data_4GZ3 # _entry.id 4GZ3 # _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 4GZ3 RCSB RCSB074813 WWPDB D_1000074813 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 4GYW . unspecified PDB 4GYY . unspecified PDB 4GZ5 . unspecified PDB 4GZ6 . unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 4GZ3 _pdbx_database_status.recvd_initial_deposition_date 2012-09-05 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Lazarus, M.B.' 1 'Jiang, J.' 2 'Gloster, T.M.' 3 'Zandberg, W.F.' 4 'Vocadlo, D.J.' 5 'Walker, S.' 6 # _citation.id primary _citation.title 'Structural snapshots of the reaction coordinate for O-GlcNAc transferase.' _citation.journal_abbrev Nat.Chem.Biol. _citation.journal_volume 8 _citation.page_first 966 _citation.page_last 968 _citation.year 2012 _citation.journal_id_ASTM ? _citation.country US _citation.journal_id_ISSN 1552-4450 _citation.journal_id_CSD ? _citation.book_publisher ? _citation.pdbx_database_id_PubMed 23103939 _citation.pdbx_database_id_DOI 10.1038/nchembio.1109 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Lazarus, M.B.' 1 primary 'Jiang, J.' 2 primary 'Gloster, T.M.' 3 primary 'Zandberg, W.F.' 4 primary 'Whitworth, G.E.' 5 primary 'Vocadlo, D.J.' 6 primary 'Walker, S.' 7 # _cell.entry_id 4GZ3 _cell.length_a 98.770 _cell.length_b 137.620 _cell.length_c 153.016 _cell.angle_alpha 90.00 _cell.angle_beta 102.82 _cell.angle_gamma 90.00 _cell.Z_PDB 8 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 4GZ3 _symmetry.space_group_name_H-M 'I 1 2 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 5 _symmetry.space_group_name_Hall ? # 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 'UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit' 80974.508 2 2.4.1.255 ? ? ? 2 polymer syn 'Casein kinase II subunit alpha' 1398.562 2 2.7.11.1 ? ? ? 3 non-polymer syn "URIDINE-5'-DIPHOSPHATE" 404.161 2 ? ? ? ? 4 non-polymer syn 'SULFATE ION' 96.063 3 ? ? ? ? 5 non-polymer syn '2-(acetylamino)-2-deoxy-5-thio-beta-D-glucopyranose' 237.273 2 ? ? ? ? 6 water nat water 18.015 836 ? ? ? ? # loop_ _entity_name_com.entity_id _entity_name_com.name 1 'O-GlcNAc transferase subunit p110, O-linked N-acetylglucosamine transferase 110 kDa subunit, OGT' 2 'CK II alpha' # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no ;GPGSCPTHADSLNNLANIKREQGNIEEAVRLYRKALEVFPEFAAAHSNLASVLQQQGKLQEALMHYKEAIRISPTFADAY SNMGNTLKEMQDVQGALQCYTRAIQINPAFADAHSNLASIHKDSGNIPEAIASYRTALKLKPDFPDAYCNLAHCLQIVCD WTDYDERMKKLVSIVADQLEKNRLPSVHPHHSMLYPLSHGFRKAIAERHGNLCLDKINVLHKPPYEHPKDLKLSDGRLRV GYVSSDFGNHPTSHLMQSIPGMHNPDKFEVFCYALSPDDGTNFRVKVMAEANHFIDLSQIPCNGKAADRIHQDGIHILVN MNGYTKGARNELFALRPAPIQAMWLGYPGTSGALFMDYIITDQETSPAEVAEQYSEKLAYMPHTFFIGDHANMFPHLKKK AVIDFKSNGHIYDNRIVLNGIDLKAFLDSLPDVKIVKMKCPDGGDNADSSNTALNMPVIPMNTIAEAVIEMINRGQIQIT INGFSISNGLATTQINNKAATGEEVPRTIIVTTRSQYGLPEDAIVYCNFNQLYKIDPSTLQMWANILKRVPNSVLWLLRF PAVGEPNIQQYAQNMGLPQNRIIFSPVAPKEEHVRRGQLADVCLDTPLCNGHTTGMDVLWAGTPMVTMPGETLASRVAAS QLTCLGCLELIAKNRQEYEDIAVKLGTDLEYLKKVRGKVWKQRISSPLFNTKQYTMELERLYLQMWEHYAAGNKPDHMIK PVE ; ;GPGSCPTHADSLNNLANIKREQGNIEEAVRLYRKALEVFPEFAAAHSNLASVLQQQGKLQEALMHYKEAIRISPTFADAY SNMGNTLKEMQDVQGALQCYTRAIQINPAFADAHSNLASIHKDSGNIPEAIASYRTALKLKPDFPDAYCNLAHCLQIVCD WTDYDERMKKLVSIVADQLEKNRLPSVHPHHSMLYPLSHGFRKAIAERHGNLCLDKINVLHKPPYEHPKDLKLSDGRLRV GYVSSDFGNHPTSHLMQSIPGMHNPDKFEVFCYALSPDDGTNFRVKVMAEANHFIDLSQIPCNGKAADRIHQDGIHILVN MNGYTKGARNELFALRPAPIQAMWLGYPGTSGALFMDYIITDQETSPAEVAEQYSEKLAYMPHTFFIGDHANMFPHLKKK AVIDFKSNGHIYDNRIVLNGIDLKAFLDSLPDVKIVKMKCPDGGDNADSSNTALNMPVIPMNTIAEAVIEMINRGQIQIT INGFSISNGLATTQINNKAATGEEVPRTIIVTTRSQYGLPEDAIVYCNFNQLYKIDPSTLQMWANILKRVPNSVLWLLRF PAVGEPNIQQYAQNMGLPQNRIIFSPVAPKEEHVRRGQLADVCLDTPLCNGHTTGMDVLWAGTPMVTMPGETLASRVAAS QLTCLGCLELIAKNRQEYEDIAVKLGTDLEYLKKVRGKVWKQRISSPLFNTKQYTMELERLYLQMWEHYAAGNKPDHMIK PVE ; A,C ? 2 'polypeptide(L)' no no YPGGSTPVSSANMM YPGGSTPVSSANMM B,D ? # 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 PRO n 1 3 GLY n 1 4 SER n 1 5 CYS n 1 6 PRO n 1 7 THR n 1 8 HIS n 1 9 ALA n 1 10 ASP n 1 11 SER n 1 12 LEU n 1 13 ASN n 1 14 ASN n 1 15 LEU n 1 16 ALA n 1 17 ASN n 1 18 ILE n 1 19 LYS n 1 20 ARG n 1 21 GLU n 1 22 GLN n 1 23 GLY n 1 24 ASN n 1 25 ILE n 1 26 GLU n 1 27 GLU n 1 28 ALA n 1 29 VAL n 1 30 ARG n 1 31 LEU n 1 32 TYR n 1 33 ARG n 1 34 LYS n 1 35 ALA n 1 36 LEU n 1 37 GLU n 1 38 VAL n 1 39 PHE n 1 40 PRO n 1 41 GLU n 1 42 PHE n 1 43 ALA n 1 44 ALA n 1 45 ALA n 1 46 HIS n 1 47 SER n 1 48 ASN n 1 49 LEU n 1 50 ALA n 1 51 SER n 1 52 VAL n 1 53 LEU n 1 54 GLN n 1 55 GLN n 1 56 GLN n 1 57 GLY n 1 58 LYS n 1 59 LEU n 1 60 GLN n 1 61 GLU n 1 62 ALA n 1 63 LEU n 1 64 MET n 1 65 HIS n 1 66 TYR n 1 67 LYS n 1 68 GLU n 1 69 ALA n 1 70 ILE n 1 71 ARG n 1 72 ILE n 1 73 SER n 1 74 PRO n 1 75 THR n 1 76 PHE n 1 77 ALA n 1 78 ASP n 1 79 ALA n 1 80 TYR n 1 81 SER n 1 82 ASN n 1 83 MET n 1 84 GLY n 1 85 ASN n 1 86 THR n 1 87 LEU n 1 88 LYS n 1 89 GLU n 1 90 MET n 1 91 GLN n 1 92 ASP n 1 93 VAL n 1 94 GLN n 1 95 GLY n 1 96 ALA n 1 97 LEU n 1 98 GLN n 1 99 CYS n 1 100 TYR n 1 101 THR n 1 102 ARG n 1 103 ALA n 1 104 ILE n 1 105 GLN n 1 106 ILE n 1 107 ASN n 1 108 PRO n 1 109 ALA n 1 110 PHE n 1 111 ALA n 1 112 ASP n 1 113 ALA n 1 114 HIS n 1 115 SER n 1 116 ASN n 1 117 LEU n 1 118 ALA n 1 119 SER n 1 120 ILE n 1 121 HIS n 1 122 LYS n 1 123 ASP n 1 124 SER n 1 125 GLY n 1 126 ASN n 1 127 ILE n 1 128 PRO n 1 129 GLU n 1 130 ALA n 1 131 ILE n 1 132 ALA n 1 133 SER n 1 134 TYR n 1 135 ARG n 1 136 THR n 1 137 ALA n 1 138 LEU n 1 139 LYS n 1 140 LEU n 1 141 LYS n 1 142 PRO n 1 143 ASP n 1 144 PHE n 1 145 PRO n 1 146 ASP n 1 147 ALA n 1 148 TYR n 1 149 CYS n 1 150 ASN n 1 151 LEU n 1 152 ALA n 1 153 HIS n 1 154 CYS n 1 155 LEU n 1 156 GLN n 1 157 ILE n 1 158 VAL n 1 159 CYS n 1 160 ASP n 1 161 TRP n 1 162 THR n 1 163 ASP n 1 164 TYR n 1 165 ASP n 1 166 GLU n 1 167 ARG n 1 168 MET n 1 169 LYS n 1 170 LYS n 1 171 LEU n 1 172 VAL n 1 173 SER n 1 174 ILE n 1 175 VAL n 1 176 ALA n 1 177 ASP n 1 178 GLN n 1 179 LEU n 1 180 GLU n 1 181 LYS n 1 182 ASN n 1 183 ARG n 1 184 LEU n 1 185 PRO n 1 186 SER n 1 187 VAL n 1 188 HIS n 1 189 PRO n 1 190 HIS n 1 191 HIS n 1 192 SER n 1 193 MET n 1 194 LEU n 1 195 TYR n 1 196 PRO n 1 197 LEU n 1 198 SER n 1 199 HIS n 1 200 GLY n 1 201 PHE n 1 202 ARG n 1 203 LYS n 1 204 ALA n 1 205 ILE n 1 206 ALA n 1 207 GLU n 1 208 ARG n 1 209 HIS n 1 210 GLY n 1 211 ASN n 1 212 LEU n 1 213 CYS n 1 214 LEU n 1 215 ASP n 1 216 LYS n 1 217 ILE n 1 218 ASN n 1 219 VAL n 1 220 LEU n 1 221 HIS n 1 222 LYS n 1 223 PRO n 1 224 PRO n 1 225 TYR n 1 226 GLU n 1 227 HIS n 1 228 PRO n 1 229 LYS n 1 230 ASP n 1 231 LEU n 1 232 LYS n 1 233 LEU n 1 234 SER n 1 235 ASP n 1 236 GLY n 1 237 ARG n 1 238 LEU n 1 239 ARG n 1 240 VAL n 1 241 GLY n 1 242 TYR n 1 243 VAL n 1 244 SER n 1 245 SER n 1 246 ASP n 1 247 PHE n 1 248 GLY n 1 249 ASN n 1 250 HIS n 1 251 PRO n 1 252 THR n 1 253 SER n 1 254 HIS n 1 255 LEU n 1 256 MET n 1 257 GLN n 1 258 SER n 1 259 ILE n 1 260 PRO n 1 261 GLY n 1 262 MET n 1 263 HIS n 1 264 ASN n 1 265 PRO n 1 266 ASP n 1 267 LYS n 1 268 PHE n 1 269 GLU n 1 270 VAL n 1 271 PHE n 1 272 CYS n 1 273 TYR n 1 274 ALA n 1 275 LEU n 1 276 SER n 1 277 PRO n 1 278 ASP n 1 279 ASP n 1 280 GLY n 1 281 THR n 1 282 ASN n 1 283 PHE n 1 284 ARG n 1 285 VAL n 1 286 LYS n 1 287 VAL n 1 288 MET n 1 289 ALA n 1 290 GLU n 1 291 ALA n 1 292 ASN n 1 293 HIS n 1 294 PHE n 1 295 ILE n 1 296 ASP n 1 297 LEU n 1 298 SER n 1 299 GLN n 1 300 ILE n 1 301 PRO n 1 302 CYS n 1 303 ASN n 1 304 GLY n 1 305 LYS n 1 306 ALA n 1 307 ALA n 1 308 ASP n 1 309 ARG n 1 310 ILE n 1 311 HIS n 1 312 GLN n 1 313 ASP n 1 314 GLY n 1 315 ILE n 1 316 HIS n 1 317 ILE n 1 318 LEU n 1 319 VAL n 1 320 ASN n 1 321 MET n 1 322 ASN n 1 323 GLY n 1 324 TYR n 1 325 THR n 1 326 LYS n 1 327 GLY n 1 328 ALA n 1 329 ARG n 1 330 ASN n 1 331 GLU n 1 332 LEU n 1 333 PHE n 1 334 ALA n 1 335 LEU n 1 336 ARG n 1 337 PRO n 1 338 ALA n 1 339 PRO n 1 340 ILE n 1 341 GLN n 1 342 ALA n 1 343 MET n 1 344 TRP n 1 345 LEU n 1 346 GLY n 1 347 TYR n 1 348 PRO n 1 349 GLY n 1 350 THR n 1 351 SER n 1 352 GLY n 1 353 ALA n 1 354 LEU n 1 355 PHE n 1 356 MET n 1 357 ASP n 1 358 TYR n 1 359 ILE n 1 360 ILE n 1 361 THR n 1 362 ASP n 1 363 GLN n 1 364 GLU n 1 365 THR n 1 366 SER n 1 367 PRO n 1 368 ALA n 1 369 GLU n 1 370 VAL n 1 371 ALA n 1 372 GLU n 1 373 GLN n 1 374 TYR n 1 375 SER n 1 376 GLU n 1 377 LYS n 1 378 LEU n 1 379 ALA n 1 380 TYR n 1 381 MET n 1 382 PRO n 1 383 HIS n 1 384 THR n 1 385 PHE n 1 386 PHE n 1 387 ILE n 1 388 GLY n 1 389 ASP n 1 390 HIS n 1 391 ALA n 1 392 ASN n 1 393 MET n 1 394 PHE n 1 395 PRO n 1 396 HIS n 1 397 LEU n 1 398 LYS n 1 399 LYS n 1 400 LYS n 1 401 ALA n 1 402 VAL n 1 403 ILE n 1 404 ASP n 1 405 PHE n 1 406 LYS n 1 407 SER n 1 408 ASN n 1 409 GLY n 1 410 HIS n 1 411 ILE n 1 412 TYR n 1 413 ASP n 1 414 ASN n 1 415 ARG n 1 416 ILE n 1 417 VAL n 1 418 LEU n 1 419 ASN n 1 420 GLY n 1 421 ILE n 1 422 ASP n 1 423 LEU n 1 424 LYS n 1 425 ALA n 1 426 PHE n 1 427 LEU n 1 428 ASP n 1 429 SER n 1 430 LEU n 1 431 PRO n 1 432 ASP n 1 433 VAL n 1 434 LYS n 1 435 ILE n 1 436 VAL n 1 437 LYS n 1 438 MET n 1 439 LYS n 1 440 CYS n 1 441 PRO n 1 442 ASP n 1 443 GLY n 1 444 GLY n 1 445 ASP n 1 446 ASN n 1 447 ALA n 1 448 ASP n 1 449 SER n 1 450 SER n 1 451 ASN n 1 452 THR n 1 453 ALA n 1 454 LEU n 1 455 ASN n 1 456 MET n 1 457 PRO n 1 458 VAL n 1 459 ILE n 1 460 PRO n 1 461 MET n 1 462 ASN n 1 463 THR n 1 464 ILE n 1 465 ALA n 1 466 GLU n 1 467 ALA n 1 468 VAL n 1 469 ILE n 1 470 GLU n 1 471 MET n 1 472 ILE n 1 473 ASN n 1 474 ARG n 1 475 GLY n 1 476 GLN n 1 477 ILE n 1 478 GLN n 1 479 ILE n 1 480 THR n 1 481 ILE n 1 482 ASN n 1 483 GLY n 1 484 PHE n 1 485 SER n 1 486 ILE n 1 487 SER n 1 488 ASN n 1 489 GLY n 1 490 LEU n 1 491 ALA n 1 492 THR n 1 493 THR n 1 494 GLN n 1 495 ILE n 1 496 ASN n 1 497 ASN n 1 498 LYS n 1 499 ALA n 1 500 ALA n 1 501 THR n 1 502 GLY n 1 503 GLU n 1 504 GLU n 1 505 VAL n 1 506 PRO n 1 507 ARG n 1 508 THR n 1 509 ILE n 1 510 ILE n 1 511 VAL n 1 512 THR n 1 513 THR n 1 514 ARG n 1 515 SER n 1 516 GLN n 1 517 TYR n 1 518 GLY n 1 519 LEU n 1 520 PRO n 1 521 GLU n 1 522 ASP n 1 523 ALA n 1 524 ILE n 1 525 VAL n 1 526 TYR n 1 527 CYS n 1 528 ASN n 1 529 PHE n 1 530 ASN n 1 531 GLN n 1 532 LEU n 1 533 TYR n 1 534 LYS n 1 535 ILE n 1 536 ASP n 1 537 PRO n 1 538 SER n 1 539 THR n 1 540 LEU n 1 541 GLN n 1 542 MET n 1 543 TRP n 1 544 ALA n 1 545 ASN n 1 546 ILE n 1 547 LEU n 1 548 LYS n 1 549 ARG n 1 550 VAL n 1 551 PRO n 1 552 ASN n 1 553 SER n 1 554 VAL n 1 555 LEU n 1 556 TRP n 1 557 LEU n 1 558 LEU n 1 559 ARG n 1 560 PHE n 1 561 PRO n 1 562 ALA n 1 563 VAL n 1 564 GLY n 1 565 GLU n 1 566 PRO n 1 567 ASN n 1 568 ILE n 1 569 GLN n 1 570 GLN n 1 571 TYR n 1 572 ALA n 1 573 GLN n 1 574 ASN n 1 575 MET n 1 576 GLY n 1 577 LEU n 1 578 PRO n 1 579 GLN n 1 580 ASN n 1 581 ARG n 1 582 ILE n 1 583 ILE n 1 584 PHE n 1 585 SER n 1 586 PRO n 1 587 VAL n 1 588 ALA n 1 589 PRO n 1 590 LYS n 1 591 GLU n 1 592 GLU n 1 593 HIS n 1 594 VAL n 1 595 ARG n 1 596 ARG n 1 597 GLY n 1 598 GLN n 1 599 LEU n 1 600 ALA n 1 601 ASP n 1 602 VAL n 1 603 CYS n 1 604 LEU n 1 605 ASP n 1 606 THR n 1 607 PRO n 1 608 LEU n 1 609 CYS n 1 610 ASN n 1 611 GLY n 1 