 ? 573 LEU A CG 1 ATOM 3882 C CD1 . LEU A 1 530 ? 7.222 46.392 22.597 1.00 33.72 ? 573 LEU A CD1 1 ATOM 3883 C CD2 . LEU A 1 530 ? 5.621 44.472 22.681 1.00 48.34 ? 573 LEU A CD2 1 ATOM 3884 N N . TYR A 1 531 ? 5.038 45.991 27.820 1.00 47.11 ? 574 TYR A N 1 ATOM 3885 C CA . TYR A 1 531 ? 5.226 45.920 29.266 1.00 42.10 ? 574 TYR A CA 1 ATOM 3886 C C . TYR A 1 531 ? 4.546 44.689 29.843 1.00 48.35 ? 574 TYR A C 1 ATOM 3887 O O . TYR A 1 531 ? 5.121 43.976 30.673 1.00 37.85 ? 574 TYR A O 1 ATOM 3888 C CB . TYR A 1 531 ? 4.661 47.201 29.891 1.00 47.97 ? 574 TYR A CB 1 ATOM 3889 C CG . TYR A 1 531 ? 4.893 47.427 31.374 1.00 55.80 ? 574 TYR A CG 1 ATOM 3890 C CD1 . TYR A 1 531 ? 6.050 48.049 31.832 1.00 47.22 ? 574 TYR A CD1 1 ATOM 3891 C CD2 . TYR A 1 531 ? 3.928 47.069 32.312 1.00 59.50 ? 574 TYR A CD2 1 ATOM 3892 C CE1 . TYR A 1 531 ? 6.252 48.282 33.181 1.00 42.08 ? 574 TYR A CE1 1 ATOM 3893 C CE2 . TYR A 1 531 ? 4.123 47.298 33.664 1.00 55.06 ? 574 TYR A CE2 1 ATOM 3894 C CZ . TYR A 1 531 ? 5.285 47.905 34.093 1.00 58.85 ? 574 TYR A CZ 1 ATOM 3895 O OH . TYR A 1 531 ? 5.482 48.136 35.436 1.00 52.37 ? 574 TYR A OH 1 ATOM 3896 N N . HIS A 1 532 ? 3.326 44.418 29.394 1.00 42.41 ? 575 HIS A N 1 ATOM 3897 C CA . HIS A 1 532 ? 2.523 43.296 29.850 1.00 37.68 ? 575 HIS A CA 1 ATOM 3898 C C . HIS A 1 532 ? 2.748 42.038 29.019 1.00 44.02 ? 575 HIS A C 1 ATOM 3899 O O . HIS A 1 532 ? 1.998 41.068 29.170 1.00 56.12 ? 575 HIS A O 1 ATOM 3900 C CB . HIS A 1 532 ? 1.044 43.685 29.843 1.00 38.02 ? 575 HIS A CB 1 ATOM 3901 C CG . HIS A 1 532 ? 0.727 44.836 30.748 1.00 66.30 ? 575 HIS A CG 1 ATOM 3902 N ND1 . HIS A 1 532 ? 0.690 44.715 32.122 1.00 59.15 ? 575 HIS A ND1 1 ATOM 3903 C CD2 . HIS A 1 532 ? 0.449 46.133 30.478 1.00 48.14 ? 575 HIS A CD2 1 ATOM 3904 C CE1 . HIS A 1 532 ? 0.396 45.887 32.657 1.00 38.46 ? 575 HIS A CE1 1 ATOM 3905 N NE2 . HIS A 1 532 ? 0.245 46.764 31.681 1.00 47.16 ? 575 HIS A NE2 1 ATOM 3906 N N . LYS A 1 533 ? 3.739 42.043 28.128 1.00 41.89 ? 576 LYS A N 1 ATOM 3907 C CA . LYS A 1 533 ? 4.025 40.894 27.273 1.00 45.49 ? 576 LYS A CA 1 ATOM 3908 C C . LYS A 1 533 ? 2.872 40.614 26.314 1.00 40.08 ? 576 LYS A C 1 ATOM 3909 O O . LYS A 1 533 ? 2.595 39.462 25.975 1.00 43.60 ? 576 LYS A O 1 ATOM 3910 C CB . LYS A 1 533 ? 4.340 39.646 28.103 1.00 44.31 ? 576 LYS A CB 1 ATOM 3911 C CG . LYS A 1 533 ? 5.693 39.674 28.802 1.00 52.48 ? 576 LYS A CG 1 ATOM 3912 C CD . LYS A 1 533 ? 5.854 38.476 29.732 1.00 43.97 ? 576 LYS A CD 1 ATOM 3913 C CE . LYS A 1 533 ? 4.798 38.488 30.830 1.00 42.65 ? 576 LYS A CE 1 ATOM 3914 N NZ . LYS A 1 533 ? 4.949 37.344 31.771 1.00 40.32 1 576 LYS A NZ 1 ATOM 3915 N N . GLY A 1 534 ? 2.187 41.665 25.875 1.00 33.63 ? 577 GLY A N 1 ATOM 3916 C CA . GLY A 1 534 ? 1.139 41.536 24.891 1.00 36.96 ? 577 GLY A CA 1 ATOM 3917 C C . GLY A 1 534 ? -0.249 41.327 25.450 1.00 42.02 ? 577 GLY A C 1 ATOM 3918 O O . GLY A 1 534 ? -1.186 41.128 24.667 1.00 59.20 ? 577 GLY A O 1 ATOM 3919 N N . HIS A 1 535 ? -0.414 41.354 26.769 1.00 40.73 ? 578 HIS A N 1 ATOM 3920 C CA . HIS A 1 535 ? -1.714 41.174 27.416 1.00 43.16 ? 578 HIS A CA 1 ATOM 3921 C C . HIS A 1 535 ? -1.925 42.292 28.428 1.00 58.21 ? 578 HIS A C 1 ATOM 3922 O O . HIS A 1 535 ? -1.987 42.050 29.639 1.00 60.06 ? 578 HIS A O 1 ATOM 3923 C CB . HIS A 1 535 ? -1.810 39.805 28.091 1.00 45.14 ? 578 HIS A CB 1 ATOM 3924 C CG . HIS A 1 535 ? -3.211 39.387 28.412 1.00 45.52 ? 578 HIS A CG 1 ATOM 3925 N ND1 . HIS A 1 535 ? -4.040 38.790 27.487 1.00 52.53 ? 578 HIS A ND1 1 ATOM 3926 C CD2 . HIS A 1 535 ? -3.933 39.490 29.552 1.00 60.42 ? 578 HIS A CD2 1 ATOM 3927 C CE1 . HIS A 1 535 ? -5.210 38.535 28.046 1.00 49.85 ? 578 HIS A CE1 1 ATOM 3928 N NE2 . HIS A 1 535 ? -5.172 38.951 29.299 1.00 68.80 ? 578 HIS A NE2 1 ATOM 3929 N N . PRO A 1 536 ? -2.041 43.533 27.965 1.00 64.45 ? 579 PRO A N 1 ATOM 3930 C CA . PRO A 1 536 ? -2.247 44.649 28.890 1.00 54.14 ? 579 PRO A CA 1 ATOM 3931 C C . PRO A 1 536 ? -3.607 44.546 29.555 1.00 65.32 ? 579 PRO A C 1 ATOM 3932 O O . PRO A 1 536 ? -4.525 43.911 29.014 1.00 61.39 ? 579 PRO A O 1 ATOM 3933 C CB . PRO A 1 536 ? -2.162 45.882 27.981 1.00 49.90 ? 579 PRO A CB 1 ATOM 3934 C CG . PRO A 1 536 ? -2.581 45.377 26.645 1.00 48.77 ? 579 PRO A CG 1 ATOM 3935 C CD . PRO A 1 536 ? -2.050 43.972 26.559 1.00 52.13 ? 579 PRO A CD 1 ATOM 3936 N N . PRO A 1 537 ? -3.777 45.152 30.729 1.00 69.14 ? 580 PRO A N 1 ATOM 3937 C CA . PRO A 1 537 ? -5.053 45.014 31.441 1.00 51.35 ? 580 PRO A CA 1 ATOM 3938 C C . PRO A 1 537 ? -6.171 45.786 30.763 1.00 56.61 ? 580 PRO A C 1 ATOM 3939 O O . PRO A 1 537 ? -5.938 46.503 29.786 1.00 43.83 ? 580 PRO A O 1 ATOM 3940 C CB . PRO A 1 537 ? -4.738 45.579 32.829 1.00 67.19 ? 580 PRO A CB 1 ATOM 3941 C CG . PRO A 1 537 ? -3.643 46.561 32.580 1.00 69.80 ? 580 PRO A CG 1 ATOM 3942 C CD . PRO A 1 537 ? -2.813 45.983 31.469 1.00 59.33 ? 580 PRO A CD 1 ATOM 3943 N N . SER A 1 538 ? -7.386 45.666 31.298 1.00 81.52 ? 581 SER A N 1 ATOM 3944 C CA . SER A 1 538 ? -8.531 46.346 30.706 1.00 79.15 ? 581 SER A CA 1 ATOM 3945 C C . SER A 1 538 ? -8.539 47.838 31.015 1.00 88.69 ? 581 SER A C 1 ATOM 3946 O O . SER A 1 538 ? -9.008 48.631 30.192 1.00 88.57 ? 581 SER A O 1 ATOM 3947 C CB . SER A 1 538 ? -9.829 45.696 31.185 1.00 90.42 ? 581 SER A CB 1 ATOM 3948 O OG . SER A 1 538 ? -9.716 44.283 31.184 1.00 92.79 ? 581 SER A OG 1 ATOM 3949 N N . GLU A 1 539 ? -8.040 48.238 32.181 1.00 81.04 ? 582 GLU A N 1 ATOM 3950 C CA . GLU A 1 539 ? -8.025 49.652 32.522 1.00 78.24 ? 582 GLU A CA 1 ATOM 3951 C C . GLU A 1 539 ? -7.101 50.402 31.564 1.00 79.09 ? 582 GLU A C 1 ATOM 3952 O O . GLU A 1 539 ? -5.996 49.930 31.268 1.00 74.17 ? 582 GLU A O 1 ATOM 3953 C CB . GLU A 1 539 ? -7.584 49.851 33.972 1.00 99.12 ? 582 GLU A CB 1 ATOM 3954 C CG . GLU A 1 539 ? -8.583 49.299 34.984 1.00 97.19 ? 582 GLU A CG 1 ATOM 3955 C CD . GLU A 1 539 ? -8.445 49.934 36.354 1.00 104.69 ? 582 GLU A CD 1 ATOM 3956 O OE1 . GLU A 1 539 ? -8.048 51.117 36.423 1.00 87.10 ? 582 GLU A OE1 1 ATOM 3957 O OE2 . GLU A 1 539 ? -8.734 49.252 37.360 1.00 116.62 -1 582 GLU A OE2 1 ATOM 3958 N N . PRO A 1 540 ? -7.506 51.582 31.084 1.00 81.19 ? 583 PRO A N 1 ATOM 3959 C CA . PRO A 1 540 ? -6.766 52.224 29.984 1.00 81.07 ? 583 PRO A CA 1 ATOM 3960 C C . PRO A 1 540 ? -5.378 52.737 30.343 1.00 85.30 ? 583 PRO A C 1 ATOM 3961 O O . PRO A 1 540 ? -4.582 52.975 29.425 1.00 97.77 ? 583 PRO A O 1 ATOM 3962 C CB . PRO A 1 540 ? -7.687 53.382 29.577 1.00 74.42 ? 583 PRO A CB 1 ATOM 3963 C CG . PRO A 1 540 ? -8.472 53.682 30.808 1.00 96.73 ? 583 PRO A CG 1 ATOM 3964 C CD . PRO A 1 540 ? -8.685 52.363 31.493 1.00 99.36 ? 583 PRO A CD 1 ATOM 3965 N N . CYS A 1 541 ? -5.048 52.921 31.620 1.00 89.24 ? 584 CYS A N 1 ATOM 3966 C CA . CYS A 1 541 ? -3.764 53.512 31.999 1.00 99.25 ? 584 CYS A CA 1 ATOM 3967 C C . CYS A 1 541 ? -3.626 54.927 31.423 1.00 88.60 ? 584 CYS A C 1 ATOM 3968 O O . CYS A 1 541 ? -2.892 55.175 30.465 1.00 84.28 ? 584 CYS A O 1 ATOM 3969 C CB . CYS A 1 541 ? -2.589 52.637 31.545 1.00 84.40 ? 584 CYS A CB 1 ATOM 3970 S SG . CYS A 1 541 ? -0.954 53.387 31.856 1.00 110.89 ? 584 CYS A SG 1 ATOM 3971 N N . GLY A 1 542 ? -4.375 55.846 32.020 1.00 95.16 ? 585 GLY A N 1 ATOM 3972 C CA . GLY A 1 542 ? -4.338 57.225 31.586 1.00 89.52 ? 585 GLY A CA 1 ATOM 3973 C C . GLY A 1 542 ? -3.061 57.933 32.018 1.00 82.53 ? 585 GLY A C 1 ATOM 3974 O O . GLY A 1 542 ? -2.069 57.331 32.431 1.00 84.26 ? 585 GLY A O 1 ATOM 3975 N N . THR A 1 543 ? -3.102 59.260 31.896 1.00 83.14 ? 586 THR A N 1 ATOM 3976 C CA . THR A 1 543 ? -1.912 60.096 32.062 1.00 86.28 ? 586 THR A CA 1 ATOM 3977 C C . THR A 1 543 ? -1.153 59.830 33.358 1.00 71.57 ? 586 THR A C 1 ATOM 3978 O O . THR A 1 543 ? 0.072 59.623 33.298 1.00 66.54 ? 586 THR A O 1 ATOM 3979 C CB . THR A 1 543 ? -2.315 61.574 31.944 1.00 75.64 ? 586 THR A CB 1 ATOM 3980 O OG1 . THR A 1 543 ? -3.290 61.897 32.942 1.00 74.87 ? 586 THR A OG1 1 ATOM 3981 C CG2 . THR A 1 543 ? -2.903 61.852 30.567 1.00 71.78 ? 586 THR A CG2 1 ATOM 3982 N N . PRO A 1 544 ? -1.782 59.844 34.539 1.00 69.66 ? 587 PRO A N 1 ATOM 3983 C CA . PRO A 1 544 ? -1.008 59.600 35.768 1.00 72.07 ? 587 PRO A CA 1 ATOM 3984 C C . PRO A 1 544 ? -0.350 58.234 35.785 1.00 68.32 ? 587 PRO A C 1 ATOM 3985 O O . PRO A 1 544 ? 0.770 58.090 36.292 1.00 59.22 ? 587 PRO A O 1 ATOM 3986 C CB . PRO A 1 544 ? -2.063 59.739 36.874 1.00 42.53 ? 587 PRO A CB 1 ATOM 3987 C CG . PRO A 1 544 ? -3.336 59.359 36.212 1.00 50.30 ? 587 PRO A CG 1 ATOM 3988 C CD . PRO A 1 544 ? -3.232 59.869 34.800 1.00 59.32 ? 587 PRO A CD 1 ATOM 3989 N N . CYS A 1 545 ? -1.027 57.218 35.249 1.00 66.87 ? 588 CYS A N 1 ATOM 3990 C CA . CYS A 1 545 ? -0.411 55.904 35.108 1.00 60.40 ? 588 CYS A CA 1 ATOM 3991 C C . CYS A 1 545 ? 0.878 56.000 34.298 1.00 60.68 ? 588 CYS A C 1 ATOM 3992 O O . CYS A 1 545 ? 1.937 55.519 34.724 1.00 50.79 ? 588 CYS A O 1 ATOM 3993 C CB . CYS A 1 545 ? -1.408 54.944 34.455 1.00 60.16 ? 588 CYS A CB 1 ATOM 3994 S SG . CYS A 1 545 ? -0.748 53.358 33.881 1.00 105.65 ? 588 CYS A SG 1 ATOM 3995 N N . ARG A 1 546 ? 0.811 56.644 33.130 1.00 55.06 ? 589 ARG A N 1 ATOM 3996 C CA . ARG A 1 546 ? 2.008 56.822 32.318 1.00 42.59 ? 589 ARG A CA 1 ATOM 3997 C C . ARG A 1 546 ? 3.115 57.497 33.117 1.00 45.44 ? 589 ARG A C 1 ATOM 3998 O O . ARG A 1 546 ? 4.258 57.026 33.139 1.00 45.12 ? 589 ARG A O 1 ATOM 3999 C CB . ARG A 1 546 ? 1.681 57.634 31.064 1.00 45.02 ? 589 ARG A CB 1 ATOM 4000 C CG . ARG A 1 546 ? 2.911 57.995 30.235 1.00 39.42 ? 589 ARG A CG 1 ATOM 4001 C CD . ARG A 1 546 ? 2.541 58.716 28.951 1.00 53.02 ? 589 ARG A CD 1 ATOM 4002 N NE . ARG A 1 546 ? 1.882 59.994 29.201 1.00 65.67 ? 589 ARG A NE 1 ATOM 4003 C CZ . ARG A 1 546 ? 1.686 60.926 28.274 1.00 66.08 ? 589 ARG A CZ 1 ATOM 4004 N NH1 . ARG A 1 546 ? 2.102 60.728 27.031 1.00 53.67 1 589 ARG A NH1 1 ATOM 4005 N NH2 . ARG A 1 546 ? 1.073 62.059 28.588 1.00 91.41 ? 589 ARG A NH2 1 ATOM 4006 N N . LEU A 1 547 ? 2.789 58.595 33.801 1.00 55.20 ? 590 LEU A N 1 ATOM 4007 C CA . LEU A 1 547 ? 3.814 59.320 34.547 1.00 57.81 ? 590 LEU A CA 1 ATOM 4008 C C . LEU A 1 547 ? 4.457 58.431 35.604 1.00 54.67 ? 590 LEU A C 1 ATOM 4009 O O . LEU A 1 547 ? 5.687 58.398 35.745 1.00 52.83 ? 590 LEU A O 1 ATOM 4010 C CB . LEU A 1 547 ? 3.214 60.569 35.188 1.00 69.34 ? 590 LEU A CB 1 ATOM 4011 C CG . LEU A 1 547 ? 4.195 61.734 35.295 1.00 81.85 ? 590 LEU A CG 1 ATOM 4012 C CD1 . LEU A 1 547 ? 4.565 62.235 33.907 1.00 69.92 ? 590 LEU A CD1 1 ATOM 4013 C CD2 . LEU A 1 547 ? 3.613 62.854 36.141 1.00 99.18 ? 590 LEU A CD2 1 ATOM 4014 N N . ALA A 1 548 ? 3.635 57.704 36.362 1.00 55.31 ? 591 ALA A N 1 ATOM 4015 C CA . ALA A 1 548 ? 4.171 56.779 37.353 1.00 45.35 ? 591 ALA A CA 1 ATOM 4016 C C . ALA A 1 548 ? 5.118 55.776 36.709 1.00 57.39 ? 591 ALA A C 1 ATOM 4017 O O . ALA A 1 548 ? 6.199 55.496 37.244 1.00 42.23 ? 591 ALA A O 1 ATOM 4018 C CB . ALA A 1 548 ? 3.029 56.056 38.066 1.00 37.71 ? 591 ALA A CB 1 ATOM 4019 N N . THR A 1 549 ? 4.729 55.227 35.555 1.00 55.24 ? 592 THR A N 1 ATOM 4020 C CA . THR A 1 549 ? 5.540 54.200 34.910 1.00 38.06 ? 592 THR A CA 1 ATOM 4021 C C . THR A 1 549 ? 6.877 54.761 34.439 1.00 43.86 ? 592 THR A C 1 ATOM 4022 O O . THR A 1 549 ? 7.935 54.194 34.734 1.00 54.42 ? 592 THR A O 1 ATOM 4023 C CB . THR A 1 549 ? 4.771 53.589 33.743 1.00 42.56 ? 592 THR A CB 1 ATOM 4024 O OG1 . THR A 1 549 ? 3.517 53.085 34.218 1.00 48.42 ? 592 THR A OG1 1 ATOM 4025 C CG2 . THR A 1 549 ? 5.568 52.450 33.128 1.00 46.86 ? 592 THR A CG2 1 ATOM 4026 N N . LEU A 1 550 ? 6.852 55.873 33.701 1.00 38.64 ? 593 LEU A N 1 ATOM 4027 C CA . LEU A 1 550 ? 8.100 56.464 33.231 1.00 40.46 ? 593 LEU A CA 1 ATOM 4028 C C . LEU A 1 550 ? 9.008 56.808 34.404 1.00 43.69 ? 593 LEU A C 1 ATOM 4029 O O . LEU A 1 550 ? 10.215 56.519 34.382 1.00 45.61 ? 593 LEU A O 1 ATOM 4030 C CB . LEU A 1 550 ? 7.798 57.698 32.378 1.00 46.79 ? 593 LEU A CB 1 ATOM 4031 C CG . LEU A 1 550 ? 6.815 57.450 31.225 1.00 42.21 ? 593 LEU A CG 1 ATOM 4032 C CD1 . LEU A 1 550 ? 6.507 58.725 30.452 1.00 34.68 ? 593 LEU A CD1 1 ATOM 4033 C CD2 . LEU A 1 550 ? 7.334 56.365 30.293 1.00 37.22 ? 593 LEU A CD2 1 ATOM 4034 N N . CYS A 1 551 ? 8.436 57.419 35.446 1.00 53.87 ? 594 CYS A N 1 ATOM 4035 C CA . CYS A 1 551 ? 9.197 57.683 36.660 1.00 55.68 ? 594 CYS A CA 1 ATOM 4036 C C . CYS A 1 551 ? 9.839 56.406 37.185 1.00 52.50 ? 594 CYS A C 1 ATOM 4037 O O . CYS A 1 551 ? 11.005 56.409 37.597 1.00 49.22 ? 594 CYS A O 1 ATOM 4038 C CB . CYS A 1 551 ? 8.282 58.309 37.714 1.00 64.40 ? 594 CYS A CB 1 ATOM 4039 S SG . CYS A 1 551 ? 9.040 58.585 39.333 1.00 92.35 ? 594 CYS A SG 1 ATOM 4040 N N . ALA A 1 552 ? 9.096 55.296 37.161 1.00 40.62 ? 595 ALA A N 1 ATOM 4041 C CA . ALA A 1 552 ? 9.675 54.017 37.557 1.00 29.80 ? 595 ALA A CA 1 ATOM 4042 C C . ALA A 1 552 ? 10.868 53.668 36.680 1.00 40.08 ? 595 ALA A C 1 ATOM 4043 O O . ALA A 1 552 ? 11.897 53.193 37.175 1.00 44.69 ? 595 ALA A O 1 ATOM 4044 C CB . ALA A 1 552 ? 8.618 52.916 37.488 1.00 32.26 ? 595 ALA A CB 1 ATOM 4045 N N . GLN A 1 553 ? 10.744 53.891 35.370 1.00 44.40 ? 596 GLN A N 1 ATOM 4046 C CA . GLN A 1 553 ? 11.840 53.594 34.457 1.00 37.81 ? 596 GLN A CA 1 ATOM 4047 C C . GLN A 1 553 ? 13.080 54.407 34.793 1.00 45.64 ? 596 GLN A C 1 ATOM 4048 O O . GLN A 1 553 ? 14.206 53.953 34.552 1.00 40.97 ? 596 GLN A O 1 ATOM 4049 C CB . GLN A 1 553 ? 11.413 53.868 33.016 1.00 35.98 ? 596 GLN A CB 1 ATOM 4050 C CG . GLN A 1 553 ? 10.056 53.300 32.653 1.00 35.24 ? 596 GLN A CG 1 ATOM 4051 C CD . GLN A 1 553 ? 9.921 51.835 33.014 1.00 50.85 ? 596 GLN A CD 1 ATOM 4052 O OE1 . GLN A 1 553 ? 10.889 51.071 32.951 1.00 48.84 ? 596 GLN A OE1 1 ATOM 4053 N NE2 . GLN A 1 553 ? 8.713 51.432 33.390 1.00 51.48 ? 596 GLN A NE2 1 ATOM 4054 N N . LEU A 1 554 ? 12.902 55.606 35.345 1.00 48.25 ? 597 LEU A N 1 ATOM 4055 C CA . LEU A 1 554 ? 14.050 56.450 35.646 1.00 54.57 ? 597 LEU A CA 1 ATOM 4056 C C . LEU A 1 554 ? 14.611 56.261 37.052 1.00 52.66 ? 597 LEU A C 1 ATOM 4057 O O . LEU A 1 554 ? 15.688 56.794 37.341 1.00 56.95 ? 597 LEU A O 1 ATOM 4058 C CB . LEU A 1 554 ? 13.689 57.925 35.444 1.00 51.04 ? 597 LEU A CB 1 ATOM 4059 C CG . LEU A 1 554 ? 13.439 58.346 33.994 1.00 53.21 ? 597 LEU A CG 1 ATOM 4060 C CD1 . LEU A 1 554 ? 13.282 59.856 33.884 1.00 57.51 ? 597 LEU A CD1 1 ATOM 4061 C CD2 . LEU A 1 554 ? 14.560 57.853 33.090 1.00 46.73 ? 597 LEU A CD2 1 ATOM 4062 N N . SER A 1 555 ? 13.946 55.509 37.927 1.00 48.54 ? 598 SER A N 1 ATOM 4063 C CA . SER A 1 555 ? 14.389 55.394 39.315 1.00 46.41 ? 598 SER A CA 1 ATOM 4064 C C . SER A 1 555 ? 15.105 54.062 39.510 1.00 51.99 ? 598 SER A C 1 ATOM 4065 O O . SER A 1 555 ? 14.470 53.029 39.734 1.00 44.32 ? 598 SER A O 1 ATOM 4066 C CB . SER A 1 555 ? 13.191 55.507 40.251 1.00 35.52 ? 598 SER A CB 1 ATOM 4067 O OG . SER A 1 555 ? 12.434 56.672 39.971 1.00 57.26 ? 598 SER A OG 1 ATOM 4068 N N . ALA A 1 556 ? 16.436 54.108 39.521 1.00 45.19 ? 599 ALA A N 1 ATOM 4069 C CA . ALA A 1 556 ? 17.266 52.964 39.866 1.00 38.04 ? 599 ALA A CA 1 ATOM 4070 C C . ALA A 1 556 ? 17.728 53.014 41.312 1.00 49.20 ? 599 ALA A C 1 ATOM 4071 O O . ALA A 1 556 ? 18.394 52.084 41.779 1.00 47.08 ? 599 ALA A O 1 ATOM 4072 C CB . ALA A 1 556 ? 18.478 52.888 38.932 1.00 41.15 ? 599 ALA A CB 1 ATOM 4073 N N . ARG A 1 557 ? 17.385 54.078 42.026 1.00 48.14 ? 600 ARG A N 1 ATOM 4074 C CA . ARG A 1 557 ? 17.780 54.275 43.410 1.00 43.65 ? 600 ARG A CA 1 ATOM 4075 C C . ARG A 1 557 ? 16.507 54.458 44.218 1.00 46.80 ? 600 ARG A C 1 ATOM 4076 O O . ARG A 1 557 ? 15.697 55.339 43.910 1.00 53.39 ? 600 ARG A O 1 ATOM 4077 C CB . ARG A 1 557 ? 18.711 55.479 43.558 1.00 42.06 ? 600 ARG A CB 1 ATOM 4078 C CG . ARG A 1 557 ? 19.368 55.575 44.920 1.00 45.11 ? 600 ARG A CG 1 ATOM 4079 C CD . ARG A 1 557 ? 20.494 56.589 44.922 1.00 40.88 ? 600 ARG A CD 1 ATOM 4080 N NE . ARG A 1 557 ? 20.006 57.952 44.749 1.00 39.29 ? 600 ARG A NE 1 ATOM 4081 C CZ . ARG A 1 557 ? 20.792 59.023 44.717 1.00 48.31 ? 600 ARG A CZ 1 ATOM 4082 N NH1 . ARG A 1 557 ? 22.107 58.882 44.842 1.00 45.33 1 600 ARG A NH1 1 ATOM 4083 N NH2 . ARG A 1 557 ? 20.264 60.230 44.559 1.00 36.76 ? 600 ARG A NH2 1 ATOM 4084 N N . ALA A 1 558 ? 16.322 53.614 45.230 1.00 41.46 ? 601 ALA A N 1 ATOM 4085 C CA . ALA A 1 558 ? 15.126 53.694 46.054 1.00 54.22 ? 601 ALA A CA 1 ATOM 4086 C C . ALA A 1 558 ? 15.016 55.080 46.676 1.00 57.24 ? 601 ALA A C 1 ATOM 4087 O O . ALA A 1 558 ? 16.017 55.753 46.933 1.00 56.23 ? 601 ALA A O 1 ATOM 4088 C CB . ALA A 1 558 ? 15.149 52.619 47.139 1.00 49.55 ? 601 ALA A CB 1 ATOM 4089 N N . ASP A 1 559 ? 13.780 55.504 46.921 1.00 63.65 ? 602 ASP A N 1 ATOM 4090 C CA . ASP A 1 559 ? 13.505 56.877 47.354 1.00 66.42 ? 602 ASP A CA 1 ATOM 4091 C C . ASP A 1 559 ? 13.985 57.763 46.207 1.00 83.71 ? 602 ASP A C 1 ATOM 4092 O O . ASP A 1 559 ? 13.631 57.487 45.048 1.00 104.25 ? 602 ASP A O 1 ATOM 4093 C CB . ASP A 1 559 ? 14.139 57.152 48.713 1.00 80.28 ? 602 ASP A CB 1 ATOM 4094 C CG . ASP A 1 559 ? 13.631 56.215 49.800 1.00 94.79 ? 602 ASP A CG 1 ATOM 4095 O OD1 . ASP A 1 559 ? 13.050 55.158 49.468 1.00 82.08 ? 602 ASP A OD1 1 ATOM 4096 O OD2 . ASP A 1 559 ? 13.816 56.538 50.993 1.00 99.10 -1 602 ASP A OD2 1 ATOM 4097 N N . SER A 1 560 ? 14.783 58.795 46.459 1.00 71.87 ? 603 SER A N 1 ATOM 4098 C CA . SER A 1 560 ? 15.285 59.674 45.409 1.00 78.73 ? 603 SER A CA 1 ATOM 4099 C C . SER A 1 560 ? 14.156 60.128 44.482 1.00 82.75 ? 603 SER A C 1 ATOM 4100 O O . SER A 1 560 ? 14.141 59.781 43.294 1.00 78.84 ? 603 SER A O 1 ATOM 4101 C CB . SER A 1 560 ? 16.392 58.995 44.614 1.00 58.53 ? 603 SER A CB 1 ATOM 4102 O OG . SER A 1 560 ? 17.560 58.808 45.393 1.00 51.02 ? 603 SER A OG 1 ATOM 4103 N N . PRO A 1 561 ? 13.182 60.886 44.992 1.00 78.82 ? 604 PRO A N 1 ATOM 4104 C CA . PRO A 1 561 ? 12.118 61.386 44.109 1.00 69.64 ? 604 PRO A CA 1 ATOM 4105 C C . PRO A 1 561 ? 12.637 62.356 43.062 1.00 69.23 ? 604 PRO A C 1 ATOM 4106 O O . PRO A 1 561 ? 12.068 62.441 41.965 1.00 74.31 ? 604 PRO A O 1 ATOM 4107 C CB . PRO A 1 561 ? 11.140 62.058 45.082 1.00 61.97 ? 604 PRO A CB 1 ATOM 4108 C CG . PRO A 1 561 ? 11.987 62.436 46.258 1.00 72.64 ? 604 PRO A CG 1 ATOM 4109 C CD . PRO A 1 561 ? 13.018 61.349 46.382 1.00 61.58 ? 604 PRO A CD 1 ATOM 4110 N N . ALA A 1 562 ? 13.717 63.080 43.370 1.00 48.41 ? 605 ALA A N 1 ATOM 4111 C CA . ALA A 1 562 ? 14.290 64.035 42.430 1.00 55.26 ? 605 ALA A CA 1 ATOM 4112 C C . ALA A 1 562 ? 14.579 63.409 41.071 1.00 70.68 ? 605 ALA A C 1 ATOM 4113 O O . ALA A 1 562 ? 14.605 64.115 40.058 1.00 65.44 ? 605 ALA A O 1 ATOM 4114 C CB . ALA A 1 562 ? 15.570 64.637 43.012 1.00 44.91 ? 605 ALA A CB 1 ATOM 4115 N N . LEU A 1 563 ? 14.817 62.095 41.025 1.00 60.29 ? 606 LEU A N 1 ATOM 4116 C CA . LEU A 1 563 ? 15.133 61.456 39.752 1.00 55.02 ? 606 LEU A CA 1 ATOM 4117 C C . LEU A 1 563 ? 14.027 61.666 38.726 1.00 59.91 ? 606 LEU A C 1 ATOM 4118 O O . LEU A 1 563 ? 14.291 61.661 37.517 1.00 42.17 ? 606 LEU A O 1 ATOM 4119 C CB . LEU A 1 563 ? 15.381 59.963 39.960 1.00 44.86 ? 606 LEU A CB 1 ATOM 4120 C CG . LEU A 1 563 ? 16.629 59.572 40.748 1.00 43.81 ? 606 LEU A CG 1 ATOM 4121 C CD1 . LEU A 1 563 ? 16.617 58.085 41.069 1.00 53.08 ? 606 LEU A CD1 1 ATOM 4122 C CD2 . LEU A 1 563 ? 17.879 59.944 39.971 1.00 38.20 ? 606 LEU A CD2 1 ATOM 4123 N N . CYS A 1 564 ? 12.789 61.848 39.182 1.00 50.70 ? 607 CYS A N 1 ATOM 4124 C CA . CYS A 1 564 ? 11.645 62.053 38.304 1.00 52.27 ? 607 CYS A CA 1 ATOM 4125 C C . CYS A 1 564 ? 11.321 63.530 38.101 1.00 70.26 ? 607 CYS A C 1 ATOM 4126 O O . CYS A 1 564 ? 10.296 63.857 37.492 1.00 60.25 ? 607 CYS A O 1 ATOM 4127 C CB . CYS A 1 564 ? 10.440 61.282 38.844 1.00 52.75 ? 607 CYS A CB 1 ATOM 4128 S SG . CYS A 1 564 ? 10.799 59.500 38.903 1.00 89.74 ? 607 CYS A SG 1 ATOM 4129 N N . ARG A 1 565 ? 12.152 64.452 38.620 1.00 95.03 ? 608 ARG A N 1 ATOM 4130 C CA . ARG A 1 565 ? 11.854 65.898 38.587 1.00 81.58 ? 608 ARG A CA 1 ATOM 4131 C C . ARG A 1 565 ? 11.490 66.405 37.193 1.00 69.17 ? 608 ARG A C 1 ATOM 4132 O O . ARG A 1 565 ? 10.560 67.205 37.044 1.00 62.11 ? 608 ARG A O 1 ATOM 4133 C CB . ARG A 1 565 ? 13.053 66.667 39.152 1.00 76.64 ? 608 ARG A CB 1 ATOM 4134 C CG . ARG A 1 565 ? 14.365 66.362 38.437 1.00 79.48 ? 608 ARG A CG 1 ATOM 4135 C CD . ARG A 1 565 ? 15.562 66.957 39.167 1.00 72.42 ? 608 ARG A CD 1 ATOM 4136 N NE . ARG A 1 565 ? 16.825 66.398 38.687 1.00 70.51 ? 608 ARG A NE 1 ATOM 4137 C CZ . ARG A 1 565 ? 17.667 67.022 37.870 1.00 90.77 ? 608 ARG A CZ 1 ATOM 4138 N NH1 . ARG A 1 565 ? 17.393 68.244 37.432 1.00 95.97 1 608 ARG A NH1 1 ATOM 4139 N NH2 . ARG A 1 565 ? 18.788 66.420 37.492 1.00 82.75 ? 608 ARG A NH2 1 ATOM 4140 N N . HIS A 1 566 ? 12.201 65.955 36.158 1.00 64.94 ? 609 HIS A N 1 ATOM 4141 C CA . HIS A 1 566 ? 11.973 66.518 34.832 1.00 61.25 ? 609 HIS A CA 1 ATOM 4142 C C . HIS A 1 566 ? 10.687 66.029 34.177 1.00 58.67 ? 609 HIS A C 1 ATOM 4143 O O . HIS A 1 566 ? 10.334 66.529 33.104 1.00 62.86 ? 609 HIS A O 1 ATOM 4144 C CB . HIS A 1 566 ? 13.174 66.248 33.922 1.00 62.75 ? 609 HIS A CB 1 ATOM 4145 C CG . HIS A 1 566 ? 14.399 67.021 34.306 1.00 77.32 ? 609 HIS A CG 1 ATOM 4146 N ND1 . HIS A 1 566 ? 15.660 66.699 33.852 1.00 85.66 ? 609 HIS A ND1 1 ATOM 4147 C CD2 . HIS A 1 566 ? 14.549 68.118 35.085 1.00 63.72 ? 609 HIS A CD2 1 ATOM 4148 C CE1 . HIS A 1 566 ? 16.535 67.558 34.343 1.00 76.35 ? 609 HIS A CE1 1 ATOM 4149 N NE2 . HIS A 1 566 ? 15.887 68.429 35.095 1.00 74.00 ? 609 HIS A NE2 1 ATOM 4150 N N . LEU A 1 567 ? 9.980 65.079 34.786 1.00 56.90 ? 610 LEU A N 1 ATOM 4151 C CA . LEU A 1 567 ? 8.663 64.663 34.314 1.00 57.21 ? 610 LEU A CA 1 ATOM 4152 C C . LEU A 1 567 ? 7.623 65.509 35.048 1.00 93.74 ? 610 LEU A C 1 ATOM 4153 O O . LEU A 1 567 ? 7.436 65.356 36.260 1.00 85.37 ? 610 LEU A O 1 ATOM 4154 C CB . LEU A 1 567 ? 8.444 63.174 34.573 1.00 61.24 ? 610 LEU A CB 1 ATOM 4155 C CG . LEU A 1 567 ? 9.436 62.141 34.017 1.00 58.66 ? 610 LEU A CG 1 ATOM 4156 C CD1 . LEU A 1 567 ? 9.087 60.746 34.532 1.00 47.07 ? 610 LEU A CD1 1 ATOM 4157 C CD2 . LEU A 1 567 ? 9.500 62.146 32.499 1.00 43.99 ? 610 LEU A CD2 1 ATOM 4158 N N . MET A 1 568 ? 6.940 66.395 34.323 1.00 104.16 ? 611 MET A N 1 ATOM 4159 C CA . MET A 1 568 ? 5.924 67.250 34.945 1.00 99.70 ? 611 MET A CA 1 ATOM 4160 C C . MET A 1 568 ? 4.631 66.497 35.239 1.00 96.08 ? 611 MET A C 1 ATOM 4161 O O . MET A 1 568 ? 3.574 67.110 35.401 1.00 73.90 ? 611 MET A O 1 ATOM 4162 C CB . MET A 1 568 ? 5.607 68.465 34.068 1.00 86.55 ? 611 MET A CB 1 ATOM 4163 C CG . MET A 1 568 ? 6.778 69.397 33.811 1.00 101.94 ? 611 MET A CG 1 ATOM 4164 S SD . MET A 1 568 ? 6.291 70.840 32.838 1.00 147.11 ? 611 MET A SD 1 ATOM 4165 C CE . MET A 1 568 ? 5.765 70.069 31.309 1.00 107.98 ? 611 MET A CE 1 ATOM 4166 N N . PHE B 1 39 ? -1.790 36.242 50.800 1.00 78.06 ? 82 PHE B N 1 ATOM 4167 C CA . PHE B 1 39 ? -1.253 37.168 49.807 1.00 92.05 ? 82 PHE B CA 1 ATOM 4168 C C . PHE B 1 39 ? 0.010 37.844 50.326 1.00 100.06 ? 82 PHE B C 1 ATOM 4169 O O . PHE B 1 39 ? -0.001 39.027 50.663 1.00 108.66 ? 82 PHE B O 1 ATOM 4170 C CB . PHE B 1 39 ? -2.300 38.222 49.429 1.00 101.72 ? 82 PHE B CB 1 ATOM 4171 C CG . PHE B 1 39 ? -1.874 39.126 48.304 1.00 113.66 ? 82 PHE B CG 1 ATOM 4172 C CD1 . PHE B 1 39 ? -2.085 38.755 46.985 1.00 100.28 ? 82 PHE B CD1 1 ATOM 4173 C CD2 . PHE B 1 39 ? -1.268 40.345 48.564 1.00 97.98 ? 82 PHE B CD2 1 ATOM 4174 C CE1 . PHE B 1 39 ? -1.696 39.581 45.947 1.00 78.12 ? 82 PHE B CE1 1 ATOM 4175 C CE2 . PHE B 1 39 ? -0.874 41.174 47.532 1.00 101.32 ? 82 PHE B CE2 1 ATOM 4176 C CZ . PHE B 1 39 ? -1.090 40.792 46.221 1.00 100.67 ? 82 PHE B CZ 1 ATOM 4177 N N . GLY B 1 40 ? 1.095 37.087 50.405 1.00 95.52 ? 83 GLY B N 1 ATOM 4178 C CA . GLY B 1 40 ? 2.349 37.620 50.886 1.00 102.08 ? 83 GLY B CA 1 ATOM 4179 C C . GLY B 1 40 ? 2.360 37.792 52.395 1.00 115.50 ? 83 GLY B C 1 ATOM 4180 O O . GLY B 1 40 ? 1.324 37.865 53.055 1.00 110.03 ? 83 GLY B O 1 ATOM 4181 N N . TRP B 1 41 ? 3.571 37.871 52.949 1.00 121.62 ? 84 TRP B N 1 ATOM 4182 C CA . TRP B 1 41 ? 3.714 37.976 54.396 1.00 115.95 ? 84 TRP B CA 1 ATOM 4183 C C . TRP B 1 41 ? 3.481 39.393 54.905 1.00 113.13 ? 84 TRP B C 1 ATOM 4184 O O . TRP B 1 41 ? 3.086 39.572 56.061 1.00 114.93 ? 84 TRP B O 1 ATOM 4185 C CB . TRP B 1 41 ? 5.103 37.493 54.822 1.00 121.14 ? 84 TRP B CB 1 ATOM 4186 C CG . TRP B 1 41 ? 6.095 38.598 54.977 1.00 122.32 ? 84 TRP B CG 1 ATOM 4187 C CD1 . TRP B 1 41 ? 6.799 39.218 53.986 1.00 120.52 ? 84 TRP B CD1 1 ATOM 4188 C CD2 . TRP B 1 41 ? 6.498 39.217 56.203 1.00 124.35 ? 84 TRP B CD2 1 ATOM 4189 N NE1 . TRP B 1 41 ? 7.615 40.188 54.519 1.00 122.44 ? 84 TRP B NE1 1 ATOM 4190 C CE2 . TRP B 1 41 ? 7.448 40.207 55.879 1.00 124.46 ? 84 TRP B CE2 1 ATOM 4191 C CE3 . TRP B 1 41 ? 6.146 39.032 57.543 1.00 117.82 ? 84 TRP B CE3 1 ATOM 4192 C CZ2 . TRP B 1 41 ? 8.051 41.007 56.847 1.00 118.32 ? 84 TRP B CZ2 1 ATOM 4193 C CZ3 . TRP B 1 41 ? 6.745 39.827 58.501 1.00 123.44 ? 84 TRP B CZ3 1 ATOM 4194 C CH2 . TRP B 1 41 ? 7.687 40.802 58.150 1.00 123.95 ? 84 TRP B CH2 1 ATOM 4195 N N . GLY B 1 42 ? 3.713 40.405 54.063 1.00 130.75 ? 85 GLY B N 1 ATOM 4196 C CA . GLY B 1 42 ? 3.644 41.782 54.529 1.00 109.75 ? 85 GLY B CA 1 ATOM 4197 C C . GLY B 1 42 ? 2.352 42.120 55.244 1.00 99.04 ? 85 GLY B C 1 ATOM 4198 O O . GLY B 1 42 ? 2.324 43.014 56.093 1.00 106.50 ? 85 GLY B O 1 ATOM 4199 N N . ASN B 1 43 ? 1.266 41.420 54.914 1.00 95.84 ? 86 ASN B N 1 ATOM 4200 C CA . ASN B 1 43 ? -0.017 41.652 55.564 1.00 94.34 ? 86 ASN B CA 1 ATOM 4201 C C . ASN B 1 43 ? -0.085 41.066 56.970 1.00 90.65 ? 86 ASN B C 1 ATOM 4202 O O . ASN B 1 43 ? -0.921 41.504 57.768 1.00 96.22 ? 86 ASN B O 1 ATOM 4203 C CB . ASN B 1 43 ? -1.140 41.061 54.708 1.00 104.49 ? 86 ASN B CB 1 ATOM 4204 C CG . ASN B 1 43 ? -2.232 42.067 54.383 1.00 118.76 ? 86 ASN B CG 1 ATOM 4205 O OD1 . ASN B 1 43 ? -2.567 42.931 55.193 1.00 116.03 ? 86 ASN B OD1 1 ATOM 4206 N ND2 . ASN B 1 43 ? -2.793 41.950 53.181 1.00 127.79 ? 86 ASN B ND2 1 ATOM 4207 N N . LEU B 1 44 ? 0.771 40.091 57.290 1.00 102.85 ? 87 LEU B N 1 ATOM 4208 C CA . LEU B 1 44 ? 0.720 39.405 58.580 1.00 99.15 ? 87 LEU B CA 1 ATOM 4209 C C . LEU B 1 44 ? 1.417 40.155 59.708 1.00 87.72 ? 87 LEU B C 1 ATOM 4210 O O . LEU B 1 44 ? 1.149 39.858 60.877 1.00 74.35 ? 87 LEU B O 1 ATOM 4211 C CB . LEU B 1 44 ? 1.327 38.006 58.471 1.00 87.00 ? 87 LEU B CB 1 ATOM 4212 C CG . LEU B 1 44 ? 0.425 36.941 57.854 1.00 91.66 ? 87 LEU B CG 1 ATOM 4213 C CD1 . LEU B 1 44 ? 1.017 35.565 58.090 1.00 91.12 ? 87 LEU B CD1 1 ATOM 4214 C CD2 . LEU B 1 44 ? -0.976 37.037 58.436 1.00 72.77 ? 87 LEU B CD2 1 ATOM 4215 N N . THR B 1 45 ? 2.316 41.090 59.394 1.00 90.73 ? 88 THR B N 1 ATOM 4216 C CA . THR B 1 45 ? 3.103 41.743 60.437 1.00 80.61 ? 88 THR B CA 1 ATOM 4217 C C . THR B 1 45 ? 2.214 42.238 61.570 1.00 75.91 ? 88 THR B C 1 ATOM 4218 O O . THR B 1 45 ? 2.511 42.019 62.750 1.00 76.66 ? 88 THR B O 1 ATOM 4219 C CB . THR B 1 45 ? 3.909 42.899 59.844 1.00 79.41 ? 88 THR B CB 1 ATOM 4220 O OG1 . THR B 1 45 ? 3.024 43.797 59.163 1.00 102.24 ? 88 THR B OG1 1 ATOM 4221 C CG2 . THR B 1 45 ? 4.938 42.376 58.862 1.00 84.39 ? 88 THR B CG2 1 ATOM 4222 N N . CYS B 1 46 ? 1.108 42.904 61.229 1.00 73.88 ? 89 CYS B N 1 ATOM 4223 C CA . CYS B 1 46 ? 0.215 43.432 62.259 1.00 81.05 ? 89 CYS B CA 1 ATOM 4224 C C . CYS B 1 46 ? -0.321 42.336 63.172 1.00 75.20 ? 89 CYS B C 1 ATOM 4225 O O . CYS B 1 46 ? -0.099 42.406 64.394 1.00 73.63 ? 89 CYS B O 1 ATOM 4226 C CB . CYS B 1 46 ? -0.912 44.221 61.588 1.00 85.72 ? 89 CYS B CB 1 ATOM 4227 S SG . CYS B 1 46 ? -2.138 44.908 62.729 1.00 126.51 ? 89 CYS B SG 1 ATOM 4228 N N . PRO B 1 47 ? -1.017 41.312 62.669 1.00 72.24 ? 90 PRO B N 1 ATOM 4229 C CA . PRO B 1 47 ? -1.505 40.255 63.573 1.00 71.85 ? 90 PRO B CA 1 ATOM 4230 C C . PRO B 1 47 ? -0.403 39.570 64.364 1.00 63.35 ? 90 PRO B C 1 ATOM 4231 O O . PRO B 1 47 ? -0.585 39.298 65.557 1.00 66.20 ? 90 PRO B O 1 ATOM 4232 C CB . PRO B 1 47 ? -2.211 39.285 62.615 1.00 70.92 ? 90 PRO B CB 1 ATOM 4233 C CG . PRO B 1 47 ? -2.633 40.141 61.471 1.00 78.53 ? 90 PRO B CG 1 ATOM 4234 C CD . PRO B 1 47 ? -1.525 41.144 61.298 1.00 79.83 ? 90 PRO B CD 1 ATOM 4235 N N . ILE B 1 48 ? 0.736 39.276 63.734 1.00 62.15 ? 91 ILE B N 1 ATOM 4236 C CA . ILE B 1 48 ? 1.847 38.670 64.465 1.00 58.19 ? 91 ILE B CA 1 ATOM 4237 C C . ILE B 1 48 ? 2.314 39.592 65.581 1.00 61.27 ? 91 ILE B C 1 ATOM 4238 O O . ILE B 1 48 ? 2.693 39.136 66.667 1.00 66.40 ? 91 ILE B O 1 ATOM 4239 C CB . ILE B 1 48 ? 2.997 38.317 63.504 1.00 71.73 ? 91 ILE B CB 1 ATOM 4240 C CG1 . ILE B 1 48 ? 2.633 37.083 62.682 1.00 73.69 ? 91 ILE B CG1 1 ATOM 4241 C CG2 . ILE B 1 48 ? 4.290 38.103 64.274 1.00 63.02 ? 91 ILE B CG2 1 ATOM 4242 C CD1 . ILE B 1 48 ? 2.252 35.891 63.533 1.00 64.79 ? 91 ILE B CD1 1 ATOM 4243 N N . CYS B 1 49 ? 2.293 40.902 65.337 1.00 62.73 ? 92 CYS B N 1 ATOM 4244 C CA . CYS B 1 49 ? 2.654 41.847 66.387 1.00 70.93 ? 92 CYS B CA 1 ATOM 4245 C C . CYS B 1 49 ? 1.657 41.783 67.538 1.00 67.73 ? 92 CYS B C 1 ATOM 4246 O O . CYS B 1 49 ? 2.036 41.565 68.696 1.00 58.32 ? 92 CYS B O 1 ATOM 4247 C CB . CYS B 1 49 ? 2.733 43.263 65.811 1.00 74.41 ? 92 CYS B CB 1 ATOM 4248 S SG . CYS B 1 49 ? 3.261 44.525 66.994 1.00 74.17 ? 92 CYS B SG 1 ATOM 4249 N N . LYS B 1 50 ? 0.368 41.943 67.230 1.00 58.48 ? 93 LYS B N 1 ATOM 4250 C CA . LYS B 1 50 ? -0.646 41.969 68.279 1.00 64.60 ? 93 LYS B CA 1 ATOM 4251 C C . LYS B 1 50 ? -0.612 40.692 69.111 1.00 72.33 ? 93 LYS B C 1 ATOM 4252 O O . LYS B 1 50 ? -0.648 40.742 70.347 1.00 70.63 ? 93 LYS B O 1 ATOM 4253 C CB . LYS B 1 50 ? -2.028 42.202 67.665 1.00 55.72 ? 93 LYS B CB 1 ATOM 4254 C CG . LYS B 1 50 ? -2.216 43.627 67.164 1.00 60.38 ? 93 LYS B CG 1 ATOM 4255 C CD . LYS B 1 50 ? -3.681 44.004 67.035 1.00 69.70 ? 93 LYS B CD 1 ATOM 4256 C CE . LYS B 1 50 ? -3.831 45.490 66.731 1.00 72.50 ? 93 LYS B CE 1 ATOM 4257 N NZ . LYS B 1 50 ? -5.257 45.919 66.702 1.00 74.84 1 93 LYS B NZ 1 ATOM 4258 N N . GLY B 1 51 ? -0.540 39.535 68.453 1.00 52.81 ? 94 GLY B N 1 ATOM 4259 C CA . GLY B 1 51 ? -0.377 38.300 69.201 1.00 60.14 ? 94 GLY B CA 1 ATOM 4260 C C . GLY B 1 51 ? 0.890 38.305 70.033 1.00 64.36 ? 94 GLY B C 1 ATOM 4261 O O . GLY B 1 51 ? 0.896 37.854 71.183 1.00 54.29 ? 94 GLY B O 1 ATOM 4262 N N . LEU B 1 52 ? 1.976 38.836 69.469 1.00 56.07 ? 95 LEU B N 1 ATOM 4263 C CA . LEU B 1 52 ? 3.240 38.904 70.192 1.00 55.48 ? 95 LEU B CA 1 ATOM 4264 C C . LEU B 1 52 ? 3.070 39.627 71.524 1.00 58.44 ? 95 LEU B C 1 ATOM 4265 O O . LEU B 1 52 ? 3.461 39.114 72.582 1.00 65.25 ? 95 LEU B O 1 ATOM 4266 C CB . LEU B 1 52 ? 4.286 39.604 69.320 1.00 57.75 ? 95 LEU B CB 1 ATOM 4267 C CG . LEU B 1 52 ? 5.754 39.179 69.398 1.00 67.21 ? 95 LEU B CG 1 ATOM 4268 C CD1 . LEU B 1 52 ? 5.887 37.671 69.283 1.00 60.17 ? 95 LEU B CD1 1 ATOM 4269 C CD2 . LEU B 1 52 ? 6.560 39.867 68.304 1.00 58.12 ? 95 LEU B CD2 1 ATOM 4270 N N . PHE B 1 53 ? 2.457 40.812 71.498 1.00 70.13 ? 96 PHE B N 1 ATOM 4271 C CA . PHE B 1 53 ? 2.316 41.583 72.726 1.00 63.77 ? 96 PHE B CA 1 ATOM 4272 C C . PHE B 1 53 ? 1.194 41.076 73.621 1.00 67.57 ? 96 PHE B C 1 ATOM 4273 O O . PHE B 1 53 ? 1.194 41.385 74.817 1.00 74.43 ? 96 PHE B O 1 ATOM 4274 C CB . PHE B 1 53 ? 2.107 43.062 72.402 1.00 63.23 ? 96 PHE B CB 1 ATOM 4275 C CG . PHE B 1 53 ? 3.360 43.757 71.967 1.00 58.25 ? 96 PHE B CG 1 ATOM 4276 C CD1 . PHE B 1 53 ? 4.258 44.237 72.900 1.00 58.51 ? 96 PHE B CD1 1 ATOM 4277 C CD2 . PHE B 1 53 ? 3.650 43.915 70.625 1.00 59.18 ? 96 PHE B CD2 1 ATOM 4278 C CE1 . PHE B 1 53 ? 5.420 44.868 72.505 1.00 56.56 ? 96 PHE B CE1 1 ATOM 4279 C CE2 . PHE B 1 53 ? 4.810 44.546 70.224 1.00 67.65 ? 96 PHE B CE2 1 ATOM 4280 C CZ . PHE B 1 53 ? 5.696 45.024 71.166 1.00 54.55 ? 96 PHE B CZ 1 ATOM 4281 N N . THR B 1 54 ? 0.247 40.303 73.087 1.00 54.51 ? 97 THR B N 1 ATOM 4282 C CA . THR B 1 54 ? -0.685 39.605 73.965 1.00 59.22 ? 97 THR B CA 1 ATOM 4283 C C . THR B 1 54 ? 0.046 38.547 74.785 1.00 60.69 ? 97 THR B C 1 ATOM 4284 O O . THR B 1 54 ? -0.140 38.446 76.007 1.00 53.47 ? 97 THR B O 1 ATOM 4285 C CB . THR B 1 54 ? -1.813 38.972 73.149 1.00 49.87 ? 97 THR B CB 1 ATOM 4286 O OG1 . THR B 1 54 ? -2.569 39.996 72.491 1.00 48.18 ? 97 THR B OG1 1 ATOM 4287 C CG2 . THR B 1 54 ? -2.738 38.173 74.055 1.00 51.48 ? 97 THR B CG2 1 ATOM 4288 N N . ALA B 1 55 ? 0.906 37.765 74.125 1.00 63.42 ? 98 ALA B N 1 ATOM 4289 C CA . ALA B 1 55 ? 1.689 36.758 74.832 1.00 63.81 ? 98 ALA B CA 1 ATOM 4290 C C . ALA B 1 55 ? 2.643 37.398 75.832 1.00 80.41 ? 98 ALA B C 1 ATOM 4291 O O . ALA B 1 55 ? 2.849 36.866 76.930 1.00 77.69 ? 98 ALA B O 1 ATOM 4292 C CB . ALA B 1 55 ? 2.459 35.894 73.834 1.00 63.59 ? 98 ALA B CB 1 ATOM 4293 N N . ILE B 1 56 ? 3.246 38.534 75.473 1.00 70.25 ? 99 ILE B N 1 ATOM 4294 C CA . ILE B 1 56 ? 4.097 39.235 76.431 1.00 68.02 ? 99 ILE B CA 1 ATOM 4295 C C . ILE B 1 56 ? 3.268 39.694 77.624 1.00 71.49 ? 99 ILE B C 1 ATOM 4296 O O . ILE B 1 56 ? 3.653 39.508 78.784 1.00 72.55 ? 99 ILE B O 1 ATOM 4297 C CB . ILE B 1 56 ? 4.816 40.415 75.755 1.00 60.60 ? 99 ILE B CB 1 ATOM 4298 C CG1 . ILE B 1 56 ? 5.654 39.925 74.577 1.00 72.76 ? 99 ILE B CG1 1 ATOM 4299 C CG2 . ILE B 1 56 ? 5.703 41.139 76.754 1.00 72.43 ? 99 ILE B CG2 1 ATOM 4300 C CD1 . ILE B 1 56 ? 6.348 41.036 73.823 1.00 69.81 ? 99 ILE B CD1 1 ATOM 4301 N N . ASN B 1 57 ? 2.110 40.298 77.347 1.00 70.46 ? 100 ASN B N 1 ATOM 4302 C CA . ASN B 1 57 ? 1.209 40.757 78.398 1.00 65.30 ? 100 ASN B CA 1 ATOM 4303 C C . ASN B 1 57 ? 0.919 39.644 79.399 1.00 71.36 ? 100 ASN B C 1 ATOM 4304 O O . ASN B 1 57 ? 1.282 39.732 80.580 1.00 69.73 ? 100 ASN B O 1 ATOM 4305 C CB . ASN B 1 57 ? -0.087 41.272 77.770 1.00 81.40 ? 100 ASN B CB 1 ATOM 4306 C CG . ASN B 1 57 ? -1.023 41.885 78.786 1.00 88.26 ? 100 ASN B CG 1 ATOM 4307 O OD1 . ASN B 1 57 ? -1.683 41.177 79.547 1.00 94.66 ? 100 ASN B OD1 1 ATOM 4308 N ND2 . ASN B 1 57 ? -1.101 43.211 78.792 1.00 82.46 ? 100 ASN B ND2 1 ATOM 4309 N N . LEU B 1 58 ? 0.258 38.577 78.938 1.00 82.66 ? 101 LEU B N 1 ATOM 4310 C CA . LEU B 1 58 ? -0.027 37.469 79.844 1.00 76.31 ? 101 LEU B CA 1 ATOM 4311 C C . LEU B 1 58 ? 1.243 36.886 80.445 1.00 72.95 ? 101 LEU B C 1 ATOM 4312 O O . LEU B 1 58 ? 1.186 36.292 81.527 1.00 74.39 ? 101 LEU B O 1 ATOM 4313 C CB . LEU B 1 58 ? -0.806 36.367 79.122 1.00 65.23 ? 101 LEU B CB 1 ATOM 4314 C CG . LEU B 1 58 ? -2.289 36.623 78.851 1.00 82.82 ? 101 LEU B CG 1 ATOM 4315 C CD1 . LEU B 1 58 ? -2.476 37.696 77.785 1.00 76.11 ? 101 LEU B CD1 1 ATOM 4316 C CD2 . LEU B 1 58 ? -2.986 35.330 78.453 1.00 75.11 ? 101 LEU B CD2 1 ATOM 4317 N N . GLY B 1 59 ? 2.386 37.057 79.781 1.00 83.29 ? 102 GLY B N 1 ATOM 4318 C CA . GLY B 1 59 ? 3.617 36.477 80.292 1.00 76.36 ? 102 GLY B CA 1 ATOM 4319 C C . GLY B 1 59 ? 4.120 37.192 81.531 1.00 71.59 ? 102 GLY B C 1 ATOM 4320 O O . GLY B 1 59 ? 4.462 36.558 82.533 1.00 79.66 ? 102 GLY B O 1 ATOM 4321 N N . LEU B 1 60 ? 4.170 38.521 81.484 1.00 76.62 ? 103 LEU B N 1 ATOM 4322 C CA . LEU B 1 60 ? 4.608 39.290 82.640 1.00 81.54 ? 103 LEU B CA 1 ATOM 4323 C C . LEU B 1 60 ? 3.472 39.586 83.610 1.00 75.56 ? 103 LEU B C 1 ATOM 4324 O O . LEU B 1 60 ? 3.706 40.221 84.642 1.00 72.58 ? 103 LEU B O 1 ATOM 4325 C CB . LEU B 1 60 ? 5.282 40.596 82.194 1.00 61.48 ? 103 LEU B CB 1 ATOM 4326 C CG . LEU B 1 60 ? 4.512 41.604 81.339 1.00 67.59 ? 103 LEU B CG 1 ATOM 4327 C CD1 . LEU B 1 60 ? 3.429 42.306 82.145 1.00 69.69 ? 103 LEU B CD1 1 ATOM 4328 C CD2 . LEU B 1 60 ? 5.476 42.613 80.737 1.00 59.42 ? 103 LEU B CD2 1 ATOM 4329 N N . LYS B 1 61 ? 2.253 39.131 83.311 1.00 77.09 ? 104 LYS B N 1 ATOM 4330 C CA . LYS B 1 61 ? 1.181 39.192 84.296 1.00 71.21 ? 104 LYS B CA 1 ATOM 4331 C C . LYS B 1 61 ? 1.416 38.259 85.482 1.00 87.57 ? 104 LYS B C 1 ATOM 4332 O O . LYS B 1 61 ? 0.686 38.354 86.475 1.00 90.00 ? 104 LYS B O 1 ATOM 4333 C CB . LYS B 1 61 ? -0.155 38.862 83.628 1.00 84.16 ? 104 LYS B CB 1 ATOM 4334 C CG . LYS B 1 61 ? -1.366 39.036 84.523 1.00 80.80 ? 104 LYS B CG 1 ATOM 4335 C CD . LYS B 1 61 ? -2.656 38.857 83.741 1.00 83.49 ? 104 LYS B CD 1 ATOM 4336 C CE . LYS B 1 61 ? -3.859 38.843 84.667 1.00 100.94 ? 104 LYS B CE 1 ATOM 4337 N NZ . LYS B 1 61 ? -4.011 40.132 85.397 1.00 103.44 1 104 LYS B NZ 1 ATOM 4338 N N . LYS B 1 62 ? 2.415 37.378 85.409 1.00 94.17 ? 105 LYS B N 1 ATOM 4339 C CA . LYS B 1 62 ? 2.747 36.469 86.501 1.00 83.77 ? 105 LYS B CA 1 ATOM 4340 C C . LYS B 1 62 ? 3.848 37.059 87.376 1.00 87.90 ? 105 LYS B C 1 ATOM 4341 O O . LYS B 1 62 ? 4.767 37.717 86.879 1.00 90.20 ? 105 LYS B O 1 ATOM 4342 C CB . LYS B 1 62 ? 3.193 35.108 85.960 1.00 78.90 ? 105 LYS B CB 1 ATOM 4343 C CG . LYS B 1 62 ? 2.065 34.122 85.670 1.00 76.70 ? 105 LYS B CG 1 ATOM 4344 C CD . LYS B 1 62 ? 1.219 34.548 84.483 1.00 84.90 ? 105 LYS B CD 1 ATOM 4345 C CE . LYS B 1 62 ? 0.210 33.469 84.116 1.00 85.28 ? 105 LYS B CE 1 ATOM 4346 N NZ . LYS B 1 62 ? -0.617 33.854 82.938 1.00 69.10 1 105 LYS B NZ 1 ATOM 4347 N N . GLU B 1 63 ? 3.757 36.799 88.682 1.00 95.36 ? 106 GLU B N 1 ATOM 4348 C CA . GLU B 1 63 ? 4.665 37.434 89.637 1.00 102.75 ? 106 GLU B CA 1 ATOM 4349 C C . GLU B 1 63 ? 6.130 37.056 89.441 1.00 95.66 ? 106 GLU B C 1 ATOM 4350 O O . GLU B 1 63 ? 6.989 37.942 89.602 1.00 81.27 ? 106 GLU B O 1 ATOM 4351 C CB . GLU B 1 63 ? 4.217 37.118 91.071 1.00 101.69 ? 106 GLU B CB 1 ATOM 4352 C CG . GLU B 1 63 ? 3.224 38.119 91.663 1.00 121.55 ? 106 GLU B CG 1 ATOM 4353 C CD . GLU B 1 63 ? 3.893 39.400 92.152 1.00 130.45 ? 106 GLU B CD 1 ATOM 4354 O OE1 . GLU B 1 63 ? 5.081 39.346 92.538 1.00 130.26 ? 106 GLU B OE1 1 ATOM 4355 O OE2 . GLU B 1 63 ? 3.228 40.461 92.154 1.00 104.26 -1 106 GLU B OE2 1 ATOM 4356 N N . PRO B 1 64 ? 6.494 35.803 89.140 1.00 83.45 ? 107 PRO B N 1 ATOM 4357 C CA . PRO B 1 64 ? 7.927 35.483 89.005 1.00 70.34 ? 107 PRO B CA 1 ATOM 4358 C C . PRO B 1 64 ? 8.649 36.391 88.022 1.00 80.86 ? 107 PRO B C 1 ATOM 4359 O O . PRO B 1 64 ? 9.756 36.873 88.307 1.00 78.59 ? 107 PRO B O 1 ATOM 4360 C CB . PRO B 1 64 ? 7.915 34.024 88.525 1.00 69.65 ? 107 PRO B CB 1 ATOM 4361 C CG . PRO B 1 64 ? 6.607 33.483 88.984 1.00 77.00 ? 107 PRO B CG 1 ATOM 4362 C CD . PRO B 1 64 ? 5.640 34.625 88.904 1.00 66.56 ? 107 PRO B CD 1 ATOM 4363 N N . ASN B 1 65 ? 8.038 36.638 86.861 1.00 73.91 ? 108 ASN B N 1 ATOM 4364 C CA . ASN B 1 65 ? 8.638 37.541 85.886 1.00 81.75 ? 108 ASN B CA 1 ATOM 4365 C C . ASN B 1 65 ? 8.772 38.950 86.451 1.00 72.16 ? 108 ASN B C 1 ATOM 4366 O O . ASN B 1 65 ? 9.785 39.622 86.228 1.00 63.16 ? 108 ASN B O 1 ATOM 4367 C CB . ASN B 1 65 ? 7.806 37.547 84.604 1.00 86.51 ? 108 ASN B CB 1 ATOM 4368 C CG . ASN B 1 65 ? 7.722 36.176 83.963 1.00 87.62 ? 108 ASN B CG 1 ATOM 4369 O OD1 . ASN B 1 65 ? 8.613 35.341 84.133 1.00 75.89 ? 108 ASN B OD1 1 ATOM 4370 N ND2 . ASN B 1 65 ? 6.644 35.935 83.228 1.00 86.18 ? 108 ASN B ND2 1 ATOM 4371 N N . VAL B 1 66 ? 7.761 39.414 87.191 1.00 75.32 ? 109 VAL B N 1 ATOM 4372 C CA . VAL B 1 66 ? 7.872 40.705 87.866 1.00 73.87 ? 109 VAL B CA 1 ATOM 4373 C C . VAL B 1 66 ? 9.108 40.727 88.754 1.00 67.29 ? 109 VAL B C 1 ATOM 4374 O O . VAL B 1 66 ? 9.848 41.718 88.799 1.00 65.21 ? 109 VAL B O 1 ATOM 4375 C CB . VAL B 1 66 ? 6.591 41.005 88.668 1.00 61.20 ? 109 VAL B CB 1 ATOM 4376 C CG1 . VAL B 1 66 ? 6.687 42.371 89.328 1.00 62.95 ? 109 VAL B CG1 1 ATOM 4377 C CG2 . VAL B 1 66 ? 5.367 40.924 87.771 1.00 54.66 ? 109 VAL B CG2 1 ATOM 4378 N N . ALA B 1 67 ? 9.353 39.630 89.472 1.00 61.58 ? 110 ALA B N 1 ATOM 4379 C CA . ALA B 1 67 ? 10.575 39.525 90.260 1.00 66.33 ? 110 ALA B CA 1 ATOM 4380 C C . ALA B 1 67 ? 11.810 39.656 89.379 1.00 64.85 ? 110 ALA B C 1 ATOM 4381 O O . ALA B 1 67 ? 12.768 40.350 89.739 1.00 55.36 ? 110 ALA B O 1 ATOM 4382 C CB . ALA B 1 67 ? 10.593 38.199 91.020 1.00 63.61 ? 110 ALA B CB 1 ATOM 4383 N N . ARG B 1 68 ? 11.810 38.994 88.218 1.00 73.39 ? 111 ARG B N 1 ATOM 4384 C CA . ARG B 1 68 ? 12.969 39.060 87.330 1.00 64.35 ? 111 ARG B CA 1 ATOM 4385 C C . ARG B 1 68 ? 13.244 40.489 86.870 1.00 62.74 ? 111 ARG B C 1 ATOM 4386 O O . ARG B 1 68 ? 14.382 40.973 86.952 1.00 65.91 ? 111 ARG B O 1 ATOM 4387 C CB . ARG B 1 68 ? 12.762 38.130 86.134 1.00 75.00 ? 111 ARG B CB 1 ATOM 4388 C CG . ARG B 1 68 ? 12.849 36.658 86.492 1.00 72.63 ? 111 ARG B CG 1 ATOM 4389 C CD . ARG B 1 68 ? 12.734 35.771 85.266 1.00 88.71 ? 111 ARG B CD 1 ATOM 4390 N NE . ARG B 1 68 ? 12.775 34.355 85.624 1.00 110.96 ? 111 ARG B NE 1 ATOM 4391 C CZ . ARG B 1 68 ? 11.724 33.658 86.042 1.00 108.00 ? 111 ARG B CZ 1 ATOM 4392 N NH1 . ARG B 1 68 ? 10.539 34.243 86.155 1.00 95.59 1 111 ARG B NH1 1 ATOM 4393 N NH2 . ARG B 1 68 ? 11.856 32.373 86.348 1.00 93.58 ? 111 ARG B NH2 1 ATOM 4394 N N . VAL B 1 69 ? 12.215 41.180 86.369 1.00 53.99 ? 112 VAL B N 1 ATOM 4395 C CA . VAL B 1 69 ? 12.397 42.572 85.968 1.00 59.79 ? 112 VAL B CA 1 ATOM 4396 C C . VAL B 1 69 ? 12.907 43.392 87.144 1.00 62.11 ? 112 VAL B C 1 ATOM 4397 O O . VAL B 1 69 ? 13.807 44.228 86.993 1.00 59.91 ? 112 VAL B O 1 ATOM 4398 C CB . VAL B 1 69 ? 11.091 43.152 85.389 1.00 53.66 ? 112 VAL B CB 1 ATOM 4399 C CG1 . VAL B 1 69 ? 10.491 42.201 84.368 1.00 73.44 ? 112 VAL B CG1 1 ATOM 4400 C CG2 . VAL B 1 69 ? 10.091 43.448 86.494 1.00 57.02 ? 112 VAL B CG2 1 ATOM 4401 N N . GLY B 1 70 ? 12.358 43.151 88.336 1.00 64.21 ? 113 GLY B N 1 ATOM 4402 C CA . GLY B 1 70 ? 12.830 43.861 89.514 1.00 52.07 ? 113 GLY B CA 1 ATOM 4403 C C . GLY B 1 70 ? 14.316 43.671 89.753 1.00 63.90 ? 113 GLY B C 1 ATOM 4404 O O . GLY B 1 70 ? 15.041 44.631 90.019 1.00 55.74 ? 113 GLY B O 1 ATOM 4405 N N . SER B 1 71 ? 14.787 42.422 89.673 1.00 59.49 ? 114 SER B N 1 ATOM 4406 C CA . SER B 1 71 ? 16.188 42.134 89.972 1.00 57.55 ? 114 SER B CA 1 ATOM 4407 C C . SER B 1 71 ? 17.115 42.719 88.912 1.00 64.79 ? 114 SER B C 1 ATOM 4408 O O . SER B 1 71 ? 18.178 43.267 89.241 1.00 64.78 ? 114 SER B O 1 ATOM 4409 C CB . SER B 1 71 ? 16.395 40.626 90.104 1.00 41.20 ? 114 SER B CB 1 ATOM 4410 O OG . SER B 1 71 ? 16.017 39.953 88.916 1.00 83.58 ? 114 SER B OG 1 ATOM 4411 N N . VAL B 1 72 ? 16.739 42.607 87.634 1.00 66.05 ? 115 VAL B N 1 ATOM 4412 C CA . VAL B 1 72 ? 17.530 43.246 86.586 1.00 70.62 ? 115 VAL B CA 1 ATOM 4413 C C . VAL B 1 72 ? 17.602 44.747 86.831 1.00 65.27 ? 115 VAL B C 1 ATOM 4414 O O . VAL B 1 72 ? 18.668 45.367 86.711 1.00 64.54 ? 115 VAL B O 1 ATOM 4415 C CB . VAL B 1 72 ? 16.944 42.929 85.197 1.00 69.42 ? 115 VAL B CB 1 ATOM 4416 C CG1 . VAL B 1 72 ? 17.815 43.536 84.105 1.00 56.73 ? 115 VAL B CG1 1 ATOM 4417 C CG2 . VAL B 1 72 ? 16.796 41.428 85.007 1.00 61.77 ? 115 VAL B CG2 1 ATOM 4418 N N . ALA B 1 73 ? 16.465 45.352 87.185 1.00 57.14 ? 116 ALA B N 1 ATOM 4419 C CA . ALA B 1 73 ? 16.445 46.774 87.503 1.00 54.16 ? 116 ALA B CA 1 ATOM 4420 C C . ALA B 1 73 ? 17.349 47.091 88.687 1.00 56.06 ? 116 ALA B C 1 ATOM 4421 O O . ALA B 1 73 ? 17.986 48.148 88.721 1.00 65.70 ? 116 ALA B O 1 ATOM 4422 C CB . ALA B 1 73 ? 15.011 47.229 87.782 1.00 37.14 ? 116 ALA B CB 1 ATOM 4423 N N . ILE B 1 74 ? 17.413 46.196 89.674 1.00 53.01 ? 117 ILE B N 1 ATOM 4424 C CA . ILE B 1 74 ? 18.284 46.424 90.824 1.00 51.47 ? 117 ILE B CA 1 ATOM 4425 C C . ILE B 1 74 ? 19.739 46.452 90.382 1.00 58.32 ? 117 ILE B C 1 ATOM 4426 O O . ILE B 1 74 ? 20.501 47.362 90.735 1.00 67.11 ? 117 ILE B O 1 ATOM 4427 C CB . ILE B 1 74 ? 18.046 45.353 91.903 1.00 53.12 ? 117 ILE B CB 1 ATOM 4428 C CG1 . ILE B 1 74 ? 16.613 45.437 92.425 1.00 50.46 ? 117 ILE B CG1 1 ATOM 4429 C CG2 . ILE B 1 74 ? 19.058 45.495 93.033 1.00 50.05 ? 117 ILE B CG2 1 ATOM 4430 C CD1 . ILE B 1 74 ? 16.387 44.696 93.728 1.00 70.70 ? 117 ILE B CD1 1 ATOM 4431 N N . LYS B 1 75 ? 20.143 45.458 89.591 1.00 57.87 ? 118 LYS B N 1 ATOM 4432 C CA . LYS B 1 75 ? 21.518 45.432 89.108 1.00 56.31 ? 118 LYS B CA 1 ATOM 4433 C C . LYS B 1 75 ? 21.830 46.686 88.298 1.00 62.37 ? 118 LYS B C 1 ATOM 4434 O O . LYS B 1 75 ? 22.924 47.257 88.414 1.00 66.26 ? 118 LYS B O 1 ATOM 4435 C CB . LYS B 1 75 ? 21.756 44.165 88.285 1.00 63.89 ? 118 LYS B CB 1 ATOM 4436 C CG . LYS B 1 75 ? 21.520 42.882 89.073 1.00 75.07 ? 118 LYS B CG 1 ATOM 4437 C CD . LYS B 1 75 ? 21.972 41.643 88.315 1.00 83.15 ? 118 LYS B CD 1 ATOM 4438 C CE . LYS B 1 75 ? 21.827 40.394 89.178 1.00 69.36 ? 118 LYS B CE 1 ATOM 4439 N NZ . LYS B 1 75 ? 22.343 39.171 88.501 1.00 77.56 1 118 LYS B NZ 1 ATOM 4440 N N . LEU B 1 76 ? 20.871 47.143 87.488 1.00 61.57 ? 119 LEU B N 1 ATOM 4441 C CA . LEU B 1 76 ? 21.082 48.352 86.695 1.00 68.30 ? 119 LEU B CA 1 ATOM 4442 C C . LEU B 1 76 ? 21.234 49.583 87.584 1.00 73.88 ? 119 LEU B C 1 ATOM 4443 O O . LEU B 1 76 ? 22.135 50.403 87.375 1.00 71.94 ? 119 LEU B O 1 ATOM 4444 C CB . LEU B 1 76 ? 19.924 48.533 85.713 1.00 71.56 ? 119 LEU B CB 1 ATOM 4445 C CG . LEU B 1 76 ? 19.785 47.448 84.642 1.00 82.71 ? 119 LEU B CG 1 ATOM 4446 C CD1 . LEU B 1 76 ? 18.507 47.650 83.842 1.00 70.58 ? 119 LEU B CD1 1 ATOM 4447 C CD2 . LEU B 1 76 ? 21.003 47.422 83.726 1.00 63.57 ? 119 LEU B CD2 1 ATOM 4448 N N . CYS B 1 77 ? 20.356 49.730 88.582 1.00 85.01 ? 120 CYS B N 1 ATOM 4449 C CA . CYS B 1 77 ? 20.484 50.817 89.550 1.00 62.16 ? 120 CYS B CA 1 ATOM 4450 C C . CYS B 1 77 ? 21.874 50.825 90.166 1.00 74.96 ? 120 CYS B C 1 ATOM 4451 O O . CYS B 1 77 ? 22.540 51.866 90.221 1.00 65.68 ? 120 CYS B O 1 ATOM 4452 C CB . CYS B 1 77 ? 19.416 50.675 90.637 1.00 55.74 ? 120 CYS B CB 1 ATOM 4453 S SG . CYS B 1 77 ? 19.258 52.061 91.817 1.00 122.25 ? 120 CYS B SG 1 ATOM 4454 N N . ASN B 1 78 ? 22.333 49.659 90.629 1.00 72.02 ? 121 ASN B N 1 ATOM 4455 C CA . ASN B 1 78 ? 23.691 49.568 91.150 1.00 76.14 ? 121 ASN B CA 1 ATOM 4456 C C . ASN B 1 78 ? 24.715 49.992 90.107 1.00 83.82 ? 121 ASN B C 1 ATOM 4457 O O . ASN B 1 78 ? 25.762 50.550 90.457 1.00 77.48 ? 121 ASN B O 1 ATOM 4458 C CB . ASN B 1 78 ? 23.974 48.146 91.636 1.00 72.87 ? 121 ASN B CB 1 ATOM 4459 C CG . ASN B 1 78 ? 23.076 47.734 92.788 1.00 85.38 ? 121 ASN B CG 1 ATOM 4460 O OD1 . ASN B 1 78 ? 22.635 48.570 93.580 1.00 86.14 ? 121 ASN B OD1 1 ATOM 4461 N ND2 . ASN B 1 78 ? 22.799 46.440 92.887 1.00 85.33 ? 121 ASN B ND2 1 ATOM 4462 N N . LEU B 1 79 ? 24.430 49.750 88.824 1.00 88.39 ? 122 LEU B N 1 ATOM 4463 C CA . LEU B 1 79 ? 25.365 50.144 87.774 1.00 86.51 ? 122 LEU B CA 1 ATOM 4464 C C . LEU B 1 79 ? 25.445 51.662 87.642 1.00 86.31 ? 122 LEU B C 1 ATOM 4465 O O . LEU B 1 79 ? 26.541 52.232 87.581 1.00 67.63 ? 122 LEU B O 1 ATOM 4466 C CB . LEU B 1 79 ? 24.961 49.500 86.448 1.00 94.53 ? 122 LEU B CB 1 ATOM 4467 C CG . LEU B 1 79 ? 25.270 48.004 86.345 1.00 103.07 ? 122 LEU B CG 1 ATOM 4468 C CD1 . LEU B 1 79 ? 24.870 47.452 84.981 1.00 103.28 ? 122 LEU B CD1 1 ATOM 4469 C CD2 . LEU B 1 79 ? 26.741 47.735 86.631 1.00 90.32 ? 122 LEU B CD2 1 ATOM 4470 N N . LEU B 1 80 ? 24.292 52.337 87.601 1.00 91.98 ? 123 LEU B N 1 ATOM 4471 C CA . LEU B 1 80 ? 24.254 53.796 87.535 1.00 87.32 ? 123 LEU B CA 1 ATOM 4472 C C . LEU B 1 80 ? 24.679 54.450 88.844 1.00 97.77 ? 123 LEU B C 1 ATOM 4473 O O . LEU B 1 80 ? 24.784 55.681 88.903 1.00 87.55 ? 123 LEU B O 1 ATOM 4474 C CB . LEU B 1 80 ? 22.849 54.275 87.157 1.00 81.75 ? 123 LEU B CB 1 ATOM 4475 C CG . LEU B 1 80 ? 22.246 53.791 85.835 1.00 100.23 ? 123 LEU B CG 1 ATOM 4476 C CD1 . LEU B 1 80 ? 20.886 54.440 85.601 1.00 89.20 ? 123 LEU B CD1 1 ATOM 4477 C CD2 . LEU B 1 80 ? 23.183 54.060 84.668 1.00 87.07 ? 123 LEU B CD2 1 ATOM 4478 N N . LYS B 1 81 ? 24.925 53.647 89.873 1.00 98.83 ? 124 LYS B N 1 ATOM 4479 C CA . LYS B 1 81 ? 25.230 54.051 91.251 1.00 87.27 ? 124 LYS B CA 1 ATOM 4480 C C . LYS B 1 81 ? 24.096 54.945 91.761 1.00 90.25 ? 124 LYS B C 1 ATOM 4481 O O . LYS B 1 81 ? 22.952 54.812 91.306 1.00 91.80 ? 124 LYS B O 1 ATOM 4482 C CB . LYS B 1 81 ? 26.604 54.694 91.266 1.00 79.09 ? 124 LYS B CB 1 ATOM 4483 C CG . LYS B 1 81 ? 27.719 53.768 90.806 1.00 82.03 ? 124 LYS B CG 1 ATOM 4484 C CD . LYS B 1 81 ? 28.872 54.540 90.184 1.00 88.46 ? 124 LYS B CD 1 ATOM 4485 C CE . LYS B 1 81 ? 28.434 55.207 88.883 1.00 96.50 ? 124 LYS B CE 1 ATOM 4486 N NZ . LYS B 1 81 ? 29.536 55.958 88.218 1.00 94.22 1 124 LYS B NZ 1 ATOM 4487 N N . ILE B 1 82 ? 24.408 55.881 92.662 1.00 94.01 ? 125 ILE B N 1 ATOM 4488 C CA . ILE B 1 82 ? 23.459 56.909 93.101 1.00 107.43 ? 125 ILE B CA 1 ATOM 4489 C C . ILE B 1 82 ? 22.040 56.333 93.210 1.00 101.67 ? 125 ILE B C 1 ATOM 4490 O O . ILE B 1 82 ? 21.212 56.576 92.328 1.00 81.89 ? 125 ILE B O 1 ATOM 4491 C CB . ILE B 1 82 ? 23.508 58.151 92.187 1.00 120.42 ? 125 ILE B CB 1 ATOM 4492 C CG1 . ILE B 1 82 ? 22.639 59.264 92.777 1.00 120.29 ? 125 ILE B CG1 1 ATOM 4493 C CG2 . ILE B 1 82 ? 23.108 57.806 90.755 1.00 106.77 ? 125 ILE B CG2 1 ATOM 4494 C CD1 . ILE B 1 82 ? 23.095 59.723 94.152 1.00 75.22 ? 125 ILE B CD1 1 ATOM 4495 N N . ALA B 1 83 ? 21.736 55.571 94.261 1.00 90.58 ? 126 ALA B N 1 ATOM 4496 C CA . ALA B 1 83 ? 22.374 55.670 95.570 1.00 66.80 ? 126 ALA B CA 1 ATOM 4497 C C . ALA B 1 83 ? 22.779 54.296 96.136 1.00 90.12 ? 126 ALA B C 1 ATOM 4498 O O . ALA B 1 83 ? 22.705 53.295 95.420 1.00 95.21 ? 126 ALA B O 1 ATOM 4499 C CB . ALA B 1 83 ? 21.431 56.398 96.526 1.00 88.07 ? 126 ALA B CB 1 ATOM 4500 N N . PRO B 1 84 ? 23.211 54.248 97.400 1.00 92.75 ? 127 PRO B N 1 ATOM 4501 C CA . PRO B 1 84 ? 23.750 52.999 97.966 1.00 81.55 ? 127 PRO B CA 1 ATOM 4502 C C . PRO B 1 84 ? 22.845 51.809 97.705 1.00 72.37 ? 127 PRO B C 1 ATOM 4503 O O . PRO B 1 84 ? 21.616 51.950 97.614 1.00 61.73 ? 127 PRO B O 1 ATOM 4504 C CB . PRO B 1 84 ? 23.835 53.311 99.466 1.00 84.72 ? 127 PRO B CB 1 ATOM 4505 C CG . PRO B 1 84 ? 24.119 54.759 99.506 1.00 73.13 ? 127 PRO B CG 1 ATOM 4506 C CD . PRO B 1 84 ? 23.365 55.369 98.349 1.00 82.06 ? 127 PRO B CD 1 ATOM 4507 N N . PRO B 1 85 ? 23.429 50.609 97.601 1.00 77.41 ? 128 PRO B N 1 ATOM 4508 C CA . PRO B 1 85 ? 22.678 49.449 97.085 1.00 75.65 ? 128 PRO B CA 1 ATOM 4509 C C . PRO B 1 85 ? 21.378 49.162 97.815 1.00 60.43 ? 128 PRO B C 1 ATOM 4510 O O . PRO B 1 85 ? 20.370 48.846 97.168 1.00 67.30 ? 128 PRO B O 1 ATOM 4511 C CB . PRO B 1 85 ? 23.676 48.294 97.253 1.00 62.60 ? 128 PRO B CB 1 ATOM 4512 C CG . PRO B 1 85 ? 25.020 48.950 97.263 1.00 78.58 ? 128 PRO B CG 1 ATOM 4513 C CD . PRO B 1 85 ? 24.820 50.267 97.945 1.00 73.78 ? 128 PRO B CD 1 ATOM 4514 N N . ALA B 1 86 ? 21.375 49.242 99.147 1.00 58.87 ? 129 ALA B N 1 ATOM 4515 C CA . ALA B 1 86 ? 20.157 48.943 99.891 1.00 60.15 ? 129 ALA B CA 1 ATOM 4516 C C . ALA B 1 86 ? 19.006 49.827 99.433 1.00 70.49 ? 129 ALA B C 1 ATOM 4517 O O . ALA B 1 86 ? 17.856 49.373 99.345 1.00 57.52 ? 129 ALA B O 1 ATOM 4518 C CB . ALA B 1 86 ? 20.405 49.113 101.389 1.00 35.17 ? 129 ALA B CB 1 ATOM 4519 N N . VAL B 1 87 ? 19.300 51.088 99.112 1.00 69.25 ? 130 VAL B N 1 ATOM 4520 C CA . VAL B 1 87 ? 18.258 51.997 98.650 1.00 67.13 ? 130 VAL B CA 1 ATOM 4521 C C . VAL B 1 87 ? 17.707 51.534 97.308 1.00 65.99 ? 130 VAL B C 1 ATOM 4522 O O . VAL B 1 87 ? 16.488 51.433 97.124 1.00 60.25 ? 130 VAL B O 1 ATOM 4523 C CB . VAL B 1 87 ? 18.799 53.436 98.578 1.00 72.39 ? 130 VAL B CB 1 ATOM 4524 C CG1 . VAL B 1 87 ? 17.669 54.410 98.284 1.00 61.63 ? 130 VAL B CG1 1 ATOM 4525 C CG2 . VAL B 1 87 ? 19.503 53.797 99.875 1.00 59.35 ? 130 VAL B CG2 1 ATOM 4526 N N . CYS B 1 88 ? 18.594 51.224 96.357 1.00 73.72 ? 131 CYS B N 1 ATOM 4527 C CA . CYS B 1 88 ? 18.152 50.675 95.079 1.00 58.15 ? 131 CYS B CA 1 ATOM 4528 C C . CYS B 1 88 ? 17.212 49.498 95.296 1.00 62.90 ? 131 CYS B C 1 ATOM 4529 O O . CYS B 1 88 ? 16.073 49.485 94.810 1.00 63.70 ? 131 CYS B O 1 ATOM 4530 C CB . CYS B 1 88 ? 19.359 50.232 94.248 1.00 59.39 ? 131 CYS B CB 1 ATOM 4531 S SG . CYS B 1 88 ? 20.345 51.524 93.454 1.00 86.99 ? 131 CYS B SG 1 ATOM 4532 N N . GLN B 1 89 ? 17.679 48.504 96.054 1.00 59.69 ? 132 GLN B N 1 ATOM 4533 C CA . GLN B 1 89 ? 16.890 47.301 96.288 1.00 57.53 ? 132 GLN B CA 1 ATOM 4534 C C . GLN B 1 89 ? 15.516 47.639 96.857 1.00 57.38 ? 132 GLN B C 1 ATOM 4535 O O . GLN B 1 89 ? 14.488 47.212 96.319 1.00 61.23 ? 132 GLN B O 1 ATOM 4536 C CB . GLN B 1 89 ? 17.655 46.358 97.216 1.00 60.63 ? 132 GLN B CB 1 ATOM 4537 C CG . GLN B 1 89 ? 17.098 44.949 97.278 1.00 82.51 ? 132 GLN B CG 1 ATOM 4538 C CD . GLN B 1 89 ? 18.128 43.946 97.756 1.00 103.03 ? 132 GLN B CD 1 ATOM 4539 O OE1 . GLN B 1 89 ? 19.326 44.230 97.771 1.00 96.26 ? 132 GLN B OE1 1 ATOM 4540 N NE2 . GLN B 1 89 ? 17.666 42.766 98.160 1.00 107.88 ? 132 GLN B NE2 1 ATOM 4541 N N . SER B 1 90 ? 15.475 48.406 97.949 1.00 62.25 ? 133 SER B N 1 ATOM 4542 C CA . SER B 1 90 ? 14.196 48.686 98.598 1.00 66.62 ? 133 SER B CA 1 ATOM 4543 C C . SER B 1 90 ? 13.257 49.437 97.662 1.00 62.93 ? 133 SER B C 1 ATOM 4544 O O . SER B 1 90 ? 12.080 49.079 97.520 1.00 56.87 ? 133 SER B O 1 ATOM 4545 C CB . SER B 1 90 ? 14.421 49.482 99.886 1.00 60.04 ? 133 SER B CB 1 ATOM 4546 O OG . SER B 1 90 ? 15.250 48.777 100.793 1.00 64.05 ? 133 SER B OG 1 ATOM 4547 N N . ILE B 1 91 ? 13.767 50.478 97.001 1.00 59.13 ? 134 ILE B N 1 ATOM 4548 C CA . ILE B 1 91 ? 12.916 51.320 96.163 1.00 65.46 ? 134 ILE B CA 1 ATOM 4549 C C . ILE B 1 91 ? 12.322 50.499 95.024 1.00 66.56 ? 134 ILE B C 1 ATOM 4550 O O . ILE B 1 91 ? 11.109 50.532 94.773 1.00 62.63 ? 134 ILE B O 1 ATOM 4551 C CB . ILE B 1 91 ? 13.710 52.532 95.640 1.00 55.14 ? 134 ILE B CB 1 ATOM 4552 C CG1 . ILE B 1 91 ? 12.784 53.527 94.940 1.00 44.43 ? 134 ILE B CG1 1 ATOM 4553 C CG2 . ILE B 1 91 ? 14.822 52.093 94.700 1.00 49.54 ? 134 ILE B CG2 1 ATOM 4554 C CD1 . ILE B 1 91 ? 11.955 54.349 95.887 1.00 45.13 ? 134 ILE B CD1 1 ATOM 4555 N N . VAL B 1 92 ? 13.166 49.733 94.327 1.00 59.67 ? 135 VAL B N 1 ATOM 4556 C CA . VAL B 1 92 ? 12.669 48.930 93.214 1.00 48.77 ? 135 VAL B CA 1 ATOM 4557 C C . VAL B 1 92 ? 11.687 47.879 93.714 1.00 56.44 ? 135 VAL B C 1 ATOM 4558 O O . VAL B 1 92 ? 10.654 47.628 93.085 1.00 63.37 ? 135 VAL B O 1 ATOM 4559 C CB . VAL B 1 92 ? 13.837 48.295 92.443 1.00 50.97 ? 135 VAL B CB 1 ATOM 4560 C CG1 . VAL B 1 92 ? 14.734 47.550 93.399 1.00 72.11 ? 135 VAL B CG1 1 ATOM 4561 C CG2 . VAL B 1 92 ? 13.309 47.355 91.368 1.00 54.46 ? 135 VAL B CG2 1 ATOM 4562 N N . HIS B 1 93 ? 11.985 47.252 94.856 1.00 54.48 ? 136 HIS B N 1 ATOM 4563 C CA . HIS B 1 93 ? 11.034 46.306 95.431 1.00 54.45 ? 136 HIS B CA 1 ATOM 4564 C C . HIS B 1 93 ? 9.697 46.970 95.720 1.00 52.99 ? 136 HIS B C 1 ATOM 4565 O O . HIS B 1 93 ? 8.653 46.310 95.674 1.00 56.23 ? 136 HIS B O 1 ATOM 4566 C CB . HIS B 1 93 ? 11.599 45.685 96.708 1.00 56.91 ? 136 HIS B CB 1 ATOM 4567 C CG . HIS B 1 93 ? 12.439 44.471 96.470 1.00 64.25 ? 136 HIS B CG 1 ATOM 4568 N ND1 . HIS B 1 93 ? 13.809 44.528 96.319 1.00 64.44 ? 136 HIS B ND1 1 ATOM 4569 C CD2 . HIS B 1 93 ? 12.103 43.163 96.365 1.00 70.44 ? 136 HIS B CD2 1 ATOM 4570 C CE1 . HIS B 1 93 ? 14.279 43.309 96.125 1.00 72.73 ? 136 HIS B CE1 1 ATOM 4571 N NE2 . HIS B 1 93 ? 13.265 42.462 96.150 1.00 85.10 ? 136 HIS B NE2 1 ATOM 4572 N N . LEU B 1 94 ? 9.708 48.266 96.028 1.00 59.80 ? 137 LEU B N 1 ATOM 4573 C CA . LEU B 1 94 ? 8.463 48.969 96.306 1.00 57.44 ? 137 LEU B CA 1 ATOM 4574 C C . LEU B 1 94 ? 7.699 49.296 95.023 1.00 68.13 ? 137 LEU B C 1 ATOM 4575 O O . LEU B 1 94 ? 6.467 49.204 94.994 1.00 68.49 ? 137 LEU B O 1 ATOM 4576 C CB . LEU B 1 94 ? 8.763 50.239 97.106 1.00 63.46 ? 137 LEU B CB 1 ATOM 4577 C CG . LEU B 1 94 ? 7.600 51.093 97.610 1.00 64.79 ? 137 LEU B CG 1 ATOM 4578 C CD1 . LEU B 1 94 ? 6.724 50.291 98.556 1.00 68.39 ? 137 LEU B CD1 1 ATOM 4579 C CD2 . LEU B 1 94 ? 8.127 52.339 98.302 1.00 64.16 ? 137 LEU B CD2 1 ATOM 4580 N N . PHE B 1 95 ? 8.410 49.679 93.956 1.00 60.76 ? 138 PHE B N 1 ATOM 4581 C CA . PHE B 1 95 ? 7.755 50.098 92.715 1.00 58.73 ? 138 PHE B CA 1 ATOM 4582 C C . PHE B 1 95 ? 7.352 48.940 91.802 1.00 63.36 ? 138 PHE B C 1 ATOM 4583 O O . PHE B 1 95 ? 6.358 49.058 91.072 1.00 62.60 ? 138 PHE B O 1 ATOM 4584 C CB . PHE B 1 95 ? 