612 HIS n 1 613 THR n 1 614 THR n 1 615 GLY n 1 616 MET n 1 617 ASP n 1 618 VAL n 1 619 LEU n 1 620 TRP n 1 621 ALA n 1 622 GLY n 1 623 THR n 1 624 PRO n 1 625 MET n 1 626 VAL n 1 627 THR n 1 628 MET n 1 629 PRO n 1 630 GLY n 1 631 GLU n 1 632 THR n 1 633 LEU n 1 634 ALA n 1 635 SER n 1 636 ARG n 1 637 VAL n 1 638 ALA n 1 639 ALA n 1 640 SER n 1 641 GLN n 1 642 LEU n 1 643 THR n 1 644 CYS n 1 645 LEU n 1 646 GLY n 1 647 CYS n 1 648 LEU n 1 649 GLU n 1 650 LEU n 1 651 ILE n 1 652 ALA n 1 653 LYS n 1 654 ASN n 1 655 ARG n 1 656 GLN n 1 657 GLU n 1 658 TYR n 1 659 GLU n 1 660 ASP n 1 661 ILE n 1 662 ALA n 1 663 VAL n 1 664 LYS n 1 665 LEU n 1 666 GLY n 1 667 THR n 1 668 ASP n 1 669 LEU n 1 670 GLU n 1 671 TYR n 1 672 LEU n 1 673 LYS n 1 674 LYS n 1 675 VAL n 1 676 ARG n 1 677 GLY n 1 678 LYS n 1 679 VAL n 1 680 TRP n 1 681 LYS n 1 682 GLN n 1 683 ARG n 1 684 ILE n 1 685 SER n 1 686 SER n 1 687 PRO n 1 688 LEU n 1 689 PHE n 1 690 ASN n 1 691 THR n 1 692 LYS n 1 693 GLN n 1 694 TYR n 1 695 THR n 1 696 MET n 1 697 GLU n 1 698 LEU n 1 699 GLU n 1 700 ARG n 1 701 LEU n 1 702 TYR n 1 703 LEU n 1 704 GLN n 1 705 MET n 1 706 TRP n 1 707 GLU n 1 708 HIS n 1 709 TYR n 1 710 ALA n 1 711 ALA n 1 712 GLY n 1 713 ASN n 1 714 LYS n 1 715 PRO n 1 716 ASP n 1 717 HIS n 1 718 MET n 1 719 ILE n 1 720 LYS n 1 721 PRO n 1 722 VAL n 1 723 GLU n 2 1 TYR n 2 2 PRO n 2 3 GLY n 2 4 GLY n 2 5 SER n 2 6 THR n 2 7 PRO n 2 8 VAL n 2 9 SER n 2 10 SER n 2 11 ALA n 2 12 ASN n 2 13 MET n 2 14 MET n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name human _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene OGT _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 ? _entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562 _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 ? # _pdbx_entity_src_syn.entity_id 2 _pdbx_entity_src_syn.pdbx_src_id 1 _pdbx_entity_src_syn.pdbx_alt_source_flag sample _pdbx_entity_src_syn.pdbx_beg_seq_num ? _pdbx_entity_src_syn.pdbx_end_seq_num ? _pdbx_entity_src_syn.organism_scientific 'Homo sapiens' _pdbx_entity_src_syn.organism_common_name human _pdbx_entity_src_syn.ncbi_taxonomy_id 9606 _pdbx_entity_src_syn.details 'synthetic peptide' # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin _struct_ref.pdbx_db_isoform 1 UNP OGT1_HUMAN O15294 1 ;CPTHADSLNNLANIKREQGNIEEAVRLYRKALEVFPEFAAAHSNLASVLQQQGKLQEALMHYKEAIRISPTFADAYSNMG NTLKEMQDVQGALQCYTRAIQINPAFADAHSNLASIHKDSGNIPEAIASYRTALKLKPDFPDAYCNLAHCLQIVCDWTDY DERMKKLVSIVADQLEKNRLPSVHPHHSMLYPLSHGFRKAIAERHGNLCLDKINVLHKPPYEHPKDLKLSDGRLRVGYVS SDFGNHPTSHLMQSIPGMHNPDKFEVFCYALSPDDGTNFRVKVMAEANHFIDLSQIPCNGKAADRIHQDGIHILVNMNGY TKGARNELFALRPAPIQAMWLGYPGTSGALFMDYIITDQETSPAEVAEQYSEKLAYMPHTFFIGDHANMFPHLKKKAVID FKSNGHIYDNRIVLNGIDLKAFLDSLPDVKIVKMKCPDGGDNADSSNTALNMPVIPMNTIAEAVIEMINRGQIQITINGF SISNGLATTQINNKAATGEEVPRTIIVTTRSQYGLPEDAIVYCNFNQLYKIDPSTLQMWANILKRVPNSVLWLLRFPAVG EPNIQQYAQNMGLPQNRIIFSPVAPKEEHVRRGQLADVCLDTPLCNGHTTGMDVLWAGTPMVTMPGETLASRVAASQLTC LGCLELIAKNRQEYEDIAVKLGTDLEYLKKVRGKVWKQRISSPLFNTKQYTMELERLYLQMWEHYAAGNKPDHMIKPVE ; 323 ? 2 UNP CSK21_HUMAN P68400 2 PGGSTPVSSANMM 340 ? # 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 4GZ3 A 5 ? 723 ? O15294 323 ? 1041 ? 313 1031 2 2 4GZ3 B 2 ? 14 ? P68400 340 ? 352 ? 14 26 3 1 4GZ3 C 5 ? 723 ? O15294 323 ? 1041 ? 313 1031 4 2 4GZ3 D 2 ? 14 ? P68400 340 ? 352 ? 14 26 # 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 4GZ3 GLY A 1 ? UNP O15294 ? ? 'EXPRESSION TAG' 309 1 1 4GZ3 PRO A 2 ? UNP O15294 ? ? 'EXPRESSION TAG' 310 2 1 4GZ3 GLY A 3 ? UNP O15294 ? ? 'EXPRESSION TAG' 311 3 1 4GZ3 SER A 4 ? UNP O15294 ? ? 'EXPRESSION TAG' 312 4 2 4GZ3 TYR B 1 ? UNP P68400 ? ? 'EXPRESSION TAG' 13 5 3 4GZ3 GLY C 1 ? UNP O15294 ? ? 'EXPRESSION TAG' 309 6 3 4GZ3 PRO C 2 ? UNP O15294 ? ? 'EXPRESSION TAG' 310 7 3 4GZ3 GLY C 3 ? UNP O15294 ? ? 'EXPRESSION TAG' 311 8 3 4GZ3 SER C 4 ? UNP O15294 ? ? 'EXPRESSION TAG' 312 9 4 4GZ3 TYR D 1 ? UNP P68400 ? ? 'EXPRESSION TAG' 13 10 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight 0YT D-saccharide . '2-(acetylamino)-2-deoxy-5-thio-beta-D-glucopyranose' ? 'C8 H15 N O5 S' 237.273 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 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 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 SO4 non-polymer . 'SULFATE ION' ? 'O4 S -2' 96.063 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 UDP 'RNA linking' . "URIDINE-5'-DIPHOSPHATE" ? 'C9 H14 N2 O12 P2' 404.161 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # _exptl.entry_id 4GZ3 _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.08 _exptl_crystal.density_percent_sol 60.03 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.temp 298 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 7.0 _exptl_crystal_grow.pdbx_details '1.6M Lithium Sulfate, 0.1M Bis Tris Propane pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector CCD _diffrn_detector.type 'ADSC QUANTUM 315' _diffrn_detector.pdbx_collection_date 2011-07-19 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'Si(111)' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.075 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'NSLS BEAMLINE X29A' _diffrn_source.pdbx_synchrotron_site NSLS _diffrn_source.pdbx_synchrotron_beamline X29A _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 1.075 # _reflns.entry_id 4GZ3 _reflns.observed_criterion_sigma_I 2 _reflns.observed_criterion_sigma_F 2 _reflns.d_resolution_low 49.87 _reflns.d_resolution_high 1.9 _reflns.number_obs 154828 _reflns.number_all 154828 _reflns.percent_possible_obs 99.1 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI ? _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy ? _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 1.9 _reflns_shell.d_res_low 2.0 _reflns_shell.percent_possible_all 99.0 _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy ? _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 4GZ3 _refine.ls_number_reflns_obs 154706 _refine.ls_number_reflns_all 154706 _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.00 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 48.154 _refine.ls_d_res_high 1.900 _refine.ls_percent_reflns_obs 98.93 _refine.ls_R_factor_obs 0.2274 _refine.ls_R_factor_all 0.2274 _refine.ls_R_factor_R_work 0.2262 _refine.ls_R_factor_R_free 0.2496 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.03 _refine.ls_number_reflns_R_free 7781 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean ? _refine.aniso_B[1][1] 0.5463 _refine.aniso_B[2][2] -0.3929 _refine.aniso_B[3][3] -0.1534 _refine.aniso_B[1][2] -0.0000 _refine.aniso_B[1][3] 4.3117 _refine.aniso_B[2][3] 0.0000 _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol 0.400 _refine.solvent_model_param_bsol 45.196 _refine.pdbx_solvent_vdw_probe_radii 1.10 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.86 _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.58 _refine.pdbx_overall_phase_error 24.80 _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_diffrn_id 1 _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 11018 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 93 _refine_hist.number_atoms_solvent 836 _refine_hist.number_atoms_total 11947 _refine_hist.d_res_high 1.900 _refine_hist.d_res_low 48.154 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_restraint_function _refine_ls_restr.pdbx_refine_id f_bond_d 0.005 ? ? 11448 ? 'X-RAY DIFFRACTION' f_angle_d 0.915 ? ? 15554 ? 'X-RAY DIFFRACTION' f_dihedral_angle_d 13.055 ? ? 4291 ? 'X-RAY DIFFRACTION' f_chiral_restr 0.063 ? ? 1716 ? 'X-RAY DIFFRACTION' f_plane_restr 0.004 ? ? 2013 ? 'X-RAY DIFFRACTION' # loop_ _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.pdbx_refine_id . 1.9000 1.9216 4842 0.3009 99.00 0.3487 . . 251 . . . . 'X-RAY DIFFRACTION' . 1.9216 1.9442 4859 0.2902 99.00 0.3528 . . 292 . . . . 'X-RAY DIFFRACTION' . 1.9442 1.9679 4868 0.2618 99.00 0.2871 . . 246 . . . . 'X-RAY DIFFRACTION' . 1.9679 1.9928 4926 0.2418 99.00 0.2695 . . 256 . . . . 'X-RAY DIFFRACTION' . 1.9928 2.0190 4878 0.2259 99.00 0.2580 . . 287 . . . . 'X-RAY DIFFRACTION' . 2.0190 2.0467 4876 0.2248 99.00 0.2746 . . 251 . . . . 'X-RAY DIFFRACTION' . 2.0467 2.0759 4872 0.2212 99.00 0.2581 . . 236 . . . . 'X-RAY DIFFRACTION' . 2.0759 2.1069 4936 0.2172 99.00 0.2586 . . 234 . . . . 'X-RAY DIFFRACTION' . 2.1069 2.1399 4896 0.2546 99.00 0.2862 . . 263 . . . . 'X-RAY DIFFRACTION' . 2.1399 2.1749 4907 0.2817 99.00 0.3052 . . 248 . . . . 'X-RAY DIFFRACTION' . 2.1749 2.2124 4898 0.2229 99.00 0.2373 . . 262 . . . . 'X-RAY DIFFRACTION' . 2.2124 2.2527 4884 0.2229 99.00 0.2419 . . 267 . . . . 'X-RAY DIFFRACTION' . 2.2527 2.2960 4862 0.2248 99.00 0.2617 . . 281 . . . . 'X-RAY DIFFRACTION' . 2.2960 2.3429 4916 0.2242 99.00 0.2739 . . 237 . . . . 'X-RAY DIFFRACTION' . 2.3429 2.3938 4874 0.2304 99.00 0.2608 . . 265 . . . . 'X-RAY DIFFRACTION' . 2.3938 2.4495 4857 0.2355 99.00 0.2718 . . 272 . . . . 'X-RAY DIFFRACTION' . 2.4495 2.5107 4895 0.2409 99.00 0.2807 . . 276 . . . . 'X-RAY DIFFRACTION' . 2.5107 2.5786 4910 0.2265 99.00 0.2386 . . 259 . . . . 'X-RAY DIFFRACTION' . 2.5786 2.6545 4905 0.2342 99.00 0.2803 . . 245 . . . . 'X-RAY DIFFRACTION' . 2.6545 2.7402 4954 0.2345 99.00 0.2762 . . 225 . . . . 'X-RAY DIFFRACTION' . 2.7402 2.8381 4893 0.2368 99.00 0.2705 . . 229 . . . . 'X-RAY DIFFRACTION' . 2.8381 2.9517 4908 0.2241 99.00 0.2476 . . 284 . . . . 'X-RAY DIFFRACTION' . 2.9517 3.0860 4931 0.2157 100.00 0.2250 . . 275 . . . . 'X-RAY DIFFRACTION' . 3.0860 3.2487 4942 0.2239 100.00 0.2538 . . 245 . . . . 'X-RAY DIFFRACTION' . 3.2487 3.4522 4934 0.2052 100.00 0.2220 . . 289 . . . . 'X-RAY DIFFRACTION' . 3.4522 3.7186 4898 0.2051 99.00 0.2252 . . 268 . . . . 'X-RAY DIFFRACTION' . 3.7186 4.0927 4923 0.1948 98.00 0.1973 . . 244 . . . . 'X-RAY DIFFRACTION' . 4.0927 4.6845 4746 0.1922 96.00 0.2218 . . 269 . . . . 'X-RAY DIFFRACTION' . 4.6845 5.9003 4987 0.2228 100.00 0.2275 . . 256 . . . . 'X-RAY DIFFRACTION' . 5.9003 48.1690 4948 0.2797 98.00 0.2839 . . 269 . . . . 'X-RAY DIFFRACTION' # _struct.entry_id 4GZ3 _struct.title 'Crystal structure of human O-GlcNAc Transferase with UDP and a thioglycopeptide' _struct.pdbx_descriptor ;UDP-N-acetylglucosamine--peptide N-acetylglucosaminyltransferase 110 kDa subunit (E.C.2.4.1.255), Casein kinase II subunit alpha (E.C.2.7.11.1) ; _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 4GZ3 _struct_keywords.pdbx_keywords transferase/peptide _struct_keywords.text 'OGT, O-GlcNAc, GT-B, Glycosyltransferase, O-GlcNAcylation, transferase-peptide complex' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 1 ? D N N 2 ? E N N 3 ? F N N 4 ? G N N 5 ? H N N 4 ? I N N 3 ? J N N 5 ? K N N 4 ? L N N 6 ? M N N 6 ? N N N 6 ? O N N 6 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 PRO A 6 ? GLY A 23 ? PRO A 314 GLY A 331 1 ? 18 HELX_P HELX_P2 2 ASN A 24 ? PHE A 39 ? ASN A 332 PHE A 347 1 ? 16 HELX_P HELX_P3 3 PHE A 42 ? GLY A 57 ? PHE A 350 GLY A 365 1 ? 16 HELX_P HELX_P4 4 LYS A 58 ? SER A 73 ? LYS A 366 SER A 381 1 ? 16 HELX_P HELX_P5 5 PHE A 76 ? MET A 90 ? PHE A 384 MET A 398 1 ? 15 HELX_P HELX_P6 6 ASP A 92 ? ASN A 107 ? ASP A 400 ASN A 415 1 ? 