8.656 51.067 91.949 1.00 59.26 ? 138 PHE B CB 1 ATOM 4585 C CG . PHE B 1 95 ? 8.704 52.442 92.545 1.00 81.33 ? 138 PHE B CG 1 ATOM 4586 C CD1 . PHE B 1 95 ? 9.192 52.646 93.825 1.00 90.97 ? 138 PHE B CD1 1 ATOM 4587 C CD2 . PHE B 1 95 ? 8.253 53.535 91.823 1.00 84.55 ? 138 PHE B CD2 1 ATOM 4588 C CE1 . PHE B 1 95 ? 9.227 53.915 94.373 1.00 83.98 ? 138 PHE B CE1 1 ATOM 4589 C CE2 . PHE B 1 95 ? 8.288 54.805 92.365 1.00 90.91 ? 138 PHE B CE2 1 ATOM 4590 C CZ . PHE B 1 95 ? 8.777 54.996 93.641 1.00 89.79 ? 138 PHE B CZ 1 ATOM 4591 N N . GLU B 1 96 ? 8.099 47.831 91.822 1.00 69.88 ? 139 GLU B N 1 ATOM 4592 C CA . GLU B 1 96 ? 8.041 46.851 90.737 1.00 66.78 ? 139 GLU B CA 1 ATOM 4593 C C . GLU B 1 96 ? 6.609 46.439 90.408 1.00 59.79 ? 139 GLU B C 1 ATOM 4594 O O . GLU B 1 96 ? 6.179 46.522 89.252 1.00 60.64 ? 139 GLU B O 1 ATOM 4595 C CB . GLU B 1 96 ? 8.888 45.622 91.094 1.00 66.86 ? 139 GLU B CB 1 ATOM 4596 C CG . GLU B 1 96 ? 8.444 44.884 92.357 1.00 83.52 ? 139 GLU B CG 1 ATOM 4597 C CD . GLU B 1 96 ? 9.276 43.639 92.653 1.00 78.25 ? 139 GLU B CD 1 ATOM 4598 O OE1 . GLU B 1 96 ? 10.224 43.346 91.894 1.00 77.11 ? 139 GLU B OE1 1 ATOM 4599 O OE2 . GLU B 1 96 ? 8.979 42.951 93.654 1.00 84.03 -1 139 GLU B OE2 1 ATOM 4600 N N . ASP B 1 97 ? 5.852 46.002 91.414 1.00 65.82 ? 140 ASP B N 1 ATOM 4601 C CA . ASP B 1 97 ? 4.497 45.505 91.200 1.00 68.40 ? 140 ASP B CA 1 ATOM 4602 C C . ASP B 1 97 ? 3.683 46.458 90.331 1.00 74.63 ? 140 ASP B C 1 ATOM 4603 O O . ASP B 1 97 ? 3.368 46.158 89.171 1.00 73.51 ? 140 ASP B O 1 ATOM 4604 C CB . ASP B 1 97 ? 3.787 45.305 92.544 1.00 91.00 ? 140 ASP B CB 1 ATOM 4605 C CG . ASP B 1 97 ? 4.489 44.292 93.438 1.00 117.08 ? 140 ASP B CG 1 ATOM 4606 O OD1 . ASP B 1 97 ? 4.947 43.251 92.918 1.00 119.28 ? 140 ASP B OD1 1 ATOM 4607 O OD2 . ASP B 1 97 ? 4.580 44.540 94.662 1.00 97.81 -1 140 ASP B OD2 1 ATOM 4608 N N . ASP B 1 98 ? 3.357 47.624 90.889 1.00 71.78 ? 141 ASP B N 1 ATOM 4609 C CA . ASP B 1 98 ? 2.469 48.552 90.201 1.00 71.81 ? 141 ASP B CA 1 ATOM 4610 C C . ASP B 1 98 ? 3.083 49.069 88.906 1.00 68.79 ? 141 ASP B C 1 ATOM 4611 O O . ASP B 1 98 ? 2.363 49.288 87.923 1.00 72.87 ? 141 ASP B O 1 ATOM 4612 C CB . ASP B 1 98 ? 2.115 49.705 91.141 1.00 74.91 ? 141 ASP B CB 1 ATOM 4613 C CG . ASP B 1 98 ? 1.565 49.218 92.475 1.00 97.83 ? 141 ASP B CG 1 ATOM 4614 O OD1 . ASP B 1 98 ? 0.881 48.170 92.491 1.00 93.56 ? 141 ASP B OD1 1 ATOM 4615 O OD2 . ASP B 1 98 ? 1.823 49.875 93.508 1.00 74.99 -1 141 ASP B OD2 1 ATOM 4616 N N . MET B 1 99 ? 4.405 49.259 88.875 1.00 75.44 ? 142 MET B N 1 ATOM 4617 C CA . MET B 1 99 ? 5.059 49.694 87.645 1.00 68.41 ? 142 MET B CA 1 ATOM 4618 C C . MET B 1 99 ? 4.766 48.725 86.504 1.00 69.73 ? 142 MET B C 1 ATOM 4619 O O . MET B 1 99 ? 4.211 49.107 85.463 1.00 69.68 ? 142 MET B O 1 ATOM 4620 C CB . MET B 1 99 ? 6.565 49.829 87.875 1.00 74.99 ? 142 MET B CB 1 ATOM 4621 C CG . MET B 1 99 ? 7.277 50.642 86.814 1.00 77.65 ? 142 MET B CG 1 ATOM 4622 S SD . MET B 1 99 ? 6.758 52.369 86.880 1.00 115.39 ? 142 MET B SD 1 ATOM 4623 C CE . MET B 1 99 ? 7.180 52.783 88.571 1.00 73.86 ? 142 MET B CE 1 ATOM 4624 N N . VAL B 1 100 ? 5.143 47.455 86.684 1.00 61.74 ? 143 VAL B N 1 ATOM 4625 C CA . VAL B 1 100 ? 4.841 46.443 85.676 1.00 55.95 ? 143 VAL B CA 1 ATOM 4626 C C . VAL B 1 100 ? 3.357 46.455 85.347 1.00 50.25 ? 143 VAL B C 1 ATOM 4627 O O . VAL B 1 100 ? 2.962 46.303 84.186 1.00 58.58 ? 143 VAL B O 1 ATOM 4628 C CB . VAL B 1 100 ? 5.303 45.053 86.151 1.00 54.49 ? 143 VAL B CB 1 ATOM 4629 C CG1 . VAL B 1 100 ? 4.641 43.964 85.317 1.00 49.96 ? 143 VAL B CG1 1 ATOM 4630 C CG2 . VAL B 1 100 ? 6.816 44.942 86.066 1.00 48.37 ? 143 VAL B CG2 1 ATOM 4631 N N . GLU B 1 101 ? 2.508 46.635 86.359 1.00 58.45 ? 144 GLU B N 1 ATOM 4632 C CA . GLU B 1 101 ? 1.075 46.720 86.094 1.00 57.82 ? 144 GLU B CA 1 ATOM 4633 C C . GLU B 1 101 ? 0.777 47.761 85.020 1.00 51.06 ? 144 GLU B C 1 ATOM 4634 O O . GLU B 1 101 ? 0.119 47.467 84.013 1.00 70.28 ? 144 GLU B O 1 ATOM 4635 C CB . GLU B 1 101 ? 0.321 47.046 87.385 1.00 79.59 ? 144 GLU B CB 1 ATOM 4636 C CG . GLU B 1 101 ? -1.165 47.328 87.198 1.00 65.37 ? 144 GLU B CG 1 ATOM 4637 C CD . GLU B 1 101 ? -1.989 46.065 87.042 1.00 81.81 ? 144 GLU B CD 1 ATOM 4638 O OE1 . GLU B 1 101 ? -1.422 44.960 87.187 1.00 84.58 ? 144 GLU B OE1 1 ATOM 4639 O OE2 . GLU B 1 101 ? -3.206 46.178 86.775 1.00 75.67 -1 144 GLU B OE2 1 ATOM 4640 N N . VAL B 1 102 ? 1.280 48.984 85.205 1.00 54.89 ? 145 VAL B N 1 ATOM 4641 C CA . VAL B 1 102 ? 0.921 50.065 84.290 1.00 73.13 ? 145 VAL B CA 1 ATOM 4642 C C . VAL B 1 102 ? 1.539 49.839 82.914 1.00 61.87 ? 145 VAL B C 1 ATOM 4643 O O . VAL B 1 102 ? 0.863 49.983 81.888 1.00 56.44 ? 145 VAL B O 1 ATOM 4644 C CB . VAL B 1 102 ? 1.315 51.435 84.875 1.00 71.36 ? 145 VAL B CB 1 ATOM 4645 C CG1 . VAL B 1 102 ? 0.745 51.596 86.276 1.00 64.21 ? 145 VAL B CG1 1 ATOM 4646 C CG2 . VAL B 1 102 ? 2.827 51.613 84.875 1.00 64.43 ? 145 VAL B CG2 1 ATOM 4647 N N . TRP B 1 103 ? 2.825 49.477 82.861 1.00 54.39 ? 146 TRP B N 1 ATOM 4648 C CA . TRP B 1 103 ? 3.445 49.234 81.559 1.00 54.93 ? 146 TRP B CA 1 ATOM 4649 C C . TRP B 1 103 ? 2.694 48.153 80.792 1.00 63.24 ? 146 TRP B C 1 ATOM 4650 O O . TRP B 1 103 ? 2.375 48.318 79.608 1.00 55.67 ? 146 TRP B O 1 ATOM 4651 C CB . TRP B 1 103 ? 4.917 48.860 81.727 1.00 42.57 ? 146 TRP B CB 1 ATOM 4652 C CG . TRP B 1 103 ? 5.809 50.051 81.843 1.00 57.15 ? 146 TRP B CG 1 ATOM 4653 C CD1 . TRP B 1 103 ? 5.735 51.039 82.778 1.00 66.79 ? 146 TRP B CD1 1 ATOM 4654 C CD2 . TRP B 1 103 ? 6.911 50.387 80.989 1.00 68.49 ? 146 TRP B CD2 1 ATOM 4655 N NE1 . TRP B 1 103 ? 6.722 51.968 82.563 1.00 68.71 ? 146 TRP B NE1 1 ATOM 4656 C CE2 . TRP B 1 103 ? 7.458 51.592 81.471 1.00 62.25 ? 146 TRP B CE2 1 ATOM 4657 C CE3 . TRP B 1 103 ? 7.489 49.786 79.867 1.00 73.76 ? 146 TRP B CE3 1 ATOM 4658 C CZ2 . TRP B 1 103 ? 8.555 52.207 80.871 1.00 53.63 ? 146 TRP B CZ2 1 ATOM 4659 C CZ3 . TRP B 1 103 ? 8.581 50.399 79.272 1.00 66.39 ? 146 TRP B CZ3 1 ATOM 4660 C CH2 . TRP B 1 103 ? 9.102 51.595 79.777 1.00 54.87 ? 146 TRP B CH2 1 ATOM 4661 N N . ARG B 1 104 ? 2.393 47.041 81.459 1.00 61.06 ? 147 ARG B N 1 ATOM 4662 C CA . ARG B 1 104 ? 1.601 45.993 80.829 1.00 62.16 ? 147 ARG B CA 1 ATOM 4663 C C . ARG B 1 104 ? 0.275 46.540 80.314 1.00 54.21 ? 147 ARG B C 1 ATOM 4664 O O . ARG B 1 104 ? -0.157 46.196 79.209 1.00 56.58 ? 147 ARG B O 1 ATOM 4665 C CB . ARG B 1 104 ? 1.371 44.853 81.825 1.00 64.48 ? 147 ARG B CB 1 ATOM 4666 C CG . ARG B 1 104 ? 0.501 43.720 81.312 1.00 70.49 ? 147 ARG B CG 1 ATOM 4667 C CD . ARG B 1 104 ? 0.306 42.642 82.371 1.00 76.94 ? 147 ARG B CD 1 ATOM 4668 N NE . ARG B 1 104 ? -0.388 43.138 83.556 1.00 77.78 ? 147 ARG B NE 1 ATOM 4669 C CZ . ARG B 1 104 ? -1.707 43.279 83.645 1.00 91.29 ? 147 ARG B CZ 1 ATOM 4670 N NH1 . ARG B 1 104 ? -2.481 42.966 82.614 1.00 80.63 1 147 ARG B NH1 1 ATOM 4671 N NH2 . ARG B 1 104 ? -2.252 43.735 84.765 1.00 86.90 ? 147 ARG B NH2 1 ATOM 4672 N N . ARG B 1 105 ? -0.369 47.417 81.084 1.00 54.76 ? 148 ARG B N 1 ATOM 4673 C CA . ARG B 1 105 ? -1.684 47.906 80.689 1.00 51.38 ? 148 ARG B CA 1 ATOM 4674 C C . ARG B 1 105 ? -1.641 49.070 79.705 1.00 52.34 ? 148 ARG B C 1 ATOM 4675 O O . ARG B 1 105 ? -2.695 49.435 79.172 1.00 59.68 ? 148 ARG B O 1 ATOM 4676 C CB . ARG B 1 105 ? -2.478 48.331 81.927 1.00 65.32 ? 148 ARG B CB 1 ATOM 4677 C CG . ARG B 1 105 ? -2.793 47.200 82.884 1.00 71.86 ? 148 ARG B CG 1 ATOM 4678 C CD . ARG B 1 105 ? -3.610 47.683 84.072 1.00 71.69 ? 148 ARG B CD 1 ATOM 4679 N NE . ARG B 1 105 ? -4.859 48.320 83.664 1.00 67.68 ? 148 ARG B NE 1 ATOM 4680 C CZ . ARG B 1 105 ? -5.886 48.532 84.481 1.00 68.50 ? 148 ARG B CZ 1 ATOM 4681 N NH1 . ARG B 1 105 ? -5.813 48.150 85.750 1.00 63.83 1 148 ARG B NH1 1 ATOM 4682 N NH2 . ARG B 1 105 ? -6.987 49.118 84.027 1.00 63.59 ? 148 ARG B NH2 1 ATOM 4683 N N . SER B 1 106 ? -0.477 49.674 79.457 1.00 44.40 ? 149 SER B N 1 ATOM 4684 C CA . SER B 1 106 ? -0.438 50.830 78.565 1.00 58.66 ? 149 SER B CA 1 ATOM 4685 C C . SER B 1 106 ? 0.540 50.669 77.405 1.00 57.96 ? 149 SER B C 1 ATOM 4686 O O . SER B 1 106 ? 0.134 50.387 76.272 1.00 49.40 ? 149 SER B O 1 ATOM 4687 C CB . SER B 1 106 ? -0.081 52.087 79.360 1.00 64.61 ? 149 SER B CB 1 ATOM 4688 O OG . SER B 1 106 ? 1.268 52.042 79.790 1.00 62.43 ? 149 SER B OG 1 ATOM 4689 N N . VAL B 1 107 ? 1.853 50.854 77.957 1.00 51.32 ? 150 VAL B N 1 ATOM 4690 C CA . VAL B 1 107 ? 2.893 50.922 76.935 1.00 33.24 ? 150 VAL B CA 1 ATOM 4691 C C . VAL B 1 107 ? 2.937 49.638 76.122 1.00 48.21 ? 150 VAL B C 1 ATOM 4692 O O . VAL B 1 107 ? 3.043 49.673 74.890 1.00 58.83 ? 150 VAL B O 1 ATOM 4693 C CB . VAL B 1 107 ? 4.260 51.223 77.576 1.00 54.92 ? 150 VAL B CB 1 ATOM 4694 C CG1 . VAL B 1 107 ? 5.358 51.158 76.525 1.00 47.19 ? 150 VAL B CG1 1 ATOM 4695 C CG2 . VAL B 1 107 ? 4.241 52.585 78.258 1.00 39.58 ? 150 VAL B CG2 1 ATOM 4696 N N . LEU B 1 108 ? 2.852 48.488 76.786 1.00 69.10 ? 151 LEU B N 1 ATOM 4697 C CA . LEU B 1 108 ? 3.021 47.218 76.100 1.00 45.21 ? 151 LEU B CA 1 ATOM 4698 C C . LEU B 1 108 ? 1.709 46.588 75.666 1.00 51.90 ? 151 LEU B C 1 ATOM 4699 O O . LEU B 1 108 ? 1.732 45.538 75.019 1.00 77.02 ? 151 LEU B O 1 ATOM 4700 C CB . LEU B 1 108 ? 3.781 46.242 77.001 1.00 51.60 ? 151 LEU B CB 1 ATOM 4701 C CG . LEU B 1 108 ? 5.071 46.759 77.638 1.00 66.09 ? 151 LEU B CG 1 ATOM 4702 C CD1 . LEU B 1 108 ? 5.591 45.751 78.647 1.00 60.54 ? 151 LEU B CD1 1 ATOM 4703 C CD2 . LEU B 1 108 ? 6.123 47.050 76.580 1.00 52.01 ? 151 LEU B CD2 1 ATOM 4704 N N . SER B 1 109 ? 0.575 47.178 76.018 1.00 45.97 ? 152 SER B N 1 ATOM 4705 C CA . SER B 1 109 ? -0.703 46.582 75.664 1.00 63.28 ? 152 SER B CA 1 ATOM 4706 C C . SER B 1 109 ? -0.775 46.503 74.146 1.00 75.71 ? 152 SER B C 1 ATOM 4707 O O . SER B 1 109 ? -0.712 47.551 73.486 1.00 74.42 ? 152 SER B O 1 ATOM 4708 C CB . SER B 1 109 ? -1.872 47.399 76.206 1.00 74.02 ? 152 SER B CB 1 ATOM 4709 O OG . SER B 1 109 ? -1.830 48.732 75.725 1.00 56.99 ? 152 SER B OG 1 ATOM 4710 N N . PRO B 1 110 ? -0.909 45.361 73.533 1.00 92.02 ? 153 PRO B N 1 ATOM 4711 C CA . PRO B 1 110 ? -0.945 45.456 72.094 1.00 85.50 ? 153 PRO B CA 1 ATOM 4712 C C . PRO B 1 110 ? -2.319 45.926 71.728 1.00 93.41 ? 153 PRO B C 1 ATOM 4713 O O . PRO B 1 110 ? -3.258 45.191 71.978 1.00 96.32 ? 153 PRO B O 1 ATOM 4714 C CB . PRO B 1 110 ? -0.841 44.011 71.693 1.00 67.84 ? 153 PRO B CB 1 ATOM 4715 C CG . PRO B 1 110 ? -1.540 43.290 72.801 1.00 85.89 ? 153 PRO B CG 1 ATOM 4716 C CD . PRO B 1 110 ? -1.704 44.221 73.968 1.00 80.84 ? 153 PRO B CD 1 ATOM 4717 N N . SER B 1 111 ? -2.457 47.095 71.140 1.00 64.04 ? 154 SER B N 1 ATOM 4718 C CA . SER B 1 111 ? -1.388 48.019 70.940 1.00 68.56 ? 154 SER B CA 1 ATOM 4719 C C . SER B 1 111 ? -2.277 49.189 70.661 1.00 74.64 ? 154 SER B C 1 ATOM 4720 O O . SER B 1 111 ? -3.410 49.004 70.272 1.00 63.44 ? 154 SER B O 1 ATOM 4721 C CB . SER B 1 111 ? -0.511 47.658 69.742 1.00 77.39 ? 154 SER B CB 1 ATOM 4722 O OG . SER B 1 111 ? 0.177 46.425 69.942 1.00 92.64 ? 154 SER B OG 1 ATOM 4723 N N . GLU B 1 112 ? -1.793 50.396 70.832 1.00 68.11 ? 155 GLU B N 1 ATOM 4724 C CA . GLU B 1 112 ? -0.470 50.689 71.338 1.00 62.95 ? 155 GLU B CA 1 ATOM 4725 C C . GLU B 1 112 ? 0.767 50.211 70.662 1.00 61.32 ? 155 GLU B C 1 ATOM 4726 O O . GLU B 1 112 ? 0.985 50.438 69.511 1.00 76.71 ? 155 GLU B O 1 ATOM 4727 C CB . GLU B 1 112 ? -0.381 50.397 72.818 1.00 67.89 ? 155 GLU B CB 1 ATOM 4728 C CG . GLU B 1 112 ? -1.443 51.118 73.617 1.00 73.46 ? 155 GLU B CG 1 ATOM 4729 C CD . GLU B 1 112 ? -1.319 52.614 73.545 1.00 82.42 ? 155 GLU B CD 1 ATOM 4730 O OE1 . GLU B 1 112 ? -0.188 53.094 73.460 1.00 77.06 ? 155 GLU B OE1 1 ATOM 4731 O OE2 . GLU B 1 112 ? -2.347 53.303 73.585 1.00 78.80 -1 155 GLU B OE2 1 ATOM 4732 N N . ALA B 1 113 ? 1.593 49.550 71.429 1.00 59.89 ? 156 ALA B N 1 ATOM 4733 C CA . ALA B 1 113 ? 2.931 49.153 70.986 1.00 65.97 ? 156 ALA B CA 1 ATOM 4734 C C . ALA B 1 113 ? 2.993 48.878 69.486 1.00 66.71 ? 156 ALA B C 1 ATOM 4735 O O . ALA B 1 113 ? 3.859 49.410 68.780 1.00 70.04 ? 156 ALA B O 1 ATOM 4736 C CB . ALA B 1 113 ? 3.394 47.927 71.774 1.00 64.89 ? 156 ALA B CB 1 ATOM 4737 N N . CYS B 1 114 ? 2.084 48.044 68.977 1.00 60.39 ? 157 CYS B N 1 ATOM 4738 C CA . CYS B 1 114 ? 2.054 47.800 67.539 1.00 72.00 ? 157 CYS B CA 1 ATOM 4739 C C . CYS B 1 114 ? 1.709 49.075 66.779 1.00 74.38 ? 157 CYS B C 1 ATOM 4740 O O . CYS B 1 114 ? 2.339 49.392 65.763 1.00 60.10 ? 157 CYS B O 1 ATOM 4741 C CB . CYS B 1 114 ? 1.075 46.672 67.214 1.00 77.73 ? 157 CYS B CB 1 ATOM 4742 S SG . CYS B 1 114 ? 1.549 45.075 67.949 1.00 104.87 ? 157 CYS B SG 1 ATOM 4743 N N . GLY B 1 115 ? 0.726 49.834 67.270 1.00 67.77 ? 158 GLY B N 1 ATOM 4744 C CA . GLY B 1 115 ? 0.458 51.144 66.705 1.00 68.68 ? 158 GLY B CA 1 ATOM 4745 C C . GLY B 1 115 ? 1.653 52.074 66.741 1.00 67.45 ? 158 GLY B C 1 ATOM 4746 O O . GLY B 1 115 ? 1.706 53.038 65.971 1.00 69.17 ? 158 GLY B O 1 ATOM 4747 N N . LEU B 1 116 ? 2.609 51.818 67.633 1.00 70.63 ? 159 LEU B N 1 ATOM 4748 C CA . LEU B 1 116 ? 3.847 52.588 67.637 1.00 66.13 ? 159 LEU B CA 1 ATOM 4749 C C . LEU B 1 116 ? 4.792 52.105 66.546 1.00 70.79 ? 159 LEU B C 1 ATOM 4750 O O . LEU B 1 116 ? 5.356 52.911 65.799 1.00 58.10 ? 159 LEU B O 1 ATOM 4751 C CB . LEU B 1 116 ? 4.522 52.497 69.007 1.00 73.18 ? 159 LEU B CB 1 ATOM 4752 C CG . LEU B 1 116 ? 5.754 53.382 69.212 1.00 68.02 ? 159 LEU B CG 1 ATOM 4753 C CD1 . LEU B 1 116 ? 5.325 54.794 69.587 1.00 79.60 ? 159 LEU B CD1 1 ATOM 4754 C CD2 . LEU B 1 116 ? 6.696 52.805 70.262 1.00 44.39 ? 159 LEU B CD2 1 ATOM 4755 N N . LEU B 1 117 ? 4.970 50.786 66.438 1.00 68.45 ? 160 LEU B N 1 ATOM 4756 C CA . LEU B 1 117 ? 5.932 50.235 65.489 1.00 69.43 ? 160 LEU B CA 1 ATOM 4757 C C . LEU B 1 117 ? 5.401 50.228 64.061 1.00 75.69 ? 160 LEU B C 1 ATOM 4758 O O . LEU B 1 117 ? 6.188 50.295 63.109 1.00 73.76 ? 160 LEU B O 1 ATOM 4759 C CB . LEU B 1 117 ? 6.321 48.822 65.915 1.00 62.63 ? 160 LEU B CB 1 ATOM 4760 C CG . LEU B 1 117 ? 6.898 48.752 67.328 1.00 53.87 ? 160 LEU B CG 1 ATOM 4761 C CD1 . LEU B 1 117 ? 6.299 47.586 68.095 1.00 68.16 ? 160 LEU B CD1 1 ATOM 4762 C CD2 . LEU B 1 117 ? 8.414 48.646 67.278 1.00 50.02 ? 160 LEU B CD2 1 ATOM 4763 N N . LEU B 1 118 ? 4.084 50.139 63.893 1.00 76.67 ? 161 LEU B N 1 ATOM 4764 C CA . LEU B 1 118 ? 3.448 50.206 62.584 1.00 70.12 ? 161 LEU B CA 1 ATOM 4765 C C . LEU B 1 118 ? 2.620 51.478 62.447 1.00 60.56 ? 161 LEU B C 1 ATOM 4766 O O . LEU B 1 118 ? 2.915 52.322 61.598 1.00 80.61 ? 161 LEU B O 1 ATOM 4767 C CB . LEU B 1 118 ? 2.592 48.953 62.359 1.00 70.82 ? 161 LEU B CB 1 ATOM 4768 C CG . LEU B 1 118 ? 3.276 47.651 62.799 1.00 69.24 ? 161 LEU B CG 1 ATOM 4769 C CD1 . LEU B 1 118 ? 2.482 46.428 62.364 1.00 87.58 ? 161 LEU B CD1 1 ATOM 4770 C CD2 . LEU B 1 118 ? 4.721 47.566 62.308 1.00 34.70 ? 161 LEU B CD2 1 ATOM 4771 N N . GLY B 1 119 ? 1.587 51.633 63.268 1.00 66.96 ? 162 GLY B N 1 ATOM 4772 C CA . GLY B 1 119 ? 0.857 52.879 63.377 1.00 68.03 ? 162 GLY B CA 1 ATOM 4773 C C . GLY B 1 119 ? -0.370 52.934 62.487 1.00 76.90 ? 162 GLY B C 1 ATOM 4774 O O . GLY B 1 119 ? -0.481 52.235 61.481 1.00 91.70 ? 162 GLY B O 1 ATOM 4775 N N . SER B 1 120 ? -1.315 53.795 62.881 1.00 76.47 ? 163 SER B N 1 ATOM 4776 C CA . SER B 1 120 ? -2.488 54.015 62.047 1.00 86.00 ? 163 SER B CA 1 ATOM 4777 C C . SER B 1 120 ? -3.184 52.685 61.791 1.00 93.79 ? 163 SER B C 1 ATOM 4778 O O . SER B 1 120 ? -3.864 52.152 62.674 1.00 92.81 ? 163 SER B O 1 ATOM 4779 C CB . SER B 1 120 ? -2.101 54.705 60.739 1.00 104.81 ? 163 SER B CB 1 ATOM 4780 O OG . SER B 1 120 ? -1.699 56.043 60.979 1.00 94.88 ? 163 SER B OG 1 ATOM 4781 N N . THR B 1 121 ? -3.041 52.169 60.572 1.00 93.66 ? 164 THR B N 1 ATOM 4782 C CA . THR B 1 121 ? -3.678 50.933 60.130 1.00 94.30 ? 164 THR B CA 1 ATOM 4783 C C . THR B 1 121 ? -3.624 49.837 61.190 1.00 97.96 ? 164 THR B C 1 ATOM 4784 O O . THR B 1 121 ? -4.584 49.076 61.344 1.00 97.08 ? 164 THR B O 1 ATOM 4785 C CB . THR B 1 121 ? -3.009 50.438 58.849 1.00 87.93 ? 164 THR B CB 1 ATOM 4786 O OG1 . THR B 1 121 ? -1.621 50.188 59.107 1.00 77.39 ? 164 THR B OG1 1 ATOM 4787 C CG2 . THR B 1 121 ? -3.128 51.482 57.752 1.00 92.37 ? 164 THR B CG2 1 ATOM 4788 N N . CYS B 1 122 ? -2.514 49.736 61.919 1.00 91.29 ? 165 CYS B N 1 ATOM 4789 C CA . CYS B 1 122 ? -2.357 48.736 62.972 1.00 82.44 ? 165 CYS B CA 1 ATOM 4790 C C . CYS B 1 122 ? -2.154 49.459 64.295 1.00 98.98 ? 165 CYS B C 1 ATOM 4791 O O . CYS B 1 122 ? -1.127 50.115 64.499 1.00 106.99 ? 165 CYS B O 1 ATOM 4792 C CB . CYS B 1 122 ? -1.184 47.802 62.679 1.00 86.71 ? 165 CYS B CB 1 ATOM 4793 S SG . CYS B 1 122 ? -1.121 46.340 63.750 1.00 125.94 ? 165 CYS B SG 1 ATOM 4794 N N . GLY B 1 123 ? -3.135 49.341 65.189 1.00 98.89 ? 166 GLY B N 1 ATOM 4795 C CA . GLY B 1 123 ? -3.039 49.929 66.511 1.00 93.21 ? 166 GLY B CA 1 ATOM 4796 C C . GLY B 1 123 ? -3.169 51.438 66.523 1.00 76.79 ? 166 GLY B C 1 ATOM 4797 O O . GLY B 1 123 ? -3.137 52.081 65.470 1.00 84.60 ? 166 GLY B O 1 ATOM 4798 N N . HIS B 1 124 ? -3.327 52.013 67.714 1.00 90.77 ? 167 HIS B N 1 ATOM 4799 C CA . HIS B 1 124 ? -3.413 53.459 67.888 1.00 82.61 ? 167 HIS B CA 1 ATOM 4800 C C . HIS B 1 124 ? -2.626 53.838 69.131 1.00 78.71 ? 167 HIS B C 1 ATOM 4801 O O . HIS B 1 124 ? -2.910 53.332 70.220 1.00 78.42 ? 167 HIS B O 1 ATOM 4802 C CB . HIS B 1 124 ? -4.871 53.913 68.015 1.00 76.55 ? 167 HIS B CB 1 ATOM 4803 C CG . HIS B 1 124 ? -5.032 55.388 68.210 1.00 101.74 ? 167 HIS B CG 1 ATOM 4804 N ND1 . HIS B 1 124 ? -5.915 55.924 69.123 1.00 102.33 ? 167 HIS B ND1 1 ATOM 4805 C CD2 . HIS B 1 124 ? -4.426 56.440 67.610 1.00 104.82 ? 167 HIS B CD2 1 ATOM 4806 C CE1 . HIS B 1 124 ? -5.845 57.243 69.079 1.00 101.15 ? 167 HIS B CE1 1 ATOM 4807 N NE2 . HIS B 1 124 ? -4.949 57.582 68.169 1.00 118.84 ? 167 HIS B NE2 1 ATOM 4808 N N . TRP B 1 125 ? -1.655 54.735 68.978 1.00 79.55 ? 168 TRP B N 1 ATOM 4809 C CA . TRP B 1 125 ? -0.806 55.157 70.089 1.00 75.49 ? 168 TRP B CA 1 ATOM 4810 C C . TRP B 1 125 ? -1.295 56.530 70.542 1.00 85.65 ? 168 TRP B C 1 ATOM 4811 O O . TRP B 1 125 ? -1.037 57.542 69.886 1.00 79.84 ? 168 TRP B O 1 ATOM 4812 C CB . TRP B 1 125 ? 0.654 55.175 69.643 1.00 58.57 ? 168 TRP B CB 1 ATOM 4813 C CG . TRP B 1 125 ? 1.613 55.843 70.577 1.00 70.62 ? 168 TRP B CG 1 ATOM 4814 C CD1 . TRP B 1 125 ? 1.818 57.184 70.725 1.00 78.07 ? 168 TRP B CD1 1 ATOM 4815 C CD2 . TRP B 1 125 ? 2.529 55.197 71.470 1.00 82.85 ? 168 TRP B CD2 1 ATOM 4816 N NE1 . TRP B 1 125 ? 2.791 57.414 71.667 1.00 86.89 ? 168 TRP B NE1 1 ATOM 4817 C CE2 . TRP B 1 125 ? 3.245 56.210 72.140 1.00 83.56 ? 168 TRP B CE2 1 ATOM 4818 C CE3 . TRP B 1 125 ? 2.806 53.859 71.777 1.00 81.20 ? 168 TRP B CE3 1 ATOM 4819 C CZ2 . TRP B 1 125 ? 4.221 55.930 73.096 1.00 74.78 ? 168 TRP B CZ2 1 ATOM 4820 C CZ3 . TRP B 1 125 ? 3.775 53.582 72.726 1.00 69.30 ? 168 TRP B CZ3 1 ATOM 4821 C CH2 . TRP B 1 125 ? 4.471 54.613 73.374 1.00 66.64 ? 168 TRP B CH2 1 ATOM 4822 N N . ASP B 1 126 ? -2.014 56.555 71.666 1.00 81.74 ? 169 ASP B N 1 ATOM 4823 C CA . ASP B 1 126 ? -2.562 57.777 72.243 1.00 73.55 ? 169 ASP B CA 1 ATOM 4824 C C . ASP B 1 126 ? -1.778 58.295 73.441 1.00 75.65 ? 169 ASP B C 1 ATOM 4825 O O . ASP B 1 126 ? -2.214 59.265 74.066 1.00 85.49 ? 169 ASP B O 1 ATOM 4826 C CB . ASP B 1 126 ? -4.029 57.575 72.637 1.00 67.90 ? 169 ASP B CB 1 ATOM 4827 C CG . ASP B 1 126 ? -4.230 56.396 73.557 1.00 92.90 ? 169 ASP B CG 1 ATOM 4828 O OD1 . ASP B 1 126 ? -3.265 56.007 74.246 1.00 104.01 ? 169 ASP B OD1 1 ATOM 4829 O OD2 . ASP B 1 126 ? -5.358 55.863 73.597 1.00 110.55 -1 169 ASP B OD2 1 ATOM 4830 N N . ILE B 1 127 ? -0.660 57.659 73.802 1.00 78.35 ? 170 ILE B N 1 ATOM 4831 C CA . ILE B 1 127 ? -0.003 57.972 75.066 1.00 73.82 ? 170 ILE B CA 1 ATOM 4832 C C . ILE B 1 127 ? 0.271 59.463 75.163 1.00 72.66 ? 170 ILE B C 1 ATOM 4833 O O . ILE B 1 127 ? 0.916 60.053 74.290 1.00 85.15 ? 170 ILE B O 1 ATOM 4834 C CB . ILE B 1 127 ? 1.294 57.158 75.209 1.00 74.95 ? 170 ILE B CB 1 ATOM 4835 C CG1 . ILE B 1 127 ? 0.974 55.672 75.380 1.00 71.70 ? 170 ILE B CG1 1 ATOM 4836 C CG2 . ILE B 1 127 ? 2.131 57.688 76.364 1.00 65.55 ? 170 ILE B CG2 1 ATOM 4837 C CD1 . ILE B 1 127 ? -0.033 55.390 76.473 1.00 60.65 ? 170 ILE B CD1 1 ATOM 4838 N N . PHE B 1 128 ? -0.209 60.074 76.248 1.00 66.10 ? 171 PHE B N 1 ATOM 4839 C CA . PHE B 1 128 ? -0.044 61.508 76.482 1.00 67.56 ? 171 PHE B CA 1 ATOM 4840 C C . PHE B 1 128 ? -0.583 62.329 75.312 1.00 76.96 ? 171 PHE B C 1 ATOM 4841 O O . PHE B 1 128 ? -0.003 63.342 74.918 1.00 61.47 ? 171 PHE B O 1 ATOM 4842 C CB . PHE B 1 128 ? 1.422 61.843 76.764 1.00 65.18 ? 171 PHE B CB 1 ATOM 4843 C CG . PHE B 1 128 ? 1.903 61.363 78.106 1.00 83.00 ? 171 PHE B CG 1 ATOM 4844 C CD1 . PHE B 1 128 ? 1.028 61.278 79.179 1.00 72.21 ? 171 PHE B CD1 1 ATOM 4845 C CD2 . PHE B 1 128 ? 3.224 60.984 78.293 1.00 64.17 ? 171 PHE B CD2 1 ATOM 4846 C CE1 . PHE B 1 128 ? 1.463 60.839 80.414 1.00 48.78 ? 171 PHE B CE1 1 ATOM 4847 C CE2 . PHE B 1 128 ? 3.664 60.541 79.527 1.00 41.55 ? 171 PHE B CE2 1 ATOM 4848 C CZ . PHE B 1 128 ? 2.783 60.467 80.586 1.00 41.10 ? 171 PHE B CZ 1 ATOM 4849 N N . SER B 1 129 ? -1.698 61.878 74.743 1.00 74.46 ? 172 SER B N 1 ATOM 4850 C CA . SER B 1 129 ? -2.325 62.587 73.640 1.00 70.86 ? 172 SER B CA 1 ATOM 4851 C C . SER B 1 129 ? -3.068 63.823 74.140 1.00 64.09 ? 172 SER B C 1 ATOM 4852 O O . SER B 1 129 ? -3.442 63.930 75.310 1.00 75.20 ? 172 SER B O 1 ATOM 4853 C CB . SER B 1 129 ? -3.291 61.671 72.889 1.00 79.82 ? 172 SER B CB 1 ATOM 4854 O OG . SER B 1 129 ? -4.432 61.376 73.678 1.00 85.35 ? 172 SER B OG 1 ATOM 4855 N N . SER B 1 130 ? -3.295 64.756 73.219 1.00 52.42 ? 173 SER B N 1 ATOM 4856 C CA . SER B 1 130 ? -4.035 65.971 73.517 1.00 50.04 ? 173 SER B CA 1 ATOM 4857 C C . SER B 1 130 ? -5.501 65.660 73.815 1.00 46.87 ? 173 SER B C 1 ATOM 4858 O O . SER B 1 130 ? -6.051 64.642 73.386 1.00 71.94 ? 173 SER B O 1 ATOM 4859 C CB . SER B 1 130 ? -3.928 66.952 72.350 1.00 65.90 ? 173 SER B CB 1 ATOM 4860 O OG . SER B 1 130 ? -4.974 67.906 72.380 1.00 93.62 ? 173 SER B OG 1 ATOM 4861 N N . TRP B 1 131 ? -6.130 66.553 74.577 1.00 50.15 ? 174 TRP B N 1 ATOM 4862 C CA . TRP B 1 131 ? -7.552 66.459 74.885 1.00 53.76 ? 174 TRP B CA 1 ATOM 4863 C C . TRP B 1 131 ? -8.054 67.840 75.284 1.00 67.33 ? 174 TRP B C 1 ATOM 4864 O O . TRP B 1 131 ? -7.267 68.730 75.619 1.00 73.68 ? 174 TRP B O 1 ATOM 4865 C CB . TRP B 1 131 ? -7.822 65.436 75.997 1.00 68.69 ? 174 TRP B CB 1 ATOM 4866 C CG . TRP B 1 131 ? -6.867 65.520 77.159 1.00 62.07 ? 174 TRP B CG 1 ATOM 4867 C CD1 . TRP B 1 131 ? -5.632 64.945 77.248 1.00 63.06 ? 174 TRP B CD1 1 ATOM 4868 C CD2 . TRP B 1 131 ? -7.081 66.202 78.402 1.00 48.13 ? 174 TRP B CD2 1 ATOM 4869 N NE1 . TRP B 1 131 ? -5.059 65.237 78.461 1.00 51.29 ? 174 TRP B NE1 1 ATOM 4870 C CE2 . TRP B 1 131 ? -5.928 66.006 79.189 1.00 50.49 ? 174 TRP B CE2 1 ATOM 4871 C CE3 . TRP B 1 131 ? -8.132 66.963 78.922 1.00 50.82 ? 174 TRP B CE3 1 ATOM 4872 C CZ2 . TRP B 1 131 ? -5.798 66.542 80.469 1.00 49.31 ? 174 TRP B CZ2 1 ATOM 4873 C CZ3 . TRP B 1 131 ? -8.001 67.494 80.194 1.00 45.70 ? 174 TRP B CZ3 1 ATOM 4874 C CH2 . TRP B 1 131 ? -6.842 67.282 80.953 1.00 44.09 ? 174 TRP B CH2 1 ATOM 4875 N N . ASN B 1 132 ? -9.377 68.013 75.239 1.00 61.38 ? 175 ASN B N 1 ATOM 4876 C CA . ASN B 1 132 ? -10.004 69.282 75.590 1.00 77.99 ? 175 ASN B CA 1 ATOM 4877 C C . ASN B 1 132 ? -11.223 69.032 76.466 1.00 78.23 ? 175 ASN B C 1 ATOM 4878 O O . ASN B 1 132 ? -11.902 68.009 76.340 1.00 77.95 ? 175 ASN B O 1 ATOM 4879 C CB . ASN B 1 132 ? -10.452 70.098 74.370 1.00 79.62 ? 175 ASN B CB 1 ATOM 4880 C CG . ASN B 1 132 ? -9.360 70.283 73.341 1.00 109.97 ? 175 ASN B CG 1 ATOM 4881 O OD1 . ASN B 1 132 ? -8.173 70.118 73.624 1.00 108.06 ? 175 ASN B OD1 1 ATOM 4882 N ND2 . ASN B 1 132 ? -9.770 70.646 72.130 1.00 133.99 ? 175 ASN B ND2 1 ATOM 4883 N N . ILE B 1 133 ? -11.491 69.988 77.364 1.00 59.55 ? 176 ILE B N 1 ATOM 4884 C CA . ILE B 1 133 ? -12.515 69.805 78.388 1.00 72.06 ? 176 ILE B CA 1 ATOM 4885 C C . ILE B 1 133 ? -13.880 70.369 78.011 1.00 73.30 ? 176 ILE B C 1 ATOM 4886 O O . ILE B 1 133 ? -14.869 70.068 78.696 1.00 81.60 ? 176 ILE B O 1 ATOM 4887 C CB . ILE B 1 133 ? -12.058 70.434 79.719 1.00 73.11 ? 176 ILE B CB 1 ATOM 4888 C CG1 . ILE B 1 133 ? -13.007 70.034 80.849 1.00 71.38 ? 176 ILE B CG1 1 ATOM 4889 C CG2 . ILE B 1 133 ? -11.961 71.948 79.585 1.00 72.19 ? 176 ILE B CG2 1 ATOM 4890 C CD1 . ILE B 1 133 ? -13.232 68.541 80.955 1.00 70.34 ? 176 ILE B CD1 1 ATOM 4891 N N . SER B 1 134 ? -13.981 71.150 76.935 1.00 77.93 ? 177 SER B N 1 ATOM 4892 C CA . SER B 1 134 ? -15.288 71.612 76.473 1.00 96.05 ? 177 SER B CA 1 ATOM 4893 C C . SER B 1 134 ? -16.045 72.444 77.509 1.00 78.56 ? 177 SER B C 1 ATOM 4894 O O . SER B 1 134 ? -16.967 71.942 78.159 1.00 77.20 ? 177 SER B O 1 ATOM 4895 C CB . SER B 1 134 ? -16.145 70.417 76.049 1.00 94.72 ? 177 SER B CB 1 ATOM 4896 O OG . SER B 1 134 ? -16.543 69.651 77.172 1.00 81.21 ? 177 SER B OG 1 ATOM 4897 N N . LEU B 1 135 ? -15.648 73.707 77.691 1.00 79.11 ? 178 LEU B N 1 ATOM 4898 C CA . LEU B 1 135 ? -16.373 74.611 78.576 1.00 74.30 ? 178 LEU B CA 1 ATOM 4899 C C . LEU B 1 135 ? -17.846 74.704 78.178 1.00 65.19 ? 178 LEU B C 1 ATOM 4900 O O . LEU B 1 135 ? -18.209 74.452 77.026 1.00 67.60 ? 178 LEU B O 1 ATOM 4901 C CB . LEU B 1 135 ? -15.756 76.008 78.534 1.00 49.51 ? 178 LEU B CB 1 ATOM 4902 C CG . LEU B 1 135 ? -14.233 76.082 78.531 1.00 49.32 ? 178 LEU B CG 1 ATOM 4903 C CD1 . LEU B 1 135 ? -13.777 77.514 78.344 1.00 62.36 ? 178 LEU B CD1 1 ATOM 4904 C CD2 . LEU B 1 135 ? -13.680 75.499 79.821 1.00 67.27 ? 178 LEU B CD2 1 ATOM 4905 N N . PRO B 1 136 ? -18.715 75.073 79.117 1.00 73.74 ? 179 PRO B N 1 ATOM 4906 C CA . PRO B 1 136 ? -20.134 75.230 78.786 1.00 67.66 ? 179 PRO B CA 1 ATOM 4907 C C . PRO B 1 136 ? -20.362 76.433 77.884 1.00 68.67 ? 179 PRO B C 1 ATOM 4908 O O . PRO B 1 136 ? -19.536 77.343 77.786 1.00 72.66 ? 179 PRO B O 1 ATOM 4909 C CB . PRO B 1 136 ? -20.798 75.425 80.152 1.00 68.91 ? 179 PRO B CB 1 ATOM 4910 C CG . PRO B 1 136 ? -19.723 76.027 80.996 1.00 72.94 ? 179 PRO B CG 1 ATOM 4911 C CD . PRO B 1 136 ? -18.432 75.412 80.523 1.00 70.82 ? 179 PRO B CD 1 ATOM 4912 N N . THR B 1 137 ? -21.529 76.436 77.236 1.00 85.31 ? 180 THR B N 1 ATOM 4913 C CA . THR B 1 137 ? -21.851 77.431 76.219 1.00 87.38 ? 180 THR B CA 1 ATOM 4914 C C . THR B 1 137 ? -22.242 78.790 76.789 1.00 80.88 ? 180 THR B C 1 ATOM 4915 O O . THR B 1 137 ? -22.437 79.728 76.009 1.00 86.61 ? 180 THR B O 1 ATOM 4916 C CB . THR B 1 137 ? -22.981 76.920 75.322 1.00 75.18 ? 180 THR B CB 1 ATOM 4917 O OG1 . THR B 1 137 ? -24.126 76.602 76.123 1.00 90.02 ? 180 THR B OG1 1 ATOM 4918 C CG2 . THR B 1 137 ? -22.537 75.682 74.560 1.00 67.26 ? 180 THR B CG2 1 ATOM 4919 N N . VAL B 1 138 ? -22.375 78.919 78.105 1.00 72.18 ? 181 VAL B N 1 ATOM 4920 C CA . VAL B 1 138 ? -22.785 80.209 78.673 1.00 68.62 ? 181 VAL B CA 1 ATOM 4921 C C . VAL B 1 138 ? -21.807 81.290 78.226 1.00 71.95 ? 181 VAL B C 1 ATOM 4922 O O . VAL B 1 138 ? -20.579 81.102 78.345 1.00 65.39 ? 181 VAL B O 1 ATOM 4923 C CB . VAL B 1 138 ? -22.854 80.127 80.208 1.00 65.80 ? 181 VAL B CB 1 ATOM 4924 C CG1 . VAL B 1 138 ? -23.373 81.434 80.787 1.00 64.90 ? 181 VAL B CG1 1 ATOM 4925 C CG2 . VAL B 1 138 ? -23.734 78.964 80.635 1.00 70.24 ? 181 VAL B CG2 1 ATOM 4926 N N . PRO B 1 139 ? -22.279 82.424 77.704 1.00 79.79 ? 182 PRO B N 1 ATOM 4927 C CA . PRO B 1 139 ? -21.353 83.459 77.226 1.00 67.91 ? 182 PRO B CA 1 ATOM 4928 C C . PRO B 1 139 ? -20.614 84.135 78.372 1.00 56.98 ? 182 PRO B C 1 ATOM 4929 O O . PRO B 1 139 ? -21.186 84.425 79.426 1.00 51.79 ? 182 PRO B O 1 ATOM 4930 C CB . PRO B 1 139 ? -22.271 84.443 76.493 1.00 51.96 ? 182 PRO B CB 1 ATOM 4931 C CG . PRO B 1 139 ? -23.598 84.269 77.154 1.00 63.06 ? 182 PRO B CG 1 ATOM 4932 C CD . PRO B 1 139 ? -23.689 82.811 77.516 1.00 67.86 ? 182 PRO B CD 1 ATOM 4933 N N . LYS B 1 140 ? -19.335 84.402 78.143 1.00 51.02 ? 183 LYS B N 1 ATOM 4934 C CA . LYS B 1 140 ? -18.486 84.955 79.190 1.00 58.00 ? 183 LYS B CA 1 ATOM 4935 C C . LYS B 1 140 ? -18.948 86.363 79.545 1.00 66.81 ? 183 LYS B C 1 ATOM 4936 O O . LYS B 1 140 ? -19.104 87.204 78.651 1.00 65.38 ? 183 LYS B O 1 ATOM 4937 C CB . LYS B 1 140 ? -17.029 84.971 78.738 1.00 59.47 ? 183 LYS B CB 1 ATOM 4938 C CG . LYS B 1 140 ? -16.067 85.562 79.751 1.00 48.60 ? 183 LYS B CG 1 ATOM 4939 C CD . LYS B 1 140 ? -14.638 85.503 79.239 1.00 45.12 ? 183 LYS B CD 1 ATOM 4940 C CE . LYS B 1 140 ? -13.662 86.077 80.251 1.00 52.28 ? 183 LYS B CE 1 ATOM 4941 N NZ . LYS B 1 140 ? -12.264 86.037 79.744 1.00 53.01 1 183 LYS B NZ 1 ATOM 4942 N N . PRO B 1 141 ? -19.165 86.664 80.825 1.00 70.48 ? 184 PRO B N 1 ATOM 4943 C CA . PRO B 1 141 ? -19.584 88.011 81.193 1.00 65.96 ? 184 PRO B CA 1 ATOM 4944 C C . PRO B 1 141 ? -18.517 89.022 80.828 1.00 75.09 ? 184 PRO B C 1 ATOM 4945 O O . PRO B 1 141 ? -17.318 88.692 80.764 1.00 74.99 ? 184 PRO B O 1 ATOM 4946 C CB . PRO B 1 141 ? -19.778 87.918 82.713 1.00 69.02 ? 184 PRO B CB 1 ATOM 4947 C CG . PRO B 1 141 ? -18.935 86.761 83.134 1.00 78.98 ? 184 PRO B CG 1 ATOM 4948 C CD . PRO B 1 141 ? -18.984 85.791 81.996 1.00 65.68 ? 184 PRO B CD 1 ATOM 4949 N N . PRO B 1 142 ? -18.904 90.271 80.592 1.00 85.59 ? 185 PRO B N 1 ATOM 4950 C CA . PRO B 1 142 ? -17.934 91.285 80.170 1.00 86.46 ? 185 PRO B CA 1 ATOM 4951 C C . PRO B 1 142 ? -16.888 91.515 81.243 1.00 87.49 ? 185 PRO B C 1 ATOM 4952 O O . PRO B 1 142 ? -17.215 91.604 82.436 1.00 77.24 ? 185 PRO B O 1 ATOM 4953 C CB . PRO B 1 142 ? -18.800 92.535 79.954 1.00 72.39 ? 185 PRO B CB 1 ATOM 4954 C CG . PRO B 1 142 ? -19.989 92.322 80.828 1.00 76.50 ? 185 PRO B CG 1 ATOM 4955 C CD . PRO B 1 142 ? -20.246 90.840 80.807 1.00 90.51 ? 185 PRO B CD 1 ATOM 4956 N N . PRO B 1 143 ? -15.617 91.618 80.859 1.00 91.48 ? 186 PRO B N 1 ATOM 4957 C CA . PRO B 1 143 ? -14.555 91.769 81.856 1.00 85.50 ? 186 PRO B CA 1 ATOM 4958 C C . PRO B 1 143 ? -14.738 93.036 82.676 1.00 91.60 ? 186 PRO B C 1 ATOM 4959 O O . PRO B 1 143 ? -15.477 93.951 82.307 1.00 95.78 ? 186 PRO B O 1 ATOM 4960 C CB . PRO B 1 143 ? -13.276 91.832 81.009 1.00 97.54 ? 186 PRO B CB 1 ATOM 4961 C CG . PRO B 1 143 ? -13.645 91.190 79.709 1.00 92.55 ? 186 PRO B CG 1 ATOM 4962 C CD . PRO B 1 143 ? -15.085 91.546 79.488 1.00 96.31 ? 186 PRO B CD 1 ATOM 4963 N N . LYS B 1 144 ? -14.050 93.072 83.814 1.00 101.68 ? 187 LYS B N 1 ATOM 4964 C CA . LYS B 1 144 ? -14.110 94.203 84.730 1.00 100.09 ? 187 LYS B CA 1 ATOM 4965 C C . LYS B 1 144 ? -13.161 93.963 85.897 1.00 102.29 ? 187 LYS B C 1 ATOM 4966 O O . LYS B 1 144 ? -13.072 92.838 86.406 1.00 89.29 ? 187 LYS B O 1 ATOM 4967 C CB . LYS B 1 144 ? -15.539 94.420 85.234 1.00 94.27 ? 187 LYS B CB 1 ATOM 4968 C CG . LYS B 1 144 ? -15.695 95.587 86.204 1.00 97.63 ? 187 LYS B CG 1 ATOM 4969 C CD . LYS B 1 144 ? -15.485 96.926 85.512 1.00 87.83 ? 187 LYS B CD 1 ATOM 4970 C CE . LYS B 1 144 ? -15.474 98.075 86.509 1.00 78.23 ? 187 LYS B CE 1 ATOM 4971 N NZ . LYS B 1 144 ? -14.320 97.991 87.450 1.00 93.09 1 187 LYS B NZ 1 ATOM 4972 N N . PRO B 1 145 ? -12.436 94.984 86.340 1.00 120.60 ? 188 PRO B N 1 ATOM 4973 C CA . PRO B 1 145 ? -11.515 94.811 87.464 1.00 118.25 ? 188 PRO B CA 1 ATOM 4974 C C . PRO B 1 145 ? -12.274 94.759 88.777 1.00 114.87 ? 188 PRO B C 1 ATOM 4975 O O . PRO B 1 145 ? -13.369 95.330 88.893 1.00 116.98 ? 188 PRO B O 1 ATOM 4976 C CB . PRO B 1 145 ? -10.628 96.062 87.386 1.00 122.01 ? 188 PRO B CB 1 ATOM 4977 C CG . PRO B 1 145 ? -11.512 97.090 86.762 1.00 108.15 ? 188 PRO B CG 1 ATOM 4978 C CD . PRO B 1 145 ? -12.371 96.343 85.773 1.00 104.44 ? 188 PRO B CD 1 ATOM 4979 N N . PRO B 1 146 ? -11.731 94.090 89.790 1.00 117.62 ? 189 PRO B N 1 ATOM 4980 C CA . PRO B 1 146 ? -12.401 94.081 91.093 1.00 115.15 ? 189 PRO B CA 1 ATOM 4981 C C . PRO B 1 146 ? -12.323 95.456 91.734 1.00 99.21 ? 189 PRO B C 1 ATOM 4982 O O . PRO B 1 146 ? -11.344 96.189 91.576 1.00 100.45 ? 189 PRO B O 1 ATOM 4983 C CB . PRO B 1 146 ? -11.616 93.039 91.898 1.00 99.24 ? 189 PRO B CB 1 ATOM 4984 C CG . PRO B 1 146 ? -10.276 92.981 91.244 1.00 87.78 ? 189 PRO B CG 1 ATOM 4985 C CD . PRO B 1 146 ? -10.479 93.311 89.792 1.00 96.33 ? 189 PRO B CD 1 ATOM 4986 N N . SER B 1 147 ? -13.346 95.790 92.469 1.00 87.68 ? 190 SER B N 1 ATOM 4987 C CA . SER B 1 147 ? -13.140 97.154 92.924 1.00 97.17 ? 190 SER B CA 1 ATOM 4988 C C . SER B 1 147 ? -12.368 97.171 94.237 1.00 96.74 ? 190 SER B C 1 ATOM 4989 O O . SER B 1 147 ? -12.503 96.254 95.055 1.00 103.46 ? 190 SER B O 1 ATOM 4990 C CB . SER B 1 147 ? -14.480 97.861 93.109 1.00 102.88 ? 190 SER B CB 1 ATOM 4991 O OG . SER B 1 147 ? -15.178 97.956 91.879 1.00 101.52 ? 190 SER B OG 1 ATOM 4992 N N . PRO B 1 148 ? -11.549 98.193 94.461 1.00 85.36 ? 191 PRO B N 1 ATOM 4993 C CA . PRO B 1 148 ? -10.812 98.279 95.719 1.00 72.60 ? 191 PRO B CA 1 ATOM 4994 C C . PRO B 1 148 ? -11.770 98.226 96.893 1.00 69.92 ? 191 PRO B C 1 ATOM 4995 O O . PRO B 1 148 ? -12.844 98.845 96.858 1.00 86.41 ? 191 PRO B O 1 ATOM 4996 C CB . PRO B 1 148 ? -10.110 99.643 95.628 1.00 73.98 ? 191 PRO B CB 1 ATOM 4997 C CG . PRO B 1 148 ? -10.004 99.909 94.162 1.00 72.96 ? 191 PRO B CG 1 ATOM 4998 C CD . PRO B 1 148 ? -11.247 99.319 93.560 1.00 76.49 ? 191 PRO B CD 1 ATOM 4999 N N . PRO B 1 149 ? -11.426 97.492 97.947 1.00 69.59 ? 192 PRO B N 1 ATOM 5000 C CA . PRO B 1 149 ? -12.337 97.387 99.090 1.00 76.27 ? 192 PRO B CA 1 ATOM 5001 C C . PRO B 1 149 ? -12.563 98.749 99.727 1.00 78.94 ? 192 PRO B C 1 ATOM 5002 O O . PRO B 1 149 ? -11.652 99.576 99.807 1.00 81.89 ? 192 PRO B O 1 ATOM 5003 C CB . PRO B 1 149 ? -11.610 96.428 100.040 1.00 84.28 ? 192 PRO B CB 1 ATOM 5004 C CG . PRO B 1 149 ? -10.641 95.685 99.167 1.00 61.81 ? 192 PRO B CG 1 ATOM 5005 C CD . PRO B 1 149 ? -10.223 96.662 98.117 1.00 71.30 ? 192 PRO B CD 1 ATOM 5006 N N . ALA B 1 150 ? -13.796 98.986 100.165 1.00 73.18 ? 193 ALA B N 1 ATOM 5007 C CA . ALA B 1 150 ? -14.107 100.254 100.799 1.00 76.26 ? 193 ALA B CA 1 ATOM 5008 C C . ALA B 1 150 ? -13.262 100.426 102.060 1.00 80.64 ? 193 ALA B C 1 ATOM 5009 O O . ALA B 1 150 ? -12.872 99.441 102.697 1.00 76.28 ? 193 ALA B O 1 ATOM 5010 C CB . ALA B 1 150 ? -15.591 100.330 101.150 1.00 70.98 ? 193 ALA B CB 1 ATOM 5011 N N . PRO B 1 151 ? -12.966 101.665 102.449 1.00 85.77 ? 194 PRO B N 1 ATOM 5012 C CA . PRO B 1 151 ? -12.202 101.878 103.682 1.00 82.91 ? 194 PRO B CA 1 ATOM 5013 C C . PRO B 1 151 ? -12.966 101.353 104.888 1.00 74.56 ? 194 PRO B C 1 ATOM 5014 O O . PRO B 1 151 ? -14.188 101.487 104.980 1.00 72.34 ? 194 PRO B O 1 ATOM 5015 C CB . PRO B 1 151 ? -12.018 103.399 103.733 1.00 68.43 ? 194 PRO B CB 1 ATOM 5016 C CG . PRO B 1 151 ? -13.092 103.947 102.846 1.00 83.30 ? 194 PRO B CG 1 ATOM 5017 C CD . PRO B 1 151 ? -13.294 102.928 101.769 1.00 75.41 ? 194 PRO B CD 1 ATOM 5018 N N . GLY B 1 152 ? -12.226 100.763 105.825 1.00 83.20 ? 195 GLY B N 1 ATOM 5019 C CA . GLY B 1 152 ? -12.825 100.127 106.981 1.00 86.18 ? 195 GLY B CA 1 ATOM 5020 C C . GLY B 1 152 ? -13.555 98.834 106.694 1.00 79.15 ? 195 GLY B C 1 ATOM 5021 O O . GLY B 1 152 ? -14.237 98.313 107.582 1.00 78.49 ? 195 GLY B O 1 ATOM 5022 N N . ALA B 1 153 ? -13.421 98.292 105.486 1.00 80.56 ? 196 ALA B N 1 ATOM 5023 C CA . ALA B 1 153 ? -14.083 97.050 105.131 1.00 79.05 ? 196 ALA B CA 1 ATOM 5024 C C . ALA B 1 153 ? -13.464 95.873 105.883 1.00 70.02 ? 196 ALA B C 1 ATOM 5025 O O . ALA B 1 153 ? -12.331 95.955 106.366 1.00 49.74 ? 196 ALA B O 1 ATOM 5026 C CB . ALA B 1 153 ? -14.001 96.813 103.626 1.00 81.38 ? 196 ALA B CB 1 ATOM 5027 N N . PRO B 1 154 ? -14.199 94.770 106.007 1.00 74.18 ? 197 PRO B N 1 ATOM 5028 C CA . PRO B 1 154 ? -13.682 93.611 106.741 1.00 70.03 ? 197 PRO B CA 1 ATOM 5029 C C . PRO B 1 154 ? -12.559 92.909 105.990 1.00 62.81 ? 197 PRO B C 1 ATOM 5030 O O . PRO B 1 154 ? -12.394 93.047 104.776 1.00 68.76 ? 197 PRO B O 1 ATOM 5031 C CB . PRO B 1 154 ? -14.907 92.697 106.877 1.00 58.14 ? 197 PRO B CB 1 ATOM 5032 C CG . PRO B 1 154 ? -16.091 93.567 106.558 1.00 70.91 ? 197 PRO B CG 1 ATOM 5033 C CD . PRO B 1 154 ? -15.592 94.576 105.579 1.00 66.43 ? 197 PRO B CD 1 ATOM 5034 N N . VAL B 1 155 ? -11.788 92.127 106.743 1.00 62.27 ? 198 VAL B N 1 ATOM 5035 C CA . VAL B 1 155 ? -10.658 91.377 106.208 1.00 50.39 ? 198 VAL B CA 1 ATOM 5036 C C . VAL B 1 155 ? -10.657 89.977 106.806 1.00 50.35 ? 198 VAL B C 1 ATOM 5037 O O . VAL B 1 155 ? -10.895 89.799 108.005 1.00 69.31 ? 198 VAL B O 1 ATOM 5038 C CB . VAL B 1 155 ? -9.317 92.083 106.495 1.00 56.50 ? 198 VAL B CB 1 ATOM 5039 C CG1 . VAL B 1 155 ? -8.152 91.158 106.173 1.00 48.61 ? 198 VAL B CG1 1 ATOM 5040 C CG2 . VAL B 1 155 ? -9.221 93.377 105.705 1.00 62.40 ? 198 VAL B CG2 1 ATOM 5041 N N . SER B 1 156 ? -10.380 88.987 105.965 1.00 47.38 ? 199 SER B N 1 ATOM 5042 C CA . SER B 1 156 ? -10.321 87.585 106.359 1.00 58.73 ? 199 SER B CA 1 ATOM 5043 C C . SER B 1 156 ? -8.865 87.142 106.361 1.00 52.22 ? 199 SER B C 1 ATOM 5044 O O . SER B 1 156 ? -8.208 87.164 105.315 1.00 73.27 ? 199 SER B O 1 ATOM 5045 C CB . SER B 1 156 ? -11.147 86.719 105.406 1.00 65.56 ? 199 SER B CB 1 ATOM 5046 O OG . SER B 1 156 ? -10.941 85.339 105.653 1.00 70.72 ? 199 SER B OG 1 ATOM 5047 N N . ARG B 1 157 ? -8.360 86.753 107.529 1.00 58.08 ? 200 ARG B N 1 ATOM 5048 C CA . ARG B 1 157 ? -6.994 86.263 107.649 1.00 51.54 ? 200 ARG B CA 1 ATOM 5049 C C . ARG B 1 157 ? -6.984 84.748 107.493 1.00 52.86 ? 200 ARG B C 1 ATOM 5050 O O . ARG B 1 157 ? -7.752 84.046 108.157 1.00 56.00 ? 200 ARG B O 1 ATOM 5051 C CB . ARG B 1 157 ? -6.383 86.664 108.995 1.00 47.49 ? 200 ARG B CB 1 ATOM 5052 C CG . ARG B 1 157 ? -6.209 88.166 109.181 1.00 57.89 ? 200 ARG B CG 1 ATOM 5053 C CD . ARG B 1 157 ? -5.610 88.498 110.538 1.00 59.88 ? 200 ARG B CD 1 ATOM 5054 N NE . ARG B 1 157 ? -4.326 87.831 110.739 1.00 63.18 ? 200 ARG B NE 1 ATOM 5055 C CZ . ARG B 1 157 ? -3.153 88.352 110.392 1.00 72.91 ? 200 ARG B CZ 1 ATOM 5056 N NH1 . ARG B 1 157 ? -3.103 89.550 109.822 1.00 62.63 1 200 ARG B NH1 1 ATOM 5057 N NH2 . ARG B 1 157 ? -2.029 87.678 110.609 1.00 54.62 ? 200 ARG B NH2 1 ATOM 5058 N N . ILE B 1 158 ? -6.126 84.248 106.607 1.00 41.52 ? 201 ILE B N 1 ATOM 5059 C CA . ILE B 1 158 ? -6.048 82.822 106.315 1.00 51.74 ? 201 ILE B CA 1 ATOM 5060 C C . ILE B 1 158 ? -4.605 82.358 106.464 1.00 52.53 ? 201 ILE B C 1 ATOM 5061 O O . ILE B 1 158 ? -3.693 82.946 105.872 1.00 41.69 ? 201 ILE B O 1 ATOM 5062 C CB . ILE B 1 158 ? -6.587 82.494 104.910 1.00 39.71 ? 201 ILE B CB 1 ATOM 5063 C CG1 . ILE B 1 158 ? -8.084 82.802 104.847 1.00 48.28 ? 201 ILE B CG1 1 ATOM 5064 C CG2 . ILE B 1 158 ? -6.319 81.041 104.560 1.00 34.11 ? 201 ILE B CG2 1 ATOM 5065 C CD1 . ILE B 1 158 ? -8.749 82.371 103.555 1.00 64.52 ? 201 ILE B CD1 1 ATOM 5066 N N . LEU B 1 159 ? -4.403 81.311 107.263 1.00 47.49 ? 202 LEU B N 1 ATOM 5067 C CA . LEU B 1 159 ? -3.092 80.703 107.442 1.00 52.07 ? 202 LEU B CA 1 ATOM 5068 C C . LEU B 1 159 ? -2.881 79.644 106.368 1.00 61.00 ? 202 LEU B C 1 ATOM 5069 O O . LEU B 1 159 ? -3.750 78.796 106.142 1.00 56.97 ? 202 LEU B O 1 ATOM 5070 C CB . LEU B 1 159 ? -2.963 80.073 108.829 1.00 43.53 ? 202 LEU B CB 1 ATOM 5071 C CG . LEU B 1 159 ? -1.731 79.184 109.033 1.00 45.69 ? 202 LEU B CG 1 ATOM 5072 C CD1 . LEU B 1 159 ? -0.452 80.018 109.095 1.00 30.24 ? 202 LEU B CD1 1 ATOM 5073 C CD2 . LEU B 1 159 ? -1.875 78.312 110.269 1.00 36.30 ? 202 LEU B CD2 1 ATOM 5074 N N . PHE B 1 160 ? -1.736 79.700 105.700 1.00 46.91 ? 203 PHE B N 1 ATOM 5075 C CA . PHE B 1 160 ? -1.420 78.761 104.632 1.00 40.87 ? 203 PHE B CA 1 ATOM 5076 C C . PHE B 1 160 ? -0.244 77.900 105.068 1.00 36.92 ? 203 PHE B C 1 ATOM 5077 O O . PHE B 1 160 ? 0.880 78.395 105.203 1.00 43.10 ? 203 PHE B O 1 ATOM 5078 C CB . PHE B 1 160 ? -1.112 79.488 103.325 1.00 37.80 ? 203 PHE B CB 1 ATOM 5079 C CG . PHE B 1 160 ? -1.111 78.587 102.134 1.00 31.71 ? 203 PHE B CG 1 ATOM 5080 C CD1 . PHE B 1 160 ? -2.282 78.350 101.434 1.00 29.31 ? 203 PHE B CD1 1 ATOM 5081 C CD2 . PHE B 1 160 ? 0.049 77.950 101.729 1.00 35.76 ? 203 PHE B CD2 1 ATOM 5082 C CE1 . PHE B 1 160 ? -2.293 77.505 100.347 1.00 35.82 ? 203 PHE B CE1 1 ATOM 5083 C CE2 . PHE B 1 160 ? 0.045 77.104 100.637 1.00 37.10 ? 203 PHE B CE2 1 ATOM 5084 C CZ . PHE B 1 160 ? -1.128 76.882 99.946 1.00 39.55 ? 203 PHE B CZ 1 ATOM 5085 N N . LEU B 1 161 ? -0.506 76.616 105.290 1.00 34.54 ? 204 LEU B N 1 ATOM 5086 C CA . LEU B 1 161 ? 0.528 75.641 105.599 1.00 35.39 ? 204 LEU B CA 1 ATOM 5087 C C . LEU B 1 161 ? 0.710 74.713 104.411 1.00 42.61 ? 204 LEU B C 1 ATOM 5088 O O . LEU B 1 161 ? -0.268 74.305 103.776 1.00 44.22 ? 204 LEU B O 1 ATOM 5089 C CB . LEU B 1 161 ? 0.175 74.806 106.832 1.00 29.11 ? 204 LEU B CB 1 ATOM 5090 C CG . LEU B 1 161 ? -0.280 75.499 108.111 1.00 39.37 ? 204 LEU B CG 1 ATOM 5091 C CD1 . LEU B 1 161 ? -0.677 74.445 109.127 1.00 41.92 ? 204 LEU B CD1 1 ATOM 5092 C CD2 . LEU B 1 161 ? 0.814 76.402 108.656 1.00 51.28 ? 204 LEU B CD2 1 ATOM 5093 N N . THR B 1 162 ? 1.961 74.386 104.106 1.00 46.65 ? 205 THR B N 1 ATOM 5094 C CA . THR B 1 162 ? 2.232 73.453 103.028 1.00 41.69 ? 205 THR B CA 1 ATOM 5095 C C . THR B 1 162 ? 3.571 72.773 103.259 1.00 40.29 ? 205 THR B C 1 ATOM 5096 O O . THR B 1 162 ? 4.472 73.330 103.892 1.00 47.01 ? 205 THR B O 1 ATOM 5097 C CB . THR B 1 162 ? 2.237 74.151 101.669 1.00 40.44 ? 205 THR B CB 1 ATOM 5098 O OG1 . THR B 1 162 ? 2.350 73.168 100.631 1.00 58.56 ? 205 THR B OG1 1 ATOM 5099 C CG2 . THR B 1 162 ? 3.413 75.112 101.582 1.00 38.38 ? 205 THR B CG2 1 ATOM 5100 N N . ASP B 1 163 ? 3.691 71.566 102.718 1.00 47.83 ? 206 ASP B N 1 ATOM 5101 C CA . ASP B 1 163 ? 4.946 70.826 102.691 1.00 54.42 ? 206 ASP B CA 1 ATOM 5102 C C . ASP B 1 163 ? 5.579 70.757 104.080 1.00 46.03 ? 206 ASP B C 1 ATOM 5103 O O . ASP B 1 163 ? 6.672 71.269 104.322 1.00 49.59 ? 206 ASP B O 1 ATOM 5104 C CB . ASP B 1 163 ? 5.911 71.455 101.683 1.00 48.99 ? 206 ASP B CB 1 ATOM 5105 C CG . ASP B 1 163 ? 5.418 71.335 100.253 1.00 54.05 ? 206 ASP B CG 1 ATOM 5106 O OD1 . ASP B 1 163 ? 4.642 72.212 99.817 1.00 55.19 -1 206 ASP B OD1 1 ATOM 5107 O OD2 . ASP B 1 163 ? 5.804 70.366 99.566 1.00 53.89 ? 206 ASP B OD2 1 ATOM 5108 N N . LEU B 1 164 ? 4.867 70.099 104.999 1.00 45.01 ? 207 LEU B N 1 ATOM 5109 C CA . LEU B 1 164 ? 5.388 69.962 106.355 1.00 56.05 ? 207 LEU B CA 1 ATOM 5110 C C . LEU B 1 164 ? 6.475 68.896 106.425 1.00 56.02 ? 207 LEU B C 1 ATOM 5111 O O . LEU B 1 164 ? 7.486 69.084 107.111 1.00 59.22 ? 207 LEU B O 1 ATOM 5112 C CB . LEU B 1 164 ? 4.256 69.650 107.336 1.00 50.54 ? 207 LEU B CB 1 ATOM 5113 C CG . LEU B 1 164 ? 3.315 70.822 107.645 1.00 49.75 ? 207 LEU B CG 1 ATOM 5114 C CD1 . LEU B 1 164 ? 2.537 71.231 106.398 1.00 68.41 ? 207 LEU B CD1 1 ATOM 5115 C CD2 . LEU B 1 164 ? 2.367 70.500 108.792 1.00 43.54 ? 207 LEU B CD2 1 ATOM 5116 N N . HIS B 1 165 ? 6.285 67.780 105.724 1.00 56.37 ? 208 HIS B N 1 ATOM 5117 C CA . HIS B 1 165 ? 7.325 66.770 105.530 1.00 51.65 ? 208 HIS B CA 1 ATOM 5118 C C . HIS B 1 165 ? 7.918 66.324 106.871 1.00 52.47 ? 208 HIS B C 1 ATOM 5119 O O . HIS B 1 165 ? 9.056 66.634 107.223 1.00 47.02 ? 208 HIS B O 1 ATOM 5120 C CB . HIS B 1 165 ? 8.413 67.300 104.584 1.00 57.08 ? 208 HIS B CB 1 ATOM 5121 C CG . HIS B 1 165 ? 7.982 67.395 103.148 1.00 53.84 ? 208 HIS B CG 1 ATOM 5122 N ND1 . HIS B 1 165 ? 7.720 66.285 102.377 1.00 49.36 ? 208 HIS B ND1 1 ATOM 5123 C CD2 . HIS B 1 165 ? 7.784 68.466 102.339 1.00 60.94 ? 208 HIS B CD2 1 ATOM 5124 C CE1 . HIS B 1 165 ? 7.369 66.664 101.160 1.00 53.81 ? 208 HIS B CE1 1 ATOM 5125 N NE2 . HIS B 1 165 ? 7.404 67.985 101.105 1.00 62.77 ? 208 HIS B NE2 1 ATOM 5126 N N . TRP B 1 166 ? 7.100 65.587 107.622 1.00 56.27 ? 209 TRP B N 1 ATOM 5127 C CA . TRP B 1 166 ? 7.487 65.099 108.942 1.00 50.91 ? 209 TRP B CA 1 ATOM 5128 C C . TRP B 1 166 ? 8.259 63.789 108.817 1.00 55.26 ? 209 TRP B C 1 ATOM 5129 O O . TRP B 1 166 ? 7.726 62.792 108.319 1.00 59.82 ? 209 TRP B O 1 ATOM 5130 C CB . TRP B 1 166 ? 6.261 64.908 109.831 1.00 43.78 ? 209 TRP B CB 1 ATOM 5131 C CG . TRP B 1 166 ? 6.563 64.143 111.082 1.00 51.96 ? 209 TRP B CG 1 ATOM 5132 C CD1 . TRP B 1 166 ? 7.590 64.370 111.952 1.00 65.12 ? 209 TRP B CD1 1 ATOM 5133 C CD2 . TRP B 1 166 ? 5.822 63.041 111.616 1.00 62.39 ? 209 TRP B CD2 1 ATOM 5134 N NE1 . TRP B 1 166 ? 7.541 63.471 112.990 1.00 59.98 ? 209 TRP B NE1 1 ATOM 5135 C CE2 . TRP B 1 166 ? 6.463 62.646 112.808 1.00 64.13 ? 209 TRP B CE2 1 ATOM 5136 C CE3 . TRP B 1 166 ? 4.680 62.347 111.201 1.00 56.11 ? 209 TRP B CE3 1 ATOM 5137 C CZ2 . TRP B 1 166 ? 6.002 61.589 113.589 1.00 53.09 ? 209 TRP B CZ2 1 ATOM 5138 C CZ3 . TRP B 1 166 ? 4.226 61.295 111.977 1.00 67.04 ? 209 TRP B CZ3 1 ATOM 5139 C CH2 . TRP B 1 166 ? 4.886 60.926 113.158 1.00 63.03 ? 209 TRP B CH2 1 ATOM 5140 N N . ASP B 1 167 ? 9.508 63.792 109.284 1.00 61.34 ? 210 ASP B N 1 ATOM 5141 C CA . ASP B 1 167 ? 10.370 62.623 109.140 1.00 58.68 ? 210 ASP B CA 1 ATOM 5142 C C . ASP B 1 167 ? 9.997 61.527 110.133 1.00 66.94 ? 210 ASP B C 1 ATOM 5143 O O . ASP B 1 167 ? 9.810 60.367 109.751 1.00 88.34 ? 210 ASP B O 1 ATOM 5144 C CB . ASP B 1 167 ? 11.830 63.042 109.327 1.00 53.13 ? 210 ASP B CB 1 ATOM 5145 C CG . ASP B 1 167 ? 12.807 62.042 108.747 1.00 58.82 ? 210 ASP B CG 1 ATOM 5146 O OD1 . ASP B 1 167 ? 12.493 60.833 108.745 1.00 64.20 ? 210 ASP B OD1 1 ATOM 5147 O OD2 . ASP B 1 167 ? 13.895 62.470 108.298 1.00 47.77 -1 210 ASP B OD2 1 ATOM 5148 N N . HIS B 1 168 ? 9.886 61.887 111.411 1.00 53.35 ? 211 HIS B N 1 ATOM 5149 C CA . HIS B 1 168 ? 9.616 60.970 112.516 1.00 66.74 ? 211 HIS B CA 1 ATOM 5150 C C . HIS B 1 168 ? 10.849 60.150 112.866 1.00 50.46 ? 211 HIS B C 1 ATOM 5151 O O . HIS B 1 168 ? 10.977 59.659 113.993 1.00 74.81 ? 211 HIS B O 1 ATOM 5152 C CB . HIS B 1 168 ? 8.458 60.026 112.179 1.00 57.04 ? 211 HIS B CB 1 ATOM 5153 C CG . HIS B 1 168 ? 8.320 58.876 113.133 1.00 78.26 ? 211 HIS B CG 1 ATOM 5154 N ND1 . HIS B 1 168 ? 9.167 57.787 113.113 1.00 81.14 ? 211 HIS B ND1 1 ATOM 5155 C CD2 . HIS B 1 168 ? 7.437 58.646 114.134 1.00 69.12 ? 211 HIS B CD2 1 ATOM 5156 C CE1 . HIS B 1 168 ? 8.814 56.939 114.062 1.00 58.72 ? 211 HIS B CE1 1 ATOM 5157 N NE2 . HIS B 1 168 ? 7.766 57.435 114.694 1.00 64.23 ? 211 HIS B NE2 1 ATOM 5158 N N . ASP B 1 169 ? 11.770 60.015 111.919 1.00 39.43 ? 212 ASP B N 1 ATOM 5159 C CA . ASP B 1 169 ? 13.079 59.436 112.174 1.00 54.79 ? 212 ASP B CA 1 ATOM 5160 C C . ASP B 1 169 ? 14.163 60.489 112.315 1.00 56.42 ? 212 ASP B C 1 ATOM 5161 O O . ASP B 1 169 ? 15.342 60.134 112.409 1.00 54.96 ? 212 ASP B O 1 ATOM 5162 C CB . ASP B 1 169 ? 13.453 58.424 111.086 1.00 71.38 ? 212 ASP B CB 1 ATOM 5163 C CG . ASP B 1 169 ? 12.800 57.067 111.310 1.00 72.06 ? 212 ASP B CG 1 ATOM 5164 O OD1 . ASP B 1 169 ? 12.472 56.751 112.474 1.00 71.23 ? 212 ASP B OD1 1 ATOM 5165 O OD2 . ASP B 1 169 ? 12.632 56.310 110.330 1.00 84.65 -1 212 ASP B OD2 1 ATOM 5166 N N . TYR B 1 170 ? 13.806 61.771 112.275 1.00 49.46 ? 213 TYR B N 1 ATOM 5167 C CA . TYR B 1 170 ? 14.806 62.810 112.457 1.00 43.31 ? 213 TYR B CA 1 ATOM 5168 C C . TYR B 1 170 ? 15.505 62.607 113.791 1.00 45.17 ? 213 TYR B C 1 ATOM 5169 O O . TYR B 1 170 ? 14.857 62.394 114.820 1.00 39.93 ? 213 TYR B O 1 ATOM 5170 C CB . TYR B 1 170 ? 14.171 64.199 112.397 1.00 59.95 ? 213 TYR B CB 1 ATOM 5171 C CG . TYR B 1 170 ? 15.209 65.298 112.420 1.00 56.44 ? 213 TYR B CG 1 ATOM 5172 C CD1 . TYR B 1 170 ? 15.668 65.824 113.619 1.00 48.53 ? 213 TYR B CD1 1 ATOM 5173 C CD2 . TYR B 1 170 ? 15.761 65.780 111.241 1.00 53.63 ? 213 TYR B CD2 1 ATOM 5174 C CE1 . TYR B 1 170 ? 16.629 66.814 113.640 1.00 48.21 ? 213 TYR B CE1 1 ATOM 5175 C CE2 . TYR B 1 170 ? 16.725 66.766 111.255 1.00 44.05 ? 213 TYR B CE2 1 ATOM 5176 C CZ . TYR B 1 170 ? 17.155 67.279 112.456 1.00 39.88 ? 213 TYR B CZ 1 ATOM 5177 O OH . TYR B 1 170 ? 18.113 68.264 112.473 1.00 54.79 ? 213 TYR B OH 1 ATOM 5178 N N . LEU B 1 171 ? 16.833 62.643 113.766 1.00 44.00 ? 214 LEU B N 1 ATOM 5179 C CA . LEU B 1 171 ? 17.631 62.439 114.969 1.00 59.21 ? 214 LEU B CA 1 ATOM 5180 C C . LEU B 1 171 ? 18.748 63.469 114.998 1.00 59.69 ? 214 LEU B C 1 ATOM 5181 O O . LEU B 1 171 ? 19.598 63.486 114.102 1.00 43.04 ? 214 LEU B O 1 ATOM 5182 C CB . LEU B 1 171 ? 18.200 61.017 115.007 1.00 54.45 ? 214 LEU B CB 1 ATOM 5183 C CG . LEU B 1 171 ? 18.934 60.574 116.272 1.00 65.34 ? 214 LEU B CG 1 ATOM 5184 C CD1 . LEU B 1 171 ? 17.994 60.578 117.466 1.00 67.39 ? 214 LEU B CD1 1 ATOM 5185 C CD2 . LEU B 1 171 ? 19.548 59.201 116.065 1.00 63.53 ? 214 LEU B CD2 1 ATOM 5186 N N . GLU B 1 172 ? 18.747 64.323 116.020 1.00 47.04 ? 215 GLU B N 1 ATOM 5187 C CA . GLU B 1 172 ? 19.814 65.303 116.156 1.00 48.55 ? 215 GLU B CA 1 ATOM 5188 C C . GLU B 1 172 ? 21.159 64.603 116.320 1.00 47.33 ? 215 GLU B C 1 ATOM 5189 O O . GLU B 1 172 ? 21.247 63.489 116.844 1.00 61.26 ? 215 GLU B O 1 ATOM 5190 C CB . GLU B 1 172 ? 19.554 66.234 117.347 1.00 64.60 ? 215 GLU B CB 1 ATOM 5191 C CG . GLU B 1 172 ? 19.352 65.546 118.698 1.00 99.29 ? 215 GLU B CG 1 ATOM 5192 C CD . GLU B 1 172 ? 17.991 64.878 118.840 1.00 103.34 ? 215 GLU B CD 1 ATOM 5193 O OE1 . GLU B 1 172 ? 17.263 64.779 117.826 1.00 78.41 ? 215 GLU B OE1 1 ATOM 5194 O OE2 . GLU B 1 172 ? 17.650 64.462 119.972 1.00 73.41 -1 215 GLU B OE2 1 ATOM 5195 N N . GLY B 1 173 ? 22.213 65.260 115.841 1.00 50.76 ? 216 GLY B N 1 ATOM 5196 C CA . GLY B 1 173 ? 23.556 64.735 115.917 1.00 51.96 ? 216 GLY B CA 1 ATOM 5197 C C . GLY B 1 173 ? 23.962 63.832 114.771 1.00 54.00 ? 216 GLY B C 1 ATOM 5198 O O . GLY B 1 173 ? 25.163 63.625 114.561 1.00 51.34 ? 216 GLY B O 1 ATOM 5199 N N . THR B 1 174 ? 23.004 63.304 114.014 1.00 52.49 ? 217 THR B N 1 ATOM 5200 C CA . THR B 1 174 ? 23.326 62.405 112.918 1.00 52.42 ? 217 THR B CA 1 ATOM 5201 C C . THR B 1 174 ? 23.971 63.187 111.771 1.00 60.47 ? 217 THR B C 1 ATOM 5202 O O . THR B 1 174 ? 24.173 64.403 111.840 1.00 65.33 ? 217 THR B O 1 ATOM 5203 C CB . THR B 1 174 ? 22.074 61.664 112.457 1.00 46.82 ? 217 THR B CB 1 ATOM 5204 O OG1 . THR B 1 174 ? 21.051 62.609 112.122 1.00 54.56 ? 217 THR B OG1 1 ATOM 5205 C CG2 . THR B 1 174 ? 21.563 60.756 113.565 1.00 60.17 ? 217 THR B CG2 1 ATOM 5206 N N . ASP B 1 175 ? 24.288 62.478 110.695 1.00 66.18 ? 218 ASP B N 1 ATOM 5207 C CA . ASP B 1 175 ? 25.036 63.073 109.593 1.00 68.19 ? 218 ASP B CA 1 ATOM 5208 C C . ASP B 1 175 ? 24.108 63.876 108.688 1.00 63.02 ? 218 ASP B C 1 ATOM 5209 O O . ASP B 1 175 ? 23.176 63.304 108.112 1.00 64.05 ? 218 ASP B O 1 ATOM 5210 C CB . ASP B 1 175 ? 25.742 61.991 108.790 1.00 72.39 ? 218 ASP B CB 1 ATOM 5211 C CG . ASP B 1 175 ? 26.811 62.550 107.875 1.00 78.96 ? 218 ASP B CG 1 ATOM 5212 O OD1 . ASP B 1 175 ? 26.827 63.782 107.662 1.00 71.04 ? 218 ASP B OD1 1 ATOM 5213 O OD2 . ASP B 1 175 ? 27.635 61.757 107.371 1.00 83.31 -1 218 ASP B OD2 1 ATOM 5214 N N . PRO B 1 176 ? 24.309 65.190 108.550 1.00 73.41 ? 219 PRO B N 1 ATOM 5215 C CA . PRO B 1 176 ? 23.451 65.954 107.631 1.00 74.29 ? 219 PRO B CA 1 ATOM 5216 C C . PRO B 1 176 ? 23.703 65.640 106.166 1.00 83.33 ? 219 PRO B C 1 ATOM 5217 O O . PRO B 1 176 ? 22.748 65.556 105.384 1.00 77.78 ? 219 PRO B O 1 ATOM 5218 C CB . PRO B 1 176 ? 23.799 67.409 107.969 1.00 77.27 ? 219 PRO B CB 1 ATOM 5219 C CG . PRO B 1 176 ? 25.222 67.339 108.421 1.00 88.72 ? 219 PRO B CG 1 ATOM 5220 C CD . PRO B 1 176 ? 25.358 66.027 109.158 1.00 84.11 ? 219 PRO B CD 1 ATOM 5221 N N . ASP B 1 177 ? 24.961 65.455 105.768 1.00 83.03 ? 220 ASP B N 1 ATOM 5222 C CA . ASP B 1 177 ? 25.303 65.111 104.392 1.00 79.91 ? 220 ASP B CA 1 ATOM 5223 C C . ASP B 1 177 ? 25.787 63.669 104.376 1.00 78.57 ? 220 ASP B C 1 ATOM 5224 O O . ASP B 1 177 ? 26.922 63.382 104.769 1.00 96.82 ? 220 ASP B O 1 ATOM 5225 C CB . ASP B 1 177 ? 26.369 66.051 103.834 1.00 79.27 ? 220 ASP B CB 1 ATOM 5226 C CG . ASP B 1 177 ? 26.008 67.512 104.014 1.00 104.52 ? 220 ASP B CG 1 ATOM 5227 O OD1 . ASP B 1 177 ? 26.317 68.072 105.088 1.00 98.82 -1 220 ASP B OD1 1 ATOM 5228 O OD2 . ASP B 1 177 ? 25.415 68.100 103.083 1.00 116.36 ? 220 ASP B OD2 1 ATOM 5229 N N . CYS B 1 178 ? 24.941 62.778 103.877 1.00 77.79 ? 221 CYS B N 1 ATOM 5230 C CA . CYS B 1 178 ? 25.219 61.355 103.828 1.00 78.40 ? 221 CYS B CA 1 ATOM 5231 C C . CYS B 1 178 ? 24.873 60.857 102.434 1.00 83.85 ? 221 CYS B C 1 ATOM 5232 O O . CYS B 1 178 ? 24.263 61.571 101.634 1.00 84.13 ? 221 CYS B O 1 ATOM 5233 C CB . CYS B 1 178 ? 24.434 60.590 104.913 1.00 66.69 ? 221 CYS B CB 1 ATOM 5234 S SG . CYS B 1 178 ? 22.625 60.396 104.664 1.00 99.67 ? 221 CYS B SG 1 ATOM 5235 N N . ALA B 1 179 ? 25.265 59.625 102.128 1.00 80.24 ? 222 ALA B N 1 ATOM 5236 C CA . ALA B 1 179 ? 24.873 59.029 100.860 1.00 73.19 ? 222 ALA B CA 1 ATOM 5237 C C . ALA B 1 179 ? 23.551 58.326 101.118 1.00 78.48 ? 222 ALA B C 1 ATOM 5238 O O . ALA B 1 179 ? 23.511 57.252 101.726 1.00 99.23 ? 222 ALA B O 1 ATOM 5239 C CB . ALA B 1 179 ? 25.939 58.066 100.347 1.00 80.73 ? 222 ALA B CB 1 ATOM 5240 N N . ASP B 1 180 ? 22.479 58.934 100.636 1.00 61.09 ? 223 ASP B N 1 ATOM 5241 C CA . ASP B 1 180 ? 21.099 58.572 100.911 1.00 52.09 ? 223 ASP B CA 1 ATOM 5242 C C . ASP B 1 180 ? 20.226 59.686 100.355 1.00 68.71 ? 223 ASP B C 1 ATOM 5243 O O . ASP B 1 180 ? 20.639 60.853 100.362 1.00 71.91 ? 223 ASP B O 1 ATOM 5244 C CB . ASP B 1 180 ? 20.843 58.410 102.412 1.00 61.35 ? 223 ASP B CB 1 ATOM 5245 C CG . ASP B 1 180 ? 21.000 56.979 102.889 1.00 81.70 ? 223 ASP B CG 1 ATOM 5246 O OD1 . ASP B 1 180 ? 21.002 56.059 102.047 1.00 83.46 ? 223 ASP B OD1 1 ATOM 5247 O OD2 . ASP B 1 180 ? 21.108 56.774 104.117 1.00 97.98 -1 223 ASP B OD2 1 ATOM 5248 N N . PRO B 1 181 ? 19.026 59.383 99.865 1.00 62.79 ? 224 PRO B N 1 ATOM 5249 C CA . PRO B 1 181 ? 18.118 60.467 99.468 1.00 64.06 ? 224 PRO B CA 1 ATOM 5250 C C . PRO B 1 181 ? 17.752 61.394 100.615 1.00 53.40 ? 224 PRO B C 1 ATOM 5251 O O . PRO B 1 181 ? 17.374 62.544 100.362 1.00 68.43 ? 224 PRO B O 1 ATOM 5252 C CB . PRO B 1 181 ? 16.891 59.718 98.932 1.00 61.19 ? 224 PRO B CB 1 ATOM 5253 C CG . PRO B 1 181 ? 17.422 58.381 98.518 1.00 54.52 ? 224 PRO B CG 1 ATOM 5254 C CD . PRO B 1 181 ? 18.495 58.056 99.513 1.00 66.02 ? 224 PRO B CD 1 ATOM 5255 N N . LEU B 1 182 ? 17.866 60.940 101.864 1.00 58.82 ? 225 LEU B N 1 ATOM 5256 C CA . LEU B 1 182 ? 17.483 61.735 103.024 1.00 49.45 ? 225 LEU B CA 1 ATOM 5257 C C . LEU B 1 182 ? 18.411 61.406 104.186 1.00 64.13 ? 225 LEU B C 1 ATOM 5258 O O . LEU B 1 182 ? 18.768 60.242 104.389 1.00 82.38 ? 225 LEU B O 1 ATOM 5259 C CB . LEU B 1 182 ? 16.025 61.460 103.408 1.00 39.34 ? 225 LEU B CB 1 ATOM 5260 C CG . LEU B 1 182 ? 15.326 62.406 104.383 1.00 48.96 ? 225 LEU B CG 1 ATOM 5261 C CD1 . LEU B 1 182 ? 15.271 63.819 103.817 1.00 38.65 ? 225 LEU B CD1 1 ATOM 5262 C CD2 . LEU B 1 182 ? 13.927 61.898 104.718 1.00 40.67 ? 225 LEU B CD2 1 ATOM 5263 N N . CYS B 1 183 ? 18.793 62.431 104.952 1.00 64.52 ? 226 CYS B N 1 ATOM 5264 C CA . CYS B 1 183 ? 19.724 62.251 106.064 1.00 62.73 ? 226 CYS B CA 1 ATOM 5265 C C . CYS B 1 183 ? 19.152 62.829 107.358 1.00 59.25 ? 226 CYS B C 1 ATOM 5266 O O . CYS B 1 183 ? 17.973 63.195 107.413 1.00 57.10 ? 226 CYS B O 1 ATOM 5267 C CB . CYS B 1 183 ? 21.085 62.882 105.738 1.00 59.90 ? 226 CYS B CB 1 ATOM 5268 S SG . CYS B 1 183 ? 21.895 62.247 104.224 1.00 94.08 ? 226 CYS B SG 1 ATOM 5269 N N . CYS B 1 184 ? 19.975 62.901 108.409 1.00 52.80 ? 227 CYS B N 1 ATOM 5270 C CA . CYS B 1 184 ? 19.563 63.393 109.727 1.00 49.28 ? 227 CYS B CA 1 ATOM 5271 C C . CYS B 1 184 ? 18.566 62.466 110.418 1.00 53.78 ? 227 CYS B C 1 ATOM 5272 O O . CYS B 1 184 ? 17.804 62.905 111.282 1.00 52.17 ? 227 CYS B O 1 ATOM 5273 C CB . CYS B 1 184 ? 18.951 64.797 109.650 1.00 55.69 ? 227 CYS B CB 1 ATOM 5274 S SG . CYS B 1 184 ? 19.883 66.103 108.823 1.00 70.44 ? 227 CYS B SG 1 ATOM 5275 N N . ARG B 1 185 ? 18.574 61.182 110.085 1.00 65.96 ? 228 ARG B N 1 ATOM 5276 C CA . ARG B 1 185 ? 17.562 60.256 110.570 1.00 61.55 ? 228 ARG B CA 1 ATOM 5277 C C . ARG B 1 185 ? 18.229 59.022 111.165 1.00 63.66 ? 228 ARG B C 1 ATOM 5278 O O . ARG B 1 185 ? 19.458 58.893 111.177 1.00 63.91 ? 228 ARG B O 1 ATOM 5279 C CB . ARG B 1 185 ? 16.607 59.867 109.434 1.00 63.44 ? 228 ARG B CB 1 ATOM 5280 C CG . ARG B 1 185 ? 17.337 59.575 108.128 1.00 62.52 ? 228 ARG B CG 1 ATOM 5281 C CD . ARG B 1 185 ? 16.397 59.443 106.945 1.00 59.42 ? 228 ARG B CD 1 ATOM 5282 N NE . ARG B 1 185 ? 15.499 58.301 107.087 1.00 55.21 ? 228 ARG B NE 1 ATOM 5283 C CZ . ARG B 1 185 ? 14.241 58.378 107.505 1.00 59.65 ? 228 ARG B CZ 1 ATOM 5284 N NH1 . ARG B 1 185 ? 13.713 59.552 107.820 1.00 42.63 1 228 ARG B NH1 1 ATOM 5285 N NH2 . ARG B 1 185 ? 13.507 57.278 107.602 1.00 79.57 ? 228 ARG B NH2 1 ATOM 5286 N N . ARG B 1 186 ? 17.402 58.112 111.675 1.00 62.95 ? 229 ARG B N 1 ATOM 5287 C CA . ARG B 1 186 ? 17.904 56.816 112.104 1.00 68.24 ? 229 ARG B CA 1 ATOM 5288 C C . ARG B 1 186 ? 18.575 56.117 110.929 1.00 73.22 ? 229 ARG B C 1 ATOM 5289 O O . ARG B 1 186 ? 17.994 56.000 109.846 1.00 61.88 ? 229 ARG B O 1 ATOM 5290 C CB . ARG B 1 186 ? 16.765 55.953 112.651 1.00 72.30 ? 229 ARG B CB 1 ATOM 5291 C CG . ARG B 1 186 ? 16.153 56.443 113.953 1.00 67.10 ? 229 ARG B CG 1 ATOM 5292 C CD . ARG B 1 186 ? 17.117 56.283 115.116 1.00 93.49 ? 229 ARG B CD 1 ATOM 5293 N NE . ARG B 1 186 ? 16.476 56.568 116.398 1.00 115.90 ? 229 ARG B NE 1 ATOM 5294 C CZ . ARG B 1 186 ? 17.072 56.434 117.580 1.00 107.89 ? 229 ARG B CZ 1 ATOM 5295 N NH1 . ARG B 1 186 ? 18.330 56.017 117.647 1.00 80.38 1 229 ARG B NH1 1 ATOM 5296 N NH2 . ARG B 1 186 ? 16.409 56.714 118.695 1.00 98.67 ? 229 ARG B NH2 1 ATOM 5297 N N . GLY B 1 187 ? 19.808 55.667 111.138 1.00 83.86 ? 230 GLY B N 1 ATOM 5298 C CA . GLY B 1 187 ? 20.527 54.952 110.107 1.00 84.16 ? 230 GLY B CA 1 ATOM 5299 C C . GLY B 1 187 ? 21.415 55.798 109.223 1.00 75.97 ? 230 GLY B C 1 ATOM 5300 O O . GLY B 1 187 ? 22.013 55.261 108.281 1.00 66.65 ? 230 GLY B O 1 ATOM 5301 N N . SER B 1 188 ? 21.522 57.099 109.483 1.00 71.23 ? 231 SER B N 1 ATOM 5302 C CA . SER B 1 188 ? 22.445 57.943 108.740 1.00 63.36 ? 231 SER B CA 1 ATOM 5303 C C . SER B 1 188 ? 23.845 57.945 109.335 1.00 76.96 ? 231 SER B C 1 ATOM 5304 O O . SER B 1 188 ? 24.767 58.478 108.708 1.00 74.43 ? 231 SER B O 1 ATOM 5305 C CB . SER B 1 188 ? 21.915 59.379 108.668 1.00 61.50 ? 231 SER B CB 1 ATOM 5306 O OG . SER B 1 188 ? 20.664 59.427 108.003 1.00 80.45 ? 231 SER B OG 1 ATOM 5307 N N . GLY B 1 189 ? 24.026 57.364 110.521 1.00 77.71 ? 232 GLY B N 1 ATOM 5308 C CA . GLY B 1 189 ? 25.334 57.309 111.135 1.00 66.24 ? 232 GLY B CA 1 ATOM 5309 C C . GLY B 1 189 ? 25.715 58.620 111.798 1.00 63.70 ? 232 GLY B C 1 ATOM 5310 O O . GLY B 1 189 ? 24.878 59.477 112.097 1.00 70.65 ? 232 GLY B O 1 ATOM 5311 N N . LEU B 1 190 ? 27.014 58.766 112.033 1.00 63.48 ? 233 LEU B N 1 ATOM 5312 C CA . LEU B 1 190 ? 27.537 59.973 112.643 1.00 66.80 ? 233 LEU B CA 1 ATOM 5313 C C . LEU B 1 190 ? 28.475 60.675 111.672 1.00 66.14 ? 233 LEU B C 1 ATOM 5314 O O . LEU B 1 190 ? 29.130 60.023 110.853 1.00 67.38 ? 233 LEU B O 1 ATOM 5315 C CB . LEU B 1 190 ? 28.294 59.666 113.942 1.00 67.31 ? 233 LEU B CB 1 ATOM 5316 C CG . LEU B 1 190 ? 27.506 59.003 115.074 1.00 69.96 ? 233 LEU B CG 1 ATOM 5317 C CD1 . LEU B 1 190 ? 28.406 58.771 116.279 1.00 85.06 ? 233 LEU B CD1 1 ATOM 5318 C CD2 . LEU B 1 190 ? 26.281 59.821 115.452 1.00 68.83 ? 233 LEU B CD2 1 ATOM 5319 N N . PRO B 1 191 ? 28.550 62.000 111.726 1.00 76.87 ? 234 PRO B N 1 ATOM 5320 C CA . PRO B 1 191 ? 29.466 62.724 110.845 1.00 84.95 ? 234 PRO B CA 1 ATOM 5321 C C . PRO B 1 191 ? 30.906 62.482 111.255 1.00 88.29 ? 234 PRO B C 1 ATOM 5322 O O . PRO B 1 191 ? 31.243 62.564 112.446 1.00 82.27 ? 234 PRO B O 1 ATOM 5323 C CB . PRO B 1 191 ? 29.065 64.191 111.052 1.00 81.83 ? 234 PRO B CB 1 ATOM 5324 C CG . PRO B 1 191 ? 28.510 64.222 112.439 1.00 76.82 ? 234 PRO B CG 1 ATOM 5325 C CD . PRO B 1 191 ? 27.812 62.901 112.628 1.00 80.13 ? 234 PRO B CD 1 ATOM 5326 N N . PRO B 1 192 ? 31.787 62.189 110.302 1.00 98.62 ? 235 PRO B N 1 ATOM 5327 C CA . PRO B 1 192 ? 33.200 62.000 110.642 1.00 115.11 ? 235 PRO B CA 1 ATOM 5328 C C . PRO B 1 192 ? 33.921 63.320 110.863 1.00 119.03 ? 235 PRO B C 1 ATOM 5329 O O . PRO B 1 192 ? 33.645 64.325 110.203 1.00 116.20 ? 235 PRO B O 1 ATOM 5330 C CB . PRO B 1 192 ? 33.757 61.261 109.419 1.00 97.63 ? 235 PRO B CB 1 ATOM 5331 C CG . PRO B 1 192 ? 32.899 61.723 108.296 1.00 71.01 ? 235 PRO B CG 1 ATOM 5332 C CD . PRO B 1 192 ? 31.520 61.921 108.877 1.00 86.16 ? 235 PRO B CD 1 ATOM 5333 N N . ALA B 1 193 ? 34.862 63.301 111.806 1.00 117.38 ? 236 ALA B N 1 ATOM 5334 C CA . ALA B 1 193 ? 35.860 64.360 111.981 1.00 116.38 ? 236 ALA B CA 1 ATOM 5335 C C . ALA B 1 193 ? 35.169 65.706 112.170 1.00 123.13 ? 236 ALA B C 1 ATOM 5336 O O . ALA B 1 193 ? 34.384 65.848 113.124 1.00 94.69 ? 236 ALA B O 1 ATOM 5337 C CB . ALA B 1 193 ? 36.840 64.278 110.808 1.00 106.63 ? 236 ALA B CB 1 ATOM 5338 N N . SER B 1 194 ? 35.424 66.705 111.321 1.00 138.41 ? 237 SER B N 1 ATOM 5339 C CA . SER B 1 194 ? 35.114 68.102 111.597 1.00 135.92 ? 237 SER B CA 1 ATOM 5340 C C . SER B 1 194 ? 33.687 68.517 111.256 1.00 128.20 ? 237 SER B C 1 ATOM 5341 O O . SER B 1 194 ? 33.262 69.593 111.688 1.00 130.82 ? 237 SER B O 1 ATOM 5342 C CB . SER B 1 194 ? 36.089 69.005 110.831 1.00 129.55 ? 237 SER B CB 1 ATOM 5343 O OG . SER B 1 194 ? 35.849 70.374 111.107 1.00 136.01 ? 237 SER B OG 1 ATOM 5344 N N . ARG B 1 195 ? 32.943 67.722 110.501 1.00 113.37 ? 238 ARG B N 1 ATOM 5345 C CA . ARG B 1 195 ? 31.586 68.143 110.167 1.00 102.27 ? 238 ARG B CA 1 ATOM 5346 C C . ARG B 1 195 ? 30.671 67.970 111.375 1.00 92.27 ? 238 ARG B C 1 ATOM 5347 O O . ARG B 1 195 ? 30.612 66.879 111.950 1.00 91.07 ? 238 ARG B O 1 ATOM 5348 C CB . ARG B 1 195 ? 31.035 67.359 108.977 1.00 103.93 ? 238 ARG B CB 1 ATOM 5349 C CG . ARG B 1 195 ? 29.667 67.860 108.519 1.00 97.04 ? 238 ARG B CG 1 ATOM 5350 C CD . ARG B 1 195 ? 29.262 67.322 107.153 1.00 106.24 ? 238 ARG B CD 1 ATOM 5351 N NE . ARG B 1 195 ? 28.977 65.890 107.172 1.00 98.36 ? 238 ARG B NE 1 ATOM 5352 C CZ . ARG B 1 195 ? 29.836 64.953 106.786 1.00 106.91 ? 238 ARG B CZ 1 ATOM 5353 N NH1 . ARG B 1 195 ? 31.040 65.294 106.344 1.00 103.57 1 238 ARG B NH1 1 ATOM 5354 N NH2 . ARG B 1 195 ? 29.493 63.673 106.836 1.00 104.71 ? 238 ARG B NH2 1 ATOM 5355 N N . PRO B 1 196 ? 29.968 69.017 111.800 1.00 85.21 ? 239 PRO B N 1 ATOM 5356 C CA . PRO B 1 196 ? 29.056 68.880 112.939 1.00 82.32 ? 239 PRO B CA 1 ATOM 5357 C C . PRO B 1 196 ? 27.807 68.102 112.552 1.00 60.69 ? 239 PRO B C 1 ATOM 5358 O O . PRO B 1 196 ? 27.483 67.930 111.375 1.00 78.63 ? 239 PRO B O 1 ATOM 5359 C CB . PRO B 1 196 ? 28.722 70.330 113.304 1.00 69.73 ? 239 PRO B CB 1 ATOM 5360 C CG . PRO B 1 196 ? 28.897 71.079 112.029 1.00 63.78 ? 239 PRO B CG 1 ATOM 5361 C CD . PRO B 1 196 ? 30.025 70.401 111.298 1.00 80.38 ? 239 PRO B CD 1 ATOM 5362 N N . GLY B 1 197 ? 27.098 67.631 113.573 1.00 63.21 ? 240 GLY B N 1 ATOM 5363 C CA . GLY B 1 197 ? 25.885 66.869 113.371 1.00 57.87 ? 240 GLY B CA 1 ATOM 5364 C C . GLY B 1 197 ? 24.696 67.738 113.009 1.00 52.76 ? 240 GLY B C 1 ATOM 5365 O O . GLY B 1 197 ? 24.811 68.924 112.698 1.00 78.06 ? 240 GLY B O 1 ATOM 5366 N N . ALA B 1 198 ? 23.522 67.114 113.054 1.00 49.20 ? 241 ALA B N 1 ATOM 5367 C CA . ALA B 1 198 ? 22.280 67.790 112.715 1.00 59.21 ? 241 ALA B CA 1 ATOM 5368 C C . ALA B 1 198 ? 21.764 68.603 113.896 1.00 51.51 ? 241 ALA B C 1 ATOM 5369 O O . ALA B 1 198 ? 21.911 68.213 115.057 1.00 69.55 ? 241 ALA B O 1 ATOM 5370 C CB . ALA B 1 198 ? 21.220 66.777 112.278 1.00 49.01 ? 241 ALA B CB 1 ATOM 5371 N N . GLY B 1 199 ? 21.152 69.745 113.587 1.00 47.19 ? 242 GLY B N 1 ATOM 5372 C CA . GLY B 1 199 ? 20.615 70.594 114.628 1.00 54.26 ? 242 GLY B CA 1 ATOM 5373 C C . GLY B 1 199 ? 19.419 69.974 115.326 1.00 50.11 ? 242 GLY B C 1 ATOM 5374 O O . GLY B 1 199 ? 18.764 69.060 114.825 1.00 43.06 ? 242 GLY B O 1 ATOM 5375 N N . TYR B 1 200 ? 19.133 70.488 116.524 1.00 44.88 ? 243 TYR B N 1 ATOM 5376 C CA . TYR B 1 200 ? 18.012 69.962 117.299 1.00 50.68 ? 243 TYR B CA 1 ATOM 5377 C C . TYR B 1 200 ? 16.676 70.242 116.615 1.00 46.96 ? 243 TYR B C 1 ATOM 5378 O O . TYR B 1 200 ? 15.784 69.386 116.610 1.00 45.46 ? 243 TYR B O 1 ATOM 5379 C CB . TYR B 1 200 ? 18.030 70.552 118.711 1.00 51.87 ? 243 TYR B CB 1 ATOM 5380 C CG . TYR B 1 200 ? 16.927 70.041 119.621 1.00 50.94 ? 243 TYR B CG 1 ATOM 5381 C CD1 . TYR B 1 200 ? 17.035 68.811 120.263 1.00 51.32 ? 243 TYR B CD1 1 ATOM 5382 C CD2 . TYR B 1 200 ? 15.776 70.789 119.831 1.00 50.71 ? 243 TYR B CD2 1 ATOM 5383 C CE1 . TYR B 1 200 ? 16.026 68.345 121.092 1.00 43.19 ? 243 TYR B CE1 1 ATOM 5384 C CE2 . TYR B 1 200 ? 14.766 70.332 120.656 1.00 56.21 ? 243 TYR B CE2 1 ATOM 5385 C CZ . TYR B 1 200 ? 14.894 69.111 121.283 1.00 53.26 ? 243 TYR B CZ 1 ATOM 5386 O OH . TYR B 1 200 ? 13.880 68.665 122.102 1.00 43.87 ? 243 TYR B OH 1 ATOM 5387 N N . TRP B 1 201 ? 16.524 71.424 116.022 1.00 50.14 ? 244 TRP B N 1 ATOM 5388 C CA . TRP B 1 201 ? 15.270 71.864 115.422 1.00 44.61 ? 244 TRP B CA 1 ATOM 5389 C C . TRP B 1 201 ? 15.173 71.567 113.930 1.00 55.81 ? 244 TRP B C 1 ATOM 5390 O O . TRP B 1 201 ? 14.234 72.037 113.280 1.00 44.14 ? 244 TRP B O 1 ATOM 5391 C CB . TRP B 1 201 ? 15.054 73.355 115.681 1.00 42.49 ? 244 TRP B CB 1 ATOM 5392 C CG . TRP B 1 201 ? 14.875 73.660 117.140 1.00 42.92 ? 244 TRP B CG 1 ATOM 5393 C CD1 . TRP B 1 201 ? 15.789 74.222 117.981 1.00 39.27 ? 244 TRP B CD1 1 ATOM 5394 C CD2 . TRP B 1 201 ? 13.715 73.380 117.936 1.00 32.43 ? 244 TRP B CD2 1 ATOM 5395 N NE1 . TRP B 1 201 ? 15.265 74.326 119.247 1.00 51.67 ? 244 TRP B NE1 1 ATOM 5396 C CE2 . TRP B 1 201 ? 13.994 73.814 119.246 1.00 41.37 ? 244 TRP B CE2 1 ATOM 5397 C CE3 . TRP B 1 201 ? 12.467 72.808 117.665 1.00 39.71 ? 244 TRP B CE3 1 ATOM 5398 C CZ2 . TRP B 1 201 ? 13.070 73.696 120.283 1.00 31.62 ? 244 TRP B CZ2 1 ATOM 5399 C CZ3 . TRP B 1 201 ? 11.551 72.693 118.694 1.00 36.60 ? 244 TRP B CZ3 1 ATOM 5400 C CH2 . TRP B 1 201 ? 11.857 73.134 119.987 1.00 31.77 ? 244 TRP B CH2 1 ATOM 5401 N N . GLY B 1 202 ? 16.103 70.796 113.385 1.00 52.87 ? 245 GLY B N 1 ATOM 5402 C CA . GLY B 1 202 ? 16.234 70.578 111.960 1.00 44.44 ? 245 GLY B CA 1 ATOM 5403 C C . GLY B 1 202 ? 17.523 71.168 111.413 1.00 46.16 ? 245 GLY B C 1 ATOM 5404 O O . GLY B 1 202 ? 18.235 71.922 112.075 1.00 49.12 ? 245 GLY B O 1 ATOM 5405 N N . GLU B 1 203 ? 17.829 70.774 110.177 1.00 41.61 ? 246 GLU B N 1 ATOM 5406 C CA . GLU B 1 203 ? 19.133 71.029 109.585 1.00 48.73 ? 246 GLU B CA 1 ATOM 5407 C C . GLU B 1 203 ? 18.990 71.685 108.218 1.00 57.43 ? 246 GLU B C 1 ATOM 5408 O O . GLU B 1 203 ? 17.922 71.670 107.602 1.00 59.42 ? 246 GLU B O 1 ATOM 5409 C CB . GLU B 1 203 ? 19.946 69.733 109.459 1.00 64.69 ? 246 GLU B CB 1 ATOM 5410 C CG . GLU B 1 203 ? 21.388 69.964 109.073 1.00 56.24 ? 246 GLU B CG 1 ATOM 5411 C CD . GLU B 1 203 ? 22.037 71.019 109.941 1.00 70.03 ? 246 GLU B CD 1 ATOM 5412 O OE1 . GLU B 1 203 ? 21.995 70.875 111.183 1.00 61.50 ? 246 GLU B OE1 1 ATOM 5413 O OE2 . GLU B 1 203 ? 22.571 72.002 109.382 1.00 66.96 -1 246 GLU B OE2 1 ATOM 5414 N N . TYR B 1 204 ? 20.098 72.259 107.752 1.00 46.17 ? 247 TYR B N 1 ATOM 5415 C CA . TYR B 1 204 ? 20.133 73.038 106.522 1.00 45.66 ? 247 TYR B CA 1 ATOM 5416 C C . TYR B 1 204 ? 20.513 72.225 105.290 1.00 50.03 ? 247 TYR B C 1 ATOM 5417 O O . TYR B 1 204 ? 20.756 72.822 104.238 1.00 84.10 ? 247 TYR B O 1 ATOM 5418 C CB . TYR B 1 204 ? 21.109 74.210 106.660 1.00 54.52 ? 247 TYR B CB 1 ATOM 5419 C CG . TYR B 1 204 ? 20.506 75.481 107.217 1.00 56.70 ? 247 TYR B CG 1 ATOM 5420 C CD1 . TYR B 1 204 ? 19.269 75.939 106.786 1.00 51.37 ? 247 TYR B CD1 1 ATOM 5421 C CD2 . TYR B 1 204 ? 21.183 76.225 108.175 1.00 53.17 ? 247 TYR B CD2 1 ATOM 5422 C CE1 . TYR B 1 204 ? 18.723 77.102 107.297 1.00 51.24 ? 247 TYR B CE1 1 ATOM 5423 C CE2 . TYR B 1 204 ? 20.645 77.385 108.691 1.00 45.05 ? 247 TYR B CE2 1 ATOM 5424 C CZ . TYR B 1 204 ? 19.417 77.820 108.250 1.00 51.04 ? 247 TYR B CZ 1 ATOM 5425 O OH . TYR B 1 204 ? 18.888 78.978 108.769 1.00 57.61 ? 247 TYR B OH 1 ATOM 5426 N N . SER B 1 205 ? 20.633 70.902 105.384 1.00 49.60 ? 248 SER B N 1 ATOM 5427 C CA . SER B 1 205 ? 20.920 70.122 104.184 1.00 54.20 ? 248 SER B CA 1 ATOM 5428 C C . SER B 1 205 ? 20.111 68.835 104.138 1.00 46.11 ? 248 SER B C 1 ATOM 5429 O O . SER B 1 205 ? 20.243 67.988 105.026 1.00 79.74 ? 248 SER B O 1 ATOM 5430 C CB . SER B 1 205 ? 22.416 69.802 104.103 1.00 71.16 ? 248 SER B CB 1 ATOM 5431 O OG . SER B 1 205 ? 23.195 70.978 104.245 1.00 75.13 ? 248 SER B OG 1 ATOM 5432 N N . LYS B 1 206 ? 19.311 68.678 103.082 1.00 28.00 ? 249 LYS B N 1 ATOM 5433 C CA . LYS B 1 206 ? 18.715 67.395 102.697 1.00 46.07 ? 249 LYS B CA 1 ATOM 5434 C C . LYS B 1 206 ? 18.117 66.648 103.891 1.00 52.61 ? 249 LYS B C 1 ATOM 5435 O O . LYS B 1 206 ? 18.321 65.445 104.069 1.00 55.49 ? 249 LYS B O 1 ATOM 5436 C CB . LYS B 1 206 ? 19.763 66.541 101.974 1.00 39.84 ? 249 LYS B CB 1 ATOM 5437 C CG . LYS B 1 206 ? 19.297 65.183 101.492 1.00 61.86 ? 249 LYS B CG 1 ATOM 5438 C CD . LYS B 1 206 ? 20.388 64.479 100.684 1.00 85.13 ? 249 LYS B CD 1 ATOM 5439 C CE . LYS B 1 206 ? 21.684 64.344 101.474 1.00 76.77 ? 249 LYS B CE 1 ATOM 5440 N NZ . LYS B 1 206 ? 22.699 63.539 100.735 1.00 70.41 1 249 LYS B NZ 1 ATOM 5441 N N . CYS B 1 207 ? 17.339 67.361 104.705 1.00 54.10 ? 250 CYS B N 1 ATOM 5442 C CA . CYS B 1 207 ? 16.635 66.719 105.807 1.00 43.76 ? 250 CYS B CA 1 ATOM 5443 C C . CYS B 1 207 ? 15.272 67.358 106.037 1.00 56.96 ? 250 CYS B C 1 ATOM 5444 O O . CYS B 1 207 ? 15.133 68.580 105.957 1.00 70.33 ? 250 CYS B O 1 ATOM 5445 C CB . CYS B 1 207 ? 17.471 66.794 107.092 1.00 50.83 ? 250 CYS B CB 1 ATOM 5446 S SG . CYS B 1 207 ? 19.119 66.065 106.943 1.00 77.64 ? 250 CYS B SG 1 ATOM 5447 N N . ASP B 1 208 ? 14.264 66.522 106.282 1.00 38.44 ? 251 ASP B N 1 ATOM 5448 C CA . ASP B 1 208 ? 12.954 67.000 106.709 1.00 44.93 ? 251 ASP B CA 1 ATOM 5449 C C . ASP B 1 208 ? 12.981 67.374 108.197 1.00 48.42 ? 251 ASP B C 1 ATOM 5450 O O . ASP B 1 208 ? 14.027 67.375 108.852 1.00 41.33 ? 251 ASP B O 1 ATOM 5451 C CB . ASP B 1 208 ? 11.883 65.964 106.385 1.00 54.12 ? 251 ASP B CB 1 ATOM 5452 C CG . ASP B 1 208 ? 11.592 65.879 104.896 1.00 71.39 ? 251 ASP B CG 1 ATOM 5453 O OD1 . ASP B 1 208 ? 11.529 66.943 104.244 1.00 59.71 ? 251 ASP B OD1 1 ATOM 5454 O OD2 . ASP B 1 208 ? 11.431 64.751 104.378 1.00 70.37 -1 251 ASP B OD2 1 ATOM 5455 N N . LEU B 1 209 ? 11.779 67.729 108.760 1.00 44.28 ? 252 LEU B N 1 ATOM 5456 C CA . LEU B 1 209 ? 11.521 68.284 110.086 1.00 44.09 ? 252 LEU B CA 1 ATOM 5457 C C . LEU B 1 209 ? 11.212 67.187 111.103 1.00 46.06 ? 252 LEU B C 1 ATOM 5458 O O . LEU B 1 209 ? 10.486 66.238 110.791 1.00 57.78 ? 252 LEU B O 1 ATOM 5459 C CB . LEU B 1 209 ? 10.349 69.258 110.040 1.00 44.95 ? 252 LEU B CB 1 ATOM 5460 C CG . LEU B 1 209 ? 10.555 70.531 109.228 1.00 44.90 ? 252 LEU B CG 1 ATOM 5461 C CD1 . LEU B 1 209 ? 9.277 71.342 109.219 1.00 45.88 ? 252 LEU B CD1 1 ATOM 5462 C CD2 . LEU B 1 209 ? 11.709 71.337 109.801 1.00 35.47 ? 252 LEU B CD2 1 ATOM 5463 N N . PRO B 1 210 ? 11.730 67.302 112.322 1.00 38.37 ? 253 PRO B N 1 ATOM 5464 C CA . PRO B 1 210 ? 11.200 66.501 113.426 1.00 36.65 ? 253 PRO B CA 1 ATOM 5465 C C . PRO B 1 210 ? 9.890 67.080 113.932 1.00 37.85 ? 253 PRO B C 1 ATOM 5466 O O . PRO B 1 210 ? 9.640 68.283 113.842 1.00 54.40 ? 253 PRO B O 1 ATOM 5467 C CB . PRO B 1 210 ? 12.300 66.600 114.487 1.00 36.44 ? 253 PRO B CB 1 ATOM 5468 C CG . PRO B 1 210 ? 12.926 67.918 114.228 1.00 45.59 ? 253 PRO B CG 1 ATOM 5469 C CD . PRO B 1 210 ? 12.892 68.107 112.737 1.00 49.92 ? 253 PRO B CD 1 ATOM 5470 N N . LEU B 1 211 ? 9.048 66.199 114.479 1.00 44.93 ? 254 LEU B N 1 ATOM 5471 C CA . LEU B 1 211 ? 7.717 66.619 114.912 1.00 45.52 ? 254 LEU B CA 1 ATOM 5472 C C . LEU B 1 211 ? 7.772 67.805 115.866 1.00 46.68 ? 254 LEU B C 1 ATOM 5473 O O . LEU B 1 211 ? 6.851 68.632 115.891 1.00 50.42 ? 254 LEU B O 1 ATOM 5474 C CB . LEU B 1 211 ? 6.989 65.455 115.583 1.00 39.35 ? 254 LEU B CB 1 ATOM 5475 C CG . LEU B 1 211 ? 5.563 65.804 116.009 1.00 42.80 ? 254 LEU B CG 1 ATOM 5476 C CD1 . LEU B 1 211 ? 4.716 66.167 114.799 1.00 32.71 ? 254 LEU B CD1 1 ATOM 5477 C CD2 . LEU B 1 211 ? 4.931 64.673 116.814 1.00 27.31 ? 254 LEU B CD2 1 ATOM 5478 N N . ARG B 1 212 ? 8.833 67.898 116.667 1.00 44.93 ? 255 ARG B N 1 ATOM 5479 C CA . ARG B 1 212 ? 8.928 68.978 117.641 1.00 39.67 ? 255 ARG B CA 1 ATOM 5480 C C . ARG B 1 212 ? 8.946 70.341 116.962 1.00 53.10 ? 255 ARG B C 1 ATOM 5481 O O . ARG B 1 212 ? 8.409 71.310 117.509 1.00 45.82 ? 255 ARG B O 1 ATOM 5482 C CB . ARG B 1 212 ? 10.168 68.783 118.508 1.00 31.36 ? 255 ARG B CB 1 ATOM 5483 C CG . ARG B 1 212 ? 11.464 69.218 117.857 1.00 45.12 ? 255 ARG B CG 1 ATOM 5484 C CD . ARG B 1 212 ? 12.638 68.870 118.747 1.00 46.86 ? 255 ARG B CD 1 ATOM 5485 N NE . ARG B 1 212 ? 12.953 67.448 118.664 1.00 48.46 ? 255 ARG B NE 1 ATOM 5486 C CZ . ARG B 1 212 ? 14.049 66.961 118.094 1.00 47.74 ? 255 ARG B CZ 1 ATOM 5487 N NH1 . ARG B 1 212 ? 14.944 67.783 117.570 1.00 46.70 1 255 ARG B NH1 1 ATOM 5488 N NH2 . ARG B 1 212 ? 14.254 65.652 118.058 1.00 68.99 ? 255 ARG B NH2 1 ATOM 5489 N N . THR B 1 213 ? 9.564 70.443 115.781 1.00 47.19 ? 256 THR B N 1 ATOM 5490 C CA . THR B 1 213 ? 9.587 71.721 115.074 1.00 38.54 ? 256 THR B CA 1 ATOM 5491 C C . THR B 1 213 ? 8.209 72.087 114.532 1.00 41.54 ? 256 THR B C 1 ATOM 5492 O O . THR B 1 213 ? 7.873 73.275 114.448 1.00 43.27 ? 256 THR B O 1 ATOM 5493 C CB . THR B 1 213 ? 10.621 71.686 113.947 1.00 37.52 ? 256 THR B CB 1 ATOM 5494 O OG1 . THR B 1 213 ? 11.935 71.543 114.502 1.00 30.65 ? 256 THR B OG1 1 ATOM 5495 C CG2 . THR B 1 213 ? 10.562 72.962 113.125 1.00 29.26 ? 256 THR B CG2 1 ATOM 5496 N N . LEU B 1 214 ? 7.399 71.092 114.164 1.00 37.71 ? 257 LEU B N 1 ATOM 5497 C CA . LEU B 1 214 ? 6.007 71.375 113.830 1.00 36.18 ? 257 LEU B CA 1 ATOM 5498 C C . LEU B 1 214 ? 5.239 71.842 115.061 1.00 58.36 ? 257 LEU B C 1 ATOM 5499 O O . LEU B 1 214 ? 4.420 72.769 114.975 1.00 62.67 ? 257 LEU B O 1 ATOM 5500 C CB . LEU B 1 214 ? 5.349 70.143 113.210 1.00 34.07 ? 257 LEU B CB 1 ATOM 5501 C CG . LEU B 1 214 ? 6.029 69.602 111.950 1.00 52.84 ? 257 LEU B CG 1 ATOM 5502 C CD1 . LEU B 1 214 ? 5.343 68.335 111.456 1.00 51.56 ? 257 LEU B CD1 1 ATOM 5503 C CD2 . LEU B 1 214 ? 6.059 70.659 110.861 1.00 47.67 ? 257 LEU B CD2 1 ATOM 5504 N N . GLU B 1 215 ? 5.498 71.222 116.220 1.00 47.58 ? 258 GLU B N 1 ATOM 5505 C CA . GLU B 1 215 ? 4.902 71.719 117.456 1.00 49.61 ? 258 GLU B CA 1 ATOM 5506 C C . GLU B 1 215 ? 5.293 73.170 117.705 1.00 58.51 ? 258 GLU B C 1 ATOM 5507 O O . GLU B 1 215 ? 4.455 73.991 118.098 1.00 50.41 ? 258 GLU B O 1 ATOM 5508 C CB . GLU B 1 215 ? 5.322 70.851 118.643 1.00 67.84 ? 258 GLU B CB 1 ATOM 5509 C CG . GLU B 1 215 ? 4.708 71.322 119.963 1.00 104.86 ? 258 GLU B CG 1 ATOM 5510 C CD . GLU B 1 215 ? 5.255 70.595 121.181 1.00 111.66 ? 258 GLU B CD 1 ATOM 5511 O OE1 . GLU B 1 215 ? 6.118 69.706 121.013 1.00 106.88 ? 258 GLU B OE1 1 ATOM 5512 O OE2 . GLU B 1 215 ? 4.834 70.936 122.310 1.00 99.05 -1 258 GLU B OE2 1 ATOM 5513 N N . SER B 1 216 ? 6.564 73.505 117.480 1.00 46.72 ? 259 SER B N 1 ATOM 5514 C CA . SER B 1 216 ? 7.009 74.882 117.653 1.00 49.84 ? 259 SER B CA 1 ATOM 5515 C C . SER B 1 216 ? 6.255 75.815 116.716 1.00 50.27 ? 259 SER B C 1 ATOM 5516 O O . SER B 1 216 ? 5.747 76.862 117.136 1.00 47.03 ? 259 SER B O 1 ATOM 5517 C CB . SER B 1 216 ? 8.516 74.974 117.412 1.00 29.29 ? 259 SER B CB 1 ATOM 5518 O OG . SER B 1 216 ? 8.977 76.301 117.587 1.00 47.76 ? 259 SER B OG 1 ATOM 5519 N N . LEU B 1 217 ? 6.163 75.440 115.439 1.00 42.66 ? 260 LEU B N 1 ATOM 5520 C CA . LEU B 1 217 ? 5.464 76.273 114.466 1.00 50.13 ? 260 LEU B CA 1 ATOM 5521 C C . LEU B 1 217 ? 4.024 76.536 114.895 1.00 48.87 ? 260 LEU B C 1 ATOM 5522 O O . LEU B 1 217 ? 3.572 77.687 114.918 1.00 50.87 ? 260 LEU B O 1 ATOM 5523 C CB . LEU B 1 217 ? 5.516 75.604 113.091 1.00 47.94 ? 260 LEU B CB 1 ATOM 5524 C CG . LEU B 1 217 ? 5.086 76.354 111.827 1.00 41.10 ? 260 LEU B CG 1 ATOM 5525 C CD1 . LEU B 1 217 ? 5.472 75.537 110.603 1.00 37.88 ? 260 LEU B CD1 1 ATOM 5526 C CD2 . LEU B 1 217 ? 3.594 76.631 111.818 1.00 35.56 ? 260 LEU B CD2 1 ATOM 5527 N N . LEU B 1 218 ? 3.291 75.481 115.261 1.00 45.51 ? 261 LEU B N 1 ATOM 5528 C CA . LEU B 1 218 ? 1.875 75.655 115.578 1.00 47.18 ? 261 LEU B CA 1 ATOM 5529 C C . LEU B 1 218 ? 1.668 76.351 116.919 1.00 55.25 ? 261 LEU B C 1 ATOM 5530 O O . LEU B 1 218 ? 0.638 77.004 117.123 1.00 47.50 ? 261 LEU B O 1 ATOM 5531 C CB . LEU B 1 218 ? 1.160 74.304 115.568 1.00 52.30 ? 261 LEU B CB 1 ATOM 5532 C CG . LEU B 1 218 ? 1.048 73.564 114.232 1.00 49.10 ? 261 LEU B CG 1 ATOM 5533 C CD1 . LEU B 1 218 ? 0.764 72.091 114.473 1.00 67.08 ? 261 LEU B CD1 1 ATOM 5534 C CD2 . LEU B 1 218 ? -0.049 74.173 113.369 1.00 33.26 ? 261 LEU B CD2 1 ATOM 5535 N N . SER B 1 219 ? 2.623 76.225 117.843 1.00 57.68 ? 262 SER B N 1 ATOM 5536 C CA . SER B 1 219 ? 2.478 76.879 119.139 1.00 50.82 ? 262 SER B CA 1 ATOM 5537 C C . SER B 1 219 ? 2.678 78.387 119.029 1.00 63.01 ? 262 SER B C 1 ATOM 5538 O O . SER B 1 219 ? 1.951 79.162 119.663 1.00 67.57 ? 262 SER B O 1 ATOM 5539 C CB . SER B 1 219 ? 3.464 76.280 120.141 1.00 54.85 ? 262 SER B CB 1 ATOM 5540 O OG . SER B 1 219 ? 3.379 76.937 121.394 1.00 83.19 ? 262 SER B OG 1 ATOM 5541 N N . GLY B 1 220 ? 3.651 78.822 118.233 1.00 54.05 ? 263 GLY B N 1 ATOM 5542 C CA . GLY B 1 220 ? 3.955 80.229 118.074 1.00 60.00 ? 263 GLY B CA 1 ATOM 5543 C C . GLY B 1 220 ? 3.029 81.005 117.166 1.00 63.30 ? 263 GLY B C 1 ATOM 5544 O O . GLY B 1 220 ? 3.355 82.133 116.787 1.00 67.61 ? 263 GLY B O 1 ATOM 5545 N N . LEU B 1 221 ? 1.876 80.440 116.804 1.00 46.25 ? 264 LEU B N 1 ATOM 5546 C CA . LEU B 1 221 ? 0.984 81.072 115.840 1.00 41.64 ? 264 LEU B CA 1 ATOM 5547 C C . LEU B 1 221 ? 0.256 82.296 116.385 1.00 49.26 ? 264 LEU B C 1 ATOM 5548 O O . LEU B 1 221 ? -0.412 82.985 115.607 1.00 80.20 ? 264 LEU B O 1 ATOM 5549 C CB . LEU B 1 221 ? -0.040 80.056 115.337 1.00 50.69 ? 264 LEU B CB 1 ATOM 5550 C CG . LEU B 1 221 ? 0.523 79.003 114.384 1.00 46.37 ? 264 LEU B CG 1 ATOM 5551 C CD1 . LEU B 1 221 ? -0.545 77.989 114.009 1.00 38.75 ? 264 LEU B CD1 1 ATOM 5552 C CD2 . LEU B 1 221 ? 1.095 79.676 113.149 1.00 34.96 ? 264 LEU B CD2 1 ATOM 5553 N N . GLY B 1 222 ? 0.348 82.578 117.681 1.00 55.53 ? 265 GLY B N 1 ATOM 5554 C CA . GLY B 1 222 ? -0.422 83.646 118.274 1.00 48.10 ? 265 GLY B CA 1 ATOM 5555 C C . GLY B 1 222 ? -0.173 84.994 117.622 1.00 49.24 ? 265 GLY B C 1 ATOM 5556 O O . GLY B 1 222 ? -1.095 85.647 117.121 1.00 53.14 ? 265 GLY B O 1 ATOM 5557 N N . PRO B 1 223 ? 1.093 85.443 117.629 1.00 46.83 ? 266 PRO B N 1 ATOM 5558 C CA . PRO B 1 223 ? 1.623 86.689 117.070 1.00 54.44 ? 266 PRO B CA 1 ATOM 5559 C C . PRO B 1 223 ? 2.163 86.475 115.668 1.00 76.87 ? 266 PRO B C 1 ATOM 5560 O O . PRO B 1 223 ? 3.381 86.393 115.516 1.00 92.42 ? 266 PRO B O 1 ATOM 5561 C CB . PRO B 1 223 ? 2.753 87.032 118.028 1.00 65.28 ? 266 PRO B CB 1 ATOM 5562 C CG . PRO B 1 223 ? 3.327 85.689 118.338 1.00 57.78 ? 266 PRO B CG 1 ATOM 5563 C CD . PRO B 1 223 ? 2.154 84.712 118.347 1.00 57.18 ? 266 PRO B CD 1 ATOM 5564 N N . ALA B 1 224 ? 1.307 86.395 114.659 1.00 76.99 ? 267 ALA B N 1 ATOM 5565 C CA . ALA B 1 224 ? -0.117 86.665 114.771 1.00 76.39 ? 267 ALA B CA 1 ATOM 5566 C C . ALA B 1 224 ? -0.736 86.138 113.483 1.00 66.22 ? 267 ALA B C 1 ATOM 5567 O O . ALA B 1 224 ? -0.066 85.415 112.747 1.00 50.31 ? 267 ALA B O 1 ATOM 5568 C CB . ALA B 1 224 ? -0.375 88.157 114.963 1.00 60.06 ? 267 ALA B CB 1 ATOM 5569 N N . GLY B 1 225 ? -2.011 86.408 113.222 1.00 70.87 ? 268 GLY B N 1 ATOM 5570 C CA . GLY B 1 225 ? -2.955 86.995 114.152 1.00 69.51 ? 268 GLY B CA 1 ATOM 5571 C C . GLY B 1 225 ? -3.905 85.868 114.445 1.00 56.30 ? 268 GLY B C 1 ATOM 5572 O O . GLY B 1 225 ? -3.503 84.706 114.398 1.00 59.38 ? 268 GLY B O 1 ATOM 5573 N N . PRO B 1 226 ? -5.158 86.185 114.749 1.00 48.49 ? 269 PRO B N 1 ATOM 5574 C CA . PRO B 1 226 ? -6.186 85.145 114.708 1.00 59.10 ? 269 PRO B CA 1 ATOM 5575 C C . PRO B 1 226 ? -6.532 84.815 113.264 1.00 58.40 ? 269 PRO B C 1 ATOM 5576 O O . PRO B 1 226 ? -6.522 85.678 112.382 1.00 54.61 ? 269 PRO B O 1 ATOM 5577 C CB . PRO B 1 226 ? -7.367 85.793 115.433 1.00 55.27 ? 269 PRO B CB 1 ATOM 5578 C CG . PRO B 1 226 ? -7.213 87.251 115.102 1.00 46.40 ? 269 PRO B CG 1 ATOM 5579 C CD . PRO B 1 226 ? -5.723 87.512 115.052 1.00 43.98 ? 269 PRO B CD 1 ATOM 5580 N N . PHE B 1 227 ? -6.835 83.545 113.025 1.00 57.28 ? 270 PHE B N 1 ATOM 5581 C CA . PHE B 1 227 ? -7.134 83.060 111.686 1.00 52.20 ? 270 PHE B CA 1 ATOM 5582 C C . PHE B 1 227 ? -8.613 82.728 111.548 1.00 42.66 ? 270 PHE B C 1 ATOM 5583 O O . PHE B 1 227 ? -9.230 82.189 112.472 1.00 55.31 ? 270 PHE B O 1 ATOM 5584 C CB . PHE B 1 227 ? -6.284 81.836 111.337 1.00 47.97 ? 270 PHE B CB 1 ATOM 5585 C CG . PHE B 1 227 ? -4.813 82.049 111.534 1.00 52.09 ? 270 PHE B CG 1 ATOM 5586 C CD1 . PHE B 1 227 ? -4.109 82.902 110.699 1.00 43.36 ? 270 PHE B CD1 1 ATOM 5587 C CD2 . PHE B 1 227 ? -4.130 81.386 112.541 1.00 49.87 ? 270 PHE B CD2 1 ATOM 5588 C CE1 . PHE B 1 227 ? -2.752 83.102 110.871 1.00 35.36 ? 270 PHE B CE1 1 ATOM 5589 C CE2 . PHE B 1 227 ? -2.771 81.580 112.718 1.00 49.97 ? 270 PHE B CE2 1 ATOM 5590 C CZ . PHE B 1 227 ? -2.082 82.439 111.881 1.00 49.68 ? 270 PHE B CZ 1 ATOM 5591 N N . ASP B 1 228 ? -9.179 83.074 110.395 1.00 48.30 ? 271 ASP B N 1 ATOM 5592 C CA . ASP B 1 228 ? -10.530 82.644 110.065 1.00 42.93 ? 271 ASP B CA 1 ATOM 5593 C C . ASP B 1 228 ? -10.553 81.225 109.510 1.00 48.05 ? 271 ASP B C 1 ATOM 5594 O O . ASP B 1 228 ? -11.526 80.496 109.731 1.00 58.02 ? 271 ASP B O 1 ATOM 5595 C CB . ASP B 1 228 ? -11.156 83.628 109.076 1.00 61.19 ? 271 ASP B CB 1 ATOM 5596 C CG . ASP B 1 228 ? -11.418 84.991 109.699 1.00 74.10 ? 271 ASP B CG 1 ATOM 5597 O OD1 . ASP B 1 228 ? -10.439 85.695 110.028 1.00 70.67 ? 271 ASP B OD1 1 ATOM 5598 O OD2 . ASP B 1 228 ? -12.602 85.361 109.855 1.00 96.91 -1 271 ASP B OD2 1 ATOM 5599 N N . MET B 1 229 ? -9.505 80.823 108.789 1.00 53.72 ? 272 MET B N 1 ATOM 5600 C CA . MET B 1 229 ? -9.430 79.507 108.164 1.00 52.54 ? 272 MET B CA 1 ATOM 5601 C C . MET B 1 229 ? -7.966 79.145 107.944 1.00 44.19 ? 272 MET B C 1 ATOM 5602 O O . MET B 1 229 ? -7.070 79.977 108.097 1.00 45.42 ? 272 MET B O 1 ATOM 5603 C CB . MET B 1 229 ? -10.210 79.467 106.846 1.00 52.05 ? 272 MET B CB 1 ATOM 5604 C CG . MET B 1 229 ? -11.699 79.644 107.024 1.00 55.61 ? 272 MET B CG 1 ATOM 5605 S SD . MET B 1 229 ? -12.403 80.786 105.832 1.00 100.40 ? 272 MET B SD 1 ATOM 5606 C CE . MET B 1 229 ? -14.024 81.037 106.549 1.00 72.97 ? 272 MET B CE 1 ATOM 5607 N N . VAL B 1 230 ? -7.732 77.875 107.619 1.00 53.60 ? 273 VAL B N 1 ATOM 5608 C CA . VAL B 1 230 ? -6.393 77.366 107.342 1.00 54.71 ? 273 VAL B CA 1 ATOM 5609 C C . VAL B 1 230 ? -6.431 76.533 106.068 1.00 48.36 ? 273 VAL B C 1 ATOM 5610 O O . VAL B 1 230 ? -7.255 75.620 105.945 1.00 58.05 ? 273 VAL B O 1 ATOM 5611 C CB . VAL B 1 230 ? -5.852 76.532 108.517 1.00 47.72 ? 273 VAL B CB 1 ATOM 5612 C CG1 . VAL B 1 230 ? -4.401 76.145 108.275 1.00 48.65 ? 273 VAL B CG1 1 ATOM 5613 C CG2 . VAL B 1 230 ? -5.997 77.307 109.810 1.00 51.35 ? 273 VAL B CG2 1 ATOM 5614 N N . TYR B 1 231 ? -5.547 76.850 105.120 1.00 50.51 ? 274 TYR B N 1 ATOM 5615 C CA . TYR B 1 231 ? -5.360 76.055 103.910 1.00 39.57 ? 274 TYR B CA 1 ATOM 5616 C C . TYR B 1 231 ? -4.084 75.234 104.059 1.00 39.65 ? 274 TYR B C 1 ATOM 5617 O O . TYR B 1 231 ? -3.004 75.795 104.281 1.00 39.30 ? 274 TYR B O 1 ATOM 5618 C CB . TYR B 1 231 ? -5.282 76.939 102.664 1.00 35.91 ? 274 TYR B CB 1 ATOM 5619 C CG . TYR B 1 231 ? -6.520 77.767 102.392 1.00 41.55 ? 274 TYR B CG 1 ATOM 5620 C CD1 . TYR B 1 231 ? -7.672 77.610 103.152 1.00 41.29 ? 274 TYR B CD1 1 ATOM 5621 C CD2 . TYR B 1 231 ? -6.533 78.707 101.371 1.00 35.27 ? 274 TYR B CD2 1 ATOM 5622 C CE1 . TYR B 1 231 ? -8.798 78.376 102.907 1.00 48.09 ? 274 TYR B CE1 1 ATOM 5623 C CE2 . TYR B 1 231 ? -7.655 79.472 101.115 1.00 40.16 ? 274 TYR B CE2 1 ATOM 5624 C CZ . TYR B 1 231 ? -8.784 79.303 101.886 1.00 51.71 ? 274 TYR B CZ 1 ATOM 5625 O OH . TYR B 1 231 ? -9.904 80.064 101.635 1.00 55.04 ? 274 TYR B OH 1 ATOM 5626 N N . TRP B 1 232 ? -4.208 73.913 103.941 1.00 42.01 ? 275 TRP B N 1 ATOM 5627 C CA . TRP B 1 232 ? -3.104 72.979 104.151 1.00 42.20 ? 275 TRP B CA 1 ATOM 5628 C C . TRP B 1 232 ? -2.948 72.133 102.890 1.00 47.61 ? 275 TRP B C 1 ATOM 5629 O O . TRP B 1 232 ? -3.839 71.345 102.554 1.00 44.74 ? 275 TRP B O 1 ATOM 5630 C CB . TRP B 1 232 ? -3.367 72.116 105.382 1.00 47.25 ? 275 TRP B CB 1 ATOM 5631 C CG . TRP B 1 232 ? -2.277 71.161 105.702 1.00 48.90 ? 275 TRP B CG 1 ATOM 5632 C CD1 . TRP B 1 232 ? -1.010 71.150 105.191 1.00 60.13 ? 275 TRP B CD1 1 ATOM 5633 C CD2 . TRP B 1 232 ? -2.362 70.049 106.592 1.00 39.32 ? 275 TRP B CD2 1 ATOM 5634 N NE1 . TRP B 1 232 ? -0.298 70.100 105.720 1.00 64.62 ? 275 TRP B NE1 1 ATOM 5635 C CE2 . TRP B 1 232 ? -1.108 69.409 106.583 1.00 54.45 ? 275 TRP B CE2 1 ATOM 5636 C CE3 . TRP B 1 232 ? -3.379 69.534 107.400 1.00 45.90 ? 275 TRP B CE3 1 ATOM 5637 C CZ2 . TRP B 1 232 ? -0.842 68.281 107.353 1.00 56.70 ? 275 TRP B CZ2 1 ATOM 5638 C CZ3 . TRP B 1 232 ? -3.115 68.414 108.162 1.00 58.55 ? 275 TRP B CZ3 1 ATOM 5639 C CH2 . TRP B 1 232 ? -1.856 67.799 108.134 1.00 60.50 ? 275 TRP B CH2 1 ATOM 5640 N N . THR B 1 233 ? -1.813 72.292 102.200 1.00 48.82 ? 276 THR B N 1 ATOM 5641 C CA . THR B 1 233 ? -1.682 71.798 100.829 1.00 46.04 ? 276 THR B CA 1 ATOM 5642 C C . THR B 1 233 ? -1.408 70.297 100.749 1.00 57.60 ? 276 THR B C 1 ATOM 5643 O O . THR B 1 233 ? -2.055 69.594 99.966 1.00 61.62 ? 276 THR B O 1 ATOM 5644 C CB . THR B 1 233 ? -0.590 72.576 100.098 1.00 46.80 ? 276 THR B CB 1 ATOM 5645 O OG1 . THR B 1 233 ? -1.002 73.943 99.951 1.00 39.89 ? 276 THR B OG1 1 ATOM 5646 C CG2 . THR B 1 233 ? -0.355 71.979 98.733 1.00 54.94 ? 276 THR B CG2 1 ATOM 5647 N N . GLY B 1 234 ? -0.449 69.797 101.526 1.00 63.64 ? 277 GLY B N 1 ATOM 5648 C CA . GLY B 1 234 ? -0.129 68.379 101.477 1.00 60.89 ? 277 GLY B CA 1 ATOM 5649 C C . GLY B 1 234 ? 1.312 68.029 101.811 1.00 62.03 ? 277 GLY B C 1 ATOM 5650 O O . GLY B 1 234 ? 1.983 68.752 102.548 1.00 82.36 ? 277 GLY B O 1 ATOM 5651 N N . ASP B 1 235 ? 1.785 66.911 101.263 1.00 60.47 ? 278 ASP B N 1 ATOM 5652 C CA . ASP B 1 235 ? 3.152 66.445 101.495 1.00 66.04 ? 278 ASP B CA 1 ATOM 5653 C C . ASP B 1 235 ? 3.451 66.200 102.973 1.00 57.54 ? 278 ASP B C 1 ATOM 5654 O O . ASP B 1 235 ? 4.523 66.548 103.467 1.00 50.47 ? 278 ASP B O 1 ATOM 5655 C CB . ASP B 1 235 ? 4.161 67.439 100.916 1.00 57.24 ? 278 ASP B CB 1 ATOM 5656 C CG . ASP B 1 235 ? 4.630 67.051 99.527 1.00 63.39 ? 278 ASP B CG 1 ATOM 5657 O OD1 . ASP B 1 235 ? 4.227 65.973 99.042 1.00 46.78 ? 278 ASP B OD1 1 ATOM 5658 O OD2 . ASP B 1 235 ? 5.402 67.823 98.922 1.00 69.74 -1 278 ASP B OD2 1 ATOM 5659 N N . ILE B 1 236 ? 2.490 65.603 103.670 1.00 57.42 ? 279 ILE B N 1 ATOM 5660 C CA . ILE B 1 236 ? 2.624 65.316 105.095 1.00 46.19 ? 279 ILE B CA 1 ATOM 5661 C C . ILE B 1 236 ? 3.757 64.354 105.471 1.00 40.67 ? 279 ILE B C 1 ATOM 5662 O O . ILE B 1 236 ? 4.442 64.575 106.470 1.00 41.90 ? 279 ILE B O 1 ATOM 5663 C CB . ILE B 1 236 ? 1.305 64.773 105.681 1.00 49.16 ? 279 ILE B CB 1 ATOM 5664 C CG1 . ILE B 1 236 ? 0.115 65.575 105.150 1.00 49.34 ? 279 ILE B CG1 1 ATOM 5665 C CG2 . ILE B 1 236 ? 1.342 64.808 107.201 1.00 45.19 ? 279 ILE B CG2 1 ATOM 5666 C CD1 . ILE B 1 236 ? -1.219 65.127 105.705 1.00 53.51 ? 279 ILE B CD1 1 ATOM 5667 N N . PRO B 1 237 ? 3.961 63.293 104.693 1.00 44.90 ? 280 PRO B N 1 ATOM 5668 C CA . PRO B 1 237 ? 5.024 62.338 105.023 1.00 43.65 ? 280 PRO B CA 1 ATOM 5669 C C . PRO B 1 237 ? 6.375 62.817 104.517 1.00 37.72 ? 280 PRO B C 1 ATOM 5670 O O . PRO B 1 237 ? 6.478 63.627 103.594 1.00 46.78 ? 280 PRO B O 1 ATOM 5671 C CB . PRO B 1 237 ? 4.585 61.044 104.324 1.00 41.66 ? 280 PRO B CB 1 ATOM 5672 C CG . PRO B 1 237 ? 3.599 61.466 103.301 1.00 52.31 ? 280 PRO B CG 1 ATOM 5673 C CD . PRO B 1 237 ? 2.927 62.691 103.836 1.00 48.67 ? 280 PRO B CD 1 ATOM 5674 N N . ALA B 1 238 ? 7.426 62.272 105.124 1.00 47.13 ? 281 ALA B N 1 ATOM 5675 C CA . ALA B 1 238 ? 8.782 62.723 104.855 1.00 48.52 ? 281 ALA B CA 1 ATOM 5676 C C . ALA B 1 238 ? 9.259 62.248 103.484 1.00 50.19 ? 281 ALA B C 1 ATOM 5677 O O . ALA B 1 238 ? 8.524 61.632 102.707 1.00 45.84 ? 281 ALA B O 1 ATOM 5678 C CB . ALA B 1 238 ? 9.725 62.239 105.953 1.00 67.24 ? 281 ALA B CB 1 ATOM 5679 N N . HIS B 1 239 ? 10.522 62.550 103.193 1.00 65.50 ? 282 HIS B N 1 ATOM 5680 C CA . HIS B 1 239 ? 11.132 62.299 101.896 1.00 54.97 ? 282 HIS B CA 1 ATOM 5681 C C . HIS B 1 239 ? 11.798 60.935 101.776 1.00 44.54 ? 282 HIS B C 1 ATOM 5682 O O . HIS B 1 239 ? 12.517 60.711 100.799 1.00 45.28 ? 282 HIS B O 1 ATOM 5683 C CB . HIS B 1 239 ? 12.155 63.387 101.559 1.00 53.34 ? 282 HIS B CB 1 ATOM 5684 C CG . HIS B 1 239 ? 11.571 64.556 100.831 1.00 62.23 ? 282 HIS B CG 1 ATOM 5685 N ND1 . HIS B 1 239 ? 10.869 65.558 101.468 1.00 74.79 ? 282 HIS B ND1 1 ATOM 5686 C CD2 . HIS B 1 239 ? 11.561 64.868 99.514 1.00 55.29 ? 282 HIS B CD2 1 ATOM 5687 C CE1 . HIS B 1 239 ? 10.471 66.447 100.576 1.00 75.97 ? 282 HIS B CE1 1 ATOM 5688 N NE2 . HIS B 1 239 ? 10.873 66.050 99.382 1.00 74.10 ? 282 HIS B NE2 1 ATOM 5689 N N . ASP B 1 240 ? 11.621 60.030 102.737 1.00 60.53 ? 283 ASP B N 1 ATOM 5690 C CA . ASP B 1 240 ? 12.208 58.701 102.581 1.00 72.62 ? 283 ASP B CA 1 ATOM 5691 C C . ASP B 1 240 ? 11.186 57.876 101.813 1.00 72.60 ? 283 ASP B C 1 ATOM 5692 O O . ASP B 1 240 ? 10.202 57.393 102.378 1.00 68.88 ? 283 ASP B O 1 ATOM 5693 C CB . ASP B 1 240 ? 12.541 58.074 103.932 1.00 65.61 ? 283 ASP B CB 1 ATOM 5694 C CG . ASP B 1 240 ? 11.319 57.927 104.832 1.00 78.79 ? 283 ASP B CG 1 ATOM 5695 O OD1 . ASP B 1 240 ? 10.477 58.851 104.869 1.00 70.80 ? 283 ASP B OD1 1 ATOM 5696 O OD2 . ASP B 1 240 ? 11.193 56.873 105.492 1.00 66.27 -1 283 ASP B OD2 1 ATOM 5697 N N . VAL B 1 241 ? 11.433 57.701 100.513 1.00 60.55 ? 284 VAL B N 1 ATOM 5698 C CA . VAL B 1 241 ? 10.461 57.080 99.624 1.00 72.38 ? 284 VAL B CA 1 ATOM 5699 C C . VAL B 1 241 ? 10.785 55.630 99.316 1.00 75.83 ? 284 VAL B C 1 ATOM 5700 O O . VAL B 1 241 ? 9.991 54.963 98.640 1.00 67.91 ? 284 VAL B O 1 ATOM 5701 C CB . VAL B 1 241 ? 10.316 57.887 98.319 1.00 58.08 ? 284 VAL B CB 1 ATOM 5702 C CG1 . VAL B 1 241 ? 9.590 59.197 98.591 1.00 57.51 ? 284 VAL B CG1 1 ATOM 5703 C CG2 . VAL B 1 241 ? 11.679 58.150 97.706 1.00 48.21 ? 284 VAL B CG2 1 ATOM 5704 N N . TRP B 1 242 ? 11.929 55.119 99.774 1.00 71.46 ? 285 TRP B N 1 ATOM 5705 C CA . TRP B 1 242 ? 12.296 53.758 99.398 1.00 60.21 ? 285 TRP B CA 1 ATOM 5706 C C . TRP B 1 242 ? 11.604 52.711 100.267 1.00 64.48 ? 285 TRP B C 1 ATOM 5707 O O . TRP B 1 242 ? 11.042 51.744 99.742 1.00 81.99 ? 285 TRP B O 1 ATOM 5708 C CB . TRP B 1 242 ? 13.819 53.587 99.425 1.00 57.77 ? 285 TRP B CB 1 ATOM 5709 C CG . TRP B 1 242 ? 14.508 54.001 100.690 1.00 65.49 ? 285 TRP B CG 1 ATOM 5710 C CD1 . TRP B 1 242 ? 14.889 53.189 101.714 1.00 77.17 ? 285 TRP B CD1 1 ATOM 5711 C CD2 . TRP B 1 242 ? 14.940 55.322 101.045 1.00 71.46 ? 285 TRP B CD2 1 ATOM 5712 N NE1 . TRP B 1 242 ? 15.514 53.921 102.694 1.00 69.70 ? 285 TRP B NE1 1 ATOM 5713 C CE2 . TRP B 1 242 ? 15.558 55.233 102.308 1.00 75.61 ? 285 TRP B CE2 1 ATOM 5714 C CE3 . TRP B 1 242 ? 14.852 56.572 100.424 1.00 80.42 ? 285 TRP B CE3 1 ATOM 5715 C CZ2 . TRP B 1 242 ? 16.088 56.346 102.963 1.00 84.82 ? 285 TRP B CZ2 1 ATOM 5716 C CZ3 . TRP B 1 242 ? 15.379 57.677 101.077 1.00 77.01 ? 285 TRP B CZ3 1 ATOM 5717 C CH2 . TRP B 1 242 ? 15.990 57.555 102.333 1.00 70.35 ? 285 TRP B CH2 1 ATOM 5718 N N . HIS B 1 243 ? 11.628 52.876 101.592 1.00 65.58 ? 286 HIS B N 1 ATOM 5719 C CA . HIS B 1 243 ? 11.032 51.896 102.495 1.00 74.85 ? 286 HIS B CA 1 ATOM 5720 C C . HIS B 1 243 ? 9.647 52.289 103.007 1.00 77.20 ? 286 HIS B C 1 ATOM 5721 O O . HIS B 1 243 ? 9.109 51.598 103.879 1.00 104.36 ? 286 HIS B O 1 ATOM 5722 C CB . HIS B 1 243 ? 11.969 51.592 103.669 1.00 85.28 ? 286 HIS B CB 1 ATOM 5723 C CG . HIS B 1 243 ? 12.237 52.759 104.566 1.00 84.19 ? 286 HIS B CG 1 ATOM 5724 N ND1 . HIS B 1 243 ? 13.486 53.328 104.690 1.00 82.57 ? 286 HIS B ND1 1 ATOM 5725 C CD2 . HIS B 1 243 ? 11.425 53.450 105.400 1.00 104.37 ? 286 HIS B CD2 1 ATOM 5726 C CE1 . HIS B 1 243 ? 13.430 54.325 105.554 1.00 99.56 ? 286 HIS B CE1 1 ATOM 5727 N NE2 . HIS B 1 243 ? 12.190 54.421 105.999 1.00 113.67 ? 286 HIS B NE2 1 ATOM 5728 N N . GLN B 1 244 ? 9.063 53.378 102.507 1.00 64.16 ? 287 GLN B N 1 ATOM 5729 C CA . GLN B 1 244 ? 7.755 53.811 102.987 1.00 70.16 ? 287 GLN B CA 1 ATOM 5730 C C . GLN B 1 244 ? 6.740 52.676 102.900 1.00 62.21 ? 287 GLN B C 1 ATOM 5731 O O . GLN B 1 244 ? 6.808 51.819 102.015 1.00 74.01 ? 287 GLN B O 1 ATOM 5732 C CB . GLN B 1 244 ? 7.249 55.002 102.170 1.00 72.81 ? 287 GLN B CB 1 ATOM 5733 C CG . GLN B 1 244 ? 7.656 56.370 102.683 1.00 72.38 ? 287 GLN B CG 1 ATOM 5734 C CD . GLN B 1 244 ? 7.287 57.479 101.708 1.00 81.63 ? 287 GLN B CD 1 ATOM 5735 O OE1 . GLN B 1 244 ? 6.891 57.215 100.572 1.00 93.11 ? 287 GLN B OE1 1 ATOM 5736 N NE2 . GLN B 1 244 ? 7.418 58.726 102.148 1.00 74.24 ? 287 GLN B NE2 1 ATOM 5737 N N . THR B 1 245 ? 5.803 52.659 103.848 1.00 58.79 ? 288 THR B N 1 ATOM 5738 C CA . THR B 1 245 ? 4.710 51.696 103.863 1.00 59.23 ? 288 THR B CA 1 ATOM 5739 C C . THR B 1 245 ? 3.397 52.427 104.091 1.00 56.51 ? 288 THR B C 1 ATOM 5740 O O . THR B 1 245 ? 3.366 53.502 104.695 1.00 61.41 ? 288 THR B O 1 ATOM 5741 C CB . THR B 1 245 ? 4.885 50.614 104.944 1.00 64.28 ? 288 THR B CB 1 ATOM 5742 O OG1 . THR B 1 245 ? 3.635 49.949 105.160 1.00 65.23 ? 288 THR B OG1 1 ATOM 5743 C CG2 . THR B 1 245 ? 5.341 51.220 106.245 1.00 69.14 ? 288 THR B CG2 1 ATOM 5744 N N . ARG B 1 246 ? 2.306 51.832 103.600 1.00 45.75 ? 289 ARG B N 1 ATOM 5745 C CA . ARG B 1 246 ? 0.992 52.437 103.795 1.00 54.19 ? 289 ARG B CA 1 ATOM 5746 C C . ARG B 1 246 ? 0.750 52.767 105.260 1.00 55.63 ? 289 ARG B C 1 ATOM 5747 O O . ARG B 1 246 ? 0.208 53.830 105.589 1.00 63.76 ? 289 ARG B O 1 ATOM 5748 C CB . ARG B 1 246 ? -0.105 51.507 103.276 1.00 31.51 ? 289 ARG B CB 1 ATOM 5749 C CG . ARG B 1 246 ? -0.072 51.273 101.782 1.00 48.88 ? 289 ARG B CG 1 ATOM 5750 C CD . ARG B 1 246 ? -1.381 50.672 101.296 1.00 53.10 ? 289 ARG B CD 1 ATOM 5751 N NE . ARG B 1 246 ? -1.381 50.482 99.849 1.00 53.06 ? 289 ARG B NE 1 ATOM 5752 C CZ . ARG B 1 246 ? -2.431 50.068 99.149 1.00 60.09 ? 289 ARG B CZ 1 ATOM 5753 N NH1 . ARG B 1 246 ? -3.576 49.803 99.764 1.00 60.84 1 289 ARG B NH1 1 ATOM 5754 N NH2 . ARG B 1 246 ? -2.335 49.923 97.834 1.00 48.52 ? 289 ARG B NH2 1 ATOM 5755 N N . GLN B 1 247 ? 1.148 51.865 106.159 1.00 63.04 ? 290 GLN B N 1 ATOM 5756 C CA . GLN B 1 247 ? 0.965 52.121 107.581 1.00 66.34 ? 290 GLN B CA 1 ATOM 5757 C C . GLN B 1 247 ? 1.699 53.387 108.010 1.00 80.18 ? 290 GLN B C 1 ATOM 5758 O O . GLN B 1 247 ? 1.177 54.172 108.809 1.00 76.54 ? 290 GLN B O 1 ATOM 5759 C CB . GLN B 1 247 ? 1.428 50.913 108.395 1.00 79.62 ? 290 GLN B CB 1 ATOM 5760 C CG . GLN B 1 247 ? 1.261 51.078 109.898 1.00 88.34 ? 290 GLN B CG 1 ATOM 5761 C CD . GLN B 1 247 ? 1.748 49.872 110.672 1.00 79.82 ? 290 GLN B CD 1 ATOM 5762 O OE1 . GLN B 1 247 ? 1.649 48.738 110.201 1.00 86.56 ? 290 GLN B OE1 1 ATOM 5763 N NE2 . GLN B 1 247 ? 2.283 50.108 111.863 1.00 93.27 ? 290 GLN B NE2 1 ATOM 5764 N N . ASP B 1 248 ? 2.906 53.610 107.482 1.00 69.64 ? 291 ASP B N 1 ATOM 5765 C CA . ASP B 1 248 ? 3.656 54.807 107.853 1.00 65.47 ? 291 ASP B CA 1 ATOM 5766 C C . ASP B 1 248 ? 2.992 56.065 107.309 1.00 61.99 ? 291 ASP B C 1 ATOM 5767 O O . ASP B 1 248 ? 2.808 57.046 108.038 1.00 73.51 ? 291 ASP B O 1 ATOM 5768 C CB . ASP B 1 248 ? 5.102 54.716 107.361 1.00 68.00 ? 291 ASP B CB 1 ATOM 5769 C CG . ASP B 1 248 ? 5.883 53.608 108.035 1.00 85.92 ? 291 ASP B CG 1 ATOM 5770 O OD1 . ASP B 1 248 ? 5.563 53.267 109.194 1.00 87.23 ? 291 ASP B OD1 1 ATOM 5771 O OD2 . ASP B 1 248 ? 6.830 53.086 107.408 1.00 107.64 -1 291 ASP B OD2 1 ATOM 5772 N N . GLN B 1 249 ? 2.629 56.059 106.024 1.00 54.60 ? 292 GLN B N 1 ATOM 5773 C CA . GLN B 1 249 ? 1.953 57.215 105.446 1.00 62.76 ? 292 GLN B CA 1 ATOM 5774 C C . GLN B 1 249 ? 0.705 57.575 106.243 1.00 61.34 ? 292 GLN B C 1 ATOM 5775 O O . GLN B 1 249 ? 0.464 58.750 106.548 1.00 65.12 ? 292 GLN B O 1 ATOM 5776 C CB . GLN B 1 249 ? 1.611 56.946 103.979 1.00 57.50 ? 292 GLN B CB 1 ATOM 5777 C CG . GLN B 1 249 ? 2.789 56.448 103.154 1.00 54.66 ? 292 GLN B CG 1 ATOM 5778 C CD . GLN B 1 249 ? 3.942 57.436 103.128 1.00 62.96 ? 292 GLN B CD 1 ATOM 5779 O OE1 . GLN B 1 249 ? 4.822 57.405 103.988 1.00 64.55 ? 292 GLN B OE1 1 ATOM 5780 N NE2 . GLN B 1 249 ? 3.943 58.320 102.134 1.00 76.73 ? 292 GLN B NE2 1 ATOM 5781 N N . LEU B 1 250 ? -0.100 56.571 106.602 1.00 58.42 ? 293 LEU B N 1 ATOM 5782 C CA . LEU B 1 250 ? -1.270 56.852 107.430 1.00 60.66 ? 293 LEU B CA 1 ATOM 5783 C C . LEU B 1 250 ? -0.862 57.362 108.806 1.00 57.75 ? 293 LEU B C 1 ATOM 5784 O O . LEU B 1 250 ? -1.550 58.208 109.390 1.00 54.43 ? 293 LEU B O 1 ATOM 5785 C CB . LEU B 1 250 ? -2.159 55.615 107.546 1.00 55.16 ? 293 LEU B CB 1 ATOM 5786 C CG . LEU B 1 250 ? -2.894 55.269 106.251 1.00 53.89 ? 293 LEU B CG 1 ATOM 5787 C CD1 . LEU B 1 250 ? -3.987 54.248 106.506 1.00 32.22 ? 293 LEU B CD1 1 ATOM 5788 C CD2 . LEU B 1 250 ? -3.469 56.534 105.631 1.00 56.10 ? 293 LEU B CD2 1 ATOM 5789 N N . ARG B 1 251 ? 0.249 56.858 109.346 1.00 55.68 ? 294 ARG B N 1 ATOM 5790 C CA . ARG B 1 251 ? 0.763 57.394 110.602 1.00 55.51 ? 294 ARG B CA 1 ATOM 5791 C C . ARG B 1 251 ? 0.974 58.898 110.489 1.00 63.23 ? 294 ARG B C 1 ATOM 5792 O O . ARG B 1 251 ? 0.419 59.680 111.271 1.00 55.46 ? 294 ARG B O 1 ATOM 5793 C CB . ARG B 1 251 ? 2.069 56.691 110.983 1.00 48.17 ? 294 ARG B CB 1 ATOM 5794 C CG . ARG B 1 251 ? 2.732 57.263 112.230 1.00 53.97 ? 294 ARG B CG 1 ATOM 5795 C CD . ARG B 1 251 ? 4.031 56.545 112.573 1.00 37.19 ? 294 ARG B CD 1 ATOM 5796 N NE . ARG B 1 251 ? 5.042 56.721 111.534 1.00 58.63 ? 294 ARG B NE 1 ATOM 5797 C CZ . ARG B 1 251 ? 6.249 56.164 111.558 1.00 58.54 ? 294 ARG B CZ 1 ATOM 5798 N NH1 . ARG B 1 251 ? 6.605 55.389 112.571 1.00 67.13 1 294 ARG B NH1 1 ATOM 5799 N NH2 . ARG B 1 251 ? 7.102 56.383 110.566 1.00 66.02 ? 294 ARG B NH2 1 ATOM 5800 N N . ALA B 1 252 ? 1.770 59.320 109.503 1.00 52.29 ? 295 ALA B N 1 ATOM 5801 C CA . ALA B 1 252 ? 2.005 60.743 109.280 1.00 51.10 ? 295 ALA B CA 1 ATOM 5802 C C . ALA B 1 252 ? 0.689 61.501 109.159 1.00 48.20 ? 295 ALA B C 1 ATOM 5803 O O . ALA B 1 252 ? 0.468 62.507 109.847 1.00 50.42 ? 295 ALA B O 1 ATOM 5804 C CB . ALA B 1 252 ? 2.863 60.942 108.030 1.00 41.07 ? 295 ALA B CB 1 ATOM 5805 N N . LEU B 1 253 ? -0.203 61.021 108.289 1.00 39.19 ? 296 LEU B N 1 ATOM 5806 C CA . LEU B 1 253 ? -1.471 61.709 108.070 1.00 47.41 ? 296 LEU B CA 1 ATOM 5807 C C . LEU B 1 253 ? -2.212 61.937 109.382 1.00 50.96 ? 296 LEU B C 1 ATOM 5808 O O . LEU B 1 253 ? -2.608 63.065 109.701 1.00 46.21 ? 296 LEU B O 1 ATOM 5809 C CB . LEU B 1 253 ? -2.344 60.905 107.103 1.00 45.92 ? 296 LEU B CB 1 ATOM 5810 C CG . LEU B 1 253 ? -3.722 61.493 106.784 1.00 51.05 ? 296 LEU B CG 1 ATOM 5811 C CD1 . LEU B 1 253 ? -4.183 61.066 105.401 1.00 47.05 ? 296 LEU B CD1 1 ATOM 5812 C CD2 . LEU B 1 253 ? -4.752 61.096 107.835 1.00 63.28 ? 296 LEU B CD2 1 ATOM 5813 N N . THR B 1 254 ? -2.402 60.868 110.161 1.00 49.53 ? 297 THR B N 1 ATOM 5814 C CA . THR B 1 254 ? -3.247 60.954 111.348 1.00 48.95 ? 297 THR B CA 1 ATOM 5815 C C . THR B 1 254 ? -2.583 61.749 112.466 1.00 45.99 ? 297 THR B C 1 ATOM 5816 O O . THR B 1 254 ? -3.246 62.554 113.131 1.00 44.19 ? 297 THR B O 1 ATOM 5817 C CB . THR B 1 254 ? -3.623 59.555 111.832 1.00 37.63 ? 297 THR B CB 1 ATOM 5818 O OG1 . THR B 1 254 ? -2.445 58.741 111.906 1.00 57.38 ? 297 THR B OG1 1 ATOM 5819 C CG2 . THR B 1 254 ? -4.637 58.921 110.895 1.00 37.13 ? 297 THR B CG2 1 ATOM 5820 N N . THR B 1 255 ? -1.283 61.549 112.697 1.00 36.42 ? 298 THR B N 1 ATOM 5821 C CA . THR B 1 255 ? -0.649 62.259 113.806 1.00 50.57 ? 298 THR B CA 1 ATOM 5822 C C . THR B 1 255 ? -0.505 63.746 113.499 1.00 46.05 ? 298 THR B C 1 ATOM 5823 O O . THR B 1 255 ? -0.755 64.589 114.369 1.00 44.70 ? 298 THR B O 1 ATOM 5824 C CB . THR B 1 255 ? 0.713 61.648 114.145 1.00 53.02 ? 298 THR B CB 1 ATOM 5825 O OG1 . THR B 1 255 ? 1.689 62.080 113.193 1.00 72.70 ? 298 THR B OG1 1 ATOM 5826 C CG2 . THR B 1 255 ? 0.638 60.125 114.141 1.00 55.00 ? 298 THR B CG2 1 ATOM 5827 N N . VAL B 1 256 ? -0.114 64.094 112.269 1.00 52.85 ? 299 VAL B N 1 ATOM 5828 C CA . VAL B 1 256 ? 0.032 65.510 111.940 1.00 47.90 ? 299 VAL B CA 1 ATOM 5829 C C . VAL B 1 256 ? -1.331 66.194 111.851 1.00 44.34 ? 299 VAL B C 1 ATOM 5830 O O . VAL B 1 256 ? -1.498 67.334 112.308 1.00 39.49 ? 299 VAL B O 1 ATOM 5831 C CB . VAL B 1 256 ? 0.841 65.687 110.645 1.00 40.97 ? 299 VAL B CB 1 ATOM 5832 C CG1 . VAL B 1 256 ? 1.007 67.166 110.341 1.00 36.01 ? 299 VAL B CG1 1 ATOM 5833 C CG2 . VAL B 1 256 ? 2.198 65.012 110.773 1.00 51.19 ? 299 VAL B CG2 1 ATOM 5834 N N . THR B 1 257 ? -2.326 65.518 111.269 1.00 34.49 ? 300 THR B N 1 ATOM 5835 C CA . THR B 1 257 ? -3.674 66.078 111.286 1.00 45.24 ? 300 THR B CA 1 ATOM 5836 C C . THR B 1 257 ? -4.142 66.313 112.715 1.00 55.76 ? 300 THR B C 1 ATOM 5837 O O . THR B 1 257 ? -4.711 67.367 113.029 1.00 56.48 ? 300 THR B O 1 ATOM 5838 C CB . THR B 1 257 ? -4.654 65.159 110.559 1.00 53.13 ? 300 THR B CB 1 ATOM 5839 O OG1 . THR B 1 257 ? -4.205 64.938 109.218 1.00 57.41 ? 300 THR B OG1 1 ATOM 5840 C CG2 . THR B 1 257 ? -6.040 65.792 110.522 1.00 51.01 ? 300 THR B CG2 1 ATOM 5841 N N . ALA B 1 258 ? -3.894 65.344 113.599 1.00 55.59 ? 301 ALA B N 1 ATOM 5842 C CA . ALA B 1 258 ? -4.289 65.500 114.993 1.00 46.13 ? 301 ALA B CA 1 ATOM 5843 C C . ALA B 1 258 ? -3.569 66.676 115.636 1.00 63.88 ? 301 ALA B C 1 ATOM 5844 O O . ALA B 1 258 ? -4.148 67.394 116.457 1.00 65.55 ? 301 ALA B O 1 ATOM 5845 C CB . ALA B 1 258 ? -4.008 64.211 115.763 1.00 40.83 ? 301 ALA B CB 1 ATOM 5846 N N . LEU B 1 259 ? -2.301 66.888 115.279 1.00 46.76 ? 302 LEU B N 1 ATOM 5847 C CA . LEU B 1 259 ? -1.560 68.017 115.830 1.00 42.95 ? 302 LEU B CA 1 ATOM 5848 C C . LEU B 1 259 ? -2.188 69.340 115.404 1.00 57.25 ? 302 LEU B C 1 ATOM 5849 O O . LEU B 1 259 ? -2.539 70.183 116.245 1.00 67.18 ? 302 LEU B O 1 ATOM 5850 C CB . LEU B 1 259 ? -0.097 67.934 115.391 1.00 35.34 ? 302 LEU B CB 1 ATOM 5851 C CG . LEU B 1 259 ? 0.915 68.723 116.221 1.00 47.40 ? 302 LEU B CG 1 ATOM 5852 C CD1 . LEU B 1 259 ? 0.815 68.322 117.680 1.00 53.33 ? 302 LEU B CD1 1 ATOM 5853 C CD2 . LEU B 1 259 ? 2.324 68.495 115.700 1.00 50.59 ? 302 LEU B CD2 1 ATOM 5854 N N . VAL B 1 260 ? -2.348 69.536 114.090 1.00 54.85 ? 303 VAL B N 1 ATOM 5855 C CA . VAL B 1 260 ? -2.987 70.754 113.593 1.00 52.18 ? 303 VAL B CA 1 ATOM 5856 C C . VAL B 1 260 ? -4.315 70.982 114.301 1.00 49.66 ? 303 VAL B C 1 ATOM 5857 O O . VAL B 1 260 ? -4.599 72.081 114.792 1.00 53.24 ? 303 VAL B O 1 ATOM 5858 C CB . VAL B 1 260 ? -3.173 70.686 112.066 1.00 57.07 ? 303 VAL B CB 1 ATOM 5859 C CG1 . VAL B 1 260 ? -4.075 71.817 111.599 1.00 46.68 ? 303 VAL B CG1 1 ATOM 5860 C CG2 . VAL B 1 260 ? -1.828 70.760 111.366 1.00 45.77 ? 303 VAL B CG2 1 ATOM 5861 N N . ARG B 1 261 ? -5.155 69.946 114.352 1.00 54.49 ? 304 ARG B N 1 ATOM 5862 C CA . ARG B 1 261 ? -6.458 70.095 114.992 1.00 64.20 ? 304 ARG B CA 1 ATOM 5863 C C . ARG B 1 261 ? -6.307 70.469 116.462 1.00 70.76 ? 304 ARG B C 1 ATOM 5864 O O . ARG B 1 261 ? -7.105 71.246 117.000 1.00 60.46 ? 304 ARG B O 1 ATOM 5865 C CB . ARG B 1 261 ? -7.270 68.809 114.832 1.00 58.29 ? 304 ARG B CB 1 ATOM 5866 C CG . ARG B 1 261 ? -8.747 68.956 115.159 1.00 56.88 ? 304 ARG B CG 1 ATOM 5867 C CD . ARG B 1 261 ? -9.554 67.810 114.558 1.00 64.89 ? 304 ARG B CD 1 ATOM 5868 N NE . ARG B 1 261 ? -10.937 67.804 115.029 1.00 93.29 ? 304 ARG B NE 1 ATOM 5869 C CZ . ARG B 1 261 ? -11.377 67.076 116.050 1.00 100.73 ? 304 ARG B CZ 1 ATOM 5870 N NH1 . ARG B 1 261 ? -10.543 66.285 116.711 1.00 85.66 1 304 ARG B NH1 1 ATOM 5871 N NH2 . ARG B 1 261 ? -12.654 67.135 116.409 1.00 91.18 ? 304 ARG B NH2 1 ATOM 5872 N N . LYS B 1 262 ? -5.284 69.926 117.128 1.00 63.45 ? 305 LYS B N 1 ATOM 5873 C CA . LYS B 1 262 ? -5.060 70.240 118.534 1.00 62.84 ? 305 LYS B CA 1 ATOM 5874 C C . LYS B 1 262 ? -4.774 71.721 118.728 1.00 64.66 ? 305 LYS B C 1 ATOM 5875 O O . LYS B 1 262 ? -5.402 72.381 119.565 1.00 71.35 ? 305 LYS B O 1 ATOM 5876 C CB . LYS B 1 262 ? -3.904 69.404 119.089 1.00 61.66 ? 305 LYS B CB 1 ATOM 5877 C CG . LYS B 1 262 ? -3.415 69.872 120.459 1.00 55.76 ? 305 LYS B CG 1 ATOM 5878 C CD . LYS B 1 262 ? -2.331 68.965 121.026 1.00 62.99 ? 305 LYS B CD 1 ATOM 5879 C CE . LYS B 1 262 ? -1.545 69.661 122.133 1.00 78.80 ? 305 LYS B CE 1 ATOM 5880 N NZ . LYS B 1 262 ? -2.423 70.218 123.204 1.00 91.33 1 305 LYS B NZ 1 ATOM 5881 N N . PHE B 1 263 ? -3.825 72.268 117.964 1.00 66.66 ? 306 PHE B N 1 ATOM 5882 C CA . PHE B 1 263 ? -3.413 73.643 118.232 1.00 54.77 ? 306 PHE B CA 1 ATOM 5883 C C . PHE B 1 263 ? -4.359 74.679 117.635 1.00 54.24 ? 306 PHE B C 1 ATOM 5884 O O . PHE B 1 263 ? -4.503 75.768 118.203 1.00 53.75 ? 306 PHE B O 1 ATOM 5885 C CB . PHE B 1 263 ? -1.982 73.872 117.747 1.00 42.00 ? 306 PHE B CB 1 ATOM 5886 C CG . PHE B 1 263 ? -0.943 73.308 118.669 1.00 47.05 ? 306 PHE B CG 1 ATOM 5887 C CD1 . PHE B 1 263 ? -0.537 74.016 119.785 1.00 56.39 ? 306 PHE B CD1 1 ATOM 5888 C CD2 . PHE B 1 263 ? -0.386 72.064 118.434 1.00 60.08 ? 306 PHE B CD2 1 ATOM 5889 C CE1 . PHE B 1 263 ? 0.415 73.502 120.645 1.00 58.13 ? 306 PHE B CE1 1 ATOM 5890 C CE2 . PHE B 1 263 ? 0.568 71.545 119.293 1.00 67.93 ? 306 PHE B CE2 1 ATOM 5891 C CZ . PHE B 1 263 ? 0.967 72.265 120.400 1.00 51.59 ? 306 PHE B CZ 1 ATOM 5892 N N . LEU B 1 264 ? -4.998 74.391 116.502 1.00 49.23 ? 307 LEU B N 1 ATOM 5893 C CA . LEU B 1 264 ? -5.878 75.384 115.898 1.00 50.50 ? 307 LEU B CA 1 ATOM 5894 C C . LEU B 1 264 ? -7.334 75.246 116.321 1.00 58.74 ? 307 LEU B C 1 ATOM 5895 O O . LEU B 1 264 ? -8.125 76.158 116.058 1.00 60.45 ? 307 LEU B O 1 ATOM 5896 C CB . LEU B 1 264 ? -5.776 75.335 114.372 1.00 43.45 ? 307 LEU B CB 1 ATOM 5897 C CG . LEU B 1 264 ? -4.498 75.996 113.856 1.00 39.69 ? 307 LEU B CG 1 ATOM 5898 C CD1 . LEU B 1 264 ? -3.427 74.962 113.529 1.00 49.82 ? 307 LEU B CD1 1 ATOM 5899 C CD2 . LEU B 1 264 ? -4.789 76.898 112.680 1.00 41.21 ? 307 LEU B CD2 1 ATOM 5900 N N . GLY B 1 265 ? -7.706 74.147 116.971 1.00 63.54 ? 308 GLY B N 1 ATOM 5901 C CA . GLY B 1 265 ? -9.030 73.996 117.528 1.00 56.31 ? 308 GLY B CA 1 ATOM 5902 C C . GLY B 1 265 ? -10.159 74.209 116.539 1.00 61.96 ? 308 GLY B C 1 ATOM 5903 O O . GLY B 1 265 ? -10.226 73.578 115.479 1.00 68.02 ? 308 GLY B O 1 ATOM 5904 N N . PRO B 1 266 ? -11.074 75.124 116.876 1.00 72.61 ? 309 PRO B N 1 ATOM 5905 C CA . PRO B 1 266 ? -12.299 75.273 116.073 1.00 70.55 ? 309 PRO B CA 1 ATOM 5906 C C . PRO B 1 266 ? -12.078 75.854 114.686 1.00 75.34 ? 309 PRO B C 1 ATOM 5907 O O . PRO B 1 266 ? -12.971 75.720 113.840 1.00 86.81 ? 309 PRO B O 1 ATOM 5908 C CB . PRO B 1 266 ? -13.167 76.205 116.930 1.00 62.88 ? 309 PRO B CB 1 ATOM 5909 C CG . PRO B 1 266 ? -12.185 76.991 117.737 1.00 53.83 ? 309 PRO B CG 1 ATOM 5910 C CD . PRO B 1 266 ? -11.039 76.053 118.020 1.00 62.57 ? 309 PRO B CD 1 ATOM 5911 N N . VAL B 1 267 ? -10.944 76.496 114.420 1.00 73.50 ? 310 VAL B N 1 ATOM 5912 C CA . VAL B 1 267 ? -10.764 77.111 113.097 1.00 70.22 ? 310 VAL B CA 1 ATOM 5913 C C . VAL B 1 267 ? -10.738 76.021 112.031 1.00 63.11 ? 310 VAL B C 1 ATOM 5914 O O . VAL B 1 267 ? -10.026 75.009 112.191 1.00 63.87 ? 310 VAL B O 1 ATOM 5915 C CB . VAL B 1 267 ? -9.479 77.954 113.056 1.00 58.81 ? 310 VAL B CB 1 ATOM 5916 C CG1 . VAL B 1 267 ? -9.568 79.100 114.051 1.00 46.43 ? 310 VAL B CG1 1 ATOM 5917 C CG2 . VAL B 1 267 ? -8.258 77.088 113.328 1.00 65.08 ? 310 VAL B CG2 1 ATOM 5918 N N . PRO B 1 268 ? -11.481 76.167 110.936 1.00 62.92 ? 311 PRO B N 1 ATOM 5919 C CA . PRO B 1 268 ? -11.518 75.105 109.923 1.00 61.52 ? 311 PRO B CA 1 ATOM 5920 C C . PRO B 1 268 ? -10.215 75.024 109.145 1.00 54.90 ? 311 PRO B C 1 ATOM 5921 O O . PRO B 1 268 ? -9.585 76.038 108.838 1.00 65.40 ? 311 PRO B O 1 ATOM 5922 C CB . PRO B 1 268 ? -12.683 75.519 109.013 1.00 53.87 ? 311 PRO B CB 1 ATOM 5923 C CG . PRO B 1 268 ? -13.443 76.569 109.785 1.00 62.70 ? 311 PRO B CG 1 ATOM 5924 C CD . PRO B 1 268 ? -12.425 77.254 110.635 1.00 60.81 ? 311 PRO B CD 1 ATOM 5925 N N . VAL B 1 269 ? -9.813 73.796 108.833 1.00 45.17 ? 312 VAL B N 1 ATOM 5926 C CA . VAL B 1 269 ? -8.643 73.525 108.008 1.00 45.63 ? 312 VAL B CA 1 ATOM 5927 C C . VAL B 1 269 ? -9.112 72.807 106.753 1.00 52.36 ? 312 VAL B C 1 ATOM 5928 O O . VAL B 1 269 ? -9.721 71.733 106.837 1.00 53.31 ? 312 VAL B O 1 ATOM 5929 C CB . VAL B 1 269 ? -7.590 72.691 108.751 1.00 53.94 ? 312 VAL B CB 1 ATOM 5930 C CG1 . VAL B 1 269 ? -6.420 72.382 107.829 1.00 53.07 ? 312 VAL B CG1 1 ATOM 5931 C CG2 . VAL B 1 269 ? -7.113 73.432 109.986 1.00 66.37 ? 312 VAL B CG2 1 ATOM 5932 N N . TYR B 1 270 ? -8.834 73.397 105.596 1.00 54.71 ? 313 TYR B N 1 ATOM 5933 C CA . TYR B 1 270 ? -9.185 72.766 104.337 1.00 48.35 ? 313 TYR B CA 1 ATOM 5934 C C . TYR B 1 270 ? -7.918 72.203 103.717 1.00 52.98 ? 313 TYR B C 1 ATOM 5935 O O . TYR B 1 270 ? -7.076 72.979 103.238 1.00 53.48 ? 313 TYR B O 1 ATOM 5936 C CB . TYR B 1 270 ? -9.847 73.772 103.401 1.00 38.41 ? 313 TYR B CB 1 ATOM 5937 C CG . TYR B 1 270 ? -11.004 74.494 104.050 1.00 46.89 ? 313 TYR B CG 1 ATOM 5938 C CD1 . TYR B 1 270 ? -12.133 73.802 104.463 1.00 48.33 ? 313 TYR B CD1 1 ATOM 5939 C CD2 . TYR B 1 270 ? -10.965 75.866 104.257 1.00 56.98 ? 313 TYR B CD2 1 ATOM 5940 C CE1 . TYR B 1 270 ? -13.193 74.455 105.062 1.00 57.38 ? 313 TYR B CE1 1 ATOM 5941 C CE2 . TYR B 1 270 ? -12.022 76.529 104.855 1.00 65.14 ? 313 TYR B CE2 1 ATOM 5942 C CZ . TYR B 1 270 ? -13.133 75.818 105.256 1.00 62.78 ? 313 TYR B CZ 1 ATOM 5943 O OH . TYR B 1 270 ? -14.188 76.471 105.854 1.00 57.53 ? 313 TYR B OH 1 ATOM 5944 N N . PRO B 1 271 ? -7.722 70.889 103.713 1.00 57.50 ? 314 PRO B N 1 ATOM 5945 C CA . PRO B 1 271 ? -6.469 70.343 103.184 1.00 47.13 ? 314 PRO B CA 1 ATOM 5946 C C . PRO B 1 271 ? -6.555 70.052 101.700 1.00 47.25 ? 314 PRO B C 1 ATOM 5947 O O . PRO B 1 271 ? -7.611 70.208 101.079 1.00 47.31 ? 314 PRO B O 1 ATOM 5948 C CB . PRO B 1 271 ? -6.274 69.049 103.994 1.00 53.22 ? 314 PRO B CB 1 ATOM 5949 C CG . PRO B 1 271 ? -7.391 69.032 105.033 1.00 48.16 ? 314 PRO B CG 1 ATOM 5950 C CD . PRO B 1 271 ? -8.482 69.874 104.457 1.00 56.02 ? 314 PRO B CD 1 ATOM 5951 N N . ALA B 1 272 ? -5.432 69.628 101.129 1.00 47.84 ? 315 ALA B N 1 ATOM 5952 C CA . ALA B 1 272 ? -5.360 69.161 99.754 1.00 56.35 ? 315 ALA B CA 1 ATOM 5953 C C . ALA B 1 272 ? -4.386 67.995 99.719 1.00 55.91 ? 315 ALA B C 1 ATOM 5954 O O . ALA B 1 272 ? -3.630 67.767 100.667 1.00 48.80 ? 315 ALA B O 1 ATOM 5955 C CB . ALA B 1 272 ? -4.933 70.276 98.789 1.00 35.26 ? 315 ALA B CB 1 ATOM 5956 N N . VAL B 1 273 ? -4.410 67.240 98.626 1.00 51.40 ? 316 VAL B N 1 ATOM 5957 C CA . VAL B 1 273 ? -3.598 66.035 98.509 1.00 40.50 ? 316 VAL B CA 1 ATOM 5958 C C . VAL B 1 273 ? -2.305 66.393 97.791 1.00 41.01 ? 