16 HELX_P HELX_P7 7 PHE A 110 ? SER A 124 ? PHE A 418 SER A 432 1 ? 15 HELX_P HELX_P8 8 ASN A 126 ? LYS A 141 ? ASN A 434 LYS A 449 1 ? 16 HELX_P HELX_P9 9 PHE A 144 ? VAL A 158 ? PHE A 452 VAL A 466 1 ? 15 HELX_P HELX_P10 10 ASP A 163 ? LYS A 181 ? ASP A 471 LYS A 489 1 ? 19 HELX_P HELX_P11 11 HIS A 190 ? TYR A 195 ? HIS A 498 TYR A 503 5 ? 6 HELX_P HELX_P12 12 SER A 198 ? VAL A 219 ? SER A 506 VAL A 527 1 ? 22 HELX_P HELX_P13 13 HIS A 250 ? GLN A 257 ? HIS A 558 GLN A 565 1 ? 8 HELX_P HELX_P14 14 SER A 258 ? HIS A 263 ? SER A 566 HIS A 571 1 ? 6 HELX_P HELX_P15 15 THR A 281 ? ALA A 291 ? THR A 589 ALA A 599 1 ? 11 HELX_P HELX_P16 16 SER A 298 ? ILE A 300 ? SER A 606 ILE A 608 5 ? 3 HELX_P HELX_P17 17 CYS A 302 ? ASP A 313 ? CYS A 610 ASP A 621 1 ? 12 HELX_P HELX_P18 18 ASN A 330 ? LEU A 335 ? ASN A 638 LEU A 643 1 ? 6 HELX_P HELX_P19 19 PRO A 367 ? TYR A 374 ? PRO A 675 TYR A 682 5 ? 8 HELX_P HELX_P20 20 ASP A 389 ? PHE A 394 ? ASP A 697 PHE A 702 1 ? 6 HELX_P HELX_P21 21 PRO A 395 ? LYS A 398 ? PRO A 703 LYS A 706 5 ? 4 HELX_P HELX_P22 22 ASP A 422 ? SER A 429 ? ASP A 730 SER A 737 1 ? 8 HELX_P HELX_P23 23 ASN A 462 ? GLY A 475 ? ASN A 770 GLY A 783 1 ? 14 HELX_P HELX_P24 24 ALA A 491 ? ASN A 496 ? ALA A 799 ASN A 804 1 ? 6 HELX_P HELX_P25 25 ASN A 496 ? THR A 501 ? ASN A 804 THR A 809 1 ? 6 HELX_P HELX_P26 26 SER A 515 ? TYR A 517 ? SER A 823 TYR A 825 5 ? 3 HELX_P HELX_P27 27 GLN A 531 ? ILE A 535 ? GLN A 839 ILE A 843 5 ? 5 HELX_P HELX_P28 28 ASP A 536 ? VAL A 550 ? ASP A 844 VAL A 858 1 ? 15 HELX_P HELX_P29 29 PRO A 561 ? VAL A 563 ? PRO A 869 VAL A 871 5 ? 3 HELX_P HELX_P30 30 GLY A 564 ? MET A 575 ? GLY A 872 MET A 883 1 ? 12 HELX_P HELX_P31 31 PRO A 578 ? ASN A 580 ? PRO A 886 ASN A 888 5 ? 3 HELX_P HELX_P32 32 PRO A 589 ? GLY A 597 ? PRO A 897 GLY A 905 1 ? 9 HELX_P HELX_P33 33 GLN A 598 ? ALA A 600 ? GLN A 906 ALA A 908 5 ? 3 HELX_P HELX_P34 34 HIS A 612 ? ALA A 621 ? HIS A 920 ALA A 929 1 ? 10 HELX_P HELX_P35 35 THR A 632 ? SER A 635 ? THR A 940 SER A 943 5 ? 4 HELX_P HELX_P36 36 ARG A 636 ? GLY A 646 ? ARG A 944 GLY A 954 1 ? 11 HELX_P HELX_P37 37 CYS A 647 ? ILE A 651 ? CYS A 955 ILE A 959 5 ? 5 HELX_P HELX_P38 38 ASN A 654 ? ASP A 668 ? ASN A 962 ASP A 976 1 ? 15 HELX_P HELX_P39 39 ASP A 668 ? SER A 686 ? ASP A 976 SER A 994 1 ? 19 HELX_P HELX_P40 40 ASN A 690 ? ALA A 711 ? ASN A 998 ALA A 1019 1 ? 22 HELX_P HELX_P41 41 VAL C 29 ? PHE C 39 ? VAL C 337 PHE C 347 1 ? 11 HELX_P HELX_P42 42 PHE C 42 ? GLN C 56 ? PHE C 350 GLN C 364 1 ? 15 HELX_P HELX_P43 43 LYS C 58 ? SER C 73 ? LYS C 366 SER C 381 1 ? 16 HELX_P HELX_P44 44 PHE C 76 ? MET C 90 ? PHE C 384 MET C 398 1 ? 15 HELX_P HELX_P45 45 ASP C 92 ? ASN C 107 ? ASP C 400 ASN C 415 1 ? 16 HELX_P HELX_P46 46 PHE C 110 ? SER C 124 ? PHE C 418 SER C 432 1 ? 15 HELX_P HELX_P47 47 ASN C 126 ? LYS C 141 ? ASN C 434 LYS C 449 1 ? 16 HELX_P HELX_P48 48 PHE C 144 ? VAL C 158 ? PHE C 452 VAL C 466 1 ? 15 HELX_P HELX_P49 49 ASP C 163 ? LYS C 181 ? ASP C 471 LYS C 489 1 ? 19 HELX_P HELX_P50 50 HIS C 190 ? TYR C 195 ? HIS C 498 TYR C 503 5 ? 6 HELX_P HELX_P51 51 SER C 198 ? VAL C 219 ? SER C 506 VAL C 527 1 ? 22 HELX_P HELX_P52 52 HIS C 250 ? GLN C 257 ? HIS C 558 GLN C 565 1 ? 8 HELX_P HELX_P53 53 SER C 258 ? HIS C 263 ? SER C 566 HIS C 571 1 ? 6 HELX_P HELX_P54 54 THR C 281 ? ALA C 291 ? THR C 589 ALA C 599 1 ? 11 HELX_P HELX_P55 55 SER C 298 ? ILE C 300 ? SER C 606 ILE C 608 5 ? 3 HELX_P HELX_P56 56 CYS C 302 ? ASP C 313 ? CYS C 610 ASP C 621 1 ? 12 HELX_P HELX_P57 57 ASN C 330 ? LEU C 335 ? ASN C 638 LEU C 643 1 ? 6 HELX_P HELX_P58 58 PRO C 367 ? TYR C 374 ? PRO C 675 TYR C 682 5 ? 8 HELX_P HELX_P59 59 ASP C 389 ? PHE C 394 ? ASP C 697 PHE C 702 1 ? 6 HELX_P HELX_P60 60 PRO C 395 ? LYS C 398 ? PRO C 703 LYS C 706 5 ? 4 HELX_P HELX_P61 61 ASP C 422 ? SER C 429 ? ASP C 730 SER C 737 1 ? 8 HELX_P HELX_P62 62 ASN C 462 ? GLY C 475 ? ASN C 770 GLY C 783 1 ? 14 HELX_P HELX_P63 63 ALA C 491 ? ASN C 496 ? ALA C 799 ASN C 804 1 ? 6 HELX_P HELX_P64 64 ASN C 496 ? THR C 501 ? ASN C 804 THR C 809 1 ? 6 HELX_P HELX_P65 65 SER C 515 ? GLY C 518 ? SER C 823 GLY C 826 5 ? 4 HELX_P HELX_P66 66 GLN C 531 ? ILE C 535 ? GLN C 839 ILE C 843 5 ? 5 HELX_P HELX_P67 67 ASP C 536 ? VAL C 550 ? ASP C 844 VAL C 858 1 ? 15 HELX_P HELX_P68 68 PRO C 561 ? VAL C 563 ? PRO C 869 VAL C 871 5 ? 3 HELX_P HELX_P69 69 GLY C 564 ? MET C 575 ? GLY C 872 MET C 883 1 ? 12 HELX_P HELX_P70 70 PRO C 578 ? ASN C 580 ? PRO C 886 ASN C 888 5 ? 3 HELX_P HELX_P71 71 PRO C 589 ? GLY C 597 ? PRO C 897 GLY C 905 1 ? 9 HELX_P HELX_P72 72 GLN C 598 ? ALA C 600 ? GLN C 906 ALA C 908 5 ? 3 HELX_P HELX_P73 73 HIS C 612 ? ALA C 621 ? HIS C 920 ALA C 929 1 ? 10 HELX_P HELX_P74 74 THR C 632 ? SER C 635 ? THR C 940 SER C 943 5 ? 4 HELX_P HELX_P75 75 ARG C 636 ? GLY C 646 ? ARG C 944 GLY C 954 1 ? 11 HELX_P HELX_P76 76 CYS C 647 ? ILE C 651 ? CYS C 955 ILE C 959 5 ? 5 HELX_P HELX_P77 77 ASN C 654 ? ASP C 668 ? ASN C 962 ASP C 976 1 ? 15 HELX_P HELX_P78 78 ASP C 668 ? SER C 686 ? ASP C 976 SER C 994 1 ? 19 HELX_P HELX_P79 79 ASN C 690 ? ALA C 711 ? ASN C 998 ALA C 1019 1 ? 22 # _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 covale1 covale ? ? D SER 9 OG ? ? ? 1_555 J 0YT . C1 ? ? D SER 21 D 0YT 101 1_555 ? ? ? ? ? ? ? 1.409 ? covale2 covale ? ? B SER 9 OG ? ? ? 1_555 G 0YT . C1 ? ? B SER 21 B 0YT 101 1_555 ? ? ? ? ? ? ? 1.409 ? # _struct_conn_type.id covale _struct_conn_type.criteria ? _struct_conn_type.reference ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 PHE 560 A . ? PHE 868 A PRO 561 A ? PRO 869 A 1 7.83 2 PHE 560 C . ? PHE 868 C PRO 561 C ? PRO 869 C 1 7.98 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 7 ? B ? 7 ? C ? 5 ? D ? 7 ? E ? 7 ? F ? 5 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? parallel A 2 3 ? parallel A 3 4 ? parallel A 4 5 ? parallel A 5 6 ? parallel A 6 7 ? parallel B 1 2 ? anti-parallel B 2 3 ? parallel B 3 4 ? anti-parallel B 4 5 ? anti-parallel B 5 6 ? parallel B 6 7 ? anti-parallel C 1 2 ? parallel C 2 3 ? parallel C 3 4 ? parallel C 4 5 ? parallel D 1 2 ? parallel D 2 3 ? parallel D 3 4 ? parallel D 4 5 ? parallel D 5 6 ? parallel D 6 7 ? parallel E 1 2 ? anti-parallel E 2 3 ? parallel E 3 4 ? anti-parallel E 4 5 ? anti-parallel E 5 6 ? parallel E 6 7 ? anti-parallel F 1 2 ? parallel F 2 3 ? parallel F 3 4 ? parallel F 4 5 ? parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 HIS A 293 ? ASP A 296 ? HIS A 601 ASP A 604 A 2 PHE A 268 ? ALA A 274 ? PHE A 576 ALA A 582 A 3 LEU A 238 ? SER A 244 ? LEU A 546 SER A 552 A 4 ILE A 317 ? ASN A 320 ? ILE A 625 ASN A 628 A 5 ILE A 340 ? MET A 343 ? ILE A 648 MET A 651 A 6 TYR A 358 ? THR A 361 ? TYR A 666 THR A 669 A 7 LYS A 377 ? TYR A 380 ? LYS A 685 TYR A 688 B 1 LYS A 434 ? VAL A 436 ? LYS A 742 VAL A 744 B 2 MET A 456 ? ILE A 459 ? MET A 764 ILE A 767 B 3 ALA A 401 ? ILE A 403 ? ALA A 709 ILE A 711 B 4 ILE A 416 ? ASN A 419 ? ILE A 724 ASN A 727 B 5 ILE A 509 ? THR A 513 ? ILE A 817 THR A 821 B 6 PHE A 484 ? ASN A 488 ? PHE A 792 ASN A 796 B 7 GLN A 478 ? ILE A 481 ? GLN A 786 ILE A 789 C 1 ILE A 582 ? SER A 585 ? ILE A 890 SER A 893 C 2 SER A 553 ? LEU A 558 ? SER A 861 LEU A 866 C 3 ILE A 524 ? CYS A 527 ? ILE A 832 CYS A 835 C 4 VAL A 602 ? LEU A 604 ? VAL A 910 LEU A 912 C 5 MET A 625 ? VAL A 626 ? MET A 933 VAL A 934 D 1 HIS C 293 ? ASP C 296 ? HIS C 601 ASP C 604 D 2 PHE C 268 ? ALA C 274 ? PHE C 576 ALA C 582 D 3 LEU C 238 ? SER C 244 ? LEU C 546 SER C 552 D 4 ILE C 317 ? ASN C 320 ? ILE C 625 ASN C 628 D 5 ILE C 340 ? MET C 343 ? ILE C 648 MET C 651 D 6 TYR C 358 ? THR C 361 ? TYR C 666 THR C 669 D 7 LYS C 377 ? TYR C 380 ? LYS C 685 TYR C 688 E 1 LYS C 434 ? VAL C 436 ? LYS C 742 VAL C 744 E 2 MET C 456 ? ILE C 459 ? MET C 764 ILE C 767 E 3 ALA C 401 ? ILE C 403 ? ALA C 709 ILE C 711 E 4 ILE C 416 ? ASN C 419 ? ILE C 724 ASN C 727 E 5 ILE C 509 ? THR C 513 ? ILE C 817 THR C 821 E 6 PHE C 484 ? ASN C 488 ? PHE C 792 ASN C 796 E 7 GLN C 478 ? ILE C 481 ? GLN C 786 ILE C 789 F 1 ILE C 582 ? SER C 585 ? ILE C 890 SER C 893 F 2 SER C 553 ? LEU C 558 ? SER C 861 LEU C 866 F 3 ILE C 524 ? CYS C 527 ? ILE C 832 CYS C 835 F 4 VAL C 602 ? LEU C 604 ? VAL C 910 LEU C 912 F 5 MET C 625 ? VAL C 626 ? MET C 933 VAL C 934 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 O ILE A 295 ? O ILE A 603 N CYS A 272 ? N CYS A 580 A 2 3 O TYR A 273 ? O TYR A 581 N TYR A 242 ? N TYR A 550 A 3 4 N GLY A 241 ? N GLY A 549 O VAL A 319 ? O VAL A 627 A 4 5 N ASN A 320 ? N ASN A 628 O ALA A 342 ? O ALA A 650 A 5 6 N MET A 343 ? N MET A 651 O ILE A 360 ? O ILE A 668 A 6 7 N THR A 361 ? N THR A 669 O ALA A 379 ? O ALA A 687 B 1 2 N LYS A 434 ? N LYS A 742 O VAL A 458 ? O VAL A 766 B 2 3 O ILE A 459 ? O ILE A 767 N VAL A 402 ? N VAL A 710 B 3 4 N ALA A 401 ? N ALA A 709 O LEU A 418 ? O LEU A 726 B 4 5 N VAL A 417 ? N VAL A 725 O THR A 512 ? O THR A 820 B 5 6 O ILE A 509 ? O ILE A 817 N SER A 487 ? N SER A 795 B 6 7 O ILE A 486 ? O ILE A 794 N ILE A 479 ? N ILE A 787 C 1 2 O ILE A 583 ? O ILE A 891 N LEU A 555 ? N LEU A 863 C 2 3 O TRP A 556 ? O TRP A 864 N TYR A 526 ? N TYR A 834 C 3 4 N CYS A 527 ? N CYS A 835 O LEU A 604 ? O LEU A 912 C 4 5 N CYS A 603 ? N CYS A 911 O VAL A 626 ? O VAL A 934 D 1 2 O ILE C 295 ? O ILE C 603 N CYS C 272 ? N CYS C 580 D 2 3 O TYR C 273 ? O TYR C 581 N TYR C 242 ? N TYR C 550 D 3 4 N GLY C 241 ? N GLY C 549 O VAL C 319 ? O VAL C 627 D 4 5 N ASN C 320 ? N ASN C 628 O ALA C 342 ? O ALA C 650 D 5 6 N MET C 343 ? N MET C 651 O ILE C 360 ? O ILE C 668 D 6 7 N THR C 361 ? N THR C 669 O ALA C 379 ? O ALA C 687 E 1 2 N LYS C 434 ? N LYS C 742 O VAL C 458 ? O VAL C 766 E 2 3 O ILE C 459 ? O ILE C 767 N VAL C 402 ? N VAL C 710 E 3 4 N ALA C 401 ? N ALA C 709 O LEU C 418 ? O LEU C 726 E 4 5 N VAL C 417 ? N VAL C 725 O THR C 512 ? O THR C 820 E 5 6 O ILE C 509 ? O ILE C 817 N SER C 487 ? N SER C 795 E 6 7 O ILE C 486 ? O ILE C 794 N ILE C 479 ? N ILE C 787 F 1 2 O ILE C 583 ? O ILE C 891 N LEU C 555 ? N LEU C 863 F 2 3 O TRP C 556 ? O TRP C 864 N TYR C 526 ? N TYR C 834 F 3 4 N CYS C 527 ? N CYS C 835 O LEU C 604 ? O LEU C 912 F 4 5 N CYS C 603 ? N CYS C 911 O VAL C 626 ? O VAL C 934 # 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 ? ? ? ? 22 'BINDING SITE FOR RESIDUE UDP A 1101' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 A 1102' AC3 Software ? ? ? ? 13 'BINDING SITE FOR RESIDUE 0YT B 101' AC4 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE SO4 B 102' AC5 Software ? ? ? ? 22 'BINDING SITE FOR RESIDUE UDP C 1101' AC6 Software ? ? ? ? 13 'BINDING SITE FOR RESIDUE 0YT D 101' AC7 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SO4 D 102' AC8 Software ? ? ? ? 27 'BINDING SITE FOR CHAIN B OF CASEIN KINASE II SUBUNIT ALPHA' AC9 Software ? ? ? ? 33 'BINDING SITE FOR CHAIN D OF CASEIN KINASE II SUBUNIT ALPHA' # 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 22 PRO A 251 ? PRO A 559 . ? 1_555 ? 2 AC1 22 GLN A 531 ? GLN A 839 . ? 1_555 ? 3 AC1 22 LYS A 534 ? LYS A 842 . ? 1_555 ? 4 AC1 22 LEU A 558 ? LEU A 866 . ? 1_555 ? 5 AC1 22 VAL A 587 ? VAL A 895 . ? 1_555 ? 6 AC1 22 ALA A 588 ? ALA A 896 . ? 1_555 ? 7 AC1 22 LYS A 590 ? LYS A 898 . ? 1_555 ? 