316 VAL B C 1 ATOM 5959 O O . VAL B 1 273 ? -2.322 66.817 96.628 1.00 51.28 ? 316 VAL B O 1 ATOM 5960 C CB . VAL B 1 273 ? -4.355 64.919 97.778 1.00 47.65 ? 316 VAL B CB 1 ATOM 5961 C CG1 . VAL B 1 273 ? -3.549 63.630 97.816 1.00 43.63 ? 316 VAL B CG1 1 ATOM 5962 C CG2 . VAL B 1 273 ? -5.727 64.726 98.400 1.00 45.49 ? 316 VAL B CG2 1 ATOM 5963 N N . GLY B 1 274 ? -1.180 66.222 98.490 1.00 45.06 ? 317 GLY B N 1 ATOM 5964 C CA . GLY B 1 274 ? 0.127 66.478 97.925 1.00 49.68 ? 317 GLY B CA 1 ATOM 5965 C C . GLY B 1 274 ? 0.678 65.283 97.170 1.00 45.65 ? 317 GLY B C 1 ATOM 5966 O O . GLY B 1 274 ? 0.025 64.252 97.007 1.00 36.77 ? 317 GLY B O 1 ATOM 5967 N N . ASN B 1 275 ? 1.918 65.432 96.703 1.00 52.09 ? 318 ASN B N 1 ATOM 5968 C CA . ASN B 1 275 ? 2.525 64.374 95.910 1.00 50.13 ? 318 ASN B CA 1 ATOM 5969 C C . ASN B 1 275 ? 3.243 63.335 96.762 1.00 65.60 ? 318 ASN B C 1 ATOM 5970 O O . ASN B 1 275 ? 3.525 62.240 96.259 1.00 60.97 ? 318 ASN B O 1 ATOM 5971 C CB . ASN B 1 275 ? 3.468 64.972 94.852 1.00 38.59 ? 318 ASN B CB 1 ATOM 5972 C CG . ASN B 1 275 ? 4.753 65.558 95.440 1.00 62.28 ? 318 ASN B CG 1 ATOM 5973 O OD1 . ASN B 1 275 ? 4.752 66.612 96.116 1.00 57.71 ? 318 ASN B OD1 1 ATOM 5974 N ND2 . ASN B 1 275 ? 5.871 64.900 95.141 1.00 47.57 ? 318 ASN B ND2 1 ATOM 5975 N N . HIS B 1 276 ? 3.396 63.603 98.039 1.00 64.42 ? 319 HIS B N 1 ATOM 5976 C CA . HIS B 1 276 ? 3.938 62.622 98.916 1.00 49.51 ? 319 HIS B CA 1 ATOM 5977 C C . HIS B 1 276 ? 2.837 62.274 99.890 1.00 53.17 ? 319 HIS B C 1 ATOM 5978 O O . HIS B 1 276 ? 2.692 62.893 100.895 1.00 82.27 ? 319 HIS B O 1 ATOM 5979 C CB . HIS B 1 276 ? 5.098 63.167 99.697 1.00 47.14 ? 319 HIS B CB 1 ATOM 5980 C CG . HIS B 1 276 ? 6.331 63.382 98.901 1.00 45.48 ? 319 HIS B CG 1 ATOM 5981 N ND1 . HIS B 1 276 ? 7.545 62.882 99.289 1.00 50.32 ? 319 HIS B ND1 1 ATOM 5982 C CD2 . HIS B 1 276 ? 6.556 64.065 97.765 1.00 46.30 ? 319 HIS B CD2 1 ATOM 5983 C CE1 . HIS B 1 276 ? 8.467 63.244 98.426 1.00 49.29 ? 319 HIS B CE1 1 ATOM 5984 N NE2 . HIS B 1 276 ? 7.891 63.961 97.489 1.00 51.79 ? 319 HIS B NE2 1 ATOM 5985 N N . GLU B 1 277 ? 2.026 61.302 99.577 1.00 55.28 ? 320 GLU B N 1 ATOM 5986 C CA . GLU B 1 277 ? 0.999 60.803 100.484 1.00 60.76 ? 320 GLU B CA 1 ATOM 5987 C C . GLU B 1 277 ? 0.932 59.298 100.308 1.00 67.55 ? 320 GLU B C 1 ATOM 5988 O O . GLU B 1 277 ? 1.220 58.521 101.225 1.00 67.14 ? 320 GLU B O 1 ATOM 5989 C CB . GLU B 1 277 ? -0.369 61.446 100.234 1.00 50.84 ? 320 GLU B CB 1 ATOM 5990 C CG . GLU B 1 277 ? -0.732 62.576 101.201 1.00 59.34 ? 320 GLU B CG 1 ATOM 5991 C CD . GLU B 1 277 ? 0.004 63.878 100.921 1.00 65.15 ? 320 GLU B CD 1 ATOM 5992 O OE1 . GLU B 1 277 ? 0.612 63.999 99.838 1.00 80.99 ? 320 GLU B OE1 1 ATOM 5993 O OE2 . GLU B 1 277 ? -0.031 64.787 101.780 1.00 48.26 -1 320 GLU B OE2 1 ATOM 5994 N N . SER B 1 278 ? 0.547 58.901 99.101 1.00 63.00 ? 321 SER B N 1 ATOM 5995 C CA . SER B 1 278 ? 0.476 57.506 98.723 1.00 71.07 ? 321 SER B CA 1 ATOM 5996 C C . SER B 1 278 ? 1.883 56.944 98.581 1.00 66.14 ? 321 SER B C 1 ATOM 5997 O O . SER B 1 278 ? 2.867 57.678 98.451 1.00 67.38 ? 321 SER B O 1 ATOM 5998 C CB . SER B 1 278 ? -0.292 57.347 97.409 1.00 69.53 ? 321 SER B CB 1 ATOM 5999 O OG . SER B 1 278 ? -0.190 56.027 96.900 1.00 65.48 ? 321 SER B OG 1 ATOM 6000 N N . THR B 1 279 ? 1.976 55.626 98.628 1.00 60.24 ? 322 THR B N 1 ATOM 6001 C CA . THR B 1 279 ? 3.235 54.973 98.343 1.00 56.07 ? 322 THR B CA 1 ATOM 6002 C C . THR B 1 279 ? 2.983 53.922 97.270 1.00 53.58 ? 322 THR B C 1 ATOM 6003 O O . THR B 1 279 ? 1.939 53.271 97.267 1.00 49.06 ? 322 THR B O 1 ATOM 6004 C CB . THR B 1 279 ? 3.848 54.347 99.614 1.00 59.08 ? 322 THR B CB 1 ATOM 6005 O OG1 . THR B 1 279 ? 5.079 53.691 99.289 1.00 67.63 ? 322 THR B OG1 1 ATOM 6006 C CG2 . THR B 1 279 ? 2.883 53.351 100.245 1.00 46.78 ? 322 THR B CG2 1 ATOM 6007 N N . PRO B 1 280 ? 3.922 53.789 96.324 1.00 49.27 ? 323 PRO B N 1 ATOM 6008 C CA . PRO B 1 280 ? 5.137 54.609 96.251 1.00 53.62 ? 323 PRO B CA 1 ATOM 6009 C C . PRO B 1 280 ? 4.825 56.079 95.977 1.00 62.15 ? 323 PRO B C 1 ATOM 6010 O O . PRO B 1 280 ? 3.706 56.405 95.575 1.00 64.36 ? 323 PRO B O 1 ATOM 6011 C CB . PRO B 1 280 ? 5.915 53.990 95.082 1.00 56.32 ? 323 PRO B CB 1 ATOM 6012 C CG . PRO B 1 280 ? 5.303 52.642 94.865 1.00 59.33 ? 323 PRO B CG 1 ATOM 6013 C CD . PRO B 1 280 ? 3.869 52.789 95.247 1.00 49.67 ? 323 PRO B CD 1 ATOM 6014 N N . VAL B 1 281 ? 5.806 56.954 96.209 1.00 62.62 ? 324 VAL B N 1 ATOM 6015 C CA . VAL B 1 281 ? 5.597 58.382 96.001 1.00 64.45 ? 324 VAL B CA 1 ATOM 6016 C C . VAL B 1 281 ? 5.116 58.634 94.581 1.00 62.35 ? 324 VAL B C 1 ATOM 6017 O O . VAL B 1 281 ? 5.655 58.080 93.614 1.00 55.61 ? 324 VAL B O 1 ATOM 6018 C CB . VAL B 1 281 ? 6.885 59.164 96.291 1.00 60.47 ? 324 VAL B CB 1 ATOM 6019 C CG1 . VAL B 1 281 ? 7.953 58.817 95.265 1.00 56.02 ? 324 VAL B CG1 1 ATOM 6020 C CG2 . VAL B 1 281 ? 6.598 60.655 96.270 1.00 43.69 ? 324 VAL B CG2 1 ATOM 6021 N N . ASN B 1 282 ? 4.095 59.477 94.451 1.00 61.78 ? 325 ASN B N 1 ATOM 6022 C CA . ASN B 1 282 ? 3.531 59.927 93.185 1.00 56.09 ? 325 ASN B CA 1 ATOM 6023 C C . ASN B 1 282 ? 2.501 58.959 92.614 1.00 60.98 ? 325 ASN B C 1 ATOM 6024 O O . ASN B 1 282 ? 1.949 59.244 91.544 1.00 60.07 ? 325 ASN B O 1 ATOM 6025 C CB . ASN B 1 282 ? 4.606 60.189 92.118 1.00 46.45 ? 325 ASN B CB 1 ATOM 6026 C CG . ASN B 1 282 ? 5.383 61.468 92.375 1.00 52.70 ? 325 ASN B CG 1 ATOM 6027 O OD1 . ASN B 1 282 ? 4.836 62.567 92.276 1.00 57.11 ? 325 ASN B OD1 1 ATOM 6028 N ND2 . ASN B 1 282 ? 6.661 61.330 92.711 1.00 42.18 ? 325 ASN B ND2 1 ATOM 6029 N N . SER B 1 283 ? 2.212 57.839 93.269 1.00 52.45 ? 326 SER B N 1 ATOM 6030 C CA . SER B 1 283 ? 1.289 56.857 92.712 1.00 54.33 ? 326 SER B CA 1 ATOM 6031 C C . SER B 1 283 ? -0.126 57.207 93.157 1.00 43.38 ? 326 SER B C 1 ATOM 6032 O O . SER B 1 283 ? -0.488 57.018 94.323 1.00 36.82 ? 326 SER B O 1 ATOM 6033 C CB . SER B 1 283 ? 1.670 55.447 93.157 1.00 64.36 ? 326 SER B CB 1 ATOM 6034 O OG . SER B 1 283 ? 0.550 54.578 93.138 1.00 59.84 ? 326 SER B OG 1 ATOM 6035 N N . PHE B 1 284 ? -0.933 57.682 92.212 1.00 45.48 ? 327 PHE B N 1 ATOM 6036 C CA . PHE B 1 284 ? -2.315 58.086 92.473 1.00 53.99 ? 327 PHE B CA 1 ATOM 6037 C C . PHE B 1 284 ? -3.177 57.562 91.340 1.00 67.16 ? 327 PHE B C 1 ATOM 6038 O O . PHE B 1 284 ? -3.543 58.299 90.417 1.00 68.54 ? 327 PHE B O 1 ATOM 6039 C CB . PHE B 1 284 ? -2.433 59.606 92.603 1.00 45.86 ? 327 PHE B CB 1 ATOM 6040 C CG . PHE B 1 284 ? -1.793 60.152 93.841 1.00 46.45 ? 327 PHE B CG 1 ATOM 6041 C CD1 . PHE B 1 284 ? -0.442 60.456 93.858 1.00 46.19 ? 327 PHE B CD1 1 ATOM 6042 C CD2 . PHE B 1 284 ? -2.537 60.356 94.990 1.00 44.29 ? 327 PHE B CD2 1 ATOM 6043 C CE1 . PHE B 1 284 ? 0.157 60.952 94.998 1.00 44.89 ? 327 PHE B CE1 1 ATOM 6044 C CE2 . PHE B 1 284 ? -1.945 60.850 96.131 1.00 49.47 ? 327 PHE B CE2 1 ATOM 6045 C CZ . PHE B 1 284 ? -0.594 61.150 96.135 1.00 55.24 ? 327 PHE B CZ 1 ATOM 6046 N N . PRO B 1 285 ? -3.517 56.279 91.372 1.00 72.51 ? 328 PRO B N 1 ATOM 6047 C CA . PRO B 1 285 ? -4.383 55.709 90.340 1.00 66.81 ? 328 PRO B CA 1 ATOM 6048 C C . PRO B 1 285 ? -5.721 56.423 90.299 1.00 62.27 ? 328 PRO B C 1 ATOM 6049 O O . PRO B 1 285 ? -6.328 56.685 91.349 1.00 64.58 ? 328 PRO B O 1 ATOM 6050 C CB . PRO B 1 285 ? -4.544 54.247 90.785 1.00 72.59 ? 328 PRO B CB 1 ATOM 6051 C CG . PRO B 1 285 ? -4.240 54.263 92.251 1.00 59.73 ? 328 PRO B CG 1 ATOM 6052 C CD . PRO B 1 285 ? -3.169 55.293 92.407 1.00 58.11 ? 328 PRO B CD 1 ATOM 6053 N N . PRO B 1 286 ? -6.209 56.769 89.112 1.00 60.28 ? 329 PRO B N 1 ATOM 6054 C CA . PRO B 1 286 ? -7.518 57.414 89.014 1.00 56.62 ? 329 PRO B CA 1 ATOM 6055 C C . PRO B 1 286 ? -8.601 56.478 89.513 1.00 53.59 ? 329 PRO B C 1 ATOM 6056 O O . PRO B 1 286 ? -8.321 55.320 89.853 1.00 68.34 ? 329 PRO B O 1 ATOM 6057 C CB . PRO B 1 286 ? -7.669 57.687 87.509 1.00 50.93 ? 329 PRO B CB 1 ATOM 6058 C CG . PRO B 1 286 ? -6.268 57.701 86.984 1.00 55.78 ? 329 PRO B CG 1 ATOM 6059 C CD . PRO B 1 286 ? -5.526 56.691 87.810 1.00 55.73 ? 329 PRO B CD 1 ATOM 6060 N N . PRO B 1 287 ? -9.852 56.933 89.568 1.00 58.85 ? 330 PRO B N 1 ATOM 6061 C CA . PRO B 1 287 ? -10.920 56.055 90.067 1.00 68.37 ? 330 PRO B CA 1 ATOM 6062 C C . PRO B 1 287 ? -11.164 54.829 89.199 1.00 74.53 ? 330 PRO B C 1 ATOM 6063 O O . PRO B 1 287 ? -11.772 53.865 89.683 1.00 72.49 ? 330 PRO B O 1 ATOM 6064 C CB . PRO B 1 287 ? -12.146 56.978 90.104 1.00 59.30 ? 330 PRO B CB 1 ATOM 6065 C CG . PRO B 1 287 ? -11.576 58.348 90.227 1.00 57.16 ? 330 PRO B CG 1 ATOM 6066 C CD . PRO B 1 287 ? -10.309 58.324 89.416 1.00 71.62 ? 330 PRO B CD 1 ATOM 6067 N N . PHE B 1 288 ? -10.715 54.819 87.940 1.00 70.61 ? 331 PHE B N 1 ATOM 6068 C CA . PHE B 1 288 ? -10.957 53.634 87.125 1.00 76.23 ? 331 PHE B CA 1 ATOM 6069 C C . PHE B 1 288 ? -10.058 52.468 87.517 1.00 75.81 ? 331 PHE B C 1 ATOM 6070 O O . PHE B 1 288 ? -10.255 51.359 87.010 1.00 83.68 ? 331 PHE B O 1 ATOM 6071 C CB . PHE B 1 288 ? -10.812 53.951 85.627 1.00 60.82 ? 331 PHE B CB 1 ATOM 6072 C CG . PHE B 1 288 ? -9.397 54.184 85.165 1.00 59.59 ? 331 PHE B CG 1 ATOM 6073 C CD1 . PHE B 1 288 ? -8.575 53.117 84.832 1.00 69.41 ? 331 PHE B CD1 1 ATOM 6074 C CD2 . PHE B 1 288 ? -8.907 55.469 85.011 1.00 53.38 ? 331 PHE B CD2 1 ATOM 6075 C CE1 . PHE B 1 288 ? -7.281 53.328 84.387 1.00 64.73 ? 331 PHE B CE1 1 ATOM 6076 C CE2 . PHE B 1 288 ? -7.613 55.687 84.563 1.00 61.09 ? 331 PHE B CE2 1 ATOM 6077 C CZ . PHE B 1 288 ? -6.801 54.615 84.251 1.00 65.21 ? 331 PHE B CZ 1 ATOM 6078 N N . ILE B 1 289 ? -9.085 52.691 88.398 1.00 67.31 ? 332 ILE B N 1 ATOM 6079 C CA . ILE B 1 289 ? -8.324 51.613 89.018 1.00 71.04 ? 332 ILE B CA 1 ATOM 6080 C C . ILE B 1 289 ? -8.993 51.270 90.342 1.00 65.01 ? 332 ILE B C 1 ATOM 6081 O O . ILE B 1 289 ? -9.311 52.164 91.135 1.00 78.18 ? 332 ILE B O 1 ATOM 6082 C CB . ILE B 1 289 ? -6.857 52.022 89.228 1.00 69.30 ? 332 ILE B CB 1 ATOM 6083 C CG1 . ILE B 1 289 ? -6.241 52.502 87.911 1.00 63.98 ? 332 ILE B CG1 1 ATOM 6084 C CG2 . ILE B 1 289 ? -6.060 50.867 89.814 1.00 57.01 ? 332 ILE B CG2 1 ATOM 6085 C CD1 . ILE B 1 289 ? -6.178 51.438 86.838 1.00 75.05 ? 332 ILE B CD1 1 ATOM 6086 N N . GLU B 1 290 ? -9.211 49.981 90.587 1.00 82.36 ? 333 GLU B N 1 ATOM 6087 C CA . GLU B 1 290 ? -9.929 49.532 91.770 1.00 90.84 ? 333 GLU B CA 1 ATOM 6088 C C . GLU B 1 290 ? -9.022 48.714 92.679 1.00 85.59 ? 333 GLU B C 1 ATOM 6089 O O . GLU B 1 290 ? -8.092 48.045 92.219 1.00 83.29 ? 333 GLU B O 1 ATOM 6090 C CB . GLU B 1 290 ? -11.168 48.714 91.385 1.00 87.34 ? 333 GLU B CB 1 ATOM 6091 C CG . GLU B 1 290 ? -12.158 49.491 90.529 1.00 96.81 ? 333 GLU B CG 1 ATOM 6092 C CD . GLU B 1 290 ? -13.510 48.813 90.423 1.00 106.75 ? 333 GLU B CD 1 ATOM 6093 O OE1 . GLU B 1 290 ? -13.550 47.568 90.314 1.00 92.66 ? 333 GLU B OE1 1 ATOM 6094 O OE2 . GLU B 1 290 ? -14.533 49.530 90.453 1.00 96.12 -1 333 GLU B OE2 1 ATOM 6095 N N . GLY B 1 291 ? -9.317 48.764 93.978 1.00 83.21 ? 334 GLY B N 1 ATOM 6096 C CA . GLY B 1 291 ? -8.457 48.182 94.994 1.00 70.54 ? 334 GLY B CA 1 ATOM 6097 C C . GLY B 1 291 ? -8.258 46.706 94.730 1.00 93.38 ? 334 GLY B C 1 ATOM 6098 O O . GLY B 1 291 ? -8.977 46.129 93.913 1.00 115.80 ? 334 GLY B O 1 ATOM 6099 N N . ASN B 1 292 ? -7.305 46.076 95.410 1.00 101.18 ? 335 ASN B N 1 ATOM 6100 C CA . ASN B 1 292 ? -6.567 46.647 96.537 1.00 86.65 ? 335 ASN B CA 1 ATOM 6101 C C . ASN B 1 292 ? -5.588 47.767 96.173 1.00 69.67 ? 335 ASN B C 1 ATOM 6102 O O . ASN B 1 292 ? -5.442 48.737 96.915 1.00 71.55 ? 335 ASN B O 1 ATOM 6103 C CB . ASN B 1 292 ? -5.810 45.513 97.239 1.00 86.97 ? 335 ASN B CB 1 ATOM 6104 C CG . ASN B 1 292 ? -4.904 46.000 98.350 1.00 81.02 ? 335 ASN B CG 1 ATOM 6105 O OD1 . ASN B 1 292 ? -5.285 46.843 99.165 1.00 73.96 ? 335 ASN B OD1 1 ATOM 6106 N ND2 . ASN B 1 292 ? -3.683 45.465 98.381 1.00 84.39 ? 335 ASN B ND2 1 ATOM 6107 N N . HIS B 1 293 ? -4.928 47.635 95.024 1.00 65.55 ? 336 HIS B N 1 ATOM 6108 C CA . HIS B 1 293 ? -3.824 48.518 94.658 1.00 67.53 ? 336 HIS B CA 1 ATOM 6109 C C . HIS B 1 293 ? -4.267 49.942 94.330 1.00 70.21 ? 336 HIS B C 1 ATOM 6110 O O . HIS B 1 293 ? -3.408 50.771 94.002 1.00 45.95 ? 336 HIS B O 1 ATOM 6111 C CB . HIS B 1 293 ? -3.036 47.921 93.488 1.00 82.50 ? 336 HIS B CB 1 ATOM 6112 C CG . HIS B 1 293 ? -3.888 47.471 92.342 1.00 94.14 ? 336 HIS B CG 1 ATOM 6113 N ND1 . HIS B 1 293 ? -4.261 48.311 91.315 1.00 77.71 ? 336 HIS B ND1 1 ATOM 6114 C CD2 . HIS B 1 293 ? -4.435 46.265 92.059 1.00 95.41 ? 336 HIS B CD2 1 ATOM 6115 C CE1 . HIS B 1 293 ? -5.004 47.643 90.450 1.00 63.66 ? 336 HIS B CE1 1 ATOM 6116 N NE2 . HIS B 1 293 ? -5.125 46.399 90.878 1.00 90.05 ? 336 HIS B NE2 1 ATOM 6117 N N . SER B 1 294 ? -5.563 50.244 94.382 1.00 57.42 ? 337 SER B N 1 ATOM 6118 C CA . SER B 1 294 ? -6.025 51.606 94.153 1.00 63.96 ? 337 SER B CA 1 ATOM 6119 C C . SER B 1 294 ? -5.635 52.512 95.322 1.00 60.64 ? 337 SER B C 1 ATOM 6120 O O . SER B 1 294 ? -5.005 52.091 96.296 1.00 74.93 ? 337 SER B O 1 ATOM 6121 C CB . SER B 1 294 ? -7.539 51.627 93.960 1.00 63.81 ? 337 SER B CB 1 ATOM 6122 O OG . SER B 1 294 ? -8.201 51.520 95.208 1.00 55.59 ? 337 SER B OG 1 ATOM 6123 N N . SER B 1 295 ? -6.016 53.784 95.212 1.00 63.97 ? 338 SER B N 1 ATOM 6124 C CA . SER B 1 295 ? -5.773 54.783 96.245 1.00 73.61 ? 338 SER B CA 1 ATOM 6125 C C . SER B 1 295 ? -6.939 54.931 97.217 1.00 69.75 ? 338 SER B C 1 ATOM 6126 O O . SER B 1 295 ? -6.904 55.822 98.072 1.00 64.30 ? 338 SER B O 1 ATOM 6127 C CB . SER B 1 295 ? -5.450 56.138 95.609 1.00 71.27 ? 338 SER B CB 1 ATOM 6128 O OG . SER B 1 295 ? -4.066 56.242 95.322 1.00 75.63 ? 338 SER B OG 1 ATOM 6129 N N . ARG B 1 296 ? -7.973 54.095 97.096 1.00 69.71 ? 339 ARG B N 1 ATOM 6130 C CA . ARG B 1 296 ? -9.136 54.225 97.970 1.00 72.52 ? 339 ARG B CA 1 ATOM 6131 C C . ARG B 1 296 ? -8.751 54.148 99.445 1.00 73.22 ? 339 ARG B C 1 ATOM 6132 O O . ARG B 1 296 ? -9.395 54.787 100.285 1.00 63.97 ? 339 ARG B O 1 ATOM 6133 C CB . ARG B 1 296 ? -10.170 53.153 97.619 1.00 76.44 ? 339 ARG B CB 1 ATOM 6134 C CG . ARG B 1 296 ? -11.459 53.218 98.426 1.00 76.80 ? 339 ARG B CG 1 ATOM 6135 C CD . ARG B 1 296 ? -11.473 52.156 99.512 1.00 79.96 ? 339 ARG B CD 1 ATOM 6136 N NE . ARG B 1 296 ? -11.183 50.830 98.971 1.00 87.39 ? 339 ARG B NE 1 ATOM 6137 C CZ . ARG B 1 296 ? -10.999 49.742 99.712 1.00 106.36 ? 339 ARG B CZ 1 ATOM 6138 N NH1 . ARG B 1 296 ? -11.073 49.818 101.037 1.00 97.57 1 339 ARG B NH1 1 ATOM 6139 N NH2 . ARG B 1 296 ? -10.738 48.578 99.128 1.00 77.01 ? 339 ARG B NH2 1 ATOM 6140 N N . TRP B 1 297 ? -7.707 53.384 99.781 1.00 54.26 ? 340 TRP B N 1 ATOM 6141 C CA . TRP B 1 297 ? -7.261 53.315 101.170 1.00 46.80 ? 340 TRP B CA 1 ATOM 6142 C C . TRP B 1 297 ? -6.883 54.695 101.692 1.00 68.64 ? 340 TRP B C 1 ATOM 6143 O O . TRP B 1 297 ? -7.252 55.075 102.809 1.00 69.08 ? 340 TRP B O 1 ATOM 6144 C CB . TRP B 1 297 ? -6.080 52.353 101.303 1.00 51.99 ? 340 TRP B CB 1 ATOM 6145 C CG . TRP B 1 297 ? -4.873 52.779 100.529 1.00 53.54 ? 340 TRP B CG 1 ATOM 6146 C CD1 . TRP B 1 297 ? -4.623 52.544 99.211 1.00 58.14 ? 340 TRP B CD1 1 ATOM 6147 C CD2 . TRP B 1 297 ? -3.755 53.530 101.022 1.00 56.76 ? 340 TRP B CD2 1 ATOM 6148 N NE1 . TRP B 1 297 ? -3.417 53.096 98.850 1.00 62.17 ? 340 TRP B NE1 1 ATOM 6149 C CE2 . TRP B 1 297 ? -2.864 53.708 99.944 1.00 56.46 ? 340 TRP B CE2 1 ATOM 6150 C CE3 . TRP B 1 297 ? -3.422 54.071 102.267 1.00 52.22 ? 340 TRP B CE3 1 ATOM 6151 C CZ2 . TRP B 1 297 ? -1.660 54.401 100.074 1.00 55.09 ? 340 TRP B CZ2 1 ATOM 6152 C CZ3 . TRP B 1 297 ? -2.224 54.759 102.395 1.00 52.37 ? 340 TRP B CZ3 1 ATOM 6153 C CH2 . TRP B 1 297 ? -1.359 54.919 101.304 1.00 49.07 ? 340 TRP B CH2 1 ATOM 6154 N N . LEU B 1 298 ? -6.130 55.457 100.896 1.00 73.10 ? 341 LEU B N 1 ATOM 6155 C CA . LEU B 1 298 ? -5.692 56.778 101.329 1.00 64.40 ? 341 LEU B CA 1 ATOM 6156 C C . LEU B 1 298 ? -6.860 57.754 101.379 1.00 59.74 ? 341 LEU B C 1 ATOM 6157 O O . LEU B 1 298 ? -6.999 58.517 102.343 1.00 59.18 ? 341 LEU B O 1 ATOM 6158 C CB . LEU B 1 298 ? -4.590 57.293 100.401 1.00 53.16 ? 341 LEU B CB 1 ATOM 6159 C CG . LEU B 1 298 ? -3.898 58.602 100.789 1.00 55.54 ? 341 LEU B CG 1 ATOM 6160 C CD1 . LEU B 1 298 ? -3.243 58.468 102.150 1.00 65.56 ? 341 LEU B CD1 1 ATOM 6161 C CD2 . LEU B 1 298 ? -2.870 58.999 99.741 1.00 64.23 ? 341 LEU B CD2 1 ATOM 6162 N N . TYR B 1 299 ? -7.715 57.741 100.355 1.00 48.25 ? 342 TYR B N 1 ATOM 6163 C CA . TYR B 1 299 ? -8.821 58.691 100.319 1.00 50.23 ? 342 TYR B CA 1 ATOM 6164 C C . TYR B 1 299 ? -9.825 58.428 101.434 1.00 53.73 ? 342 TYR B C 1 ATOM 6165 O O . TYR B 1 299 ? -10.398 59.376 101.983 1.00 58.03 ? 342 TYR B O 1 ATOM 6166 C CB . TYR B 1 299 ? -9.507 58.641 98.952 1.00 49.29 ? 342 TYR B CB 1 ATOM 6167 C CG . TYR B 1 299 ? -8.598 59.035 97.805 1.00 60.17 ? 342 TYR B CG 1 ATOM 6168 C CD1 . TYR B 1 299 ? -7.387 59.675 98.043 1.00 61.24 ? 342 TYR B CD1 1 ATOM 6169 C CD2 . TYR B 1 299 ? -8.943 58.760 96.488 1.00 58.10 ? 342 TYR B CD2 1 ATOM 6170 C CE1 . TYR B 1 299 ? -6.549 60.035 97.006 1.00 43.86 ? 342 TYR B CE1 1 ATOM 6171 C CE2 . TYR B 1 299 ? -8.108 59.116 95.443 1.00 67.04 ? 342 TYR B CE2 1 ATOM 6172 C CZ . TYR B 1 299 ? -6.912 59.754 95.710 1.00 63.58 ? 342 TYR B CZ 1 ATOM 6173 O OH . TYR B 1 299 ? -6.074 60.111 94.677 1.00 76.09 ? 342 TYR B OH 1 ATOM 6174 N N . GLU B 1 300 ? -10.039 57.163 101.797 1.00 63.30 ? 343 GLU B N 1 ATOM 6175 C CA . GLU B 1 300 ? -10.942 56.854 102.899 1.00 67.28 ? 343 GLU B CA 1 ATOM 6176 C C . GLU B 1 300 ? -10.271 56.988 104.261 1.00 58.48 ? 343 GLU B C 1 ATOM 6177 O O . GLU B 1 300 ? -10.967 57.206 105.258 1.00 57.90 ? 343 GLU B O 1 ATOM 6178 C CB . GLU B 1 300 ? -11.527 55.453 102.710 1.00 66.92 ? 343 GLU B CB 1 ATOM 6179 C CG . GLU B 1 300 ? -12.651 55.426 101.677 1.00 77.24 ? 343 GLU B CG 1 ATOM 6180 C CD . GLU B 1 300 ? -13.276 54.055 101.495 1.00 102.07 ? 343 GLU B CD 1 ATOM 6181 O OE1 . GLU B 1 300 ? -12.831 53.096 102.162 1.00 89.16 ? 343 GLU B OE1 1 ATOM 6182 O OE2 . GLU B 1 300 ? -14.213 53.938 100.674 1.00 105.68 -1 343 GLU B OE2 1 ATOM 6183 N N . ALA B 1 301 ? -8.941 56.889 104.327 1.00 57.88 ? 344 ALA B N 1 ATOM 6184 C CA . ALA B 1 301 ? -8.251 57.261 105.557 1.00 48.12 ? 344 ALA B CA 1 ATOM 6185 C C . ALA B 1 301 ? -8.394 58.755 105.811 1.00 61.44 ? 344 ALA B C 1 ATOM 6186 O O . ALA B 1 301 ? -8.674 59.178 106.939 1.00 69.21 ? 344 ALA B O 1 ATOM 6187 C CB . ALA B 1 301 ? -6.780 56.856 105.490 1.00 51.81 ? 344 ALA B CB 1 ATOM 6188 N N . MET B 1 302 ? -8.209 59.567 104.771 1.00 63.82 ? 345 MET B N 1 ATOM 6189 C CA . MET B 1 302 ? -8.716 60.928 104.806 1.00 63.79 ? 345 MET B CA 1 ATOM 6190 C C . MET B 1 302 ? -10.240 60.890 104.874 1.00 64.71 ? 345 MET B C 1 ATOM 6191 O O . MET B 1 302 ? -10.881 59.893 104.528 1.00 67.24 ? 345 MET B O 1 ATOM 6192 C CB . MET B 1 302 ? -8.260 61.723 103.580 1.00 64.54 ? 345 MET B CB 1 ATOM 6193 C CG . MET B 1 302 ? -6.766 61.668 103.282 1.00 61.00 ? 345 MET B CG 1 ATOM 6194 S SD . MET B 1 302 ? -6.382 62.300 101.627 1.00 60.61 ? 345 MET B SD 1 ATOM 6195 C CE . MET B 1 302 ? -4.608 62.055 101.555 1.00 36.75 ? 345 MET B CE 1 ATOM 6196 N N . ALA B 1 303 ? -10.819 61.982 105.364 1.00 68.80 ? 346 ALA B N 1 ATOM 6197 C CA . ALA B 1 303 ? -12.260 62.077 105.562 1.00 78.90 ? 346 ALA B CA 1 ATOM 6198 C C . ALA B 1 303 ? -12.652 61.258 106.783 1.00 74.12 ? 346 ALA B C 1 ATOM 6199 O O . ALA B 1 303 ? -13.724 61.460 107.362 1.00 81.83 ? 346 ALA B O 1 ATOM 6200 C CB . ALA B 1 303 ? -13.024 61.602 104.323 1.00 62.90 ? 346 ALA B CB 1 ATOM 6201 N N . LYS B 1 304 ? -11.778 60.332 107.181 1.00 74.94 ? 347 LYS B N 1 ATOM 6202 C CA . LYS B 1 304 ? -11.802 59.809 108.538 1.00 75.30 ? 347 LYS B CA 1 ATOM 6203 C C . LYS B 1 304 ? -11.050 60.744 109.474 1.00 67.45 ? 347 LYS B C 1 ATOM 6204 O O . LYS B 1 304 ? -11.525 61.047 110.574 1.00 82.22 ? 347 LYS B O 1 ATOM 6205 C CB . LYS B 1 304 ? -11.197 58.403 108.566 1.00 78.14 ? 347 LYS B CB 1 ATOM 6206 C CG . LYS B 1 304 ? -11.351 57.659 109.885 1.00 86.98 ? 347 LYS B CG 1 ATOM 6207 C CD . LYS B 1 304 ? -12.759 57.104 110.048 1.00 101.21 ? 347 LYS B CD 1 ATOM 6208 C CE . LYS B 1 304 ? -12.889 56.274 111.322 1.00 104.07 ? 347 LYS B CE 1 ATOM 6209 N NZ . LYS B 1 304 ? -12.689 57.088 112.556 1.00 83.46 1 347 LYS B NZ 1 ATOM 6210 N N . ALA B 1 305 ? -9.886 61.231 109.033 1.00 69.31 ? 348 ALA B N 1 ATOM 6211 C CA . ALA B 1 305 ? -9.123 62.209 109.799 1.00 67.80 ? 348 ALA B CA 1 ATOM 6212 C C . ALA B 1 305 ? -9.659 63.624 109.623 1.00 73.34 ? 348 ALA B C 1 ATOM 6213 O O . ALA B 1 305 ? -9.607 64.423 110.564 1.00 82.95 ? 348 ALA B O 1 ATOM 6214 C CB . ALA B 1 305 ? -7.649 62.156 109.397 1.00 56.44 ? 348 ALA B CB 1 ATOM 6215 N N . TRP B 1 306 ? -10.157 63.956 108.434 1.00 61.91 ? 349 TRP B N 1 ATOM 6216 C CA . TRP B 1 306 ? -10.624 65.300 108.125 1.00 65.58 ? 349 TRP B CA 1 ATOM 6217 C C . TRP B 1 306 ? -12.126 65.467 108.309 1.00 68.72 ? 349 TRP B C 1 ATOM 6218 O O . TRP B 1 306 ? -12.666 66.525 107.969 1.00 75.18 ? 349 TRP B O 1 ATOM 6219 C CB . TRP B 1 306 ? -10.211 65.682 106.702 1.00 56.90 ? 349 TRP B CB 1 ATOM 6220 C CG . TRP B 1 306 ? -8.722 65.693 106.524 1.00 57.38 ? 349 TRP B CG 1 ATOM 6221 C CD1 . TRP B 1 306 ? -7.782 65.748 107.512 1.00 66.58 ? 349 TRP B CD1 1 ATOM 6222 C CD2 . TRP B 1 306 ? -8.000 65.630 105.289 1.00 58.85 ? 349 TRP B CD2 1 ATOM 6223 N NE1 . TRP B 1 306 ? -6.521 65.733 106.970 1.00 52.27 ? 349 TRP B NE1 1 ATOM 6224 C CE2 . TRP B 1 306 ? -6.627 65.660 105.607 1.00 54.46 ? 349 TRP B CE2 1 ATOM 6225 C CE3 . TRP B 1 306 ? -8.380 65.555 103.947 1.00 49.41 ? 349 TRP B CE3 1 ATOM 6226 C CZ2 . TRP B 1 306 ? -5.635 65.616 104.632 1.00 41.54 ? 349 TRP B CZ2 1 ATOM 6227 C CZ3 . TRP B 1 306 ? -7.395 65.511 102.983 1.00 45.40 ? 349 TRP B CZ3 1 ATOM 6228 C CH2 . TRP B 1 306 ? -6.038 65.542 103.330 1.00 39.43 ? 349 TRP B CH2 1 ATOM 6229 N N . GLU B 1 307 ? -12.811 64.450 108.826 1.00 64.89 ? 350 GLU B N 1 ATOM 6230 C CA . GLU B 1 307 ? -14.251 64.554 109.050 1.00 75.83 ? 350 GLU B CA 1 ATOM 6231 C C . GLU B 1 307 ? -14.658 65.802 109.828 1.00 79.41 ? 350 GLU B C 1 ATOM 6232 O O . GLU B 1 307 ? -15.692 66.399 109.482 1.00 74.75 ? 350 GLU B O 1 ATOM 6233 C CB . GLU B 1 307 ? -14.751 63.285 109.756 1.00 76.51 ? 350 GLU B CB 1 ATOM 6234 C CG . GLU B 1 307 ? -16.262 63.229 109.949 1.00 86.19 ? 350 GLU B CG 1 ATOM 6235 C CD . GLU B 1 307 ? -16.728 63.954 111.198 1.00 102.67 ? 350 GLU B CD 1 ATOM 6236 O OE1 . GLU B 1 307 ? -15.909 64.137 112.125 1.00 98.38 ? 350 GLU B OE1 1 ATOM 6237 O OE2 . GLU B 1 307 ? -17.912 64.351 111.247 1.00 104.86 -1 350 GLU B OE2 1 ATOM 6238 N N . PRO B 1 308 ? -13.939 66.237 110.868 1.00 60.73 ? 351 PRO B N 1 ATOM 6239 C CA . PRO B 1 308 ? -14.392 67.435 111.598 1.00 65.49 ? 351 PRO B CA 1 ATOM 6240 C C . PRO B 1 308 ? -14.419 68.687 110.740 1.00 69.83 ? 351 PRO B C 1 ATOM 6241 O O . PRO B 1 308 ? -15.304 69.536 110.913 1.00 59.12 ? 351 PRO B O 1 ATOM 6242 C CB . PRO B 1 308 ? -13.369 67.557 112.738 1.00 62.21 ? 351 PRO B CB 1 ATOM 6243 C CG . PRO B 1 308 ? -12.766 66.199 112.870 1.00 74.53 ? 351 PRO B CG 1 ATOM 6244 C CD . PRO B 1 308 ? -12.748 65.632 111.486 1.00 69.83 ? 351 PRO B CD 1 ATOM 6245 N N . TRP B 1 309 ? -13.456 68.838 109.829 1.00 67.48 ? 352 TRP B N 1 ATOM 6246 C CA . TRP B 1 309 ? -13.341 70.065 109.049 1.00 57.08 ? 352 TRP B CA 1 ATOM 6247 C C . TRP B 1 309 ? -14.332 70.109 107.889 1.00 60.59 ? 352 TRP B C 1 ATOM 6248 O O . TRP B 1 309 ? -15.045 71.103 107.712 1.00 65.29 ? 352 TRP B O 1 ATOM 6249 C CB . TRP B 1 309 ? -11.910 70.208 108.531 1.00 44.73 ? 352 TRP B CB 1 ATOM 6250 C CG . TRP B 1 309 ? -10.897 70.390 109.621 1.00 52.59 ? 352 TRP B CG 1 ATOM 6251 C CD1 . TRP B 1 309 ? -11.065 71.075 110.789 1.00 54.69 ? 352 TRP B CD1 1 ATOM 6252 C CD2 . TRP B 1 309 ? -9.563 69.868 109.651 1.00 44.30 ? 352 TRP B CD2 1 ATOM 6253 N NE1 . TRP B 1 309 ? -9.915 71.020 111.540 1.00 52.40 ? 352 TRP B NE1 1 ATOM 6254 C CE2 . TRP B 1 309 ? -8.979 70.284 110.864 1.00 47.44 ? 352 TRP B CE2 1 ATOM 6255 C CE3 . TRP B 1 309 ? -8.805 69.093 108.768 1.00 46.81 ? 352 TRP B CE3 1 ATOM 6256 C CZ2 . TRP B 1 309 ? -7.673 69.950 111.217 1.00 45.38 ? 352 TRP B CZ2 1 ATOM 6257 C CZ3 . TRP B 1 309 ? -7.507 68.765 109.121 1.00 53.86 ? 352 TRP B CZ3 1 ATOM 6258 C CH2 . TRP B 1 309 ? -6.955 69.192 110.335 1.00 46.63 ? 352 TRP B CH2 1 ATOM 6259 N N . LEU B 1 310 ? -14.391 69.008 107.061 1.00 56.27 ? 353 LEU B N 1 ATOM 6260 C CA . LEU B 1 310 ? -15.142 69.017 105.812 1.00 54.06 ? 353 LEU B CA 1 ATOM 6261 C C . LEU B 1 310 ? -16.569 68.507 105.999 1.00 51.16 ? 353 LEU B C 1 ATOM 6262 O O . LEU B 1 310 ? -16.813 67.590 106.789 1.00 60.80 ? 353 LEU B O 1 ATOM 6263 C CB . LEU B 1 310 ? -14.429 68.170 104.761 1.00 63.01 ? 353 LEU B CB 1 ATOM 6264 C CG . LEU B 1 310 ? -12.947 68.495 104.568 1.00 55.47 ? 353 LEU B CG 1 ATOM 6265 C CD1 . LEU B 1 310 ? -12.300 67.533 103.583 1.00 58.03 ? 353 LEU B CD1 1 ATOM 6266 C CD2 . LEU B 1 310 ? -12.785 69.931 104.101 1.00 51.09 ? 353 LEU B CD2 1 ATOM 6267 N N . PRO B 1 311 ? -17.520 69.078 105.252 1.00 51.63 ? 354 PRO B N 1 ATOM 6268 C CA . PRO B 1 311 ? -18.910 68.609 105.321 1.00 56.92 ? 354 PRO B CA 1 ATOM 6269 C C . PRO B 1 311 ? -19.133 67.305 104.568 1.00 74.49 ? 354 PRO B C 1 ATOM 6270 O O . PRO B 1 311 ? -18.178 66.663 104.120 1.00 66.71 ? 354 PRO B O 1 ATOM 6271 C CB . PRO B 1 311 ? -19.693 69.766 104.691 1.00 52.15 ? 354 PRO B CB 1 ATOM 6272 C CG . PRO B 1 311 ? -18.735 70.351 103.710 1.00 57.16 ? 354 PRO B CG 1 ATOM 6273 C CD . PRO B 1 311 ? -17.370 70.227 104.342 1.00 61.92 ? 354 PRO B CD 1 ATOM 6274 N N . ALA B 1 312 ? -20.399 66.903 104.430 1.00 81.00 ? 355 ALA B N 1 ATOM 6275 C CA . ALA B 1 312 ? -20.714 65.597 103.858 1.00 70.89 ? 355 ALA B CA 1 ATOM 6276 C C . ALA B 1 312 ? -20.214 65.480 102.423 1.00 77.57 ? 355 ALA B C 1 ATOM 6277 O O . ALA B 1 312 ? -19.427 64.583 102.099 1.00 82.65 ? 355 ALA B O 1 ATOM 6278 C CB . ALA B 1 312 ? -22.222 65.348 103.926 1.00 58.98 ? 355 ALA B CB 1 ATOM 6279 N N . GLU B 1 313 ? -20.662 66.382 101.544 1.00 83.76 ? 356 GLU B N 1 ATOM 6280 C CA . GLU B 1 313 ? -20.291 66.295 100.133 1.00 92.23 ? 356 GLU B CA 1 ATOM 6281 C C . GLU B 1 313 ? -18.780 66.215 99.967 1.00 78.94 ? 356 GLU B C 1 ATOM 6282 O O . GLU B 1 313 ? -18.264 65.362 99.233 1.00 71.24 ? 356 GLU B O 1 ATOM 6283 C CB . GLU B 1 313 ? -20.851 67.492 99.360 1.00 88.33 ? 356 GLU B CB 1 ATOM 6284 C CG . GLU B 1 313 ? -22.370 67.557 99.287 1.00 106.99 ? 356 GLU B CG 1 ATOM 6285 C CD . GLU B 1 313 ? -23.008 67.959 100.604 1.00 106.11 ? 356 GLU B CD 1 ATOM 6286 O OE1 . GLU B 1 313 ? -22.558 67.468 101.662 1.00 98.56 ? 356 GLU B OE1 1 ATOM 6287 O OE2 . GLU B 1 313 ? -23.956 68.773 100.581 1.00 101.34 -1 356 GLU B OE2 1 ATOM 6288 N N . ALA B 1 314 ? -18.054 67.106 100.647 1.00 64.82 ? 357 ALA B N 1 ATOM 6289 C CA . ALA B 1 314 ? -16.597 67.096 100.581 1.00 65.74 ? 357 ALA B CA 1 ATOM 6290 C C . ALA B 1 314 ? -16.047 65.701 100.842 1.00 68.27 ? 357 ALA B C 1 ATOM 6291 O O . ALA B 1 314 ? -15.196 65.204 100.097 1.00 66.01 ? 357 ALA B O 1 ATOM 6292 C CB . ALA B 1 314 ? -16.022 68.098 101.584 1.00 67.30 ? 357 ALA B CB 1 ATOM 6293 N N . LEU B 1 315 ? -16.520 65.055 101.907 1.00 73.35 ? 358 LEU B N 1 ATOM 6294 C CA . LEU B 1 315 ? -16.059 63.706 102.205 1.00 71.62 ? 358 LEU B CA 1 ATOM 6295 C C . LEU B 1 315 ? -16.446 62.739 101.094 1.00 68.39 ? 358 LEU B C 1 ATOM 6296 O O . LEU B 1 315 ? -15.642 61.888 100.690 1.00 59.69 ? 358 LEU B O 1 ATOM 6297 C CB . LEU B 1 315 ? -16.628 63.253 103.548 1.00 78.93 ? 358 LEU B CB 1 ATOM 6298 C CG . LEU B 1 315 ? -16.228 64.153 104.720 1.00 67.79 ? 358 LEU B CG 1 ATOM 6299 C CD1 . LEU B 1 315 ? -16.827 63.655 106.030 1.00 82.44 ? 358 LEU B CD1 1 ATOM 6300 C CD2 . LEU B 1 315 ? -14.715 64.275 104.820 1.00 59.71 ? 358 LEU B CD2 1 ATOM 6301 N N . ARG B 1 316 ? -17.666 62.869 100.570 1.00 68.25 ? 359 ARG B N 1 ATOM 6302 C CA . ARG B 1 316 ? -18.129 61.955 99.532 1.00 73.25 ? 359 ARG B CA 1 ATOM 6303 C C . ARG B 1 316 ? -17.210 61.991 98.317 1.00 74.30 ? 359 ARG B C 1 ATOM 6304 O O . ARG B 1 316 ? -16.691 60.954 97.888 1.00 75.03 ? 359 ARG B O 1 ATOM 6305 C CB . ARG B 1 316 ? -19.567 62.294 99.137 1.00 64.62 ? 359 ARG B CB 1 ATOM 6306 C CG . ARG B 1 316 ? -20.310 61.143 98.476 1.00 78.13 ? 359 ARG B CG 1 ATOM 6307 C CD . ARG B 1 316 ? -21.571 61.625 97.780 1.00 96.22 ? 359 ARG B CD 1 ATOM 6308 N NE . ARG B 1 316 ? -21.268 62.479 96.635 1.00 116.04 ? 359 ARG B NE 1 ATOM 6309 C CZ . ARG B 1 316 ? -20.976 62.028 95.419 1.00 102.85 ? 359 ARG B CZ 1 ATOM 6310 N NH1 . ARG B 1 316 ? -20.944 60.723 95.183 1.00 100.70 1 359 ARG B NH1 1 ATOM 6311 N NH2 . ARG B 1 316 ? -20.714 62.882 94.437 1.00 83.12 ? 359 ARG B NH2 1 ATOM 6312 N N . THR B 1 317 ? -16.987 63.181 97.752 1.00 73.95 ? 360 THR B N 1 ATOM 6313 C CA . THR B 1 317 ? -16.140 63.272 96.567 1.00 66.65 ? 360 THR B CA 1 ATOM 6314 C C . THR B 1 317 ? -14.679 63.002 96.901 1.00 66.33 ? 360 THR B C 1 ATOM 6315 O O . THR B 1 317 ? -13.931 62.496 96.054 1.00 56.81 ? 360 THR B O 1 ATOM 6316 C CB . THR B 1 317 ? -16.281 64.646 95.909 1.00 61.61 ? 360 THR B CB 1 ATOM 6317 O OG1 . THR B 1 317 ? -15.834 65.660 96.815 1.00 76.54 ? 360 THR B OG1 1 ATOM 6318 C CG2 . THR B 1 317 ? -17.733 64.914 95.542 1.00 76.73 ? 360 THR B CG2 1 ATOM 6319 N N . LEU B 1 318 ? -14.258 63.325 98.127 1.00 60.86 ? 361 LEU B N 1 ATOM 6320 C CA . LEU B 1 318 ? -12.879 63.079 98.529 1.00 60.51 ? 361 LEU B CA 1 ATOM 6321 C C . LEU B 1 318 ? -12.576 61.590 98.604 1.00 58.94 ? 361 LEU B C 1 ATOM 6322 O O . LEU B 1 318 ? -11.445 61.176 98.327 1.00 59.16 ? 361 LEU B O 1 ATOM 6323 C CB . LEU B 1 318 ? -12.593 63.756 99.869 1.00 56.79 ? 361 LEU B CB 1 ATOM 6324 C CG . LEU B 1 318 ? -11.278 63.384 100.559 1.00 66.13 ? 361 LEU B CG 1 ATOM 6325 C CD1 . LEU B 1 318 ? -10.090 63.866 99.750 1.00 55.31 ? 361 LEU B CD1 1 ATOM 6326 C CD2 . LEU B 1 318 ? -11.236 63.958 101.968 1.00 72.35 ? 361 LEU B CD2 1 ATOM 6327 N N . ARG B 1 319 ? -13.563 60.772 98.980 1.00 66.28 ? 362 ARG B N 1 ATOM 6328 C CA . ARG B 1 319 ? -13.345 59.330 98.991 1.00 61.51 ? 362 ARG B CA 1 ATOM 6329 C C . ARG B 1 319 ? -13.140 58.787 97.582 1.00 58.44 ? 362 ARG B C 1 ATOM 6330 O O . ARG B 1 319 ? -12.467 57.765 97.406 1.00 55.82 ? 362 ARG B O 1 ATOM 6331 C CB . ARG B 1 319 ? -14.511 58.613 99.672 1.00 65.14 ? 362 ARG B CB 1 ATOM 6332 C CG . ARG B 1 319 ? -14.690 58.954 101.138 1.00 71.52 ? 362 ARG B CG 1 ATOM 6333 C CD . ARG B 1 319 ? -15.836 58.160 101.754 1.00 93.53 ? 362 ARG B CD 1 ATOM 6334 N NE . ARG B 1 319 ? -16.064 58.521 103.152 1.00 98.70 ? 362 ARG B NE 1 ATOM 6335 C CZ . ARG B 1 319 ? -17.017 59.346 103.573 1.00 86.20 ? 362 ARG B CZ 1 ATOM 6336 N NH1 . ARG B 1 319 ? -17.847 59.907 102.704 1.00 85.86 1 362 ARG B NH1 1 ATOM 6337 N NH2 . ARG B 1 319 ? -17.140 59.609 104.867 1.00 81.96 ? 362 ARG B NH2 1 ATOM 6338 N N . ILE B 1 320 ? -13.703 59.453 96.574 1.00 57.55 ? 363 ILE B N 1 ATOM 6339 C CA . ILE B 1 320 ? -13.589 59.011 95.188 1.00 54.03 ? 363 ILE B CA 1 ATOM 6340 C C . ILE B 1 320 ? -12.287 59.517 94.584 1.00 61.86 ? 363 ILE B C 1 ATOM 6341 O O . ILE B 1 320 ? -11.383 58.732 94.278 1.00 58.80 ? 363 ILE B O 1 ATOM 6342 C CB . ILE B 1 320 ? -14.779 59.495 94.339 1.00 60.20 ? 363 ILE B CB 1 ATOM 6343 C CG1 . ILE B 1 320 ? -16.113 59.098 94.971 1.00 68.95 ? 363 ILE B CG1 1 ATOM 6344 C CG2 . ILE B 1 320 ? -14.671 58.950 92.925 1.00 57.36 ? 363 ILE B CG2 1 ATOM 6345 C CD1 . ILE B 1 320 ? -17.312 59.690 94.251 1.00 50.74 ? 363 ILE B CD1 1 ATOM 6346 N N . GLY B 1 321 ? -12.196 60.832 94.382 1.00 74.58 ? 364 GLY B N 1 ATOM 6347 C CA . GLY B 1 321 ? -11.081 61.401 93.650 1.00 70.06 ? 364 GLY B CA 1 ATOM 6348 C C . GLY B 1 321 ? -10.009 62.097 94.464 1.00 69.44 ? 364 GLY B C 1 ATOM 6349 O O . GLY B 1 321 ? -8.927 62.388 93.945 1.00 76.02 ? 364 GLY B O 1 ATOM 6350 N N . GLY B 1 322 ? -10.285 62.371 95.734 1.00 60.53 ? 365 GLY B N 1 ATOM 6351 C CA . GLY B 1 322 ? -9.348 63.140 96.529 1.00 54.81 ? 365 GLY B CA 1 ATOM 6352 C C . GLY B 1 322 ? -9.417 64.629 96.282 1.00 52.90 ? 365 GLY B C 1 ATOM 6353 O O . GLY B 1 322 ? -8.393 65.315 96.363 1.00 52.88 ? 365 GLY B O 1 ATOM 6354 N N . PHE B 1 323 ? -10.600 65.147 95.960 1.00 45.47 ? 366 PHE B N 1 ATOM 6355 C CA . PHE B 1 323 ? -10.816 66.576 95.794 1.00 58.83 ? 366 PHE B CA 1 ATOM 6356 C C . PHE B 1 323 ? -12.265 66.875 96.148 1.00 54.49 ? 366 PHE B C 1 ATOM 6357 O O . PHE B 1 323 ? -13.129 65.996 96.091 1.00 54.47 ? 366 PHE B O 1 ATOM 6358 C CB . PHE B 1 323 ? -10.479 67.048 94.370 1.00 59.42 ? 366 PHE B CB 1 ATOM 6359 C CG . PHE B 1 323 ? -11.213 66.310 93.285 1.00 61.12 ? 366 PHE B CG 1 ATOM 6360 C CD1 . PHE B 1 323 ? -12.482 66.705 92.895 1.00 62.90 ? 366 PHE B CD1 1 ATOM 6361 C CD2 . PHE B 1 323 ? -10.621 65.240 92.634 1.00 67.99 ? 366 PHE B CD2 1 ATOM 6362 C CE1 . PHE B 1 323 ? -13.155 66.035 91.890 1.00 55.21 ? 366 PHE B CE1 1 ATOM 6363 C CE2 . PHE B 1 323 ? -11.289 64.568 91.630 1.00 58.64 ? 366 PHE B CE2 1 ATOM 6364 C CZ . PHE B 1 323 ? -12.557 64.968 91.257 1.00 50.12 ? 366 PHE B CZ 1 ATOM 6365 N N . TYR B 1 324 ? -12.531 68.127 96.507 1.00 44.99 ? 367 TYR B N 1 ATOM 6366 C CA . TYR B 1 324 ? -13.850 68.478 97.015 1.00 41.92 ? 367 TYR B CA 1 ATOM 6367 C C . TYR B 1 324 ? -14.112 69.960 96.786 1.00 57.05 ? 367 TYR B C 1 ATOM 6368 O O . TYR B 1 324 ? -13.266 70.701 96.278 1.00 53.78 ? 367 TYR B O 1 ATOM 6369 C CB . TYR B 1 324 ? -13.968 68.139 98.500 1.00 41.90 ? 367 TYR B CB 1 ATOM 6370 C CG . TYR B 1 324 ? -12.918 68.807 99.368 1.00 47.84 ? 367 TYR B CG 1 ATOM 6371 C CD1 . TYR B 1 324 ? -11.634 68.284 99.462 1.00 43.99 ? 367 TYR B CD1 1 ATOM 6372 C CD2 . TYR B 1 324 ? -13.211 69.954 100.095 1.00 45.29 ? 367 TYR B CD2 1 ATOM 6373 C CE1 . TYR B 1 324 ? -10.672 68.880 100.252 1.00 39.64 ? 367 TYR B CE1 1 ATOM 6374 C CE2 . TYR B 1 324 ? -12.250 70.561 100.892 1.00 46.62 ? 367 TYR B CE2 1 ATOM 6375 C CZ . TYR B 1 324 ? -10.981 70.017 100.964 1.00 46.76 ? 367 TYR B CZ 1 ATOM 6376 O OH . TYR B 1 324 ? -10.017 70.608 101.749 1.00 37.83 ? 367 TYR B OH 1 ATOM 6377 N N . ALA B 1 325 ? -15.306 70.383 97.190 1.00 48.68 ? 368 ALA B N 1 ATOM 6378 C CA . ALA B 1 325 ? -15.727 71.770 97.135 1.00 44.13 ? 368 ALA B CA 1 ATOM 6379 C C . ALA B 1 325 ? -16.610 72.047 98.341 1.00 61.61 ? 368 ALA B C 1 ATOM 6380 O O . ALA B 1 325 ? -17.348 71.173 98.803 1.00 62.15 ? 368 ALA B O 1 ATOM 6381 C CB . ALA B 1 325 ? -16.484 72.083 95.841 1.00 47.40 ? 368 ALA B CB 1 ATOM 6382 N N . LEU B 1 326 ? -16.518 73.268 98.855 1.00 57.14 ? 369 LEU B N 1 ATOM 6383 C CA . LEU B 1 326 ? -17.301 73.679 100.011 1.00 54.53 ? 369 LEU B CA 1 ATOM 6384 C C . LEU B 1 326 ? -17.378 75.200 100.008 1.00 56.59 ? 369 LEU B C 1 ATOM 6385 O O . LEU B 1 326 ? -16.815 75.868 99.137 1.00 70.61 ? 369 LEU B O 1 ATOM 6386 C CB . LEU B 1 326 ? -16.698 73.130 101.307 1.00 50.22 ? 369 LEU B CB 1 ATOM 6387 C CG . LEU B 1 326 ? -15.242 73.490 101.613 1.00 55.14 ? 369 LEU B CG 1 ATOM 6388 C CD1 . LEU B 1 326 ? -15.141 74.896 102.181 1.00 56.01 ? 369 LEU B CD1 1 ATOM 6389 C CD2 . LEU B 1 326 ? -14.616 72.477 102.557 1.00 37.21 ? 369 LEU B CD2 1 ATOM 6390 N N . SER B 1 327 ? -18.078 75.747 101.001 1.00 47.67 ? 370 SER B N 1 ATOM 6391 C CA . SER B 1 327 ? -18.350 77.182 101.079 1.00 63.27 ? 370 SER B CA 1 ATOM 6392 C C . SER B 1 327 ? -17.920 77.709 102.440 1.00 46.92 ? 370 SER B C 1 ATOM 6393 O O . SER B 1 327 ? -18.702 77.692 103.400 1.00 52.63 ? 370 SER B O 1 ATOM 6394 C CB . SER B 1 327 ? -19.826 77.479 100.821 1.00 59.76 ? 370 SER B CB 1 ATOM 6395 O OG . SER B 1 327 ? -20.177 77.205 99.476 1.00 56.42 ? 370 SER B OG 1 ATOM 6396 N N . PRO B 1 328 ? -16.679 78.187 102.562 1.00 50.34 ? 371 PRO B N 1 ATOM 6397 C CA . PRO B 1 328 ? -16.252 78.764 103.851 1.00 62.12 ? 371 PRO B CA 1 ATOM 6398 C C . PRO B 1 328 ? -17.098 79.953 104.278 1.00 60.53 ? 371 PRO B C 1 ATOM 6399 O O . PRO B 1 328 ? -17.492 80.044 105.448 1.00 56.65 ? 371 PRO B O 1 ATOM 6400 C CB . PRO B 1 328 ? -14.787 79.154 103.589 1.00 58.37 ? 371 PRO B CB 1 ATOM 6401 C CG . PRO B 1 328 ? -14.374 78.354 102.389 1.00 56.26 ? 371 PRO B CG 1 ATOM 6402 C CD . PRO B 1 328 ? -15.605 78.210 101.555 1.00 52.11 ? 371 PRO B CD 1 ATOM 6403 N N . TYR B 1 329 ? -17.386 80.873 103.358 1.00 65.21 ? 372 TYR B N 1 ATOM 6404 C CA . TYR B 1 329 ? -18.219 82.045 103.574 1.00 58.88 ? 372 TYR B CA 1 ATOM 6405 C C . TYR B 1 329 ? -19.428 82.011 102.650 1.00 66.15 ? 372 TYR B C 1 ATOM 6406 O O . TYR B 1 329 ? -19.379 81.393 101.581 1.00 66.94 ? 372 TYR B O 1 ATOM 6407 C CB . TYR B 1 329 ? -17.448 83.344 103.305 1.00 68.30 ? 372 TYR B CB 1 ATOM 6408 C CG . TYR B 1 329 ? -16.316 83.646 104.255 1.00 58.18 ? 372 TYR B CG 1 ATOM 6409 C CD1 . TYR B 1 329 ? -16.510 83.618 105.626 1.00 59.98 ? 372 TYR B CD1 1 ATOM 6410 C CD2 . TYR B 1 329 ? -15.052 83.964 103.776 1.00 54.21 ? 372 TYR B CD2 1 ATOM 6411 C CE1 . TYR B 1 329 ? -15.477 83.902 106.497 1.00 76.22 ? 372 TYR B CE1 1 ATOM 6412 C CE2 . TYR B 1 329 ? -14.013 84.245 104.636 1.00 60.88 ? 372 TYR B CE2 1 ATOM 6413 C CZ . TYR B 1 329 ? -14.229 84.213 105.996 1.00 81.35 ? 372 TYR B CZ 1 ATOM 6414 O OH . TYR B 1 329 ? -13.195 84.493 106.862 1.00 84.94 ? 372 TYR B OH 1 ATOM 6415 N N . PRO B 1 330 ? -20.527 82.659 103.028 1.00 74.90 ? 373 PRO B N 1 ATOM 6416 C CA . PRO B 1 330 ? -21.574 82.938 102.039 1.00 73.79 ? 373 PRO B CA 1 ATOM 6417 C C . PRO B 1 330 ? -21.022 83.849 100.952 1.00 80.11 ? 373 PRO B C 1 ATOM 6418 O O . PRO B 1 330 ? -20.449 84.904 101.234 1.00 80.34 ? 373 PRO B O 1 ATOM 6419 C CB . PRO B 1 330 ? -22.673 83.622 102.862 1.00 63.18 ? 373 PRO B CB 1 ATOM 6420 C CG . PRO B 1 330 ? -21.980 84.127 104.089 1.00 83.51 ? 373 PRO B CG 1 ATOM 6421 C CD . PRO B 1 330 ? -20.884 83.144 104.371 1.00 71.19 ? 373 PRO B CD 1 ATOM 6422 N N . GLY B 1 331 ? -21.202 83.435 99.701 1.00 58.63 ? 374 GLY B N 1 ATOM 6423 C CA . GLY B 1 331 ? -20.634 84.150 98.580 1.00 58.87 ? 374 GLY B CA 1 ATOM 6424 C C . GLY B 1 331 ? -19.233 83.731 98.190 1.00 59.47 ? 374 GLY B C 1 ATOM 6425 O O . GLY B 1 331 ? -18.642 84.362 97.304 1.00 71.83 ? 374 GLY B O 1 ATOM 6426 N N . LEU B 1 332 ? -18.679 82.697 98.821 1.00 57.76 ? 375 LEU B N 1 ATOM 6427 C CA . LEU B 1 332 ? -17.350 82.199 98.498 1.00 55.93 ? 375 LEU B CA 1 ATOM 6428 C C . LEU B 1 332 ? -17.377 80.682 98.383 1.00 53.26 ? 375 LEU B C 1 ATOM 6429 O O . LEU B 1 332 ? -18.123 80.000 99.092 1.00 49.98 ? 375 LEU B O 1 ATOM 6430 C CB . LEU B 1 332 ? -16.310 82.611 99.549 1.00 60.75 ? 375 LEU B CB 1 ATOM 6431 C CG . LEU B 1 332 ? -14.908 82.046 99.302 1.00 60.26 ? 375 LEU B CG 1 ATOM 6432 C CD1 . LEU B 1 332 ? -14.212 82.795 98.170 1.00 54.42 ? 375 LEU B CD1 1 ATOM 6433 C CD2 . LEU B 1 332 ? -14.067 82.072 100.568 1.00 54.60 ? 375 LEU B CD2 1 ATOM 6434 N N . ARG B 1 333 ? -16.542 80.159 97.489 1.00 46.43 ? 376 ARG B N 1 ATOM 6435 C CA . ARG B 1 333 ? -16.437 78.725 97.250 1.00 53.81 ? 376 ARG B CA 1 ATOM 6436 C C . ARG B 1 333 ? -14.967 78.346 97.206 1.00 50.42 ? 376 ARG B C 1 ATOM 6437 O O . ARG B 1 333 ? -14.199 78.914 96.422 1.00 52.92 ? 376 ARG B O 1 ATOM 6438 C CB . ARG B 1 333 ? -17.130 78.316 95.946 1.00 46.93 ? 376 ARG B CB 1 ATOM 6439 C CG . ARG B 1 333 ? -18.636 78.168 96.054 1.00 55.58 ? 376 ARG B CG 1 ATOM 6440 C CD . ARG B 1 333 ? -19.020 76.945 96.873 1.00 68.51 ? 376 ARG B CD 1 ATOM 6441 N NE . ARG B 1 333 ? -18.969 75.706 96.099 1.00 59.43 ? 376 ARG B NE 1 ATOM 6442 C CZ . ARG B 1 333 ? -19.270 74.508 96.591 1.00 62.66 ? 376 ARG B CZ 1 ATOM 6443 N NH1 . ARG B 1 333 ? -19.641 74.382 97.857 1.00 49.29 1 376 ARG B NH1 1 ATOM 6444 N NH2 . ARG B 1 333 ? -19.202 73.432 95.818 1.00 71.18 ? 376 ARG B NH2 1 ATOM 6445 N N . LEU B 1 334 ? -14.576 77.406 98.056 1.00 46.97 ? 377 LEU B N 1 ATOM 6446 C CA . LEU B 1 334 ? -13.225 76.869 98.056 1.00 45.71 ? 377 LEU B CA 1 ATOM 6447 C C . LEU B 1 334 ? -13.231 75.533 97.332 1.00 48.56 ? 377 LEU B C 1 ATOM 6448 O O . LEU B 1 334 ? -14.050 74.660 97.637 1.00 54.29 ? 377 LEU B O 1 ATOM 6449 C CB . LEU B 1 334 ? -12.696 76.696 99.479 1.00 46.22 ? 377 LEU B CB 1 ATOM 6450 C CG . LEU B 1 334 ? -11.186 76.484 99.596 1.00 42.05 ? 377 LEU B CG 1 ATOM 6451 C CD1 . LEU B 1 334 ? -10.732 76.783 101.005 1.00 46.30 ? 377 LEU B CD1 1 ATOM 6452 C CD2 . LEU B 1 334 ? -10.800 75.067 99.204 1.00 42.80 ? 377 LEU B CD2 1 ATOM 6453 N N . ILE B 1 335 ? -12.338 75.388 96.360 1.00 43.85 ? 378 ILE B N 1 ATOM 6454 C CA . ILE B 1 335 ? -12.146 74.140 95.634 1.00 40.12 ? 378 ILE B CA 1 ATOM 6455 C C . ILE B 1 335 ? -10.758 73.608 95.956 1.00 42.63 ? 378 ILE B C 1 ATOM 6456 O O . ILE B 1 335 ? -9.764 74.338 95.854 1.00 40.14 ? 378 ILE B O 1 ATOM 6457 C CB . ILE B 1 335 ? -12.349 74.325 94.122 1.00 31.83 ? 378 ILE B CB 1 ATOM 6458 C CG1 . ILE B 1 335 ? -13.746 74.895 93.856 1.00 27.82 ? 378 ILE B CG1 1 ATOM 6459 C CG2 . ILE B 1 335 ? -12.121 73.013 93.388 1.00 44.39 ? 378 ILE B CG2 1 ATOM 6460 C CD1 . ILE B 1 335 ? -14.076 75.072 92.393 1.00 40.45 ? 378 ILE B CD1 1 ATOM 6461 N N . SER B 1 336 ? -10.698 72.346 96.365 1.00 40.18 ? 379 SER B N 1 ATOM 6462 C CA . SER B 1 336 ? -9.448 71.664 96.671 1.00 41.07 ? 379 SER B CA 1 ATOM 6463 C C . SER B 1 336 ? -9.223 70.602 95.605 1.00 46.11 ? 379 SER B C 1 ATOM 6464 O O . SER B 1 336 ? -9.931 69.590 95.571 1.00 57.34 ? 379 SER B O 1 ATOM 6465 C CB . SER B 1 336 ? -9.497 71.050 98.069 1.00 46.23 ? 379 SER B CB 1 ATOM 6466 O OG . SER B 1 336 ? -8.304 70.348 98.366 1.00 58.26 ? 379 SER B OG 1 ATOM 6467 N N . LEU B 1 337 ? -8.240 70.830 94.742 1.00 45.86 ? 380 LEU B N 1 ATOM 6468 C CA . LEU B 1 337 ? -7.950 69.939 93.629 1.00 55.49 ? 380 LEU B CA 1 ATOM 6469 C C . LEU B 1 337 ? -6.839 68.965 93.989 1.00 45.09 ? 380 LEU B C 1 ATOM 6470 O O . LEU B 1 337 ? -5.894 69.312 94.704 1.00 41.68 ? 380 LEU B O 1 ATOM 6471 C CB . LEU B 1 337 ? -7.547 70.723 92.378 1.00 46.99 ? 380 LEU B CB 1 ATOM 6472 C CG . LEU B 1 337 ? -8.474 71.791 91.813 1.00 43.03 ? 380 LEU B CG 1 ATOM 6473 C CD1 . LEU B 1 337 ? -7.799 72.448 90.623 1.00 47.10 ? 380 LEU B CD1 1 ATOM 6474 C CD2 . LEU B 1 337 ? -9.793 71.167 91.405 1.00 52.04 ? 380 LEU B CD2 1 ATOM 6475 N N . ASN B 1 338 ? -6.951 67.746 93.474 1.00 47.37 ? 381 ASN B N 1 ATOM 6476 C CA . ASN B 1 338 ? -5.882 66.764 93.588 1.00 53.17 ? 381 ASN B CA 1 ATOM 6477 C C . ASN B 1 338 ? -5.011 66.890 92.343 1.00 42.84 ? 381 ASN B C 1 ATOM 6478 O O . ASN B 1 338 ? -5.395 66.441 91.260 1.00 55.38 ? 381 ASN B O 1 ATOM 6479 C CB . ASN B 1 338 ? -6.469 65.360 93.725 1.00 44.61 ? 381 ASN B CB 1 ATOM 6480 C CG . ASN B 1 338 ? -5.410 64.294 93.935 1.00 45.79 ? 381 ASN B CG 1 ATOM 6481 O OD1 . ASN B 1 338 ? -4.240 64.480 93.598 1.00 48.01 ? 381 ASN B OD1 1 ATOM 6482 N ND2 . ASN B 1 338 ? -5.822 63.161 94.492 1.00 53.11 ? 381 ASN B ND2 1 ATOM 6483 N N . MET B 1 339 ? -3.812 67.450 92.510 1.00 38.89 ? 382 MET B N 1 ATOM 6484 C CA . MET B 1 339 ? -2.940 67.758 91.383 1.00 35.74 ? 382 MET B CA 1 ATOM 6485 C C . MET B 1 339 ? -2.138 66.558 90.919 1.00 44.92 ? 382 MET B C 1 ATOM 6486 O O . MET B 1 339 ? -1.317 66.697 90.008 1.00 59.10 ? 382 MET B O 1 ATOM 6487 C CB . MET B 1 339 ? -1.970 68.894 91.730 1.00 40.46 ? 382 MET B CB 1 ATOM 6488 C CG . MET B 1 339 ? -2.598 70.243 92.063 1.00 57.59 ? 382 MET B CG 1 ATOM 6489 S SD . MET B 1 339 ? -3.608 70.938 90.737 1.00 51.71 ? 382 MET B SD 1 ATOM 6490 C CE . MET B 1 339 ? -5.077 69.932 90.865 1.00 58.16 ? 382 MET B CE 1 ATOM 6491 N N . ASN B 1 340 ? -2.327 65.396 91.535 1.00 45.28 ? 383 ASN B N 1 ATOM 6492 C CA . ASN B 1 340 ? -1.558 64.236 91.112 1.00 53.81 ? 383 ASN B CA 1 ATOM 6493 C C . ASN B 1 340 ? -2.051 63.705 89.773 1.00 55.03 ? 383 ASN B C 1 ATOM 6494 O O . ASN B 1 340 ? -1.256 63.175 88.988 1.00 51.03 ? 383 ASN B O 1 ATOM 6495 C CB . ASN B 1 340 ? -1.607 63.173 92.200 1.00 30.42 ? 383 ASN B CB 1 ATOM 6496 C CG . ASN B 1 340 ? -1.025 63.668 93.500 1.00 42.60 ? 383 ASN B CG 1 ATOM 6497 O OD1 . ASN B 1 340 ? 0.171 63.957 93.587 1.00 44.00 ? 383 ASN B OD1 1 ATOM 6498 N ND2 . ASN B 1 340 ? -1.868 63.780 94.523 1.00 46.75 ? 383 ASN B ND2 1 ATOM 6499 N N . PHE B 1 341 ? -3.349 63.842 89.493 1.00 55.54 ? 384 PHE B N 1 ATOM 6500 C CA . PHE B 1 341 ? -3.854 63.601 88.148 1.00 54.69 ? 384 PHE B CA 1 ATOM 6501 C C . PHE B 1 341 ? -3.293 64.603 87.150 1.00 43.12 ? 384 PHE B C 1 ATOM 6502 O O . PHE B 1 341 ? -3.411 64.395 85.938 1.00 58.75 ? 384 PHE B O 1 ATOM 6503 C CB . PHE B 1 341 ? -5.379 63.668 88.162 1.00 51.94 ? 384 PHE B CB 1 ATOM 6504 C CG . PHE B 1 341 ? -5.999 62.833 89.237 1.00 48.83 ? 384 PHE B CG 1 ATOM 6505 C CD1 . PHE B 1 341 ? -5.417 61.638 89.621 1.00 51.71 ? 384 PHE B CD1 1 ATOM 6506 C CD2 . PHE B 1 341 ? -7.150 63.250 89.879 1.00 59.98 ? 384 PHE B CD2 1 ATOM 6507 C CE1 . PHE B 1 341 ? -5.975 60.865 90.618 1.00 52.59 ? 384 PHE B CE1 1 ATOM 6508 C CE2 . PHE B 1 341 ? -7.717 62.479 90.879 1.00 72.15 ? 384 PHE B CE2 1 ATOM 6509 C CZ . PHE B 1 341 ? -7.126 61.285 91.249 1.00 57.24 ? 384 PHE B CZ 1 ATOM 6510 N N . CYS B 1 342 ? -2.712 65.690 87.649 1.00 64.33 ? 385 CYS B N 1 ATOM 6511 C CA . CYS B 1 342 ? -1.967 66.661 86.867 1.00 48.41 ? 385 CYS B CA 1 ATOM 6512 C C . CYS B 1 342 ? -0.534 66.217 86.613 1.00 43.51 ? 385 CYS B C 1 ATOM 6513 O O . CYS B 1 342 ? 0.059 66.612 85.604 1.00 40.12 ? 385 CYS B O 1 ATOM 6514 C CB . CYS B 1 342 ? -1.972 67.986 87.638 1.00 41.87 ? 385 CYS B CB 1 ATOM 6515 S SG . CYS B 1 342 ? -2.054 69.520 86.732 1.00 108.29 ? 385 CYS B SG 1 ATOM 6516 N N . SER B 1 343 ? 0.005 65.361 87.476 1.00 52.66 ? 386 SER B N 1 ATOM 6517 C CA . SER B 1 343 ? 1.445 65.275 87.674 1.00 45.99 ? 386 SER B CA 1 ATOM 6518 C C . SER B 1 343 ? 2.156 64.600 86.509 1.00 39.87 ? 386 SER B C 1 ATOM 6519 O O . SER B 1 343 ? 1.645 63.664 85.891 1.00 48.18 ? 386 SER B O 1 ATOM 6520 C CB . SER B 1 343 ? 1.755 64.515 88.960 1.00 52.99 ? 386 SER B CB 1 ATOM 6521 O OG . SER B 1 343 ? 3.147 64.287 89.090 1.00 66.98 ? 386 SER B OG 1 ATOM 6522 N N . ARG B 1 344 ? 3.374 65.078 86.239 1.00 50.67 ? 387 ARG B N 1 ATOM 6523 C CA . ARG B 1 344 ? 4.253 64.405 85.291 1.00 53.53 ? 387 ARG B CA 1 ATOM 6524 C C . ARG B 1 344 ? 4.847 63.133 85.879 1.00 52.94 ? 387 ARG B C 1 ATOM 6525 O O . ARG B 1 344 ? 5.083 62.166 85.147 1.00 56.28 ? 387 ARG B O 1 ATOM 6526 C CB . ARG B 1 344 ? 5.376 65.343 84.843 1.00 42.10 ? 387 ARG B CB 1 ATOM 6527 C CG . ARG B 1 344 ? 4.925 66.590 84.097 1.00 56.08 ? 387 ARG B CG 1 ATOM 6528 C CD . ARG B 1 344 ? 6.129 67.437 83.710 1.00 66.47 ? 387 ARG B CD 1 ATOM 6529 N NE . ARG B 1 344 ? 5.758 68.698 83.074 1.00 71.88 ? 387 ARG B NE 1 ATOM 6530 C CZ . ARG B 1 344 ? 5.775 68.903 81.760 1.00 86.35 ? 387 ARG B CZ 1 ATOM 6531 N NH1 . ARG B 1 344 ? 6.146 67.931 80.935 1.00 75.02 1 387 ARG B NH1 1 ATOM 6532 N NH2 . ARG B 1 344 ? 5.424 70.083 81.267 1.00 84.89 ? 387 ARG B NH2 1 ATOM 6533 N N . GLU B 1 345 ? 5.092 63.112 87.187 1.00 55.89 ? 388 GLU B N 1 ATOM 6534 C CA . GLU B 1 345 ? 5.771 62.003 87.844 1.00 50.66 ? 388 GLU B CA 1 ATOM 6535 C C . GLU B 1 345 ? 4.828 60.872 88.234 1.00 55.97 ? 388 GLU B C 1 ATOM 6536 O O . GLU B 1 345 ? 5.283 59.875 88.805 1.00 56.34 ? 388 GLU B O 1 ATOM 6537 C CB . GLU B 1 345 ? 6.499 62.509 89.090 1.00 58.20 ? 388 GLU B CB 1 ATOM 6538 C CG . GLU B 1 345 ? 7.542 63.574 88.811 1.00 63.01 ? 388 GLU B CG 1 ATOM 6539 C CD . GLU B 1 345 ? 7.974 64.309 90.068 1.00 98.84 ? 388 GLU B CD 1 ATOM 6540 O OE1 . GLU B 1 345 ? 8.347 65.497 89.964 1.00 93.05 ? 388 GLU B OE1 1 ATOM 6541 O OE2 . GLU B 1 345 ? 7.922 63.706 91.164 1.00 111.34 -1 388 GLU B OE2 1 ATOM 6542 N N . ASN B 1 346 ? 3.540 60.992 87.928 1.00 43.85 ? 389 ASN B N 1 ATOM 6543 C CA . ASN B 1 346 ? 2.562 59.954 88.232 1.00 40.95 ? 389 ASN B CA 1 ATOM 6544 C C . ASN B 1 346 ? 2.458 59.022 87.031 1.00 54.33 ? 389 ASN B C 1 ATOM 6545 O O . ASN B 1 346 ? 1.915 59.399 85.987 1.00 62.91 ? 389 ASN B O 1 ATOM 6546 C CB . ASN B 1 346 ? 1.212 60.587 88.565 1.00 47.12 ? 389 ASN B CB 1 ATOM 6547 C CG . ASN B 1 346 ? 0.121 59.560 88.795 1.00 54.67 ? 389 ASN B CG 1 ATOM 6548 O OD1 . ASN B 1 346 ? 0.385 58.361 88.881 1.00 63.06 ? 389 ASN B OD1 1 ATOM 6549 N ND2 . ASN B 1 346 ? -1.118 60.030 88.909 1.00 37.11 ? 389 ASN B ND2 1 ATOM 6550 N N . PHE B 1 347 ? 2.963 57.796 87.183 1.00 52.21 ? 390 PHE B N 1 ATOM 6551 C CA . PHE B 1 347 ? 3.045 56.891 86.044 1.00 55.15 ? 390 PHE B CA 1 ATOM 6552 C C . PHE B 1 347 ? 1.700 56.274 85.690 1.00 46.90 ? 390 PHE B C 1 ATOM 6553 O O . PHE B 1 347 ? 1.544 55.768 84.575 1.00 66.93 ? 390 PHE B O 1 ATOM 6554 C CB . PHE B 1 347 ? 4.070 55.785 86.306 1.00 66.18 ? 390 PHE B CB 1 ATOM 6555 C CG . PHE B 1 347 ? 3.927 55.128 87.644 1.00 70.59 ? 390 PHE B CG 1 ATOM 6556 C CD1 . PHE B 1 347 ? 2.944 54.177 87.859 1.00 62.82 ? 390 PHE B CD1 1 ATOM 6557 C CD2 . PHE B 1 347 ? 4.778 55.454 88.685 1.00 81.25 ? 390 PHE B CD2 1 ATOM 6558 C CE1 . PHE B 1 347 ? 2.807 53.567 89.089 1.00 59.07 ? 390 PHE B CE1 1 ATOM 6559 C CE2 . PHE B 1 347 ? 4.648 54.847 89.921 1.00 80.68 ? 390 PHE B CE2 1 ATOM 6560 C CZ . PHE B 1 347 ? 3.661 53.902 90.123 1.00 79.53 ? 390 PHE B CZ 1 ATOM 6561 N N . TRP B 1 348 ? 0.733 56.296 86.609 1.00 43.52 ? 391 TRP B N 1 ATOM 6562 C CA . TRP B 1 348 ? -0.595 55.781 86.298 1.00 49.95 ? 391 TRP B CA 1 ATOM 6563 C C . TRP B 1 348 ? -1.252 56.521 85.143 1.00 53.41 ? 391 TRP B C 1 ATOM 6564 O O . TRP B 1 348 ? -2.218 56.013 84.563 1.00 53.33 ? 391 TRP B O 1 ATOM 6565 C CB . TRP B 1 348 ? -1.491 55.850 87.532 1.00 52.94 ? 391 TRP B CB 1 ATOM 6566 C CG . TRP B 1 348 ? -1.104 54.860 88.566 1.00 61.99 ? 391 TRP B CG 1 ATOM 6567 C CD1 . TRP B 1 348 ? -0.226 55.044 89.591 1.00 54.52 ? 391 TRP B CD1 1 ATOM 6568 C CD2 . TRP B 1 348 ? -1.563 53.509 88.665 1.00 74.60 ? 391 TRP B CD2 1 ATOM 6569 N NE1 . TRP B 1 348 ? -0.115 53.892 90.330 1.00 60.20 ? 391 TRP B NE1 1 ATOM 6570 C CE2 . TRP B 1 348 ? -0.927 52.934 89.782 1.00 76.33 ? 391 TRP B CE2 1 ATOM 6571 C CE3 . TRP B 1 348 ? -2.454 52.731 87.919 1.00 67.03 ? 391 TRP B CE3 1 ATOM 6572 C CZ2 . TRP B 1 348 ? -1.153 51.616 90.173 1.00 67.05 ? 391 TRP B CZ2 1 ATOM 6573 C CZ3 . TRP B 1 348 ? -2.679 51.425 88.307 1.00 74.15 ? 391 TRP B CZ3 1 ATOM 6574 C CH2 . TRP B 1 348 ? -2.031 50.880 89.425 1.00 80.12 ? 391 TRP B CH2 1 ATOM 6575 N N . LEU B 1 349 ? -0.760 57.710 84.802 1.00 46.32 ? 392 LEU B N 1 ATOM 6576 C CA . LEU B 1 349 ? -1.341 58.454 83.694 1.00 59.24 ? 392 LEU B CA 1 ATOM 6577 C C . LEU B 1 349 ? -0.952 57.869 82.341 1.00 64.48 ? 392 LEU B C 1 ATOM 6578 O O . LEU B 1 349 ? -1.642 58.125 81.347 1.00 57.07 ? 392 LEU B O 1 ATOM 6579 C CB . LEU B 1 349 ? -0.926 59.919 83.808 1.00 60.71 ? 392 LEU B CB 1 ATOM 6580 C CG . LEU B 1 349 ? -1.319 60.475 85.181 1.00 47.63 ? 392 LEU B CG 1 ATOM 6581 C CD1 . LEU B 1 349 ? -0.829 61.898 85.389 1.00 47.51 ? 392 LEU B CD1 1 ATOM 6582 C CD2 . LEU B 1 349 ? -2.831 60.396 85.362 1.00 40.90 ? 392 LEU B CD2 1 ATOM 6583 N N . LEU B 1 350 ? 0.116 57.066 82.289 1.00 49.45 ? 393 LEU B N 1 ATOM 6584 C CA . LEU B 1 350 ? 0.463 56.358 81.060 1.00 48.97 ? 393 LEU B CA 1 ATOM 6585 C C . LEU B 1 350 ? -0.732 55.600 80.498 1.00 49.33 ? 393 LEU B C 1 ATOM 6586 O O . LEU B 1 350 ? -0.965 55.604 79.285 1.00 72.76 ? 393 LEU B O 1 ATOM 6587 C CB . LEU B 1 350 ? 1.631 55.404 81.319 1.00 51.32 ? 393 LEU B CB 1 ATOM 6588 C CG . LEU B 1 350 ? 3.018 56.039 81.422 1.00 56.99 ? 393 LEU B CG 1 ATOM 6589 C CD1 . LEU B 1 350 ? 4.030 55.054 81.988 1.00 53.42 ? 393 LEU B CD1 1 ATOM 6590 C CD2 . LEU B 1 350 ? 3.465 56.524 80.055 1.00 38.10 ? 393 LEU B CD2 1 ATOM 6591 N N . ILE B 1 351 ? -1.495 54.935 81.363 1.00 53.46 ? 394 ILE B N 1 ATOM 6592 C CA . ILE B 1 351 ? -2.697 54.219 80.951 1.00 55.55 ? 394 ILE B CA 1 ATOM 6593 C C . ILE B 1 351 ? -3.647 55.182 80.254 1.00 54.08 ? 394 ILE B C 1 ATOM 6594 O O . ILE B 1 351 ? -3.884 55.074 79.046 1.00 75.82 ? 394 ILE B O 1 ATOM 6595 C CB . ILE B 1 351 ? -3.379 53.545 82.155 1.00 51.46 ? 394 ILE B CB 1 ATOM 6596 C CG1 . ILE B 1 351 ? -2.448 52.498 82.771 1.00 58.31 ? 394 ILE B CG1 1 ATOM 6597 C CG2 . ILE B 1 351 ? -4.711 52.940 81.747 1.00 44.04 ? 394 ILE B CG2 1 ATOM 6598 C CD1 . ILE B 1 351 ? -3.006 51.833 84.011 1.00 65.85 ? 394 ILE B CD1 1 ATOM 6599 N N . ASN B 1 352 ? -4.216 56.112 81.018 1.00 63.78 ? 395 ASN B N 1 ATOM 6600 C CA . ASN B 1 352 ? -5.097 57.148 80.489 1.00 68.76 ? 395 ASN B CA 1 ATOM 6601 C C . ASN B 1 352 ? -4.726 58.468 81.147 1.00 58.51 ? 395 ASN B C 1 ATOM 6602 O O . ASN B 1 352 ? -4.844 58.603 82.367 1.00 71.77 ? 395 ASN B O 1 ATOM 6603 C CB . ASN B 1 352 ? -6.566 56.800 80.755 1.00 71.07 ? 395 ASN B CB 1 ATOM 6604 C CG . ASN B 1 352 ? -7.528 57.576 79.874 1.00 72.41 ? 395 ASN B CG 1 ATOM 6605 O OD1 . ASN B 1 352 ? -7.121 58.289 78.957 1.00 77.21 ? 395 ASN B OD1 1 ATOM 6606 N ND2 . ASN B 1 352 ? -8.822 57.434 80.155 1.00 81.46 ? 395 ASN B ND2 1 ATOM 6607 N N . SER B 1 353 ? -4.272 59.433 80.351 1.00 66.55 ? 396 SER B N 1 ATOM 6608 C CA . SER B 1 353 ? -3.922 60.752 80.862 1.00 60.26 ? 396 SER B CA 1 ATOM 6609 C C . SER B 1 353 ? -5.032 61.782 80.679 1.00 60.58 ? 396 SER B C 1 ATOM 6610 O O . SER B 1 353 ? -4.829 62.955 81.008 1.00 63.28 ? 396 SER B O 1 ATOM 6611 C CB . SER B 1 353 ? -2.636 61.256 80.194 1.00 60.63 ? 396 SER B CB 1 ATOM 6612 O OG . SER B 1 353 ? -2.882 61.704 78.872 1.00 82.95 ? 396 SER B OG 1 ATOM 6613 N N . THR B 1 354 ? -6.198 61.380 80.178 1.00 63.22 ? 397 THR B N 1 ATOM 6614 C CA . THR B 1 354 ? -7.236 62.324 79.777 1.00 58.81 ? 397 THR B CA 1 ATOM 6615 C C . THR B 1 354 ? -8.116 62.668 80.977 1.00 54.93 ? 397 THR B C 1 ATOM 6616 O O . THR B 1 354 ? -8.852 61.813 81.482 1.00 62.15 ? 397 THR B O 1 ATOM 6617 C CB . THR B 1 354 ? -8.066 61.736 78.639 1.00 59.63 ? 397 THR B CB 1 ATOM 6618 O OG1 . THR B 1 354 ? -7.204 61.432 77.535 1.00 61.23 ? 397 THR B OG1 1 ATOM 6619 C CG2 . THR B 1 354 ? -9.133 62.721 78.187 1.00 57.83 ? 397 THR B CG2 1 ATOM 6620 N N . ASP B 1 355 ? -8.052 63.937 81.412 1.00 66.72 ? 398 ASP B N 1 ATOM 6621 C CA . ASP B 1 355 ? -8.826 64.512 82.511 1.00 58.76 ? 398 ASP B CA 1 ATOM 6622 C C . ASP B 1 355 ? -9.078 63.479 83.603 1.00 53.91 ? 398 ASP B C 1 ATOM 6623 O O . ASP B 1 355 ? -10.229 63.081 83.826 1.00 45.28 ? 398 ASP B O 1 ATOM 6624 C CB . ASP B 1 355 ? -10.149 65.094 82.006 1.00 53.11 ? 398 ASP B CB 1 ATOM 6625 C CG . ASP B 1 355 ? -10.922 65.828 83.096 1.00 61.21 ? 398 ASP B CG 1 ATOM 6626 O OD1 . ASP B 1 355 ? -10.299 66.245 84.097 1.00 52.07 ? 398 ASP B OD1 1 ATOM 6627 O OD2 . ASP B 1 355 ? -12.152 65.999 82.948 1.00 63.43 -1 398 ASP B OD2 1 ATOM 6628 N N . PRO B 1 356 ? -8.036 63.002 84.282 1.00 39.30 ? 399 PRO B N 1 ATOM 6629 C CA . PRO B 1 356 ? -8.231 61.945 85.276 1.00 48.33 ? 399 PRO B CA 1 ATOM 6630 C C . PRO B 1 356 ? -9.352 62.289 86.249 1.00 53.30 ? 399 PRO B C 1 ATOM 6631 O O . PRO B 1 356 ? -9.570 63.453 86.607 1.00 60.91 ? 399 PRO B O 1 ATOM 6632 C CB . PRO B 1 356 ? -6.869 61.865 85.972 1.00 60.40 ? 399 PRO B CB 1 ATOM 6633 C CG . PRO B 1 356 ? -5.902 62.271 84.905 1.00 49.00 ? 399 PRO B CG 1 ATOM 6634 C CD . PRO B 1 356 ? -6.612 63.349 84.117 1.00 48.60 ? 399 PRO B CD 1 ATOM 6635 N N . ALA B 1 357 ? -10.115 61.263 86.618 1.00 59.89 ? 400 ALA B N 1 ATOM 6636 C CA . ALA B 1 357 ? -11.263 61.396 87.507 1.00 59.56 ? 400 ALA B CA 1 ATOM 6637 C C . ALA B 1 357 ? -12.251 62.431 86.994 1.00 56.84 ? 400 ALA B C 1 ATOM 6638 O O . ALA B 1 357 ? -13.080 62.935 87.758 1.00 58.95 ? 400 ALA B O 1 ATOM 6639 C CB . ALA B 1 357 ? -10.827 61.741 88.935 1.00 46.61 ? 400 ALA B CB 1 ATOM 6640 N N . GLY B 1 358 ? -12.173 62.753 85.704 1.00 57.31 ? 401 GLY B N 1 ATOM 6641 C CA . GLY B 1 358 ? -12.998 63.794 85.133 1.00 64.23 ? 401 GLY B CA 1 ATOM 6642 C C . GLY B 1 358 ? -13.025 65.019 86.021 1.00 58.48 ? 401 GLY B C 1 ATOM 6643 O O . GLY B 1 358 ? -14.068 65.669 86.144 1.00 69.33 ? 401 GLY B O 1 ATOM 6644 N N . GLN B 1 359 ? -11.898 65.346 86.660 1.00 53.47 ? 402 GLN B N 1 ATOM 6645 C CA . GLN B 1 359 ? -11.977 66.370 87.696 1.00 55.91 ? 402 GLN B CA 1 ATOM 6646 C C . GLN B 1 359 ? -12.035 67.773 87.103 1.00 60.80 ? 402 GLN B C 1 ATOM 6647 O O . GLN B 1 359 ? -12.815 68.610 87.572 1.00 56.55 ? 402 GLN B O 1 ATOM 6648 C CB . GLN B 1 359 ? -10.810 66.229 88.673 1.00 55.76 ? 402 GLN B CB 1 ATOM 6649 C CG . GLN B 1 359 ? -9.676 67.209 88.489 1.00 57.95 ? 402 GLN B CG 1 ATOM 6650 C CD . GLN B 1 359 ? -8.812 67.307 89.732 1.00 63.25 ? 402 GLN B CD 1 ATOM 6651 O OE1 . GLN B 1 359 ? -9.318 67.489 90.840 1.00 55.96 ? 402 GLN B OE1 1 ATOM 6652 N NE2 . GLN B 1 359 ? -7.503 67.177 89.557 1.00 62.87 ? 402 GLN B NE2 1 ATOM 6653 N N . LEU B 1 360 ? -11.244 68.041 86.061 1.00 66.66 ? 403 LEU B N 1 ATOM 6654 C CA . LEU B 1 360 ? -11.300 69.346 85.407 1.00 57.81 ? 403 LEU B CA 1 ATOM 6655 C C . LEU B 1 360 ? -12.720 69.678 84.969 1.00 57.53 ? 403 LEU B C 1 ATOM 6656 O O . LEU B 1 360 ? -13.240 70.758 85.271 1.00 62.97 ? 403 LEU B O 1 ATOM 6657 C CB . LEU B 1 360 ? -10.335 69.383 84.222 1.00 48.51 ? 403 LEU B CB 1 ATOM 6658 C CG . LEU B 1 360 ? -8.897 69.696 84.631 1.00 42.02 ? 403 LEU B CG 1 ATOM 6659 C CD1 . LEU B 1 360 ? -7.975 69.720 83.428 1.00 43.25 ? 403 LEU B CD1 1 ATOM 6660 C CD2 . LEU B 1 360 ? -8.852 71.017 85.375 1.00 45.41 ? 403 LEU B CD2 1 ATOM 6661 N N . GLN B 1 361 ? -13.368 68.756 84.254 1.00 55.69 ? 404 GLN B N 1 ATOM 6662 C CA . GLN B 1 361 ? -14.774 68.951 83.920 1.00 53.87 ? 404 GLN B CA 1 ATOM 6663 C C . GLN B 1 361 ? -15.567 69.310 85.169 1.00 63.20 ? 404 GLN B C 1 ATOM 6664 O O . GLN B 1 361 ? -16.281 70.319 85.203 1.00 59.26 ? 404 GLN B O 1 ATOM 6665 C CB . GLN B 1 361 ? -15.338 67.688 83.265 1.00 60.33 ? 404 GLN B CB 1 ATOM 6666 C CG . GLN B 1 361 ? -16.765 67.829 82.755 1.00 75.09 ? 404 GLN B CG 1 ATOM 6667 C CD . GLN B 1 361 ? -16.938 69.011 81.818 1.00 86.09 ? 404 GLN B CD 1 ATOM 6668 O OE1 . GLN B 1 361 ? -16.379 69.033 80.718 1.00 63.06 ? 404 GLN B OE1 1 ATOM 6669 N NE2 . GLN B 1 361 ? -17.709 70.006 82.251 1.00 73.25 ? 404 GLN B NE2 1 ATOM 6670 N N . TRP B 1 362 ? -15.412 68.509 86.227 1.00 59.22 ? 405 TRP B N 1 ATOM 6671 C CA . TRP B 1 362 ? -16.064 68.812 87.495 1.00 59.26 ? 405 TRP B CA 1 ATOM 6672 C C . TRP B 1 362 ? -15.780 70.247 87.913 1.00 46.33 ? 405 TRP B C 1 ATOM 6673 O O . TRP B 1 362 ? -16.701 71.016 88.214 1.00 45.04 ? 405 TRP B O 1 ATOM 6674 C CB . TRP B 1 362 ? -15.593 67.824 88.568 1.00 60.13 ? 405 TRP B CB 1 ATOM 6675 C CG . TRP B 1 362 ? -16.021 68.172 89.962 1.00 58.67 ? 405 TRP B CG 1 ATOM 6676 C CD1 . TRP B 1 362 ? -17.245 67.952 90.527 1.00 53.19 ? 405 TRP B CD1 1 ATOM 6677 C CD2 . TRP B 1 362 ? -15.220 68.795 90.973 1.00 59.08 ? 405 TRP B CD2 1 ATOM 6678 N NE1 . TRP B 1 362 ? -17.257 68.407 91.823 1.00 56.91 ? 405 TRP B NE1 1 ATOM 6679 C CE2 . TRP B 1 362 ? -16.026 68.928 92.121 1.00 49.87 ? 405 TRP B CE2 1 ATOM 6680 C CE3 . TRP B 1 362 ? -13.901 69.260 91.017 1.00 55.23 ? 405 TRP B CE3 1 ATOM 6681 C CZ2 . TRP B 1 362 ? -15.557 69.502 93.298 1.00 55.55 ? 405 TRP B CZ2 1 ATOM 6682 C CZ3 . TRP B 1 362 ? -13.437 69.831 92.187 1.00 48.59 ? 405 TRP B CZ3 1 ATOM 6683 C CH2 . TRP B 1 362 ? -14.262 69.945 93.311 1.00 61.74 ? 405 TRP B CH2 1 ATOM 6684 N N . LEU B 1 363 ? -14.501 70.631 87.902 1.00 43.96 ? 406 LEU B N 1 ATOM 6685 C CA . LEU B 1 363 ? -14.121 72.000 88.233 1.00 51.15 ? 406 LEU B CA 1 ATOM 6686 C C . LEU B 1 363 ? -14.949 73.006 87.445 1.00 53.24 ? 406 LEU B C 1 ATOM 6687 O O . LEU B 1 363 ? -15.539 73.932 88.017 1.00 50.46 ? 406 LEU B O 1 ATOM 6688 C CB . LEU B 1 363 ? -12.627 72.195 87.963 1.00 39.05 ? 406 LEU B CB 1 ATOM 6689 C CG . LEU B 1 363 ? -12.041 73.599 88.090 1.00 50.60 ? 406 LEU B CG 1 ATOM 6690 C CD1 . LEU B 1 363 ? -12.302 74.166 89.475 1.00 59.29 ? 406 LEU B CD1 1 ATOM 6691 C CD2 . LEU B 1 363 ? -10.550 73.563 87.798 1.00 39.70 ? 406 LEU B CD2 1 ATOM 6692 N N . VAL B 1 364 ? -15.035 72.819 86.127 1.00 55.82 ? 407 VAL B N 1 ATOM 6693 C CA . VAL B 1 364 ? -15.845 73.719 85.312 1.00 58.11 ? 407 VAL B CA 1 ATOM 6694 C C . VAL B 1 364 ? -17.267 73.763 85.850 1.00 53.54 ? 407 VAL B C 1 ATOM 6695 O O . VAL B 1 364 ? -17.809 74.836 86.145 1.00 66.93 ? 407 VAL B O 1 ATOM 6696 C CB . VAL B 1 364 ? -15.810 73.293 83.834 1.00 54.25 ? 407 VAL B CB 1 ATOM 6697 C CG1 . VAL B 1 364 ? -16.631 74.254 82.989 1.00 58.94 ? 407 VAL B CG1 1 ATOM 6698 C CG2 . VAL B 1 364 ? -14.374 73.226 83.335 1.00 51.55 ? 407 VAL B CG2 1 ATOM 6699 N N . GLY B 1 365 ? -17.879 72.590 86.021 1.00 53.85 ? 408 GLY B N 1 ATOM 6700 C CA . GLY B 1 365 ? -19.227 72.548 86.558 1.00 58.23 ? 408 GLY B CA 1 ATOM 6701 C C . GLY B 1 365 ? -19.368 73.360 87.828 1.00 63.06 ? 408 GLY B C 1 ATOM 6702 O O . GLY B 1 365 ? -20.382 74.030 88.039 1.00 64.34 ? 408 GLY B O 1 ATOM 6703 N N . GLU B 1 366 ? -18.345 73.325 88.685 1.00 71.07 ? 409 GLU B N 1 ATOM 6704 C CA . GLU B 1 366 ? -18.374 74.126 89.904 1.00 59.29 ? 409 GLU B CA 1 ATOM 6705 C C . GLU B 1 366 ? -18.218 75.607 89.585 1.00 67.61 ? 409 GLU B C 1 ATOM 6706 O O . GLU B 1 366 ? -19.021 76.437 90.029 1.00 71.30 ? 409 GLU B O 1 ATOM 6707 C CB . GLU B 1 366 ? -17.275 73.664 90.862 1.00 63.66 ? 409 GLU B CB 1 ATOM 6708 C CG . GLU B 1 366 ? -17.610 72.411 91.665 1.00 82.93 ? 409 GLU B CG 1 ATOM 6709 C CD . GLU B 1 366 ? -18.555 72.687 92.822 1.00 85.94 ? 409 GLU B CD 1 ATOM 6710 O OE1 . GLU B 1 366 ? -18.842 73.875 93.091 1.00 67.35 ? 409 GLU B OE1 1 ATOM 6711 O OE2 . GLU B 1 366 ? -19.002 71.715 93.470 1.00 92.02 -1 409 GLU B OE2 1 ATOM 6712 N N . LEU B 1 367 ? -17.198 75.953 88.797 1.00 62.92 ? 410 LEU B N 1 ATOM 6713 C CA . LEU B 1 367 ? -16.942 77.357 88.494 1.00 61.98 ? 410 LEU B CA 1 ATOM 6714 C C . LEU B 1 367 ? -18.162 77.999 87.852 1.00 68.56 ? 410 LEU B C 1 ATOM 6715 O O . LEU B 1 367 ? -18.604 79.081 88.261 1.00 57.20 ? 410 LEU B O 1 ATOM 6716 C CB . LEU B 1 367 ? -15.726 77.475 87.576 1.00 51.41 ? 410 LEU B CB 1 ATOM 6717 C CG . LEU B 1 367 ? -14.416 76.956 88.166 1.00 57.89 ? 410 LEU B CG 1 ATOM 6718 C CD1 . LEU B 1 367 ? -13.320 76.948 87.114 1.00 58.92 ? 410 LEU B CD1 1 ATOM 6719 C CD2 . LEU B 1 367 ? -14.012 77.794 89.364 1.00 41.69 ? 410 LEU B CD2 1 ATOM 6720 N N . GLN B 1 368 ? -18.740 77.326 86.857 1.00 66.86 ? 411 GLN B N 1 ATOM 6721 C CA . GLN B 1 368 ? -19.975 77.808 86.254 1.00 64.98 ? 411 GLN B CA 1 ATOM 6722 C C . GLN B 1 368 ? -21.063 77.962 87.308 1.00 61.80 ? 411 GLN B C 1 ATOM 6723 O O . GLN B 1 368 ? -21.749 78.989 87.363 1.00 66.10 ? 411 GLN B O 1 ATOM 6724 C CB . GLN B 1 368 ? -20.419 76.853 85.147 1.00 59.09 ? 411 GLN B CB 1 ATOM 6725 C CG . GLN B 1 368 ? -21.545 77.394 84.305 1.00 65.11 ? 411 GLN B CG 1 ATOM 6726 C CD . GLN B 1 368 ? -21.231 78.774 83.769 1.00 66.09 ? 411 GLN B CD 1 ATOM 6727 O OE1 . GLN B 1 368 ? -20.262 78.960 83.031 1.00 60.72 ? 411 GLN B OE1 1 ATOM 6728 N NE2 . GLN B 1 368 ? -22.040 79.753 84.149 1.00 68.12 ? 411 GLN B NE2 1 ATOM 6729 N N . ALA B 1 369 ? -21.212 76.957 88.176 1.00 58.60 ? 412 ALA B N 1 ATOM 6730 C CA . ALA B 1 369 ? -22.184 77.051 89.260 1.00 66.03 ? 412 ALA B CA 1 ATOM 6731 C C . ALA B 1 369 ? -22.006 78.327 90.067 1.00 70.48 ? 412 ALA B C 1 ATOM 6732 O O . ALA B 1 369 ? -22.989 78.897 90.555 1.00 70.29 ? 412 ALA B O 1 ATOM 6733 C CB . ALA B 1 369 ? -22.073 75.832 90.177 1.00 57.16 ? 412 ALA B CB 1 ATOM 6734 N N . ALA B 1 370 ? -20.767 78.797 90.210 1.00 67.68 ? 413 ALA B N 1 ATOM 6735 C CA . ALA B 1 370 ? -20.523 80.032 90.943 1.00 48.41 ? 413 ALA B CA 1 ATOM 6736 C C . ALA B 1 370 ? -20.863 81.259 90.105 1.00 70.24 ? 413 ALA B C 1 ATOM 6737 O O . ALA B 1 370 ? -21.408 82.238 90.627 1.00 73.10 ? 413 ALA B O 1 ATOM 6738 C CB . ALA B 1 370 ? -19.069 80.084 91.409 1.00 47.93 ? 413 ALA B CB 1 ATOM 6739 N N . GLU B 1 371 ? -20.546 81.228 88.808 1.00 68.77 ? 414 GLU B N 1 ATOM 6740 C CA . GLU B 1 371 ? -20.851 82.364 87.945 1.00 64.18 ? 414 GLU B CA 1 ATOM 6741 C C . GLU B 1 371 ? -22.339 82.700 87.979 1.00 65.51 ? 414 GLU B C 1 ATOM 6742 O O . GLU B 1 371 ? -22.722 83.850 88.218 1.00 63.36 ? 414 GLU B O 1 ATOM 6743 C CB . GLU B 1 371 ? -20.392 82.084 86.513 1.00 69.91 ? 414 GLU B CB 1 ATOM 6744 C CG . GLU B 1 371 ? -20.232 83.345 85.670 1.00 74.99 ? 414 GLU B CG 1 ATOM 6745 C CD . GLU B 1 371 ? -20.093 83.057 84.187 1.00 76.99 ? 414 GLU B CD 1 ATOM 6746 O OE1 . GLU B 1 371 ? -21.130 82.848 83.520 1.00 75.92 ? 414 GLU B OE1 1 ATOM 6747 O OE2 . GLU B 1 371 ? -18.948 83.041 83.688 1.00 80.02 -1 414 GLU B OE2 1 ATOM 6748 N N . ASP B 1 372 ? -23.193 81.707 87.721 1.00 75.17 ? 415 ASP B N 1 ATOM 6749 C CA . ASP B 1 372 ? -24.631 81.897 87.899 1.00 77.78 ? 415 ASP B CA 1 ATOM 6750 C C . ASP B 1 372 ? -24.969 82.348 89.316 1.00 72.98 ? 415 ASP B C 1 ATOM 6751 O O . ASP B 1 372 ? -25.868 83.174 89.515 1.00 80.64 ? 415 ASP B O 1 ATOM 6752 C CB . ASP B 1 372 ? -25.376 80.602 87.570 1.00 78.70 ? 415 ASP B CB 1 ATOM 6753 C CG . ASP B 1 372 ? -24.845 79.916 86.324 1.00 83.97 ? 415 ASP B CG 1 ATOM 6754 O OD1 . ASP B 1 372 ? -24.299 80.611 85.442 1.00 86.33 ? 415 ASP B OD1 1 ATOM 6755 O OD2 . ASP B 1 372 ? -24.976 78.676 86.229 1.00 75.60 -1 415 ASP B OD2 1 ATOM 6756 N N . ARG B 1 373 ? -24.264 81.816 90.313 1.00 65.43 ? 416 ARG B N 1 ATOM 6757 C CA . ARG B 1 373 ? -24.562 82.082 91.715 1.00 75.15 ? 416 ARG B CA 1 ATOM 6758 C C . ARG B 1 373 ? -23.967 83.394 92.215 1.00 79.40 ? 416 ARG B C 1 ATOM 6759 O O . ARG B 1 373 ? -24.329 83.847 93.308 1.00 70.73 ? 416 ARG B O 1 ATOM 6760 C CB . ARG B 1 373 ? -24.079 80.895 92.556 1.00 74.23 ? 416 ARG B CB 1 ATOM 6761 C CG . ARG B 1 373 ? -24.530 80.874 94.004 1.00 78.81 ? 416 ARG B CG 1 ATOM 6762 C CD . ARG B 1 373 ? -23.814 79.752 94.742 1.00 78.36 ? 416 ARG B CD 1 ATOM 6763 N NE . ARG B 1 373 ? -23.802 78.530 93.938 1.00 81.88 ? 416 ARG B NE 1 ATOM 6764 C CZ . ARG B 1 373 ? -22.913 77.549 94.065 1.00 85.35 ? 416 ARG B CZ 1 ATOM 6765 N NH1 . ARG B 1 373 ? -21.946 77.638 94.969 1.00 88.61 1 416 ARG B NH1 1 ATOM 6766 N NH2 . ARG B 1 373 ? -22.990 76.476 93.285 1.00 61.62 ? 416 ARG B NH2 1 ATOM 6767 N N . GLY B 1 374 ? -23.075 84.009 91.443 1.00 75.41 ? 417 GLY B N 1 ATOM 6768 C CA . GLY B 1 374 ? -22.491 85.294 91.774 1.00 65.26 ? 417 GLY B CA 1 ATOM 6769 C C . GLY B 1 374 ? -21.557 85.305 92.960 1.00 65.23 ? 417 GLY B C 1 ATOM 6770 O O . GLY B 1 374 ? -21.317 86.370 93.535 1.00 62.44 ? 417 GLY B O 1 ATOM 6771 N N . ASP B 1 375 ? -21.013 84.154 93.341 1.00 63.44 ? 418 ASP B N 1 ATOM 6772 C CA . ASP B 1 375 ? -19.991 84.080 94.371 1.00 73.94 ? 418 ASP B CA 1 ATOM 6773 C C . ASP B 1 375 ? -18.624 83.922 93.705 1.00 64.41 ? 418 ASP B C 1 ATOM 6774 O O . ASP B 1 375 ? -18.505 83.843 92.480 1.00 64.30 ? 418 ASP B O 1 ATOM 6775 C CB . ASP B 1 375 ? -20.285 82.958 95.370 1.00 80.81 ? 418 ASP B CB 1 ATOM 6776 C CG . ASP B 1 375 ? -20.791 81.698 94.711 1.00 88.84 ? 418 ASP B CG 1 ATOM 6777 O OD1 . ASP B 1 375 ? -20.602 81.549 93.485 1.00 88.27 ? 418 ASP B OD1 1 ATOM 6778 O OD2 . ASP B 1 375 ? -21.370 80.853 95.431 1.00 84.69 -1 418 ASP B OD2 1 ATOM 6779 N N . LYS B 1 376 ? -17.581 83.849 94.525 1.00 69.54 ? 419 LYS B N 1 ATOM 6780 C CA . LYS B 1 376 ? -16.208 83.811 94.050 1.00 66.00 ? 419 LYS B CA 1 ATOM 6781 C C . LYS B 1 376 ? -15.512 82.572 94.596 1.00 59.01 ? 419 LYS B C 1 ATOM 6782 O O . LYS B 1 376 ? -15.912 82.009 95.618 1.00 69.99 ? 419 LYS B O 1 ATOM 6783 C CB . LYS B 1 376 ? -15.451 85.081 94.463 1.00 63.03 ? 419 LYS B CB 1 ATOM 6784 C CG . LYS B 1 376 ? -16.159 86.371 94.066 1.00 63.39 ? 419 LYS B CG 1 ATOM 6785 C CD . LYS B 1 376 ? -15.179 87.431 93.585 1.00 74.29 ? 419 LYS B CD 1 ATOM 6786 C CE . LYS B 1 376 ? -15.904 88.621 92.974 1.00 59.11 ? 419 LYS B CE 1 ATOM 6787 N NZ . LYS B 1 376 ? -16.826 88.200 91.881 1.00 68.73 1 419 LYS B NZ 1 ATOM 6788 N N . VAL B 1 377 ? -14.464 82.141 93.896 1.00 42.61 ? 420 VAL B N 1 ATOM 6789 C CA . VAL B 1 377 ? -13.869 80.829 94.111 1.00 48.34 ? 420 VAL B CA 1 ATOM 6790 C C . VAL B 1 377 ? -12.417 80.980 94.541 1.00 47.75 ? 420 VAL B C 1 ATOM 6791 O O . VAL B 1 377 ? -11.664 81.777 93.971 1.00 39.87 ? 420 VAL B O 1 ATOM 6792 C CB . VAL B 1 377 ? -13.965 79.958 92.841 1.00 43.99 ? 420 VAL B CB 1 ATOM 6793 C CG1 . VAL B 1 377 ? -13.309 78.605 93.073 1.00 35.15 ? 420 VAL B CG1 1 ATOM 6794 C CG2 . VAL B 1 377 ? -15.417 79.791 92.427 1.00 41.21 ? 420 VAL B CG2 1 ATOM 6795 N N . HIS B 1 378 ? -12.033 80.203 95.550 1.00 35.59 ? 421 HIS B N 1 ATOM 6796 C CA . HIS B 1 378 ? -10.640 79.991 95.912 1.00 40.28 ? 421 HIS B CA 1 ATOM 6797 C C . HIS B 1 378 ? -10.253 78.581 95.500 1.00 44.13 ? 421 HIS B C 1 ATOM 6798 O O . HIS B 1 378 ? -10.949 77.619 95.842 1.00 56.58 ? 421 HIS B O 1 ATOM 6799 C CB . HIS B 1 378 ? -10.416 80.176 97.414 1.00 41.74 ? 421 HIS B CB 1 ATOM 6800 C CG . HIS B 1 378 ? -10.402 81.605 97.853 1.00 47.46 ? 421 HIS B CG 1 ATOM 6801 N ND1 . HIS B 1 378 ? -10.315 81.973 99.178 1.00 43.15 ? 421 HIS B ND1 1 ATOM 6802 C CD2 . HIS B 1 378 ? -10.472 82.756 97.145 1.00 48.13 ? 421 HIS B CD2 1 ATOM 6803 C CE1 . HIS B 1 378 ? -10.327 83.291 99.267 1.00 53.34 ? 421 HIS B CE1 1 ATOM 6804 N NE2 . HIS B 1 378 ? -10.424 83.791 98.048 1.00 51.39 ? 421 HIS B NE2 1 ATOM 6805 N N . ILE B 1 379 ? -9.154 78.460 94.766 1.00 43.14 ? 422 ILE B N 1 ATOM 6806 C CA . ILE B 1 379 ? -8.625 77.170 94.347 1.00 38.05 ? 422 ILE B CA 1 ATOM 6807 C C . ILE B 1 379 ? -7.337 76.913 95.110 1.00 53.48 ? 422 ILE B C 1 ATOM 6808 O O . ILE B 1 379 ? -6.496 77.809 95.249 1.00 40.50 ? 422 ILE B O 1 ATOM 6809 C CB . ILE B 1 379 ? -8.384 77.129 92.827 1.00 42.07 ? 422 ILE B CB 1 ATOM 6810 C CG1 . ILE B 1 379 ? -9.685 77.420 92.079 1.00 48.12 ? 422 ILE B CG1 1 ATOM 6811 C CG2 . ILE B 1 379 ? -7.825 75.774 92.417 1.00 37.33 ? 422 ILE B CG2 1 ATOM 6812 C CD1 . ILE B 1 379 ? -9.525 77.489 90.582 1.00 44.36 ? 422 ILE B CD1 1 ATOM 6813 N N . ILE B 1 380 ? -7.187 75.689 95.610 1.00 44.82 ? 423 ILE B N 1 ATOM 6814 C CA . ILE B 1 380 ? -5.983 75.271 96.312 1.00 35.18 ? 423 ILE B CA 1 ATOM 6815 C C . ILE B 1 380 ? -5.581 73.891 95.810 1.00 42.01 ? 423 ILE B C 1 ATOM 6816 O O . ILE B 1 380 ? -6.427 73.081 95.419 1.00 49.53 ? 423 ILE B O 1 ATOM 6817 C CB . ILE B 1 380 ? -6.182 75.277 97.845 1.00 36.60 ? 423 ILE B CB 1 ATOM 6818 C CG1 . ILE B 1 380 ? -7.204 74.219 98.259 1.00 54.65 ? 423 ILE B CG1 1 ATOM 6819 C CG2 . ILE B 1 380 ? -6.618 76.655 98.323 1.00 39.07 ? 423 ILE B CG2 1 ATOM 6820 C CD1 . ILE B 1 380 ? -7.489 74.199 99.744 1.00 34.01 ? 423 ILE B CD1 1 ATOM 6821 N N . GLY B 1 381 ? -4.276 73.635 95.809 1.00 30.54 ? 424 GLY B N 1 ATOM 6822 C CA . GLY B 1 381 ? -3.742 72.364 95.347 1.00 39.38 ? 424 GLY B CA 1 ATOM 6823 C C . GLY B 1 381 ? -2.264 72.290 95.655 1.00 41.25 ? 424 GLY B C 1 ATOM 6824 O O . GLY B 1 381 ? -1.638 73.284 96.036 1.00 36.10 ? 424 GLY B O 1 ATOM 6825 N N . HIS B 1 382 ? -1.705 71.088 95.499 1.00 38.89 ? 425 HIS B N 1 ATOM 6826 C CA . HIS B 1 382 ? -0.291 70.903 95.832 1.00 44.34 ? 425 HIS B CA 1 ATOM 6827 C C . HIS B 1 382 ? 0.606 71.396 94.702 1.00 47.80 ? 425 HIS B C 1 ATOM 6828 O O . HIS B 1 382 ? 1.300 72.407 94.840 1.00 42.36 ? 425 HIS B O 1 ATOM 6829 C CB . HIS B 1 382 ? 0.012 69.436 96.155 1.00 37.96 ? 425 HIS B CB 1 ATOM 6830 C CG . HIS B 1 382 ? 1.430 69.206 96.588 1.00 42.18 ? 425 HIS B CG 1 ATOM 6831 N ND1 . HIS B 1 382 ? 1.977 69.824 97.690 1.00 38.56 ? 425 HIS B ND1 1 ATOM 6832 C CD2 . HIS B 1 382 ? 2.418 68.440 96.061 1.00 54.19 ? 425 HIS B CD2 1 ATOM 6833 C CE1 . HIS B 1 382 ? 3.237 69.450 97.825 1.00 56.62 ? 425 HIS B CE1 1 ATOM 6834 N NE2 . HIS B 1 382 ? 3.531 68.606 96.852 1.00 49.96 ? 425 HIS B NE2 1 ATOM 6835 N N . ILE B 1 383 ? 0.601 70.690 93.582 1.00 54.47 ? 426 ILE B N 1 ATOM 6836 C CA . ILE B 1 383 ? 1.483 71.032 92.466 1.00 56.82 ? 426 ILE B CA 1 ATOM 6837 C C . ILE B 1 383 ? 0.894 72.225 91.718 1.00 52.94 ? 426 ILE B C 1 ATOM 6838 O O . ILE B 1 383 ? -0.309 72.220 91.408 1.00 57.16 ? 426 ILE B O 1 ATOM 6839 C CB . ILE B 1 383 ? 1.666 69.835 91.540 1.00 49.06 ? 426 ILE B CB 1 ATOM 6840 C CG1 . ILE B 1 383 ? 2.295 68.670 92.305 1.00 41.49 ? 426 ILE B CG1 1 ATOM 6841 C CG2 . ILE B 1 383 ? 2.525 70.215 90.345 1.00 51.53 ? 426 ILE B CG2 1 ATOM 6842 C CD1 . ILE B 1 383 ? 2.517 67.439 91.465 1.00 37.09 ? 426 ILE B CD1 1 ATOM 6843 N N . PRO B 1 384 ? 1.687 73.257 91.429 1.00 33.83 ? 427 PRO B N 1 ATOM 6844 C CA . PRO B 1 384 ? 1.143 74.414 90.730 1.00 44.46 ? 427 PRO B CA 1 ATOM 6845 C C . PRO B 1 384 ? 0.913 74.092 89.267 1.00 54.35 ? 427 PRO B C 1 ATOM 6846 O O . PRO B 1 384 ? 1.671 73.315 88.660 1.00 58.27 ? 427 PRO B O 1 ATOM 6847 C CB . PRO B 1 384 ? 2.242 75.477 90.902 1.00 47.66 ? 427 PRO B CB 1 ATOM 6848 C CG . PRO B 1 384 ? 3.497 74.682 91.037 1.00 34.55 ? 427 PRO B CG 1 ATOM 6849 C CD . PRO B 1 384 ? 3.118 73.412 91.746 1.00 33.52 ? 427 PRO B CD 1 ATOM 6850 N N . PRO B 1 385 ? -0.119 74.665 88.651 1.00 46.23 ? 428 PRO B N 1 ATOM 6851 C CA . PRO B 1 385 ? -0.297 74.475 87.209 1.00 47.89 ? 428 PRO B CA 1 ATOM 6852 C C . PRO B 1 385 ? 0.843 75.151 86.471 1.00 61.75 ? 428 PRO B C 1 ATOM 6853 O O . PRO B 1 385 ? 1.232 76.275 86.795 1.00 60.16 ? 428 PRO B O 1 ATOM 6854 C CB . PRO B 1 385 ? -1.640 75.153 86.923 1.00 42.96 ? 428 PRO B CB 1 ATOM 6855 C CG . PRO B 1 385 ? -1.737 76.209 87.965 1.00 41.08 ? 428 PRO B CG 1 ATOM 6856 C CD . PRO B 1 385 ? -1.060 75.656 89.200 1.00 43.55 ? 428 PRO B CD 1 ATOM 6857 N N . GLY B 1 386 ? 1.388 74.458 85.480 1.00 31.56 ? 429 GLY B N 1 ATOM 6858 C CA . GLY B 1 386 ? 2.626 74.861 84.855 1.00 43.19 ? 429 GLY B CA 1 ATOM 6859 C C . GLY B 1 386 ? 3.802 73.999 85.250 1.00 41.44 ? 429 GLY B C 1 ATOM 6860 O O . GLY B 1 386 ? 4.857 74.073 84.607 1.00 45.12 ? 429 GLY B O 1 ATOM 6861 N N . HIS B 1 387 ? 3.663 73.219 86.313 1.00 43.01 ? 430 HIS B N 1 ATOM 6862 C CA . HIS B 1 387 ? 4.499 72.050 86.524 1.00 53.85 ? 430 HIS B CA 1 ATOM 6863 C C . HIS B 1 387 ? 3.835 70.791 85.988 1.00 64.14 ? 430 HIS B C 1 ATOM 6864 O O . HIS B 1 387 ? 4.406 69.701 86.105 1.00 58.53 ? 430 HIS B O 1 ATOM 6865 C CB . HIS B 1 387 ? 4.823 71.881 88.013 1.00 48.22 ? 430 HIS B CB 1 ATOM 6866 C CG . HIS B 1 387 ? 5.871 72.826 88.515 1.00 51.82 ? 430 HIS B CG 1 ATOM 6867 N ND1 . HIS B 1 387 ? 5.804 74.187 88.310 1.00 59.81 ? 430 HIS B ND1 1 ATOM 6868 C CD2 . HIS B 1 387 ? 7.015 72.606 89.205 1.00 63.21 ? 430 HIS B CD2 1 ATOM 6869 C CE1 . HIS B 1 387 ? 6.858 74.766 88.857 1.00 56.04 ? 430 HIS B CE1 1 ATOM 6870 N NE2 . HIS B 1 387 ? 7.609 73.829 89.405 1.00 77.27 ? 430 HIS B NE2 1 ATOM 6871 N N . CYS B 1 388 ? 2.648 70.924 85.395 1.00 50.06 ? 431 CYS B N 1 ATOM 6872 C CA . CYS B 1 388 ? 1.840 69.793 84.973 1.00 52.25 ? 431 CYS B CA 1 ATOM 6873 C C . CYS B 1 388 ? 2.180 69.383 83.541 1.00 65.27 ? 431 CYS B C 1 ATOM 6874 O O . CYS B 1 388 ? 3.016 69.996 82.873 1.00 69.78 ? 431 CYS B O 1 ATOM 6875 C CB . CYS B 1 388 ? 0.364 70.136 85.117 1.00 51.36 ? 431 CYS B CB 1 ATOM 6876 S SG . CYS B 1 388 ? -0.170 70.252 86.828 1.00 69.53 ? 431 CYS B SG 1 ATOM 6877 N N . LEU B 1 389 ? 1.527 68.320 83.062 1.00 55.05 ? 432 LEU B N 1 ATOM 6878 C CA . LEU B 1 389 ? 2.020 67.640 81.870 1.00 60.86 ? 432 LEU B CA 1 ATOM 6879 C C . LEU B 1 389 ? 2.052 68.489 80.605 1.00 85.01 ? 432 LEU B C 1 ATOM 6880 O O . LEU B 1 389 ? 3.067 69.122 80.297 1.00 98.52 ? 432 LEU B O 1 ATOM 6881 C CB . LEU B 1 389 ? 1.155 66.405 81.596 1.00 50.82 ? 432 LEU B CB 1 ATOM 6882 C CG . LEU B 1 389 ? 1.237 65.200 82.529 1.00 47.27 ? 432 LEU B CG 1 ATOM 6883 C CD1 . LEU B 1 389 ? -0.012 64.339 82.395 1.00 45.01 ? 432 LEU B CD1 1 ATOM 6884 C CD2 . LEU B 1 389 ? 2.474 64.389 82.193 1.00 36.41 ? 432 LEU B CD2 1 ATOM 6885 N N . LYS B 1 390 ? 0.943 68.502 79.866 1.00 85.70 ? 433 LYS B N 1 ATOM 6886 C CA . LYS B 1 390 ? 0.776 69.351 78.692 1.00 59.56 ? 433 LYS B CA 1 ATOM 6887 C C . LYS B 1 390 ? -0.672 69.803 78.575 1.00 55.98 ? 433 LYS B C 1 ATOM 6888 O O . LYS B 1 390 ? -0.992 70.986 78.719 1.00 47.39 ? 433 LYS B O 1 ATOM 6889 C CB . LYS B 1 390 ? 1.214 68.608 77.426 1.00 95.79 ? 433 LYS B CB 1 ATOM 6890 C CG . LYS B 1 390 ? 0.873 69.318 76.119 1.00 103.92 ? 433 LYS B CG 1 ATOM 6891 C CD . LYS B 1 390 ? 1.818 70.476 75.834 1.00 98.97 ? 433 LYS B CD 1 ATOM 6892 C CE . LYS B 1 390 ? 1.762 70.876 74.364 1.00 83.42 ? 433 LYS B CE 1 ATOM 6893 N NZ . LYS B 1 390 ? 2.733 71.958 74.036 1.00 71.96 1 433 LYS B NZ 1 ATOM 6894 N N . SER B 1 391 ? -1.548 68.832 78.295 1.00 50.73 ? 434 SER B N 1 ATOM 6895 C CA . SER B 1 391 ? -2.954 69.122 78.045 1.00 47.97 ? 434 SER B CA 1 ATOM 6896 C C . SER B 1 391 ? -3.656 69.593 79.310 1.00 55.14 ? 434 SER B C 1 ATOM 6897 O O . SER B 1 391 ? -4.432 70.555 79.273 1.00 49.47 ? 434 SER B O 1 ATOM 6898 C CB . SER B 1 391 ? -3.642 67.883 77.471 1.00 46.92 ? 434 SER B CB 1 ATOM 6899 O OG . SER B 1 391 ? -2.931 67.389 76.348 1.00 54.71 ? 434 SER B OG 1 ATOM 6900 N N . TRP B 1 392 ? -3.398 68.927 80.439 1.00 57.82 ? 435 TRP B N 1 ATOM 6901 C CA . TRP B 1 392 ? -3.981 69.361 81.704 1.00 40.87 ? 435 TRP B CA 1 ATOM 6902 C C . TRP B 1 392 ? -3.676 70.833 81.949 1.00 54.28 ? 435 TRP B C 1 ATOM 6903 O O . TRP B 1 392 ? -4.576 71.634 82.230 1.00 48.76 ? 435 TRP B O 1 ATOM 6904 C CB . TRP B 1 392 ? -3.442 68.500 82.850 1.00 53.02 ? 435 TRP B CB 1 ATOM 6905 C CG . TRP B 1 392 ? -4.384 68.315 84.020 1.00 52.77 ? 435 TRP B CG 1 ATOM 6906 C CD1 . TRP B 1 392 ? -4.987 67.153 84.406 1.00 66.21 ? 435 TRP B CD1 1 ATOM 6907 C CD2 . TRP B 1 392 ? -4.826 69.320 84.942 1.00 39.85 ? 435 TRP B CD2 1 ATOM 6908 N NE1 . TRP B 1 392 ? -5.771 67.370 85.513 1.00 56.89 ? 435 TRP B NE1 1 ATOM 6909 C CE2 . TRP B 1 392 ? -5.691 68.692 85.860 1.00 58.78 ? 435 TRP B CE2 1 ATOM 6910 C CE3 . TRP B 1 392 ? -4.573 70.688 85.082 1.00 41.51 ? 435 TRP B CE3 1 ATOM 6911 C CZ2 . TRP B 1 392 ? -6.304 69.385 86.902 1.00 63.02 ? 435 TRP B CZ2 1 ATOM 6912 C CZ3 . TRP B 1 392 ? -5.181 71.373 86.118 1.00 54.47 ? 435 TRP B CZ3 1 ATOM 6913 C CH2 . TRP B 1 392 ? -6.037 70.721 87.015 1.00 47.71 ? 435 TRP B CH2 1 ATOM 6914 N N . SER B 1 393 ? -2.402 71.210 81.822 1.00 44.95 ? 436 SER B N 1 ATOM 6915 C CA . SER B 1 393 ? -2.005 72.592 82.071 1.00 41.74 ? 436 SER B CA 1 ATOM 6916 C C . SER B 1 393 ? -2.753 73.551 81.152 1.00 49.32 ? 436 SER B C 1 ATOM 6917 O O . SER B 1 393 ? -3.316 74.553 81.607 1.00 56.18 ? 436 SER B O 1 ATOM 6918 C CB . SER B 1 393 ? -0.494 72.737 81.891 1.00 37.85 ? 436 SER B CB 1 ATOM 6919 O OG . SER B 1 393 ? -0.070 74.065 82.143 1.00 51.33 ? 436 SER B OG 1 ATOM 6920 N N . TRP B 1 394 ? -2.780 73.249 79.852 1.00 56.55 ? 437 TRP B N 1 ATOM 6921 C CA . TRP B 1 394 ? -3.407 74.150 78.888 1.00 43.59 ? 437 TRP B CA 1 ATOM 6922 C C . TRP B 1 394 ? -4.903 74.294 79.142 1.00 44.29 ? 437 TRP B C 1 ATOM 6923 O O . TRP B 1 394 ? -5.460 75.390 79.000 1.00 58.93 ? 437 TRP B O 1 ATOM 6924 C CB . TRP B 1 394 ? -3.136 73.653 77.471 1.00 54.22 ? 437 TRP B CB 1 ATOM 6925 C CG . TRP B 1 394 ? -1.764 74.018 76.987 1.00 56.83 ? 437 TRP B CG 1 ATOM 6926 C CD1 . TRP B 1 394 ? -0.573 73.555 77.471 1.00 54.48 ? 437 TRP B CD1 1 ATOM 6927 C CD2 . TRP B 1 394 ? -1.439 74.926 75.929 1.00 67.17 ? 437 TRP B CD2 1 ATOM 6928 N NE1 . TRP B 1 394 ? 0.472 74.118 76.779 1.00 58.20 ? 437 TRP B NE1 1 ATOM 6929 C CE2 . TRP B 1 394 ? -0.032 74.962 75.826 1.00 67.78 ? 437 TRP B CE2 1 ATOM 6930 C CE3 . TRP B 1 394 ? -2.200 75.710 75.057 1.00 54.61 ? 437 TRP B CE3 1 ATOM 6931 C CZ2 . TRP B 1 394 ? 0.627 75.752 74.888 1.00 61.29 ? 437 TRP B CZ2 1 ATOM 6932 C CZ3 . TRP B 1 394 ? -1.544 76.493 74.129 1.00 57.63 ? 437 TRP B CZ3 1 ATOM 6933 C CH2 . TRP B 1 394 ? -0.144 76.509 74.051 1.00 57.84 ? 437 TRP B CH2 1 ATOM 6934 N N . ASN B 1 395 ? -5.574 73.202 79.514 1.00 47.82 ? 438 ASN B N 1 ATOM 6935 C CA . ASN B 1 395 ? -6.988 73.299 79.861 1.00 52.08 ? 438 ASN B CA 1 ATOM 6936 C C . ASN B 1 395 ? -7.190 74.114 81.132 1.00 59.64 ? 438 ASN B C 1 ATOM 6937 O O . ASN B 1 395 ? -8.170 74.859 81.249 1.00 58.74 ? 438 ASN B O 1 ATOM 6938 C CB . ASN B 1 395 ? -7.599 71.907 80.009 1.00 34.49 ? 438 ASN B CB 1 ATOM 6939 C CG . ASN B 1 395 ? -7.858 71.248 78.678 1.00 51.43 ? 438 ASN B CG 1 ATOM 6940 O OD1 . ASN B 1 395 ? -8.957 71.345 78.128 1.00 58.59 ? 438 ASN B OD1 1 ATOM 6941 N ND2 . ASN B 1 395 ? -6.844 70.584 78.140 1.00 57.90 ? 438 ASN B ND2 1 ATOM 6942 N N . TYR B 1 396 ? -6.285 73.979 82.104 1.00 50.35 ? 439 TYR B N 1 ATOM 6943 C CA . TYR B 1 396 ? -6.373 74.818 83.293 1.00 55.73 ? 439 TYR B CA 1 ATOM 6944 C C . TYR B 1 396 ? -6.265 76.295 82.920 1.00 55.24 ? 439 TYR B C 1 ATOM 6945 O O . TYR B 1 396 ? -7.129 77.101 83.282 1.00 53.94 ? 439 TYR B O 1 ATOM 6946 C CB . TYR B 1 396 ? -5.297 74.415 84.305 1.00 58.53 ? 439 TYR B CB 1 ATOM 6947 C CG . TYR B 1 396 ? -5.498 75.032 85.672 1.00 45.25 ? 439 TYR B CG 1 ATOM 6948 C CD1 . TYR B 1 396 ? -6.457 74.539 86.544 1.00 41.21 ? 439 TYR B CD1 1 ATOM 6949 C CD2 . TYR B 1 396 ? -4.725 76.104 86.089 1.00 54.31 ? 439 TYR B CD2 1 ATOM 6950 C CE1 . TYR B 1 396 ? -6.649 75.103 87.788 1.00 34.14 ? 439 TYR B CE1 1 ATOM 6951 C CE2 . TYR B 1 396 ? -4.907 76.673 87.332 1.00 51.83 ? 439 TYR B CE2 1 ATOM 6952 C CZ . TYR B 1 396 ? -5.870 76.171 88.178 1.00 53.02 ? 439 TYR B CZ 1 ATOM 6953 O OH . TYR B 1 396 ? -6.049 76.745 89.419 1.00 55.11 ? 439 TYR B OH 1 ATOM 6954 N N . TYR B 1 397 ? -5.210 76.665 82.188 1.00 40.87 ? 440 TYR B N 1 ATOM 6955 C CA . TYR B 1 397 ? -5.067 78.038 81.707 1.00 45.31 ? 440 TYR B CA 1 ATOM 6956 C C . TYR B 1 397 ? -6.348 78.517 81.036 1.00 43.69 ? 440 TYR B C 1 ATOM 6957 O O . TYR B 1 397 ? -6.870 79.595 81.348 1.00 56.06 ? 440 TYR B O 1 ATOM 6958 C CB . TYR B 1 397 ? -3.891 78.123 80.730 1.00 43.39 ? 440 TYR B CB 1 ATOM 6959 C CG . TYR B 1 397 ? -3.104 79.418 80.764 1.00 53.03 ? 440 TYR B CG 1 ATOM 6960 C CD1 . TYR B 1 397 ? -2.091 79.606 81.695 1.00 58.06 ? 440 TYR B CD1 1 ATOM 6961 C CD2 . TYR B 1 397 ? -3.348 80.435 79.848 1.00 49.89 ? 440 TYR B CD2 1 ATOM 6962 C CE1 . TYR B 1 397 ? -1.356 80.777 81.730 1.00 59.28 ? 440 TYR B CE1 1 ATOM 6963 C CE2 . TYR B 1 397 ? -2.615 81.616 79.876 1.00 51.93 ? 440 TYR B CE2 1 ATOM 6964 C CZ . TYR B 1 397 ? -1.620 81.778 80.821 1.00 59.53 ? 440 TYR B CZ 1 ATOM 6965 O OH . TYR B 1 397 ? -0.880 82.938 80.867 1.00 53.29 ? 440 TYR B OH 1 ATOM 6966 N N . ARG B 1 398 ? -6.873 77.715 80.108 1.00 48.35 ? 441 ARG B N 1 ATOM 6967 C CA . ARG B 1 398 ? -8.101 78.082 79.412 1.00 44.39 ? 441 ARG B CA 1 ATOM 6968 C C . ARG B 1 398 ? -9.246 78.321 80.390 1.00 52.28 ? 441 ARG B C 1 ATOM 6969 O O . ARG B 1 398 ? -10.043 79.253 80.214 1.00 59.05 ? 441 ARG B O 1 ATOM 6970 C CB . ARG B 1 398 ? -8.452 76.987 78.401 1.00 43.27 ? 441 ARG B CB 1 ATOM 6971 C CG . ARG B 1 398 ? -9.764 77.167 77.655 1.00 67.98 ? 441 ARG B CG 1 ATOM 6972 C CD . ARG B 1 398 ? -9.725 76.401 76.332 1.00 70.47 ? 441 ARG B CD 1 ATOM 6973 N NE . ARG B 1 398 ? -11.056 76.122 75.800 1.00 69.52 ? 441 ARG B NE 1 ATOM 6974 C CZ . ARG B 1 398 ? -11.634 74.925 75.826 1.00 75.14 ? 441 ARG B CZ 1 ATOM 6975 N NH1 . ARG B 1 398 ? -10.996 73.889 76.351 1.00 77.70 1 441 ARG B NH1 1 ATOM 6976 N NH2 . ARG B 1 398 ? -12.849 74.761 75.320 1.00 80.11 ? 441 ARG B NH2 1 ATOM 6977 N N . ILE B 1 399 ? -9.330 77.503 81.442 1.00 60.70 ? 442 ILE B N 1 ATOM 6978 C CA . ILE B 1 399 ? -10.433 77.617 82.392 1.00 54.77 ? 442 ILE B CA 1 ATOM 6979 C C . ILE B 1 399 ? -10.302 78.886 83.227 1.00 58.74 ? 442 ILE B C 1 ATOM 6980 O O . ILE B 1 399 ? -11.233 79.697 83.299 1.00 58.45 ? 442 ILE B O 1 ATOM 6981 C CB . ILE B 1 399 ? -10.506 76.363 83.279 1.00 50.84 ? 442 ILE B CB 1 ATOM 6982 C CG1 . ILE B 1 399 ? -10.733 75.120 82.417 1.00 46.27 ? 442 ILE B CG1 1 ATOM 6983 C CG2 . ILE B 1 399 ? -11.603 76.510 84.322 1.00 59.03 ? 442 ILE B CG2 1 ATOM 6984 C CD1 . ILE B 1 399 ? -10.771 73.832 83.207 1.00 61.22 ? 442 ILE B CD1 1 ATOM 6985 N N . VAL B 1 400 ? -9.149 79.077 83.875 1.00 55.86 ? 443 VAL B N 1 ATOM 6986 C CA . VAL B 1 400 ? -8.969 80.269 84.700 1.00 51.13 ? 443 VAL B CA 1 ATOM 6987 C C . VAL B 1 400 ? -9.186 81.519 83.862 1.00 59.89 ? 443 VAL B C 1 ATOM 6988 O O . VAL B 1 400 ? -9.813 82.486 84.312 1.00 59.92 ? 443 VAL B O 1 ATOM 6989 C CB . VAL B 1 400 ? -7.583 80.268 85.374 1.00 54.88 ? 443 VAL B CB 1 ATOM 6990 C CG1 . VAL B 1 400 ? -7.288 78.903 85.988 1.00 66.14 ? 443 VAL B CG1 1 ATOM 6991 C CG2 . VAL B 1 400 ? -6.502 80.680 84.399 1.00 60.64 ? 443 VAL B CG2 1 ATOM 6992 N N . ALA B 1 401 ? -8.672 81.520 82.628 1.00 58.90 ? 444 ALA B N 1 ATOM 6993 C CA . ALA B 1 401 ? -8.896 82.653 81.739 1.00 51.43 ? 444 ALA B CA 1 ATOM 6994 C C . ALA B 1 401 ? -10.384 82.873 81.492 1.00 48.95 ? 444 ALA B C 1 ATOM 6995 O O . ALA B 1 401 ? -10.867 84.010 81.536 1.00 58.84 ? 444 ALA B O 1 ATOM 6996 C CB . ALA B 1 401 ? -8.156 82.439 80.419 1.00 57.11 ? 444 ALA B CB 1 ATOM 6997 N N . ARG B 1 402 ? -11.130 81.796 81.236 1.00 47.46 ? 445 ARG B N 1 ATOM 6998 C CA . ARG B 1 402 ? -12.561 81.942 80.987 1.00 54.24 ? 445 ARG B CA 1 ATOM 6999 C C . ARG B 1 402 ? -13.296 82.480 82.213 1.00 46.80 ? 445 ARG B C 1 ATOM 7000 O O . ARG B 1 402 ? -14.218 83.293 82.088 1.00 48.81 ? 445 ARG B O 1 ATOM 7001 C CB . ARG B 1 402 ? -13.146 80.598 80.544 1.00 40.15 ? 445 ARG B CB 1 ATOM 7002 C CG . ARG B 1 402 ? -14.654 80.469 80.710 1.00 42.90 ? 445 ARG B CG 1 ATOM 7003 C CD . ARG B 1 402 ? -15.422 81.434 79.828 1.00 49.13 ? 445 ARG B CD 1 ATOM 7004 N NE . ARG B 1 402 ? -16.864 81.262 79.981 1.00 52.54 ? 445 ARG B NE 1 ATOM 7005 C CZ . ARG B 1 402 ? -17.581 81.820 80.952 1.00 62.25 ? 445 ARG B CZ 1 ATOM 7006 N NH1 . ARG B 1 402 ? -16.988 82.581 81.862 1.00 52.44 1 445 ARG B NH1 1 ATOM 7007 N NH2 . ARG B 1 402 ? -18.888 81.613 81.019 1.00 64.18 ? 445 ARG B NH2 1 ATOM 7008 N N . TYR B 1 403 ? -12.918 82.020 83.403 1.00 52.54 ? 446 TYR B N 1 ATOM 7009 C CA . TYR B 1 403 ? -13.650 82.294 84.634 1.00 56.16 ? 446 TYR B CA 1 ATOM 7010 C C . TYR B 1 403 ? -13.046 83.427 85.466 1.00 55.61 ? 446 TYR B C 1 ATOM 7011 O O . TYR B 1 403 ? -13.377 83.557 86.650 1.00 52.25 ? 446 TYR B O 1 ATOM 7012 C CB . TYR B 1 403 ? -13.813 81.003 85.433 1.00 47.97 ? 446 TYR B CB 1 ATOM 7013 C CG . TYR B 1 403 ? -14.832 80.124 84.748 1.00 56.34 ? 446 TYR B CG 1 ATOM 7014 C CD1 . TYR B 1 403 ? -16.181 80.462 84.761 1.00 61.56 ? 446 TYR B CD1 1 ATOM 7015 C CD2 . TYR B 1 403 ? -14.445 78.997 84.035 1.00 46.84 ? 446 TYR B CD2 1 ATOM 7016 C CE1 . TYR B 1 403 ? -17.121 79.686 84.111 1.00 51.54 ? 446 TYR B CE1 1 ATOM 7017 C CE2 . TYR B 1 403 ? -15.380 78.212 83.383 1.00 46.89 ? 446 TYR B CE2 1 ATOM 7018 C CZ . TYR B 1 403 ? -16.715 78.563 83.425 1.00 51.56 ? 446 TYR B CZ 1 ATOM 7019 O OH . TYR B 1 403 ? -17.651 77.788 82.781 1.00 66.62 ? 446 TYR B OH 1 ATOM 7020 N N . GLU B 1 404 ? -12.155 84.232 84.877 1.00 55.45 ? 447 GLU B N 1 ATOM 7021 C CA . GLU B 1 404 ? -11.389 85.241 85.606 1.00 63.03 ? 447 GLU B CA 1 ATOM 7022 C C . GLU B 1 404 ? -12.216 85.988 86.655 1.00 64.22 ? 447 GLU B C 1 ATOM 7023 O O . GLU B 1 404 ? -11.899 85.941 87.849 1.00 73.24 ? 447 GLU B O 1 ATOM 7024 C CB . GLU B 1 404 ? -10.758 86.231 84.614 1.00 64.38 ? 447 GLU B CB 1 ATOM 7025 C CG . GLU B 1 404 ? -11.740 86.981 83.719 1.00 75.68 ? 447 GLU B CG 1 ATOM 7026 C CD . GLU B 1 404 ? -11.063 88.047 82.862 1.00 86.11 ? 447 GLU B CD 1 ATOM 7027 O OE1 . GLU B 1 404 ? -9.839 88.250 83.012 1.00 71.98 ? 447 GLU B OE1 1 ATOM 7028 O OE2 . GLU B 1 404 ? -11.756 88.683 82.039 1.00 94.22 -1 447 GLU B OE2 1 ATOM 7029 N N . ASN B 1 405 ? -13.254 86.717 86.236 1.00 67.53 ? 448 ASN B N 1 ATOM 7030 C CA . ASN B 1 405 ? -14.019 87.506 87.201 1.00 63.64 ? 448 ASN B CA 1 ATOM 7031 C C . ASN B 1 405 ? -14.524 86.657 88.362 1.00 70.38 ? 448 ASN B C 1 ATOM 7032 O O . ASN B 1 405 ? -14.645 87.154 89.487 1.00 81.23 ? 448 ASN B O 1 ATOM 7033 C CB . ASN B 1 405 ? -15.201 88.196 86.514 1.00 77.93 ? 448 ASN B CB 1 ATOM 7034 C CG . ASN B 1 405 ? -14.764 89.226 85.492 1.00 91.06 ? 448 ASN B CG 1 ATOM 7035 O OD1 . ASN B 1 405 ? -14.559 88.910 84.320 1.00 93.48 ? 448 ASN B OD1 1 ATOM 7036 N ND2 . ASN B 1 405 ? -14.626 90.472 85.932 1.00 86.14 ? 448 ASN B ND2 1 ATOM 7037 N N . THR B 1 406 ? -14.813 85.376 88.117 1.00 69.27 ? 449 THR B N 1 ATOM 7038 C CA . THR B 1 406 ? -15.353 84.517 89.167 1.00 52.08 ? 449 THR B CA 1 ATOM 7039 C C . THR B 1 406 ? -14.264 84.007 90.103 1.00 52.49 ? 449 THR B C 1 ATOM 7040 O O . THR B 1 406 ? -14.482 83.909 91.316 1.00 53.31 ? 449 THR B O 1 ATOM 7041 C CB . THR B 1 406 ? -16.111 83.341 88.555 1.00 43.73 ? 449 THR B CB 1 ATOM 7042 O OG1 . THR B 1 406 ? -17.198 83.834 87.762 1.00 65.18 ? 449 THR B OG1 1 ATOM 7043 C CG2 . THR B 1 406 ? -16.655 82.437 89.649 1.00 42.89 ? 449 THR B CG2 1 ATOM 7044 N N . LEU B 1 407 ? -13.097 83.668 89.567 1.00 51.09 ? 450 LEU B N 1 ATOM 7045 C CA . LEU B 1 407 ? -12.024 83.106 90.376 1.00 51.03 ? 450 LEU B CA 1 ATOM 7046 C C . LEU B 1 407 ? -11.311 84.227 91.128 1.00 53.83 ? 450 LEU B C 1 ATOM 7047 O O . LEU B 1 407 ? -10.687 85.100 90.514 1.00 55.45 ? 450 LEU B O 1 ATOM 7048 C CB . LEU B 1 407 ? -11.057 82.340 89.477 1.00 44.97 ? 450 LEU B CB 1 ATOM 7049 C CG . LEU B 1 407 ? -9.708 81.882 90.021 1.00 56.76 ? 450 LEU B CG 1 ATOM 7050 C CD1 . LEU B 1 407 ? -9.231 80.681 89.228 1.00 61.94 ? 450 LEU B CD1 1 ATOM 7051 C CD2 . LEU B 1 407 ? -8.692 83.014 89.933 1.00 41.74 ? 450 LEU B CD2 1 ATOM 7052 N N . ALA B 1 408 ? -11.398 84.197 92.460 1.00 53.16 ? 451 ALA B N 1 ATOM 7053 C CA . ALA B 1 408 ? -10.838 85.273 93.272 1.00 40.77 ? 451 ALA B CA 1 ATOM 7054 C C . ALA B 1 408 ? -9.351 85.081 93.556 1.00 47.69 ? 451 ALA B C 1 ATOM 7055 O O . ALA B 1 408 ? -8.584 86.050 93.518 1.00 57.80 ? 451 ALA B O 1 ATOM 7056 C CB . ALA B 1 408 ? -11.619 85.403 94.578 1.00 46.97 ? 451 ALA B CB 1 ATOM 7057 N N . ALA B 1 409 ? -8.924 83.858 93.866 1.00 44.46 ? 452 ALA B N 1 ATOM 7058 C CA . ALA B 1 409 ? -7.530 83.626 94.221 1.00 43.60 ? 452 ALA B CA 1 ATOM 7059 C C . ALA B 1 409 ? -7.190 82.159 94.009 1.00 48.03 ? 452 ALA B C 1 ATOM 7060 O O . ALA B 1 409 ? -8.074 81.308 93.875 1.00 43.36 ? 452 ALA B O 1 ATOM 7061 C CB . ALA B 1 409 ? -7.240 84.041 95.666 1.00 43.72 ? 452 ALA B CB 1 ATOM 7062 N N . GLN B 1 410 ? -5.887 81.877 93.966 1.00 35.11 ? 453 GLN B N 1 ATOM 7063 C CA . GLN B 1 410 ? -5.390 80.519 93.799 1.00 42.28 ? 453 GLN B CA 1 ATOM 7064 C C . GLN B 1 410 ? -4.133 80.322 94.629 1.00 48.20 ? 453 GLN B C 1 ATOM 7065 O O . GLN B 1 410 ? -3.257 81.192 94.658 1.00 53.74 ? 453 GLN B O 1 ATOM 7066 C CB . GLN B 1 410 ? -5.075 80.207 92.339 1.00 49.26 ? 453 GLN B CB 1 ATOM 7067 C CG . GLN B 1 410 ? -6.246 80.350 91.406 1.00 46.62 ? 453 GLN B CG 1 ATOM 7068 C CD . GLN B 1 410 ? -5.811 80.278 89.966 1.00 51.12 ? 453 GLN B CD 1 ATOM 7069 O OE1 . GLN B 1 410 ? -5.175 79.309 89.547 1.00 49.72 ? 453 GLN B OE1 1 ATOM 7070 N NE2 . GLN B 1 410 ? -6.126 81.315 89.201 1.00 49.72 ? 453 GLN B NE2 1 ATOM 7071 N N . PHE B 1 411 ? -4.039 79.166 95.282 1.00 42.83 ? 454 PHE B N 1 ATOM 7072 C CA . PHE B 1 411 ? -2.935 78.858 96.178 1.00 42.40 ? 454 PHE B CA 1 ATOM 7073 C C . PHE B 1 411 ? -2.396 77.471 95.866 1.00 44.92 ? 454 PHE B C 1 ATOM 7074 O O . PHE B 1 411 ? -3.168 76.528 95.660 1.00 48.48 ? 454 PHE B O 1 ATOM 7075 C CB . PHE B 1 411 ? -3.386 78.942 97.636 1.00 39.28 ? 454 PHE B CB 1 ATOM 7076 C CG . PHE B 1 411 ? -4.126 80.207 97.965 1.00 44.45 ? 454 PHE B CG 1 ATOM 7077 C CD1 . PHE B 1 411 ? -5.484 80.316 97.715 1.00 34.09 ? 454 PHE B CD1 1 ATOM 7078 C CD2 . PHE B 1 411 ? -3.465 81.286 98.528 1.00 47.44 ? 454 PHE B CD2 1 ATOM 7079 C CE1 . PHE B 1 411 ? -6.167 81.474 98.016 1.00 35.58 ? 454 PHE B CE1 1 ATOM 7080 C CE2 . PHE B 1 411 ? -4.145 82.448 98.834 1.00 37.77 ? 454 PHE B CE2 1 ATOM 7081 C CZ . PHE B 1 411 ? -5.498 82.541 98.577 1.00 38.40 ? 454 PHE B CZ 1 ATOM 7082 N N . PHE B 1 412 ? -1.070 77.351 95.833 1.00 34.79 ? 455 PHE B N 1 ATOM 7083 C CA . PHE B 1 412 ? -0.418 76.091 95.506 1.00 33.75 ? 455 PHE B CA 1 ATOM 7084 C C . PHE B 1 412 ? 0.901 75.986 96.252 1.00 36.36 ? 455 PHE B C 1 ATOM 7085 O O . PHE B 1 412 ? 1.570 76.989 96.511 1.00 54.31 ? 455 PHE B O 1 ATOM 7086 C CB . PHE B 1 412 ? -0.164 75.949 94.001 1.00 41.98 ? 455 PHE B CB 1 ATOM 7087 C CG . PHE B 1 412 ? -1.409 75.754 93.188 1.00 39.87 ? 455 PHE B CG 1 ATOM 7088 C CD1 . PHE B 1 412 ? -1.993 74.503 93.087 1.00 50.56 ? 455 PHE B CD1 1 ATOM 7089 C CD2 . PHE B 1 412 ? -1.991 76.816 92.522 1.00 35.89 ? 455 PHE B CD2 1 ATOM 7090 C CE1 . PHE B 1 412 ? -3.137 74.315 92.336 1.00 52.19 ? 455 PHE B CE1 1 ATOM 7091 C CE2 . PHE B 1 412 ? -3.135 76.634 91.771 1.00 47.30 ? 455 PHE B CE2 1 ATOM 7092 C CZ . PHE B 1 412 ? -3.710 75.381 91.678 1.00 43.50 ? 455 PHE B CZ 1 ATOM 7093 N N . GLY B 1 413 ? 1.252 74.758 96.611 1.00 33.35 ? 456 GLY B N 1 ATOM 7094 C CA . GLY B 1 413 ? 2.519 74.464 97.249 1.00 42.47 ? 456 GLY B CA 1 ATOM 7095 C C . GLY B 1 413 ? 3.528 73.743 96.377 1.00 43.60 ? 456 GLY B C 1 ATOM 7096 O O . GLY B 1 413 ? 3.613 73.958 95.165 1.00 43.37 ? 456 GLY B O 1 ATOM 7097 N N . HIS B 1 414 ? 4.244 72.819 96.979 1.00 49.55 ? 457 HIS B N 1 ATOM 7098 C CA . HIS B 1 414 ? 5.124 71.948 96.255 1.00 41.24 ? 457 HIS B CA 1 ATOM 7099 C C . HIS B 1 414 ? 6.469 72.425 95.885 1.00 40.21 ? 457 HIS B C 1 ATOM 7100 O O . HIS B 1 414 ? 7.398 71.690 95.901 1.00 31.78 ? 457 HIS B O 1 ATOM 7101 C CB . HIS B 1 414 ? 4.407 71.488 95.006 1.00 42.36 ? 457 HIS B CB 1 ATOM 7102 C CG . HIS B 1 414 ? 5.041 70.308 94.362 1.00 57.47 ? 457 HIS B CG 1 ATOM 7103 N ND1 . HIS B 1 414 ? 5.398 69.185 95.068 1.00 73.97 ? 457 HIS B ND1 1 ATOM 7104 C CD2 . HIS B 1 414 ? 5.403 70.085 93.085 1.00 32.49 ? 457 HIS B CD2 1 ATOM 7105 C CE1 . HIS B 1 414 ? 5.959 68.323 94.246 1.00 73.40 ? 457 HIS B CE1 1 ATOM 7106 N NE2 . HIS B 1 414 ? 5.975 68.848 93.038 1.00 25.98 ? 457 HIS B NE2 1 ATOM 7107 N N . THR B 1 415 ? 6.574 73.670 95.525 1.00 47.30 ? 458 THR B N 1 ATOM 7108 C CA . THR B 1 415 ? 7.872 74.176 95.098 1.00 41.29 ? 458 THR B CA 1 ATOM 7109 C C . THR B 1 415 ? 8.849 74.191 96.260 1.00 48.88 ? 458 THR B C 1 ATOM 7110 O O . THR B 1 415 ? 10.063 74.077 96.054 1.00 39.33 ? 458 THR B O 1 ATOM 7111 C CB . THR B 1 415 ? 7.736 75.579 94.511 1.00 50.14 ? 458 THR B CB 1 ATOM 7112 O OG1 . THR B 1 415 ? 6.999 76.412 95.420 1.00 57.00 ? 458 THR B OG1 1 ATOM 7113 C CG2 . THR B 1 415 ? 7.022 75.529 93.166 1.00 44.94 ? 458 THR B CG2 1 ATOM 7114 N N . HIS B 1 416 ? 8.337 74.400 97.467 1.00 47.63 ? 459 HIS B N 1 ATOM 7115 C CA . HIS B 1 416 ? 9.192 74.486 98.641 1.00 37.46 ? 459 HIS B CA 1 ATOM 7116 C C . HIS B 1 416 ? 9.870 75.860 98.686 1.00 51.63 ? 459 HIS B C 1 ATOM 7117 O O . HIS B 1 416 ? 10.612 76.163 99.620 1.00 55.65 ? 459 HIS B O 1 ATOM 7118 C CB . HIS B 1 416 ? 10.244 73.377 98.624 1.00 42.82 ? 459 HIS B CB 1 ATOM 7119 C CG . HIS B 1 416 ? 9.717 72.038 99.037 1.00 55.89 ? 459 HIS B CG 1 ATOM 7120 N ND1 . HIS B 1 416 ? 10.483 71.114 99.714 1.00 34.83 ? 459 HIS B ND1 1 ATOM 7121 C CD2 . HIS B 1 416 ? 8.501 71.468 98.868 1.00 59.51 ? 459 HIS B CD2 1 ATOM 7122 C CE1 . HIS B 1 416 ? 9.761 70.032 99.945 1.00 46.32 ? 459 HIS B CE1 1 ATOM 7123 N NE2 . HIS B 1 416 ? 8.554 70.221 99.442 1.00 41.38 ? 459 HIS B NE2 1 ATOM 7124 N N . VAL B 1 417 ? 9.609 76.685 97.672 1.00 62.26 ? 460 VAL B N 1 ATOM 7125 C CA . VAL B 1 417 ? 10.187 78.020 97.591 1.00 49.18 ? 460 VAL B CA 1 ATOM 7126 C C . VAL B 1 417 ? 9.071 79.034 97.365 1.00 49.58 ? 460 VAL B C 1 ATOM 7127 O O . VAL B 1 417 ? 7.960 78.697 96.943 1.00 42.60 ? 460 VAL B O 1 ATOM 7128 C CB . VAL B 1 417 ? 11.249 78.130 96.480 1.00 44.02 ? 460 VAL B CB 1 ATOM 7129 C CG1 . VAL B 1 417 ? 12.465 77.290 96.824 1.00 43.29 ? 460 VAL B CG1 1 ATOM 7130 C CG2 . VAL B 1 417 ? 10.661 77.706 95.148 1.00 45.22 ? 460 VAL B CG2 1 ATOM 7131 N N . ASP B 1 418 ? 9.392 80.298 97.636 1.00 43.42 ? 461 ASP B N 1 ATOM 7132 C CA . ASP B 1 418 ? 8.409 81.378 97.652 1.00 40.60 ? 461 ASP B CA 1 ATOM 7133 C C . ASP B 1 418 ? 8.399 82.062 96.289 1.00 43.84 ? 461 ASP B C 1 ATOM 7134 O O . ASP B 1 418 ? 9.350 82.768 95.938 1.00 56.26 ? 461 ASP B O 1 ATOM 7135 C CB . ASP B 1 418 ? 8.749 82.372 98.759 1.00 52.09 ? 461 ASP B CB 1 ATOM 7136 C CG . ASP B 1 418 ? 7.700 83.447 98.923 1.00 53.91 ? 461 ASP B CG 1 ATOM 7137 O OD1 . ASP B 1 418 ? 6.813 83.557 98.049 1.00 60.46 ? 461 ASP B OD1 1 ATOM 7138 O OD2 . ASP B 1 418 ? 7.774 84.198 99.920 1.00 31.58 -1 461 ASP B OD2 1 ATOM 7139 N N . GLU B 1 419 ? 7.313 81.889 95.541 1.00 50.47 ? 462 GLU B N 1 ATOM 7140 C CA . GLU B 1 419 ? 7.202 82.434 94.191 1.00 38.50 ? 462 GLU B CA 1 ATOM 7141 C C . GLU B 1 419 ? 5.724 82.512 93.819 1.00 38.53 ? 462 GLU B C 1 ATOM 7142 O O . GLU B 1 419 ? 4.843 82.313 94.662 1.00 47.92 ? 462 GLU B O 1 ATOM 7143 C CB . GLU B 1 419 ? 8.011 81.590 93.201 1.00 37.64 ? 462 GLU B CB 1 ATOM 7144 C CG . GLU B 1 419 ? 7.649 80.114 93.203 1.00 46.40 ? 462 GLU B CG 1 ATOM 7145 C CD . GLU B 1 419 ? 8.467 79.308 92.205 1.00 68.80 ? 462 GLU B CD 1 ATOM 7146 O OE1 . GLU B 1 419 ? 9.051 79.913 91.277 1.00 64.29 ? 462 GLU B OE1 1 ATOM 7147 O OE2 . GLU B 1 419 ? 8.531 78.067 92.356 1.00 63.47 -1 462 GLU B OE2 1 ATOM 7148 N N . PHE B 1 420 ? 5.449 82.835 92.556 1.00 49.22 ? 463 PHE B N 1 ATOM 7149 C CA . PHE B 1 420 ? 4.084 82.957 92.065 1.00 45.65 ? 463 PHE B CA 1 ATOM 7150 C C . PHE B 1 420 ? 4.059 82.624 90.578 1.00 47.68 ? 463 PHE B C 1 ATOM 7151 O O . PHE B 1 420 ? 5.092 82.337 89.966 1.00 51.84 ? 463 PHE B O 1 ATOM 7152 C CB . PHE B 1 420 ? 3.530 84.358 92.320 1.00 38.92 ? 463 PHE B CB 1 ATOM 7153 C CG . PHE B 1 420 ? 4.377 85.453 91.743 1.00 38.36 ? 463 PHE B CG 1 ATOM 7154 C CD1 . PHE B 1 420 ? 5.452 85.961 92.452 1.00 43.50 ? 463 PHE B CD1 1 ATOM 7155 C CD2 . PHE B 1 420 ? 4.094 85.982 90.497 1.00 44.98 ? 463 PHE B CD2 1 ATOM 7156 C CE1 . PHE B 1 420 ? 6.236 86.969 91.924 1.00 36.95 ? 463 PHE B CE1 1 ATOM 7157 C CE2 . PHE B 1 420 ? 4.875 86.994 89.964 1.00 43.21 ? 463 PHE B CE2 1 ATOM 7158 C CZ . PHE B 1 420 ? 5.948 87.486 90.679 1.00 39.07 ? 463 PHE B CZ 1 ATOM 7159 N N . GLU B 1 421 ? 2.859 82.657 90.000 1.00 42.81 ? 464 GLU B N 1 ATOM 7160 C CA . GLU B 1 421 ? 2.666 82.427 88.575 1.00 41.02 ? 464 GLU B CA 1 ATOM 7161 C C . GLU B 1 421 ? 1.541 83.323 88.079 1.00 49.19 ? 464 GLU B C 1 ATOM 7162 O O . GLU B 1 421 ? 0.495 83.432 88.726 1.00 53.08 ? 464 GLU B O 1 ATOM 7163 C CB . GLU B 1 421 ? 2.360 80.952 88.281 1.00 33.08 ? 464 GLU B CB 1 ATOM 7164 C CG . GLU B 1 421 ? 3.578 80.051 88.420 1.00 47.93 ? 464 GLU B CG 1 ATOM 7165 C CD . GLU B 1 421 ? 3.291 78.610 88.050 1.00 64.69 ? 464 GLU B CD 1 ATOM 7166 O OE1 . GLU B 1 421 ? 2.100 78.265 87.914 1.00 56.47 ? 464 GLU B OE1 1 ATOM 7167 O OE2 . GLU B 1 421 ? 4.255 77.826 87.893 1.00 52.48 -1 464 GLU B OE2 1 ATOM 7168 N N . VAL B 1 422 ? 1.757 83.961 86.929 1.00 49.89 ? 465 VAL B N 1 ATOM 7169 C CA . VAL B 1 422 ? 0.830 84.943 86.375 1.00 39.62 ? 465 VAL B CA 1 ATOM 7170 C C . VAL B 1 422 ? 0.101 84.328 85.189 1.00 42.10 ? 465 VAL B C 1 ATOM 7171 O O . VAL B 1 422 ? 0.724 83.700 84.324 1.00 57.47 ? 465 VAL B O 1 ATOM 7172 C CB . VAL B 1 422 ? 1.559 86.227 85.947 1.00 43.58 ? 465 VAL B CB 1 ATOM 7173 C CG1 . VAL B 1 422 ? 0.552 87.310 85.590 1.00 46.35 ? 465 VAL B CG1 1 ATOM 7174 C CG2 . VAL B 1 422 ? 2.507 86.694 87.038 1.00 39.74 ? 465 VAL B CG2 1 ATOM 7175 N N . PHE B 1 423 ? -1.216 84.506 85.153 1.00 42.88 ? 466 PHE B N 1 ATOM 7176 C CA . PHE B 1 423 ? -2.049 84.053 84.047 1.00 46.29 ? 466 PHE B CA 1 ATOM 7177 C C . PHE B 1 423 ? -2.436 85.237 83.172 1.00 47.43 ? 466 PHE B C 1 ATOM 7178 O O . PHE B 1 423 ? -2.749 86.319 83.678 1.00 57.21 ? 466 PHE B O 1 ATOM 7179 C CB . PHE B 1 423 ? -3.309 83.353 84.560 1.00 50.88 ? 466 PHE B CB 1 ATOM 7180 C CG . PHE B 1 423 ? -3.036 82.071 85.289 1.00 42.96 ? 466 PHE B CG 1 ATOM 7181 C CD1 . PHE B 1 423 ? -2.430 82.079 86.530 1.00 51.29 ? 466 PHE B CD1 1 ATOM 7182 C CD2 . PHE B 1 423 ? -3.385 80.858 84.729 1.00 52.11 ? 466 PHE B CD2 1 ATOM 7183 C CE1 . PHE B 1 423 ? -2.178 80.900 87.197 1.00 53.43 ? 466 PHE B CE1 1 ATOM 7184 C CE2 . PHE B 1 423 ? -3.138 79.680 85.391 1.00 48.25 ? 466 PHE B CE2 1 ATOM 7185 C CZ . PHE B 1 423 ? -2.533 79.699 86.626 1.00 55.00 ? 466 PHE B CZ 1 ATOM 7186 N N . TYR B 1 424 ? -2.438 85.022 81.862 1.00 53.84 ? 467 TYR B N 1 ATOM 7187 C CA . TYR B 1 424 ? -2.783 86.059 80.898 1.00 48.41 ? 467 TYR B CA 1 ATOM 7188 C C . TYR B 1 424 ? -4.028 85.662 80.114 1.00 51.89 ? 467 TYR B C 1 ATOM 7189 O O . TYR B 1 424 ? -4.556 84.556 80.249 1.00 61.00 ? 467 TYR B O 1 ATOM 7190 C CB . TYR B 1 424 ? -1.619 86.318 79.941 1.00 37.76 ? 467 TYR B CB 1 ATOM 7191 C CG . TYR B 1 424 ? -0.377 86.861 80.601 1.00 46.70 ? 467 TYR B CG 1 ATOM 7192 C CD1 . TYR B 1 424 ? 0.540 86.015 81.205 1.00 53.88 ? 467 TYR B CD1 1 ATOM 7193 C CD2 . TYR B 1 424 ? -0.117 88.224 80.611 1.00 47.51 ? 467 TYR B CD2 1 ATOM 7194 C CE1 . TYR B 1 424 ? 1.681 86.514 81.806 1.00 60.10 ? 467 TYR B CE1 1 ATOM 7195 C CE2 . TYR B 1 424 ? 1.017 88.730 81.208 1.00 44.35 ? 467 TYR B CE2 1 ATOM 7196 C CZ . TYR B 1 424 ? 1.913 87.872 81.803 1.00 45.82 ? 467 TYR B CZ 1 ATOM 7197 O OH . TYR B 1 424 ? 3.044 88.376 82.397 1.00 56.04 ? 467 TYR B OH 1 ATOM 7198 N N . ASP B 1 425 ? -4.483 86.586 79.272 1.00 58.60 ? 468 ASP B N 1 ATOM 7199 C CA . ASP B 1 425 ? -5.617 86.317 78.402 1.00 55.30 ? 468 ASP B CA 1 ATOM 7200 C C . ASP B 1 425 ? -5.214 85.345 77.302 1.00 53.59 ? 468 ASP B C 1 ATOM 7201 O O . ASP B 1 425 ? -4.095 85.396 76.784 1.00 53.47 ? 468 ASP B O 1 ATOM 7202 C CB . ASP B 1 425 ? -6.146 87.620 77.799 1.00 63.88 ? 468 ASP B CB 1 ATOM 7203 C CG . ASP B 1 425 ? -5.108 88.339 76.950 1.00 69.19 ? 468 ASP B CG 1 ATOM 7204 O OD1 . ASP B 1 425 ? -4.193 88.971 77.528 1.00 48.64 ? 468 ASP B OD1 1 ATOM 7205 O OD2 . ASP B 1 425 ? -5.211 88.271 75.705 1.00 59.78 -1 468 ASP B OD2 1 ATOM 7206 N N . GLU B 1 426 ? -6.141 84.455 76.941 1.00 62.72 ? 469 GLU B N 1 ATOM 7207 C CA . GLU B 1 426 ? -5.813 83.368 76.026 1.00 65.07 ? 469 GLU B CA 1 ATOM 7208 C C . GLU B 1 426 ? -5.594 83.847 74.597 1.00 74.10 ? 469 GLU B C 1 ATOM 7209 O O . GLU B 1 426 ? -4.975 83.126 73.806 1.00 66.76 ? 469 GLU B O 1 ATOM 7210 C CB . GLU B 1 426 ? -6.920 82.313 76.045 1.00 56.61 ? 469 GLU B CB 1 ATOM 7211 C CG . GLU B 1 426 ? -6.434 80.900 75.765 1.00 75.50 ? 469 GLU B CG 1 ATOM 7212 C CD . GLU B 1 426 ? -7.534 79.864 75.915 1.00 83.54 ? 469 GLU B CD 1 ATOM 7213 O OE1 . GLU B 1 426 ? -8.681 80.250 76.226 1.00 85.84 ? 469 GLU B OE1 1 ATOM 7214 O OE2 . GLU B 1 426 ? -7.252 78.664 75.710 1.00 79.85 -1 469 GLU B OE2 1 ATOM 7215 N N . GLU B 1 427 ? -6.074 85.042 74.250 1.00 75.26 ? 470 GLU B N 1 ATOM 7216 C CA . GLU B 1 427 ? -5.985 85.514 72.867 1.00 58.19 ? 470 GLU B CA 1 ATOM 7217 C C . GLU B 1 427 ? -4.634 86.166 72.585 1.00 66.00 ? 470 GLU B C 1 ATOM 7218 O O . GLU B 1 427 ? -3.804 85.614 71.856 1.00 77.27 ? 470 GLU B O 1 ATOM 7219 C CB . GLU B 1 427 ? -7.129 86.489 72.568 1.00 66.97 ? 470 GLU B CB 1 ATOM 7220 C CG . GLU B 1 427 ? -8.527 85.922 72.783 1.00 81.16 ? 470 GLU B CG 1 ATOM 7221 C CD . GLU B 1 427 ? -9.007 86.046 74.220 1.00 83.56 ? 470 GLU B CD 1 ATOM 7222 O OE1 . GLU B 1 427 ? -8.201 86.439 75.090 1.00 93.60 ? 470 GLU B OE1 1 ATOM 7223 O OE2 . GLU B 1 427 ? -10.196 85.759 74.476 1.00 74.80 -1 470 GLU B OE2 1 ATOM 7224 N N . THR B 1 428 ? -4.410 87.355 73.143 1.00 61.82 ? 471 THR B N 1 ATOM 7225 C CA . THR B 1 428 ? -3.185 88.106 72.903 1.00 60.18 ? 471 THR B CA 1 ATOM 7226 C C . THR B 1 428 ? -2.084 87.816 73.912 1.00 56.74 ? 471 THR B C 1 ATOM 7227 O O . THR B 1 428 ? -0.929 88.182 73.665 1.00 61.04 ? 471 THR B O 1 ATOM 7228 C CB . THR B 1 428 ? -3.479 89.607 72.925 1.00 65.82 ? 471 THR B CB 1 ATOM 7229 O OG1 . THR B 1 428 ? -3.723 90.021 74.277 1.00 48.69 ? 471 THR B OG1 1 ATOM 7230 C CG2 . THR B 1 428 ? -4.702 89.918 72.077 1.00 59.78 ? 471 THR B CG2 1 ATOM 7231 N N . LEU B 1 429 ? -2.403 87.174 75.032 1.00 58.68 ? 472 LEU B N 1 ATOM 7232 C CA . LEU B 1 429 ? -1.435 86.902 76.089 1.00 43.31 ? 472 LEU B CA 1 ATOM 7233 C C . LEU B 1 429 ? -0.746 88.173 76.581 1.00 56.63 ? 472 LEU B C 1 ATOM 7234 O O . LEU B 1 429 ? 0.386 88.115 77.070 1.00 62.23 ? 472 LEU B O 1 ATOM 7235 C CB . LEU B 1 429 ? -0.378 85.898 75.616 1.00 43.97 ? 472 LEU B CB 1 ATOM 7236 C CG . LEU B 1 429 ? -0.790 84.448 75.351 1.00 45.50 ? 472 LEU B CG 1 ATOM 7237 C CD1 . LEU B 1 429 ? 0.420 83.645 74.895 1.00 42.70 ? 472 LEU B CD1 1 ATOM 7238 C CD2 . LEU B 1 429 ? -1.428 83.812 76.571 1.00 47.48 ? 472 LEU B CD2 1 ATOM 7239 N N . SER B 1 430 ? -1.381 89.336 76.418 1.00 47.94 ? 473 SER B N 1 ATOM 7240 C CA . SER B 1 430 ? -0.816 90.592 76.896 1.00 47.05 ? 473 SER B CA 1 ATOM 7241 C C . SER B 1 430 ? -1.363 91.057 78.242 1.00 40.81 ? 473 SER B C 1 ATOM 7242 O O . SER B 1 430 ? -0.779 91.965 78.841 1.00 45.25 ? 473 SER B O 1 ATOM 7243 C CB . SER B 1 430 ? -1.033 91.699 75.853 1.00 50.75 ? 473 SER B CB 1 ATOM 7244 O OG . SER B 1 430 ? -2.413 91.928 75.617 1.00 46.59 ? 473 SER B OG 1 ATOM 7245 N N . ARG B 1 431 ? -2.449 90.469 78.737 1.00 39.49 ? 474 ARG B N 1 ATOM 7246 C CA . ARG B 1 431 ? -3.153 91.019 79.894 1.00 46.67 ? 474 ARG B CA 1 ATOM 7247 C C . ARG B 1 431 ? -3.138 90.045 81.064 1.00 51.73 ? 474 ARG B C 1 ATOM 7248 O O . ARG B 1 431 ? -3.729 88.956 80.958 1.00 54.38 ? 474 ARG B O 1 ATOM 7249 C CB . ARG B 1 431 ? -4.596 91.366 79.524 1.00 32.29 ? 474 ARG B CB 1 ATOM 7250 C CG . ARG B 1 431 ? -5.421 91.881 80.689 1.00 34.44 ? 474 ARG B CG 1 ATOM 7251 C CD . ARG B 1 431 ? -6.805 92.317 80.237 1.00 22.64 ? 474 ARG B CD 1 ATOM 7252 N NE . ARG B 1 431 ? -7.589 91.202 79.717 1.00 33.03 ? 474 ARG B NE 1 ATOM 7253 C CZ . ARG B 1 431 ? -8.407 90.455 80.452 1.00 60.87 ? 474 ARG B CZ 1 ATOM 7254 N NH1 . ARG B 1 431 ? -8.551 90.702 81.749 1.00 54.67 1 474 ARG B NH1 1 ATOM 7255 N NH2 . ARG B 1 431 ? -9.082 89.461 79.888 1.00 53.43 ? 474 ARG B NH2 1 ATOM 7256 N N . PRO B 1 432 ? -2.502 90.369 82.193 1.00 48.50 ? 475 PRO B N 1 ATOM 7257 C CA . PRO B 1 432 ? -2.600 89.475 83.357 1.00 43.55 ? 475 PRO B CA 1 ATOM 7258 C C . PRO B 1 432 ? -4.037 89.433 83.849 1.00 44.46 ? 475 PRO B C 1 ATOM 7259 O O . PRO B 1 432 ? -4.616 90.460 84.205 1.00 51.13 ? 475 PRO B O 1 ATOM 7260 C CB . PRO B 1 432 ? -1.670 90.128 84.387 1.00 47.62 ? 475 PRO B CB 1 ATOM 7261 C CG . PRO B 1 432 ? -0.885 91.174 83.634 1.00 52.32 ? 475 PRO B CG 1 ATOM 7262 C CD . PRO B 1 432 ? -1.751 91.596 82.496 1.00 48.06 ? 475 PRO B CD 1 ATOM 7263 N N . LEU B 1 433 ? -4.615 88.234 83.873 1.00 53.76 ? 476 LEU B N 1 ATOM 7264 C CA . LEU B 1 433 ? -5.964 88.051 84.387 1.00 48.73 ? 476 LEU B CA 1 ATOM 7265 C C . LEU B 1 433 ? -6.011 87.396 85.759 1.00 44.55 ? 476 LEU B C 1 ATOM 7266 O O . LEU B 1 433 ? -7.102 87.262 86.323 1.00 57.89 ? 476 LEU B O 1 ATOM 7267 C CB . LEU B 1 433 ? -6.812 87.256 83.388 1.00 56.98 ? 476 LEU B CB 1 ATOM 7268 C CG . LEU B 1 433 ? -6.298 85.904 82.910 1.00 65.60 ? 476 LEU B CG 1 ATOM 7269 C CD1 . LEU B 1 433 ? -6.568 84.838 83.957 1.00 79.81 ? 476 LEU B CD1 1 ATOM 7270 C CD2 . LEU B 1 433 ? -6.957 85.549 81.591 1.00 68.46 ? 476 LEU B CD2 1 ATOM 7271 N N . ALA B 1 434 ? -4.873 86.982 86.310 1.00 49.83 ? 477 ALA B N 1 ATOM 7272 C CA . ALA B 1 434 ? -4.876 86.304 87.601 1.00 43.87 ? 477 ALA B CA 1 ATOM 7273 C C . ALA B 1 434 ? -3.454 85.895 87.952 1.00 35.67 ? 477 ALA B C 1 ATOM 7274 O O . ALA B 1 434 ? -2.579 85.821 87.084 1.00 47.75 ? 477 ALA B O 1 ATOM 7275 C CB . ALA B 1 434 ? -5.788 85.074 87.594 1.00 25.91 ? 477 ALA B CB 1 ATOM 7276 N N . VAL B 1 435 ? -3.240 85.618 89.236 1.00 32.47 ? 478 VAL B N 1 ATOM 7277 C CA . VAL B 1 435 ? -1.951 85.158 89.736 1.00 37.08 ? 478 VAL B CA 1 ATOM 7278 C C . VAL B 1 435 ? -2.194 84.073 90.769 1.00 37.67 ? 478 VAL B C 1 ATOM 7279 O O . VAL B 1 435 ? -3.103 84.180 91.598 1.00 41.91 ? 478 VAL B O 1 ATOM 7280 C CB . VAL B 1 435 ? -1.122 86.294 90.365 1.00 43.29 ? 478 VAL B CB 1 ATOM 7281 C CG1 . VAL B 1 435 ? -1.921 86.983 91.457 1.00 40.66 ? 478 VAL B CG1 1 ATOM 7282 C CG2 . VAL B 1 435 ? 0.176 85.737 90.930 1.00 33.64 ? 478 VAL B CG2 1 ATOM 7283 N N . ALA B 1 436 ? -1.361 83.042 90.734 1.00 40.55 ? 479 ALA B N 1 ATOM 7284 C CA . ALA B 1 436 ? -1.372 81.982 91.727 1.00 38.51 ? 479 ALA B CA 1 ATOM 7285 C C . ALA B 1 436 ? -0.150 82.134 92.615 1.00 40.39 ? 479 ALA B C 1 ATOM 7286 O O . ALA B 1 436 ? 0.957 82.383 92.126 1.00 34.06 ? 479 ALA B O 1 ATOM 7287 C CB . ALA B 1 436 ? -1.383 80.600 91.071 1.00 38.87 ? 479 ALA B CB 1 ATOM 7288 N N . PHE B 1 437 ? -0.356 81.987 93.917 1.00 40.93 ? 480 PHE B N 1 ATOM 7289 C CA . PHE B 1 437 ? 0.706 82.140 94.900 1.00 44.55 ? 480 PHE B CA 1 ATOM 7290 C C . PHE B 1 437 ? 1.267 80.768 95.251 1.00 49.81 ? 480 PHE B C 1 ATOM 7291 O O . PHE B 1 437 ? 0.520 79.863 95.638 1.00 49.57 ? 480 PHE B O 1 ATOM 7292 C CB . PHE B 1 437 ? 0.194 82.859 96.145 1.00 36.43 ? 480 PHE B CB 1 ATOM 7293 C CG . PHE B 1 437 ? -0.315 84.238 95.871 1.00 36.91 ? 480 PHE B CG 1 ATOM 7294 C CD1 . PHE B 1 437 ? 0.569 85.293 95.711 1.00 42.24 ? 480 PHE B CD1 1 ATOM 7295 C CD2 . PHE B 1 437 ? -1.673 84.482 95.765 1.00 36.53 ? 480 PHE B CD2 1 ATOM 7296 C CE1 . PHE B 1 437 ? 0.108 86.568 95.453 1.00 36.94 ? 480 PHE B CE1 1 ATOM 7297 C CE2 . PHE B 1 437 ? -2.144 85.757 95.506 1.00 30.25 ? 480 PHE B CE2 1 ATOM 7298 C CZ . PHE B 1 437 ? -1.250 86.801 95.350 1.00 34.23 ? 480 PHE B CZ 1 ATOM 7299 N N . LEU B 1 438 ? 2.573 80.609 95.070 1.00 48.52 ? 481 LEU B N 1 ATOM 7300 C CA . LEU B 1 438 ? 3.281 79.392 95.439 1.00 36.45 ? 481 LEU B CA 1 ATOM 7301 C C . LEU B 1 438 ? 4.006 79.674 96.751 1.00 44.24 ? 481 LEU B C 1 ATOM 7302 O O . LEU B 1 438 ? 4.978 80.437 96.781 1.00 46.41 ? 481 LEU B O 1 ATOM 7303 C CB . LEU B 1 438 ? 4.246 78.968 94.334 1.00 47.23 ? 481 LEU B CB 1 ATOM 7304 C CG . LEU B 1 438 ? 3.630 78.350 93.071 1.00 47.80 ? 481 LEU B CG 1 ATOM 7305 C CD1 . LEU B 1 438 ? 2.629 79.279 92.395 1.00 39.16 ? 481 LEU B CD1 1 ATOM 7306 C CD2 . LEU B 1 438 ? 4.722 77.945 92.092 1.00 44.96 ? 481 LEU B CD2 1 ATOM 7307 N N . ALA B 1 439 ? 3.516 79.057 97.850 1.00 68.03 ? 482 ALA B N 1 ATOM 7308 C CA . ALA B 1 439 ? 3.971 79.325 99.205 1.00 34.49 ? 482 ALA B CA 1 ATOM 7309 C C . ALA B 1 439 ? 5.212 78.507 99.540 1.00 37.00 ? 482 ALA B C 1 ATOM 7310 O O . ALA B 1 439 ? 5.351 77.363 99.094 1.00 63.10 ? 482 ALA B O 1 ATOM 7311 C CB . ALA B 1 439 ? 2.869 79.005 100.204 1.00 50.16 ? 482 ALA B CB 1 ATOM 7312 N N . PRO B 1 440 ? 6.119 79.069 100.332 1.00 42.67 ? 483 PRO B N 1 ATOM 7313 C CA . PRO B 1 440 ? 7.309 78.316 100.735 1.00 41.01 ? 483 PRO B CA 1 ATOM 7314 C C . PRO B 1 440 ? 6.949 77.195 101.697 1.00 56.65 ? 483 PRO B C 1 ATOM 7315 O O . PRO B 1 440 ? 5.885 77.179 102.321 1.00 47.54 ? 483 PRO B O 1 ATOM 7316 C CB . PRO B 1 440 ? 8.190 79.372 101.411 1.00 52.54 ? 483 PRO B CB 1 ATOM 7317 C CG . PRO B 1 440 ? 7.238 80.424 101.870 1.00 34.62 ? 483 PRO B CG 1 ATOM 7318 C CD . PRO B 1 440 ? 6.123 80.444 100.862 1.00 37.83 ? 483 PRO B CD 1 ATOM 7319 N N . SER B 1 441 ? 7.874 76.247 101.811 1.00 65.29 ? 484 SER B N 1 ATOM 7320 C CA . SER B 1 441 ? 7.627 75.021 102.554 1.00 45.09 ? 484 SER B CA 1 ATOM 7321 C C . SER B 1 441 ? 7.816 75.228 104.048 1.00 48.98 ? 484 SER B C 1 ATOM 7322 O O . SER B 1 441 ? 8.746 75.911 104.483 1.00 53.33 ? 484 SER B O 1 ATOM 7323 C CB . SER B 1 441 ? 8.575 73.922 102.080 1.00 47.39 ? 484 SER B CB 1 ATOM 7324 O OG . SER B 1 441 ? 9.913 74.263 102.398 1.00 40.13 ? 484 SER B OG 1 ATOM 7325 N N . ALA B 1 442 ? 6.925 74.625 104.837 1.00 52.83 ? 485 ALA B N 1 ATOM 7326 C CA . ALA B 1 442 ? 7.209 74.480 106.259 1.00 48.24 ? 485 ALA B CA 1 ATOM 7327 C C . ALA B 1 442 ? 8.476 73.667 106.479 1.00 43.92 ? 485 ALA B C 1 ATOM 7328 O O . ALA B 1 442 ? 9.236 73.940 107.415 1.00 41.69 ? 485 ALA B O 1 ATOM 7329 C CB . ALA B 1 442 ? 6.026 73.826 106.973 1.00 44.86 ? 485 ALA B CB 1 ATOM 7330 N N . THR B 1 443 ? 8.727 72.684 105.619 1.00 43.44 ? 486 THR B N 1 ATOM 7331 C CA . THR B 1 443 ? 9.901 71.837 105.750 1.00 50.08 ? 486 THR B CA 1 ATOM 7332 C C . THR B 1 443 ? 11.167 72.583 105.349 1.00 45.76 ? 486 THR B C 1 ATOM 7333 O O . THR B 1 443 ? 11.136 73.617 104.679 1.00 44.05 ? 486 THR B O 1 ATOM 7334 C CB . THR B 1 443 ? 9.776 70.581 104.892 1.00 62.43 ? 486 THR B CB 1 ATOM 7335 O OG1 . THR B 1 443 ? 10.984 69.817 105.004 1.00 54.84 ? 