8 AC1 22 HIS A 593 ? HIS A 901 . ? 1_555 ? 9 AC1 22 ARG A 596 ? ARG A 904 . ? 1_555 ? 10 AC1 22 HIS A 612 ? HIS A 920 . ? 1_555 ? 11 AC1 22 THR A 613 ? THR A 921 . ? 1_555 ? 12 AC1 22 THR A 614 ? THR A 922 . ? 1_555 ? 13 AC1 22 ASP A 617 ? ASP A 925 . ? 1_555 ? 14 AC1 22 HOH L . ? HOH A 1204 . ? 1_555 ? 15 AC1 22 HOH L . ? HOH A 1214 . ? 1_555 ? 16 AC1 22 HOH L . ? HOH A 1384 . ? 1_555 ? 17 AC1 22 THR B 6 ? THR B 18 . ? 1_555 ? 18 AC1 22 PRO B 7 ? PRO B 19 . ? 1_555 ? 19 AC1 22 VAL B 8 ? VAL B 20 . ? 1_555 ? 20 AC1 22 SER B 9 ? SER B 21 . ? 1_555 ? 21 AC1 22 0YT G . ? 0YT B 101 . ? 1_555 ? 22 AC1 22 HOH M . ? HOH B 201 . ? 1_555 ? 23 AC2 4 GLY A 57 ? GLY A 365 . ? 1_555 ? 24 AC2 4 LEU A 59 ? LEU A 367 . ? 1_555 ? 25 AC2 4 GLN A 60 ? GLN A 368 . ? 1_555 ? 26 AC2 4 HOH L . ? HOH A 1574 . ? 1_555 ? 27 AC3 13 HIS A 190 ? HIS A 498 . ? 1_555 ? 28 AC3 13 THR A 252 ? THR A 560 . ? 1_555 ? 29 AC3 13 LEU A 255 ? LEU A 563 . ? 1_555 ? 30 AC3 13 LEU A 345 ? LEU A 653 . ? 1_555 ? 31 AC3 13 GLY A 346 ? GLY A 654 . ? 1_555 ? 32 AC3 13 PRO A 348 ? PRO A 656 . ? 1_555 ? 33 AC3 13 PHE A 386 ? PHE A 694 . ? 1_555 ? 34 AC3 13 TYR A 533 ? TYR A 841 . ? 1_555 ? 35 AC3 13 HIS A 612 ? HIS A 920 . ? 1_555 ? 36 AC3 13 THR A 613 ? THR A 921 . ? 1_555 ? 37 AC3 13 UDP E . ? UDP A 1101 . ? 1_555 ? 38 AC3 13 HOH L . ? HOH A 1317 . ? 1_555 ? 39 AC3 13 SER B 9 ? SER B 21 . ? 1_555 ? 40 AC4 3 GLY A 327 ? GLY A 635 . ? 1_555 ? 41 AC4 3 ASN B 12 ? ASN B 24 . ? 1_555 ? 42 AC4 3 MET B 13 ? MET B 25 . ? 1_555 ? 43 AC5 22 PRO C 251 ? PRO C 559 . ? 1_555 ? 44 AC5 22 GLN C 531 ? GLN C 839 . ? 1_555 ? 45 AC5 22 LYS C 534 ? LYS C 842 . ? 1_555 ? 46 AC5 22 LEU C 558 ? LEU C 866 . ? 1_555 ? 47 AC5 22 VAL C 587 ? VAL C 895 . ? 1_555 ? 48 AC5 22 ALA C 588 ? ALA C 896 . ? 1_555 ? 49 AC5 22 LYS C 590 ? LYS C 898 . ? 1_555 ? 50 AC5 22 HIS C 593 ? HIS C 901 . ? 1_555 ? 51 AC5 22 ARG C 596 ? ARG C 904 . ? 1_555 ? 52 AC5 22 HIS C 612 ? HIS C 920 . ? 1_555 ? 53 AC5 22 THR C 613 ? THR C 921 . ? 1_555 ? 54 AC5 22 THR C 614 ? THR C 922 . ? 1_555 ? 55 AC5 22 ASP C 617 ? ASP C 925 . ? 1_555 ? 56 AC5 22 HOH N . ? HOH C 1202 . ? 1_555 ? 57 AC5 22 HOH N . ? HOH C 1213 . ? 1_555 ? 58 AC5 22 HOH N . ? HOH C 1391 . ? 1_555 ? 59 AC5 22 THR D 6 ? THR D 18 . ? 1_555 ? 60 AC5 22 PRO D 7 ? PRO D 19 . ? 1_555 ? 61 AC5 22 VAL D 8 ? VAL D 20 . ? 1_555 ? 62 AC5 22 SER D 9 ? SER D 21 . ? 1_555 ? 63 AC5 22 0YT J . ? 0YT D 101 . ? 1_555 ? 64 AC5 22 HOH O . ? HOH D 202 . ? 1_555 ? 65 AC6 13 HIS C 190 ? HIS C 498 . ? 1_555 ? 66 AC6 13 THR C 252 ? THR C 560 . ? 1_555 ? 67 AC6 13 LEU C 255 ? LEU C 563 . ? 1_555 ? 68 AC6 13 LEU C 345 ? LEU C 653 . ? 1_555 ? 69 AC6 13 GLY C 346 ? GLY C 654 . ? 1_555 ? 70 AC6 13 PRO C 348 ? PRO C 656 . ? 1_555 ? 71 AC6 13 PHE C 386 ? PHE C 694 . ? 1_555 ? 72 AC6 13 TYR C 533 ? TYR C 841 . ? 1_555 ? 73 AC6 13 HIS C 612 ? HIS C 920 . ? 1_555 ? 74 AC6 13 THR C 613 ? THR C 921 . ? 1_555 ? 75 AC6 13 UDP I . ? UDP C 1101 . ? 1_555 ? 76 AC6 13 HOH N . ? HOH C 1322 . ? 1_555 ? 77 AC6 13 SER D 9 ? SER D 21 . ? 1_555 ? 78 AC7 4 GLY C 327 ? GLY C 635 . ? 1_555 ? 79 AC7 4 HOH N . ? HOH C 1462 . ? 1_555 ? 80 AC7 4 ASN D 12 ? ASN D 24 . ? 1_555 ? 81 AC7 4 MET D 13 ? MET D 25 . ? 1_555 ? 82 AC8 27 LEU A 63 ? LEU A 371 . ? 2_555 ? 83 AC8 27 LEU A 87 ? LEU A 395 . ? 2_555 ? 84 AC8 27 LYS A 88 ? LYS A 396 . ? 1_555 ? 85 AC8 27 ASP A 92 ? ASP A 400 . ? 2_555 ? 86 AC8 27 SER A 186 ? SER A 494 . ? 1_555 ? 87 AC8 27 HIS A 188 ? HIS A 496 . ? 1_555 ? 88 AC8 27 HIS A 209 ? HIS A 517 . ? 1_555 ? 89 AC8 27 ASN A 249 ? ASN A 557 . ? 1_555 ? 90 AC8 27 HIS A 250 ? HIS A 558 . ? 1_555 ? 91 AC8 27 PRO A 251 ? PRO A 559 . ? 1_555 ? 92 AC8 27 TYR A 324 ? TYR A 632 . ? 1_555 ? 93 AC8 27 THR A 325 ? THR A 633 . ? 1_555 ? 94 AC8 27 LYS A 326 ? LYS A 634 . ? 1_555 ? 95 AC8 27 GLN A 531 ? GLN A 839 . ? 1_555 ? 96 AC8 27 VAL A 587 ? VAL A 895 . ? 1_555 ? 97 AC8 27 UDP E . ? UDP A 1101 . ? 1_555 ? 98 AC8 27 HOH L . ? HOH A 1214 . ? 1_555 ? 99 AC8 27 HOH L . ? HOH A 1384 . ? 1_555 ? 100 AC8 27 HOH L . ? HOH A 1397 . ? 1_555 ? 101 AC8 27 TYR B 1 ? TYR B 13 . ? 1_555 ? 102 AC8 27 0YT G . ? 0YT B 101 . ? 1_555 ? 103 AC8 27 SO4 H . ? SO4 B 102 . ? 1_555 ? 104 AC8 27 HOH M . ? HOH B 201 . ? 1_555 ? 105 AC8 27 HOH M . ? HOH B 202 . ? 1_555 ? 106 AC8 27 HOH M . ? HOH B 203 . ? 1_555 ? 107 AC8 27 HOH M . ? HOH B 204 . ? 1_555 ? 108 AC8 27 HOH M . ? HOH B 207 . ? 1_555 ? 109 AC9 33 LEU C 63 ? LEU C 371 . ? 2_555 ? 110 AC9 33 LEU C 87 ? LEU C 395 . ? 2_555 ? 111 AC9 33 ASP C 92 ? ASP C 400 . ? 2_555 ? 112 AC9 33 ASP C 123 ? ASP C 431 . ? 1_555 ? 113 AC9 33 SER C 186 ? SER C 494 . ? 1_555 ? 114 AC9 33 HIS C 188 ? HIS C 496 . ? 1_555 ? 115 AC9 33 HIS C 209 ? HIS C 517 . ? 1_555 ? 116 AC9 33 ASN C 249 ? ASN C 557 . ? 1_555 ? 117 AC9 33 HIS C 250 ? HIS C 558 . ? 1_555 ? 118 AC9 33 PRO C 251 ? PRO C 559 . ? 1_555 ? 119 AC9 33 TYR C 324 ? TYR C 632 . ? 1_555 ? 120 AC9 33 THR C 325 ? THR C 633 . ? 1_555 ? 121 AC9 33 LYS C 326 ? LYS C 634 . ? 1_555 ? 122 AC9 33 GLN C 531 ? GLN C 839 . ? 1_555 ? 123 AC9 33 VAL C 587 ? VAL C 895 . ? 1_555 ? 124 AC9 33 ALA C 588 ? ALA C 896 . ? 1_555 ? 125 AC9 33 PRO C 589 ? PRO C 897 . ? 1_555 ? 126 AC9 33 UDP I . ? UDP C 1101 . ? 1_555 ? 127 AC9 33 HOH N . ? HOH C 1213 . ? 1_555 ? 128 AC9 33 HOH N . ? HOH C 1391 . ? 1_555 ? 129 AC9 33 HOH N . ? HOH C 1462 . ? 1_555 ? 130 AC9 33 0YT J . ? 0YT D 101 . ? 1_555 ? 131 AC9 33 SO4 K . ? SO4 D 102 . ? 1_555 ? 132 AC9 33 HOH O . ? HOH D 202 . ? 1_555 ? 133 AC9 33 HOH O . ? HOH D 203 . ? 1_555 ? 134 AC9 33 HOH O . ? HOH D 204 . ? 1_555 ? 135 AC9 33 HOH O . ? HOH D 205 . ? 1_555 ? 136 AC9 33 HOH O . ? HOH D 206 . ? 1_555 ? 137 AC9 33 HOH O . ? HOH D 207 . ? 1_555 ? 138 AC9 33 HOH O . ? HOH D 209 . ? 1_555 ? 139 AC9 33 HOH O . ? HOH D 210 . ? 1_555 ? 140 AC9 33 HOH O . ? HOH D 211 . ? 1_555 ? 141 AC9 33 HOH O . ? HOH D 212 . ? 1_555 ? # _database_PDB_matrix.entry_id 4GZ3 _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 4GZ3 _atom_sites.fract_transf_matrix[1][1] 0.010125 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.002304 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.007266 _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] 0.006702 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O P S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . PRO A 1 6 ? -1.247 41.125 -43.072 1.00 91.26 ? 314 PRO A N 1 ATOM 2 C CA . PRO A 1 6 ? -1.503 42.331 -42.278 1.00 90.50 ? 314 PRO A CA 1 ATOM 3 C C . PRO A 1 6 ? -2.953 42.796 -42.399 1.00 86.38 ? 314 PRO A C 1 ATOM 4 O O . PRO A 1 6 ? -3.706 42.710 -41.429 1.00 84.31 ? 314 PRO A O 1 ATOM 5 C CB . PRO A 1 6 ? -0.560 43.361 -42.902 1.00 95.84 ? 314 PRO A CB 1 ATOM 6 C CG . PRO A 1 6 ? 0.569 42.547 -43.432 1.00 97.41 ? 314 PRO A CG 1 ATOM 7 C CD . PRO A 1 6 ? -0.050 41.265 -43.919 1.00 95.10 ? 314 PRO A CD 1 ATOM 8 N N . THR A 1 7 ? -3.332 43.284 -43.576 1.00 84.70 ? 315 THR A N 1 ATOM 9 C CA . THR A 1 7 ? -4.704 43.715 -43.819 1.00 80.88 ? 315 THR A CA 1 ATOM 10 C C . THR A 1 7 ? -5.633 42.505 -43.846 1.00 74.42 ? 315 THR A C 1 ATOM 11 O O . THR A 1 7 ? -6.758 42.558 -43.344 1.00 72.24 ? 315 THR A O 1 ATOM 12 C CB . THR A 1 7 ? -4.829 44.485 -45.148 1.00 84.58 ? 315 THR A CB 1 ATOM 13 O OG1 . THR A 1 7 ? -3.894 45.572 -45.164 1.00 88.22 ? 315 THR A OG1 1 ATOM 14 C CG2 . THR A 1 7 ? -6.238 45.033 -45.321 1.00 83.76 ? 315 THR A CG2 1 ATOM 15 N N . HIS A 1 8 ? -5.148 41.416 -44.434 1.00 71.22 ? 316 HIS A N 1 ATOM 16 C CA . HIS A 1 8 ? -5.896 40.164 -44.494 1.00 66.27 ? 316 HIS A CA 1 ATOM 17 C C . HIS A 1 8 ? -6.056 39.567 -43.097 1.00 58.41 ? 316 HIS A C 1 ATOM 18 O O . HIS A 1 8 ? -7.091 38.980 -42.772 1.00 54.66 ? 316 HIS A O 1 ATOM 19 C CB . HIS A 1 8 ? -5.185 39.173 -45.420 1.00 68.24 ? 316 HIS A CB 1 ATOM 20 C CG . HIS A 1 8 ? -5.876 37.849 -45.542 1.00 67.64 ? 316 HIS A CG 1 ATOM 21 N ND1 . HIS A 1 8 ? -7.212 37.675 -45.254 1.00 67.08 ? 316 HIS A ND1 1 ATOM 22 C CD2 . HIS A 1 8 ? -5.411 36.635 -45.920 1.00 67.57 ? 316 HIS A CD2 1 ATOM 23 C CE1 . HIS A 1 8 ? -7.541 36.411 -45.450 1.00 65.70 ? 316 HIS A CE1 1 ATOM 24 N NE2 . HIS A 1 8 ? -6.467 35.758 -45.855 1.00 66.51 ? 316 HIS A NE2 1 ATOM 25 N N . ALA A 1 9 ? -5.028 39.723 -42.271 1.00 55.74 ? 317 ALA A N 1 ATOM 26 C CA . ALA A 1 9 ? -5.080 39.234 -40.899 1.00 52.65 ? 317 ALA A CA 1 ATOM 27 C C . ALA A 1 9 ? -6.098 40.022 -40.082 1.00 51.46 ? 317 ALA A C 1 ATOM 28 O O . ALA A 1 9 ? -6.753 39.472 -39.197 1.00 50.70 ? 317 ALA A O 1 ATOM 29 C CB . ALA A 1 9 ? -3.713 39.313 -40.257 1.00 54.00 ? 317 ALA A CB 1 ATOM 30 N N . ASP A 1 10 ? -6.219 41.311 -40.385 1.00 52.62 ? 318 ASP A N 1 ATOM 31 C CA . ASP A 1 10 ? -7.202 42.170 -39.735 1.00 55.47 ? 318 ASP A CA 1 ATOM 32 C C . ASP A 1 10 ? -8.621 41.661 -39.942 1.00 54.13 ? 318 ASP A C 1 ATOM 33 O O . ASP A 1 10 ? -9.396 41.562 -38.991 1.00 50.82 ? 318 ASP A O 1 ATOM 34 C CB . ASP A 1 10 ? -7.096 43.604 -40.258 1.00 60.52 ? 318 ASP A CB 1 ATOM 35 C CG . ASP A 1 10 ? -6.201 44.469 -39.402 1.00 65.19 ? 318 ASP A CG 1 ATOM 36 O OD1 . ASP A 1 10 ? -6.137 44.223 -38.179 1.00 66.62 ? 318 ASP A OD1 1 ATOM 37 O OD2 . ASP A 1 10 ? -5.562 45.394 -39.949 1.00 67.78 ? 318 ASP A OD2 1 ATOM 38 N N A SER A 1 11 ? -8.956 41.340 -41.189 0.56 55.43 ? 319 SER A N 1 ATOM 39 N N B SER A 1 11 ? -8.953 41.341 -41.189 0.44 55.43 ? 319 SER A N 1 ATOM 40 C CA A SER A 1 11 ? -10.294 40.864 -41.527 0.56 55.18 ? 319 SER A CA 1 ATOM 41 C CA B SER A 1 11 ? -10.286 40.860 -41.535 0.44 55.18 ? 319 SER A CA 1 ATOM 42 C C A SER A 1 11 ? -10.576 39.492 -40.921 0.56 52.83 ? 319 SER A C 1 ATOM 43 C C B SER A 1 11 ? -10.570 39.499 -40.909 0.44 52.84 ? 319 SER A C 1 ATOM 44 O O A SER A 1 11 ? -11.705 39.198 -40.529 0.56 52.58 ? 319 SER A O 1 ATOM 45 O O B SER A 1 11 ? -11.695 39.220 -40.493 0.44 52.54 ? 319 SER A O 1 ATOM 46 C CB A SER A 1 11 ? -10.491 40.831 -43.046 0.56 57.13 ? 319 SER A CB 1 ATOM 47 C CB B SER A 1 11 ? -10.448 40.783 -43.055 0.44 57.09 ? 319 SER A CB 1 ATOM 48 O OG A SER A 1 11 ? -9.531 40.000 -43.676 0.56 57.27 ? 319 SER A OG 1 ATOM 49 O OG B SER A 1 11 ? -10.243 42.050 -43.653 0.44 59.70 ? 319 SER A OG 1 ATOM 50 N N . LEU A 1 12 ? -9.545 38.657 -40.845 1.00 51.00 ? 320 LEU A N 1 ATOM 51 C CA . LEU A 1 12 ? -9.679 37.338 -40.240 1.00 50.38 ? 320 LEU A CA 1 ATOM 52 C C . LEU A 1 12 ? -9.982 37.466 -38.753 1.00 47.63 ? 320 LEU A C 1 ATOM 53 O O . LEU A 1 12 ? -10.863 36.782 -38.228 1.00 46.16 ? 320 LEU A O 1 ATOM 54 C CB . LEU A 1 12 ? -8.413 36.512 -40.460 1.00 51.86 ? 320 LEU A CB 1 ATOM 55 C CG . LEU A 1 12 ? -8.216 35.993 -41.885 1.00 54.05 ? 320 LEU A CG 1 ATOM 56 C CD1 . LEU A 1 12 ? -6.809 35.459 -42.073 1.00 53.25 ? 320 LEU A CD1 1 ATOM 57 C CD2 . LEU A 1 12 ? -9.246 34.915 -42.193 1.00 55.09 ? 320 LEU A CD2 1 ATOM 58 N N . ASN A 1 13 ? -9.252 38.353 -38.082 1.00 47.71 ? 321 ASN A N 1 ATOM 59 C CA . ASN A 1 13 ? -9.490 38.632 -36.670 1.00 47.69 ? 321 ASN A CA 1 ATOM 60 C C . ASN A 1 13 ? -10.869 39.256 -36.467 1.00 49.68 ? 321 ASN A C 1 ATOM 61 O O . ASN A 1 13 ? -11.552 38.968 -35.484 1.00 49.94 ? 321 ASN A O 1 ATOM 62 C CB . ASN A 1 13 ? -8.390 39.540 -36.109 1.00 47.22 ? 321 ASN A CB 1 ATOM 63 C CG . ASN A 1 13 ? -8.609 39.898 -34.648 1.00 44.82 ? 321 ASN A CG 1 ATOM 64 O OD1 . ASN A 1 13 ? -8.461 39.057 -33.761 1.00 43.67 ? 321 ASN A OD1 1 ATOM 65 N ND2 . ASN A 1 13 ? -8.948 41.157 -34.392 1.00 46.38 ? 321 ASN A ND2 1 ATOM 66 N N . ASN A 1 14 ? -11.274 40.102 -37.409 1.00 48.86 ? 322 ASN A N 1 ATOM 67 C CA . ASN A 1 14 ? -12.607 40.697 -37.384 1.00 53.26 ? 322 ASN A CA 1 ATOM 68 C C . ASN A 1 14 ? -13.711 39.646 -37.495 1.00 51.57 ? 322 ASN A C 1 ATOM 69 O O . ASN A 1 14 ? -14.681 39.673 -36.736 1.00 52.62 ? 322 ASN A O 1 ATOM 70 C CB . ASN A 1 14 ? -12.759 41.729 -38.504 1.00 58.37 ? 322 ASN A CB 1 ATOM 71 C CG . ASN A 1 14 ? -14.146 42.343 -38.545 1.00 63.99 ? 322 ASN A CG 1 ATOM 72 O OD1 . ASN A 1 14 ? -14.810 42.477 -37.515 1.00 65.25 ? 322 ASN A OD1 1 ATOM 73 N ND2 . ASN A 1 14 ? -14.595 42.715 -39.740 1.00 67.33 ? 322 ASN A ND2 1 ATOM 74 N N . LEU A 1 15 ? -13.559 38.727 -38.445 1.00 49.70 ? 323 LEU A N 1 ATOM 75 C CA . LEU A 1 15 ? -14.533 37.657 -38.641 1.00 50.93 ? 323 LEU A CA 1 ATOM 76 C C . LEU A 1 15 ? -14.631 36.771 -37.413 1.00 48.97 ? 323 LEU A C 1 ATOM 77 O O . LEU A 1 15 ? -15.713 36.316 -37.047 1.00 45.68 ? 323 LEU A O 1 ATOM 78 C CB . LEU A 1 15 ? -14.147 36.787 -39.830 1.00 53.35 ? 323 LEU A CB 1 ATOM 79 C CG . LEU A 1 15 ? -14.337 37.356 -41.228 1.00 57.00 ? 323 LEU A CG 1 ATOM 80 C CD1 . LEU A 1 15 ? -14.039 36.260 -42.221 1.00 58.28 ? 323 LEU A CD1 1 ATOM 81 C CD2 . LEU A 1 15 ? -15.751 37.892 -41.408 1.00 57.75 ? 323 LEU A CD2 1 ATOM 82 N N . ALA A 1 16 ? -13.483 36.516 -36.794 1.00 46.28 ? 324 ALA A N 1 ATOM 83 C CA . ALA A 1 16 ? -13.430 35.687 -35.603 1.00 43.91 ? 324 ALA A CA 1 ATOM 84 C C . ALA A 1 16 ? -14.224 36.325 -34.469 1.00 44.00 ? 324 ALA A C 1 ATOM 85 O O . ALA A 1 16 ? -14.987 35.647 -33.787 1.00 44.36 ? 324 ALA A O 1 ATOM 86 C CB . ALA A 1 16 ? -11.993 35.456 -35.188 1.00 42.01 ? 324 ALA A CB 1 ATOM 87 N N . ASN A 1 17 ? -14.037 37.628 -34.272 1.00 47.36 ? 325 ASN A N 1 ATOM 88 C CA . ASN A 1 17 ? -14.803 38.373 -33.277 1.00 48.80 ? 325 ASN A CA 1 ATOM 89 C C . ASN A 1 17 ? -16.303 38.242 -33.521 1.00 50.91 ? 325 ASN A C 1 ATOM 90 O O . ASN A 1 17 ? -17.084 38.092 -32.581 1.00 50.47 ? 325 ASN A O 1 ATOM 91 C CB . ASN A 1 17 ? -14.415 39.854 -33.283 1.00 49.80 ? 325 ASN A CB 1 ATOM 92 C CG . ASN A 1 17 ? -12.982 40.088 -32.846 1.00 49.47 ? 325 ASN A CG 1 ATOM 93 O OD1 . ASN A 1 17 ? -12.392 39.274 -32.135 1.00 48.28 ? 325 ASN A OD1 1 ATOM 94 N ND2 . ASN A 1 17 ? -12.417 41.215 -33.266 1.00 50.02 ? 325 ASN A ND2 1 ATOM 95 N N . ILE A 1 18 ? -16.693 38.297 -34.791 1.00 53.32 ? 326 ILE A N 1 ATOM 96 C CA . ILE A 1 18 ? -18.098 38.184 -35.177 1.00 56.85 ? 326 ILE A CA 1 ATOM 97 C C . ILE A 1 18 ? -18.658 36.813 -34.804 1.00 59.94 ? 326 ILE A C 1 ATOM 98 O O . ILE A 1 18 ? -19.664 36.712 -34.099 1.00 60.75 ? 326 ILE A O 1 ATOM 99 C CB . ILE A 1 18 ? -18.288 38.422 -36.688 1.00 55.75 ? 326 ILE A CB 1 ATOM 100 C CG1 . ILE A 1 18 ? -17.865 39.844 -37.061 1.00 56.98 ? 326 ILE A CG1 1 ATOM 101 C CG2 . ILE A 1 18 ? -19.736 38.188 -37.089 1.00 55.24 ? 326 ILE A CG2 1 ATOM 102 C CD1 . ILE A 1 18 ? -17.843 40.099 -38.547 1.00 50.49 ? 326 ILE A CD1 1 ATOM 103 N N . LYS A 1 19 ? -17.992 35.762 -35.274 1.00 61.67 ? 327 LYS A N 1 ATOM 104 C CA . LYS A 1 19 ? -18.400 34.393 -34.976 1.00 63.97 ? 327 LYS A CA 1 ATOM 105 C C . LYS A 1 19 ? -18.377 34.126 -33.472 1.00 62.85 ? 327 LYS A C 1 ATOM 106 O O . LYS A 1 19 ? -19.159 33.322 -32.961 1.00 63.26 ? 327 LYS A O 1 ATOM 107 C CB . LYS A 1 19 ? -17.498 33.397 -35.709 1.00 65.46 ? 327 LYS A CB 1 ATOM 108 C CG . LYS A 1 19 ? -18.224 32.546 -36.738 1.00 69.76 ? 327 LYS A CG 1 ATOM 109 C CD . LYS A 1 19 ? -18.905 33.402 -37.791 1.00 73.14 ? 327 LYS A CD 1 ATOM 110 C CE . LYS A 1 19 ? -19.703 32.543 -38.757 1.00 77.44 ? 327 LYS A CE 1 ATOM 111 N NZ . LYS A 1 19 ? -20.762 31.763 -38.057 1.00 80.29 ? 327 LYS A NZ 1 ATOM 112 N N . ARG A 1 20 ? -17.477 34.810 -32.773 1.00 61.52 ? 328 ARG A N 1 ATOM 113 C CA . ARG A 1 20 ? -17.394 34.725 -31.321 1.00 62.40 ? 328 ARG A CA 1 ATOM 114 C C . ARG A 1 20 ? -18.678 35.241 -30.681 1.00 64.88 ? 328 ARG A C 1 ATOM 115 O O . ARG A 1 20 ? -19.243 34.599 -29.796 1.00 65.65 ? 328 ARG A O 1 ATOM 116 C CB . ARG A 1 20 ? -16.190 35.521 -30.813 1.00 61.74 ? 328 ARG A CB 1 ATOM 117 C CG . ARG A 1 20 ? -16.061 35.576 -29.301 1.00 63.44 ? 328 ARG A CG 1 ATOM 118 C CD . ARG A 1 20 ? -14.817 36.349 -28.885 1.00 65.71 ? 328 ARG A CD 1 ATOM 119 N NE . ARG A 1 20 ? -14.659 36.388 -27.433 1.00 70.18 ? 328 ARG A NE 1 ATOM 120 C CZ . ARG A 1 20 ? -13.551 36.775 -26.806 1.00 71.37 ? 328 ARG A CZ 1 ATOM 121 N NH1 . ARG A 1 20 ? -12.485 37.151 -27.501 1.00 70.02 ? 328 ARG A NH1 1 ATOM 122 N NH2 . ARG A 1 20 ? -13.505 36.775 -25.481 1.00 73.33 ? 328 ARG A NH2 1 ATOM 123 N N . GLU A 1 21 ? -19.139 36.400 -31.141 1.00 67.26 ? 329 GLU A N 1 ATOM 124 C CA . GLU A 1 21 ? -20.357 37.007 -30.613 1.00 72.58 ? 329 GLU A CA 1 ATOM 125 C C . GLU A 1 21 ? -21.589 36.156 -30.908 1.00 74.33 ? 329 GLU A C 1 ATOM 126 O O . GLU A 1 21 ? -22.528 36.113 -30.114 1.00 77.24 ? 329 GLU A O 1 ATOM 127 C CB . GLU A 1 21 ? -20.541 38.421 -31.173 1.00 75.69 ? 329 GLU A CB 1 ATOM 128 C CG . GLU A 1 21 ? -19.424 39.381 -30.800 1.00 77.01 ? 329 GLU A CG 1 ATOM 129 C CD . GLU A 1 21 ? -19.244 39.513 -29.298 1.00 80.34 ? 329 GLU A CD 1 ATOM 130 O OE1 . GLU A 1 21 ? -20.264 39.593 -28.580 1.00 83.23 ? 329 GLU A OE1 1 ATOM 131 O OE2 . GLU A 1 21 ? -18.082 39.530 -28.836 1.00 79.37 ? 329 GLU A OE2 1 ATOM 132 N N . GLN A 1 22 ? -21.574 35.474 -32.050 1.00 73.56 ? 330 GLN A N 1 ATOM 133 C CA . GLN A 1 22 ? -22.670 34.589 -32.432 1.00 76.07 ? 330 GLN A CA 1 ATOM 134 C C . GLN A 1 22 ? -22.718 33.353 -31.539 1.00 77.75 ? 330 GLN A C 1 ATOM 135 O O . GLN A 1 22 ? -23.727 32.649 -31.491 1.00 80.72 ? 330 GLN A O 1 ATOM 136 C CB . GLN A 1 22 ? -22.527 34.161 -33.892 1.00 75.89 ? 330 GLN A CB 1 ATOM 137 C CG . GLN A 1 22 ? -22.515 35.308 -34.885 1.00 77.02 ? 330 GLN A CG 1 ATOM 138 C CD . GLN A 1 22 ? -22.218 34.841 -36.294 1.00 78.45 ? 330 GLN A CD 1 ATOM 139 O OE1 . GLN A 1 22 ? -22.228 33.643 -36.578 1.00 79.64 ? 330 GLN A OE1 1 ATOM 140 N NE2 . GLN A 1 22 ? -21.942 35.784 -37.185 1.00 78.47 ? 330 GLN A NE2 1 ATOM 141 N N . GLY A 1 23 ? -21.620 33.089 -30.840 1.00 75.87 ? 331 GLY A N 1 ATOM 142 C CA . GLY A 1 23 ? -21.548 31.953 -29.943 1.00 75.26 ? 331 GLY A CA 1 ATOM 143 C C . GLY A 1 23 ? -20.780 30.793 -30.541 1.00 72.38 ? 331 GLY A C 1 ATOM 144 O O . GLY A 1 23 ? -20.556 29.781 -29.877 1.00 72.72 ? 331 GLY A O 1 ATOM 145 N N . ASN A 1 24 ? -20.380 30.936 -31.801 1.00 69.70 ? 332 ASN A N 1 ATOM 146 C CA . ASN A 1 24 ? -19.585 29.909 -32.460 1.00 67.74 ? 332 ASN A CA 1 ATOM 147 C C . ASN A 1 24 ? -18.132 29.993 -32.005 1.00 66.43 ? 332 ASN A C 1 ATOM 148 O O . ASN A 1 24 ? -17.275 30.529 -32.708 1.00 65.19 ? 332 ASN A O 1 ATOM 149 C CB . ASN A 1 24 ? -19.682 30.040 -33.980 1.00 66.58 ? 332 ASN A CB 1 ATOM 150 C CG . ASN A 1 24 ? -19.450 28.721 -34.693 1.00 65.89 ? 332 ASN A CG 1 ATOM 151 O OD1 . ASN A 1 24 ? -18.740 27.848 -34.193 1.00 64.10 ? 332 ASN A OD1 1 ATOM 152 N ND2 . ASN A 1 24 ? -20.050 28.570 -35.870 1.00 67.42 ? 332 ASN A ND2 1 ATOM 153 N N . ILE A 1 25 ? -17.872 29.461 -30.816 1.00 66.90 ? 333 ILE A N 1 ATOM 154 C CA . ILE A 1 25 ? -16.564 29.564 -30.181 1.00 64.37 ? 333 ILE A CA 1 ATOM 155 C C . ILE A 1 25 ? -15.468 28.857 -30.975 1.00 60.90 ? 333 ILE A C 1 ATOM 156 O O . ILE A 1 25 ? -14.364 29.381 -31.120 1.00 60.64 ? 333 ILE A O 1 ATOM 157 C CB . ILE A 1 25 ? -16.605 29.014 -28.740 1.00 67.51 ? 333 ILE A CB 1 ATOM 158 C CG1 . ILE A 1 25 ? -17.678 29.742 -27.928 1.00 71.35 ? 333 ILE A CG1 1 ATOM 159 C CG2 . ILE A 1 25 ? -15.252 29.152 -28.067 1.00 66.06 ? 333 ILE A CG2 1 ATOM 160 C CD1 . ILE A 1 25 ? -17.479 31.242 -27.861 1.00 71.98 ? 333 ILE A CD1 1 ATOM 161 N N . GLU A 1 26 ? -15.773 27.675 -31.501 1.00 59.93 ? 334 GLU A N 1 ATOM 162 C CA . GLU A 1 26 ? -14.775 26.907 -32.239 1.00 59.26 ? 334 GLU A CA 1 ATOM 163 C C . GLU A 1 26 ? -14.426 27.531 -33.592 1.00 56.51 ? 334 GLU A C 1 ATOM 164 O O . GLU A 1 26 ? -13.270 27.492 -34.016 1.00 51.46 ? 334 GLU A O 1 ATOM 165 C CB . GLU A 1 26 ? -15.209 25.447 -32.403 1.00 63.82 ? 334 GLU A CB 1 ATOM 166 C CG . GLU A 1 26 ? -15.337 24.677 -31.088 1.00 67.63 ? 334 GLU A CG 1 ATOM 167 C CD . GLU A 1 26 ? -14.008 24.488 -30.361 1.00 68.41 ? 334 GLU A CD 1 ATOM 168 O OE1 . GLU A 1 26 ? -12.939 24.753 -30.955 1.00 66.96 ? 334 GLU A OE1 1 ATOM 169 O OE2 . GLU A 1 26 ? -14.035 24.066 -29.185 1.00 69.84 ? 334 GLU A OE2 1 ATOM 170 N N . GLU A 1 27 ? -15.420 28.103 -34.267 1.00 57.23 ? 335 GLU A N 1 ATOM 171 C CA . GLU A 1 27 ? -15.167 28.829 -35.509 1.00 57.38 ? 335 GLU A CA 1 ATOM 172 C C . GLU A 1 27 ? -14.313 30.064 -35.248 1.00 52.56 ? 335 GLU A C 1 ATOM 173 O O . GLU A 1 27 ? -13.450 30.417 -36.056 1.00 50.27 ? 335 GLU A O 1 ATOM 174 C CB . GLU A 1 27 ? -16.476 29.235 -36.189 1.00 63.29 ? 335 GLU A CB 1 ATOM 175 C CG . GLU A 1 27 ? -16.939 28.271 -37.267 1.00 69.42 ? 335 GLU A CG 1 ATOM 176 C CD . GLU A 1 27 ? -15.987 28.220 -38.448 1.00 72.07 ? 335 GLU A CD 1 ATOM 177 O OE1 . GLU A 1 27 ? -15.931 29.208 -39.214 1.00 72.21 ? 335 GLU A OE1 1 ATOM 178 O OE2 . GLU A 1 27 ? -15.292 27.193 -38.608 1.00 72.92 ? 335 GLU A OE2 1 ATOM 179 N N . ALA A 1 28 ? -14.564 30.718 -34.116 1.00 50.11 ? 336 ALA A N 1 ATOM 180 C CA . ALA A 1 28 ? -13.779 31.876 -33.708 1.00 47.97 ? 336 ALA A CA 1 ATOM 181 C C . ALA A 1 28 ? -12.322 31.477 -33.498 1.00 42.90 ? 336 ALA A C 1 ATOM 182 O O . ALA A 1 28 ? -11.414 32.165 -33.956 1.00 40.81 ? 336 ALA A O 1 ATOM 183 C CB . ALA A 1 28 ? -14.354 32.494 -32.442 1.00 49.55 ? 336 ALA A CB 1 ATOM 184 N N . VAL A 1 29 ? -12.110 30.357 -32.812 1.00 42.29 ? 337 VAL A N 1 ATOM 185 C CA . VAL A 1 29 ? -10.764 29.841 -32.586 1.00 40.11 ? 337 VAL A CA 1 ATOM 186 C C . VAL A 1 29 ? -10.050 29.559 -33.908 1.00 41.80 ? 337 VAL A C 1 ATOM 187 O O . VAL A 1 29 ? -8.921 30.008 -34.116 1.00 42.33 ? 337 VAL A O 1 ATOM 188 C CB . VAL A 1 29 ? -10.779 28.564 -31.720 1.00 40.63 ? 337 VAL A CB 1 ATOM 189 C CG1 . VAL A 1 29 ? -9.406 27.900 -31.713 1.00 38.32 ? 337 VAL A CG1 1 ATOM 190 C CG2 . VAL A 1 29 ? -11.219 28.892 -30.301 1.00 41.74 ? 337 VAL A CG2 1 ATOM 191 N N . ARG A 1 30 ? -10.716 28.829 -34.802 1.00 42.87 ? 338 ARG A N 1 ATOM 192 C CA . ARG A 1 30 ? -10.140 28.494 -36.103 1.00 42.73 ? 338 ARG A CA 1 ATOM 193 C C . ARG A 1 30 ? -9.744 29.746 -36.884 1.00 43.19 ? 338 ARG A C 1 ATOM 194 O O . ARG A 1 30 ? -8.699 29.776 -37.540 1.00 43.52 ? 338 ARG A O 1 ATOM 195 C CB . ARG A 1 30 ? -11.109 27.645 -36.929 1.00 44.65 ? 338 ARG A CB 1 ATOM 196 C CG . ARG A 1 30 ? -10.533 27.186 -38.264 1.00 47.11 ? 338 ARG A CG 1 ATOM 197 C CD . ARG A 1 30 ? -11.572 26.471 -39.124 1.00 50.76 ? 338 ARG A CD 1 ATOM 198 N NE . ARG A 1 30 ? -12.661 27.356 -39.531 1.00 53.24 ? 338 ARG A NE 1 ATOM 199 C CZ . ARG A 1 30 ? -12.612 28.167 -40.583 1.00 57.03 ? 338 ARG A CZ 1 ATOM 200 N NH1 . ARG A 1 30 ? -11.523 28.215 -41.340 1.00 59.33 ? 338 ARG A NH1 1 ATOM 201 N NH2 . ARG A 1 30 ? -13.652 28.936 -40.879 1.00 56.18 ? 338 ARG A NH2 1 ATOM 202 N N . LEU A 1 31 ? -10.576 30.780 -36.799 1.00 40.42 ? 339 LEU A N 1 ATOM 203 C CA . LEU A 1 31 ? -10.317 32.037 -37.496 1.00 42.37 ? 