486 THR B OG1 1 ATOM 7336 C CG2 . THR B 1 443 ? 9.561 70.958 103.435 1.00 49.68 ? 486 THR B CG2 1 ATOM 7337 N N . THR B 1 444 ? 12.294 72.036 105.786 1.00 49.01 ? 487 THR B N 1 ATOM 7338 C CA . THR B 1 444 ? 13.611 72.575 105.494 1.00 46.35 ? 487 THR B CA 1 ATOM 7339 C C . THR B 1 444 ? 14.240 71.957 104.256 1.00 50.10 ? 487 THR B C 1 ATOM 7340 O O . THR B 1 444 ? 15.376 72.306 103.922 1.00 47.27 ? 487 THR B O 1 ATOM 7341 C CB . THR B 1 444 ? 14.535 72.354 106.695 1.00 54.05 ? 487 THR B CB 1 ATOM 7342 O OG1 . THR B 1 444 ? 15.894 72.602 106.317 1.00 68.48 ? 487 THR B OG1 1 ATOM 7343 C CG2 . THR B 1 444 ? 14.410 70.924 107.196 1.00 53.08 ? 487 THR B CG2 1 ATOM 7344 N N . TYR B 1 445 ? 13.524 71.076 103.559 1.00 64.53 ? 488 TYR B N 1 ATOM 7345 C CA . TYR B 1 445 ? 14.146 70.170 102.597 1.00 60.13 ? 488 TYR B CA 1 ATOM 7346 C C . TYR B 1 445 ? 14.976 70.922 101.563 1.00 55.71 ? 488 TYR B C 1 ATOM 7347 O O . TYR B 1 445 ? 14.467 71.777 100.832 1.00 40.72 ? 488 TYR B O 1 ATOM 7348 C CB . TYR B 1 445 ? 13.076 69.320 101.904 1.00 61.55 ? 488 TYR B CB 1 ATOM 7349 C CG . TYR B 1 445 ? 13.653 68.237 101.014 1.00 63.59 ? 488 TYR B CG 1 ATOM 7350 C CD1 . TYR B 1 445 ? 14.444 67.226 101.544 1.00 48.37 ? 488 TYR B CD1 1 ATOM 7351 C CD2 . TYR B 1 445 ? 13.398 68.218 99.645 1.00 70.33 ? 488 TYR B CD2 1 ATOM 7352 C CE1 . TYR B 1 445 ? 14.975 66.236 100.737 1.00 60.85 ? 488 TYR B CE1 1 ATOM 7353 C CE2 . TYR B 1 445 ? 13.923 67.229 98.830 1.00 53.77 ? 488 TYR B CE2 1 ATOM 7354 C CZ . TYR B 1 445 ? 14.710 66.241 99.382 1.00 63.96 ? 488 TYR B CZ 1 ATOM 7355 O OH . TYR B 1 445 ? 15.237 65.254 98.581 1.00 60.65 ? 488 TYR B OH 1 ATOM 7356 N N . ILE B 1 446 ? 16.244 70.527 101.460 1.00 69.64 ? 489 ILE B N 1 ATOM 7357 C CA . ILE B 1 446 ? 17.249 71.175 100.626 1.00 28.96 ? 489 ILE B CA 1 ATOM 7358 C C . ILE B 1 446 ? 17.530 72.597 101.096 1.00 43.75 ? 489 ILE B C 1 ATOM 7359 O O . ILE B 1 446 ? 17.253 73.570 100.386 1.00 60.58 ? 489 ILE B O 1 ATOM 7360 C CB . ILE B 1 446 ? 16.816 71.152 99.153 1.00 50.53 ? 489 ILE B CB 1 ATOM 7361 C CG1 . ILE B 1 446 ? 16.487 69.713 98.751 1.00 59.75 ? 489 ILE B CG1 1 ATOM 7362 C CG2 . ILE B 1 446 ? 17.903 71.740 98.264 1.00 85.83 ? 489 ILE B CG2 1 ATOM 7363 C CD1 . ILE B 1 446 ? 17.615 68.737 99.000 1.00 35.41 ? 489 ILE B CD1 1 ATOM 7364 N N . GLY B 1 447 ? 18.080 72.716 102.303 1.00 51.67 ? 490 GLY B N 1 ATOM 7365 C CA . GLY B 1 447 ? 18.775 73.913 102.759 1.00 48.45 ? 490 GLY B CA 1 ATOM 7366 C C . GLY B 1 447 ? 17.965 75.172 102.973 1.00 45.90 ? 490 GLY B C 1 ATOM 7367 O O . GLY B 1 447 ? 18.465 76.273 102.703 1.00 57.01 ? 490 GLY B O 1 ATOM 7368 N N . LEU B 1 448 ? 16.743 75.053 103.473 1.00 35.79 ? 491 LEU B N 1 ATOM 7369 C CA . LEU B 1 448 ? 15.891 76.214 103.657 1.00 45.39 ? 491 LEU B CA 1 ATOM 7370 C C . LEU B 1 448 ? 15.519 76.375 105.125 1.00 54.30 ? 491 LEU B C 1 ATOM 7371 O O . LEU B 1 448 ? 15.413 75.397 105.871 1.00 50.13 ? 491 LEU B O 1 ATOM 7372 C CB . LEU B 1 448 ? 14.621 76.103 102.812 1.00 45.27 ? 491 LEU B CB 1 ATOM 7373 C CG . LEU B 1 448 ? 14.857 75.940 101.310 1.00 42.15 ? 491 LEU B CG 1 ATOM 7374 C CD1 . LEU B 1 448 ? 13.538 75.725 100.589 1.00 46.32 ? 491 LEU B CD1 1 ATOM 7375 C CD2 . LEU B 1 448 ? 15.628 77.116 100.727 1.00 24.48 ? 491 LEU B CD2 1 ATOM 7376 N N . ASN B 1 449 ? 15.325 77.620 105.534 1.00 44.35 ? 492 ASN B N 1 ATOM 7377 C CA . ASN B 1 449 ? 14.669 77.865 106.803 1.00 40.08 ? 492 ASN B CA 1 ATOM 7378 C C . ASN B 1 449 ? 13.222 77.386 106.716 1.00 42.60 ? 492 ASN B C 1 ATOM 7379 O O . ASN B 1 449 ? 12.587 77.513 105.664 1.00 29.83 ? 492 ASN B O 1 ATOM 7380 C CB . ASN B 1 449 ? 14.708 79.351 107.162 1.00 35.01 ? 492 ASN B CB 1 ATOM 7381 C CG . ASN B 1 449 ? 16.081 79.809 107.608 1.00 47.22 ? 492 ASN B CG 1 ATOM 7382 O OD1 . ASN B 1 449 ? 16.739 79.141 108.401 1.00 67.41 ? 492 ASN B OD1 1 ATOM 7383 N ND2 . ASN B 1 449 ? 16.518 80.955 107.103 1.00 43.11 ? 492 ASN B ND2 1 ATOM 7384 N N . PRO B 1 450 ? 12.688 76.795 107.779 1.00 33.33 ? 493 PRO B N 1 ATOM 7385 C CA . PRO B 1 450 ? 11.258 76.477 107.794 1.00 37.49 ? 493 PRO B CA 1 ATOM 7386 C C . PRO B 1 450 ? 10.437 77.749 107.654 1.00 39.18 ? 493 PRO B C 1 ATOM 7387 O O . PRO B 1 450 ? 10.887 78.842 108.003 1.00 58.39 ? 493 PRO B O 1 ATOM 7388 C CB . PRO B 1 450 ? 11.053 75.821 109.164 1.00 32.97 ? 493 PRO B CB 1 ATOM 7389 C CG . PRO B 1 450 ? 12.412 75.333 109.561 1.00 32.63 ? 493 PRO B CG 1 ATOM 7390 C CD . PRO B 1 450 ? 13.381 76.316 108.986 1.00 30.63 ? 493 PRO B CD 1 ATOM 7391 N N . GLY B 1 451 ? 9.229 77.611 107.115 1.00 30.29 ? 494 GLY B N 1 ATOM 7392 C CA . GLY B 1 451 ? 8.377 78.776 106.983 1.00 32.47 ? 494 GLY B CA 1 ATOM 7393 C C . GLY B 1 451 ? 6.926 78.426 106.758 1.00 31.89 ? 494 GLY B C 1 ATOM 7394 O O . GLY B 1 451 ? 6.586 77.318 106.333 1.00 38.42 ? 494 GLY B O 1 ATOM 7395 N N . TYR B 1 452 ? 6.066 79.400 107.054 1.00 24.03 ? 495 TYR B N 1 ATOM 7396 C CA . TYR B 1 452 ? 4.652 79.336 106.717 1.00 26.35 ? 495 TYR B CA 1 ATOM 7397 C C . TYR B 1 452 ? 4.202 80.719 106.268 1.00 42.95 ? 495 TYR B C 1 ATOM 7398 O O . TYR B 1 452 ? 4.934 81.705 106.383 1.00 41.52 ? 495 TYR B O 1 ATOM 7399 C CB . TYR B 1 452 ? 3.790 78.836 107.882 1.00 26.67 ? 495 TYR B CB 1 ATOM 7400 C CG . TYR B 1 452 ? 3.967 79.578 109.188 1.00 46.49 ? 495 TYR B CG 1 ATOM 7401 C CD1 . TYR B 1 452 ? 5.022 79.282 110.042 1.00 42.63 ? 495 TYR B CD1 1 ATOM 7402 C CD2 . TYR B 1 452 ? 3.059 80.553 109.581 1.00 37.86 ? 495 TYR B CD2 1 ATOM 7403 C CE1 . TYR B 1 452 ? 5.182 79.947 111.236 1.00 34.99 ? 495 TYR B CE1 1 ATOM 7404 C CE2 . TYR B 1 452 ? 3.210 81.227 110.778 1.00 39.88 ? 495 TYR B CE2 1 ATOM 7405 C CZ . TYR B 1 452 ? 4.273 80.919 111.603 1.00 47.01 ? 495 TYR B CZ 1 ATOM 7406 O OH . TYR B 1 452 ? 4.426 81.583 112.802 1.00 58.14 ? 495 TYR B OH 1 ATOM 7407 N N . ARG B 1 453 ? 2.993 80.776 105.718 1.00 45.35 ? 496 ARG B N 1 ATOM 7408 C CA . ARG B 1 453 ? 2.446 82.006 105.170 1.00 35.90 ? 496 ARG B CA 1 ATOM 7409 C C . ARG B 1 453 ? 1.070 82.285 105.755 1.00 42.62 ? 496 ARG B C 1 ATOM 7410 O O . ARG B 1 453 ? 0.353 81.376 106.181 1.00 40.58 ? 496 ARG B O 1 ATOM 7411 C CB . ARG B 1 453 ? 2.349 81.935 103.644 1.00 41.64 ? 496 ARG B CB 1 ATOM 7412 C CG . ARG B 1 453 ? 1.562 83.067 103.027 1.00 41.67 ? 496 ARG B CG 1 ATOM 7413 C CD . ARG B 1 453 ? 2.039 83.330 101.627 1.00 47.22 ? 496 ARG B CD 1 ATOM 7414 N NE . ARG B 1 453 ? 3.448 83.690 101.612 1.00 46.37 ? 496 ARG B NE 1 ATOM 7415 C CZ . ARG B 1 453 ? 4.196 83.698 100.517 1.00 52.27 ? 496 ARG B CZ 1 ATOM 7416 N NH1 . ARG B 1 453 ? 3.667 83.359 99.348 1.00 52.79 1 496 ARG B NH1 1 ATOM 7417 N NH2 . ARG B 1 453 ? 5.472 84.041 100.593 1.00 55.74 ? 496 ARG B NH2 1 ATOM 7418 N N . VAL B 1 454 ? 0.704 83.564 105.746 1.00 40.43 ? 497 VAL B N 1 ATOM 7419 C CA . VAL B 1 454 ? -0.622 84.023 106.141 1.00 40.43 ? 497 VAL B CA 1 ATOM 7420 C C . VAL B 1 454 ? -1.066 85.076 105.137 1.00 41.71 ? 497 VAL B C 1 ATOM 7421 O O . VAL B 1 454 ? -0.313 86.007 104.833 1.00 44.57 ? 497 VAL B O 1 ATOM 7422 C CB . VAL B 1 454 ? -0.639 84.597 107.572 1.00 30.21 ? 497 VAL B CB 1 ATOM 7423 C CG1 . VAL B 1 454 ? -0.334 83.505 108.583 1.00 49.99 ? 497 VAL B CG1 1 ATOM 7424 C CG2 . VAL B 1 454 ? 0.353 85.737 107.696 1.00 50.88 ? 497 VAL B CG2 1 ATOM 7425 N N . TYR B 1 455 ? -2.285 84.934 104.627 1.00 40.70 ? 498 TYR B N 1 ATOM 7426 C CA . TYR B 1 455 ? -2.838 85.839 103.630 1.00 39.13 ? 498 TYR B CA 1 ATOM 7427 C C . TYR B 1 455 ? -3.893 86.742 104.254 1.00 42.78 ? 498 TYR B C 1 ATOM 7428 O O . TYR B 1 455 ? -4.715 86.291 105.057 1.00 55.31 ? 498 TYR B O 1 ATOM 7429 C CB . TYR B 1 455 ? -3.459 85.061 102.464 1.00 34.10 ? 498 TYR B CB 1 ATOM 7430 C CG . TYR B 1 455 ? -2.458 84.305 101.620 1.00 43.95 ? 498 TYR B CG 1 ATOM 7431 C CD1 . TYR B 1 455 ? -1.723 84.948 100.635 1.00 44.90 ? 498 TYR B CD1 1 ATOM 7432 C CD2 . TYR B 1 455 ? -2.248 82.948 101.808 1.00 39.10 ? 498 TYR B CD2 1 ATOM 7433 C CE1 . TYR B 1 455 ? -0.807 84.261 99.865 1.00 42.21 ? 498 TYR B CE1 1 ATOM 7434 C CE2 . TYR B 1 455 ? -1.336 82.254 101.043 1.00 37.18 ? 498 TYR B CE2 1 ATOM 7435 C CZ . TYR B 1 455 ? -0.619 82.914 100.070 1.00 34.61 ? 498 TYR B CZ 1 ATOM 7436 O OH . TYR B 1 455 ? 0.297 82.224 99.304 1.00 41.85 ? 498 TYR B OH 1 ATOM 7437 N N . GLN B 1 456 ? -3.855 88.020 103.889 1.00 49.80 ? 499 GLN B N 1 ATOM 7438 C CA . GLN B 1 456 ? -4.968 88.930 104.126 1.00 47.34 ? 499 GLN B CA 1 ATOM 7439 C C . GLN B 1 456 ? -5.838 88.958 102.873 1.00 46.87 ? 499 GLN B C 1 ATOM 7440 O O . GLN B 1 456 ? -5.354 89.282 101.784 1.00 47.34 ? 499 GLN B O 1 ATOM 7441 C CB . GLN B 1 456 ? -4.489 90.341 104.473 1.00 58.97 ? 499 GLN B CB 1 ATOM 7442 C CG . GLN B 1 456 ? -3.999 90.536 105.905 1.00 68.86 ? 499 GLN B CG 1 ATOM 7443 C CD . GLN B 1 456 ? -2.554 90.127 106.105 1.00 72.50 ? 499 GLN B CD 1 ATOM 7444 O OE1 . GLN B 1 456 ? -1.748 90.172 105.176 1.00 69.65 ? 499 GLN B OE1 1 ATOM 7445 N NE2 . GLN B 1 456 ? -2.217 89.734 107.327 1.00 83.56 ? 499 GLN B NE2 1 ATOM 7446 N N . ILE B 1 457 ? -7.108 88.595 103.026 1.00 38.14 ? 500 ILE B N 1 ATOM 7447 C CA . ILE B 1 457 ? -8.034 88.453 101.910 1.00 39.11 ? 500 ILE B CA 1 ATOM 7448 C C . ILE B 1 457 ? -9.256 89.324 102.165 1.00 50.89 ? 500 ILE B C 1 ATOM 7449 O O . ILE B 1 457 ? -9.654 89.541 103.313 1.00 63.75 ? 500 ILE B O 1 ATOM 7450 C CB . ILE B 1 457 ? -8.449 86.979 101.716 1.00 41.90 ? 500 ILE B CB 1 ATOM 7451 C CG1 . ILE B 1 457 ? -7.207 86.093 101.587 1.00 41.48 ? 500 ILE B CG1 1 ATOM 7452 C CG2 . ILE B 1 457 ? -9.373 86.832 100.518 1.00 43.42 ? 500 ILE B CG2 1 ATOM 7453 C CD1 . ILE B 1 457 ? -7.508 84.613 101.617 1.00 48.23 ? 500 ILE B CD1 1 ATOM 7454 N N . ASP B 1 458 ? -9.855 89.823 101.084 1.00 52.61 ? 501 ASP B N 1 ATOM 7455 C CA . ASP B 1 458 ? -11.091 90.586 101.213 1.00 51.36 ? 501 ASP B CA 1 ATOM 7456 C C . ASP B 1 458 ? -12.143 89.745 101.928 1.00 57.50 ? 501 ASP B C 1 ATOM 7457 O O . ASP B 1 458 ? -12.421 88.607 101.537 1.00 51.90 ? 501 ASP B O 1 ATOM 7458 C CB . ASP B 1 458 ? -11.600 91.036 99.845 1.00 52.95 ? 501 ASP B CB 1 ATOM 7459 C CG . ASP B 1 458 ? -12.480 92.271 99.931 1.00 64.71 ? 501 ASP B CG 1 ATOM 7460 O OD1 . ASP B 1 458 ? -12.519 92.896 101.014 1.00 73.25 ? 501 ASP B OD1 1 ATOM 7461 O OD2 . ASP B 1 458 ? -13.133 92.616 98.923 1.00 60.97 -1 501 ASP B OD2 1 ATOM 7462 N N . GLY B 1 459 ? -12.735 90.322 102.970 1.00 61.64 ? 502 GLY B N 1 ATOM 7463 C CA . GLY B 1 459 ? -13.433 89.567 103.989 1.00 64.35 ? 502 GLY B CA 1 ATOM 7464 C C . GLY B 1 459 ? -14.812 89.075 103.601 1.00 59.55 ? 502 GLY B C 1 ATOM 7465 O O . GLY B 1 459 ? -15.181 88.990 102.427 1.00 59.92 ? 502 GLY B O 1 ATOM 7466 N N . ASN B 1 460 ? -15.583 88.740 104.634 1.00 57.63 ? 503 ASN B N 1 ATOM 7467 C CA . ASN B 1 460 ? -16.868 88.064 104.504 1.00 71.24 ? 503 ASN B CA 1 ATOM 7468 C C . ASN B 1 460 ? -17.986 89.105 104.529 1.00 61.21 ? 503 ASN B C 1 ATOM 7469 O O . ASN B 1 460 ? -18.269 89.698 105.575 1.00 66.66 ? 503 ASN B O 1 ATOM 7470 C CB . ASN B 1 460 ? -16.993 87.037 105.632 1.00 58.76 ? 503 ASN B CB 1 ATOM 7471 C CG . ASN B 1 460 ? -18.411 86.558 105.869 1.00 66.94 ? 503 ASN B CG 1 ATOM 7472 O OD1 . ASN B 1 460 ? -19.234 86.498 104.956 1.00 71.21 ? 503 ASN B OD1 1 ATOM 7473 N ND2 . ASN B 1 460 ? -18.692 86.194 107.119 1.00 76.74 ? 503 ASN B ND2 1 ATOM 7474 N N . TYR B 1 461 ? -18.626 89.314 103.379 1.00 70.37 ? 504 TYR B N 1 ATOM 7475 C CA . TYR B 1 461 ? -19.733 90.257 103.234 1.00 64.65 ? 504 TYR B CA 1 ATOM 7476 C C . TYR B 1 461 ? -20.149 90.283 101.767 1.00 57.89 ? 504 TYR B C 1 ATOM 7477 O O . TYR B 1 461 ? -19.438 89.781 100.890 1.00 63.36 ? 504 TYR B O 1 ATOM 7478 C CB . TYR B 1 461 ? -19.374 91.666 103.711 1.00 55.09 ? 504 TYR B CB 1 ATOM 7479 C CG . TYR B 1 461 ? -18.262 92.333 102.935 1.00 55.00 ? 504 TYR B CG 1 ATOM 7480 C CD1 . TYR B 1 461 ? -16.932 92.146 103.287 1.00 63.63 ? 504 TYR B CD1 1 ATOM 7481 C CD2 . TYR B 1 461 ? -18.544 93.165 101.860 1.00 57.95 ? 504 TYR B CD2 1 ATOM 7482 C CE1 . TYR B 1 461 ? -15.912 92.762 102.584 1.00 65.45 ? 504 TYR B CE1 1 ATOM 7483 C CE2 . TYR B 1 461 ? -17.530 93.785 101.149 1.00 69.08 ? 504 TYR B CE2 1 ATOM 7484 C CZ . TYR B 1 461 ? -16.216 93.579 101.515 1.00 67.13 ? 504 TYR B CZ 1 ATOM 7485 O OH . TYR B 1 461 ? -15.203 94.192 100.814 1.00 74.70 ? 504 TYR B OH 1 ATOM 7486 N N . SER B 1 462 ? -21.316 90.870 101.512 1.00 61.38 ? 505 SER B N 1 ATOM 7487 C CA . SER B 1 462 ? -21.841 90.932 100.155 1.00 81.88 ? 505 SER B CA 1 ATOM 7488 C C . SER B 1 462 ? -21.012 91.886 99.302 1.00 80.96 ? 505 SER B C 1 ATOM 7489 O O . SER B 1 462 ? -20.644 92.980 99.740 1.00 70.88 ? 505 SER B O 1 ATOM 7490 C CB . SER B 1 462 ? -23.301 91.384 100.168 1.00 83.71 ? 505 SER B CB 1 ATOM 7491 O OG . SER B 1 462 ? -23.400 92.792 100.315 1.00 80.20 ? 505 SER B OG 1 ATOM 7492 N N . GLY B 1 463 ? -20.738 91.475 98.065 1.00 66.12 ? 506 GLY B N 1 ATOM 7493 C CA . GLY B 1 463 ? -19.925 92.265 97.167 1.00 71.14 ? 506 GLY B CA 1 ATOM 7494 C C . GLY B 1 463 ? -18.432 92.095 97.342 1.00 76.50 ? 506 GLY B C 1 ATOM 7495 O O . GLY B 1 463 ? -17.664 92.666 96.556 1.00 67.41 ? 506 GLY B O 1 ATOM 7496 N N . SER B 1 464 ? -17.996 91.339 98.347 1.00 70.84 ? 507 SER B N 1 ATOM 7497 C CA . SER B 1 464 ? -16.572 91.117 98.558 1.00 63.81 ? 507 SER B CA 1 ATOM 7498 C C . SER B 1 464 ? -15.932 90.494 97.325 1.00 59.78 ? 507 SER B C 1 ATOM 7499 O O . SER B 1 464 ? -16.519 89.631 96.667 1.00 62.86 ? 507 SER B O 1 ATOM 7500 C CB . SER B 1 464 ? -16.352 90.211 99.770 1.00 66.01 ? 507 SER B CB 1 ATOM 7501 O OG . SER B 1 464 ? -14.988 89.846 99.891 1.00 62.18 ? 507 SER B OG 1 ATOM 7502 N N . SER B 1 465 ? -14.716 90.945 97.013 1.00 47.89 ? 508 SER B N 1 ATOM 7503 C CA . SER B 1 465 ? -13.956 90.360 95.916 1.00 46.10 ? 508 SER B CA 1 ATOM 7504 C C . SER B 1 465 ? -13.316 89.037 96.309 1.00 46.89 ? 508 SER B C 1 ATOM 7505 O O . SER B 1 465 ? -13.079 88.185 95.445 1.00 50.65 ? 508 SER B O 1 ATOM 7506 C CB . SER B 1 465 ? -12.870 91.328 95.458 1.00 48.59 ? 508 SER B CB 1 ATOM 7507 O OG . SER B 1 465 ? -11.858 91.426 96.444 1.00 50.48 ? 508 SER B OG 1 ATOM 7508 N N . HIS B 1 466 ? -13.034 88.848 97.597 1.00 50.86 ? 509 HIS B N 1 ATOM 7509 C CA . HIS B 1 466 ? -12.404 87.628 98.098 1.00 55.00 ? 509 HIS B CA 1 ATOM 7510 C C . HIS B 1 466 ? -11.033 87.407 97.468 1.00 50.40 ? 509 HIS B C 1 ATOM 7511 O O . HIS B 1 466 ? -10.596 86.268 97.286 1.00 45.34 ? 509 HIS B O 1 ATOM 7512 C CB . HIS B 1 466 ? -13.304 86.410 97.877 1.00 36.70 ? 509 HIS B CB 1 ATOM 7513 C CG . HIS B 1 466 ? -14.617 86.502 98.589 1.00 44.83 ? 509 HIS B CG 1 ATOM 7514 N ND1 . HIS B 1 466 ? -14.756 86.238 99.934 1.00 50.77 ? 509 HIS B ND1 1 ATOM 7515 C CD2 . HIS B 1 466 ? -15.850 86.841 98.143 1.00 53.36 ? 509 HIS B CD2 1 ATOM 7516 C CE1 . HIS B 1 466 ? -16.018 86.406 100.285 1.00 65.00 ? 509 HIS B CE1 1 ATOM 7517 N NE2 . HIS B 1 466 ? -16.703 86.772 99.217 1.00 55.99 ? 509 HIS B NE2 1 ATOM 7518 N N . VAL B 1 467 ? -10.341 88.498 97.146 1.00 34.57 ? 510 VAL B N 1 ATOM 7519 C CA . VAL B 1 467 ? -9.036 88.446 96.498 1.00 53.01 ? 510 VAL B CA 1 ATOM 7520 C C . VAL B 1 467 ? -7.965 88.789 97.521 1.00 41.49 ? 510 VAL B C 1 ATOM 7521 O O . VAL B 1 467 ? -8.203 89.543 98.471 1.00 48.19 ? 510 VAL B O 1 ATOM 7522 C CB . VAL B 1 467 ? -8.947 89.394 95.283 1.00 43.35 ? 510 VAL B CB 1 ATOM 7523 C CG1 . VAL B 1 467 ? -10.022 89.055 94.264 1.00 53.26 ? 510 VAL B CG1 1 ATOM 7524 C CG2 . VAL B 1 467 ? -9.063 90.841 95.733 1.00 42.15 ? 510 VAL B CG2 1 ATOM 7525 N N . VAL B 1 468 ? -6.780 88.208 97.334 1.00 33.17 ? 511 VAL B N 1 ATOM 7526 C CA . VAL B 1 468 ? -5.680 88.450 98.258 1.00 34.49 ? 511 VAL B CA 1 ATOM 7527 C C . VAL B 1 468 ? -5.350 89.936 98.266 1.00 42.34 ? 511 VAL B C 1 ATOM 7528 O O . VAL B 1 468 ? -5.039 90.525 97.223 1.00 56.87 ? 511 VAL B O 1 ATOM 7529 C CB . VAL B 1 468 ? -4.464 87.605 97.873 1.00 36.15 ? 511 VAL B CB 1 ATOM 7530 C CG1 . VAL B 1 468 ? -3.249 88.021 98.682 1.00 45.76 ? 511 VAL B CG1 1 ATOM 7531 C CG2 . VAL B 1 468 ? -4.769 86.128 98.080 1.00 35.35 ? 511 VAL B CG2 1 ATOM 7532 N N . LEU B 1 469 ? -5.427 90.550 99.449 1.00 47.94 ? 512 LEU B N 1 ATOM 7533 C CA . LEU B 1 469 ? -5.000 91.934 99.636 1.00 32.03 ? 512 LEU B CA 1 ATOM 7534 C C . LEU B 1 469 ? -3.502 92.034 99.898 1.00 42.18 ? 512 LEU B C 1 ATOM 7535 O O . LEU B 1 469 ? -2.844 92.967 99.424 1.00 48.06 ? 512 LEU B O 1 ATOM 7536 C CB . LEU B 1 469 ? -5.781 92.561 100.787 1.00 35.36 ? 512 LEU B CB 1 ATOM 7537 C CG . LEU B 1 469 ? -7.300 92.469 100.646 1.00 45.85 ? 512 LEU B CG 1 ATOM 7538 C CD1 . LEU B 1 469 ? -7.992 92.954 101.914 1.00 58.87 ? 512 LEU B CD1 1 ATOM 7539 C CD2 . LEU B 1 469 ? -7.771 93.246 99.435 1.00 37.86 ? 512 LEU B CD2 1 ATOM 7540 N N . ASP B 1 470 ? -2.956 91.093 100.662 1.00 43.17 ? 513 ASP B N 1 ATOM 7541 C CA . ASP B 1 470 ? -1.546 91.087 101.024 1.00 44.37 ? 513 ASP B CA 1 ATOM 7542 C C . ASP B 1 470 ? -1.219 89.701 101.567 1.00 46.37 ? 513 ASP B C 1 ATOM 7543 O O . ASP B 1 470 ? -2.098 88.846 101.699 1.00 44.25 ? 513 ASP B O 1 ATOM 7544 C CB . ASP B 1 470 ? -1.244 92.189 102.046 1.00 37.03 ? 513 ASP B CB 1 ATOM 7545 C CG . ASP B 1 470 ? 0.235 92.514 102.143 1.00 52.67 ? 513 ASP B CG 1 ATOM 7546 O OD1 . ASP B 1 470 ? 1.060 91.687 101.703 1.00 67.71 ? 513 ASP B OD1 1 ATOM 7547 O OD2 . ASP B 1 470 ? 0.572 93.597 102.667 1.00 59.52 -1 513 ASP B OD2 1 ATOM 7548 N N . HIS B 1 471 ? 0.054 89.479 101.887 1.00 41.06 ? 514 HIS B N 1 ATOM 7549 C CA . HIS B 1 471 ? 0.441 88.238 102.538 1.00 37.89 ? 514 HIS B CA 1 ATOM 7550 C C . HIS B 1 471 ? 1.721 88.456 103.332 1.00 49.23 ? 514 HIS B C 1 ATOM 7551 O O . HIS B 1 471 ? 2.509 89.362 103.048 1.00 46.57 ? 514 HIS B O 1 ATOM 7552 C CB . HIS B 1 471 ? 0.605 87.091 101.531 1.00 36.03 ? 514 HIS B CB 1 ATOM 7553 C CG . HIS B 1 471 ? 1.829 87.190 100.671 1.00 48.27 ? 514 HIS B CG 1 ATOM 7554 N ND1 . HIS B 1 471 ? 1.764 87.315 99.299 1.00 42.63 ? 514 HIS B ND1 1 ATOM 7555 C CD2 . HIS B 1 471 ? 3.147 87.151 100.983 1.00 41.85 ? 514 HIS B CD2 1 ATOM 7556 C CE1 . HIS B 1 471 ? 2.988 87.362 98.805 1.00 38.84 ? 514 HIS B CE1 1 ATOM 7557 N NE2 . HIS B 1 471 ? 3.846 87.267 99.806 1.00 41.85 ? 514 HIS B NE2 1 ATOM 7558 N N . GLU B 1 472 ? 1.913 87.603 104.338 1.00 45.83 ? 515 GLU B N 1 ATOM 7559 C CA . GLU B 1 472 ? 3.072 87.648 105.214 1.00 42.56 ? 515 GLU B CA 1 ATOM 7560 C C . GLU B 1 472 ? 3.732 86.277 105.231 1.00 53.51 ? 515 GLU B C 1 ATOM 7561 O O . GLU B 1 472 ? 3.085 85.257 104.975 1.00 57.69 ? 515 GLU B O 1 ATOM 7562 C CB . GLU B 1 472 ? 2.682 88.060 106.647 1.00 56.23 ? 515 GLU B CB 1 ATOM 7563 C CG . GLU B 1 472 ? 1.545 89.078 106.725 1.00 57.41 ? 515 GLU B CG 1 ATOM 7564 C CD . GLU B 1 472 ? 1.090 89.354 108.152 1.00 73.49 ? 515 GLU B CD 1 ATOM 7565 O OE1 . GLU B 1 472 ? 0.982 88.395 108.949 1.00 74.07 ? 515 GLU B OE1 1 ATOM 7566 O OE2 . GLU B 1 472 ? 0.838 90.535 108.475 1.00 78.35 -1 515 GLU B OE2 1 ATOM 7567 N N . THR B 1 473 ? 5.032 86.259 105.522 1.00 39.53 ? 516 THR B N 1 ATOM 7568 C CA . THR B 1 473 ? 5.816 85.029 105.525 1.00 34.21 ? 516 THR B CA 1 ATOM 7569 C C . THR B 1 473 ? 6.664 84.978 106.786 1.00 48.83 ? 516 THR B C 1 ATOM 7570 O O . THR B 1 473 ? 7.536 85.830 106.984 1.00 46.10 ? 516 THR B O 1 ATOM 7571 C CB . THR B 1 473 ? 6.702 84.937 104.276 1.00 60.56 ? 516 THR B CB 1 ATOM 7572 O OG1 . THR B 1 473 ? 5.895 85.067 103.097 1.00 49.89 ? 516 THR B OG1 1 ATOM 7573 C CG2 . THR B 1 473 ? 7.448 83.610 104.235 1.00 46.88 ? 516 THR B CG2 1 ATOM 7574 N N . TYR B 1 474 ? 6.414 83.979 107.629 1.00 50.28 ? 517 TYR B N 1 ATOM 7575 C CA . TYR B 1 474 ? 7.183 83.754 108.846 1.00 27.36 ? 517 TYR B CA 1 ATOM 7576 C C . TYR B 1 474 ? 8.155 82.599 108.639 1.00 42.76 ? 517 TYR B C 1 ATOM 7577 O O . TYR B 1 474 ? 7.846 81.632 107.936 1.00 49.72 ? 517 TYR B O 1 ATOM 7578 C CB . TYR B 1 474 ? 6.265 83.453 110.032 1.00 39.04 ? 517 TYR B CB 1 ATOM 7579 C CG . TYR B 1 474 ? 5.300 84.571 110.377 1.00 49.74 ? 517 TYR B CG 1 ATOM 7580 C CD1 . TYR B 1 474 ? 4.063 84.665 109.752 1.00 50.54 ? 517 TYR B CD1 1 ATOM 7581 C CD2 . TYR B 1 474 ? 5.628 85.532 111.330 1.00 36.53 ? 517 TYR B CD2 1 ATOM 7582 C CE1 . TYR B 1 474 ? 3.177 85.680 110.064 1.00 46.10 ? 517 TYR B CE1 1 ATOM 7583 C CE2 . TYR B 1 474 ? 4.749 86.551 111.647 1.00 40.66 ? 517 TYR B CE2 1 ATOM 7584 C CZ . TYR B 1 474 ? 3.524 86.620 111.012 1.00 56.48 ? 517 TYR B CZ 1 ATOM 7585 O OH . TYR B 1 474 ? 2.644 87.633 111.322 1.00 61.48 ? 517 TYR B OH 1 ATOM 7586 N N . ILE B 1 475 ? 9.334 82.703 109.254 1.00 34.38 ? 518 ILE B N 1 ATOM 7587 C CA . ILE B 1 475 ? 10.361 81.675 109.147 1.00 33.17 ? 518 ILE B CA 1 ATOM 7588 C C . ILE B 1 475 ? 11.033 81.494 110.500 1.00 43.64 ? 518 ILE B C 1 ATOM 7589 O O . ILE B 1 475 ? 11.001 82.375 111.361 1.00 50.34 ? 518 ILE B O 1 ATOM 7590 C CB . ILE B 1 475 ? 11.422 82.005 108.071 1.00 30.85 ? 518 ILE B CB 1 ATOM 7591 C CG1 . ILE B 1 475 ? 12.228 83.248 108.464 1.00 38.95 ? 518 ILE B CG1 1 ATOM 7592 C CG2 . ILE B 1 475 ? 10.773 82.172 106.709 1.00 35.76 ? 518 ILE B CG2 1 ATOM 7593 C CD1 . ILE B 1 475 ? 13.465 82.957 109.297 1.00 31.12 ? 518 ILE B CD1 1 ATOM 7594 N N . LEU B 1 476 ? 11.653 80.329 110.674 1.00 35.45 ? 519 LEU B N 1 ATOM 7595 C CA . LEU B 1 476 ? 12.450 80.021 111.855 1.00 37.85 ? 519 LEU B CA 1 ATOM 7596 C C . LEU B 1 476 ? 13.911 79.986 111.424 1.00 37.86 ? 519 LEU B C 1 ATOM 7597 O O . LEU B 1 476 ? 14.325 79.083 110.690 1.00 48.31 ? 519 LEU B O 1 ATOM 7598 C CB . LEU B 1 476 ? 12.019 78.696 112.482 1.00 32.27 ? 519 LEU B CB 1 ATOM 7599 C CG . LEU B 1 476 ? 12.779 78.274 113.741 1.00 45.11 ? 519 LEU B CG 1 ATOM 7600 C CD1 . LEU B 1 476 ? 12.336 79.122 114.920 1.00 47.37 ? 519 LEU B CD1 1 ATOM 7601 C CD2 . LEU B 1 476 ? 12.573 76.798 114.042 1.00 46.29 ? 519 LEU B CD2 1 ATOM 7602 N N . ASN B 1 477 ? 14.695 80.957 111.883 1.00 41.99 ? 520 ASN B N 1 ATOM 7603 C CA . ASN B 1 477 ? 16.096 81.035 111.488 1.00 31.45 ? 520 ASN B CA 1 ATOM 7604 C C . ASN B 1 477 ? 16.838 79.976 112.288 1.00 39.96 ? 520 ASN B C 1 ATOM 7605 O O . ASN B 1 477 ? 16.980 80.097 113.509 1.00 44.44 ? 520 ASN B O 1 ATOM 7606 C CB . ASN B 1 477 ? 16.634 82.437 111.780 1.00 44.18 ? 520 ASN B CB 1 ATOM 7607 C CG . ASN B 1 477 ? 18.072 82.644 111.322 1.00 42.20 ? 520 ASN B CG 1 ATOM 7608 O OD1 . ASN B 1 477 ? 18.804 81.689 111.071 1.00 49.40 ? 520 ASN B OD1 1 ATOM 7609 N ND2 . ASN B 1 477 ? 18.485 83.914 111.236 1.00 38.75 ? 520 ASN B ND2 1 ATOM 7610 N N . LEU B 1 478 ? 17.355 78.957 111.603 1.00 37.64 ? 521 LEU B N 1 ATOM 7611 C CA . LEU B 1 478 ? 17.923 77.832 112.334 1.00 36.57 ? 521 LEU B CA 1 ATOM 7612 C C . LEU B 1 478 ? 19.285 78.162 112.911 1.00 42.42 ? 521 LEU B C 1 ATOM 7613 O O . LEU B 1 478 ? 19.644 77.641 113.972 1.00 58.48 ? 521 LEU B O 1 ATOM 7614 C CB . LEU B 1 478 ? 18.022 76.599 111.439 1.00 39.97 ? 521 LEU B CB 1 ATOM 7615 C CG . LEU B 1 478 ? 16.690 75.897 111.201 1.00 35.87 ? 521 LEU B CG 1 ATOM 7616 C CD1 . LEU B 1 478 ? 16.854 74.786 110.179 1.00 55.72 ? 521 LEU B CD1 1 ATOM 7617 C CD2 . LEU B 1 478 ? 16.151 75.359 112.511 1.00 44.03 ? 521 LEU B CD2 1 ATOM 7618 N N . THR B 1 479 ? 20.043 79.031 112.243 1.00 36.72 ? 522 THR B N 1 ATOM 7619 C CA . THR B 1 479 ? 21.336 79.436 112.774 1.00 40.75 ? 522 THR B CA 1 ATOM 7620 C C . THR B 1 479 ? 21.210 79.949 114.203 1.00 52.15 ? 522 THR B C 1 ATOM 7621 O O . THR B 1 479 ? 22.088 79.706 115.037 1.00 50.91 ? 522 THR B O 1 ATOM 7622 C CB . THR B 1 479 ? 21.962 80.492 111.867 1.00 38.53 ? 522 THR B CB 1 ATOM 7623 O OG1 . THR B 1 479 ? 22.164 79.932 110.562 1.00 48.60 ? 522 THR B OG1 1 ATOM 7624 C CG2 . THR B 1 479 ? 23.294 80.955 112.433 1.00 43.11 ? 522 THR B CG2 1 ATOM 7625 N N . GLN B 1 480 ? 20.136 80.683 114.501 1.00 40.97 ? 523 GLN B N 1 ATOM 7626 C CA . GLN B 1 480 ? 19.929 81.127 115.875 1.00 42.51 ? 523 GLN B CA 1 ATOM 7627 C C . GLN B 1 480 ? 19.264 80.056 116.732 1.00 40.38 ? 523 GLN B C 1 ATOM 7628 O O . GLN B 1 480 ? 19.674 79.834 117.875 1.00 40.50 ? 523 GLN B O 1 ATOM 7629 C CB . GLN B 1 480 ? 19.108 82.414 115.896 1.00 42.89 ? 523 GLN B CB 1 ATOM 7630 C CG . GLN B 1 480 ? 19.865 83.603 115.350 1.00 41.75 ? 523 GLN B CG 1 ATOM 7631 C CD . GLN B 1 480 ? 18.968 84.777 115.061 1.00 39.90 ? 523 GLN B CD 1 ATOM 7632 O OE1 . GLN B 1 480 ? 17.751 84.701 115.234 1.00 46.75 ? 523 GLN B OE1 1 ATOM 7633 N NE2 . GLN B 1 480 ? 19.561 85.876 114.613 1.00 36.23 ? 523 GLN B NE2 1 ATOM 7634 N N . ALA B 1 481 ? 18.250 79.373 116.196 1.00 33.78 ? 524 ALA B N 1 ATOM 7635 C CA . ALA B 1 481 ? 17.433 78.492 117.025 1.00 42.02 ? 524 ALA B CA 1 ATOM 7636 C C . ALA B 1 481 ? 18.184 77.239 117.463 1.00 46.21 ? 524 ALA B C 1 ATOM 7637 O O . ALA B 1 481 ? 17.907 76.700 118.540 1.00 44.28 ? 524 ALA B O 1 ATOM 7638 C CB . ALA B 1 481 ? 16.156 78.106 116.277 1.00 40.93 ? 524 ALA B CB 1 ATOM 7639 N N . ASN B 1 482 ? 19.128 76.759 116.659 1.00 52.24 ? 525 ASN B N 1 ATOM 7640 C CA . ASN B 1 482 ? 19.838 75.531 116.993 1.00 50.22 ? 525 ASN B CA 1 ATOM 7641 C C . ASN B 1 482 ? 21.003 75.747 117.951 1.00 51.38 ? 525 ASN B C 1 ATOM 7642 O O . ASN B 1 482 ? 21.662 74.772 118.328 1.00 49.42 ? 525 ASN B O 1 ATOM 7643 C CB . ASN B 1 482 ? 20.329 74.846 115.718 1.00 50.36 ? 525 ASN B CB 1 ATOM 7644 C CG . ASN B 1 482 ? 19.213 74.138 114.977 1.00 58.62 ? 525 ASN B CG 1 ATOM 7645 O OD1 . ASN B 1 482 ? 18.252 73.664 115.588 1.00 58.16 ? 525 ASN B OD1 1 ATOM 7646 N ND2 . ASN B 1 482 ? 19.338 74.054 113.656 1.00 52.24 ? 525 ASN B ND2 1 ATOM 7647 N N . ILE B 1 483 ? 21.271 76.980 118.354 1.00 49.62 ? 526 ILE B N 1 ATOM 7648 C CA . ILE B 1 483 ? 22.350 77.234 119.317 1.00 54.31 ? 526 ILE B CA 1 ATOM 7649 C C . ILE B 1 483 ? 21.967 76.646 120.668 1.00 52.17 ? 526 ILE B C 1 ATOM 7650 O O . ILE B 1 483 ? 20.797 76.757 121.079 1.00 48.73 ? 526 ILE B O 1 ATOM 7651 C CB . ILE B 1 483 ? 22.625 78.733 119.425 1.00 55.09 ? 526 ILE B CB 1 ATOM 7652 C CG1 . ILE B 1 483 ? 23.188 79.251 118.104 1.00 49.73 ? 526 ILE B CG1 1 ATOM 7653 C CG2 . ILE B 1 483 ? 23.579 79.019 120.575 1.00 50.33 ? 526 ILE B CG2 1 ATOM 7654 C CD1 . ILE B 1 483 ? 24.404 78.485 117.636 1.00 61.57 ? 526 ILE B CD1 1 ATOM 7655 N N . PRO B 1 484 ? 22.886 75.990 121.374 1.00 46.92 ? 527 PRO B N 1 ATOM 7656 C CA . PRO B 1 484 ? 22.543 75.434 122.689 1.00 45.27 ? 527 PRO B CA 1 ATOM 7657 C C . PRO B 1 484 ? 22.009 76.515 123.619 1.00 53.69 ? 527 PRO B C 1 ATOM 7658 O O . PRO B 1 484 ? 22.640 77.556 123.825 1.00 40.07 ? 527 PRO B O 1 ATOM 7659 C CB . PRO B 1 484 ? 23.874 74.863 123.190 1.00 38.63 ? 527 PRO B CB 1 ATOM 7660 C CG . PRO B 1 484 ? 24.686 74.641 121.955 1.00 50.76 ? 527 PRO B CG 1 ATOM 7661 C CD . PRO B 1 484 ? 24.285 75.724 121.000 1.00 46.73 ? 527 PRO B CD 1 ATOM 7662 N N . GLY B 1 485 ? 20.844 76.244 124.203 1.00 45.71 ? 528 GLY B N 1 ATOM 7663 C CA . GLY B 1 485 ? 20.170 77.180 125.072 1.00 35.67 ? 528 GLY B CA 1 ATOM 7664 C C . GLY B 1 485 ? 19.238 78.147 124.373 1.00 44.45 ? 528 GLY B C 1 ATOM 7665 O O . GLY B 1 485 ? 18.440 78.810 125.048 1.00 45.98 ? 528 GLY B O 1 ATOM 7666 N N . ALA B 1 486 ? 19.306 78.245 123.047 1.00 44.32 ? 529 ALA B N 1 ATOM 7667 C CA . ALA B 1 486 ? 18.446 79.153 122.307 1.00 34.94 ? 529 ALA B CA 1 ATOM 7668 C C . ALA B 1 486 ? 16.999 78.666 122.321 1.00 34.44 ? 529 ALA B C 1 ATOM 7669 O O . ALA B 1 486 ? 16.708 77.494 122.566 1.00 51.26 ? 529 ALA B O 1 ATOM 7670 C CB . ALA B 1 486 ? 18.937 79.307 120.870 1.00 48.37 ? 529 ALA B CB 1 ATOM 7671 N N . ILE B 1 487 ? 16.088 79.595 122.071 1.00 44.50 ? 530 ILE B N 1 ATOM 7672 C CA . ILE B 1 487 ? 14.652 79.342 122.027 1.00 41.99 ? 530 ILE B CA 1 ATOM 7673 C C . ILE B 1 487 ? 14.174 79.553 120.593 1.00 48.47 ? 530 ILE B C 1 ATOM 7674 O O . ILE B 1 487 ? 14.350 80.650 120.046 1.00 55.17 ? 530 ILE B O 1 ATOM 7675 C CB . ILE B 1 487 ? 13.889 80.249 123.004 1.00 40.53 ? 530 ILE B CB 1 ATOM 7676 C CG1 . ILE B 1 487 ? 14.430 80.058 124.421 1.00 36.18 ? 530 ILE B CG1 1 ATOM 7677 C CG2 . ILE B 1 487 ? 12.402 79.954 122.958 1.00 40.98 ? 530 ILE B CG2 1 ATOM 7678 C CD1 . ILE B 1 487 ? 13.767 80.927 125.455 1.00 38.58 ? 530 ILE B CD1 1 ATOM 7679 N N . PRO B 1 488 ? 13.586 78.548 119.946 1.00 45.24 ? 531 PRO B N 1 ATOM 7680 C CA . PRO B 1 488 ? 13.114 78.736 118.567 1.00 46.43 ? 531 PRO B CA 1 ATOM 7681 C C . PRO B 1 488 ? 12.103 79.873 118.486 1.00 40.30 ? 531 PRO B C 1 ATOM 7682 O O . PRO B 1 488 ? 11.145 79.929 119.258 1.00 44.49 ? 531 PRO B O 1 ATOM 7683 C CB . PRO B 1 488 ? 12.476 77.384 118.225 1.00 40.81 ? 531 PRO B CB 1 ATOM 7684 C CG . PRO B 1 488 ? 12.096 76.805 119.544 1.00 41.48 ? 531 PRO B CG 1 ATOM 7685 C CD . PRO B 1 488 ? 13.175 77.248 120.497 1.00 52.46 ? 531 PRO B CD 1 ATOM 7686 N N . HIS B 1 489 ? 12.318 80.779 117.533 1.00 37.06 ? 532 HIS B N 1 ATOM 7687 C CA . HIS B 1 489 ? 11.454 81.938 117.351 1.00 44.08 ? 532 HIS B CA 1 ATOM 7688 C C . HIS B 1 489 ? 11.092 82.055 115.879 1.00 46.79 ? 532 HIS B C 1 ATOM 7689 O O . HIS B 1 489 ? 11.972 81.991 115.015 1.00 54.50 ? 532 HIS B O 1 ATOM 7690 C CB . HIS B 1 489 ? 12.142 83.220 117.836 1.00 50.68 ? 532 HIS B CB 1 ATOM 7691 C CG . HIS B 1 489 ? 11.340 84.464 117.609 1.00 50.98 ? 532 HIS B CG 1 ATOM 7692 N ND1 . HIS B 1 489 ? 11.143 85.009 116.360 1.00 54.38 ? 532 HIS B ND1 1 ATOM 7693 C CD2 . HIS B 1 489 ? 10.686 85.271 118.478 1.00 72.31 ? 532 HIS B CD2 1 ATOM 7694 C CE1 . HIS B 1 489 ? 10.400 86.096 116.466 1.00 49.44 ? 532 HIS B CE1 1 ATOM 7695 N NE2 . HIS B 1 489 ? 10.108 86.277 117.741 1.00 56.42 ? 532 HIS B NE2 1 ATOM 7696 N N . TRP B 1 490 ? 9.805 82.240 115.592 1.00 39.51 ? 533 TRP B N 1 ATOM 7697 C CA . TRP B 1 490 ? 9.322 82.339 114.216 1.00 39.62 ? 533 TRP B CA 1 ATOM 7698 C C . TRP B 1 490 ? 9.137 83.811 113.875 1.00 41.12 ? 533 TRP B C 1 ATOM 7699 O O . TRP B 1 490 ? 8.142 84.429 114.260 1.00 36.48 ? 533 TRP B O 1 ATOM 7700 C CB . TRP B 1 490 ? 8.018 81.567 114.057 1.00 36.75 ? 533 TRP B CB 1 ATOM 7701 C CG . TRP B 1 490 ? 8.165 80.095 114.276 1.00 50.09 ? 533 TRP B CG 1 ATOM 7702 C CD1 . TRP B 1 490 ? 8.076 79.427 115.462 1.00 53.82 ? 533 TRP B CD1 1 ATOM 7703 C CD2 . TRP B 1 490 ? 8.434 79.105 113.278 1.00 54.22 ? 533 TRP B CD2 1 ATOM 7704 N NE1 . TRP B 1 490 ? 8.271 78.081 115.264 1.00 45.43 ? 533 TRP B NE1 1 ATOM 7705 C CE2 . TRP B 1 490 ? 8.494 77.859 113.930 1.00 41.40 ? 533 TRP B CE2 1 ATOM 7706 C CE3 . TRP B 1 490 ? 8.629 79.151 111.893 1.00 53.32 ? 533 TRP B CE3 1 ATOM 7707 C CZ2 . TRP B 1 490 ? 8.738 76.674 113.247 1.00 47.35 ? 533 TRP B CZ2 1 ATOM 7708 C CZ3 . TRP B 1 490 ? 8.872 77.976 111.218 1.00 38.37 ? 533 TRP B CZ3 1 ATOM 7709 C CH2 . TRP B 1 490 ? 8.923 76.754 111.893 1.00 47.06 ? 533 TRP B CH2 1 ATOM 7710 N N . GLN B 1 491 ? 10.066 84.351 113.088 1.00 44.36 ? 534 GLN B N 1 ATOM 7711 C CA . GLN B 1 491 ? 10.122 85.778 112.823 1.00 42.92 ? 534 GLN B CA 1 ATOM 7712 C C . GLN B 1 491 ? 9.277 86.127 111.597 1.00 42.57 ? 534 GLN B C 1 ATOM 7713 O O . GLN B 1 491 ? 8.735 85.255 110.914 1.00 51.01 ? 534 GLN B O 1 ATOM 7714 C CB . GLN B 1 491 ? 11.578 86.222 112.666 1.00 33.04 ? 534 GLN B CB 1 ATOM 7715 C CG . GLN B 1 491 ? 12.339 85.523 111.555 1.00 35.42 ? 534 GLN B CG 1 ATOM 7716 C CD . GLN B 1 491 ? 13.822 85.868 111.555 1.00 41.27 ? 534 GLN B CD 1 ATOM 7717 O OE1 . GLN B 1 491 ? 14.571 85.461 112.449 1.00 37.43 ? 534 GLN B OE1 1 ATOM 7718 N NE2 . GLN B 1 491 ? 14.254 86.613 110.542 1.00 30.28 ? 534 GLN B NE2 1 ATOM 7719 N N . LEU B 1 492 ? 9.169 87.426 111.306 1.00 47.10 ? 535 LEU B N 1 ATOM 7720 C CA . LEU B 1 492 ? 8.260 87.894 110.268 1.00 34.50 ? 535 LEU B CA 1 ATOM 7721 C C . LEU B 1 492 ? 8.874 87.962 108.879 1.00 56.73 ? 535 LEU B C 1 ATOM 7722 O O . LEU B 1 492 ? 8.124 88.046 107.900 1.00 70.78 ? 535 LEU B O 1 ATOM 7723 C CB . LEU B 1 492 ? 7.715 89.280 110.617 1.00 39.08 ? 535 LEU B CB 1 ATOM 7724 C CG . LEU B 1 492 ? 6.747 89.842 109.575 1.00 36.02 ? 535 LEU B CG 1 ATOM 7725 C CD1 . LEU B 1 492 ? 5.524 88.953 109.442 1.00 35.17 ? 535 LEU B CD1 1 ATOM 7726 C CD2 . LEU B 1 492 ? 6.342 91.266 109.921 1.00 61.37 ? 535 LEU B CD2 1 ATOM 7727 N N . LEU B 1 493 ? 10.199 87.920 108.752 1.00 56.62 ? 536 LEU B N 1 ATOM 7728 C CA . LEU B 1 493 ? 10.785 88.050 107.423 1.00 55.76 ? 536 LEU B CA 1 ATOM 7729 C C . LEU B 1 493 ? 10.244 89.303 106.740 1.00 50.20 ? 536 LEU B C 1 ATOM 7730 O O . LEU B 1 493 ? 10.564 90.422 107.152 1.00 77.51 ? 536 LEU B O 1 ATOM 7731 C CB . LEU B 1 493 ? 10.519 86.804 106.577 1.00 28.34 ? 536 LEU B CB 1 ATOM 7732 C CG . LEU B 1 493 ? 11.571 86.608 105.484 1.00 40.65 ? 536 LEU B CG 1 ATOM 7733 C CD1 . LEU B 1 493 ? 12.954 86.492 106.106 1.00 30.09 ? 536 LEU B CD1 1 ATOM 7734 C CD2 . LEU B 1 493 ? 11.262 85.383 104.639 1.00 44.65 ? 536 LEU B CD2 1 ATOM 7735 N N . TYR B 1 494 ? 9.448 89.134 105.687 1.00 32.78 ? 537 TYR B N 1 ATOM 7736 C CA . TYR B 1 494 ? 8.947 90.258 104.910 1.00 56.41 ? 537 TYR B CA 1 ATOM 7737 C C . TYR B 1 494 ? 7.423 90.284 104.859 1.00 51.95 ? 537 TYR B C 1 ATOM 7738 O O . TYR B 1 494 ? 6.743 89.317 105.211 1.00 38.34 ? 537 TYR B O 1 ATOM 7739 C CB . TYR B 1 494 ? 9.487 90.222 103.475 1.00 48.99 ? 537 TYR B CB 1 ATOM 7740 C CG . TYR B 1 494 ? 8.762 89.255 102.564 1.00 49.98 ? 537 TYR B CG 1 ATOM 7741 C CD1 . TYR B 1 494 ? 8.977 87.884 102.660 1.00 50.70 ? 537 TYR B CD1 1 ATOM 7742 C CD2 . TYR B 1 494 ? 7.877 89.712 101.597 1.00 50.38 ? 537 TYR B CD2 1 ATOM 7743 C CE1 . TYR B 1 494 ? 8.323 86.996 101.826 1.00 46.14 ? 537 TYR B CE1 1 ATOM 7744 C CE2 . TYR B 1 494 ? 7.218 88.830 100.756 1.00 59.25 ? 537 TYR B CE2 1 ATOM 7745 C CZ . TYR B 1 494 ? 7.446 87.473 100.875 1.00 50.86 ? 537 TYR B CZ 1 ATOM 7746 O OH . TYR B 1 494 ? 6.796 86.592 100.042 1.00 45.13 ? 537 TYR B OH 1 ATOM 7747 N N . ARG B 1 495 ? 6.903 91.442 104.449 1.00 50.14 ? 538 ARG B N 1 ATOM 7748 C CA . ARG B 1 495 ? 5.539 91.594 103.964 1.00 46.25 ? 538 ARG B CA 1 ATOM 7749 C C . ARG B 1 495 ? 5.580 92.011 102.500 1.00 46.42 ? 538 ARG B C 1 ATOM 7750 O O . ARG B 1 495 ? 6.420 92.824 102.100 1.00 42.24 ? 538 ARG B O 1 ATOM 7751 C CB . ARG B 1 495 ? 4.749 92.620 104.776 1.00 57.23 ? 538 ARG B CB 1 ATOM 7752 C CG . ARG B 1 495 ? 4.008 92.029 105.965 1.00 59.02 ? 538 ARG B CG 1 ATOM 7753 C CD . ARG B 1 495 ? 2.970 93.005 106.496 1.00 66.52 ? 538 ARG B CD 1 ATOM 7754 N NE . ARG B 1 495 ? 3.399 93.671 107.722 1.00 68.26 ? 538 ARG B NE 1 ATOM 7755 C CZ . ARG B 1 495 ? 2.975 93.337 108.936 1.00 66.52 ? 538 ARG B CZ 1 ATOM 7756 N NH1 . ARG B 1 495 ? 2.109 92.343 109.088 1.00 63.27 1 538 ARG B NH1 1 ATOM 7757 N NH2 . ARG B 1 495 ? 3.414 93.997 109.998 1.00 58.27 ? 538 ARG B NH2 1 ATOM 7758 N N . ALA B 1 496 ? 4.672 91.447 101.704 1.00 53.43 ? 539 ALA B N 1 ATOM 7759 C CA . ALA B 1 496 ? 4.700 91.613 100.255 1.00 45.87 ? 539 ALA B CA 1 ATOM 7760 C C . ALA B 1 496 ? 4.640 93.075 99.828 1.00 40.07 ? 539 ALA B C 1 ATOM 7761 O O . ALA B 1 496 ? 5.629 93.623 99.327 1.00 43.41 ? 539 ALA B O 1 ATOM 7762 C CB . ALA B 1 496 ? 3.544 90.843 99.615 1.00 32.75 ? 539 ALA B CB 1 ATOM 7763 N N . ARG B 1 497 ? 3.484 93.712 100.023 1.00 36.71 ? 540 ARG B N 1 ATOM 7764 C CA . ARG B 1 497 ? 3.289 95.077 99.544 1.00 39.61 ? 540 ARG B CA 1 ATOM 7765 C C . ARG B 1 497 ? 4.403 96.004 100.018 1.00 45.61 ? 540 ARG B C 1 ATOM 7766 O O . ARG B 1 497 ? 4.974 96.765 99.227 1.00 53.73 ? 540 ARG B O 1 ATOM 7767 C CB . ARG B 1 497 ? 1.927 95.594 100.007 1.00 25.29 ? 540 ARG B CB 1 ATOM 7768 C CG . ARG B 1 497 ? 0.751 94.877 99.385 1.00 37.58 ? 540 ARG B CG 1 ATOM 7769 C CD . ARG B 1 497 ? -0.540 95.624 99.654 1.00 43.59 ? 540 ARG B CD 1 ATOM 7770 N NE . ARG B 1 497 ? -0.431 97.037 99.309 1.00 50.19 ? 540 ARG B NE 1 ATOM 7771 C CZ . ARG B 1 497 ? -1.399 97.926 99.500 1.00 51.44 ? 540 ARG B CZ 1 ATOM 7772 N NH1 . ARG B 1 497 ? -2.553 97.543 100.031 1.00 58.57 1 540 ARG B NH1 1 ATOM 7773 N NH2 . ARG B 1 497 ? -1.213 99.195 99.164 1.00 48.89 ? 540 ARG B NH2 1 ATOM 7774 N N . GLU B 1 498 ? 4.728 95.954 101.310 1.00 37.75 ? 541 GLU B N 1 ATOM 7775 C CA . GLU B 1 498 ? 5.777 96.821 101.838 1.00 44.04 ? 541 GLU B CA 1 ATOM 7776 C C . GLU B 1 498 ? 7.123 96.529 101.181 1.00 44.15 ? 541 GLU B C 1 ATOM 7777 O O . GLU B 1 498 ? 7.877 97.453 100.854 1.00 43.04 ? 541 GLU B O 1 ATOM 7778 C CB . GLU B 1 498 ? 5.857 96.668 103.356 1.00 49.12 ? 541 GLU B CB 1 ATOM 7779 C CG . GLU B 1 498 ? 6.681 97.737 104.050 1.00 78.93 ? 541 GLU B CG 1 ATOM 7780 C CD . GLU B 1 498 ? 6.515 97.704 105.561 1.00 109.01 ? 541 GLU B CD 1 ATOM 7781 O OE1 . GLU B 1 498 ? 5.979 96.697 106.078 1.00 92.97 ? 541 GLU B OE1 1 ATOM 7782 O OE2 . GLU B 1 498 ? 6.910 98.688 106.228 1.00 103.18 -1 541 GLU B OE2 1 ATOM 7783 N N . THR B 1 499 ? 7.430 95.251 100.955 1.00 40.55 ? 542 THR B N 1 ATOM 7784 C CA . THR B 1 499 ? 8.758 94.882 100.472 1.00 41.33 ? 542 THR B CA 1 ATOM 7785 C C . THR B 1 499 ? 8.945 95.245 99.004 1.00 47.38 ? 542 THR B C 1 ATOM 7786 O O . THR B 1 499 ? 10.032 95.676 98.602 1.00 32.22 ? 542 THR B O 1 ATOM 7787 C CB . THR B 1 499 ? 9.002 93.388 100.690 1.00 48.59 ? 542 THR B CB 1 ATOM 7788 O OG1 . THR B 1 499 ? 9.361 93.153 102.058 1.00 51.89 ? 542 THR B OG1 1 ATOM 7789 C CG2 . THR B 1 499 ? 10.116 92.884 99.774 1.00 39.85 ? 542 THR B CG2 1 ATOM 7790 N N . TYR B 1 500 ? 7.928 95.011 98.176 1.00 49.56 ? 543 TYR B N 1 ATOM 7791 C CA . TYR B 1 500 ? 8.019 95.262 96.744 1.00 45.23 ? 543 TYR B CA 1 ATOM 7792 C C . TYR B 1 500 ? 7.394 96.586 96.314 1.00 54.09 ? 543 TYR B C 1 ATOM 7793 O O . TYR B 1 500 ? 7.443 96.918 95.126 1.00 55.79 ? 543 TYR B O 1 ATOM 7794 C CB . TYR B 1 500 ? 7.369 94.109 95.976 1.00 46.22 ? 543 TYR B CB 1 ATOM 7795 C CG . TYR B 1 500 ? 8.028 92.775 96.230 1.00 51.33 ? 543 TYR B CG 1 ATOM 7796 C CD1 . TYR B 1 500 ? 9.351 92.548 95.867 1.00 49.97 ? 543 TYR B CD1 1 ATOM 7797 C CD2 . TYR B 1 500 ? 7.334 91.747 96.852 1.00 42.58 ? 543 TYR B CD2 1 ATOM 7798 C CE1 . TYR B 1 500 ? 9.958 91.324 96.102 1.00 43.91 ? 543 TYR B CE1 1 ATOM 7799 C CE2 . TYR B 1 500 ? 7.933 90.525 97.093 1.00 45.49 ? 543 TYR B CE2 1 ATOM 7800 C CZ . TYR B 1 500 ? 9.244 90.318 96.718 1.00 33.90 ? 543 TYR B CZ 1 ATOM 7801 O OH . TYR B 1 500 ? 9.838 89.101 96.961 1.00 39.89 ? 543 TYR B OH 1 ATOM 7802 N N . GLY B 1 501 ? 6.822 97.354 97.239 1.00 49.99 ? 544 GLY B N 1 ATOM 7803 C CA . GLY B 1 501 ? 6.156 98.589 96.870 1.00 47.61 ? 544 GLY B CA 1 ATOM 7804 C C . GLY B 1 501 ? 5.039 98.387 95.861 1.00 57.51 ? 544 GLY B C 1 ATOM 7805 O O . GLY B 1 501 ? 5.005 99.048 94.818 1.00 64.34 ? 544 GLY B O 1 ATOM 7806 N N . LEU B 1 502 ? 4.129 97.454 96.150 1.00 49.24 ? 545 LEU B N 1 ATOM 7807 C CA . LEU B 1 502 ? 2.989 97.185 95.279 1.00 50.15 ? 545 LEU B CA 1 ATOM 7808 C C . LEU B 1 502 ? 1.768 97.953 95.753 1.00 62.97 ? 545 LEU B C 1 ATOM 7809 O O . LEU B 1 502 ? 1.468 97.943 96.957 1.00 62.31 ? 545 LEU B O 1 ATOM 7810 C CB . LEU B 1 502 ? 2.672 95.694 95.245 1.00 48.72 ? 545 LEU B CB 1 ATOM 7811 C CG . LEU B 1 502 ? 3.877 94.759 95.299 1.00 51.64 ? 545 LEU B CG 1 ATOM 7812 C CD1 . LEU B 1 502 ? 3.413 93.317 95.370 1.00 41.37 ? 545 LEU B CD1 1 ATOM 7813 C CD2 . LEU B 1 502 ? 4.778 94.986 94.098 1.00 52.65 ? 545 LEU B CD2 1 ATOM 7814 N N . PRO B 1 503 ? 1.038 98.620 94.856 1.00 51.32 ? 546 PRO B N 1 ATOM 7815 C CA . PRO B 1 503 ? -0.211 99.273 95.274 1.00 49.71 ? 546 PRO B CA 1 ATOM 7816 C C . PRO B 1 503 ? -1.250 98.286 95.760 1.00 48.50 ? 546 PRO B C 1 ATOM 7817 O O . PRO B 1 503 ? -2.161 98.670 96.504 1.00 44.77 ? 546 PRO B O 1 ATOM 7818 C CB . PRO B 1 503 ? -0.675 99.981 93.998 1.00 36.70 ? 546 PRO B CB 1 ATOM 7819 C CG . PRO B 1 503 ? -0.123 99.126 92.901 1.00 36.76 ? 546 PRO B CG 1 ATOM 7820 C CD . PRO B 1 503 ? 1.214 98.647 93.395 1.00 38.71 ? 546 PRO B CD 1 ATOM 7821 N N . ASN B 1 504 ? -1.143 97.030 95.348 1.00 52.39 ? 547 ASN B N 1 ATOM 7822 C CA . ASN B 1 504 ? -2.019 95.952 95.786 1.00 47.11 ? 547 ASN B CA 1 ATOM 7823 C C . ASN B 1 504 ? -1.397 94.650 95.295 1.00 47.12 ? 547 ASN B C 1 ATOM 7824 O O . ASN B 1 504 ? -0.363 94.654 94.620 1.00 57.08 ? 547 ASN B O 1 ATOM 7825 C CB . ASN B 1 504 ? -3.438 96.151 95.259 1.00 54.49 ? 547 ASN B CB 1 ATOM 7826 C CG . ASN B 1 504 ? -3.461 96.475 93.783 1.00 47.45 ? 547 ASN B CG 1 ATOM 7827 O OD1 . ASN B 1 504 ? -3.522 95.581 92.937 1.00 50.84 ? 547 ASN B OD1 1 ATOM 7828 N ND2 . ASN B 1 504 ? -3.389 97.761 93.461 1.00 59.32 ? 547 ASN B ND2 1 ATOM 7829 N N . THR B 1 505 ? -2.031 93.534 95.639 1.00 38.21 ? 548 THR B N 1 ATOM 7830 C CA . THR B 1 505 ? -1.548 92.212 95.263 1.00 50.58 ? 548 THR B CA 1 ATOM 7831 C C . THR B 1 505 ? -2.237 91.653 94.020 1.00 44.24 ? 548 THR B C 1 ATOM 7832 O O . THR B 1 505 ? -2.060 90.470 93.710 1.00 37.27 ? 548 THR B O 1 ATOM 7833 C CB . THR B 1 505 ? -1.677 91.245 96.440 1.00 38.57 ? 548 THR B CB 1 ATOM 7834 O OG1 . THR B 1 505 ? -2.972 91.377 97.036 1.00 68.08 ? 548 THR B OG1 1 ATOM 7835 C CG2 . THR B 1 505 ? -0.613 91.558 97.481 1.00 36.23 ? 548 THR B CG2 1 ATOM 7836 N N . LEU B 1 506 ? -3.042 92.461 93.322 1.00 41.32 ? 549 LEU B N 1 ATOM 7837 C CA . LEU B 1 506 ? -3.720 91.991 92.121 1.00 48.49 ? 549 LEU B CA 1 ATOM 7838 C C . LEU B 1 506 ? -2.712 91.632 91.023 1.00 52.37 ? 549 LEU B C 1 ATOM 7839 O O . LEU B 1 506 ? -1.551 92.048 91.067 1.00 58.13 ? 549 LEU B O 1 ATOM 7840 C CB . LEU B 1 506 ? -4.694 93.051 91.610 1.00 36.71 ? 549 LEU B CB 1 ATOM 7841 C CG . LEU B 1 506 ? -6.011 93.230 92.370 1.00 47.35 ? 549 LEU B CG 1 ATOM 7842 C CD1 . LEU B 1 506 ? -5.764 93.532 93.842 1.00 76.53 ? 549 LEU B CD1 1 ATOM 7843 C CD2 . LEU B 1 506 ? -6.849 94.327 91.732 1.00 36.46 ? 549 LEU B CD2 1 ATOM 7844 N N . PRO B 1 507 ? -3.153 90.876 90.010 1.00 41.01 ? 550 PRO B N 1 ATOM 7845 C CA . PRO B 1 507 ? -2.187 90.289 89.056 1.00 48.18 ? 550 PRO B CA 1 ATOM 7846 C C . PRO B 1 507 ? -1.324 91.307 88.330 1.00 44.15 ? 550 PRO B C 1 ATOM 7847 O O . PRO B 1 507 ? -0.103 91.111 88.210 1.00 46.05 ? 550 PRO B O 1 ATOM 7848 C CB . PRO B 1 507 ? -3.093 89.521 88.083 1.00 47.25 ? 550 PRO B CB 1 ATOM 7849 C CG . PRO B 1 507 ? -4.360 89.276 88.843 1.00 42.97 ? 550 PRO B CG 1 ATOM 7850 C CD . PRO B 1 507 ? -4.538 90.477 89.718 1.00 42.43 ? 550 PRO B CD 1 ATOM 7851 N N . THR B 1 508 ? -1.925 92.388 87.828 1.00 39.52 ? 551 THR B N 1 ATOM 7852 C CA . THR B 1 508 ? -1.146 93.404 87.129 1.00 49.01 ? 551 THR B CA 1 ATOM 7853 C C . THR B 1 508 ? 0.057 93.832 87.956 1.00 44.76 ? 551 THR B C 1 ATOM 7854 O O . THR B 1 508 ? 1.152 94.040 87.420 1.00 40.26 ? 551 THR B O 1 ATOM 7855 C CB . THR B 1 508 ? -2.028 94.609 86.795 1.00 56.53 ? 551 THR B CB 1 ATOM 7856 O OG1 . THR B 1 508 ? -3.221 94.164 86.136 1.00 67.48 ? 551 THR B OG1 1 ATOM 7857 C CG2 . THR B 1 508 ? -1.287 95.584 85.889 1.00 39.03 ? 551 THR B CG2 1 ATOM 7858 N N . ALA B 1 509 ? -0.124 93.948 89.273 1.00 42.87 ? 552 ALA B N 1 ATOM 7859 C CA . ALA B 1 509 ? 0.979 94.343 90.140 1.00 44.88 ? 552 ALA B CA 1 ATOM 7860 C C . ALA B 1 509 ? 2.129 93.346 90.064 1.00 56.61 ? 552 ALA B C 1 ATOM 7861 O O . ALA B 1 509 ? 3.301 93.741 90.046 1.00 49.71 ? 552 ALA B O 1 ATOM 7862 C CB . ALA B 1 509 ? 0.486 94.482 91.579 1.00 43.62 ? 552 ALA B CB 1 ATOM 7863 N N . TRP B 1 510 ? 1.817 92.047 90.021 1.00 55.05 ? 553 TRP B N 1 ATOM 7864 C CA . TRP B 1 510 ? 2.875 91.042 89.958 1.00 58.82 ? 553 TRP B CA 1 ATOM 7865 C C . TRP B 1 510 ? 3.540 91.013 88.586 1.00 52.20 ? 553 TRP B C 1 ATOM 7866 O O . TRP B 1 510 ? 4.755 90.805 88.485 1.00 45.99 ? 553 TRP B O 1 ATOM 7867 C CB . TRP B 1 510 ? 2.320 89.667 90.328 1.00 51.55 ? 553 TRP B CB 1 ATOM 7868 C CG . TRP B 1 510 ? 1.846 89.596 91.746 1.00 52.87 ? 553 TRP B CG 1 ATOM 7869 C CD1 . TRP B 1 510 ? 0.555 89.632 92.184 1.00 46.99 ? 553 TRP B CD1 1 ATOM 7870 C CD2 . TRP B 1 510 ? 2.666 89.506 92.917 1.00 41.38 ? 553 TRP B CD2 1 ATOM 7871 N NE1 . TRP B 1 510 ? 0.520 89.556 93.556 1.00 48.47 ? 553 TRP B NE1 1 ATOM 7872 C CE2 . TRP B 1 510 ? 1.803 89.479 94.030 1.00 43.68 ? 553 TRP B CE2 1 ATOM 7873 C CE3 . TRP B 1 510 ? 4.046 89.440 93.132 1.00 48.00 ? 553 TRP B CE3 1 ATOM 7874 C CZ2 . TRP B 1 510 ? 2.275 89.387 95.338 1.00 47.78 ? 553 TRP B CZ2 1 ATOM 7875 C CZ3 . TRP B 1 510 ? 4.513 89.351 94.431 1.00 44.65 ? 553 TRP B CZ3 1 ATOM 7876 C CH2 . TRP B 1 510 ? 3.630 89.324 95.517 1.00 41.86 ? 553 TRP B CH2 1 ATOM 7877 N N . HIS B 1 511 ? 2.767 91.212 87.518 1.00 44.69 ? 554 HIS B N 1 ATOM 7878 C CA . HIS B 1 511 ? 3.364 91.364 86.194 1.00 48.08 ? 554 HIS B CA 1 ATOM 7879 C C . HIS B 1 511 ? 4.375 92.507 86.185 1.00 43.13 ? 554 HIS B C 1 ATOM 7880 O O . HIS B 1 511 ? 5.562 92.326 85.855 1.00 38.52 ? 554 HIS B O 1 ATOM 7881 C CB . HIS B 1 511 ? 2.253 91.598 85.168 1.00 52.53 ? 554 HIS B CB 1 ATOM 7882 C CG . HIS B 1 511 ? 2.747 91.872 83.783 1.00 46.06 ? 554 HIS B CG 1 ATOM 7883 N ND1 . HIS B 1 511 ? 2.768 90.911 82.797 1.00 37.56 ? 554 HIS B ND1 1 ATOM 7884 C CD2 . HIS B 1 511 ? 3.211 93.008 83.212 1.00 47.48 ? 554 HIS B CD2 1 ATOM 7885 C CE1 . HIS B 1 511 ? 3.239 91.438 81.682 1.00 49.80 ? 554 HIS B CE1 1 ATOM 7886 N NE2 . HIS B 1 511 ? 3.518 92.709 81.907 1.00 55.70 ? 554 HIS B NE2 1 ATOM 7887 N N . ASN B 1 512 ? 3.913 93.701 86.563 1.00 45.94 ? 555 ASN B N 1 ATOM 7888 C CA . ASN B 1 512 ? 4.792 94.859 86.637 1.00 52.38 ? 555 ASN B CA 1 ATOM 7889 C C . ASN B 1 512 ? 5.994 94.582 87.527 1.00 49.25 ? 555 ASN B C 1 ATOM 7890 O O . ASN B 1 512 ? 7.100 95.061 87.248 1.00 55.01 ? 555 ASN B O 1 ATOM 7891 C CB . ASN B 1 512 ? 4.006 96.065 87.155 1.00 43.90 ? 555 ASN B CB 1 ATOM 7892 C CG . ASN B 1 512 ? 2.842 96.432 86.254 1.00 57.93 ? 555 ASN B CG 1 ATOM 7893 O OD1 . ASN B 1 512 ? 2.931 96.322 85.031 1.00 75.53 ? 555 ASN B OD1 1 ATOM 7894 N ND2 . ASN B 1 512 ? 1.737 96.862 86.856 1.00 44.23 ? 555 ASN B ND2 1 ATOM 7895 N N . LEU B 1 513 ? 5.807 93.790 88.587 1.00 48.20 ? 556 LEU B N 1 ATOM 7896 C CA . LEU B 1 513 ? 6.930 93.441 89.449 1.00 48.70 ? 556 LEU B CA 1 ATOM 7897 C C . LEU B 1 513 ? 7.944 92.580 88.710 1.00 53.19 ? 556 LEU B C 1 ATOM 7898 O O . LEU B 1 513 ? 9.156 92.788 88.843 1.00 46.12 ? 556 LEU B O 1 ATOM 7899 C CB . LEU B 1 513 ? 6.431 92.716 90.699 1.00 47.21 ? 556 LEU B CB 1 ATOM 7900 C CG . LEU B 1 513 ? 7.483 92.152 91.664 1.00 46.81 ? 556 LEU B CG 1 ATOM 7901 C CD1 . LEU B 1 513 ? 8.438 93.229 92.166 1.00 46.89 ? 556 LEU B CD1 1 ATOM 7902 C CD2 . LEU B 1 513 ? 6.807 91.447 92.832 1.00 40.37 ? 556 LEU B CD2 1 ATOM 7903 N N . VAL B 1 514 ? 7.472 91.619 87.914 1.00 44.83 ? 557 VAL B N 1 ATOM 7904 C CA . VAL B 1 514 ? 8.394 90.747 87.194 1.00 37.82 ? 557 VAL B CA 1 ATOM 7905 C C . VAL B 1 514 ? 9.241 91.559 86.226 1.00 52.49 ? 557 VAL B C 1 ATOM 7906 O O . VAL B 1 514 ? 10.473 91.456 86.220 1.00 50.64 ? 557 VAL B O 1 ATOM 7907 C CB . VAL B 1 514 ? 7.633 89.619 86.479 1.00 36.95 ? 557 VAL B CB 1 ATOM 7908 C CG1 . VAL B 1 514 ? 8.612 88.705 85.756 1.00 23.10 ? 557 VAL B CG1 1 ATOM 7909 C CG2 . VAL B 1 514 ? 6.802 88.839 87.476 1.00 35.86 ? 557 VAL B CG2 1 ATOM 7910 N N . TYR B 1 515 ? 8.604 92.378 85.383 1.00 42.23 ? 558 TYR B N 1 ATOM 7911 C CA . TYR B 1 515 ? 9.436 93.117 84.433 1.00 42.13 ? 558 TYR B CA 1 ATOM 7912 C C . TYR B 1 515 ? 10.294 94.166 85.134 1.00 49.99 ? 558 TYR B C 1 ATOM 7913 O O . TYR B 1 515 ? 11.425 94.438 84.700 1.00 47.38 ? 558 TYR B O 1 ATOM 7914 C CB . TYR B 1 515 ? 8.572 93.730 83.338 1.00 35.75 ? 558 TYR B CB 1 ATOM 7915 C CG . TYR B 1 515 ? 8.078 92.672 82.386 1.00 41.43 ? 558 TYR B CG 1 ATOM 7916 C CD1 . TYR B 1 515 ? 8.927 92.122 81.436 1.00 39.32 ? 558 TYR B CD1 1 ATOM 7917 C CD2 . TYR B 1 515 ? 6.780 92.201 82.454 1.00 46.30 ? 558 TYR B CD2 1 ATOM 7918 C CE1 . TYR B 1 515 ? 8.492 91.141 80.572 1.00 47.75 ? 558 TYR B CE1 1 ATOM 7919 C CE2 . TYR B 1 515 ? 6.337 91.218 81.594 1.00 61.58 ? 558 TYR B CE2 1 ATOM 7920 C CZ . TYR B 1 515 ? 7.195 90.693 80.655 1.00 60.45 ? 558 TYR B CZ 1 ATOM 7921 O OH . TYR B 1 515 ? 6.746 89.714 79.799 1.00 70.06 ? 558 TYR B OH 1 ATOM 7922 N N . ARG B 1 516 ? 9.808 94.715 86.250 1.00 35.62 ? 559 ARG B N 1 ATOM 7923 C CA . ARG B 1 516 ? 10.638 95.617 87.039 1.00 48.37 ? 559 ARG B CA 1 ATOM 7924 C C . ARG B 1 516 ? 11.880 94.897 87.544 1.00 54.23 ? 559 ARG B C 1 ATOM 7925 O O . ARG B 1 516 ? 12.964 95.488 87.628 1.00 51.47 ? 559 ARG B O 1 ATOM 7926 C CB . ARG B 1 516 ? 9.840 96.175 88.217 1.00 40.03 ? 559 ARG B CB 1 ATOM 7927 C CG . ARG B 1 516 ? 10.393 97.473 88.779 1.00 41.63 ? 559 ARG B CG 1 ATOM 7928 C CD . ARG B 1 516 ? 9.785 97.785 90.132 1.00 62.99 ? 559 ARG B CD 1 ATOM 7929 N NE . ARG B 1 516 ? 8.364 97.457 90.185 1.00 60.33 ? 559 ARG B NE 1 ATOM 7930 C CZ . ARG B 1 516 ? 7.664 97.363 91.312 1.00 72.57 ? 559 ARG B CZ 1 ATOM 7931 N NH1 . ARG B 1 516 ? 8.256 97.577 92.483 1.00 50.60 1 559 ARG B NH1 1 ATOM 7932 N NH2 . ARG B 1 516 ? 6.374 97.049 91.266 1.00 54.73 ? 559 ARG B NH2 1 ATOM 7933 N N . MET B 1 517 ? 11.742 93.613 87.872 1.00 45.95 ? 560 MET B N 1 ATOM 7934 C CA . MET B 1 517 ? 12.880 92.841 88.351 1.00 46.35 ? 560 MET B CA 1 ATOM 7935 C C . MET B 1 517 ? 13.820 92.502 87.206 1.00 50.90 ? 560 MET B C 1 ATOM 7936 O O . MET B 1 517 ? 15.045 92.521 87.376 1.00 55.42 ? 560 MET B O 1 ATOM 7937 C CB . MET B 1 517 ? 12.383 91.579 89.054 1.00 44.66 ? 560 MET B CB 1 ATOM 7938 C CG . MET B 1 517 ? 12.063 91.791 90.527 1.00 50.11 ? 560 MET B CG 1 ATOM 7939 S SD . MET B 1 517 ? 11.214 90.395 91.293 1.00 56.74 ? 560 MET B SD 1 ATOM 7940 C CE . MET B 1 517 ? 12.345 89.058 90.937 1.00 52.40 ? 560 MET B CE 1 ATOM 7941 N N . ARG B 1 518 ? 13.267 92.197 86.028 1.00 55.92 ? 561 ARG B N 1 ATOM 7942 C CA . ARG B 1 518 ? 14.098 92.119 84.833 1.00 54.13 ? 561 ARG B CA 1 ATOM 7943 C C . ARG B 1 518 ? 14.969 93.359 84.709 1.00 53.15 ? 561 ARG B C 1 ATOM 7944 O O . ARG B 1 518 ? 16.147 93.268 84.342 1.00 51.12 ? 561 ARG B O 1 ATOM 7945 C CB . ARG B 1 518 ? 13.228 91.946 83.586 1.00 48.70 ? 561 ARG B CB 1 ATOM 7946 C CG . ARG B 1 518 ? 13.946 92.268 82.279 1.00 53.02 ? 561 ARG B CG 1 ATOM 7947 C CD . ARG B 1 518 ? 15.236 91.472 82.125 1.00 69.79 ? 561 ARG B CD 1 ATOM 7948 N NE . ARG B 1 518 ? 16.029 91.937 80.987 1.00 99.44 ? 561 ARG B NE 1 ATOM 7949 C CZ . ARG B 1 518 ? 17.244 91.489 80.682 1.00 93.41 ? 561 ARG B CZ 1 ATOM 7950 N NH1 . ARG B 1 518 ? 17.820 90.557 81.430 1.00 75.77 1 561 ARG B NH1 1 ATOM 7951 N NH2 . ARG B 1 518 ? 17.886 91.976 79.628 1.00 88.31 ? 561 ARG B NH2 1 ATOM 7952 N N . GLY B 1 519 ? 14.411 94.528 85.017 1.00 51.69 ? 562 GLY B N 1 ATOM 7953 C CA . GLY B 1 519 ? 15.216 95.735 85.003 1.00 56.85 ? 562 GLY B CA 1 ATOM 7954 C C . GLY B 1 519 ? 16.149 95.933 86.186 1.00 61.94 ? 562 GLY B C 1 ATOM 7955 O O . GLY B 1 519 ? 17.340 96.198 85.996 1.00 70.73 ? 562 GLY B O 1 ATOM 7956 N N . ASP B 1 520 ? 15.637 95.786 87.410 1.00 69.60 ? 563 ASP B N 1 ATOM 7957 C CA . ASP B 1 520 ? 16.362 96.161 88.626 1.00 72.59 ? 563 ASP B CA 1 ATOM 7958 C C . ASP B 1 520 ? 16.982 94.924 89.268 1.00 57.97 ? 563 ASP B C 1 ATOM 7959 O O . ASP B 1 520 ? 16.266 94.045 89.757 1.00 61.86 ? 563 ASP B O 1 ATOM 7960 C CB . ASP B 1 520 ? 15.431 96.872 89.607 1.00 60.88 ? 563 ASP B CB 1 ATOM 7961 C CG . ASP B 1 520 ? 16.158 97.393 90.839 1.00 73.84 ? 563 ASP B CG 1 ATOM 7962 O OD1 . ASP B 1 520 ? 17.139 96.755 91.279 1.00 83.56 ? 563 ASP B OD1 1 ATOM 7963 O OD2 . ASP B 1 520 ? 15.742 98.443 91.375 1.00 78.74 -1 563 ASP B OD2 1 ATOM 7964 N N . MET B 1 521 ? 18.315 94.876 89.299 1.00 57.53 ? 564 MET B N 1 ATOM 7965 C CA . MET B 1 521 ? 19.000 93.705 89.835 1.00 64.11 ? 564 MET B CA 1 ATOM 7966 C C . MET B 1 521 ? 18.939 93.658 91.357 1.00 66.99 ? 564 MET B C 1 ATOM 7967 O O . MET B 1 521 ? 18.838 92.574 91.939 1.00 62.48 ? 564 MET B O 1 ATOM 7968 C CB . MET B 1 521 ? 20.455 93.684 89.361 1.00 85.23 ? 564 MET B CB 1 ATOM 7969 C CG . MET B 1 521 ? 21.254 92.476 89.839 1.00 61.25 ? 564 MET B CG 1 ATOM 7970 S SD . MET B 1 521 ? 20.541 90.899 89.332 1.00 88.03 ? 564 MET B SD 1 ATOM 7971 C CE . MET B 1 521 ? 21.121 90.785 87.642 1.00 99.42 ? 564 MET B CE 1 ATOM 7972 N N . GLN B 1 522 ? 18.997 94.815 92.019 1.00 65.96 ? 565 GLN B N 1 ATOM 7973 C CA . GLN B 1 522 ? 18.895 94.834 93.476 1.00 51.65 ? 565 GLN B CA 1 ATOM 7974 C C . GLN B 1 522 ? 17.553 94.269 93.932 1.00 58.20 ? 565 GLN B C 1 ATOM 7975 O O . GLN B 1 522 ? 17.488 93.419 94.832 1.00 71.32 ? 565 GLN B O 1 ATOM 7976 C CB . GLN B 1 522 ? 19.101 96.261 93.987 1.00 48.18 ? 565 GLN B CB 1 ATOM 7977 C CG . GLN B 1 522 ? 18.968 96.419 95.493 1.00 96.20 ? 565 GLN B CG 1 ATOM 7978 C CD . GLN B 1 522 ? 19.207 97.847 95.956 1.00 106.75 ? 565 GLN B CD 1 ATOM 7979 O OE1 . GLN B 1 522 ? 19.530 98.726 95.155 1.00 104.13 ? 565 GLN B OE1 1 ATOM 7980 N NE2 . GLN B 1 522 ? 19.056 98.082 97.256 1.00 97.39 ? 565 GLN B NE2 1 ATOM 7981 N N . LEU B 1 523 ? 16.468 94.725 93.305 1.00 58.38 ? 566 LEU B N 1 ATOM 7982 C CA . LEU B 1 523 ? 15.143 94.211 93.628 1.00 46.65 ? 566 LEU B CA 1 ATOM 7983 C C . LEU B 1 523 ? 15.082 92.697 93.447 1.00 52.52 ? 566 LEU B C 1 ATOM 7984 O O . LEU B 1 523 ? 14.582 91.973 94.319 1.00 57.47 ? 566 LEU B O 1 ATOM 7985 C CB . LEU B 1 523 ? 14.094 94.906 92.762 1.00 40.39 ? 566 LEU B CB 1 ATOM 7986 C CG . LEU B 1 523 ? 12.652 94.764 93.242 1.00 46.80 ? 566 LEU B CG 1 ATOM 7987 C CD1 . LEU B 1 523 ? 12.492 95.418 94.605 1.00 53.50 ? 566 LEU B CD1 1 ATOM 7988 C CD2 . LEU B 1 523 ? 11.694 95.373 92.235 1.00 65.43 ? 566 LEU B CD2 1 ATOM 7989 N N . PHE B 1 524 ? 15.574 92.194 92.311 1.00 52.84 ? 567 PHE B N 1 ATOM 7990 C CA . PHE B 1 524 ? 15.584 90.748 92.125 1.00 49.97 ? 567 PHE B CA 1 ATOM 7991 C C . PHE B 1 524 ? 16.396 90.069 93.213 1.00 47.58 ? 567 PHE B C 1 ATOM 7992 O O . PHE B 1 524 ? 16.047 88.974 93.657 1.00 57.55 ? 567 PHE B O 1 ATOM 7993 C CB . PHE B 1 524 ? 16.134 90.356 90.757 1.00 52.32 ? 567 PHE B CB 1 ATOM 7994 C CG . PHE B 1 524 ? 16.342 88.868 90.607 1.00 36.26 ? 567 PHE B CG 1 ATOM 7995 C CD1 . PHE B 1 524 ? 15.282 88.037 90.282 1.00 37.83 ? 567 PHE B CD1 1 ATOM 7996 C CD2 . PHE B 1 524 ? 17.589 88.300 90.817 1.00 42.48 ? 567 PHE B CD2 1 ATOM 7997 C CE1 . PHE B 1 524 ? 15.461 86.668 90.157 1.00 35.42 ? 567 PHE B CE1 1 ATOM 7998 C CE2 . PHE B 1 524 ? 17.776 86.932 90.693 1.00 49.03 ? 567 PHE B CE2 1 ATOM 7999 C CZ . PHE B 1 524 ? 16.710 86.115 90.362 1.00 43.50 ? 567 PHE B CZ 1 ATOM 8000 N N . GLN B 1 525 ? 17.491 90.694 93.647 1.00 49.89 ? 568 GLN B N 1 ATOM 8001 C CA . GLN B 1 525 ? 18.253 90.127 94.752 1.00 45.45 ? 568 GLN B CA 1 ATOM 8002 C C . GLN B 1 525 ? 17.374 89.977 95.982 1.00 44.45 ? 568 GLN B C 1 ATOM 8003 O O . GLN B 1 525 ? 17.448 88.967 96.694 1.00 46.15 ? 568 GLN B O 1 ATOM 8004 C CB . GLN B 1 525 ? 19.472 90.996 95.053 1.00 52.87 ? 568 GLN B CB 1 ATOM 8005 C CG . GLN B 1 525 ? 20.599 90.789 94.070 1.00 64.75 ? 568 GLN B CG 1 ATOM 8006 C CD . GLN B 1 525 ? 20.917 89.321 93.886 1.00 81.61 ? 568 GLN B CD 1 ATOM 8007 O OE1 . GLN B 1 525 ? 20.901 88.548 94.845 1.00 87.18 ? 568 GLN B OE1 1 ATOM 8008 N NE2 . GLN B 1 525 ? 21.189 88.924 92.650 1.00 91.12 ? 568 GLN B NE2 1 ATOM 8009 N N . THR B 1 526 ? 16.516 90.966 96.234 1.00 52.78 ? 569 THR B N 1 ATOM 8010 C CA . THR B 1 526 ? 15.537 90.841 97.309 1.00 35.65 ? 569 THR B CA 1 ATOM 8011 C C . THR B 1 526 ? 14.624 89.640 97.081 1.00 39.40 ? 569 THR B C 1 ATOM 8012 O O . THR B 1 526 ? 14.490 88.767 97.952 1.00 49.76 ? 569 THR B O 1 ATOM 8013 C CB . THR B 1 526 ? 14.719 92.127 97.413 1.00 33.14 ? 569 THR B CB 1 ATOM 8014 O OG1 . THR B 1 526 ? 15.589 93.221 97.732 1.00 54.07 ? 569 THR B OG1 1 ATOM 8015 C CG2 . THR B 1 526 ? 13.648 91.998 98.478 1.00 30.54 ? 569 THR B CG2 1 ATOM 8016 N N . PHE B 1 527 ? 13.988 89.576 95.907 1.00 44.60 ? 570 PHE B N 1 ATOM 8017 C CA . PHE B 1 527 ? 13.077 88.470 95.619 1.00 42.77 ? 570 PHE B CA 1 ATOM 8018 C C . PHE B 1 527 ? 13.774 87.125 95.749 1.00 40.33 ? 570 PHE B C 1 ATOM 8019 O O . PHE B 1 527 ? 13.127 86.116 96.041 1.00 46.00 ? 570 PHE B O 1 ATOM 8020 C CB . PHE B 1 527 ? 12.489 88.617 94.215 1.00 44.73 ? 570 PHE B CB 1 ATOM 8021 C CG . PHE B 1 527 ? 11.734 87.403 93.741 1.00 33.27 ? 570 PHE B CG 1 ATOM 8022 C CD1 . PHE B 1 527 ? 10.388 87.256 94.021 1.00 32.99 ? 570 PHE B CD1 1 ATOM 8023 C CD2 . PHE B 1 527 ? 12.375 86.404 93.024 1.00 43.29 ? 570 PHE B CD2 1 ATOM 8024 C CE1 . PHE B 1 527 ? 