339 LEU A CA 1 ATOM 204 C C . LEU A 1 31 ? -9.181 32.853 -36.871 1.00 42.04 ? 339 LEU A C 1 ATOM 205 O O . LEU A 1 31 ? -8.390 33.469 -37.592 1.00 40.88 ? 339 LEU A O 1 ATOM 206 C CB . LEU A 1 31 ? -11.595 32.874 -37.595 1.00 43.70 ? 339 LEU A CB 1 ATOM 207 C CG . LEU A 1 31 ? -12.633 32.365 -38.599 1.00 47.65 ? 339 LEU A CG 1 ATOM 208 C CD1 . LEU A 1 31 ? -13.917 33.188 -38.541 1.00 49.10 ? 339 LEU A CD1 1 ATOM 209 C CD2 . LEU A 1 31 ? -12.047 32.382 -40.002 1.00 49.14 ? 339 LEU A CD2 1 ATOM 210 N N . TYR A 1 32 ? -9.108 32.869 -35.540 1.00 41.06 ? 340 TYR A N 1 ATOM 211 C CA . TYR A 1 32 ? -8.006 33.533 -34.851 1.00 39.47 ? 340 TYR A CA 1 ATOM 212 C C . TYR A 1 32 ? -6.692 32.885 -35.263 1.00 39.00 ? 340 TYR A C 1 ATOM 213 O O . TYR A 1 32 ? -5.706 33.572 -35.535 1.00 38.32 ? 340 TYR A O 1 ATOM 214 C CB . TYR A 1 32 ? -8.168 33.443 -33.333 1.00 39.38 ? 340 TYR A CB 1 ATOM 215 C CG . TYR A 1 32 ? -9.195 34.394 -32.757 1.00 42.68 ? 340 TYR A CG 1 ATOM 216 C CD1 . TYR A 1 32 ? -9.206 35.736 -33.115 1.00 45.94 ? 340 TYR A CD1 1 ATOM 217 C CD2 . TYR A 1 32 ? -10.157 33.948 -31.862 1.00 45.07 ? 340 TYR A CD2 1 ATOM 218 C CE1 . TYR A 1 32 ? -10.146 36.610 -32.593 1.00 47.58 ? 340 TYR A CE1 1 ATOM 219 C CE2 . TYR A 1 32 ? -11.104 34.812 -31.337 1.00 48.76 ? 340 TYR A CE2 1 ATOM 220 C CZ . TYR A 1 32 ? -11.094 36.141 -31.706 1.00 49.77 ? 340 TYR A CZ 1 ATOM 221 O OH . TYR A 1 32 ? -12.032 37.002 -31.181 1.00 51.51 ? 340 TYR A OH 1 ATOM 222 N N . ARG A 1 33 ? -6.692 31.556 -35.312 1.00 38.12 ? 341 ARG A N 1 ATOM 223 C CA . ARG A 1 33 ? -5.504 30.803 -35.698 1.00 39.97 ? 341 ARG A CA 1 ATOM 224 C C . ARG A 1 33 ? -5.096 31.093 -37.135 1.00 42.69 ? 341 ARG A C 1 ATOM 225 O O . ARG A 1 33 ? -3.909 31.107 -37.459 1.00 44.16 ? 341 ARG A O 1 ATOM 226 C CB . ARG A 1 33 ? -5.730 29.302 -35.515 1.00 41.83 ? 341 ARG A CB 1 ATOM 227 C CG . ARG A 1 33 ? -5.907 28.874 -34.066 1.00 40.16 ? 341 ARG A CG 1 ATOM 228 C CD . ARG A 1 33 ? -5.783 27.362 -33.929 1.00 42.04 ? 341 ARG A CD 1 ATOM 229 N NE . ARG A 1 33 ? -6.213 26.899 -32.613 1.00 41.51 ? 341 ARG A NE 1 ATOM 230 C CZ . ARG A 1 33 ? -5.442 26.890 -31.532 1.00 41.10 ? 341 ARG A CZ 1 ATOM 231 N NH1 . ARG A 1 33 ? -4.189 27.325 -31.600 1.00 40.97 ? 341 ARG A NH1 1 ATOM 232 N NH2 . ARG A 1 33 ? -5.927 26.449 -30.379 1.00 40.89 ? 341 ARG A NH2 1 ATOM 233 N N . LYS A 1 34 ? -6.085 31.318 -37.994 1.00 44.21 ? 342 LYS A N 1 ATOM 234 C CA . LYS A 1 34 ? -5.821 31.645 -39.388 1.00 47.80 ? 342 LYS A CA 1 ATOM 235 C C . LYS A 1 34 ? -5.181 33.027 -39.491 1.00 45.86 ? 342 LYS A C 1 ATOM 236 O O . LYS A 1 34 ? -4.270 33.235 -40.286 1.00 45.56 ? 342 LYS A O 1 ATOM 237 C CB . LYS A 1 34 ? -7.112 31.588 -40.208 1.00 52.45 ? 342 LYS A CB 1 ATOM 238 C CG . LYS A 1 34 ? -6.922 31.843 -41.691 1.00 58.99 ? 342 LYS A CG 1 ATOM 239 C CD . LYS A 1 34 ? -6.097 30.748 -42.349 1.00 63.46 ? 342 LYS A CD 1 ATOM 240 C CE . LYS A 1 34 ? -5.914 31.024 -43.832 1.00 69.96 ? 342 LYS A CE 1 ATOM 241 N NZ . LYS A 1 34 ? -5.128 29.959 -44.517 1.00 74.20 ? 342 LYS A NZ 1 ATOM 242 N N . ALA A 1 35 ? -5.654 33.961 -38.670 1.00 45.86 ? 343 ALA A N 1 ATOM 243 C CA . ALA A 1 35 ? -5.094 35.310 -38.634 1.00 45.63 ? 343 ALA A CA 1 ATOM 244 C C . ALA A 1 35 ? -3.631 35.287 -38.196 1.00 44.46 ? 343 ALA A C 1 ATOM 245 O O . ALA A 1 35 ? -2.803 36.051 -38.701 1.00 41.61 ? 343 ALA A O 1 ATOM 246 C CB . ALA A 1 35 ? -5.910 36.200 -37.710 1.00 43.04 ? 343 ALA A CB 1 ATOM 247 N N . LEU A 1 36 ? -3.319 34.401 -37.256 1.00 41.09 ? 344 LEU A N 1 ATOM 248 C CA . LEU A 1 36 ? -1.954 34.257 -36.767 1.00 41.03 ? 344 LEU A CA 1 ATOM 249 C C . LEU A 1 36 ? -1.077 33.602 -37.828 1.00 44.19 ? 344 LEU A C 1 ATOM 250 O O . LEU A 1 36 ? 0.115 33.891 -37.927 1.00 47.12 ? 344 LEU A O 1 ATOM 251 C CB . LEU A 1 36 ? -1.927 33.448 -35.466 1.00 37.29 ? 344 LEU A CB 1 ATOM 252 C CG . LEU A 1 36 ? -2.592 34.109 -34.254 1.00 36.36 ? 344 LEU A CG 1 ATOM 253 C CD1 . LEU A 1 36 ? -2.622 33.168 -33.054 1.00 32.67 ? 344 LEU A CD1 1 ATOM 254 C CD2 . LEU A 1 36 ? -1.885 35.411 -33.901 1.00 35.91 ? 344 LEU A CD2 1 ATOM 255 N N . GLU A 1 37 ? -1.678 32.725 -38.624 1.00 44.97 ? 345 GLU A N 1 ATOM 256 C CA . GLU A 1 37 ? -0.972 32.049 -39.705 1.00 48.22 ? 345 GLU A CA 1 ATOM 257 C C . GLU A 1 37 ? -0.584 33.040 -40.803 1.00 52.69 ? 345 GLU A C 1 ATOM 258 O O . GLU A 1 37 ? 0.437 32.875 -41.475 1.00 55.87 ? 345 GLU A O 1 ATOM 259 C CB . GLU A 1 37 ? -1.850 30.937 -40.287 1.00 50.14 ? 345 GLU A CB 1 ATOM 260 C CG . GLU A 1 37 ? -1.215 30.148 -41.422 1.00 54.00 ? 345 GLU A CG 1 ATOM 261 C CD . GLU A 1 37 ? -2.129 29.056 -41.948 1.00 58.26 ? 345 GLU A CD 1 ATOM 262 O OE1 . GLU A 1 37 ? -1.884 28.558 -43.069 1.00 61.12 ? 345 GLU A OE1 1 ATOM 263 O OE2 . GLU A 1 37 ? -3.092 28.696 -41.238 1.00 58.22 ? 345 GLU A OE2 1 ATOM 264 N N . VAL A 1 38 ? -1.406 34.070 -40.973 1.00 52.37 ? 346 VAL A N 1 ATOM 265 C CA . VAL A 1 38 ? -1.176 35.090 -41.991 1.00 55.54 ? 346 VAL A CA 1 ATOM 266 C C . VAL A 1 38 ? -0.223 36.175 -41.494 1.00 55.12 ? 346 VAL A C 1 ATOM 267 O O . VAL A 1 38 ? 0.649 36.634 -42.228 1.00 55.08 ? 346 VAL A O 1 ATOM 268 C CB . VAL A 1 38 ? -2.503 35.733 -42.434 1.00 58.58 ? 346 VAL A CB 1 ATOM 269 C CG1 . VAL A 1 38 ? -2.253 36.854 -43.433 1.00 62.90 ? 346 VAL A CG1 1 ATOM 270 C CG2 . VAL A 1 38 ? -3.415 34.679 -43.033 1.00 60.69 ? 346 VAL A CG2 1 ATOM 271 N N . PHE A 1 39 ? -0.392 36.573 -40.237 1.00 55.81 ? 347 PHE A N 1 ATOM 272 C CA . PHE A 1 39 ? 0.431 37.614 -39.634 1.00 57.62 ? 347 PHE A CA 1 ATOM 273 C C . PHE A 1 39 ? 0.726 37.251 -38.181 1.00 51.66 ? 347 PHE A C 1 ATOM 274 O O . PHE A 1 39 ? -0.024 37.621 -37.281 1.00 48.29 ? 347 PHE A O 1 ATOM 275 C CB . PHE A 1 39 ? -0.294 38.958 -39.710 1.00 63.95 ? 347 PHE A CB 1 ATOM 276 C CG . PHE A 1 39 ? 0.496 40.117 -39.170 1.00 69.09 ? 347 PHE A CG 1 ATOM 277 C CD1 . PHE A 1 39 ? 1.871 40.174 -39.320 1.00 71.65 ? 347 PHE A CD1 1 ATOM 278 C CD2 . PHE A 1 39 ? -0.145 41.155 -38.510 1.00 70.05 ? 347 PHE A CD2 1 ATOM 279 C CE1 . PHE A 1 39 ? 2.593 41.244 -38.823 1.00 72.05 ? 347 PHE A CE1 1 ATOM 280 C CE2 . PHE A 1 39 ? 0.572 42.227 -38.011 1.00 70.49 ? 347 PHE A CE2 1 ATOM 281 C CZ . PHE A 1 39 ? 1.942 42.271 -38.168 1.00 71.18 ? 347 PHE A CZ 1 ATOM 282 N N . PRO A 1 40 ? 1.826 36.515 -37.955 1.00 52.88 ? 348 PRO A N 1 ATOM 283 C CA . PRO A 1 40 ? 2.227 35.980 -36.645 1.00 50.70 ? 348 PRO A CA 1 ATOM 284 C C . PRO A 1 40 ? 2.376 37.030 -35.538 1.00 47.82 ? 348 PRO A C 1 ATOM 285 O O . PRO A 1 40 ? 2.121 36.721 -34.374 1.00 42.97 ? 348 PRO A O 1 ATOM 286 C CB . PRO A 1 40 ? 3.584 35.331 -36.939 1.00 52.83 ? 348 PRO A CB 1 ATOM 287 C CG . PRO A 1 40 ? 3.523 34.978 -38.385 1.00 55.70 ? 348 PRO A CG 1 ATOM 288 C CD . PRO A 1 40 ? 2.739 36.083 -39.028 1.00 56.16 ? 348 PRO A CD 1 ATOM 289 N N . GLU A 1 41 ? 2.780 38.245 -35.895 1.00 51.22 ? 349 GLU A N 1 ATOM 290 C CA . GLU A 1 41 ? 3.008 39.297 -34.906 1.00 51.43 ? 349 GLU A CA 1 ATOM 291 C C . GLU A 1 41 ? 1.762 40.150 -34.667 1.00 48.90 ? 349 GLU A C 1 ATOM 292 O O . GLU A 1 41 ? 1.814 41.380 -34.728 1.00 47.62 ? 349 GLU A O 1 ATOM 293 C CB . GLU A 1 41 ? 4.177 40.184 -35.336 1.00 55.50 ? 349 GLU A CB 1 ATOM 294 C CG . GLU A 1 41 ? 5.498 39.452 -35.433 1.00 58.59 ? 349 GLU A CG 1 ATOM 295 C CD . GLU A 1 41 ? 6.021 39.014 -34.084 1.00 59.40 ? 349 GLU A CD 1 ATOM 296 O OE1 . GLU A 1 41 ? 6.510 39.880 -33.328 1.00 61.38 ? 349 GLU A OE1 1 ATOM 297 O OE2 . GLU A 1 41 ? 5.944 37.805 -33.776 1.00 59.08 ? 349 GLU A OE2 1 ATOM 298 N N . PHE A 1 42 ? 0.647 39.485 -34.382 1.00 45.41 ? 350 PHE A N 1 ATOM 299 C CA . PHE A 1 42 ? -0.633 40.154 -34.198 1.00 42.72 ? 350 PHE A CA 1 ATOM 300 C C . PHE A 1 42 ? -1.037 40.080 -32.725 1.00 40.33 ? 350 PHE A C 1 ATOM 301 O O . PHE A 1 42 ? -1.662 39.109 -32.295 1.00 39.26 ? 350 PHE A O 1 ATOM 302 C CB . PHE A 1 42 ? -1.690 39.482 -35.083 1.00 42.71 ? 350 PHE A CB 1 ATOM 303 C CG . PHE A 1 42 ? -2.901 40.336 -35.367 1.00 41.80 ? 350 PHE A CG 1 ATOM 304 C CD1 . PHE A 1 42 ? -3.141 41.504 -34.657 1.00 41.11 ? 350 PHE A CD1 1 ATOM 305 C CD2 . PHE A 1 42 ? -3.808 39.957 -36.347 1.00 42.65 ? 350 PHE A CD2 1 ATOM 306 C CE1 . PHE A 1 42 ? -4.260 42.276 -34.921 1.00 42.40 ? 350 PHE A CE1 1 ATOM 307 C CE2 . PHE A 1 42 ? -4.928 40.725 -36.619 1.00 42.97 ? 350 PHE A CE2 1 ATOM 308 C CZ . PHE A 1 42 ? -5.154 41.885 -35.905 1.00 43.33 ? 350 PHE A CZ 1 ATOM 309 N N . ALA A 1 43 ? -0.679 41.115 -31.965 1.00 37.19 ? 351 ALA A N 1 ATOM 310 C CA . ALA A 1 43 ? -0.921 41.152 -30.524 1.00 38.37 ? 351 ALA A CA 1 ATOM 311 C C . ALA A 1 43 ? -2.396 40.989 -30.165 1.00 37.11 ? 351 ALA A C 1 ATOM 312 O O . ALA A 1 43 ? -2.740 40.222 -29.268 1.00 36.64 ? 351 ALA A O 1 ATOM 313 C CB . ALA A 1 43 ? -0.371 42.440 -29.927 1.00 39.20 ? 351 ALA A CB 1 ATOM 314 N N . ALA A 1 44 ? -3.258 41.713 -30.871 1.00 38.14 ? 352 ALA A N 1 ATOM 315 C CA . ALA A 1 44 ? -4.695 41.656 -30.626 1.00 38.97 ? 352 ALA A CA 1 ATOM 316 C C . ALA A 1 44 ? -5.269 40.263 -30.887 1.00 38.51 ? 352 ALA A C 1 ATOM 317 O O . ALA A 1 44 ? -6.142 39.799 -30.154 1.00 40.55 ? 352 ALA A O 1 ATOM 318 C CB . ALA A 1 44 ? -5.417 42.695 -31.474 1.00 44.08 ? 352 ALA A CB 1 ATOM 319 N N . ALA A 1 45 ? -4.776 39.600 -31.929 1.00 38.18 ? 353 ALA A N 1 ATOM 320 C CA . ALA A 1 45 ? -5.252 38.262 -32.269 1.00 38.39 ? 353 ALA A CA 1 ATOM 321 C C . ALA A 1 45 ? -4.877 37.249 -31.191 1.00 36.20 ? 353 ALA A C 1 ATOM 322 O O . ALA A 1 45 ? -5.683 36.394 -30.824 1.00 34.97 ? 353 ALA A O 1 ATOM 323 C CB . ALA A 1 45 ? -4.714 37.825 -33.624 1.00 39.13 ? 353 ALA A CB 1 ATOM 324 N N . HIS A 1 46 ? -3.651 37.352 -30.687 1.00 35.00 ? 354 HIS A N 1 ATOM 325 C CA . HIS A 1 46 ? -3.196 36.477 -29.615 1.00 33.00 ? 354 HIS A CA 1 ATOM 326 C C . HIS A 1 46 ? -4.010 36.698 -28.348 1.00 34.44 ? 354 HIS A C 1 ATOM 327 O O . HIS A 1 46 ? -4.400 35.743 -27.675 1.00 34.29 ? 354 HIS A O 1 ATOM 328 C CB . HIS A 1 46 ? -1.710 36.698 -29.325 1.00 31.61 ? 354 HIS A CB 1 ATOM 329 C CG . HIS A 1 46 ? -0.796 35.956 -30.251 1.00 30.80 ? 354 HIS A CG 1 ATOM 330 N ND1 . HIS A 1 46 ? -0.684 34.582 -30.242 1.00 30.68 ? 354 HIS A ND1 1 ATOM 331 C CD2 . HIS A 1 46 ? 0.061 36.396 -31.203 1.00 32.95 ? 354 HIS A CD2 1 ATOM 332 C CE1 . HIS A 1 46 ? 0.196 34.207 -31.153 1.00 32.76 ? 354 HIS A CE1 1 ATOM 333 N NE2 . HIS A 1 46 ? 0.662 35.288 -31.752 1.00 33.64 ? 354 HIS A NE2 1 ATOM 334 N N . SER A 1 47 ? -4.267 37.962 -28.029 1.00 35.02 ? 355 SER A N 1 ATOM 335 C CA . SER A 1 47 ? -5.024 38.304 -26.829 1.00 34.64 ? 355 SER A CA 1 ATOM 336 C C . SER A 1 47 ? -6.479 37.844 -26.929 1.00 33.68 ? 355 SER A C 1 ATOM 337 O O . SER A 1 47 ? -7.072 37.413 -25.936 1.00 31.77 ? 355 SER A O 1 ATOM 338 C CB . SER A 1 47 ? -4.954 39.808 -26.565 1.00 36.67 ? 355 SER A CB 1 ATOM 339 O OG . SER A 1 47 ? -5.724 40.156 -25.430 1.00 40.07 ? 355 SER A OG 1 ATOM 340 N N . ASN A 1 48 ? -7.046 37.933 -28.129 1.00 35.41 ? 356 ASN A N 1 ATOM 341 C CA . ASN A 1 48 ? -8.421 37.506 -28.361 1.00 35.99 ? 356 ASN A CA 1 ATOM 342 C C . ASN A 1 48 ? -8.574 35.995 -28.265 1.00 34.85 ? 356 ASN A C 1 ATOM 343 O O . ASN A 1 48 ? -9.503 35.493 -27.634 1.00 35.48 ? 356 ASN A O 1 ATOM 344 C CB . ASN A 1 48 ? -8.917 37.985 -29.726 1.00 38.48 ? 356 ASN A CB 1 ATOM 345 C CG . ASN A 1 48 ? -9.185 39.479 -29.764 1.00 41.17 ? 356 ASN A CG 1 ATOM 346 O OD1 . ASN A 1 48 ? -9.414 40.109 -28.731 1.00 39.56 ? 356 ASN A OD1 1 ATOM 347 N ND2 . ASN A 1 48 ? -9.171 40.051 -30.966 1.00 42.36 ? 356 ASN A ND2 1 ATOM 348 N N . LEU A 1 49 ? -7.663 35.273 -28.907 1.00 33.07 ? 357 LEU A N 1 ATOM 349 C CA . LEU A 1 49 ? -7.670 33.817 -28.847 1.00 32.79 ? 357 LEU A CA 1 ATOM 350 C C . LEU A 1 49 ? -7.470 33.353 -27.408 1.00 30.26 ? 357 LEU A C 1 ATOM 351 O O . LEU A 1 49 ? -8.140 32.428 -26.950 1.00 31.32 ? 357 LEU A O 1 ATOM 352 C CB . LEU A 1 49 ? -6.583 33.232 -29.756 1.00 32.88 ? 357 LEU A CB 1 ATOM 353 C CG . LEU A 1 49 ? -6.424 31.707 -29.743 1.00 33.89 ? 357 LEU A CG 1 ATOM 354 C CD1 . LEU A 1 49 ? -7.732 31.009 -30.110 1.00 32.63 ? 357 LEU A CD1 1 ATOM 355 C CD2 . LEU A 1 49 ? -5.305 31.273 -30.678 1.00 35.41 ? 357 LEU A CD2 1 ATOM 356 N N . ALA A 1 50 ? -6.557 34.011 -26.699 1.00 26.82 ? 358 ALA A N 1 ATOM 357 C CA . ALA A 1 50 ? -6.266 33.665 -25.308 1.00 27.50 ? 358 ALA A CA 1 ATOM 358 C C . ALA A 1 50 ? -7.508 33.795 -24.437 1.00 30.40 ? 358 ALA A C 1 ATOM 359 O O . ALA A 1 50 ? -7.819 32.907 -23.639 1.00 29.19 ? 358 ALA A O 1 ATOM 360 C CB . ALA A 1 50 ? -5.144 34.539 -24.762 1.00 28.93 ? 358 ALA A CB 1 ATOM 361 N N . SER A 1 51 ? -8.219 34.904 -24.606 1.00 31.42 ? 359 SER A N 1 ATOM 362 C CA . SER A 1 51 ? -9.442 35.152 -23.857 1.00 33.66 ? 359 SER A CA 1 ATOM 363 C C . SER A 1 51 ? -10.490 34.074 -24.132 1.00 34.42 ? 359 SER A C 1 ATOM 364 O O . SER A 1 51 ? -11.187 33.629 -23.217 1.00 34.11 ? 359 SER A O 1 ATOM 365 C CB . SER A 1 51 ? -9.997 36.537 -24.190 1.00 36.83 ? 359 SER A CB 1 ATOM 366 O OG . SER A 1 51 ? -11.329 36.677 -23.723 1.00 41.85 ? 359 SER A OG 1 ATOM 367 N N . VAL A 1 52 ? -10.592 33.653 -25.390 1.00 30.86 ? 360 VAL A N 1 ATOM 368 C CA . VAL A 1 52 ? -11.535 32.609 -25.775 1.00 33.71 ? 360 VAL A CA 1 ATOM 369 C C . VAL A 1 52 ? -11.135 31.250 -25.202 1.00 33.92 ? 360 VAL A C 1 ATOM 370 O O . VAL A 1 52 ? -11.978 30.507 -24.694 1.00 34.78 ? 360 VAL A O 1 ATOM 371 C CB . VAL A 1 52 ? -11.678 32.518 -27.307 1.00 39.89 ? 360 VAL A CB 1 ATOM 372 C CG1 . VAL A 1 52 ? -12.307 31.201 -27.714 1.00 43.53 ? 360 VAL A CG1 1 ATOM 373 C CG2 . VAL A 1 52 ? -12.506 33.682 -27.823 1.00 41.62 ? 360 VAL A CG2 1 ATOM 374 N N . LEU A 1 53 ? -9.846 30.932 -25.278 1.00 30.32 ? 361 LEU A N 1 ATOM 375 C CA . LEU A 1 53 ? -9.342 29.682 -24.722 1.00 32.29 ? 361 LEU A CA 1 ATOM 376 C C . LEU A 1 53 ? -9.578 29.646 -23.217 1.00 32.11 ? 361 LEU A C 1 ATOM 377 O O . LEU A 1 53 ? -9.982 28.618 -22.667 1.00 32.94 ? 361 LEU A O 1 ATOM 378 C CB . LEU A 1 53 ? -7.854 29.511 -25.045 1.00 31.00 ? 361 LEU A CB 1 ATOM 379 C CG . LEU A 1 53 ? -7.558 29.252 -26.526 1.00 30.39 ? 361 LEU A CG 1 ATOM 380 C CD1 . LEU A 1 53 ? -6.060 29.319 -26.819 1.00 27.11 ? 361 LEU A CD1 1 ATOM 381 C CD2 . LEU A 1 53 ? -8.138 27.908 -26.954 1.00 31.26 ? 361 LEU A CD2 1 ATOM 382 N N . GLN A 1 54 ? -9.339 30.780 -22.565 1.00 32.75 ? 362 GLN A N 1 ATOM 383 C CA . GLN A 1 54 ? -9.554 30.913 -21.129 1.00 34.41 ? 362 GLN A CA 1 ATOM 384 C C . GLN A 1 54 ? -11.019 30.659 -20.772 1.00 35.94 ? 362 GLN A C 1 ATOM 385 O O . GLN A 1 54 ? -11.318 30.050 -19.746 1.00 34.97 ? 362 GLN A O 1 ATOM 386 C CB . GLN A 1 54 ? -9.121 32.303 -20.647 1.00 38.20 ? 362 GLN A CB 1 ATOM 387 C CG . GLN A 1 54 ? -9.401 32.572 -19.172 1.00 42.79 ? 362 GLN A CG 1 ATOM 388 C CD . GLN A 1 54 ? -9.100 34.008 -18.765 1.00 47.96 ? 362 GLN A CD 1 ATOM 389 O OE1 . GLN A 1 54 ? -8.783 34.856 -19.604 1.00 50.63 ? 362 GLN A OE1 1 ATOM 390 N NE2 . GLN A 1 54 ? -9.201 34.286 -17.470 1.00 47.40 ? 362 GLN A NE2 1 ATOM 391 N N . GLN A 1 55 ? -11.927 31.119 -21.627 1.00 38.67 ? 363 GLN A N 1 ATOM 392 C CA . GLN A 1 55 ? -13.355 30.905 -21.414 1.00 44.03 ? 363 GLN A CA 1 ATOM 393 C C . GLN A 1 55 ? -13.728 29.429 -21.534 1.00 44.30 ? 363 GLN A C 1 ATOM 394 O O . GLN A 1 55 ? -14.619 28.944 -20.833 1.00 45.26 ? 363 GLN A O 1 ATOM 395 C CB . GLN A 1 55 ? -14.183 31.730 -22.401 1.00 50.36 ? 363 GLN A CB 1 ATOM 396 C CG . GLN A 1 55 ? -14.263 33.209 -22.067 1.00 56.23 ? 363 GLN A CG 1 ATOM 397 C CD . GLN A 1 55 ? -15.400 33.908 -22.796 1.00 63.47 ? 363 GLN A CD 1 ATOM 398 O OE1 . GLN A 1 55 ? -15.639 33.666 -23.981 1.00 65.98 ? 363 GLN A OE1 1 ATOM 399 N NE2 . GLN A 1 55 ? -16.114 34.773 -22.083 1.00 65.92 ? 363 GLN A NE2 1 ATOM 400 N N . GLN A 1 56 ? -13.046 28.721 -22.428 1.00 40.87 ? 364 GLN A N 1 ATOM 401 C CA . GLN A 1 56 ? -13.291 27.295 -22.624 1.00 42.25 ? 364 GLN A CA 1 ATOM 402 C C . GLN A 1 56 ? -12.654 26.455 -21.523 1.00 41.06 ? 364 GLN A C 1 ATOM 403 O O . GLN A 1 56 ? -12.874 25.244 -21.453 1.00 44.09 ? 364 GLN A O 1 ATOM 404 C CB . GLN A 1 56 ? -12.758 26.838 -23.981 1.00 45.37 ? 364 GLN A CB 1 ATOM 405 C CG . GLN A 1 56 ? -13.596 27.265 -25.169 1.00 50.53 ? 364 GLN A CG 1 ATOM 406 C CD . GLN A 1 56 ? -13.022 26.767 -26.477 1.00 52.34 ? 364 GLN A CD 1 ATOM 407 O OE1 . GLN A 1 56 ? -11.815 26.841 -26.704 1.00 50.89 ? 364 GLN A OE1 1 ATOM 408 N NE2 . GLN A 1 56 ? -13.884 26.243 -27.342 1.00 55.19 ? 364 GLN A NE2 1 ATOM 409 N N . GLY A 1 57 ? -11.853 27.096 -20.676 1.00 34.47 ? 365 GLY A N 1 ATOM 410 C CA . GLY A 1 57 ? -11.197 26.401 -19.584 1.00 35.53 ? 365 GLY A CA 1 ATOM 411 C C . GLY A 1 57 ? -9.852 25.827 -19.987 1.00 33.55 ? 365 GLY A C 1 ATOM 412 O O . GLY A 1 57 ? -9.230 25.083 -19.225 1.00 34.56 ? 365 GLY A O 1 ATOM 413 N N . LYS A 1 58 ? -9.406 26.169 -21.191 1.00 31.34 ? 366 LYS A N 1 ATOM 414 C CA . LYS A 1 58 ? -8.102 25.734 -21.681 1.00 31.41 ? 366 LYS A CA 1 ATOM 415 C C . LYS A 1 58 ? -7.044 26.742 -21.246 1.00 31.42 ? 366 LYS A C 1 ATOM 416 O O . LYS A 1 58 ? -6.546 27.528 -22.050 1.00 33.26 ? 366 LYS A O 1 ATOM 417 C CB . LYS A 1 58 ? -8.128 25.582 -23.203 1.00 29.85 ? 366 LYS A CB 1 ATOM 418 C CG . LYS A 1 58 ? -9.156 24.568 -23.695 1.00 32.68 ? 366 LYS A CG 1 ATOM 419 C CD . LYS A 1 58 ? -9.118 24.392 -25.208 1.00 34.79 ? 366 LYS A CD 1 ATOM 420 C CE . LYS A 1 58 ? -10.196 23.422 -25.671 1.00 37.61 ? 366 LYS A CE 1 ATOM 421 N NZ . LYS A 1 58 ? -10.223 23.264 -27.157 1.00 40.04 ? 366 LYS A NZ 1 ATOM 422 N N . LEU A 1 59 ? -6.711 26.712 -19.961 1.00 32.21 ? 367 LEU A N 1 ATOM 423 C CA . LEU A 1 59 ? -5.894 27.756 -19.347 1.00 29.94 ? 367 LEU A CA 1 ATOM 424 C C . LEU A 1 59 ? -4.422 27.730 -19.764 1.00 30.04 ? 367 LEU A C 1 ATOM 425 O O . LEU A 1 59 ? -3.833 28.780 -20.021 1.00 28.34 ? 367 LEU A O 1 ATOM 426 C CB . LEU A 1 59 ? -6.016 27.692 -17.825 1.00 28.46 ? 367 LEU A CB 1 ATOM 427 C CG . LEU A 1 59 ? -7.456 27.665 -17.305 1.00 28.89 ? 367 LEU A CG 1 ATOM 428 C CD1 . LEU A 1 59 ? -7.473 27.526 -15.793 1.00 26.66 ? 367 LEU A CD1 1 ATOM 429 C CD2 . LEU A 1 59 ? -8.210 28.910 -17.745 1.00 28.13 ? 367 LEU A CD2 1 ATOM 430 N N . GLN A 1 60 ? -3.828 26.540 -19.818 1.00 29.46 ? 368 GLN A N 1 ATOM 431 C CA . GLN A 1 60 ? -2.441 26.415 -20.258 1.00 27.86 ? 368 GLN A CA 1 ATOM 432 C C . GLN A 1 60 ? -2.277 26.948 -21.676 1.00 28.07 ? 368 GLN A C 1 ATOM 433 O O . GLN A 1 60 ? -1.306 27.649 -21.981 1.00 26.66 ? 368 GLN A O 1 ATOM 434 C CB . GLN A 1 60 ? -1.956 24.964 -20.165 1.00 29.32 ? 368 GLN A CB 1 ATOM 435 C CG . GLN A 1 60 ? -1.690 24.501 -18.742 1.00 30.16 ? 368 GLN A CG 1 ATOM 436 C CD . GLN A 1 60 ? -1.258 23.048 -18.666 1.00 36.93 ? 368 GLN A CD 1 ATOM 437 O OE1 . GLN A 1 60 ? -0.157 22.745 -18.214 1.00 41.43 ? 368 GLN A OE1 1 ATOM 438 N NE2 . GLN A 1 60 ? -2.129 22.142 -19.096 1.00 36.34 ? 368 GLN A NE2 1 ATOM 439 N N . GLU A 1 61 ? -3.236 26.632 -22.539 1.00 28.05 ? 369 GLU A N 1 ATOM 440 C CA . GLU A 1 61 ? -3.170 27.087 -23.919 1.00 28.41 ? 369 GLU A CA 1 ATOM 441 C C . GLU A 1 61 ? -3.385 28.597 -24.009 1.00 28.25 ? 369 GLU A C 1 ATOM 442 O O . GLU A 1 61 ? -2.743 29.274 -24.810 1.00 29.17 ? 369 GLU A O 1 ATOM 443 C CB . GLU A 1 61 ? -4.180 26.337 -24.799 1.00 30.46 ? 369 GLU A CB 1 ATOM 444 C CG . GLU A 1 61 ? -3.748 26.242 -26.252 1.00 30.04 ? 369 GLU A CG 1 ATOM 445 C CD . GLU A 1 61 ? -4.746 25.507 -27.126 1.00 33.76 ? 369 GLU A CD 1 ATOM 446 O OE1 . GLU A 1 61 ? -5.668 24.861 -26.575 1.00 34.25 ? 369 GLU A OE1 1 ATOM 447 O OE2 . GLU A 1 61 ? -4.606 25.578 -28.367 1.00 33.16 ? 369 GLU A OE2 1 ATOM 448 N N . ALA A 1 62 ? -4.284 29.119 -23.182 1.00 27.39 ? 370 ALA A N 1 ATOM 449 C CA . ALA A 1 62 ? -4.512 30.562 -23.109 1.00 28.36 ? 370 ALA A CA 1 ATOM 450 C C . ALA A 1 62 ? -3.238 31.292 -22.679 1.00 27.78 ? 370 ALA A C 1 ATOM 451 O O . ALA A 1 62 ? -2.909 32.353 -23.206 1.00 29.33 ? 370 ALA A O 1 ATOM 452 C CB . ALA A 1 62 ? -5.655 30.870 -22.147 1.00 30.15 ? 370 ALA A CB 1 ATOM 453 N N . LEU A 1 63 ? -2.519 30.702 -21.729 1.00 24.75 ? 371 LEU A N 1 ATOM 454 C CA . LEU A 1 63 ? -1.284 31.282 -21.206 1.00 25.52 ? 371 LEU A CA 1 ATOM 455 C C . LEU A 1 63 ? -0.237 31.499 -22.303 1.00 29.70 ? 371 LEU A C 1 ATOM 456 O O . LEU A 1 63 ? 0.474 32.510 -22.305 1.00 28.74 ? 371 LEU A O 1 ATOM 457 C CB . LEU A 1 63 ? -0.721 30.380 -20.110 1.00 27.35 ? 371 LEU A CB 1 ATOM 458 C CG . LEU A 1 63 ? 0.036 31.055 -18.976 1.00 29.55 ? 371 LEU A CG 1 ATOM 459 C CD1 . LEU A 1 63 ? -0.870 32.079 -18.312 1.00 34.05 ? 371 LEU A CD1 1 ATOM 460 C CD2 . LEU A 1 63 ? 0.529 30.013 -17.975 1.00 25.61 ? 371 LEU A CD2 1 ATOM 461 N N . MET A 1 64 ? -0.147 30.543 -23.228 1.00 29.69 ? 372 MET A N 1 ATOM 462 C CA . MET A 1 64 ? 0.765 30.641 -24.366 1.00 29.23 ? 372 MET A CA 1 ATOM 463 C C . MET A 1 64 ? 0.540 31.926 -25.140 1.00 31.15 ? 372 MET A C 1 ATOM 464 O O . MET A 1 64 ? 1.483 32.659 -25.446 1.00 31.87 ? 372 MET A O 1 ATOM 465 C CB . MET A 1 64 ? 0.558 29.470 -25.330 1.00 30.37 ? 372 MET A CB 1 ATOM 466 C CG . MET A 1 64 ? 1.406 28.256 -25.066 1.00 32.30 ? 372 MET A CG 1 ATOM 467 S SD . MET A 1 64 ? 1.206 27.025 -26.378 1.00 37.72 ? 372 MET A SD 1 ATOM 468 C CE . MET A 1 64 ? 2.002 27.840 -27.759 1.00 57.97 ? 372 MET A CE 1 ATOM 469 N N . HIS A 1 65 ? -0.721 32.187 -25.467 1.00 28.12 ? 373 HIS A N 1 ATOM 470 C CA . HIS A 1 65 ? -1.061 33.326 -26.304 1.00 25.93 ? 373 HIS A CA 1 ATOM 471 C C . HIS A 1 65 ? -0.972 34.661 -25.570 1.00 26.19 ? 373 HIS A C 1 ATOM 472 O O . HIS A 1 65 ? -0.637 35.678 -26.176 1.00 24.78 ? 373 HIS A O 1 ATOM 473 C CB . HIS A 1 65 ? -2.426 33.110 -26.961 1.00 26.33 ? 373 HIS A CB 1 ATOM 474 C CG . HIS A 1 65 ? -2.436 31.964 -27.925 1.00 29.14 ? 373 HIS A CG 1 ATOM 475 N ND1 . HIS A 1 65 ? -1.909 32.060 -29.194 1.00 30.96 ? 373 HIS A ND1 1 ATOM 476 C CD2 . HIS A 1 65 ? -2.863 30.687 -27.791 1.00 28.70 ? 373 HIS A CD2 1 ATOM 477 C CE1 . HIS A 1 65 ? -2.031 30.899 -29.810 1.00 30.69 ? 373 HIS A CE1 1 ATOM 478 N NE2 . HIS A 1 65 ? -2.608 30.048 -28.981 1.00 30.45 ? 373 HIS A NE2 1 ATOM 479 N N . TYR A 1 66 ? -1.247 34.657 -24.267 1.00 25.20 ? 374 TYR A N 1 ATOM 480 C CA . TYR A 1 66 ? -1.032 35.859 -23.469 1.00 26.61 ? 374 TYR A CA 1 ATOM 481 C C . TYR A 1 66 ? 0.453 36.222 -23.464 1.00 25.32 ? 374 TYR A C 1 ATOM 482 O O . TYR A 1 66 ? 0.812 37.397 -23.540 1.00 24.02 ? 374 TYR A O 1 ATOM 483 C CB . TYR A 1 66 ? -1.546 35.675 -22.035 1.00 27.66 ? 374 TYR A CB 1 ATOM 484 C CG . TYR A 1 66 ? -3.044 35.850 -21.883 1.00 24.91 ? 374 TYR A CG 1 ATOM 485 C CD1 . TYR A 1 66 ? -3.696 36.945 -22.432 1.00 26.42 ? 