9.692 86.141 93.589 1.00 38.25 ? 570 PHE B CE1 1 ATOM 8025 C CE2 . PHE B 1 527 ? 11.685 85.287 92.592 1.00 39.98 ? 570 PHE B CE2 1 ATOM 8026 C CZ . PHE B 1 527 ? 10.343 85.154 92.876 1.00 44.20 ? 570 PHE B CZ 1 ATOM 8027 N N . TRP B 1 528 ? 15.084 87.090 95.516 1.00 39.51 ? 571 TRP B N 1 ATOM 8028 C CA . TRP B 1 528 ? 15.867 85.865 95.596 1.00 41.85 ? 571 TRP B CA 1 ATOM 8029 C C . TRP B 1 528 ? 16.131 85.490 97.047 1.00 47.49 ? 571 TRP B C 1 ATOM 8030 O O . TRP B 1 528 ? 16.023 84.316 97.422 1.00 47.29 ? 571 TRP B O 1 ATOM 8031 C CB . TRP B 1 528 ? 17.170 86.063 94.816 1.00 44.31 ? 571 TRP B CB 1 ATOM 8032 C CG . TRP B 1 528 ? 18.079 84.876 94.709 1.00 49.23 ? 571 TRP B CG 1 ATOM 8033 C CD1 . TRP B 1 528 ? 19.274 84.702 95.340 1.00 49.66 ? 571 TRP B CD1 1 ATOM 8034 C CD2 . TRP B 1 528 ? 17.883 83.711 93.898 1.00 53.77 ? 571 TRP B CD2 1 ATOM 8035 N NE1 . TRP B 1 528 ? 19.831 83.499 94.982 1.00 48.91 ? 571 TRP B NE1 1 ATOM 8036 C CE2 . TRP B 1 528 ? 18.995 82.870 94.098 1.00 46.45 ? 571 TRP B CE2 1 ATOM 8037 C CE3 . TRP B 1 528 ? 16.869 83.294 93.029 1.00 51.74 ? 571 TRP B CE3 1 ATOM 8038 C CZ2 . TRP B 1 528 ? 19.124 81.638 93.462 1.00 47.95 ? 571 TRP B CZ2 1 ATOM 8039 C CZ3 . TRP B 1 528 ? 16.998 82.069 92.400 1.00 40.78 ? 571 TRP B CZ3 1 ATOM 8040 C CH2 . TRP B 1 528 ? 18.118 81.257 92.618 1.00 41.84 ? 571 TRP B CH2 1 ATOM 8041 N N . PHE B 1 529 ? 16.457 86.485 97.875 1.00 49.63 ? 572 PHE B N 1 ATOM 8042 C CA . PHE B 1 529 ? 16.604 86.251 99.306 1.00 37.34 ? 572 PHE B CA 1 ATOM 8043 C C . PHE B 1 529 ? 15.319 85.693 99.904 1.00 42.86 ? 572 PHE B C 1 ATOM 8044 O O . PHE B 1 529 ? 15.347 84.724 100.670 1.00 45.86 ? 572 PHE B O 1 ATOM 8045 C CB . PHE B 1 529 ? 17.012 87.549 100.000 1.00 38.22 ? 572 PHE B CB 1 ATOM 8046 C CG . PHE B 1 529 ? 17.033 87.460 101.497 1.00 40.38 ? 572 PHE B CG 1 ATOM 8047 C CD1 . PHE B 1 529 ? 15.879 87.670 102.234 1.00 45.92 ? 572 PHE B CD1 1 ATOM 8048 C CD2 . PHE B 1 529 ? 18.210 87.186 102.170 1.00 36.54 ? 572 PHE B CD2 1 ATOM 8049 C CE1 . PHE B 1 529 ? 15.899 87.595 103.610 1.00 36.58 ? 572 PHE B CE1 1 ATOM 8050 C CE2 . PHE B 1 529 ? 18.234 87.111 103.547 1.00 32.79 ? 572 PHE B CE2 1 ATOM 8051 C CZ . PHE B 1 529 ? 17.078 87.314 104.265 1.00 36.71 ? 572 PHE B CZ 1 ATOM 8052 N N . LEU B 1 530 ? 14.176 86.303 99.579 1.00 36.34 ? 573 LEU B N 1 ATOM 8053 C CA . LEU B 1 530 ? 12.914 85.781 100.098 1.00 33.58 ? 573 LEU B CA 1 ATOM 8054 C C . LEU B 1 530 ? 12.541 84.456 99.446 1.00 48.91 ? 573 LEU B C 1 ATOM 8055 O O . LEU B 1 530 ? 11.883 83.617 100.074 1.00 39.27 ? 573 LEU B O 1 ATOM 8056 C CB . LEU B 1 530 ? 11.804 86.810 99.907 1.00 29.41 ? 573 LEU B CB 1 ATOM 8057 C CG . LEU B 1 530 ? 12.092 88.114 100.648 1.00 43.52 ? 573 LEU B CG 1 ATOM 8058 C CD1 . LEU B 1 530 ? 11.000 89.133 100.389 1.00 45.20 ? 573 LEU B CD1 1 ATOM 8059 C CD2 . LEU B 1 530 ? 12.241 87.839 102.138 1.00 32.92 ? 573 LEU B CD2 1 ATOM 8060 N N . TYR B 1 531 ? 12.944 84.263 98.190 1.00 42.08 ? 574 TYR B N 1 ATOM 8061 C CA . TYR B 1 531 ? 12.692 83.013 97.482 1.00 45.76 ? 574 TYR B CA 1 ATOM 8062 C C . TYR B 1 531 ? 13.115 81.820 98.327 1.00 41.81 ? 574 TYR B C 1 ATOM 8063 O O . TYR B 1 531 ? 12.380 80.833 98.446 1.00 34.28 ? 574 TYR B O 1 ATOM 8064 C CB . TYR B 1 531 ? 13.447 83.051 96.149 1.00 49.19 ? 574 TYR B CB 1 ATOM 8065 C CG . TYR B 1 531 ? 13.177 81.933 95.164 1.00 47.63 ? 574 TYR B CG 1 ATOM 8066 C CD1 . TYR B 1 531 ? 12.115 82.009 94.274 1.00 54.53 ? 574 TYR B CD1 1 ATOM 8067 C CD2 . TYR B 1 531 ? 14.024 80.836 95.076 1.00 52.52 ? 574 TYR B CD2 1 ATOM 8068 C CE1 . TYR B 1 531 ? 11.878 81.005 93.353 1.00 53.83 ? 574 TYR B CE1 1 ATOM 8069 C CE2 . TYR B 1 531 ? 13.797 79.830 94.156 1.00 54.72 ? 574 TYR B CE2 1 ATOM 8070 C CZ . TYR B 1 531 ? 12.724 79.919 93.296 1.00 55.05 ? 574 TYR B CZ 1 ATOM 8071 O OH . TYR B 1 531 ? 12.492 78.920 92.379 1.00 78.43 ? 574 TYR B OH 1 ATOM 8072 N N . HIS B 1 532 ? 14.284 81.915 98.951 1.00 36.11 ? 575 HIS B N 1 ATOM 8073 C CA . HIS B 1 532 ? 14.856 80.871 99.788 1.00 38.45 ? 575 HIS B CA 1 ATOM 8074 C C . HIS B 1 532 ? 14.449 80.990 101.251 1.00 39.97 ? 575 HIS B C 1 ATOM 8075 O O . HIS B 1 532 ? 15.051 80.331 102.106 1.00 39.51 ? 575 HIS B O 1 ATOM 8076 C CB . HIS B 1 532 ? 16.379 80.871 99.658 1.00 40.76 ? 575 HIS B CB 1 ATOM 8077 C CG . HIS B 1 532 ? 16.857 80.574 98.271 1.00 54.26 ? 575 HIS B CG 1 ATOM 8078 N ND1 . HIS B 1 532 ? 16.554 81.376 97.191 1.00 57.49 ? 575 HIS B ND1 1 ATOM 8079 C CD2 . HIS B 1 532 ? 17.596 79.551 97.784 1.00 47.55 ? 575 HIS B CD2 1 ATOM 8080 C CE1 . HIS B 1 532 ? 17.098 80.865 96.100 1.00 53.31 ? 575 HIS B CE1 1 ATOM 8081 N NE2 . HIS B 1 532 ? 17.735 79.757 96.433 1.00 51.03 ? 575 HIS B NE2 1 ATOM 8082 N N . LYS B 1 533 ? 13.500 81.864 101.573 1.00 40.78 ? 576 LYS B N 1 ATOM 8083 C CA . LYS B 1 533 ? 13.056 82.029 102.951 1.00 37.28 ? 576 LYS B CA 1 ATOM 8084 C C . LYS B 1 533 ? 14.184 82.554 103.824 1.00 29.46 ? 576 LYS B C 1 ATOM 8085 O O . LYS B 1 533 ? 14.289 82.206 105.001 1.00 46.98 ? 576 LYS B O 1 ATOM 8086 C CB . LYS B 1 533 ? 12.502 80.718 103.517 1.00 36.40 ? 576 LYS B CB 1 ATOM 8087 C CG . LYS B 1 533 ? 11.150 80.311 102.946 1.00 35.10 ? 576 LYS B CG 1 ATOM 8088 C CD . LYS B 1 533 ? 10.744 78.925 103.419 1.00 40.15 ? 576 LYS B CD 1 ATOM 8089 C CE . LYS B 1 533 ? 11.743 77.880 102.950 1.00 48.35 ? 576 LYS B CE 1 ATOM 8090 N NZ . LYS B 1 533 ? 11.358 76.503 103.369 1.00 45.52 1 576 LYS B NZ 1 ATOM 8091 N N . GLY B 1 534 ? 15.047 83.380 103.240 1.00 36.52 ? 577 GLY B N 1 ATOM 8092 C CA . GLY B 1 534 ? 16.100 84.041 103.972 1.00 38.76 ? 577 GLY B CA 1 ATOM 8093 C C . GLY B 1 534 ? 17.413 83.299 104.026 1.00 38.81 ? 577 GLY B C 1 ATOM 8094 O O . GLY B 1 534 ? 18.348 83.783 104.676 1.00 42.37 ? 577 GLY B O 1 ATOM 8095 N N . HIS B 1 535 ? 17.527 82.153 103.360 1.00 43.68 ? 578 HIS B N 1 ATOM 8096 C CA . HIS B 1 535 ? 18.759 81.366 103.356 1.00 49.66 ? 578 HIS B CA 1 ATOM 8097 C C . HIS B 1 535 ? 19.127 81.034 101.914 1.00 49.02 ? 578 HIS B C 1 ATOM 8098 O O . HIS B 1 535 ? 19.132 79.866 101.507 1.00 49.56 ? 578 HIS B O 1 ATOM 8099 C CB . HIS B 1 535 ? 18.600 80.101 104.201 1.00 41.31 ? 578 HIS B CB 1 ATOM 8100 C CG . HIS B 1 535 ? 19.899 79.497 104.637 1.00 55.21 ? 578 HIS B CG 1 ATOM 8101 N ND1 . HIS B 1 535 ? 20.591 79.947 105.740 1.00 58.80 ? 578 HIS B ND1 1 ATOM 8102 C CD2 . HIS B 1 535 ? 20.630 78.478 104.125 1.00 63.73 ? 578 HIS B CD2 1 ATOM 8103 C CE1 . HIS B 1 535 ? 21.694 79.235 105.887 1.00 53.44 ? 578 HIS B CE1 1 ATOM 8104 N NE2 . HIS B 1 535 ? 21.742 78.337 104.920 1.00 51.27 ? 578 HIS B NE2 1 ATOM 8105 N N . PRO B 1 536 ? 19.451 82.045 101.115 1.00 51.92 ? 579 PRO B N 1 ATOM 8106 C CA . PRO B 1 536 ? 19.824 81.802 99.722 1.00 51.17 ? 579 PRO B CA 1 ATOM 8107 C C . PRO B 1 536 ? 21.143 81.056 99.640 1.00 52.02 ? 579 PRO B C 1 ATOM 8108 O O . PRO B 1 536 ? 21.954 81.104 100.577 1.00 53.80 ? 579 PRO B O 1 ATOM 8109 C CB . PRO B 1 536 ? 19.942 83.215 99.136 1.00 40.65 ? 579 PRO B CB 1 ATOM 8110 C CG . PRO B 1 536 ? 20.280 84.064 100.301 1.00 51.93 ? 579 PRO B CG 1 ATOM 8111 C CD . PRO B 1 536 ? 19.534 83.471 101.468 1.00 54.07 ? 579 PRO B CD 1 ATOM 8112 N N . PRO B 1 537 ? 21.399 80.368 98.530 1.00 62.60 ? 580 PRO B N 1 ATOM 8113 C CA . PRO B 1 537 ? 22.607 79.539 98.436 1.00 61.16 ? 580 PRO B CA 1 ATOM 8114 C C . PRO B 1 537 ? 23.888 80.351 98.347 1.00 67.45 ? 580 PRO B C 1 ATOM 8115 O O . PRO B 1 537 ? 23.863 81.586 98.340 1.00 60.60 ? 580 PRO B O 1 ATOM 8116 C CB . PRO B 1 537 ? 22.372 78.731 97.154 1.00 47.92 ? 580 PRO B CB 1 ATOM 8117 C CG . PRO B 1 537 ? 21.505 79.616 96.326 1.00 62.00 ? 580 PRO B CG 1 ATOM 8118 C CD . PRO B 1 537 ? 20.606 80.340 97.290 1.00 55.89 ? 580 PRO B CD 1 ATOM 8119 N N . SER B 1 538 ? 25.020 79.648 98.291 1.00 74.32 ? 581 SER B N 1 ATOM 8120 C CA . SER B 1 538 ? 26.312 80.318 98.213 1.00 59.11 ? 581 SER B CA 1 ATOM 8121 C C . SER B 1 538 ? 26.560 80.892 96.825 1.00 86.44 ? 581 SER B C 1 ATOM 8122 O O . SER B 1 538 ? 27.211 81.935 96.695 1.00 90.19 ? 581 SER B O 1 ATOM 8123 C CB . SER B 1 538 ? 27.425 79.339 98.583 1.00 84.47 ? 581 SER B CB 1 ATOM 8124 O OG . SER B 1 538 ? 27.050 78.534 99.689 1.00 87.33 ? 581 SER B OG 1 ATOM 8125 N N . GLU B 1 539 ? 26.050 80.235 95.786 1.00 88.36 ? 582 GLU B N 1 ATOM 8126 C CA . GLU B 1 539 ? 26.264 80.705 94.426 1.00 79.72 ? 582 GLU B CA 1 ATOM 8127 C C . GLU B 1 539 ? 25.592 82.059 94.210 1.00 79.80 ? 582 GLU B C 1 ATOM 8128 O O . GLU B 1 539 ? 24.467 82.280 94.676 1.00 82.71 ? 582 GLU B O 1 ATOM 8129 C CB . GLU B 1 539 ? 25.728 79.698 93.406 1.00 87.00 ? 582 GLU B CB 1 ATOM 8130 C CG . GLU B 1 539 ? 26.482 78.377 93.343 1.00 113.59 ? 582 GLU B CG 1 ATOM 8131 C CD . GLU B 1 539 ? 26.275 77.654 92.018 1.00 122.38 ? 582 GLU B CD 1 ATOM 8132 O OE1 . GLU B 1 539 ? 26.077 78.338 90.991 1.00 100.23 ? 582 GLU B OE1 1 ATOM 8133 O OE2 . GLU B 1 539 ? 26.303 76.404 92.004 1.00 117.74 -1 582 GLU B OE2 1 ATOM 8134 N N . PRO B 1 540 ? 26.253 82.984 93.508 1.00 74.28 ? 583 PRO B N 1 ATOM 8135 C CA . PRO B 1 540 ? 25.712 84.344 93.351 1.00 80.93 ? 583 PRO B CA 1 ATOM 8136 C C . PRO B 1 540 ? 24.454 84.428 92.494 1.00 79.79 ? 583 PRO B C 1 ATOM 8137 O O . PRO B 1 540 ? 23.803 85.482 92.499 1.00 85.36 ? 583 PRO B O 1 ATOM 8138 C CB . PRO B 1 540 ? 26.876 85.109 92.707 1.00 75.92 ? 583 PRO B CB 1 ATOM 8139 C CG . PRO B 1 540 ? 27.680 84.063 92.017 1.00 79.28 ? 583 PRO B CG 1 ATOM 8140 C CD . PRO B 1 540 ? 27.573 82.834 92.873 1.00 90.32 ? 583 PRO B CD 1 ATOM 8141 N N . CYS B 1 541 ? 24.091 83.371 91.764 1.00 77.45 ? 584 CYS B N 1 ATOM 8142 C CA . CYS B 1 541 ? 23.010 83.451 90.785 1.00 101.05 ? 584 CYS B CA 1 ATOM 8143 C C . CYS B 1 541 ? 23.415 84.394 89.655 1.00 110.77 ? 584 CYS B C 1 ATOM 8144 O O . CYS B 1 541 ? 24.445 84.165 89.012 1.00 120.01 ? 584 CYS B O 1 ATOM 8145 C CB . CYS B 1 541 ? 21.709 83.889 91.475 1.00 85.11 ? 584 CYS B CB 1 ATOM 8146 S SG . CYS B 1 541 ? 20.250 84.226 90.437 1.00 84.49 ? 584 CYS B SG 1 ATOM 8147 N N . GLY B 1 542 ? 22.643 85.437 89.384 1.00 82.33 ? 585 GLY B N 1 ATOM 8148 C CA . GLY B 1 542 ? 23.011 86.340 88.308 1.00 90.87 ? 585 GLY B CA 1 ATOM 8149 C C . GLY B 1 542 ? 22.164 86.178 87.059 1.00 76.03 ? 585 GLY B C 1 ATOM 8150 O O . GLY B 1 542 ? 21.121 85.520 87.041 1.00 62.23 ? 585 GLY B O 1 ATOM 8151 N N . THR B 1 543 ? 22.662 86.789 85.975 1.00 63.23 ? 586 THR B N 1 ATOM 8152 C CA . THR B 1 543 ? 21.884 87.052 84.768 1.00 61.62 ? 586 THR B CA 1 ATOM 8153 C C . THR B 1 543 ? 21.130 85.840 84.228 1.00 57.40 ? 586 THR B C 1 ATOM 8154 O O . THR B 1 543 ? 19.899 85.891 84.113 1.00 57.42 ? 586 THR B O 1 ATOM 8155 C CB . THR B 1 543 ? 22.797 87.599 83.669 1.00 55.91 ? 586 THR B CB 1 ATOM 8156 O OG1 . THR B 1 543 ? 23.683 88.579 84.222 1.00 61.08 ? 586 THR B OG1 1 ATOM 8157 C CG2 . THR B 1 543 ? 21.967 88.240 82.567 1.00 55.52 ? 586 THR B CG2 1 ATOM 8158 N N . PRO B 1 544 ? 21.802 84.738 83.885 1.00 55.77 ? 587 PRO B N 1 ATOM 8159 C CA . PRO B 1 544 ? 21.046 83.580 83.373 1.00 49.32 ? 587 PRO B CA 1 ATOM 8160 C C . PRO B 1 544 ? 20.110 82.993 84.413 1.00 64.90 ? 587 PRO B C 1 ATOM 8161 O O . PRO B 1 544 ? 18.974 82.610 84.098 1.00 60.07 ? 587 PRO B O 1 ATOM 8162 C CB . PRO B 1 544 ? 22.152 82.599 82.964 1.00 52.50 ? 587 PRO B CB 1 ATOM 8163 C CG . PRO B 1 544 ? 23.303 82.954 83.848 1.00 60.34 ? 587 PRO B CG 1 ATOM 8164 C CD . PRO B 1 544 ? 23.240 84.448 84.018 1.00 60.13 ? 587 PRO B CD 1 ATOM 8165 N N . CYS B 1 545 ? 20.575 82.923 85.661 1.00 65.23 ? 588 CYS B N 1 ATOM 8166 C CA . CYS B 1 545 ? 19.726 82.515 86.774 1.00 55.37 ? 588 CYS B CA 1 ATOM 8167 C C . CYS B 1 545 ? 18.516 83.435 86.916 1.00 49.09 ? 588 CYS B C 1 ATOM 8168 O O . CYS B 1 545 ? 17.370 82.971 86.980 1.00 54.38 ? 588 CYS B O 1 ATOM 8169 C CB . CYS B 1 545 ? 20.572 82.480 88.050 1.00 59.20 ? 588 CYS B CB 1 ATOM 8170 S SG . CYS B 1 545 ? 19.695 82.446 89.617 1.00 73.14 ? 588 CYS B SG 1 ATOM 8171 N N . ARG B 1 546 ? 18.751 84.750 86.950 1.00 40.56 ? 589 ARG B N 1 ATOM 8172 C CA . ARG B 1 546 ? 17.643 85.697 87.054 1.00 48.03 ? 589 ARG B CA 1 ATOM 8173 C C . ARG B 1 546 ? 16.632 85.478 85.938 1.00 46.41 ? 589 ARG B C 1 ATOM 8174 O O . ARG B 1 546 ? 15.417 85.441 86.177 1.00 45.38 ? 589 ARG B O 1 ATOM 8175 C CB . ARG B 1 546 ? 18.162 87.134 87.021 1.00 41.32 ? 589 ARG B CB 1 ATOM 8176 C CG . ARG B 1 546 ? 17.044 88.166 86.989 1.00 39.22 ? 589 ARG B CG 1 ATOM 8177 C CD . ARG B 1 546 ? 17.578 89.589 87.031 1.00 56.94 ? 589 ARG B CD 1 ATOM 8178 N NE . ARG B 1 546 ? 18.385 89.903 85.856 1.00 69.75 ? 589 ARG B NE 1 ATOM 8179 C CZ . ARG B 1 546 ? 18.763 91.130 85.518 1.00 73.37 ? 589 ARG B CZ 1 ATOM 8180 N NH1 . ARG B 1 546 ? 18.405 92.163 86.268 1.00 66.96 1 589 ARG B NH1 1 ATOM 8181 N NH2 . ARG B 1 546 ? 19.496 91.322 84.428 1.00 80.56 ? 589 ARG B NH2 1 ATOM 8182 N N . LEU B 1 547 ? 17.118 85.355 84.703 1.00 44.38 ? 590 LEU B N 1 ATOM 8183 C CA . LEU B 1 547 ? 16.220 85.177 83.570 1.00 50.65 ? 590 LEU B CA 1 ATOM 8184 C C . LEU B 1 547 ? 15.394 83.907 83.721 1.00 50.48 ? 590 LEU B C 1 ATOM 8185 O O . LEU B 1 547 ? 14.174 83.918 83.518 1.00 62.96 ? 590 LEU B O 1 ATOM 8186 C CB . LEU B 1 547 ? 17.019 85.150 82.269 1.00 53.83 ? 590 LEU B CB 1 ATOM 8187 C CG . LEU B 1 547 ? 16.274 85.758 81.085 1.00 65.23 ? 590 LEU B CG 1 ATOM 8188 C CD1 . LEU B 1 547 ? 16.083 87.250 81.314 1.00 64.89 ? 590 LEU B CD1 1 ATOM 8189 C CD2 . LEU B 1 547 ? 17.013 85.497 79.785 1.00 95.34 ? 590 LEU B CD2 1 ATOM 8190 N N . ALA B 1 548 ? 16.043 82.797 84.079 1.00 39.51 ? 591 ALA B N 1 ATOM 8191 C CA . ALA B 1 548 ? 15.301 81.560 84.289 1.00 41.30 ? 591 ALA B CA 1 ATOM 8192 C C . ALA B 1 548 ? 14.207 81.745 85.334 1.00 54.00 ? 591 ALA B C 1 ATOM 8193 O O . ALA B 1 548 ? 13.062 81.318 85.131 1.00 55.94 ? 591 ALA B O 1 ATOM 8194 C CB . ALA B 1 548 ? 16.256 80.440 84.700 1.00 30.45 ? 591 ALA B CB 1 ATOM 8195 N N . THR B 1 549 ? 14.533 82.405 86.448 1.00 47.90 ? 592 THR B N 1 ATOM 8196 C CA . THR B 1 549 ? 13.563 82.553 87.529 1.00 43.21 ? 592 THR B CA 1 ATOM 8197 C C . THR B 1 549 ? 12.372 83.400 87.093 1.00 50.29 ? 592 THR B C 1 ATOM 8198 O O . THR B 1 549 ? 11.214 82.999 87.265 1.00 53.40 ? 592 THR B O 1 ATOM 8199 C CB . THR B 1 549 ? 14.241 83.160 88.758 1.00 47.03 ? 592 THR B CB 1 ATOM 8200 O OG1 . THR B 1 549 ? 15.351 82.339 89.143 1.00 51.24 ? 592 THR B OG1 1 ATOM 8201 C CG2 . THR B 1 549 ? 13.261 83.263 89.917 1.00 47.78 ? 592 THR B CG2 1 ATOM 8202 N N . LEU B 1 550 ? 12.637 84.577 86.521 1.00 46.33 ? 593 LEU B N 1 ATOM 8203 C CA . LEU B 1 550 ? 11.545 85.431 86.063 1.00 42.16 ? 593 LEU B CA 1 ATOM 8204 C C . LEU B 1 550 ? 10.681 84.709 85.032 1.00 43.57 ? 593 LEU B C 1 ATOM 8205 O O . LEU B 1 550 ? 9.443 84.704 85.125 1.00 44.55 ? 593 LEU B O 1 ATOM 8206 C CB . LEU B 1 550 ? 12.121 86.729 85.495 1.00 35.83 ? 593 LEU B CB 1 ATOM 8207 C CG . LEU B 1 550 ? 13.052 87.458 86.471 1.00 41.92 ? 593 LEU B CG 1 ATOM 8208 C CD1 . LEU B 1 550 ? 13.676 88.700 85.851 1.00 41.36 ? 593 LEU B CD1 1 ATOM 8209 C CD2 . LEU B 1 550 ? 12.288 87.823 87.735 1.00 30.49 ? 593 LEU B CD2 1 ATOM 8210 N N . CYS B 1 551 ? 11.324 84.065 84.054 1.00 46.43 ? 594 CYS B N 1 ATOM 8211 C CA . CYS B 1 551 ? 10.579 83.288 83.071 1.00 50.31 ? 594 CYS B CA 1 ATOM 8212 C C . CYS B 1 551 ? 9.665 82.282 83.753 1.00 49.37 ? 594 CYS B C 1 ATOM 8213 O O . CYS B 1 551 ? 8.508 82.107 83.350 1.00 45.13 ? 594 CYS B O 1 ATOM 8214 C CB . CYS B 1 551 ? 11.543 82.589 82.110 1.00 52.26 ? 594 CYS B CB 1 ATOM 8215 S SG . CYS B 1 551 ? 10.746 81.477 80.921 1.00 96.25 ? 594 CYS B SG 1 ATOM 8216 N N . ALA B 1 552 ? 10.159 81.617 84.798 1.00 56.08 ? 595 ALA B N 1 ATOM 8217 C CA . ALA B 1 552 ? 9.293 80.717 85.549 1.00 46.91 ? 595 ALA B CA 1 ATOM 8218 C C . ALA B 1 552 ? 8.106 81.473 86.132 1.00 47.01 ? 595 ALA B C 1 ATOM 8219 O O . ALA B 1 552 ? 6.965 80.998 86.067 1.00 38.08 ? 595 ALA B O 1 ATOM 8220 C CB . ALA B 1 552 ? 10.087 80.015 86.648 1.00 47.05 ? 595 ALA B CB 1 ATOM 8221 N N . GLN B 1 553 ? 8.351 82.667 86.681 1.00 44.38 ? 596 GLN B N 1 ATOM 8222 C CA . GLN B 1 553 ? 7.266 83.449 87.267 1.00 38.19 ? 596 GLN B CA 1 ATOM 8223 C C . GLN B 1 553 ? 6.185 83.765 86.246 1.00 46.69 ? 596 GLN B C 1 ATOM 8224 O O . GLN B 1 553 ? 5.016 83.934 86.613 1.00 46.64 ? 596 GLN B O 1 ATOM 8225 C CB . GLN B 1 553 ? 7.802 84.750 87.865 1.00 39.40 ? 596 GLN B CB 1 ATOM 8226 C CG . GLN B 1 553 ? 9.013 84.571 88.744 1.00 40.06 ? 596 GLN B CG 1 ATOM 8227 C CD . GLN B 1 553 ? 8.790 83.517 89.804 1.00 57.73 ? 596 GLN B CD 1 ATOM 8228 O OE1 . GLN B 1 553 ? 7.682 83.368 90.325 1.00 56.85 ? 596 GLN B OE1 1 ATOM 8229 N NE2 . GLN B 1 553 ? 9.837 82.764 90.117 1.00 63.13 ? 596 GLN B NE2 1 ATOM 8230 N N . LEU B 1 554 ? 6.549 83.876 84.970 1.00 46.07 ? 597 LEU B N 1 ATOM 8231 C CA . LEU B 1 554 ? 5.550 84.190 83.956 1.00 43.44 ? 597 LEU B CA 1 ATOM 8232 C C . LEU B 1 554 ? 4.909 82.958 83.318 1.00 51.47 ? 597 LEU B C 1 ATOM 8233 O O . LEU B 1 554 ? 3.938 83.107 82.567 1.00 32.94 ? 597 LEU B O 1 ATOM 8234 C CB . LEU B 1 554 ? 6.163 85.077 82.868 1.00 38.48 ? 597 LEU B CB 1 ATOM 8235 C CG . LEU B 1 554 ? 6.490 86.498 83.332 1.00 41.13 ? 597 LEU B CG 1 ATOM 8236 C CD1 . LEU B 1 554 ? 6.919 87.379 82.171 1.00 39.99 ? 597 LEU B CD1 1 ATOM 8237 C CD2 . LEU B 1 554 ? 5.289 87.099 84.046 1.00 48.44 ? 597 LEU B CD2 1 ATOM 8238 N N . SER B 1 555 ? 5.401 81.751 83.598 1.00 54.10 ? 598 SER B N 1 ATOM 8239 C CA . SER B 1 555 ? 4.889 80.547 82.946 1.00 40.02 ? 598 SER B CA 1 ATOM 8240 C C . SER B 1 555 ? 3.963 79.810 83.909 1.00 42.45 ? 598 SER B C 1 ATOM 8241 O O . SER B 1 555 ? 4.421 79.075 84.786 1.00 61.07 ? 598 SER B O 1 ATOM 8242 C CB . SER B 1 555 ? 6.044 79.649 82.518 1.00 51.99 ? 598 SER B CB 1 ATOM 8243 O OG . SER B 1 555 ? 6.995 80.365 81.751 1.00 64.48 ? 598 SER B OG 1 ATOM 8244 N N . ALA B 1 556 ? 2.655 79.964 83.705 1.00 48.47 ? 599 ALA B N 1 ATOM 8245 C CA . ALA B 1 556 ? 1.644 79.184 84.404 1.00 41.69 ? 599 ALA B CA 1 ATOM 8246 C C . ALA B 1 556 ? 1.142 78.027 83.560 1.00 41.88 ? 599 ALA B C 1 ATOM 8247 O O . ALA B 1 556 ? 0.308 77.243 84.024 1.00 43.17 ? 599 ALA B O 1 ATOM 8248 C CB . ALA B 1 556 ? 0.469 80.078 84.817 1.00 35.82 ? 599 ALA B CB 1 ATOM 8249 N N . ARG B 1 557 ? 1.622 77.920 82.327 1.00 48.54 ? 600 ARG B N 1 ATOM 8250 C CA . ARG B 1 557 ? 1.218 76.886 81.388 1.00 34.86 ? 600 ARG B CA 1 ATOM 8251 C C . ARG B 1 557 ? 2.471 76.161 80.928 1.00 47.62 ? 600 ARG B C 1 ATOM 8252 O O . ARG B 1 557 ? 3.375 76.780 80.356 1.00 53.97 ? 600 ARG B O 1 ATOM 8253 C CB . ARG B 1 557 ? 0.475 77.502 80.201 1.00 41.02 ? 600 ARG B CB 1 ATOM 8254 C CG . ARG B 1 557 ? -0.177 76.509 79.267 1.00 49.11 ? 600 ARG B CG 1 ATOM 8255 C CD . ARG B 1 557 ? -1.117 77.220 78.307 1.00 63.14 ? 600 ARG B CD 1 ATOM 8256 N NE . ARG B 1 557 ? -0.410 78.102 77.382 1.00 55.33 ? 600 ARG B NE 1 ATOM 8257 C CZ . ARG B 1 557 ? -1.010 78.829 76.445 1.00 50.66 ? 600 ARG B CZ 1 ATOM 8258 N NH1 . ARG B 1 557 ? -2.329 78.779 76.314 1.00 49.05 1 600 ARG B NH1 1 ATOM 8259 N NH2 . ARG B 1 557 ? -0.294 79.606 75.643 1.00 40.47 ? 600 ARG B NH2 1 ATOM 8260 N N . ALA B 1 558 ? 2.536 74.862 81.198 1.00 43.45 ? 601 ALA B N 1 ATOM 8261 C CA . ALA B 1 558 ? 3.684 74.087 80.760 1.00 56.52 ? 601 ALA B CA 1 ATOM 8262 C C . ALA B 1 558 ? 3.775 74.094 79.238 1.00 60.00 ? 601 ALA B C 1 ATOM 8263 O O . ALA B 1 558 ? 2.767 74.186 78.532 1.00 51.74 ? 601 ALA B O 1 ATOM 8264 C CB . ALA B 1 558 ? 3.591 72.652 81.280 1.00 60.93 ? 601 ALA B CB 1 ATOM 8265 N N . ASP B 1 559 ? 5.003 74.018 78.732 1.00 63.74 ? 602 ASP B N 1 ATOM 8266 C CA . ASP B 1 559 ? 5.247 74.021 77.291 1.00 77.19 ? 602 ASP B CA 1 ATOM 8267 C C . ASP B 1 559 ? 4.694 75.283 76.629 1.00 65.85 ? 602 ASP B C 1 ATOM 8268 O O . ASP B 1 559 ? 4.051 75.225 75.579 1.00 74.49 ? 602 ASP B O 1 ATOM 8269 C CB . ASP B 1 559 ? 4.664 72.764 76.643 1.00 92.12 ? 602 ASP B CB 1 ATOM 8270 C CG . ASP B 1 559 ? 5.232 71.488 77.236 1.00 93.67 ? 602 ASP B CG 1 ATOM 8271 O OD1 . ASP B 1 559 ? 5.810 71.555 78.342 1.00 87.45 ? 602 ASP B OD1 1 ATOM 8272 O OD2 . ASP B 1 559 ? 5.096 70.420 76.603 1.00 107.77 -1 602 ASP B OD2 1 ATOM 8273 N N . SER B 1 560 ? 4.939 76.432 77.250 1.00 50.68 ? 603 SER B N 1 ATOM 8274 C CA . SER B 1 560 ? 4.507 77.730 76.729 1.00 49.71 ? 603 SER B CA 1 ATOM 8275 C C . SER B 1 560 ? 5.704 78.671 76.734 1.00 61.30 ? 603 SER B C 1 ATOM 8276 O O . SER B 1 560 ? 5.732 79.661 77.476 1.00 55.83 ? 603 SER B O 1 ATOM 8277 C CB . SER B 1 560 ? 3.348 78.304 77.545 1.00 55.35 ? 603 SER B CB 1 ATOM 8278 O OG . SER B 1 560 ? 2.170 77.537 77.370 1.00 55.13 ? 603 SER B OG 1 ATOM 8279 N N . PRO B 1 561 ? 6.713 78.392 75.906 1.00 71.86 ? 604 PRO B N 1 ATOM 8280 C CA . PRO B 1 561 ? 7.894 79.270 75.879 1.00 62.02 ? 604 PRO B CA 1 ATOM 8281 C C . PRO B 1 561 ? 7.583 80.685 75.429 1.00 61.47 ? 604 PRO B C 1 ATOM 8282 O O . PRO B 1 561 ? 8.238 81.630 75.890 1.00 57.85 ? 604 PRO B O 1 ATOM 8283 C CB . PRO B 1 561 ? 8.832 78.557 74.896 1.00 45.67 ? 604 PRO B CB 1 ATOM 8284 C CG . PRO B 1 561 ? 7.915 77.766 74.014 1.00 48.67 ? 604 PRO B CG 1 ATOM 8285 C CD . PRO B 1 561 ? 6.787 77.321 74.897 1.00 59.55 ? 604 PRO B CD 1 ATOM 8286 N N . ALA B 1 562 ? 6.582 80.864 74.563 1.00 46.82 ? 605 ALA B N 1 ATOM 8287 C CA . ALA B 1 562 ? 6.234 82.200 74.094 1.00 54.52 ? 605 ALA B CA 1 ATOM 8288 C C . ALA B 1 562 ? 5.984 83.162 75.247 1.00 65.71 ? 605 ALA B C 1 ATOM 8289 O O . ALA B 1 562 ? 6.217 84.369 75.113 1.00 78.65 ? 605 ALA B O 1 ATOM 8290 C CB . ALA B 1 562 ? 5.000 82.128 73.194 1.00 66.41 ? 605 ALA B CB 1 ATOM 8291 N N . LEU B 1 563 ? 5.530 82.646 76.392 1.00 48.01 ? 606 LEU B N 1 ATOM 8292 C CA . LEU B 1 563 ? 5.212 83.507 77.526 1.00 60.18 ? 606 LEU B CA 1 ATOM 8293 C C . LEU B 1 563 ? 6.419 84.309 77.994 1.00 73.02 ? 606 LEU B C 1 ATOM 8294 O O . LEU B 1 563 ? 6.259 85.396 78.563 1.00 66.55 ? 606 LEU B O 1 ATOM 8295 C CB . LEU B 1 563 ? 4.652 82.665 78.669 1.00 34.91 ? 606 LEU B CB 1 ATOM 8296 C CG . LEU B 1 563 ? 3.297 82.030 78.355 1.00 46.70 ? 606 LEU B CG 1 ATOM 8297 C CD1 . LEU B 1 563 ? 2.912 81.024 79.426 1.00 65.84 ? 606 LEU B CD1 1 ATOM 8298 C CD2 . LEU B 1 563 ? 2.225 83.096 78.204 1.00 43.11 ? 606 LEU B CD2 1 ATOM 8299 N N . CYS B 1 564 ? 7.629 83.799 77.774 1.00 72.69 ? 607 CYS B N 1 ATOM 8300 C CA . CYS B 1 564 ? 8.839 84.489 78.198 1.00 67.02 ? 607 CYS B CA 1 ATOM 8301 C C . CYS B 1 564 ? 9.455 85.334 77.089 1.00 78.47 ? 607 CYS B C 1 ATOM 8302 O O . CYS B 1 564 ? 10.534 85.907 77.286 1.00 79.91 ? 607 CYS B O 1 ATOM 8303 C CB . CYS B 1 564 ? 9.854 83.474 78.736 1.00 67.37 ? 607 CYS B CB 1 ATOM 8304 S SG . CYS B 1 564 ? 9.203 82.565 80.168 1.00 98.56 ? 607 CYS B SG 1 ATOM 8305 N N . ARG B 1 565 ? 8.815 85.438 75.909 1.00 88.54 ? 608 ARG B N 1 ATOM 8306 C CA . ARG B 1 565 ? 9.419 86.148 74.766 1.00 68.05 ? 608 ARG B CA 1 ATOM 8307 C C . ARG B 1 565 ? 9.900 87.536 75.168 1.00 71.58 ? 608 ARG B C 1 ATOM 8308 O O . ARG B 1 565 ? 10.952 88.000 74.712 1.00 75.90 ? 608 ARG B O 1 ATOM 8309 C CB . ARG B 1 565 ? 8.408 86.275 73.622 1.00 47.23 ? 608 ARG B CB 1 ATOM 8310 C CG . ARG B 1 565 ? 7.163 87.052 74.022 1.00 73.50 ? 608 ARG B CG 1 ATOM 8311 C CD . ARG B 1 565 ? 6.079 87.064 72.959 1.00 77.54 ? 608 ARG B CD 1 ATOM 8312 N NE . ARG B 1 565 ? 4.832 87.597 73.505 1.00 96.73 ? 608 ARG B NE 1 ATOM 8313 C CZ . ARG B 1 565 ? 3.884 88.190 72.785 1.00 113.53 ? 608 ARG B CZ 1 ATOM 8314 N NH1 . ARG B 1 565 ? 4.031 88.332 71.472 1.00 104.36 1 608 ARG B NH1 1 ATOM 8315 N NH2 . ARG B 1 565 ? 2.789 88.647 73.381 1.00 96.50 ? 608 ARG B NH2 1 ATOM 8316 N N . HIS B 1 566 ? 9.131 88.214 76.020 1.00 75.99 ? 609 HIS B N 1 ATOM 8317 C CA . HIS B 1 566 ? 9.369 89.608 76.357 1.00 60.58 ? 609 HIS B CA 1 ATOM 8318 C C . HIS B 1 566 ? 10.555 89.806 77.291 1.00 75.19 ? 609 HIS B C 1 ATOM 8319 O O . HIS B 1 566 ? 10.920 90.957 77.554 1.00 76.23 ? 609 HIS B O 1 ATOM 8320 C CB . HIS B 1 566 ? 8.104 90.196 76.979 1.00 60.08 ? 609 HIS B CB 1 ATOM 8321 C CG . HIS B 1 566 ? 6.942 90.242 76.037 1.00 67.03 ? 609 HIS B CG 1 ATOM 8322 N ND1 . HIS B 1 566 ? 6.998 90.873 74.813 1.00 60.82 ? 609 HIS B ND1 1 ATOM 8323 C CD2 . HIS B 1 566 ? 5.696 89.719 76.133 1.00 67.54 ? 609 HIS B CD2 1 ATOM 8324 C CE1 . HIS B 1 566 ? 5.835 90.745 74.200 1.00 68.42 ? 609 HIS B CE1 1 ATOM 8325 N NE2 . HIS B 1 566 ? 5.027 90.049 74.979 1.00 59.15 ? 609 HIS B NE2 1 ATOM 8326 N N . LEU B 1 567 ? 11.168 88.733 77.792 1.00 79.40 ? 610 LEU B N 1 ATOM 8327 C CA . LEU B 1 567 ? 12.373 88.884 78.598 1.00 77.34 ? 610 LEU B CA 1 ATOM 8328 C C . LEU B 1 567 ? 13.650 88.882 77.770 1.00 85.20 ? 610 LEU B C 1 ATOM 8329 O O . LEU B 1 567 ? 14.729 89.121 78.325 1.00 72.28 ? 610 LEU B O 1 ATOM 8330 C CB . LEU B 1 567 ? 12.446 87.786 79.666 1.00 83.37 ? 610 LEU B CB 1 ATOM 8331 C CG . LEU B 1 567 ? 11.274 87.743 80.649 1.00 82.24 ? 610 LEU B CG 1 ATOM 8332 C CD1 . LEU B 1 567 ? 11.367 86.533 81.576 1.00 55.04 ? 610 LEU B CD1 1 ATOM 8333 C CD2 . LEU B 1 567 ? 11.232 89.032 81.455 1.00 56.31 ? 610 LEU B CD2 1 ATOM 8334 N N . MET B 1 568 ? 13.555 88.638 76.466 1.00 106.33 ? 611 MET B N 1 ATOM 8335 C CA . MET B 1 568 ? 14.717 88.668 75.585 1.00 103.33 ? 611 MET B CA 1 ATOM 8336 C C . MET B 1 568 ? 15.816 87.726 76.068 1.00 104.21 ? 611 MET B C 1 ATOM 8337 O O . MET B 1 568 ? 15.543 86.605 76.498 1.00 90.62 ? 611 MET B O 1 ATOM 8338 C CB . MET B 1 568 ? 15.256 90.098 75.474 1.00 104.23 ? 611 MET B CB 1 ATOM 8339 C CG . MET B 1 568 ? 14.258 91.090 74.888 1.00 103.63 ? 611 MET B CG 1 ATOM 8340 S SD . MET B 1 568 ? 14.907 92.768 74.729 1.00 128.19 ? 611 MET B SD 1 ATOM 8341 C CE . MET B 1 568 ? 15.209 93.187 76.446 1.00 90.99 ? 611 MET B CE 1 HETATM 8342 ZN ZN . ZN C 2 . ? 8.583 35.983 40.548 1.00 55.24 ? 701 ZN A ZN 1 HETATM 8343 ZN ZN . ZN D 2 . ? 10.639 36.990 42.543 1.00 90.48 ? 702 ZN A ZN 1 HETATM 8344 C C . ACT E 3 . ? 7.628 38.242 42.657 1.00 81.40 ? 703 ACT A C 1 HETATM 8345 O O . ACT E 3 . ? 8.340 37.699 41.772 1.00 62.56 ? 703 ACT A O 1 HETATM 8346 O OXT . ACT E 3 . ? 6.534 38.824 42.445 1.00 80.56 ? 703 ACT A OXT 1 HETATM 8347 C CH3 . ACT E 3 . ? 8.132 38.186 44.105 1.00 53.88 ? 703 ACT A CH3 1 HETATM 8348 C C1 . NAG F 4 . ? 19.284 60.535 87.556 1.00 148.87 ? 704 NAG A C1 1 HETATM 8349 C C2 . NAG F 4 . ? 20.088 60.799 88.837 1.00 158.43 ? 704 NAG A C2 1 HETATM 8350 C C3 . NAG F 4 . ? 21.291 61.719 88.653 1.00 155.17 ? 704 NAG A C3 1 HETATM 8351 C C4 . NAG F 4 . ? 22.044 61.403 87.370 1.00 154.75 ? 704 NAG A C4 1 HETATM 8352 C C5 . NAG F 4 . ? 21.083 61.491 86.196 1.00 152.81 ? 704 NAG A C5 1 HETATM 8353 C C6 . NAG F 4 . ? 21.788 61.212 84.872 1.00 123.75 ? 704 NAG A C6 1 HETATM 8354 C C7 . NAG F 4 . ? 19.429 61.184 91.165 1.00 147.38 ? 704 NAG A C7 1 HETATM 8355 C C8 . NAG F 4 . ? 18.417 61.808 92.081 1.00 119.56 ? 704 NAG A C8 1 HETATM 8356 N N2 . NAG F 4 . ? 19.206 61.346 89.861 1.00 162.05 ? 704 NAG A N2 1 HETATM 8357 O O3 . NAG F 4 . ? 22.170 61.554 89.771 1.00 150.72 ? 704 NAG A O3 1 HETATM 8358 O O4 . NAG F 4 . ? 23.111 62.344 87.199 1.00 150.68 ? 704 NAG A O4 1 HETATM 8359 O O5 . NAG F 4 . ? 20.061 60.514 86.352 1.00 153.16 ? 704 NAG A O5 1 HETATM 8360 O O6 . NAG F 4 . ? 20.831 61.174 83.808 1.00 98.86 ? 704 NAG A O6 1 HETATM 8361 O O7 . NAG F 4 . ? 20.388 60.564 91.594 1.00 137.41 ? 704 NAG A O7 1 HETATM 8362 H HN2 . NAG F 4 . ? 18.396 61.867 89.558 1.00 194.45 ? 704 NAG A HN2 1 HETATM 8363 H HO3 . NAG F 4 . ? 22.918 62.160 89.686 1.00 180.86 ? 704 NAG A HO3 1 HETATM 8364 H HO4 . NAG F 4 . ? 23.592 62.142 86.385 1.00 180.82 ? 704 NAG A HO4 1 HETATM 8365 H HO6 . NAG F 4 . ? 21.285 60.998 82.972 1.00 118.63 ? 704 NAG A HO6 1 HETATM 8366 C C1 . NAG G 4 . ? 25.732 56.996 53.351 1.00 114.82 ? 705 NAG A C1 1 HETATM 8367 C C2 . NAG G 4 . ? 26.034 58.488 53.122 1.00 125.76 ? 705 NAG A C2 1 HETATM 8368 C C3 . NAG G 4 . ? 24.815 59.374 52.818 1.00 119.45 ? 705 NAG A C3 1 HETATM 8369 C C4 . NAG G 4 . ? 23.643 58.654 52.157 1.00 107.79 ? 705 NAG A C4 1 HETATM 8370 C C5 . NAG G 4 . ? 23.431 57.339 52.884 1.00 110.97 ? 705 NAG A C5 1 HETATM 8371 C C6 . NAG G 4 . ? 22.193 56.572 52.438 1.00 94.75 ? 705 NAG A C6 1 HETATM 8372 C C7 . NAG G 4 . ? 27.901 59.397 54.424 1.00 131.62 ? 705 NAG A C7 1 HETATM 8373 C C8 . NAG G 4 . ? 28.338 59.854 55.786 1.00 110.34 ? 705 NAG A C8 1 HETATM 8374 N N2 . NAG G 4 . ? 26.633 59.001 54.342 1.00 130.60 ? 705 NAG A N2 1 HETATM 8375 O O3 . NAG G 4 . ? 25.218 60.467 51.982 1.00 106.94 ? 705 NAG A O3 1 HETATM 8376 O O4 . NAG G 4 . ? 22.469 59.474 52.244 1.00 80.46 ? 705 NAG A O4 1 HETATM 8377 O O5 . NAG G 4 . ? 24.579 56.541 52.639 1.00 110.98 ? 705 NAG A O5 1 HETATM 8378 O O6 . NAG G 4 . ? 22.065 55.414 53.272 1.00 81.82 ? 705 NAG A O6 1 HETATM 8379 O O7 . NAG G 4 . ? 28.659 59.386 53.468 1.00 126.41 ? 705 NAG A O7 1 HETATM 8380 H HN2 . NAG G 4 . ? 26.053 59.038 55.168 1.00 156.73 ? 705 NAG A HN2 1 HETATM 8381 H HO3 . NAG G 4 . ? 24.480 61.083 51.879 1.00 128.33 ? 705 NAG A HO3 1 HETATM 8382 H HO4 . NAG G 4 . ? 21.723 59.013 51.836 1.00 96.56 ? 705 NAG A HO4 1 HETATM 8383 H HO6 . NAG G 4 . ? 21.284 54.910 53.007 1.00 98.18 ? 705 NAG A HO6 1 HETATM 8384 C C1 . NAG H 4 . ? -3.188 36.764 20.841 1.00 40.56 ? 706 NAG A C1 1 HETATM 8385 C C2 . NAG H 4 . ? -2.815 38.021 20.057 1.00 47.93 ? 706 NAG A C2 1 HETATM 8386 C C3 . NAG H 4 . ? -4.013 38.938 19.835 1.00 65.16 ? 706 NAG A C3 1 HETATM 8387 C C4 . NAG H 4 . ? -5.153 38.179 19.171 1.00 66.37 ? 706 NAG A C4 1 HETATM 8388 C C5 . NAG H 4 . ? -5.427 36.886 19.939 1.00 66.06 ? 706 NAG A C5 1 HETATM 8389 C C6 . NAG H 4 . ? -6.443 36.031 19.193 1.00 68.66 ? 706 NAG A C6 1 HETATM 8390 C C7 . NAG H 4 . ? -0.588 38.950 20.068 1.00 57.75 ? 706 NAG A C7 1 HETATM 8391 C C8 . NAG H 4 . ? -0.445 40.310 19.448 1.00 69.54 ? 706 NAG A C8 1 HETATM 8392 N N2 . NAG H 4 . ? -1.732 38.730 20.712 1.00 42.83 ? 706 NAG A N2 1 HETATM 8393 O O3 . NAG H 4 . ? -3.630 40.064 19.036 1.00 62.08 ? 706 NAG A O3 1 HETATM 8394 O O4 . NAG H 4 . ? -6.322 39.013 19.194 1.00 71.53 ? 706 NAG A O4 1 HETATM 8395 O O5 . NAG H 4 . ? -4.252 36.091 20.163 1.00 42.45 ? 706 NAG A O5 1 HETATM 8396 O O6 . NAG H 4 . ? -5.754 35.235 18.223 1.00 63.80 ? 706 NAG A O6 1 HETATM 8397 O O7 . NAG H 4 . ? 0.284 38.100 19.981 1.00 50.24 ? 706 NAG A O7 1 HETATM 8398 C C1 . NAG I 4 . ? -6.938 39.169 17.899 1.00 81.24 ? 707 NAG A C1 1 HETATM 8399 C C2 . NAG I 4 . ? -8.452 39.142 18.100 1.00 93.93 ? 707 NAG A C2 1 HETATM 8400 C C3 . NAG I 4 . ? -9.207 39.397 16.802 1.00 90.52 ? 707 NAG A C3 1 HETATM 8401 C C4 . NAG I 4 . ? -8.716 40.695 16.180 1.00 99.47 ? 707 NAG A C4 1 HETATM 8402 C C5 . NAG I 4 . ? -7.201 40.648 16.015 1.00 101.79 ? 707 NAG A C5 1 HETATM 8403 C C6 . NAG I 4 . ? -6.691 41.962 15.428 1.00 111.15 ? 707 NAG A C6 1 HETATM 8404 C C7 . NAG I 4 . ? -9.244 37.815 19.972 1.00 99.20 ? 707 NAG A C7 1 HETATM 8405 C C8 . NAG I 4 . ? -10.181 36.695 20.323 1.00 74.56 ? 707 NAG A C8 1 HETATM 8406 N N2 . NAG I 4 . ? -8.878 37.887 18.691 1.00 93.00 ? 707 NAG A N2 1 HETATM 8407 O O3 . NAG I 4 . ? -10.612 39.487 17.061 1.00 102.10 ? 707 NAG A O3 1 HETATM 8408 O O4 . NAG I 4 . ? -9.355 40.919 14.916 1.00 108.91 ? 707 NAG A O4 1 HETATM 8409 O O5 . NAG I 4 . ? -6.562 40.398 17.273 1.00 98.90 ? 707 NAG A O5 1 HETATM 8410 O O6 . NAG I 4 . ? -7.502 42.335 14.307 1.00 116.33 ? 707 NAG A O6 1 HETATM 8411 O O7 . NAG I 4 . ? -8.846 38.611 20.811 1.00 90.28 ? 707 NAG A O7 1 HETATM 8412 C C1 . NAG J 4 . ? 36.710 33.181 23.415 1.00 65.36 ? 708 NAG A C1 1 HETATM 8413 C C2 . NAG J 4 . ? 36.456 31.690 23.621 1.00 80.88 ? 708 NAG A C2 1 HETATM 8414 C C3 . NAG J 4 . ? 37.743 30.893 23.790 1.00 92.51 ? 708 NAG A C3 1 HETATM 8415 C C4 . NAG J 4 . ? 38.809 31.247 22.761 1.00 99.74 ? 708 NAG A C4 1 HETATM 8416 C C5 . NAG J 4 . ? 38.918 32.756 22.553 1.00 91.84 ? 708 NAG A C5 1 HETATM 8417 C C6 . NAG J 4 . ? 39.803 33.062 21.346 1.00 106.98 ? 708 NAG A C6 1 HETATM 8418 C C7 . NAG J 4 . ? 34.446 30.893 24.739 1.00 84.67 ? 708 NAG A C7 1 HETATM 8419 C C8 . NAG J 4 . ? 33.774 30.661 26.060 1.00 72.85 ? 708 NAG A C8 1 HETATM 8420 N N2 . NAG J 4 . ? 35.633 31.491 24.799 1.00 88.80 ? 708 NAG A N2 1 HETATM 8421 O O3 . NAG J 4 . ? 37.429 29.500 23.670 1.00 82.33 ? 708 NAG A O3 1 HETATM 8422 O O4 . NAG J 4 . ? 40.064 30.750 23.252 1.00 114.70 ? 708 NAG A O4 1 HETATM 8423 O O5 . NAG J 4 . ? 37.637 33.357 22.341 1.00 77.32 ? 708 NAG A O5 1 HETATM 8424 O O6 . NAG J 4 . ? 39.837 34.472 21.089 1.00 87.07 ? 708 NAG A O6 1 HETATM 8425 O O7 . NAG J 4 . ? 33.939 30.554 23.683 1.00 84.46 ? 708 NAG A O7 1 HETATM 8426 C C1 . NAG K 4 . ? 40.572 29.676 22.428 1.00 121.01 ? 709 NAG A C1 1 HETATM 8427 C C2 . NAG K 4 . ? 42.091 29.629 22.579 1.00 117.51 ? 709 NAG A C2 1 HETATM 8428 C C3 . NAG K 4 . ? 42.690 28.525 21.720 1.00 123.83 ? 709 NAG A C3 1 HETATM 8429 C C4 . NAG K 4 . ? 42.038 27.195 22.066 1.00 131.48 ? 709 NAG A C4 1 HETATM 8430 C C5 . NAG K 4 . ? 40.516 27.310 22.005 1.00 130.34 ? 709 NAG A C5 1 HETATM 8431 C C6 . NAG K 4 . ? 39.858 26.021 22.489 1.00 124.52 ? 709 NAG A C6 1 HETATM 8432 C C7 . NAG K 4 . ? 42.757 31.901 23.117 1.00 129.91 ? 709 NAG A C7 1 HETATM 8433 C C8 . NAG K 4 . ? 43.377 33.171 22.611 1.00 129.03 ? 709 NAG A C8 1 HETATM 8434 N N2 . NAG K 4 . ? 42.673 30.911 22.232 1.00 124.43 ? 709 NAG A N2 1 HETATM 8435 O O3 . NAG K 4 . ? 44.102 28.445 21.951 1.00 122.65 ? 709 NAG A O3 1 HETATM 8436 O O4 . NAG K 4 . ? 42.492 26.199 21.138 1.00 127.82 ? 709 NAG A O4 1 HETATM 8437 O O5 . NAG K 4 . ? 40.036 28.401 22.800 1.00 129.93 ? 709 NAG A O5 1 HETATM 8438 O O6 . NAG K 4 . ? 38.462 26.039 22.172 1.00 105.65 ? 709 NAG A O6 1 HETATM 8439 O O7 . NAG K 4 . ? 42.354 31.786 24.265 1.00 106.33 ? 709 NAG A O7 1 HETATM 8440 H HN2 . NAG K 4 . ? 43.018 31.045 21.292 1.00 149.32 ? 709 NAG A HN2 1 HETATM 8441 H HO3 . NAG K 4 . ? 44.482 27.754 21.391 1.00 147.18 ? 709 NAG A HO3 1 HETATM 8442 H HO4 . NAG K 4 . ? 42.103 25.344 21.368 1.00 153.39 ? 709 NAG A HO4 1 HETATM 8443 H HO6 . NAG K 4 . ? 38.051 25.220 22.481 1.00 126.78 ? 709 NAG A HO6 1 HETATM 8444 C C1 . NAG L 4 . ? 14.932 22.425 60.219 1.00 61.57 ? 710 NAG A C1 1 HETATM 8445 C C2 . NAG L 4 . ? 13.893 21.488 60.831 1.00 71.31 ? 710 NAG A C2 1 HETATM 8446 C C3 . NAG L 4 . ? 12.586 21.597 60.067 1.00 76.54 ? 710 NAG A C3 1 HETATM 8447 C C4 . NAG L 4 . ? 12.025 22.979 60.349 1.00 78.05 ? 710 NAG A C4 1 HETATM 8448 C C5 . NAG L 4 . ? 13.078 24.059 60.113 1.00 83.45 ? 710 NAG A C5 1 HETATM 8449 C C6 . NAG L 4 . ? 13.348 24.858 61.387 1.00 97.88 ? 710 NAG A C6 1 HETATM 8450 C C7 . NAG L 4 . ? 15.420 19.723 61.503 1.00 81.02 ? 710 NAG A C7 1 HETATM 8451 C C8 . NAG L 4 . ? 16.626 19.344 60.693 1.00 64.79 ? 710 NAG A C8 1 HETATM 8452 N N2 . NAG L 4 . ? 14.364 20.118 60.795 1.00 83.71 ? 710 NAG A N2 1 HETATM 8453 O O3 . NAG L 4 . ? 11.673 20.576 60.496 1.00 80.28 ? 710 NAG A O3 1 HETATM 8454 O O4 . NAG L 4 . ? 10.900 23.230 59.500 1.00 72.85 ? 710 NAG A O4 1 HETATM 8455 O O5 . NAG L 4 . ? 14.318 23.557 59.588 1.00 84.38 ? 710 NAG A O5 1 HETATM 8456 O O6 . NAG L 4 . ? 13.834 26.162 61.043 1.00 88.57 ? 710 NAG A O6 1 HETATM 8457 O O7 . NAG L 4 . ? 15.407 19.676 62.726 1.00 52.92 ? 710 NAG A O7 1 HETATM 8458 C C1 . NAG M 4 . ? 10.750 20.230 59.439 1.00 85.96 ? 711 NAG A C1 1 HETATM 8459 C C2 . NAG M 4 . ? 9.683 19.300 60.028 1.00 95.41 ? 711 NAG A C2 1 HETATM 8460 C C3 . NAG M 4 . ? 8.463 19.115 59.131 1.00 94.18 ? 711 NAG A C3 1 HETATM 8461 C C4 . NAG M 4 . ? 7.982 20.469 58.641 1.00 83.94 ? 711 NAG A C4 1 HETATM 8462 C C5 . NAG M 4 . ? 9.129 21.128 57.894 1.00 90.07 ? 711 NAG A C5 1 HETATM 8463 C C6 . NAG M 4 . ? 8.689 22.422 57.216 1.00 70.45 ? 711 NAG A C6 1 HETATM 8464 C C7 . NAG M 4 . ? 11.137 17.402 59.526 1.00 116.73 ? 711 NAG A C7 1 HETATM 8465 C C8 . NAG M 4 . ? 12.197 16.583 60.208 1.00 88.84 ? 711 NAG A C8 1 HETATM 8466 N N2 . NAG M 4 . ? 10.266 18.004 60.336 1.00 109.87 ? 711 NAG A N2 1 HETATM 8467 O O3 . NAG M 4 . ? 7.412 18.474 59.863 1.00 93.57 ? 711 NAG A O3 1 HETATM 8468 O O4 . NAG M 4 . ? 6.849 20.306 57.783 1.00 72.60 ? 711 NAG A O4 1 HETATM 8469 O O5 . NAG M 4 . ? 10.192 21.392 58.811 1.00 88.48 ? 711 NAG A O5 1 HETATM 8470 O O6 . NAG M 4 . ? 9.708 22.858 56.309 1.00 60.27 ? 711 NAG A O6 1 HETATM 8471 O O7 . NAG M 4 . ? 11.078 17.503 58.310 1.00 98.70 ? 711 NAG A O7 1 HETATM 8472 C C1 . NAG N 4 . ? 26.011 44.438 61.389 1.00 80.59 ? 712 NAG A C1 1 HETATM 8473 C C2 . NAG N 4 . ? 26.521 44.596 62.822 1.00 105.05 ? 712 NAG A C2 1 HETATM 8474 C C3 . NAG N 4 . ? 28.031 44.414 62.903 1.00 100.45 ? 712 NAG A C3 1 HETATM 8475 C C4 . NAG N 4 . ? 28.742 45.218 61.824 1.00 101.70 ? 712 NAG A C4 1 HETATM 8476 C C5 . NAG N 4 . ? 28.161 44.918 60.445 1.00 94.51 ? 712 NAG A C5 1 HETATM 8477 C C6 . NAG N 4 . ? 29.249 44.342 59.547 1.00 84.14 ? 712 NAG A C6 1 HETATM 8478 C C7 . NAG N 4 . ? 25.366 45.931 64.486 1.00 108.66 ? 712 NAG A C7 1 HETATM 8479 C C8 . NAG N 4 . ? 25.200 44.638 65.234 1.00 87.41 ? 712 NAG A C8 1 HETATM 8480 N N2 . NAG N 4 . ? 26.114 45.874 63.383 1.00 107.83 ? 712 NAG A N2 1 HETATM 8481 O O3 . NAG N 4 . ? 28.351 43.026 62.757 1.00 94.95 ? 712 NAG A O3 1 HETATM 8482 O O4 . NAG N 4 . ? 28.637 46.617 62.114 1.00 94.19 ? 712 NAG A O4 1 HETATM 8483 O O5 . NAG N 4 . ? 27.069 43.994 60.533 1.00 77.32 ? 712 NAG A O5 1 HETATM 8484 O O6 . NAG N 4 . ? 29.979 43.345 60.272 1.00 79.59 ? 712 NAG A O6 1 HETATM 8485 O O7 . NAG N 4 . ? 24.849 46.968 64.870 1.00 87.76 ? 712 NAG A O7 1 HETATM 8486 ZN ZN . ZN O 2 . ? 7.081 69.205 99.391 1.00 45.52 ? 701 ZN B ZN 1 HETATM 8487 ZN ZN . ZN P 2 . ? 5.254 68.198 97.201 1.00 98.55 ? 702 ZN B ZN 1 HETATM 8488 C C . ACT Q 3 . ? 8.177 67.904 97.164 1.00 72.41 ? 703 ACT B C 1 HETATM 8489 O O . ACT Q 3 . ? 9.237 67.656 97.782 1.00 68.31 ? 703 ACT B O 1 HETATM 8490 O OXT . ACT Q 3 . ? 7.116 68.097 97.798 1.00 79.21 ? 703 ACT B OXT 1 HETATM 8491 C CH3 . ACT Q 3 . ? 8.180 67.971 95.659 1.00 46.45 ? 703 ACT B CH3 1 HETATM 8492 C C1 . NAG R 4 . ? -3.858 42.768 52.649 1.00 132.42 ? 704 NAG B C1 1 HETATM 8493 C C2 . NAG R 4 . ? -3.379 44.130 52.130 1.00 141.13 ? 704 NAG B C2 1 HETATM 8494 C C3 . NAG R 4 . ? -4.377 44.800 51.192 1.00 142.17 ? 704 NAG B C3 1 HETATM 8495 C C4 . NAG R 4 . ? -4.831 43.837 50.109 1.00 136.51 ? 704 NAG B C4 1 HETATM 8496 C C5 . NAG R 4 . ? -5.427 42.598 50.759 1.00 132.72 ? 704 NAG B C5 1 HETATM 8497 C C6 . NAG R 4 . ? -5.800 41.558 49.709 1.00 129.61 ? 704 NAG B C6 1 HETATM 8498 C C7 . NAG R 4 . ? -2.419 46.148 53.095 1.00 136.25 ? 704 NAG B C7 1 HETATM 8499 C C8 . NAG R 4 . ? -2.248 46.975 54.336 1.00 123.22 ? 704 NAG B C8 1 HETATM 8500 N N2 . NAG R 4 . ? -3.119 45.027 53.243 1.00 142.97 ? 704 NAG B N2 1 HETATM 8501 O O3 . NAG R 4 . ? -3.779 45.949 50.580 1.00 141.98 ? 704 NAG B O3 1 HETATM 8502 O O4 . NAG R 4 . ? -5.812 44.487 49.291 1.00 115.23 ? 704 NAG B O4 1 HETATM 8503 O O5 . NAG R 4 . ? -4.489 41.977 51.634 1.00 123.35 ? 704 NAG B O5 1 HETATM 8504 O O6 . NAG R 4 . ? -4.617 40.850 49.318 1.00 119.43 ? 704 NAG B O6 1 HETATM 8505 O O7 . NAG R 4 . ? -1.942 46.481 52.022 1.00 133.41 ? 704 NAG B O7 1 HETATM 8506 H HN2 . NAG R 4 . ? -3.494 44.785 54.149 1.00 171.56 ? 704 NAG B HN2 1 HETATM 8507 H HO3 . NAG R 4 . ? -4.429 46.389 50.015 1.00 170.38 ? 704 NAG B HO3 1 HETATM 8508 H HO4 . NAG R 4 . ? -6.105 43.881 48.596 1.00 138.28 ? 704 NAG B HO4 1 HETATM 8509 H HO6 . NAG R 4 . ? -4.844 40.186 48.652 1.00 143.32 ? 704 NAG B HO6 1 HETATM 8510 C C1 . NAG S 4 . ? -8.945 70.882 70.970 1.00 137.17 ? 705 NAG B C1 1 HETATM 8511 C C2 . NAG S 4 . ? -7.523 71.379 71.233 1.00 144.34 ? 705 NAG B C2 1 HETATM 8512 C C3 . NAG S 4 . ? -6.871 71.698 69.894 1.00 141.57 ? 705 NAG B C3 1 HETATM 8513 C C4 . NAG S 4 . ? -6.942 70.497 68.956 1.00 150.04 ? 705 NAG B C4 1 HETATM 8514 C C5 . NAG S 4 . ? -8.363 69.944 68.859 1.00 153.19 ? 705 NAG B C5 1 HETATM 8515 C C6 . NAG S 4 . ? -8.405 68.630 68.083 1.00 146.30 ? 705 NAG B C6 1 HETATM 8516 C C7 . NAG S 4 . ? -6.742 72.631 73.172 1.00 139.24 ? 705 NAG B C7 1 HETATM 8517 C C8 . NAG S 4 . ? -6.837 73.911 73.951 1.00 133.61 ? 705 NAG B C8 1 HETATM 8518 N N2 . NAG S 4 . ? -7.515 72.554 72.089 1.00 143.84 ? 705 NAG B N2 1 HETATM 8519 O O3 . NAG S 4 . ? -5.503 72.071 70.094 1.00 144.00 ? 705 NAG B O3 1 HETATM 8520 O O4 . NAG S 4 . ? -6.498 70.906 67.656 1.00 144.87 ? 705 NAG B O4 1 HETATM 8521 O O5 . NAG S 4 . ? -8.894 69.706 70.160 1.00 129.45 ? 705 NAG B O5 1 HETATM 8522 O O6 . NAG S 4 . ? -9.749 68.130 68.053 1.00 114.89 ? 705 NAG B O6 1 HETATM 8523 O O7 . NAG S 4 . ? -6.002 71.722 73.512 1.00 126.94 ? 705 NAG B O7 1 HETATM 8524 H HN2 . NAG S 4 . ? -8.114 73.329 71.843 1.00 172.61 ? 705 NAG B HN2 1 HETATM 8525 H HO3 . NAG S 4 . ? -5.107 72.310 69.245 1.00 172.80 ? 705 NAG B HO3 1 HETATM 8526 H HO4 . NAG S 4 . ? -6.502 70.145 67.060 1.00 173.84 ? 705 NAG B HO4 1 HETATM 8527 H HO6 . NAG S 4 . ? -9.772 67.298 67.561 1.00 137.87 ? 705 NAG B HO6 1 HETATM 8528 C C1 . NAG T 4 . ? 19.813 84.307 110.821 1.00 35.66 ? 706 NAG B C1 1 HETATM 8529 C C2 . NAG T 4 . ? 19.775 85.619 110.037 1.00 45.17 ? 706 NAG B C2 1 HETATM 8530 C C3 . NAG T 4 . ? 21.162 86.056 109.604 1.00 46.38 ? 706 NAG B C3 1 HETATM 8531 C C4 . NAG T 4 . ? 22.111 86.106 110.782 1.00 47.38 ? 706 NAG B C4 1 HETATM 8532 C C5 . NAG T 4 . ? 22.048 84.811 111.584 1.00 42.50 ? 706 NAG B C5 1 HETATM 8533 C C6 . NAG T 4 . ? 22.865 84.958 112.864 1.00 46.08 ? 706 NAG B C6 1 HETATM 8534 C C7 . NAG T 4 . ? 17.678 85.795 108.812 1.00 42.41 ? 706 NAG B C7 1 HETATM 8535 C C8 . NAG T 4 . ? 16.956 85.432 107.545 1.00 36.40 ? 706 NAG B C8 1 HETATM 8536 N N2 . NAG T 4 . ? 18.966 85.468 108.844 1.00 40.12 ? 706 NAG B N2 1 HETATM 8537 O O3 . NAG T 4 . ? 21.084 87.367 109.034 1.00 44.29 ? 706 NAG B O3 1 HETATM 8538 O O4 . NAG T 4 . ? 23.424 86.251 110.233 1.00 54.82 ? 706 NAG B O4 1 HETATM 8539 O O5 . NAG T 4 . ? 20.707 84.442 111.930 1.00 38.10 ? 706 NAG B O5 1 HETATM 8540 O O6 . NAG T 4 . ? 22.157 85.782 113.800 1.00 37.93 ? 706 NAG B O6 1 HETATM 8541 O O7 . NAG T 4 . ? 17.121 86.349 109.748 1.00 37.90 ? 706 NAG B O7 1 HETATM 8542 C C1 . NAG U 4 . ? 24.134 87.321 110.884 1.00 56.84 ? 707 NAG B C1 1 HETATM 8543 C C2 . NAG U 4 . ? 25.621 87.084 110.639 1.00 47.21 ? 707 NAG B C2 1 HETATM 8544 C C3 . NAG U 4 . ? 26.473 88.196 111.222 1.00 71.66 ? 707 NAG B C3 1 HETATM 8545 C C4 . NAG U 4 . ? 25.987 89.540 110.712 1.00 76.67 ? 707 NAG B C4 1 HETATM 8546 C C5 . NAG U 4 . ? 24.493 89.689 110.969 1.00 71.06 ? 707 NAG B C5 1 HETATM 8547 C C6 . NAG U 4 . ? 23.969 91.002 110.400 1.00 61.19 ? 707 NAG B C6 1 HETATM 8548 C C7 . NAG U 4 . ? 26.004 84.710 110.463 1.00 74.10 ? 707 NAG B C7 1 HETATM 8549 C C8 . NAG U 4 . ? 26.186 83.414 111.197 1.00 47.92 ? 707 NAG B C8 1 HETATM 8550 N N2 . NAG U 4 . ? 26.003 85.809 111.211 1.00 54.27 ? 707 NAG B N2 1 HETATM 8551 O O3 . NAG U 4 . ? 27.831 88.006 110.811 1.00 88.70 ? 707 NAG B O3 1 HETATM 8552 O O4 . NAG U 4 . ? 26.696 90.555 111.432 1.00 91.43 ? 707 NAG B O4 1 HETATM 8553 O O5 . NAG U 4 . ? 23.762 88.609 110.380 1.00 73.38 ? 707 NAG B O5 1 HETATM 8554 O O6 . NAG U 4 . ? 22.539 90.952 110.339 1.00 60.85 ? 707 NAG B O6 1 HETATM 8555 O O7 . NAG U 4 . ? 25.868 84.759 109.249 1.00 81.20 ? 707 NAG B O7 1 HETATM 8556 C C1 . MAN V 5 . ? 27.040 91.629 110.536 1.00 83.15 ? 708 MAN B C1 1 HETATM 8557 C C2 . MAN V 5 . ? 28.442 91.374 109.978 1.00 105.10 ? 708 MAN B C2 1 HETATM 8558 C C3 . MAN V 5 . ? 28.819 92.436 108.960 1.00 117.53 ? 708 MAN B C3 1 HETATM 8559 C C4 . MAN V 5 . ? 28.033 93.714 109.230 1.00 108.47 ? 708 MAN B C4 1 HETATM 8560 C C5 . MAN V 5 . ? 27.846 93.903 110.731 1.00 103.11 ? 708 MAN B C5 1 HETATM 8561 C C6 . MAN V 5 . ? 27.192 95.246 111.052 1.00 98.84 ? 708 MAN B C6 1 HETATM 8562 O O2 . MAN V 5 . ? 28.479 90.093 109.336 1.00 92.65 ? 708 MAN B O2 1 HETATM 8563 O O3 . MAN V 5 . ? 28.543 91.943 107.642 1.00 110.87 ? 708 MAN B O3 1 HETATM 8564 O O4 . MAN V 5 . ? 28.739 94.833 108.685 1.00 91.53 ? 708 MAN B O4 1 HETATM 8565 O O5 . MAN V 5 . ? 26.983 92.882 111.232 1.00 76.99 ? 708 MAN B O5 1 HETATM 8566 O O6 . MAN V 5 . ? 28.024 96.347 110.666 1.00 84.99 ? 708 MAN B O6 1 HETATM 8567 C C1 . NAG W 4 . ? -2.677 45.801 99.358 1.00 89.51 ? 709 NAG B C1 1 HETATM 8568 C C2 . NAG W 4 . ? -2.354 44.622 100.270 1.00 88.25 ? 709 NAG B C2 1 HETATM 8569 C C3 . NAG W 4 . ? -1.347 45.036 101.331 1.00 82.17 ? 709 NAG B C3 1 HETATM 8570 C C4 . NAG W 4 . ? -0.086 45.573 100.670 1.00 87.52 ? 709 NAG B C4 1 HETATM 8571 C C5 . NAG W 4 . ? -0.428 46.633 99.624 1.00 86.99 ? 709 NAG B C5 1 HETATM 8572 C C6 . NAG W 4 . ? 0.806 46.996 98.803 1.00 75.18 ? 709 NAG B C6 1 HETATM 8573 C C7 . NAG W 4 . ? -4.106 42.965 100.443 1.00 87.58 ? 709 NAG B C7 1 HETATM 8574 C C8 . NAG W 4 . ? -5.603 42.894 100.511 1.00 78.04 ? 709 NAG B C8 1 HETATM 8575 N N2 . NAG W 4 . ? -3.555 44.092 100.886 1.00 88.29 ? 709 NAG B N2 1 HETATM 8576 O O3 . NAG W 4 . ? -1.018 43.902 102.139 1.00 97.43 ? 709 NAG B O3 1 HETATM 8577 O O4 . NAG W 4 . ? 0.748 46.165 101.679 1.00 100.04 ? 709 NAG B O4 1 HETATM 8578 O O5 . NAG W 4 . ? -1.464 46.218 98.725 1.00 87.35 ? 709 NAG B O5 1 HETATM 8579 O O6 . NAG W 4 . ? 1.018 46.009 97.787 1.00 100.59 ? 709 NAG B O6 1 HETATM 8580 O O7 . NAG W 4 . ? -3.431 42.046 100.007 1.00 81.46 ? 709 NAG B O7 1 HETATM 8581 C C1 . NAG X 4 . ? 1.802 45.257 102.067 1.00 90.44 ? 710 NAG B C1 1 HETATM 8582 C C2 . NAG X 4 . ? 3.021 46.065 102.505 1.00 90.71 ? 710 NAG B C2 1 HETATM 8583 C C3 . NAG X 4 . ? 4.176 45.163 102.913 1.00 99.54 ? 710 NAG B C3 1 HETATM 8584 C C4 . NAG X 4 . ? 3.732 44.157 103.971 1.00 121.40 ? 710 NAG B C4 1 HETATM 8585 C C5 . NAG X 4 . ? 2.425 43.485 103.549 1.00 116.91 ? 710 NAG B C5 1 HETATM 8586 C C6 . NAG X 4 . ? 1.882 42.605 104.673 1.00 119.14 ? 710 NAG B C6 1 HETATM 8587 C C7 . NAG X 4 . ? 3.347 48.273 101.561 1.00 88.00 ? 710 NAG B C7 1 HETATM 8588 C C8 . NAG X 4 . ? 4.485 49.072 100.993 1.00 72.71 ? 710 NAG B C8 1 HETATM 8589 N N2 . NAG X 4 . ? 3.458 46.952 101.445 1.00 100.84 ? 710 NAG B N2 1 HETATM 8590 O O3 . NAG X 4 . ? 5.212 46.008 103.425 1.00 93.75 ? 710 NAG B O3 1 HETATM 8591 O O4 . NAG X 4 . ? 4.694 43.099 104.155 1.00 125.57 ? 710 NAG B O4 1 HETATM 8592 O O5 . NAG X 4 . ? 1.414 44.422 103.160 1.00 109.46 ? 710 NAG B O5 1 HETATM 8593 O O6 . NAG X 4 . ? 1.367 43.423 105.731 1.00 109.32 ? 710 NAG B O6 1 HETATM 8594 O O7 . NAG X 4 . ? 2.384 48.799 102.097 1.00 69.98 ? 710 NAG B O7 1 HETATM 8595 C C1 . MAN Y 5 . ? 6.048 43.552 104.414 1.00 130.66 ? 711 MAN B C1 1 HETATM 8596 C C2 . MAN Y 5 . ? 6.913 42.327 104.716 1.00 128.60 ? 711 MAN B C2 1 HETATM 8597 C C3 . MAN Y 5 . ? 6.483 41.663 106.019 1.00 135.51 ? 711 MAN B C3 1 HETATM 8598 C C4 . MAN Y 5 . ? 6.449 42.669 107.165 1.00 135.91 ? 711 MAN B C4 1 HETATM 8599 C C5 . MAN Y 5 . ? 5.684 43.937 106.782 1.00 134.67 ? 711 MAN B C5 1 HETATM 8600 C C6 . MAN Y 5 . ? 5.853 45.041 107.828 1.00 124.96 ? 711 MAN B C6 1 HETATM 8601 O O2 . MAN Y 5 . ? 8.288 42.723 104.786 1.00 134.82 ? 711 MAN B O2 1 HETATM 8602 O O3 . MAN Y 5 . ? 7.384 40.594 106.338 1.00 129.62 ? 711 MAN B O3 1 HETATM 8603 O O4 . MAN Y 5 . ? 5.813 42.033 108.284 1.00 125.61 ? 711 MAN B O4 1 HETATM 8604 O O5 . MAN Y 5 . ? 6.136 44.455 105.527 1.00 144.81 ? 711 MAN B O5 1 HETATM 8605 O O6 . MAN Y 5 . ? 7.190 45.557 107.797 1.00 107.94 ? 711 MAN B O6 1 HETATM 8606 H H1 . MAN Y 5 . ? 6.447 44.042 103.514 1.00 156.79 ? 711 MAN B H1 1 HETATM 8607 H H2 . MAN Y 5 . ? 6.782 41.602 103.900 1.00 154.32 ? 711 MAN B H2 1 HETATM 8608 H H3 . MAN Y 5 . ? 5.470 41.259 105.883 1.00 162.61 ? 711 MAN B H3 1 HETATM 8609 H H4 . MAN Y 5 . ? 7.480 42.943 107.427 1.00 163.09 ? 711 MAN B H4 1 HETATM 8610 H H5 . MAN Y 5 . ? 4.616 43.689 106.712 1.00 161.60 ? 711 MAN B H5 1 HETATM 8611 H H61 . MAN Y 5 . ? 5.638 44.640 108.821 1.00 149.95 ? 711 MAN B H61 1 HETATM 8612 H H62 . MAN Y 5 . ? 5.144 45.847 107.628 1.00 149.95 ? 711 MAN B H62 1 HETATM 8613 H HO2 . MAN Y 5 . ? 8.827 41.966 105.054 1.00 161.78 ? 711 MAN B HO2 1 HETATM 8614 H HO3 . MAN Y 5 . ? 7.155 40.227 107.204 1.00 155.55 ? 711 MAN B HO3 1 HETATM 8615 H HO4 . MAN Y 5 . ? 5.848 42.621 109.051 1.00 150.73 ? 711 MAN B HO4 1 HETATM 8616 H HO6 . MAN Y 5 . ? 7.261 46.305 108.406 1.00 129.53 ? 711 MAN B HO6 1 HETATM 8617 C C1 . NAG Z 4 . ? -9.887 58.086 79.432 1.00 91.93 ? 712 NAG B C1 1 HETATM 8618 C C2 . NAG Z 4 . ? -10.456 57.168 78.352 1.00 100.48 ? 712 NAG B C2 1 HETATM 8619 C C3 . NAG Z 4 . ? -11.659 57.810 77.686 1.00 108.01 ? 712 NAG B C3 1 HETATM 8620 C C4 . NAG Z 4 . ? -12.723 58.108 78.730 1.00 101.46 ? 712 NAG B C4 1 HETATM 8621 C C5 . NAG Z 4 . ? -12.154 58.995 79.839 1.00 98.06 ? 712 NAG B C5 1 HETATM 8622 C C6 . NAG Z 4 . ? -13.106 59.053 81.032 1.00 108.60 ? 712 NAG B C6 1 HETATM 8623 C C7 . NAG Z 4 . ? -8.825 55.689 77.312 1.00 95.30 ? 712 NAG B C7 1 HETATM 8624 C C8 . NAG Z 4 . ? -7.361 55.737 76.980 1.00 82.79 ? 712 NAG B C8 1 HETATM 8625 N N2 . NAG Z 4 . ? -9.449 56.865 77.350 1.00 99.37 ? 712 NAG B N2 1 HETATM 8626 O O3 . NAG Z 4 . ? -12.192 56.916 76.703 1.00 108.26 ? 712 NAG B O3 1 HETATM 8627 O O4 . NAG Z 4 . ? -13.863 58.666 78.043 1.00 119.24 ? 712 NAG B O4 1 HETATM 8628 O O5 . NAG Z 4 . ? -10.912 58.491 80.351 1.00 97.94 ? 712 NAG B O5 1 HETATM 8629 O O6 . NAG Z 4 . ? -12.677 60.054 81.964 1.00 90.27 ? 712 NAG B O6 1 HETATM 8630 O O7 . NAG Z 4 . ? -9.406 54.636 77.530 1.00 80.80 ? 712 NAG B O7 1 HETATM 8631 C C1 . NAG AA 4 . ? -14.129 60.052 78.349 1.00 120.55 ? 713 NAG B C1 1 HETATM 8632 C C2 . NAG AA 4 . ? -14.661 60.739 77.079 1.00 127.29 ? 713 NAG B C2 1 HETATM 8633 C C3 . NAG AA 4 . ? -15.504 61.989 77.336 1.00 127.23 ? 713 NAG B C3 1 HETATM 8634 C C4 . NAG AA 4 . ? -16.448 61.804 78.514 1.00 119.14 ? 713 NAG B C4 1 HETATM 8635 C C5 . NAG AA 4 . ? -15.615 61.388 79.713 1.00 96.93 ? 713 NAG B C5 1 HETATM 8636 C C6 . NAG AA 4 . ? -16.437 61.289 80.992 1.00 100.41 ? 713 NAG B C6 1 HETATM 8637 C C7 . NAG AA 4 . ? -13.212 60.431 75.132 1.00 114.57 ? 713 NAG B C7 1 HETATM 8638 C C8 . NAG AA 4 . ? -12.041 60.981 74.370 1.00 102.93 ? 713 NAG B C8 1 HETATM 8639 N N2 . NAG AA 4 . ? -13.552 61.119 76.220 1.00 128.69 ? 713 NAG B N2 1 HETATM 8640 O O3 . NAG AA 4 . ? -16.261 62.298 76.158 1.00 112.34 ? 713 NAG B O3 1 HETATM 8641 O O4 . NAG AA 4 . ? -17.141 63.031 78.778 1.00 99.02 ? 713 NAG B O4 1 HETATM 8642 O O5 . NAG AA 4 . ? -15.054 60.110 79.440 1.00 107.05 ? 713 NAG B O5 1 HETATM 8643 O O6 . NAG AA 4 . ? -17.334 60.177 80.897 1.00 105.21 ? 713 NAG B O6 1 HETATM 8644 O O7 . NAG AA 4 . ? -13.807 59.427 74.775 1.00 94.52 ? 713 NAG B O7 1 HETATM 8645 H HN2 . NAG AA 4 . ? -13.025 61.944 76.468 1.00 154.42 ? 713 NAG B HN2 1 HETATM 8646 H HO3 . NAG AA 4 . ? -16.755 63.117 76.298 1.00 134.80 ? 713 NAG B HO3 1 HETATM 8647 H HO4 . NAG AA 4 . ? -17.730 62.912 79.535 1.00 118.82 ? 713 NAG B HO4 1 HETATM 8648 H HO6 . NAG AA 4 . ? -17.856 60.114 81.709 1.00 126.25 ? 713 NAG B HO6 1 HETATM 8649 C C1 . NAG BA 4 . ? -19.969 85.701 107.570 1.00 90.56 ? 714 NAG B C1 1 HETATM 8650 C C2 . NAG BA 4 . ? -19.798 84.897 108.862 1.00 90.85 ? 714 NAG B C2 1 HETATM 8651 C C3 . NAG BA 4 . ? -21.062 84.670 109.696 1.00 100.50 ? 714 NAG B C3 1 HETATM 8652 C C4 . NAG BA 4 . ? -22.214 85.647 109.475 1.00 118.70 ? 714 NAG B C4 1 HETATM 8653 C C5 . NAG BA 4 . ? -22.189 86.285 108.089 1.00 115.97 ? 714 NAG B C5 1 HETATM 8654 C C6 . NAG BA 4 . ? -23.155 87.460 107.990 1.00 119.28 ? 714 NAG B C6 1 HETATM 8655 C C7 . NAG BA 4 . ? -18.027 83.236 108.987 1.00 64.01 ? 714 NAG B C7 1 HETATM 8656 C C8 . NAG BA 4 . ? -17.632 81.815 108.712 1.00 31.03 ? 714 NAG B C8 1 HETATM 8657 N N2 . NAG BA 4 . ? -19.229 83.598 108.547 1.00 66.76 ? 714 NAG B N2 1 HETATM 8658 O O3 . NAG BA 4 . ? -20.684 84.741 111.077 1.00 85.93 ? 714 NAG B O3 1 HETATM 8659 O O4 . NAG BA 4 . ? -23.432 84.900 109.621 1.00 126.40 ? 714 NAG B O4 1 HETATM 8660 O O5 . NAG BA 4 . ? -20.886 86.767 107.782 1.00 104.69 ? 714 NAG B O5 1 HETATM 8661 O O6 . NAG BA 4 . ? -23.024 88.064 106.697 1.00 101.71 ? 714 NAG B O6 1 HETATM 8662 O O7 . NAG BA 4 . ? -17.294 84.010 109.581 1.00 68.85 ? 714 NAG B O7 1 HETATM 8663 C C1 . NAG CA 4 . ? -24.153 85.278 110.816 1.00 134.61 ? 715 NAG B C1 1 HETATM 8664 C C2 . NAG CA 4 . ? -25.617 84.870 110.646 1.00 132.82 ? 715 NAG B C2 1 HETATM 8665 C C3 . NAG CA 4 . ? -26.437 85.239 111.875 1.00 142.57 ? 715 NAG B C3 1 HETATM 8666 C C4 . NAG CA 4 . ? -25.793 84.657 113.125 1.00 147.62 ? 715 NAG B C4 1 HETATM 8667 C C5 . NAG CA 4 . ? -24.316 85.027 113.194 1.00 140.49 ? 715 NAG B C5 1 HETATM 8668 C C6 . NAG CA 4 . ? -23.666 84.342 114.391 1.00 130.50 ? 715 NAG B C6 1 HETATM 8669 C C7 . NAG CA 4 . ? -26.097 84.920 108.261 1.00 130.44 ? 715 NAG B C7 1 HETATM 8670 C C8 . NAG CA 4 . ? -26.913 85.563 107.178 1.00 114.46 ? 715 NAG B C8 1 HETATM 8671 N N2 . NAG CA 4 . ? -26.187 85.487 109.463 1.00 135.71 ? 715 NAG B N2 1 HETATM 8672 O O3 . NAG CA 4 . ? -27.764 84.719 111.739 1.00 134.14 ? 715 NAG B O3 1 HETATM 8673 O O4 . NAG CA 4 . ? -26.461 85.161 114.288 1.00 129.89 ? 715 NAG B O4 1 HETATM 8674 O O5 . NAG CA 4 . ? -23.633 84.649 111.994 1.00 140.31 ? 715 NAG B O5 1 HETATM 8675 O O6 . NAG CA 4 . ? -23.980 82.945 114.370 1.00 111.92 ? 715 NAG B O6 1 HETATM 8676 O O7 . NAG CA 4 . ? -25.397 83.943 108.050 1.00 115.97 ? 715 NAG B O7 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 GLY 1 44 ? ? ? A . n A 1 2 ALA 2 45 ? ? ? A . n A 1 3 PRO 3 46 ? ? ? A . n A 1 4 LEU 4 47 ? ? ? A . n A 1 5 SER 5 48 ? ? ? A . n A 1 6 ASP 6 49 ? ? ? A . n A 1 7 SER 7 50 ? ? ? A . n A 1 8 ARG 8 51 ? ? ? A . n A 1 9 VAL 9 52 ? ? ? A . n A 1 10 LEU 10 53 ? ? ? A . n A 1 11 TRP 11 54 ? ? ? A . n A 1 12 ALA 12 55 ? ? ? A . n A 1 13 PRO 13 56 ? ? ? A . n A 1 14 ALA 14 57 ? ? ? A . n A 1 15 GLU 15 58 ? ? ? A . n A 1 16 ALA 16 59 ? ? ? A . n A 1 17 HIS 17 60 ? ? ? A . n A 1 18 PRO 18 61 ? ? ? A . n A 1 19 LEU 19 62 ? ? ? A . n A 1 20 SER 20 63 ? ? ? A . n A 1 21 PRO 21 64 ? ? ? A . n A 1 22 GLN 22 65 ? ? ? A . n A 1 23 GLY 23 66 ? ? ? A . n A 1 24 HIS 24 67 ? ? ? A . n A 1 25 PRO 25 68 ? ? ? A . n A 1 26 ALA 26 69 ? ? ? A . n A 1 27 ARG 27 70 ? ? ? A . n A 1 28 LEU 28 71 ? ? ? A . n A 1 29 HIS 29 72 ? ? ? A . n A 1 30 ARG 30 73 ? ? ? A . n A 1 31 ILE 31 74 ? ? ? A . n A 1 32 VAL 32 75 ? ? ? A . n A 1 33 PRO 33 76 ? ? ? A . n A 1 34 ARG 34 77 ? ? ? A . n A 1 35 LEU 35 78 ? ? ? A . n A 1 36 ARG 36 79 ? ? ? A . n A 1 37 ASP 37 80 ? ? ? A . n A 1 38 VAL 38 81 ? ? ? A . n A 1 39 PHE 39 82 ? ? ? A . n A 1 40 GLY 40 83 83 GLY GLY A . n A 1 41 TRP 41 84 84 TRP TRP A . n A 1 42 GLY 42 85 85 GLY GLY A . n A 1 43 ASN 43 86 86 ASN ASN A . n A 1 44 LEU 44 87 87 LEU LEU A . n A 1 45 THR 45 88 88 THR THR A . n A 1 46 CYS 46 89 89 CYS CYS A . n A 1 47 PRO 47 90 90 PRO PRO A . n A 1 48 ILE 48 91 91 ILE ILE A . n A 1 49 CYS 49 92 92 CYS CYS A . n A 1 50 LYS 50 93 93 LYS LYS A . n A 1 51 GLY 51 94 94 GLY GLY A . n A 1 52 LEU 52 95 95 LEU LEU A . n A 1 53 PHE 53 96 96 PHE PHE A . n A 1 54 THR 54 97 97 THR THR A . n A 1 55 ALA 55 98 98 ALA ALA A . n A 1 56 ILE 56 99 99 ILE ILE A . n A 1 57 ASN 57 100 100 ASN ASN A . n A 1 58 LEU 58 101 101 LEU LEU A . n A 1 59 GLY 59 102 102 GLY GLY A . n A 1 60 LEU 60 103 103 LEU LEU A . n A 1 61 LYS 61 104 104 LYS LYS A . n A 1 62 LYS 62 105 105 LYS LYS A . n A 1 63 GLU 63 106 106 GLU GLU A . n A 1 64 PRO 64 107 107 PRO PRO A . n A 1 65 ASN 65 108 108 ASN ASN A . n A 1 66 VAL 66 109 109 VAL VAL A . n A 1 67 ALA 67 110 110 ALA ALA A . n A 1 68 ARG 68 111 111 ARG ARG A . n A 1 69 VAL 69 112 112 VAL VAL A . n A 1 70 GLY 70 113 113 GLY GLY A . n A 1 71 SER 71 114 114 SER SER A . n A 1 72 VAL 72 115 115 VAL VAL A . n A 1 73 ALA 73 116 116 ALA ALA A . n A 1 74 ILE 74 117 117 ILE ILE A . n A 1 75 LYS 75 118 118 LYS LYS A . n A 1 76 LEU 76 119 119 LEU LEU A . n A 1 77 CYS 77 120 120 CYS CYS A . n A 1 78 ASN 78 121 121 ASN ASN A . n A 1 79 LEU 79 122 122 LEU LEU A . n A 1 80 LEU 80 123 123 LEU LEU A . n A 1 81 LYS 81 124 124 LYS LYS A . n A 1 82 ILE 82 125 125 ILE ILE A . n A 1 83 ALA 83 126 126 ALA ALA A . n A 1 84 PRO 84 127 127 PRO PRO A . n A 1 85 PRO 85 128 128 PRO PRO A . n A 1 86 ALA 86 129 129 ALA ALA A . n A 1 87 VAL 87 130 130 VAL VAL A . n A 1 88 CYS 88 131 131 CYS CYS A . n A 1 89 GLN 89 132 132 GLN GLN A . n A 1 90 SER 90 133 133 SER SER A . n A 1 91 ILE 91 134 134 ILE ILE A . n A 1 92 VAL 92 135 135 VAL VAL A . n A 1 93 HIS 93 136 136 HIS HIS A . n A 1 94 LEU 94 137 137 LEU LEU A . n A 1 95 PHE 95 138 138 PHE PHE A . n A 1 96 GLU 96 139 139 GLU GLU A . n A 1 97 ASP 97 140 140 ASP ASP A . n A 1 98 ASP 98 141 141 ASP ASP A . n A 1 99 MET 99 142 142 MET MET A . n A 1 100 VAL 100 143 143 VAL VAL A . n A 1 101 GLU 101 144 144 GLU GLU A . n A 1 102 VAL 102 145 145 VAL VAL A . n A 1 103 TRP 103 146 146 TRP TRP A . n A 1 104 ARG 104 147 147 ARG ARG A . n A 1 105 ARG 105 148 148 ARG ARG A . n A 1 106 SER 106 149 149 SER SER A . n A 1 107 VAL 107 150 150 VAL VAL A . n A 1 108 LEU 108 151 151 LEU LEU A . n A 1 109 SER 109 152 152 SER SER A . n A 1 110 PRO 110 153 153 PRO PRO A . n A 1 111 SER 111 154 154 SER SER A . n A 1 112 GLU 112 155 155 GLU GLU A . n A 1 113 ALA 113 156 156 ALA ALA A . n A 1 114 CYS 114 157 157 CYS CYS A . n A 1 115 GLY 115 158 158 GLY GLY A . n A 1 116 LEU 116 159 159 LEU LEU A . n A 1 117 LEU 117 160 160 LEU LEU A . n A 1 118 LEU 118 161 161 LEU LEU A . n A 1 119 GLY 119 162 162 GLY GLY A . n A 1 120 SER 120 163 163 SER SER A . n A 1 121 THR 121 164 164 THR THR A . n A 1 122 CYS 122 165 165 CYS CYS A . n A 1 123 GLY 123 166 166 GLY GLY A . n A 1 124 HIS 124 167 167 HIS HIS A . n A 1 125 TRP 125 168 168 TRP TRP A . n A 1 126 ASP 126 169 169 ASP ASP A . n A 1 127 ILE 127 170 170 ILE ILE A . n A 1 128 PHE 128 171 171 PHE PHE A . n A 1 129 SER 129 172 172 SER SER A . n A 1 130 SER 130 173 173 SER SER A . n A 1 131 TRP 131 174 174 TRP TRP A . n A 1 132 ASN 132 175 175 ASN ASN A . n A 1 133 ILE 133 176 176 ILE ILE A . n A 1 134 SER 134 177 177 SER SER A . n A 1 135 LEU 135 178 178 LEU LEU A . n A 1 136 PRO 136 179 179 PRO PRO A . n A 1 137 THR 137 180 180 THR THR A . n A 1 138 VAL 138 181 181 VAL VAL A . n A 1 139 PRO 139 182 182 PRO PRO A . n A 1 140 LYS 140 183 183 LYS LYS A . n A 1 141 PRO 141 184 184 PRO PRO A . n A 1 142 PRO 142 185 185 PRO PRO A . n A 1 143 PRO 143 186 186 PRO PRO A . n A 1 144 LYS 144 187 187 LYS LYS A . n A 1 145 PRO 145 188 188 PRO PRO A . n A 1 146 PRO 146 189 189 PRO PRO A . n A 1 147 SER 147 190 190 SER SER A . n A 1 148 PRO 148 191 191 PRO PRO A . n A 1 149 PRO 149 192 192 PRO PRO A . n A 1 150 ALA 150 193 193 ALA ALA A . n A 1 151 PRO 151 194 194 PRO PRO A . n A 1 152 GLY 152 195 195 GLY GLY A . n A 1 153 ALA 153 196 196 ALA ALA A . n A 1 154 PRO 154 197 197 PRO PRO A . n A 1 155 VAL 155 198 198 VAL VAL A . n A 1 156 SER 156 199 199 SER SER A . n A 1 157 ARG 157 200 200 ARG ARG A . n A 1 158 ILE 158 201 201 ILE ILE A . n A 1 159 LEU 159 202 202 LEU LEU A . n A 1 160 PHE 160 203 203 PHE PHE A . n A 1 161 LEU 161 204 204 LEU LEU A . n A 1 162 THR 162 205 205 THR THR A . n A 1 163 ASP 163 206 206 ASP ASP A . n A 1 164 LEU 164 207 207 LEU LEU A . n A 1 165 HIS 165 208 208 HIS HIS A . n A 1 166 TRP 166 209 209 TRP TRP A . n A 1 167 ASP 167 210 210 ASP ASP A . n A 1 168 HIS 168 211 211 HIS HIS A . n A 1 169 ASP 169 212 212 ASP ASP A . n A 1 170 TYR 170 213 213 TYR TYR A . n A 1 171 LEU 171 214 214 LEU LEU A . n A 1 172 GLU 172 215 215 GLU GLU A . n A 1 173 GLY 173 216 216 GLY GLY A . n A 1 174 THR 174 217 217 THR THR A . n A 1 175 ASP 175 218 218 ASP ASP A . n A 1 176 PRO 176 219 219 PRO PRO A . n A 1 177 ASP 177 220 220 ASP ASP A . n A 1 178 CYS 178 221 221 CYS CYS A . n A 1 179 ALA 179 222 222 ALA ALA A . n A 1 180 ASP 180 223 223 ASP ASP A . n A 1 181 PRO 181 224 224 PRO PRO A . n A 1 182 LEU 182 225 225 LEU LEU A . n A 1 183 CYS 183 226 226 CYS CYS A . n A 1 184 CYS 184 227 227 CYS CYS A . n A 1 185 ARG 185 228 228 ARG ARG A . n A 1 186 ARG 186 229 229 ARG ARG A . n A 1 187 GLY 187 230 230 GLY GLY A . n A 1 188 SER 188 231 231 SER SER A . n A 1 189 GLY 189 232 232 GLY GLY A . n A 1 190 LEU 190 233 233 LEU LEU A . n A 1 191 PRO 191 234 234 PRO PRO A . n A 1 192 PRO 192 235 235 PRO PRO A . n A 1 193 ALA 193 236 236 ALA ALA A . n A 1 194 SER 194 237 237 SER SER A . n A 1 195 ARG 195 238 238 ARG ARG A . n A 1 196 PRO 196 239 239 PRO PRO A . n A 1 197 GLY 197 240 240 GLY GLY A . n A 1 198 ALA 198 241 241 ALA ALA A . n A 1 199 GLY 199 242 242 GLY GLY A . n A 1 200 TYR 200 243 243 TYR TYR A . n A 1 201 TRP 201 244 244 TRP TRP A . n A 1 202 GLY 202 245 245 GLY GLY A . n A 1 203 GLU 203 246 246 GLU GLU A . n A 1 204 TYR 204 247 247 TYR TYR A . n A 1 205 SER 205 248 248 SER SER A . n A 1 206 LYS 206 249 249 LYS LYS A . n A 1 207 CYS 207 250 250 CYS CYS A . n A 1 208 ASP 208 251 251 ASP ASP A . n A 1 209 LEU 209 252 252 LEU LEU A . n A 1 210 PRO 210 253 253 PRO PRO A . n A 1 211 LEU 211 254 254 LEU LEU A . n A 1 212 ARG 212 255 255 ARG ARG A . n A 1 213 THR 213 256 256 THR THR A . n A 1 214 LEU 214 257 257 LEU LEU A . n A 1 215 GLU 215 258 258 GLU GLU A . n A 1 216 SER 216 259 259 SER SER A . n A 1 217 LEU 217 260 260 LEU LEU A . n A 1 218 LEU 218 261 261 LEU LEU A . n A 1 219 SER 219 262 262 SER SER A . n A 1 220 GLY 220 263 263 GLY GLY A . n A 1 221 LEU 221 264 264 LEU LEU A . n A 1 222 GLY 222 265 265 GLY GLY A . n A 1 223 PRO 223 266 266 PRO PRO A . n A 1 224 ALA 224 267 267 ALA ALA A . n A 1 225 GLY 225 268 268 GLY GLY A . n A 1 226 PRO 226 269 269 PRO PRO A . n A 1 227 PHE 227 270 270 PHE PHE A . n A 1 228 ASP 228 271 271 ASP ASP A . n A 1 229 MET 229 272 272 MET MET A . n A 1 230 VAL 230 273 273 VAL VAL A . n A 1 231 TYR 231 274 274 TYR TYR A . n A 1 232 TRP 232 275 275 TRP TRP A . n A 1 233 THR 233 276 276 THR THR A . n A 1 234 GLY 234 277 277 GLY GLY A . n A 1 235 ASP 235 278 278 ASP ASP A . n A 1 236 ILE 236 279 279 ILE ILE A . n A 1 237 PRO 237 280 280 PRO PRO A . n A 1 238 ALA 238 281 281 ALA ALA A . n A 1 239 HIS 239 282 282 HIS HIS A . n A 1 240 ASP 240 283 283 ASP ASP A . n A 1 241 VAL 241 284 284 VAL VAL A . n A 1 242 TRP 242 285 285 TRP TRP A . n A 1 243 HIS 243 286 286 HIS HIS A . n A 1 244 GLN 244 287 287 GLN GLN A . n A 1 245 THR 245 288 288 THR THR A . n A 1 246 ARG 246 289 289 ARG ARG A . n A 1 247 GLN 247 290 290 GLN GLN A . n A 1 248 ASP 248 291 291 ASP ASP A . n A 1 249 GLN 249 292 292 GLN GLN A . n A 1 250 LEU 250 293 293 LEU LEU A . n A 1 251 ARG 251 294 294 ARG ARG A . n A 1 252 ALA 252 295 295 ALA ALA A . n A 1 253 LEU 253 296 296 LEU LEU A . n A 1 254 THR 254 297 297 THR THR A . n A 1 255 THR 255 298 298 THR THR A . n A 1 256 VAL 256 299 299 VAL VAL A . n A 1 257 THR 257 300 300 THR THR A . n A 1 258 ALA 258 301 301 ALA ALA A . n A 1 259 LEU 259 302 302 LEU LEU A . n A 1 260 VAL 260 303 303 VAL VAL A . n A 1 261 ARG 261 304 304 ARG ARG A . n A 1 262 LYS 262 305 305 LYS LYS A . n A 1 263 PHE 263 306 306 PHE PHE A . n A 1 264 LEU 264 307 307 LEU LEU A . n A 1 265 GLY 265 308 308 GLY GLY A . n A 1 266 PRO 266 309 309 PRO PRO A . n A 1 267 VAL 267 310 310 VAL VAL A . n A 1 268 PRO 268 311 311 PRO PRO A . n A 1 269 VAL 269 312 312 VAL VAL A . n A 1 270 TYR 270 313 313 TYR TYR A . n A 1 271 PRO 271 314 314 PRO PRO A . n A 1 272 ALA 272 315 315 ALA ALA A . n A 1 273 VAL 273 316 316 VAL VAL A . n A 1 274 GLY 274 317 317 GLY GLY A . n A 1 275 ASN 275 318 318 ASN ASN A . n A 1 276 HIS 276 319 319 HIS HIS A . n A 1 277 GLU 277 320 320 GLU GLU A . n A 1 278 SER 278 321 321 SER SER A . n A 1 279 THR 279 322 322 THR THR A . n A 1 280 PRO 280 323 323 PRO PRO A . n A 1 281 VAL 281 324 324 VAL VAL A . n A 1 282 ASN 282 325 325 ASN ASN A . n A 1 283 SER 283 326 326 SER SER A . n A 1 284 PHE 284 327 327 PHE PHE A . n A 1 285 PRO 285 328 328 PRO PRO A . n A 1 286 PRO 286 329 329 PRO PRO A . n A 1 287 PRO 287 330 330 PRO PRO A . n A 1 288 PHE 288 331 331 PHE PHE A . n A 1 289 ILE 289 332 332 ILE ILE A . n A 1 290 GLU 290 333 333 GLU GLU A . n A 1 291 GLY 291 334 334 GLY GLY A . n A 1 292 ASN 292 335 335 ASN ASN A . n A 1 293 HIS 293 336 336 HIS HIS A . n A 1 294 SER 294 337 337 SER SER A . n A 1 295 SER 295 338 338 SER SER A . n A 1 296 ARG 296 339 339 ARG ARG A . n A 1 297 TRP 297 340 340 TRP TRP A . n A 1 298 LEU 298 341 341 LEU LEU A . n A 1 299 TYR 299 342 342 TYR TYR A . n A 1 300 GLU 300 343 343 GLU GLU A . n A 1 301 ALA 301 344 344 ALA ALA A . n A 1 302 MET 302 345 345 MET MET A . n A 1 303 ALA 303 346 346 ALA ALA A . n A 1 304 LYS 304 347 347 LYS LYS A . n A 1 305 ALA 305 348 348 ALA ALA A . n A 1 306 TRP 306 349 349 TRP TRP A . n A 1 307 GLU 307 350 350 GLU GLU A . n A 1 308 PRO 308 351 351 PRO PRO A . n A 1 309 TRP 309 352 352 TRP TRP A . n A 1 310 LEU 310 353 353 LEU LEU A . n A 1 311 PRO 311 354 354 PRO PRO A . n A 1 312 ALA 312 355 355 ALA ALA A . n A 1 313 GLU 313 356 356 GLU GLU A . n A 1 314 ALA 314 357 357 ALA ALA A . n A 1 315 LEU 315 358 358 LEU LEU A . n A 1 316 ARG 316 359 359 ARG ARG A . n A 1 317 THR 317 360 360 THR THR A . n A 1 318 LEU 318 361 361 LEU LEU A . n A 1 319 ARG 319 362 362 ARG ARG A . n A 1 320 ILE 320 363 363 ILE ILE A . n A 1 321 GLY 321 364 364 GLY GLY A . n A 1 322 GLY 322 365 365 GLY GLY A . n A 1 323 PHE 323 366 366 PHE PHE A . n A 1 324 TYR 324 367 367 TYR TYR A . n A 1 325 ALA 325 368 368 ALA ALA A . n A 1 326 LEU 326 369 369 LEU LEU A . n A 1 327 SER 327 370 370 SER SER A . n A 1 328 PRO 328 371 371 PRO PRO A . n A 1 329 TYR 329 372 372 TYR TYR A . n A 1 330 PRO 330 373 373 PRO PRO A . n A 1 331 GLY 331 374 374 GLY GLY A . n A 1 332 LEU 332 375 375 LEU LEU A . n A 1 333 ARG 333 376 376 ARG ARG A . n A 1 334 LEU 334 377 377 LEU LEU A . n A 1 335 ILE 335 378 378 ILE ILE A . n A 1 336 SER 336 379 379 SER SER A . n A 1 337 LEU 337 380 380 LEU LEU A . n A 1 338 ASN 338 381 381 ASN ASN A . n A 1 339 MET 339 382 382 MET MET A . n A 1 340 ASN 340 383 383 ASN ASN A . n A 1 341 PHE 341 384 384 PHE PHE A . n A 1 342 CYS 342 385 385 CYS CYS A . n A 1 343 SER 343 386 386 SER SER A . n A 1 344 ARG 344 387 387 ARG ARG A . n A 1 345 GLU 345 388 388 GLU GLU A . n A 1 346 ASN 346 389 389 ASN ASN A . n A 1 347 PHE 347 390 390 PHE PHE A . n A 1 348 TRP 348 391 391 TRP TRP A . n A 1 349 LEU 349 392 392 LEU LEU A . n A 1 350 LEU 350 393 393 LEU LEU A . n A 1 351 ILE 351 394 394 ILE ILE A . n A 1 352 ASN 352 395 395 ASN ASN A . n A 1 353 SER 353 396 396 SER SER A . n A 1 354 THR 354 397 397 THR THR A . n A 1 355 ASP 355 398 398 ASP ASP A . n A 1 356 PRO 356 399 399 PRO PRO A . n A 1 357 ALA 357 400 400 ALA ALA A . n A 1 358 GLY 358 401 401 GLY GLY A . n A 1 359 GLN 359 402 402 GLN GLN A . n A 1 360 LEU 360 403 403 LEU LEU A . n A 1 361 GLN 361 404 404 GLN GLN A . n A 1 362 TRP 362 405 405 TRP TRP A . n A 1 363 LEU 363 406 406 LEU LEU A . n A 1 364 VAL 364 407 407 VAL VAL A . n A 1 365 GLY 365 408 408 GLY GLY A . n A 1 366 GLU 366 409 409 GLU GLU A . n A 1 367 LEU 367 410 410 LEU LEU A . n A 1 368 GLN 368 411 411 GLN GLN A . n A 1 369 ALA 369 412 412 ALA ALA A . n A 1 370 ALA 370 413 413 ALA ALA A . n A 1 371 GLU 371 414 414 GLU GLU A . n A 1 372 ASP 372 415 415 ASP ASP A . n A 1 373 ARG 373 416 416 ARG ARG A . n A 1 374 GLY 374 417 417 GLY GLY A . n A 1 375 ASP 375 418 418 ASP ASP A . n A 1 376 LYS 376 419 419 LYS LYS A . n A 1 377 VAL 377 420 420 VAL VAL A . n A 1 378 HIS 378 421 421 HIS HIS A . n A 1 379 ILE 379 422 422 ILE ILE A . n A 1 380 ILE 380 423 423 ILE ILE A . n A 1 381 GLY 381 424 424 GLY GLY A . n A 1 382 HIS 382 425 425 HIS HIS A . n A 1 383 ILE 383 426 426 ILE ILE A . n A 1 384 PRO 384 427 427 PRO PRO A . n A 1 385 PRO 385 428 428 PRO PRO A . n A 1 386 GLY 386 429 429 GLY GLY A . n A 1 387 HIS 387 430 430 HIS HIS A . n A 1 388 CYS 388 431 431 CYS CYS A . n A 1 389 LEU 389 432 432 LEU LEU A . n A 1 390 LYS 390 433 433 LYS LYS A . n A 1 391 SER 391 434 434 SER SER A . n A 1 392 TRP 392 435 435 TRP TRP A . n A 1 393 SER 393 436 436 SER SER A . n A 1 394 TRP 394 437 437 TRP TRP A . n A 1 395 ASN 395 438 438 ASN ASN A . n A 1 396 TYR 396 439 439 TYR TYR A . n A 1 397 TYR 397 440 440 TYR TYR A . n A 1 398 ARG 398 441 441 ARG ARG A . n A 1 399 ILE 399 442 442 ILE ILE A . n A 1 400 VAL 400 443 443 VAL VAL A . n A 1 401 ALA 401 444 444 ALA ALA A . n A 1 402 ARG 402 445 445 ARG ARG A . n A 1 403 TYR 403 446 446 TYR TYR A . n A 1 404 GLU 404 447 447 GLU GLU A . n A 1 405 ASN 405 448 448 ASN ASN A . n A 1 406 THR 406 449 449 THR THR A . n A 1 407 LEU 407 450 450 LEU LEU A . n A 1 408 ALA 408 451 451 ALA ALA A . n A 1 409 ALA 409 452 452 ALA ALA A . n A 1 410 GLN 410 453 453 GLN GLN A . n A 1 411 PHE 411 454 454 PHE PHE A . n A 1 412 PHE 412 455 455 PHE PHE A . n A 1 413 GLY 413 456 456 GLY GLY A . n A 1 414 HIS 414 457 457 HIS HIS A . n A 1 415 THR 415 458 458 THR THR A . n A 1 416 HIS 416 459 459 HIS HIS A . n A 1 417 VAL 417 460 460 VAL VAL A . n A 1 418 ASP 418 461 461 ASP ASP A . n A 1 419 GLU 419 462 462 GLU GLU A . n A 1 420 PHE 420 463 463 PHE PHE A . n A 1 421 GLU 421 464 464 GLU GLU A . n A 1 422 VAL 422 465 465 VAL VAL A . n A 1 423 PHE 423 466 466 PHE PHE A . n A 1 424 TYR 424 467 467 TYR TYR A . n A 1 425 ASP 425 468 468 ASP ASP A . n A 1 426 GLU 426 469 469 GLU GLU A . n A 1 427 GLU 427 470 470 GLU GLU A . n A 1 428 THR 428 471 471 THR THR A . n A 1 429 LEU 429 472 472 LEU LEU A . n A 1 430 SER 430 473 473 SER SER A . n A 1 431 ARG 431 474 474 ARG ARG A . n A 1 432 PRO 432 475 475 PRO PRO A . n A 1 433 LEU 433 476 476 LEU LEU A . n A 1 434 ALA 434 477 477 ALA ALA A . n A 1 435 VAL 435 478 478 VAL VAL A . n A 1 436 ALA 436 479 479 ALA ALA A . n A 1 437 PHE 437 480 480 PHE PHE A . n A 1 438 LEU 438 481 481 LEU LEU A . n A 1 439 ALA 439 482 482 ALA ALA A . n A 1 440 PRO 440 483 483 PRO PRO A . n A 1 441 SER 441 484 484 SER SER A . n A 1 442 ALA 442 485 485 ALA ALA A . n A 1 443 THR 443 486 486 THR THR A . n A 1 444 THR 444 487 487 THR THR A . n A 1 445 TYR 445 488 488 TYR TYR A . n A 1 446 ILE 446 489 489 ILE ILE A . n A 1 447 GLY 447 490 490 GLY GLY A . n A 1 448 LEU 448 491 491 LEU LEU A . n A 1 449 ASN 449 492 492 ASN ASN A . n A 1 450 PRO 450 493 493 PRO PRO A . n A 1 451 GLY 451 494 494 GLY GLY A . n A 1 452 TYR 452 495 495 TYR TYR A . n A 1 453 ARG 453 496 496 ARG ARG A . n A 1 454 VAL 454 497 497 VAL VAL A . n A 1 455 TYR 455 498 498 TYR TYR A . n A 1 456 GLN 456 499 499 GLN GLN A . n A 1 457 ILE 457 500 500 ILE ILE A . n A 1 458 ASP 458 501 501 ASP ASP A . n A 1 459 GLY 459 502 502 GLY GLY A . n A 1 460 ASN 460 503 503 ASN ASN A . n A 1 461 TYR 461 504 504 TYR TYR A . n A 1 462 SER 462 505 505 SER SER A . n A 1 463 GLY 463 506 506 GLY GLY A . n A 1 464 SER 464 507 507 SER SER A . n A 1 465 SER 465 508 508 SER SER A . n A 1 466 HIS 466 509 509 HIS HIS A . n A 1 467 VAL 467 510 510 VAL VAL A . n A 1 468 VAL 468 511 511 VAL VAL A . n A 1 469 LEU 469 512 512 LEU LEU A . n A 1 470 ASP 470 513 513 ASP ASP A . n A 1 471 HIS 471 514 514 HIS HIS A . n A 1 472 GLU 472 515 515 GLU GLU A . n A 1 473 THR 473 516 516 THR THR A . n A 1 474 TYR 474 517 517 TYR TYR A . n A 1 475 ILE 475 518 518 ILE ILE A . n A 1 476 LEU 476 519 519 LEU LEU A . n A 1 477 ASN 477 520 520 ASN ASN A . n A 1 478 LEU 478 521 521 LEU LEU A . n A 1 479 THR 479 522 522 THR THR A . n A 1 480 GLN 480 523 523 GLN GLN A . n A 1 481 ALA 481 524 524 ALA ALA A . n A 1 482 ASN 482 525 525 ASN ASN A . n A 1 483 ILE 483 526 526 ILE ILE A . n A 1 484 PRO 484 527 527 PRO PRO A . n A 1 485 GLY 485 528 528 GLY GLY A . n A 1 486 ALA 486 529 529 ALA ALA A . n A 1 487 ILE 487 530 530 ILE ILE A . n A 1 488 PRO 488 531 531 PRO PRO A . n A 1 489 HIS 489 532 532 HIS HIS A . n A 1 490 TRP 490 533 533 TRP TRP A . n A 1 491 GLN 491 534 534 GLN GLN A . n A 1 492 LEU 492 535 535 LEU LEU A . n A 1 493 LEU 493 536 536 LEU LEU A . n A 1 494 TYR 494 537 537 TYR TYR A . n A 1 495 ARG 495 538 538 ARG ARG A . n A 1 496 ALA 496 539 539 ALA ALA A . n A 1 497 ARG 497 540 540 ARG ARG A . n A 1 498 GLU 498 541 541 GLU GLU A . n A 1 499 THR 499 542 542 THR THR A . n A 1 500 TYR 500 543 543 TYR TYR A . n A 1 501 GLY 501 544 544 GLY GLY A . n A 1 502 LEU 502 545 545 LEU LEU A . n A 1 503 PRO 503 546 546 PRO PRO A . n A 1 504 ASN 504 547 547 ASN ASN A . n A 1 505 THR 505 548 548 THR THR A . n A 1 506 LEU 506 549 549 LEU LEU A . n A 1 507 PRO 507 550 550 PRO PRO A . n A 1 508 THR 508 551 551 THR THR A . n A 1 509 ALA 509 552 552 ALA ALA A . n A 1 510 TRP 510 553 553 TRP TRP A . n A 1 511 HIS 511 554 554 HIS HIS A . n A 1 512 ASN 512 555 555 ASN ASN A . n A 1 513 LEU 513 556 556 LEU LEU A . n A 1 514 VAL 514 557 557 VAL VAL A . n A 1 515 TYR 515 558 558 TYR TYR A . n A 1 516 ARG 516 559 559 ARG ARG A . n A 1 517 MET 517 560 560 MET MET A . n A 1 518 ARG 518 561 561 ARG ARG A . n A 1 519 GLY 519 562 562 GLY GLY A . n A 1 520 ASP 520 563 563 ASP ASP A . n A 1 521 MET 521 564 564 MET MET A . n A 1 522 GLN 522 565 565 GLN GLN A . n A 1 523 LEU 523 566 566 LEU LEU A . n A 1 524 PHE 524 567 567 PHE PHE A . n A 1 525 GLN 525 568 568 GLN GLN A . n A 1 526 THR 526 569 569 THR THR A . n A 1 527 PHE 527 570 570 PHE PHE A . n A 1 528 TRP 528 571 571 TRP TRP A . n A 1 529 PHE 529 572 572 PHE PHE A . n A 1 530 LEU 530 573 573 LEU LEU A . n A 1 531 TYR 531 574 574 TYR TYR A . n A 1 532 HIS 532 575 575 HIS HIS A . n A 1 533 LYS 533 576 576 LYS LYS A . n A 1 534 GLY 534 577 577 GLY GLY A . n A 1 535 HIS 535 578 578 HIS HIS A . n A 1 536 PRO 536 579 579 PRO PRO A . n A 1 537 PRO 537 580 580 PRO PRO A . n A 1 538 SER 538 581 581 SER SER A . n A 1 539 GLU 539 582 582 GLU GLU A . n A 1 540 PRO 540 583 583 PRO PRO A . n A 1 541 CYS 541 584 584 CYS CYS A . n A 1 542 GLY 542 585 585 GLY GLY A . n A 1 543 THR 543 586 586 THR THR A . n A 1 544 PRO 544 587 587 PRO PRO A . n A 1 545 CYS 545 588 588 CYS CYS A . n A 1 546 ARG 546 589 589 ARG ARG A . n A 1 547 LEU 547 590 590 LEU LEU A . n A 1 548 ALA 548 591 591 ALA ALA A . n A 1 549 THR 549 592 592 THR THR A . n A 1 550 LEU 550 593 593 LEU LEU A . n A 1 551 CYS 551 594 594 CYS CYS A . n A 1 552 ALA 552 595 595 ALA ALA A . n A 1 553 GLN 553 596 596 GLN GLN A . n A 1 554 LEU 554 597 597 LEU LEU A . n A 1 555 SER 555 598 598 SER SER A . n A 1 556 ALA 556 599 599 ALA ALA A . n A 1 557 ARG 557 600 600 ARG ARG A . n A 1 558 ALA 558 601 601 ALA ALA A . n A 1 559 ASP 559 602 602 ASP ASP A . n A 1 560 SER 560 603 603 SER SER A . n A 1 561 PRO 561 604 604 PRO PRO A . n A 1 562 ALA 562 605 605 ALA ALA A . n A 1 563 LEU 563 606 606 LEU LEU A . n A 1 564 CYS 564 607 607 CYS CYS A . n A 1 565 ARG 565 608 608 ARG ARG A . n A 1 566 HIS 566 609 609 HIS HIS A . n A 1 567 LEU 567 610 610 LEU LEU A . n A 1 568 MET 568 611 611 MET MET A . n A 1 569 PRO 569 612 ? ? ? A . n A 1 570 ASP 570 613 ? ? ? A . n A 1 571 GLY 571 614 ? ? ? A . n A 1 572 SER 572 615 ? ? ? A . n A 1 573 LEU 573 616 ? ? ? A . n A 1 574 PRO 574 617 ? ? ? A . n A 1 575 GLU 575 618 ? ? ? A . n A 1 576 ALA 576 619 ? ? ? A . n A 1 577 GLN 577 620 ? ? ? A . n A 1 578 SER 578 621 ? ? ? A . n A 1 579 LEU 579 622 ? ? ? A . n A 1 580 TRP 580 623 ? ? ? A . n A 1 581 PRO 581 624 ? ? ? A . n A 1 582 ARG 582 625 ? ? ? A . n A 1 583 PRO 583 626 ? ? ? A . n A 1 584 LEU 584 627 ? ? ? A . n A 1 585 PHE 585 628 ? ? ? A . n A 1 586 SER 586 629 ? ? ? A . n B 1 1 GLY 1 44 ? ? ? B . n B 1 2 ALA 2 45 ? ? ? B . n B 1 3 PRO 3 46 ? ? ? B . n B 1 4 LEU 4 47 ? ? ? B . n B 1 5 SER 5 48 ? ? ? B . n B 1 6 ASP 6 49 ? ? ? B . n B 1 7 SER 7 50 ? ? ? B . n B 1 8 ARG 8 51 ? ? ? B . n B 1 9 VAL 9 52 ? ? ? B . n B 1 10 LEU 10 53 ? ? ? B . n B 1 11 TRP 11 54 ? ? ? B . n B 1 12 ALA 12 55 ? ? ? B . n B 1 13 PRO 13 56 ? ? ? B . n B 1 14 ALA 14 57 ? ? ? B . n B 1 15 GLU 15 58 ? ? ? B . n B 1 16 ALA 16 59 ? ? ? B . n B 1 17 HIS 17 60 ? ? ? B . n B 1 18 PRO 18 61 ? ? ? B . n B 1 19 LEU 19 62 ? ? ? B . n B 1 20 SER 20 63 ? ? ? B . n B 1 21 PRO 21 64 ? ? ? B . n B 1 22 GLN 22 65 ? ? ? B . n B 1 23 GLY 23 66 ? ? ? B . n B 1 24 HIS 24 67 ? ? ? B . n B 1 25 PRO 25 68 ? ? ? B . n B 1 26 ALA 26 69 ? ? ? B . n B 1 27 ARG 27 70 ? ? ? B . n B 1 28 LEU 28 71 ? ? ? B . n B 1 29 HIS 29 72 ? ? ? B . n B 1 30 ARG 30 73 ? ? ? B . n B 1 31 ILE 31 74 ? ? ? B . n B 1 32 VAL 32 75 ? ? ? B . n B 1 33 PRO 33 76 ? ? ? B . n B 1 34 ARG 34 77 ? ? ? B . n B 1 35 LEU 35 78 ? ? ? B . n B 1 36 ARG 36 79 ? ? ? B . n B 1 37 ASP 37 80 ? ? ? B . n B 1 38 VAL 38 81 ? ? ? B . n B 1 39 PHE 39 82 82 PHE PHE B . n B 1 40 GLY 40 83 83 GLY GLY B . n B 1 41 TRP 41 84 84 TRP TRP B . n B 1 42 GLY 42 85 85 GLY GLY B . n B 1 43 ASN 43 86 86 ASN ASN B . n B 1 44 LEU 44 87 87 LEU LEU B . n B 1 45 THR 45 88 88 THR THR B . n B 1 46 CYS 46 89 89 CYS CYS B . n B 1 47 PRO 47 90 90 PRO PRO B . n B 1 48 ILE 48 91 91 ILE ILE B . n B 1 49 CYS 49 92 92 CYS CYS B . n B 1 50 LYS 50 93 93 LYS LYS B . n B 1 51 GLY 51 94 94 GLY GLY B . n B 1 52 LEU 52 95 95 LEU LEU B . n B 1 53 PHE 53 96 96 PHE PHE B . n B 1 54 THR 54 97 97 THR THR B . n B 1 55 ALA 55 98 98 ALA ALA B . n B 1 56 ILE 56 99 99 ILE ILE B . n B 1 57 ASN 57 100 100 ASN ASN B . n B 1 58 LEU 58 101 101 LEU LEU B . n B 1 59 GLY 59 102 102 GLY GLY B . n B 1 60 LEU 60 103 103 LEU LEU B . n B 1 61 LYS 61 104 104 LYS LYS B . n B 1 62 LYS 62 105 105 LYS LYS B . n B 1 63 GLU 63 106 106 GLU GLU B . n B 1 64 PRO 64 107 107 PRO PRO B . n B 1 65 ASN 65 108 108 ASN ASN B . n B 1 66 VAL 66 109 109 VAL VAL B . n B 1 67 ALA 67 110 110 ALA ALA B . n B 1 68 ARG 68 111 111 ARG ARG B . n B 1 69 VAL 69 112 112 VAL VAL B . n B 1 70 GLY 70 113 113 GLY GLY B . n B 1 71 SER 71 114 114 SER SER B . n B 1 72 VAL 72 115 115 VAL VAL B . n B 1 73 ALA 73 116 116 ALA ALA B . n B 1 74 ILE 74 117 117 ILE ILE B . n B 1 75 LYS 75 118 118 LYS LYS B . n B 1 76 LEU 76 119 119 LEU LEU B . n B 1 77 CYS 77 120 120 CYS CYS B . n B 1 78 ASN 78 121 121 ASN ASN B . n B 1 79 LEU 79 122 122 LEU LEU B . n B 1 80 LEU 80 123 123 LEU LEU B . n B 1 81 LYS 81 124 124 LYS LYS B . n B 1 82 ILE 82 125 125 ILE ILE B . n B 1 83 ALA 83 126 126 ALA ALA B . n B 1 84 PRO 84 127 127 PRO PRO B . n B 1 85 PRO 85 128 128 PRO PRO B . n B 1 86 ALA 86 129 129 ALA ALA B . n B 1 87 VAL 87 130 130 VAL VAL B . n B 1 88 CYS 88 131 131 CYS CYS B . n B 1 89 GLN 89 132 132 GLN GLN B . n B 1 90 SER 90 133 133 SER SER B . n B 1 91 ILE 91 134 134 ILE ILE B . n B 1 92 VAL 92 135 135 VAL VAL B . n B 1 93 HIS 93 136 136 HIS HIS B . n B 1 94 LEU 94 137 137 LEU LEU B . n B 1 95 PHE 95 138 138 PHE PHE B . n B 1 96 GLU 96 139 139 GLU GLU B . n B 1 97 ASP 97 140 140 ASP ASP B . n B 1 98 ASP 98 141 141 ASP ASP B . n B 1 99 MET 99 142 142 MET MET B . n B 1 100 VAL 100 143 143 VAL VAL B . n B 1 101 GLU 101 144 144 GLU GLU B . n B 1 102 VAL 102 145 145 VAL VAL B . n B 1 103 TRP 103 146 146 TRP TRP B . n B 1 104 ARG 104 147 147 ARG ARG B . n B 1 105 ARG 105 148 148 ARG ARG B . n B 1 106 SER 106 149 149 SER SER B . n B 1 107 VAL 107 150 150 VAL VAL B . n B 1 108 LEU 108 151 151 LEU LEU B . n B 1 109 SER 109 152 152 SER SER B . n B 1 110 PRO 110 153 153 PRO PRO B . n B 1 111 SER 111 154 154 SER SER B . n B 1 112 GLU 112 155 155 GLU GLU B . n B 1 113 ALA 113 156 156 ALA ALA B . n B 1 114 CYS 114 157 157 CYS CYS B . n B 1 115 GLY 115 158 158 GLY GLY B . n B 1 116 LEU 116 159 159 LEU LEU B . n B 1 117 LEU 117 160 160 LEU LEU B . n B 1 118 LEU 118 161 161 LEU LEU B . n B 1 119 GLY 119 162 162 GLY GLY B . n B 1 120 SER 120 163 163 SER SER B . n B 1 121 THR 121 164 164 THR THR B . n B 1 122 CYS 122 165 165 CYS CYS B . n B 1 123 GLY 123 166 166 GLY GLY B . n B 1 124 HIS 124 167 167 HIS HIS B . n B 1 125 TRP 125 168 168 TRP TRP B . n B 1 126 ASP 126 169 169 ASP ASP B . n B 1 127 ILE 127 170 170 ILE ILE B . n B 1 128 PHE 128 171 171 PHE PHE B . n B 1 129 SER 129 172 172 SER SER B . n B 1 130 SER 130 173 173 SER SER B . n B 1 131 TRP 131 174 174 TRP TRP B . n B 1 132 ASN 132 175 175 ASN ASN B . n B 1 133 ILE 133 176 176 ILE ILE B . n B 1 134 SER 134 177 177 SER SER B . n B 1 135 LEU 135 178 178 LEU LEU B . n B 1 136 PRO 136 179 179 PRO PRO B . n B 1 137 THR 137 180 180 THR THR B . n B 1 138 VAL 138 181 181 VAL VAL B . n B 1 139 PRO 139 182 182 PRO PRO B . n B 1 140 LYS 140 183 183 LYS LYS B . n B 1 141 PRO 141 184 184 PRO PRO B . n B 1 142 PRO 142 185 185 PRO PRO B . n B 1 143 PRO 143 186 186 PRO PRO B . n B 1 144 LYS 144 187 187 LYS LYS B . n B 1 145 PRO 145 188 188 PRO PRO B . n B 1 146 PRO 146 189 189 PRO PRO B . n B 1 147 SER 147 190 190 SER SER B . n B 1 148 PRO 148 191 191 PRO PRO B . n B 1 149 PRO 149 192 192 PRO PRO B . n B 1 150 ALA 150 193 193 ALA ALA B . n B 1 151 PRO 151 194 194 PRO PRO B . n B 1 152 GLY 152 195 195 GLY GLY B . n B 1 153 ALA 153 196 196 ALA ALA B . n B 1 154 PRO 154 197 197 PRO PRO B . n B 1 155 VAL 155 198 198 VAL VAL B . n B 1 156 SER 156 199 199 SER SER B . n B 1 157 ARG 157 200 200 ARG ARG B . n B 1 158 ILE 158 201 201 ILE ILE B . n B 1 159 LEU 159 202 202 LEU LEU B . n B 1 160 PHE 160 203 203 PHE PHE B . n B 1 161 LEU 161 204 204 LEU LEU B . n B 1 162 THR 162 205 205 THR THR B . n B 1 163 ASP 163 206 206 ASP ASP B . n B 1 164 LEU 164 207 207 LEU LEU B . n B 1 165 HIS 165 208 208 HIS HIS B . n B 1 166 TRP 166 209 209 TRP TRP B . n B 1 167 ASP 167 210 210 ASP ASP B . n B 1 168 HIS 168 211 211 HIS HIS B . n B 1 169 ASP 169 212 212 ASP ASP B . n B 1 170 TYR 170 213 213 TYR TYR B . n B 1 171 LEU 171 214 214 LEU LEU B . n B 1 172 GLU 172 215 215 GLU GLU B . n B 1 173 GLY 173 216 216 GLY GLY B . n B 1 174 THR 174 217 217 THR THR B . n B 1 175 ASP 175 218 218 ASP ASP B . n B 1 176 PRO 176 219 219 PRO PRO B . n B 1 177 ASP 177 220 220 ASP ASP B . n B 1 178 CYS 178 221 221 CYS CYS B . n B 1 179 ALA 179 222 222 ALA ALA B . n B 1 180 ASP 180 223 223 ASP ASP B . n B 1 181 PRO 181 224 224 PRO PRO B . n B 1 182 LEU 182 225 225 LEU LEU B . n B 1 183 CYS 183 226 226 CYS CYS B . n B 1 184 CYS 184 227 227 CYS CYS B . n B 1 185 ARG 185 228 228 ARG ARG B . n B 1 186 ARG 186 229 229 ARG ARG B . n B 1 187 GLY 187 230 230 GLY GLY B . n B 1 188 SER 188 231 231 SER SER B . n B 1 189 GLY 189 232 232 GLY GLY B . n B 1 190 LEU 190 233 233 LEU LEU B . n B 1 191 PRO 191 234 234 PRO PRO B . n B 1 192 PRO 192 235 235 PRO PRO B . n B 1 193 ALA 193 236 236 ALA ALA B . n B 1 194 SER 194 237 237 SER SER B . n B 1 195 ARG 195 238 238 ARG ARG B . n B 1 196 PRO 196 239 239 PRO PRO B . n B 1 197 GLY 197 240 240 GLY GLY B . n B 1 198 ALA 198 241 241 ALA ALA B . n B 1 199 GLY 199 242 242 GLY GLY B . n B 1 200 TYR 200 243 243 TYR TYR B . n B 1 201 TRP 201 244 244 TRP TRP B . n B 1 202 GLY 202 245 245 GLY GLY B . n B 1 203 GLU 203 246 246 GLU GLU B . n B 1 204 TYR 204 247 247 TYR TYR B . n B 1 205 SER 205 248 248 SER SER B . n B 1 206 LYS 206 249 249 LYS LYS B . n B 1 207 CYS 207 250 250 CYS CYS B . n B 1 208 ASP 208 251 251 ASP ASP B . n B 1 209 LEU 209 252 252 LEU LEU B . n B 1 210 PRO 210 253 253 PRO PRO B . n B 1 211 LEU 211 254 254 LEU LEU B . n B 1 212 ARG 212 255 255 ARG ARG B . n B 1 213 THR 213 256 256 THR THR B . n B 1 214 LEU 214 257 257 LEU LEU B . n B 1 215 GLU 215 258 258 GLU GLU B . n B 1 216 SER 216 259 259 SER SER B . n B 1 217 LEU 217 260 260 LEU LEU B . n B 1 218 LEU 218 261 261 LEU LEU B . n B 1 219 SER 219 262 262 SER SER B . n B 1 220 GLY 220 263 263 GLY GLY B . n B 1 221 LEU 221 264 264 LEU LEU B . n B 1 222 GLY 222 265 265 GLY GLY B . n B 1 223 PRO 223 266 266 PRO PRO B . n B 1 224 ALA 224 267 267 ALA ALA B . n B 1 225 GLY 225 268 268 GLY GLY B . n B 1 226 PRO 226 269 269 PRO PRO B . n B 1 227 PHE 227 270 270 PHE PHE B . n B 1 228 ASP 228 271 271 ASP ASP B . n B 1 229 MET 229 272 272 MET MET B . n B 1 230 VAL 230 273 273 VAL VAL B . n B 1 231 TYR 231 274 274 TYR TYR B . n B 1 232 TRP 232 275 275 TRP TRP B . n B 1 233 THR 233 276 276 THR THR B . n B 1 234 GLY 234 277 277 GLY GLY B . n B 1 235 ASP 235 278 278 ASP ASP B . n B 1 236 ILE 236 279 279 ILE ILE B . n B 1 237 PRO 237 280 280 PRO PRO B . n B 1 238 ALA 238 281 281 ALA ALA B . n B 1 239 HIS 239 282 282 HIS HIS B . n B 1 240 ASP 240 283 283 ASP ASP B . n B 1 241 VAL 241 284 284 VAL VAL B . n B 1 242 TRP 242 285 285 TRP TRP B . n B 1 243 HIS 243 286 286 HIS HIS B . n B 1 244 GLN 244 287 287 GLN GLN B . n B 1 245 THR 245 288 288 THR THR B . n B 1 246 ARG 246 289 289 ARG ARG B . n B 1 247 GLN 247 290 290 GLN GLN B . n B 1 248 ASP 248 291 291 ASP ASP B . n B 1 249 GLN 249 292 292 GLN GLN B . n B 1 250 LEU 250 293 293 LEU LEU B . n B 1 251 ARG 251 294 294 ARG ARG B . n B 1 252 ALA 252 295 295 ALA ALA B . n B 1 253 LEU 253 296 296 LEU LEU B . n B 1 254 THR 254 297 297 THR THR B . n B 1 255 THR 255 298 298 THR THR B . n B 1 256 VAL 256 299 299 VAL VAL B . n B 1 257 THR 257 300 300 THR THR B . n B 1 258 ALA 258 301 301 ALA ALA B . n B 1 259 LEU 259 302 302 LEU LEU B . n B 1 260 VAL 260 303 303 VAL VAL B . n B 1 261 ARG 261 304 304 ARG ARG B . n B 1 262 LYS 262 305 305 LYS LYS B . n B 1 263 PHE 263 306 306 PHE PHE B . n B 1 264 LEU 264 307 307 LEU LEU B . n B 1 265 GLY 265 308 308 GLY GLY B . n B 1 266 PRO 266 309 309 PRO PRO B . n B 1 267 VAL 267 310 310 VAL VAL B . n B 1 268 PRO 268 311 311 PRO PRO B . n B 1 269 VAL 269 312 312 VAL VAL B . n B 1 270 TYR 270 313 313 TYR TYR B . n B 1 271 PRO 271 314 314 PRO PRO B . n B 1 272 ALA 272 315 315 ALA ALA B . n B 1 273 VAL 273 316 316 VAL VAL B . n B 1 274 GLY 274 317 317 GLY GLY B . n B 1 275 ASN 275 318 318 ASN ASN B . n B 1 276 HIS 276 319 319 HIS HIS B . n B 1 277 GLU 277 320 320 GLU GLU B . n B 1 278 SER 278 321 321 SER SER B . n B 1 279 THR 279 322 322 THR THR B . n B 1 280 PRO 280 323 323 PRO PRO B . n B 1 281 VAL 281 324 324 VAL VAL B . n B 1 282 ASN 282 325 325 ASN ASN B . n B 1 283 SER 283 326 326 SER SER B . n B 1 284 PHE 284 327 327 PHE PHE B . n B 1 285 PRO 285 328 328 PRO PRO B . n B 1 286 PRO 286 329 329 PRO PRO B . n B 1 287 PRO 287 330 330 PRO PRO B . n B 1 288 PHE 288 331 331 PHE PHE B . n B 1 289 ILE 289 332 332 ILE ILE B . n B 1 290 GLU 290 333 333 GLU GLU B . n B 1 291 GLY 291 334 334 GLY GLY B . n B 1 292 ASN 292 335 335 ASN ASN B . n B 1 293 HIS 293 336 336 HIS HIS B . n B 1 294 SER 294 337 337 SER SER B . n B 1 295 SER 295 338 338 SER SER B . n B 1 296 ARG 296 339 339 ARG ARG B . n B 1 297 TRP 297 340 340 TRP TRP B . n B 1 298 LEU 298 341 341 LEU LEU B . n B 1 299 TYR 299 342 342 TYR TYR B . n B 1 300 GLU 300 343 343 GLU GLU B . n B 1 301 ALA 301 344 344 ALA ALA B . n B 1 302 MET 302 345 345 MET MET B . n B 1 303 ALA 303 346 346 ALA ALA B . n B 1 304 LYS 304 347 347 LYS LYS B . n B 1 305 ALA 305 348 348 ALA ALA B . n B 1 306 TRP 306 349 349 TRP TRP B . n B 1 307 GLU 307 350 350 GLU GLU B . n B 1 308 PRO 308 351 351 PRO PRO B . n B 1 309 TRP 309 352 352 TRP TRP B . n B 1 310 LEU 310 353 353 LEU LEU B . n B 1 311 PRO 311 354 354 PRO PRO B . n B 1 312 ALA 312 355 355 ALA ALA B . n B 1 313 GLU 313 356 356 GLU GLU B . n B 1 314 ALA 314 357 357 ALA ALA B . n B 1 315 LEU 315 358 358 LEU LEU B . n B 1 316 ARG 316 359 359 ARG ARG B . n B 1 317 THR 317 360 360 THR THR B . n B 1 318 LEU 318 361 361 LEU LEU B . n B 1 319 ARG 319 362 362 ARG ARG B . n B 1 320 ILE 320 363 363 ILE ILE B . n B 1 321 GLY 321 364 364 GLY GLY B . n B 1 322 GLY 322 365 365 GLY GLY B . n B 1 323 PHE 323 366 366 PHE PHE B . n B 1 324 TYR 324 367 367 TYR TYR B . n B 1 325 ALA 325 368 368 ALA ALA B . n B 1 326 LEU 326 369 369 LEU LEU B . n B 1 327 SER 327 370 370 SER SER B . n B 1 328 PRO 328 371 371 PRO PRO B . n B 1 329 TYR 329 372 372 TYR TYR B . n B 1 330 PRO 330 373 373 PRO PRO B . n B 1 331 GLY 331 374 374 GLY GLY B . n B 1 332 LEU 332 375 375 LEU LEU B . n B 1 333 ARG 333 376 376 ARG ARG B . n B 1 334 LEU 334 377 377 LEU LEU B . n B 1 335 ILE 335 378 378 ILE ILE B . n B 1 336 SER 336 379 379 SER SER B . n B 1 337 LEU 337 380 380 LEU LEU B . n B 1 338 ASN 338 381 381 ASN ASN B . n B 1 339 MET 339 382 382 MET MET B . n B 1 340 ASN 340 383 383 ASN ASN B . n B 1 341 PHE 341 384 384 PHE PHE B . n B 1 342 CYS 342 385 385 CYS CYS B . n B 1 343 SER 343 386 386 SER SER B . n B 1 344 ARG 344 387 387 ARG ARG B . n B 1 345 GLU 345 388 388 GLU GLU B . n B 1 346 ASN 346 389 389 ASN ASN B . n B 1 347 PHE 347 390 390 PHE PHE B . n B 1 348 TRP 348 391 391 TRP TRP B . n B 1 349 LEU 349 392 392 LEU LEU B . n B 1 350 LEU 350 393 393 LEU LEU B . n B 1 351 ILE 351 394 394 ILE ILE B . n B 1 352 ASN 352 395 395 ASN ASN B . n B 1 353 SER 353 396 396 SER SER B . n B 1 354 THR 354 397 397 THR THR B . n B 1 355 ASP 355 398 398 ASP ASP B . n B 1 356 PRO 356 399 399 PRO PRO B . n B 1 357 ALA 357 400 400 ALA ALA B . n B 1 358 GLY 358 401 401 GLY GLY B . n B 1 359 GLN 359 402 402 GLN GLN B . n B 1 360 LEU 360 403 403 LEU LEU B . n B 1 361 GLN 361 404 404 GLN GLN B . n B 1 362 TRP 362 405 405 TRP TRP B . n B 1 363 LEU 363 406 406 LEU LEU B . n B 1 364 VAL 364 407 407 VAL VAL B . n B 1 365 GLY 365 408 408 GLY GLY B . n B 1 366 GLU 366 409 409 GLU GLU B . n B 1 367 LEU 367 410 410 LEU LEU B . n B 1 368 GLN 368 411 411 GLN GLN B . n B 1 369 ALA 369 412 412 ALA ALA B . n B 1 370 ALA 370 413 413 ALA ALA B . n B 1 371 GLU 371 414 414 GLU GLU B . n B 1 372 ASP 372 415 415 ASP ASP B . n B 1 373 ARG 373 416 416 ARG ARG B . n B 1 374 GLY 374 417 417 GLY GLY B . n B 1 375 ASP 375 418 418 ASP ASP B . n B 1 376 LYS 376 419 419 LYS LYS B . n B 1 377 VAL 377 420 420 VAL VAL B . n B 1 378 HIS 378 421 421 HIS HIS B . n B 1 379 ILE 379 422 422 ILE ILE B . n B 1 380 ILE 380 423 423 ILE ILE B . n B 1 381 GLY 381 424 424 GLY GLY B . n B 1 382 HIS 382 425 425 HIS HIS B . n B 1 383 ILE 383 426 426 ILE ILE B . n B 1 384 PRO 384 427 427 PRO PRO B . n B 1 385 PRO 385 428 428 PRO PRO B . n B 1 386 GLY 386 429 429 GLY GLY B . n B 1 387 HIS 387 430 430 HIS HIS B . n B 1 388 CYS 388 431 431 CYS CYS B . n B 1 389 LEU 389 432 432 LEU LEU B . n B 1 390 LYS 390 433 433 LYS LYS B . n B 1 391 SER 391 434 434 SER SER B . n B 1 392 TRP 392 435 435 TRP TRP B . n B 1 393 SER 393 436 436 SER SER B . n B 1 394 TRP 394 437 437 TRP TRP B . n B 1 395 ASN 395 438 438 ASN ASN B . n B 1 396 TYR 396 439 439 TYR TYR B . n B 1 397 TYR 397 440 440 TYR TYR B . n B 1 398 ARG 398 441 441 ARG ARG B . n B 1 399 ILE 399 442 442 ILE ILE B . n B 1 400 VAL 400 443 443 VAL VAL B . n B 1 401 ALA 401 444 444 ALA ALA B . n B 1 402 ARG 402 445 445 ARG ARG B . n B 1 403 TYR 403 446 446 TYR TYR B . n B 1 404 GLU 404 447 447 GLU GLU B . n B 1 405 ASN 405 448 448 ASN ASN B . n B 1 406 THR 406 449 449 THR THR B . n B 1 407 LEU 407 450 450 LEU LEU B . n B 1 408 ALA 408 451 451 ALA ALA B . n B 1 409 ALA 409 452 452 ALA ALA B . n B 1 410 GLN 410 453 453 GLN GLN B . n B 1 411 PHE 411 454 454 PHE PHE B . n B 1 412 PHE 412 455 455 PHE PHE B . n B 1 413 GLY 413 456 456 GLY GLY B . n B 1 414 HIS 414 457 457 HIS HIS B . n B 1 415 THR 415 458 458 THR THR B . n B 1 416 HIS 416 459 459 HIS HIS B . n B 1 417 VAL 417 460 460 VAL VAL B . n B 1 418 ASP 418 461 461 ASP ASP B . n B 1 419 GLU 419 462 462 GLU GLU B . n B 1 420 PHE 420 463 463 PHE PHE B . n B 1 421 GLU 421 464 464 GLU GLU B . n B 1 422 VAL 422 465 465 VAL VAL B . n B 1 423 PHE 423 466 466 PHE PHE B . n B 1 424 TYR 424 467 467 TYR TYR B . n B 1 425 ASP 425 468 468 ASP ASP B . n B 1 426 GLU 426 469 469 GLU GLU B . n B 1 427 GLU 427 470 470 GLU GLU B . n B 1 428 THR 428 471 471 THR THR B . n B 1 429 LEU 429 472 472 LEU LEU B . n B 1 430 SER 430 473 473 SER SER B . n B 1 431 ARG 431 474 474 ARG ARG B . n B 1 432 PRO 432 475 475 PRO PRO B . n B 1 433 LEU 433 476 476 LEU LEU B . n B 1 434 ALA 434 477 477 ALA ALA B . n B 1 435 VAL 435 478 478 VAL VAL B . n B 1 436 ALA 436 479 479 ALA ALA B . n B 1 437 PHE 437 480 480 PHE PHE B . n B 1 438 LEU 438 481 481 LEU LEU B . n B 1 439 ALA 439 482 482 ALA ALA B . n B 1 440 PRO 440 483 483 PRO PRO B . n B 1 441 SER 441 484 484 SER SER B . n B 1 442 ALA 442 485 485 ALA ALA B . n B 1 443 THR 443 486 486 THR THR B . n B 1 444 THR 444 487 487 THR THR B . n B 1 445 TYR 445 488 488 TYR TYR B . n B 1 446 ILE 446 489 489 ILE ILE B . n B 1 447 GLY 447 490 490 GLY GLY B . n B 1 448 LEU 448 491 491 LEU LEU B . n B 1 449 ASN 449 492 492 ASN ASN B . n B 1 450 PRO 450 493 493 PRO PRO B . n B 1 451 GLY 451 494 494 GLY GLY B . n B 1 452 TYR 452 495 495 TYR TYR B . n B 1 453 ARG 453 496 496 ARG ARG B . n B 1 454 VAL 454 497 497 VAL VAL B . n B 1 455 TYR 455 498 498 TYR TYR B . n B 1 456 GLN 456 499 499 GLN GLN B . n B 1 457 ILE 457 500 500 ILE ILE B . n B 1 458 ASP 458 501 501 ASP ASP B . n B 1 459 GLY 459 502 502 GLY GLY B . n B 1 460 ASN 460 503 503 ASN ASN B . n B 1 461 TYR 461 504 504 TYR TYR B . n B 1 462 SER 462 505 505 SER SER B . n B 1 463 GLY 463 506 506 GLY GLY B . n B 1 464 SER 464 507 507 SER SER B . n B 1 465 SER 465 508 508 SER SER B . n B 1 466 HIS 466 509 509 HIS HIS B . n B 1 467 VAL 467 510 510 VAL VAL B . n B 1 468 VAL 468 511 511 VAL VAL B . n B 1 469 LEU 469 512 512 LEU LEU B . n B 1 470 ASP 470 513 513 ASP ASP B . n B 1 471 HIS 471 514 514 HIS HIS B . n B 1 472 GLU 472 515 515 GLU GLU B . n B 1 473 THR 473 516 516 THR THR B . n B 1 474 TYR 474 517 517 TYR TYR B . n B 1 475 ILE 475 518 518 ILE ILE B . n B 1 476 LEU 476 519 519 LEU LEU B . n B 1 477 ASN 477 520 520 ASN ASN B . n B 1 478 LEU 478 521 521 LEU LEU B . n B 1 479 THR 479 522 522 THR THR B . n B 1 480 GLN 480 523 523 GLN GLN B . n B 1 481 ALA 481 524 524 ALA ALA B . n B 1 482 ASN 482 525 525 ASN ASN B . n B 1 483 ILE 483 526 526 ILE ILE B . n B 1 484 PRO 484 527 527 PRO PRO B . n B 1 485 GLY 485 528 528 GLY GLY B . n B 1 486 ALA 486 529 529 ALA ALA B . n B 1 487 ILE 487 530 530 ILE ILE B . n B 1 488 PRO 488 531 531 PRO PRO B . n B 1 489 HIS 489 532 532 HIS HIS B . n B 1 490 TRP 490 533 533 TRP TRP B . n B 1 491 GLN 491 534 534 GLN GLN B . n B 1 492 LEU 492 535 535 LEU LEU B . n B 1 493 LEU 493 536 536 LEU LEU B . n B 1 494 TYR 494 537 537 TYR TYR B . n B 1 495 ARG 495 538 538 ARG ARG B . n B 1 496 ALA 496 539 539 ALA ALA B . n B 1 497 ARG 497 540 540 ARG ARG B . n B 1 498 GLU 498 541 541 GLU GLU B . n B 1 499 THR 499 542 542 THR THR B . n B 1 500 TYR 500 543 543 TYR TYR B . n B 1 501 GLY 501 544 544 GLY GLY B . n B 1 502 LEU 502 545 545 LEU LEU B . n B 1 503 PRO 503 546 546 PRO PRO B . n B 1 504 ASN 504 547 547 ASN ASN B . n B 1 505 THR 505 548 548 THR THR B . n B 1 506 LEU 506 549 549 LEU LEU B . n B 1 507 PRO 507 550 550 PRO PRO B . n B 1 508 THR 508 551 551 THR THR B . n B 1 509 ALA 509 552 552 ALA ALA B . n B 1 510 TRP 510 553 553 TRP TRP B . n B 1 511 HIS 511 554 554 HIS HIS B . n B 1 512 ASN 512 555 555 ASN ASN B . n B 1 513 LEU 513 556 556 LEU LEU B . n B 1 514 VAL 514 557 557 VAL VAL B . n B 1 515 TYR 515 558 558 TYR TYR B . n B 1 516 ARG 516 559 559 ARG ARG B . n B 1 517 MET 517 560 560 MET MET B . n B 1 518 ARG 518 561 561 ARG ARG B . n B 1 519 GLY 519 562 562 GLY GLY B . n B 1 520 ASP 520 563 563 ASP ASP B . n B 1 521 MET 521 564 564 MET MET B . n B 1 522 GLN 522 565 565 GLN GLN B . n B 1 523 LEU 523 566 566 LEU LEU B . n B 1 524 PHE 524 567 567 PHE PHE B . n B 1 525 GLN 525 568 568 GLN GLN B . n B 1 526 THR 526 569 569 THR THR B . n B 1 527 PHE 527 570 570 PHE PHE B . n B 1 528 TRP 528 571 571 TRP TRP B . n B 1 529 PHE 529 572 572 PHE PHE B . n B 1 530 LEU 530 573 573 LEU LEU B . n B 1 531 TYR 531 574 574 TYR TYR B . n B 1 532 HIS 532 575 575 HIS HIS B . n B 1 533 LYS 533 576 576 LYS LYS B . n B 1 534 GLY 534 577 577 GLY GLY B . n B 1 535 HIS 535 578 578 HIS HIS B . n B 1 536 PRO 536 579 579 PRO PRO B . n B 1 537 PRO 537 580 580 PRO PRO B . n B 1 538 SER 538 581 581 SER SER B . n B 1 539 GLU 539 582 582 GLU GLU B . n B 1 540 PRO 540 583 583 PRO PRO B . n B 1 541 CYS 541 584 584 CYS CYS B . n B 1 542 GLY 542 585 585 GLY GLY B . n B 1 543 THR 543 586 586 THR THR B . n B 1 544 PRO 544 587 587 PRO PRO B . n B 1 545 CYS 545 588 588 CYS CYS B . n B 1 546 ARG 546 589 589 ARG ARG B . n B 1 547 LEU 547 590 590 LEU LEU B . n B 1 548 ALA 548 591 591 ALA ALA B . n B 1 549 THR 549 592 592 THR THR B . n B 1 550 LEU 550 593 593 LEU LEU B . n B 1 551 CYS 551 594 594 CYS CYS B . n B 1 552 ALA 552 595 595 ALA ALA B . n B 1 553 GLN 553 596 596 GLN GLN B . n B 1 554 LEU 554 597 597 LEU LEU B . n B 1 555 SER 555 598 598 SER SER B . n B 1 556 ALA 556 599 599 ALA ALA B . n B 1 557 ARG 557 600 600 ARG ARG B . n B 1 558 ALA 558 601 601 ALA ALA B . n B 1 559 ASP 559 602 602 ASP ASP B . n B 1 560 SER 560 603 603 SER SER B . n B 1 561 PRO 561 604 604 PRO PRO B . n B 1 562 ALA 562 605 605 ALA ALA B . n B 1 563 LEU 563 606 606 LEU LEU B . n B 1 564 CYS 564 607 607 CYS CYS B . n B 1 565 ARG 565 608 608 ARG ARG B . n B 1 566 HIS 566 609 609 HIS HIS B . n B 1 567 LEU 567 610 610 LEU LEU B . n B 1 568 MET 568 611 611 MET MET B . n B 1 569 PRO 569 612 ? ? ? B . n B 1 570 ASP 570 613 ? ? ? B . n B 1 571 GLY 571 614 ? ? ? B . n B 1 572 SER 572 615 ? ? ? B . n B 1 573 LEU 573 616 ? ? ? B . n B 1 574 PRO 574 617 ? ? ? B . n B 1 575 GLU 575 618 ? ? ? B . n B 1 576 ALA 576 619 ? ? ? B . n B 1 577 GLN 577 620 ? ? ? B . n B 1 578 SER 578 621 ? ? ? B . n B 1 579 LEU 579 622 ? ? ? B . n B 1 580 TRP 580 623 ? ? ? B . n B 1 581 PRO 581 624 ? ? ? B . n B 1 582 ARG 582 625 ? ? ? B . n B 1 583 PRO 583 626 ? ? ? B . n B 1 584 LEU 584 627 ? ? ? B . n B 1 585 PHE 585 628 ? ? ? B . n B 1 586 SER 586 629 ? ? ? B . 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 C 2 ZN 1 701 701 ZN ZN A . D 2 ZN 1 702 702 ZN ZN A . E 3 ACT 1 703 703 ACT ACT A . F 4 NAG 1 704 704 NAG NAG A . G 4 NAG 1 705 705 NAG NAG A . H 4 NAG 1 706 706 NAG NAG A . I 4 NAG 2 707 707 NAG NAG A . J 4 NAG 1 708 709 NAG NAG A . K 4 NAG 2 709 710 NAG NAG A . L 4 NAG 1 710 711 NAG NAG A . M 4 NAG 2 711 712 NAG NAG A . N 4 NAG 1 712 713 NAG NAG A . O 2 ZN 1 701 701 ZN ZN B . P 2 ZN 1 702 702 ZN ZN B . Q 3 ACT 1 703 703 ACT ACT B . R 4 NAG 1 704 704 NAG NAG B . S 4 NAG 1 705 705 NAG NAG B . T 4 NAG 1 706 706 NAG NAG B . U 4 NAG 2 707 707 NAG NAG B . V 5 MAN 3 708 708 MAN MAN B . W 4 NAG 1 709 709 NAG NAG B . X 4 NAG 2 710 710 NAG NAG B . Y 5 MAN 3 711 711 MAN MAN B . Z 4 NAG 1 712 712 NAG NAG B . AA 4 NAG 2 713 713 NAG NAG B . BA 4 NAG 1 714 714 NAG NAG B . CA 4 NAG 2 715 715 NAG NAG B . # _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 dimeric _pdbx_struct_assembly.oligomeric_count 2 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V,W,X,Y,Z,AA,BA,CA # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 9310 ? 1 MORE -127 ? 1 'SSA (A^2)' 43430 ? # _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 OD2 ? A ASP 163 ? A ASP 206 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 NE2 ? A HIS 165 ? A HIS 208 ? 1_555 119.1 ? 2 OD2 ? A ASP 163 ? A ASP 206 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 97.5 ? 3 NE2 ? A HIS 165 ? A HIS 208 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 89.6 ? 4 OD2 ? A ASP 163 ? A ASP 206 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 NE2 ? A HIS 416 ? A HIS 459 ? 1_555 81.5 ? 5 NE2 ? A HIS 165 ? A HIS 208 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 NE2 ? A HIS 416 ? A HIS 459 ? 1_555 100.6 ? 6 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 NE2 ? A HIS 416 ? A HIS 459 ? 1_555 168.9 ? 7 OD2 ? A ASP 163 ? A ASP 206 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 105.7 ? 8 NE2 ? A HIS 165 ? A HIS 208 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 135.1 ? 9 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 82.8 ? 10 NE2 ? A HIS 416 ? A HIS 459 ? 1_555 ZN ? C ZN . ? A ZN 701 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 86.8 ? 11 OD1 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 56.4 ? 12 OD1 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 OD1 ? A ASN 275 ? A ASN 318 ? 1_555 69.1 ? 13 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 OD1 ? A ASN 275 ? A ASN 318 ? 1_555 104.6 ? 14 OD1 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 NE2 ? A HIS 382 ? A HIS 425 ? 1_555 87.2 ? 15 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 NE2 ? A HIS 382 ? A HIS 425 ? 1_555 122.9 ? 16 OD1 ? A ASN 275 ? A ASN 318 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 NE2 ? A HIS 382 ? A HIS 425 ? 1_555 99.6 ? 17 OD1 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 ND1 ? A HIS 414 ? A HIS 457 ? 1_555 154.0 ? 18 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 ND1 ? A HIS 414 ? A HIS 457 ? 1_555 149.2 ? 19 OD1 ? A ASN 275 ? A ASN 318 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 ND1 ? A HIS 414 ? A HIS 457 ? 1_555 92.4 ? 20 NE2 ? A HIS 382 ? A HIS 425 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 ND1 ? A HIS 414 ? A HIS 457 ? 1_555 77.7 ? 21 OD1 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 128.3 ? 22 OD2 ? A ASP 235 ? A ASP 278 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 74.7 ? 23 OD1 ? A ASN 275 ? A ASN 318 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 113.0 ? 24 NE2 ? A HIS 382 ? A HIS 425 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 137.9 ? 25 ND1 ? A HIS 414 ? A HIS 457 ? 1_555 ZN ? D ZN . ? A ZN 702 ? 1_555 O ? E ACT . ? A ACT 703 ? 1_555 75.1 ? 26 OD2 ? B ASP 163 ? B ASP 206 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 NE2 ? B HIS 165 ? B HIS 208 ? 1_555 114.5 ? 27 OD2 ? B ASP 163 ? B ASP 206 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 OD2 ? B ASP 235 ? B ASP 278 ? 1_555 83.2 ? 28 NE2 ? B HIS 165 ? B HIS 208 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 OD2 ? B ASP 235 ? B ASP 278 ? 1_555 85.9 ? 29 OD2 ? B ASP 163 ? B ASP 206 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 NE2 ? B HIS 416 ? B HIS 459 ? 1_555 102.9 ? 30 NE2 ? B HIS 165 ? B HIS 208 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 NE2 ? B HIS 416 ? B HIS 459 ? 1_555 100.2 ? 31 OD2 ? B ASP 235 ? B ASP 278 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 NE2 ? B HIS 416 ? B HIS 459 ? 1_555 168.4 ? 32 OD2 ? B ASP 163 ? B ASP 206 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 OXT ? Q ACT . ? B ACT 703 ? 1_555 118.6 ? 33 NE2 ? B HIS 165 ? B HIS 208 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 OXT ? Q ACT . ? B ACT 703 ? 1_555 109.3 ? 34 OD2 ? B ASP 235 ? B ASP 278 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 OXT ? Q ACT . ? B ACT 703 ? 1_555 59.1 ? 35 NE2 ? B HIS 416 ? B HIS 459 ? 1_555 ZN ? O ZN . ? B ZN 701 ? 1_555 OXT ? Q ACT . ? B ACT 703 ? 1_555 109.4 ? 36 OD2 ? B ASP 235 ? B ASP 278 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 OD1 ? B ASN 275 ? B ASN 318 ? 1_555 112.6 ? 37 OD2 ? B ASP 235 ? B ASP 278 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 NE2 ? B HIS 382 ? B HIS 425 ? 1_555 108.4 ? 38 OD1 ? B ASN 275 ? B ASN 318 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 NE2 ? B HIS 382 ? B HIS 425 ? 1_555 80.4 ? 39 OD2 ? B ASP 235 ? B ASP 278 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 ND1 ? B HIS 414 ? B HIS 457 ? 1_555 165.0 ? 40 OD1 ? B ASN 275 ? B ASN 318 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 ND1 ? B HIS 414 ? B HIS 457 ? 1_555 81.7 ? 41 NE2 ? B HIS 382 ? B HIS 425 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 ND1 ? B HIS 414 ? B HIS 457 ? 1_555 77.8 ? 42 OD2 ? B ASP 235 ? B ASP 278 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 OXT ? Q ACT . ? B ACT 703 ? 1_555 67.2 ? 43 OD1 ? B ASN 275 ? B ASN 318 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 OXT ? Q ACT . ? B ACT 703 ? 1_555 111.5 ? 44 NE2 ? B HIS 382 ? B HIS 425 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 OXT ? Q ACT . ? B ACT 703 ? 1_555 168.1 ? 45 ND1 ? B HIS 414 ? B HIS 457 ? 1_555 ZN ? P ZN . ? B ZN 702 ? 1_555 OXT ? Q ACT . ? B ACT 703 ? 1_555 103.9 ? # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2016-07-06 2 'Structure model' 1 1 2016-07-13 3 'Structure model' 1 2 2016-08-17 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Database references' 2 3 'Structure model' 'Database references' # loop_ _software.citation_id _software.classification _software.compiler_name _software.compiler_version _software.contact_author _software.contact_author_email _software.date _software.description _software.dependencies _software.hardware _software.language _software.location _software.mods _software.name _software.os _software.os_version _software.type _software.version _software.pdbx_ordinal ? refinement ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? 1.10.1_2155 1 ? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? HKL-2000 ? ? ? . 2 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? Aimless ? ? ? 0.5.23 3 ? phasing ? ? ? ? ? ? ? ? ? ? ? PHENIX ? ? ? . 4 ? 'data extraction' ? ? ? ? ? ? ? ? ? ? ? PDB_EXTRACT ? ? ? 3.20 5 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 OD1 B ASP 210 ? ? NH1 B ARG 228 ? ? 2.00 2 1 O B TYR 243 ? ? NH1 B ARG 255 ? ? 2.05 3 1 OH A TYR 247 ? ? OD1 A ASN 492 ? ? 2.05 4 1 O A TYR 243 ? ? NH1 A ARG 255 ? ? 2.06 5 1 OD2 B ASP 278 ? ? OXT B ACT 703 ? ? 2.07 6 1 O A VAL 511 ? ? OG1 A THR 548 ? ? 2.08 7 1 O4 A NAG 710 ? ? O5 A NAG 711 ? ? 2.09 8 1 OH B TYR 247 ? ? OD1 B ASN 492 ? ? 2.19 # loop_ _pdbx_validate_rmsd_angle.id _pdbx_validate_rmsd_angle.PDB_model_num _pdbx_validate_rmsd_angle.auth_atom_id_1 _pdbx_validate_rmsd_angle.auth_asym_id_1 _pdbx_validate_rmsd_angle.auth_comp_id_1 _pdbx_validate_rmsd_angle.auth_seq_id_1 _pdbx_validate_rmsd_angle.PDB_ins_code_1 _pdbx_validate_rmsd_angle.label_alt_id_1 _pdbx_validate_rmsd_angle.auth_atom_id_2 _pdbx_validate_rmsd_angle.auth_asym_id_2 _pdbx_validate_rmsd_angle.auth_comp_id_2 _pdbx_validate_rmsd_angle.auth_seq_id_2 _pdbx_validate_rmsd_angle.PDB_ins_code_2 _pdbx_validate_rmsd_angle.label_alt_id_2 _pdbx_validate_rmsd_angle.auth_atom_id_3 _pdbx_validate_rmsd_angle.auth_asym_id_3 _pdbx_validate_rmsd_angle.auth_comp_id_3 _pdbx_validate_rmsd_angle.auth_seq_id_3 _pdbx_validate_rmsd_angle.PDB_ins_code_3 _pdbx_validate_rmsd_angle.label_alt_id_3 _pdbx_validate_rmsd_angle.angle_value _pdbx_validate_rmsd_angle.angle_target_value _pdbx_validate_rmsd_angle.angle_deviation _pdbx_validate_rmsd_angle.angle_standard_deviation _pdbx_validate_rmsd_angle.linker_flag 1 1 C A SER 152 ? ? N A PRO 153 ? ? CA A PRO 153 ? ? 104.81 119.30 -14.49 1.50 Y 2 1 C A SER 152 ? ? N A PRO 153 ? ? CD A PRO 153 ? ? 141.72 128.40 13.32 2.10 Y 3 1 O B SER 149 ? ? C B SER 149 ? ? N B VAL 150 ? ? 132.99 122.70 10.29 1.60 Y 4 1 C B GLY 265 ? ? N B PRO 266 ? ? CA B PRO 266 ? ? 128.56 119.30 9.26 1.50 Y # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 LYS A 124 ? ? 54.98 -149.09 2 1 ILE A 125 ? ? 38.38 74.59 3 1 PRO A 127 ? ? -49.47 151.08 4 1 SER A 149 ? ? -124.59 -77.32 5 1 GLU A 155 ? ? 63.68 -122.57 6 1 SER A 163 ? ? 56.42 -105.54 7 1 SER A 177 ? ? 60.13 77.00 8 1 HIS A 208 ? ? 53.50 70.13 9 1 HIS A 211 ? ? 74.81 -21.55 10 1 ASP A 223 ? ? 169.37 147.55 11 1 ALA A 236 ? ? 55.48 -124.10 12 1 LYS A 249 ? ? 48.92 -131.96 13 1 CYS A 250 ? ? 59.06 87.21 14 1 ASP A 251 ? ? -68.67 -174.25 15 1 ASN A 325 ? ? 83.01 -0.16 16 1 ALA A 346 ? ? 73.21 -19.32 17 1 ILE A 394 ? ? -56.93 -70.22 18 1 ASP A 398 ? ? 32.39 62.78 19 1 ALA A 400 ? ? 54.63 18.27 20 1 ARG A 416 ? ? 79.45 -15.06 21 1 LEU A 432 ? ? -60.94 -89.15 22 1 LYS A 433 ? ? -146.63 -67.14 23 1 HIS A 457 ? ? 82.72 -37.66 24 1 HIS A 459 ? ? 67.85 -3.08 25 1 GLU A 470 ? ? -84.21 -72.25 26 1 ALA A 477 ? ? 176.27 161.93 27 1 ILE A 489 ? ? 63.09 65.06 28 1 TYR A 504 ? ? 176.88 164.12 29 1 LEU A 536 ? ? 52.88 -112.26 30 1 ALA A 539 ? ? -58.58 -71.18 31 1 CYS A 584 ? ? 60.32 73.06 32 1 ASP A 602 ? ? 62.04 -130.20 33 1 LYS B 124 ? ? 56.06 -149.83 34 1 ILE B 125 ? ? 37.39 76.69 35 1 PRO B 127 ? ? -48.92 150.48 36 1 SER B 149 ? ? -124.86 -75.55 37 1 GLU B 155 ? ? 59.38 -126.48 38 1 SER B 163 ? ? 56.27 -105.92 39 1 SER B 177 ? ? 60.04 76.21 40 1 LYS B 187 ? ? -177.27 138.94 41 1 HIS B 208 ? ? 53.10 70.78 42 1 HIS B 211 ? ? 74.88 -22.48 43 1 ASP B 223 ? ? 169.99 146.98 44 1 ALA B 236 ? ? 56.07 -121.33 45 1 GLU B 320 ? ? -142.17 -63.84 46 1 ASN B 325 ? ? 84.43 -0.25 47 1 ALA B 346 ? ? 74.78 -19.35 48 1 ASP B 398 ? ? 33.51 65.19 49 1 ALA B 400 ? ? 54.73 19.43 50 1 LEU B 432 ? ? -61.99 -88.33 51 1 LYS B 433 ? ? -145.71 -67.55 52 1 HIS B 457 ? ? 81.83 -37.80 53 1 HIS B 459 ? ? 77.35 -1.99 54 1 GLU B 470 ? ? -84.58 -71.50 55 1 ALA B 477 ? ? 177.57 161.66 56 1 ILE B 489 ? ? 64.24 64.92 57 1 TYR B 504 ? ? 176.64 166.36 58 1 LEU B 536 ? ? 52.63 -112.03 59 1 CYS B 584 ? ? 65.61 -123.03 # 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 GLY 44 ? A GLY 1 2 1 Y 1 A ALA 45 ? A ALA 2 3 1 Y 1 A PRO 46 ? A PRO 3 4 1 Y 1 A LEU 47 ? A LEU 4 5 1 Y 1 A SER 48 ? A SER 5 6 1 Y 1 A ASP 49 ? A ASP 6 7 1 Y 1 A SER 50 ? A SER 7 8 1 Y 1 A ARG 51 ? A ARG 8 9 1 Y 1 A VAL 52 ? A VAL 9 10 1 Y 1 A LEU 53 ? A LEU 10 11 1 Y 1 A TRP 54 ? A TRP 11 12 1 Y 1 A ALA 55 ? A ALA 12 13 1 Y 1 A PRO 56 ? A PRO 13 14 1 Y 1 A ALA 57 ? A ALA 14 15 1 Y 1 A GLU 58 ? A GLU 15 16 1 Y 1 A ALA 59 ? A ALA 16 17 1 Y 1 A HIS 60 ? A HIS 17 18 1 Y 1 A PRO 61 ? A PRO 18 19 1 Y 1 A LEU 62 ? A LEU 19 20 1 Y 1 A SER 63 ? A SER 20 21 1 Y 1 A PRO 64 ? A PRO 21 22 1 Y 1 A GLN 65 ? A GLN 22 23 1 Y 1 A GLY 66 ? A GLY 23 24 1 Y 1 A HIS 67 ? A HIS 24 25 1 Y 1 A PRO 68 ? A PRO 25 26 1 Y 1 A ALA 69 ? A ALA 26 27 1 Y 1 A ARG 70 ? A ARG 27 28 1 Y 1 A LEU 71 ? A LEU 28 29 1 Y 1 A HIS 72 ? A HIS 29 30 1 Y 1 A ARG 73 ? A ARG 30 31 1 Y 1 A ILE 74 ? A ILE 31 32 1 Y 1 A VAL 75 ? A VAL 32 33 1 Y 1 A PRO 76 ? A PRO 33 34 1 Y 1 A ARG 77 ? A ARG 34 35 1 Y 1 A LEU 78 ? A LEU 35 36 1 Y 1 A ARG 79 ? A ARG 36 37 1 Y 1 A ASP 80 ? A ASP 37 38 1 Y 1 A VAL 81 ? A VAL 38 39 1 Y 1 A PHE 82 ? A PHE 39 40 1 Y 1 A PRO 612 ? A PRO 569 41 1 Y 1 A ASP 613 ? A ASP 570 42 1 Y 1 A GLY 614 ? A GLY 571 43 1 Y 1 A SER 615 ? A SER 572 44 1 Y 1 A LEU 616 ? A LEU 573 45 1 Y 1 A PRO 617 ? A PRO 574 46 1 Y 1 A GLU 618 ? A GLU 575 47 1 Y 1 A ALA 619 ? A ALA 576 48 1 Y 1 A GLN 620 ? A GLN 577 49 1 Y 1 A SER 621 ? A SER 578 50 1 Y 1 A LEU 622 ? A LEU 579 51 1 Y 1 A TRP 623 ? A TRP 580 52 1 Y 1 A PRO 624 ? A PRO 581 53 1 Y 1 A ARG 625 ? A ARG 582 54 1 Y 1 A PRO 626 ? A PRO 583 55 1 Y 1 A LEU 627 ? A LEU 584 56 1 Y 1 A PHE 628 ? A PHE 585 57 1 Y 1 A SER 629 ? A SER 586 58 1 Y 1 B GLY 44 ? B GLY 1 59 1 Y 1 B ALA 45 ? B ALA 2 60 1 Y 1 B PRO 46 ? B PRO 3 61 1 Y 1 B LEU 47 ? B LEU 4 62 1 Y 1 B SER 48 ? B SER 5 63 1 Y 1 B ASP 49 ? B ASP 6 64 1 Y 1 B SER 50 ? B SER 7 65 1 Y 1 B ARG 51 ? B ARG 8 66 1 Y 1 B VAL 52 ? B VAL 9 67 1 Y 1 B LEU 53 ? B LEU 10 68 1 Y 1 B TRP 54 ? B TRP 11 69 1 Y 1 B ALA 55 ? B ALA 12 70 1 Y 1 B PRO 56 ? B PRO 13 71 1 Y 1 B ALA 57 ? B ALA 14 72 1 Y 1 B GLU 58 ? B GLU 15 73 1 Y 1 B ALA 59 ? B ALA 16 74 1 Y 1 B HIS 60 ? B HIS 17 75 1 Y 1 B PRO 61 ? B PRO 18 76 1 Y 1 B LEU 62 ? B LEU 19 77 1 Y 1 B SER 63 ? B SER 20 78 1 Y 1 B PRO 64 ? B PRO 21 79 1 Y 1 B GLN 65 ? B GLN 22 80 1 Y 1 B GLY 66 ? B GLY 23 81 1 Y 1 B HIS 67 ? B HIS 24 82 1 Y 1 B PRO 68 ? B PRO 25 83 1 Y 1 B ALA 69 ? B ALA 26 84 1 Y 1 B ARG 70 ? B ARG 27 85 1 Y 1 B LEU 71 ? B LEU 28 86 1 Y 1 B HIS 72 ? B HIS 29 87 1 Y 1 B ARG 73 ? B ARG 30 88 1 Y 1 B ILE 74 ? B ILE 31 89 1 Y 1 B VAL 75 ? B VAL 32 90 1 Y 1 B PRO 76 ? B PRO 33 91 1 Y 1 B ARG 77 ? B ARG 34 92 1 Y 1 B LEU 78 ? B LEU 35 93 1 Y 1 B ARG 79 ? B ARG 36 94 1 Y 1 B ASP 80 ? B ASP 37 95 1 Y 1 B VAL 81 ? B VAL 38 96 1 Y 1 B PRO 612 ? B PRO 569 97 1 Y 1 B ASP 613 ? B ASP 570 98 1 Y 1 B GLY 614 ? B GLY 571 99 1 Y 1 B SER 615 ? B SER 572 100 1 Y 1 B LEU 616 ? B LEU 573 101 1 Y 1 B PRO 617 ? B PRO 574 102 1 Y 1 B GLU 618 ? B GLU 575 103 1 Y 1 B ALA 619 ? B ALA 576 104 1 Y 1 B GLN 620 ? B GLN 577 105 1 Y 1 B SER 621 ? B SER 578 106 1 Y 1 B LEU 622 ? B LEU 579 107 1 Y 1 B TRP 623 ? B TRP 580 108 1 Y 1 B PRO 624 ? B PRO 581 109 1 Y 1 B ARG 625 ? B ARG 582 110 1 Y 1 B PRO 626 ? B PRO 583 111 1 Y 1 B LEU 627 ? B LEU 584 112 1 Y 1 B PHE 628 ? B PHE 585 113 1 Y 1 B SER 629 ? B SER 586 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 'ZINC ION' ZN 3 'ACETATE ION' ACT 4 N-ACETYL-D-GLUCOSAMINE NAG 5 ALPHA-D-MANNOSE MAN #