374 TYR A CD1 1 ATOM 486 C CD2 . TYR A 1 66 ? -3.805 34.914 -21.196 1.00 23.07 ? 374 TYR A CD2 1 ATOM 487 C CE1 . TYR A 1 66 ? -5.064 37.106 -22.295 1.00 28.08 ? 374 TYR A CE1 1 ATOM 488 C CE2 . TYR A 1 66 ? -5.164 35.065 -21.057 1.00 25.57 ? 374 TYR A CE2 1 ATOM 489 C CZ . TYR A 1 66 ? -5.790 36.160 -21.600 1.00 28.13 ? 374 TYR A CZ 1 ATOM 490 O OH . TYR A 1 66 ? -7.149 36.298 -21.454 1.00 29.96 ? 374 TYR A OH 1 ATOM 491 N N . LYS A 1 67 ? 1.315 35.212 -23.384 1.00 21.95 ? 375 LYS A N 1 ATOM 492 C CA . LYS A 1 67 ? 2.751 35.458 -23.363 1.00 22.95 ? 375 LYS A CA 1 ATOM 493 C C . LYS A 1 67 ? 3.226 36.036 -24.696 1.00 26.99 ? 375 LYS A C 1 ATOM 494 O O . LYS A 1 67 ? 4.125 36.875 -24.729 1.00 25.80 ? 375 LYS A O 1 ATOM 495 C CB . LYS A 1 67 ? 3.529 34.187 -22.999 1.00 25.39 ? 375 LYS A CB 1 ATOM 496 C CG . LYS A 1 67 ? 3.350 33.758 -21.547 1.00 27.62 ? 375 LYS A CG 1 ATOM 497 C CD . LYS A 1 67 ? 4.032 32.426 -21.237 1.00 30.10 ? 375 LYS A CD 1 ATOM 498 C CE . LYS A 1 67 ? 3.715 31.990 -19.809 1.00 30.14 ? 375 LYS A CE 1 ATOM 499 N NZ . LYS A 1 67 ? 4.324 30.676 -19.435 1.00 29.61 ? 375 LYS A NZ 1 ATOM 500 N N . GLU A 1 68 ? 2.604 35.595 -25.786 1.00 27.98 ? 376 GLU A N 1 ATOM 501 C CA . GLU A 1 68 ? 2.901 36.137 -27.108 1.00 35.38 ? 376 GLU A CA 1 ATOM 502 C C . GLU A 1 68 ? 2.485 37.595 -27.203 1.00 33.73 ? 376 GLU A C 1 ATOM 503 O O . GLU A 1 68 ? 3.243 38.431 -27.698 1.00 33.25 ? 376 GLU A O 1 ATOM 504 C CB . GLU A 1 68 ? 2.190 35.338 -28.201 1.00 40.77 ? 376 GLU A CB 1 ATOM 505 C CG . GLU A 1 68 ? 2.835 34.014 -28.519 1.00 47.63 ? 376 GLU A CG 1 ATOM 506 C CD . GLU A 1 68 ? 4.294 34.160 -28.908 1.00 54.94 ? 376 GLU A CD 1 ATOM 507 O OE1 . GLU A 1 68 ? 4.604 35.022 -29.762 1.00 56.80 ? 376 GLU A OE1 1 ATOM 508 O OE2 . GLU A 1 68 ? 5.134 33.420 -28.350 1.00 57.92 ? 376 GLU A OE2 1 ATOM 509 N N . ALA A 1 69 ? 1.276 37.891 -26.731 1.00 30.07 ? 377 ALA A N 1 ATOM 510 C CA . ALA A 1 69 ? 0.739 39.244 -26.815 1.00 31.70 ? 377 ALA A CA 1 ATOM 511 C C . ALA A 1 69 ? 1.652 40.240 -26.111 1.00 32.62 ? 377 ALA A C 1 ATOM 512 O O . ALA A 1 69 ? 1.930 41.315 -26.643 1.00 33.80 ? 377 ALA A O 1 ATOM 513 C CB . ALA A 1 69 ? -0.674 39.302 -26.236 1.00 30.30 ? 377 ALA A CB 1 ATOM 514 N N . ILE A 1 70 ? 2.144 39.866 -24.932 1.00 32.11 ? 378 ILE A N 1 ATOM 515 C CA . ILE A 1 70 ? 2.949 40.779 -24.123 1.00 31.39 ? 378 ILE A CA 1 ATOM 516 C C . ILE A 1 70 ? 4.374 40.959 -24.637 1.00 33.55 ? 378 ILE A C 1 ATOM 517 O O . ILE A 1 70 ? 5.018 41.966 -24.333 1.00 34.84 ? 378 ILE A O 1 ATOM 518 C CB . ILE A 1 70 ? 2.986 40.380 -22.625 1.00 37.75 ? 378 ILE A CB 1 ATOM 519 C CG1 . ILE A 1 70 ? 3.728 39.057 -22.428 1.00 38.30 ? 378 ILE A CG1 1 ATOM 520 C CG2 . ILE A 1 70 ? 1.581 40.317 -22.050 1.00 35.30 ? 378 ILE A CG2 1 ATOM 521 C CD1 . ILE A 1 70 ? 4.016 38.728 -20.965 1.00 37.21 ? 378 ILE A CD1 1 ATOM 522 N N . ARG A 1 71 ? 4.869 39.993 -25.409 1.00 30.70 ? 379 ARG A N 1 ATOM 523 C CA . ARG A 1 71 ? 6.181 40.141 -26.027 1.00 36.84 ? 379 ARG A CA 1 ATOM 524 C C . ARG A 1 71 ? 6.088 41.094 -27.209 1.00 40.09 ? 379 ARG A C 1 ATOM 525 O O . ARG A 1 71 ? 6.894 42.012 -27.347 1.00 39.78 ? 379 ARG A O 1 ATOM 526 C CB . ARG A 1 71 ? 6.731 38.802 -26.512 1.00 36.18 ? 379 ARG A CB 1 ATOM 527 C CG . ARG A 1 71 ? 8.042 38.955 -27.269 1.00 41.62 ? 379 ARG A CG 1 ATOM 528 C CD . ARG A 1 71 ? 8.477 37.664 -27.929 1.00 43.33 ? 379 ARG A CD 1 ATOM 529 N NE . ARG A 1 71 ? 7.467 37.118 -28.832 1.00 42.89 ? 379 ARG A NE 1 ATOM 530 C CZ . ARG A 1 71 ? 7.209 37.591 -30.046 1.00 45.16 ? 379 ARG A CZ 1 ATOM 531 N NH1 . ARG A 1 71 ? 7.876 38.636 -30.515 1.00 48.28 ? 379 ARG A NH1 1 ATOM 532 N NH2 . ARG A 1 71 ? 6.274 37.021 -30.793 1.00 47.95 ? 379 ARG A NH2 1 ATOM 533 N N . ILE A 1 72 ? 5.093 40.857 -28.058 1.00 40.69 ? 380 ILE A N 1 ATOM 534 C CA . ILE A 1 72 ? 4.856 41.685 -29.232 1.00 40.12 ? 380 ILE A CA 1 ATOM 535 C C . ILE A 1 72 ? 4.588 43.129 -28.822 1.00 40.78 ? 380 ILE A C 1 ATOM 536 O O . ILE A 1 72 ? 5.091 44.061 -29.448 1.00 42.40 ? 380 ILE A O 1 ATOM 537 C CB . ILE A 1 72 ? 3.663 41.150 -30.044 1.00 38.25 ? 380 ILE A CB 1 ATOM 538 C CG1 . ILE A 1 72 ? 3.950 39.728 -30.530 1.00 38.15 ? 380 ILE A CG1 1 ATOM 539 C CG2 . ILE A 1 72 ? 3.358 42.065 -31.218 1.00 38.18 ? 380 ILE A CG2 1 ATOM 540 C CD1 . ILE A 1 72 ? 2.765 39.062 -31.206 1.00 40.22 ? 380 ILE A CD1 1 ATOM 541 N N . SER A 1 73 ? 3.803 43.300 -27.760 1.00 38.40 ? 381 SER A N 1 ATOM 542 C CA A SER A 1 73 ? 3.450 44.627 -27.265 0.59 38.70 ? 381 SER A CA 1 ATOM 543 C CA B SER A 1 73 ? 3.448 44.627 -27.264 0.41 38.66 ? 381 SER A CA 1 ATOM 544 C C . SER A 1 73 ? 3.762 44.762 -25.777 1.00 40.06 ? 381 SER A C 1 ATOM 545 O O . SER A 1 73 ? 2.983 44.326 -24.932 1.00 39.70 ? 381 SER A O 1 ATOM 546 C CB A SER A 1 73 ? 1.967 44.908 -27.513 0.59 37.02 ? 381 SER A CB 1 ATOM 547 C CB B SER A 1 73 ? 1.964 44.904 -27.506 0.41 37.10 ? 381 SER A CB 1 ATOM 548 O OG A SER A 1 73 ? 1.619 46.214 -27.091 0.59 35.72 ? 381 SER A OG 1 ATOM 549 O OG B SER A 1 73 ? 1.640 44.775 -28.879 0.41 38.62 ? 381 SER A OG 1 ATOM 550 N N . PRO A 1 74 ? 4.909 45.372 -25.450 1.00 41.61 ? 382 PRO A N 1 ATOM 551 C CA . PRO A 1 74 ? 5.338 45.520 -24.055 1.00 39.13 ? 382 PRO A CA 1 ATOM 552 C C . PRO A 1 74 ? 4.493 46.510 -23.251 1.00 40.88 ? 382 PRO A C 1 ATOM 553 O O . PRO A 1 74 ? 4.586 46.513 -22.027 1.00 40.38 ? 382 PRO A O 1 ATOM 554 C CB . PRO A 1 74 ? 6.776 46.037 -24.182 1.00 39.29 ? 382 PRO A CB 1 ATOM 555 C CG . PRO A 1 74 ? 7.189 45.706 -25.596 1.00 42.57 ? 382 PRO A CG 1 ATOM 556 C CD . PRO A 1 74 ? 5.938 45.842 -26.393 1.00 43.74 ? 382 PRO A CD 1 ATOM 557 N N . THR A 1 75 ? 3.695 47.337 -23.918 1.00 43.22 ? 383 THR A N 1 ATOM 558 C CA . THR A 1 75 ? 2.825 48.272 -23.206 1.00 43.49 ? 383 THR A CA 1 ATOM 559 C C . THR A 1 75 ? 1.398 47.739 -23.104 1.00 41.54 ? 383 THR A C 1 ATOM 560 O O . THR A 1 75 ? 0.486 48.453 -22.686 1.00 44.45 ? 383 THR A O 1 ATOM 561 C CB . THR A 1 75 ? 2.802 49.670 -23.873 1.00 45.76 ? 383 THR A CB 1 ATOM 562 O OG1 . THR A 1 75 ? 2.226 49.578 -25.183 1.00 47.23 ? 383 THR A OG1 1 ATOM 563 C CG2 . THR A 1 75 ? 4.209 50.246 -23.970 1.00 45.74 ? 383 THR A CG2 1 ATOM 564 N N . PHE A 1 76 ? 1.212 46.479 -23.486 1.00 37.74 ? 384 PHE A N 1 ATOM 565 C CA . PHE A 1 76 ? -0.112 45.864 -23.509 1.00 35.82 ? 384 PHE A CA 1 ATOM 566 C C . PHE A 1 76 ? -0.570 45.528 -22.087 1.00 32.00 ? 384 PHE A C 1 ATOM 567 O O . PHE A 1 76 ? -0.575 44.360 -21.689 1.00 31.06 ? 384 PHE A O 1 ATOM 568 C CB . PHE A 1 76 ? -0.078 44.596 -24.367 1.00 33.24 ? 384 PHE A CB 1 ATOM 569 C CG . PHE A 1 76 ? -1.407 44.215 -24.960 1.00 33.49 ? 384 PHE A CG 1 ATOM 570 C CD1 . PHE A 1 76 ? -1.492 43.173 -25.868 1.00 32.08 ? 384 PHE A CD1 1 ATOM 571 C CD2 . PHE A 1 76 ? -2.566 44.894 -24.617 1.00 34.23 ? 384 PHE A CD2 1 ATOM 572 C CE1 . PHE A 1 76 ? -2.704 42.809 -26.418 1.00 33.96 ? 384 PHE A CE1 1 ATOM 573 C CE2 . PHE A 1 76 ? -3.784 44.536 -25.165 1.00 33.67 ? 384 PHE A CE2 1 ATOM 574 C CZ . PHE A 1 76 ? -3.855 43.493 -26.063 1.00 34.33 ? 384 PHE A CZ 1 ATOM 575 N N . ALA A 1 77 ? -0.957 46.552 -21.331 1.00 28.69 ? 385 ALA A N 1 ATOM 576 C CA . ALA A 1 77 ? -1.342 46.363 -19.932 1.00 25.80 ? 385 ALA A CA 1 ATOM 577 C C . ALA A 1 77 ? -2.546 45.434 -19.776 1.00 25.30 ? 385 ALA A C 1 ATOM 578 O O . ALA A 1 77 ? -2.585 44.603 -18.866 1.00 22.80 ? 385 ALA A O 1 ATOM 579 C CB . ALA A 1 77 ? -1.608 47.706 -19.265 1.00 30.02 ? 385 ALA A CB 1 ATOM 580 N N . ASP A 1 78 ? -3.520 45.575 -20.671 1.00 24.47 ? 386 ASP A N 1 ATOM 581 C CA . ASP A 1 78 ? -4.727 44.755 -20.636 1.00 26.92 ? 386 ASP A CA 1 ATOM 582 C C . ASP A 1 78 ? -4.386 43.266 -20.703 1.00 27.06 ? 386 ASP A C 1 ATOM 583 O O . ASP A 1 78 ? -5.035 42.434 -20.058 1.00 23.64 ? 386 ASP A O 1 ATOM 584 C CB . ASP A 1 78 ? -5.659 45.150 -21.783 1.00 33.98 ? 386 ASP A CB 1 ATOM 585 C CG . ASP A 1 78 ? -7.032 44.512 -21.674 1.00 43.20 ? 386 ASP A CG 1 ATOM 586 O OD1 . ASP A 1 78 ? -7.773 44.846 -20.722 1.00 46.27 ? 386 ASP A OD1 1 ATOM 587 O OD2 . ASP A 1 78 ? -7.382 43.695 -22.554 1.00 45.83 ? 386 ASP A OD2 1 ATOM 588 N N . ALA A 1 79 ? -3.354 42.938 -21.474 1.00 27.98 ? 387 ALA A N 1 ATOM 589 C CA . ALA A 1 79 ? -2.924 41.552 -21.616 1.00 26.33 ? 387 ALA A CA 1 ATOM 590 C C . ALA A 1 79 ? -2.271 41.026 -20.343 1.00 23.05 ? 387 ALA A C 1 ATOM 591 O O . ALA A 1 79 ? -2.534 39.893 -19.942 1.00 23.57 ? 387 ALA A O 1 ATOM 592 C CB . ALA A 1 79 ? -1.985 41.390 -22.805 1.00 26.89 ? 387 ALA A CB 1 ATOM 593 N N . TYR A 1 80 ? -1.415 41.828 -19.714 1.00 19.47 ? 388 TYR A N 1 ATOM 594 C CA . TYR A 1 80 ? -0.871 41.439 -18.410 1.00 21.93 ? 388 TYR A CA 1 ATOM 595 C C . TYR A 1 80 ? -1.996 41.183 -17.413 1.00 20.69 ? 388 TYR A C 1 ATOM 596 O O . TYR A 1 80 ? -1.958 40.221 -16.638 1.00 18.00 ? 388 TYR A O 1 ATOM 597 C CB . TYR A 1 80 ? 0.073 42.508 -17.854 1.00 24.01 ? 388 TYR A CB 1 ATOM 598 C CG . TYR A 1 80 ? 1.499 42.371 -18.333 1.00 24.34 ? 388 TYR A CG 1 ATOM 599 C CD1 . TYR A 1 80 ? 2.348 41.422 -17.779 1.00 25.00 ? 388 TYR A CD1 1 ATOM 600 C CD2 . TYR A 1 80 ? 2.002 43.203 -19.328 1.00 26.07 ? 388 TYR A CD2 1 ATOM 601 C CE1 . TYR A 1 80 ? 3.658 41.294 -18.213 1.00 25.39 ? 388 TYR A CE1 1 ATOM 602 C CE2 . TYR A 1 80 ? 3.302 43.084 -19.766 1.00 27.59 ? 388 TYR A CE2 1 ATOM 603 C CZ . TYR A 1 80 ? 4.128 42.132 -19.204 1.00 28.56 ? 388 TYR A CZ 1 ATOM 604 O OH . TYR A 1 80 ? 5.425 42.013 -19.648 1.00 33.70 ? 388 TYR A OH 1 ATOM 605 N N . SER A 1 81 ? -3.000 42.053 -17.440 1.00 24.43 ? 389 SER A N 1 ATOM 606 C CA . SER A 1 81 ? -4.127 41.944 -16.521 1.00 25.29 ? 389 SER A CA 1 ATOM 607 C C . SER A 1 81 ? -4.872 40.636 -16.749 1.00 27.07 ? 389 SER A C 1 ATOM 608 O O . SER A 1 81 ? -5.110 39.869 -15.809 1.00 25.43 ? 389 SER A O 1 ATOM 609 C CB . SER A 1 81 ? -5.079 43.125 -16.701 1.00 28.13 ? 389 SER A CB 1 ATOM 610 O OG . SER A 1 81 ? -6.198 43.020 -15.831 1.00 28.30 ? 389 SER A OG 1 ATOM 611 N N . ASN A 1 82 ? -5.228 40.377 -18.003 1.00 24.37 ? 390 ASN A N 1 ATOM 612 C CA . ASN A 1 82 ? -5.980 39.177 -18.327 1.00 25.57 ? 390 ASN A CA 1 ATOM 613 C C . ASN A 1 82 ? -5.156 37.915 -18.121 1.00 23.21 ? 390 ASN A C 1 ATOM 614 O O . ASN A 1 82 ? -5.694 36.868 -17.762 1.00 22.85 ? 390 ASN A O 1 ATOM 615 C CB . ASN A 1 82 ? -6.550 39.251 -19.746 1.00 27.87 ? 390 ASN A CB 1 ATOM 616 C CG . ASN A 1 82 ? -7.757 40.168 -19.834 1.00 30.44 ? 390 ASN A CG 1 ATOM 617 O OD1 . ASN A 1 82 ? -8.537 40.277 -18.885 1.00 32.08 ? 390 ASN A OD1 1 ATOM 618 N ND2 . ASN A 1 82 ? -7.913 40.838 -20.969 1.00 32.52 ? 390 ASN A ND2 1 ATOM 619 N N . MET A 1 83 ? -3.848 38.019 -18.333 1.00 21.32 ? 391 MET A N 1 ATOM 620 C CA . MET A 1 83 ? -2.963 36.890 -18.073 1.00 19.77 ? 391 MET A CA 1 ATOM 621 C C . MET A 1 83 ? -2.965 36.601 -16.583 1.00 19.71 ? 391 MET A C 1 ATOM 622 O O . MET A 1 83 ? -2.924 35.446 -16.170 1.00 23.66 ? 391 MET A O 1 ATOM 623 C CB . MET A 1 83 ? -1.541 37.179 -18.568 1.00 19.71 ? 391 MET A CB 1 ATOM 624 C CG . MET A 1 83 ? -0.578 36.001 -18.435 1.00 18.51 ? 391 MET A CG 1 ATOM 625 S SD . MET A 1 83 ? 1.078 36.422 -18.991 1.00 27.45 ? 391 MET A SD 1 ATOM 626 C CE . MET A 1 83 ? 2.033 35.101 -18.239 1.00 32.95 ? 391 MET A CE 1 ATOM 627 N N . GLY A 1 84 ? -3.028 37.660 -15.778 1.00 19.08 ? 392 GLY A N 1 ATOM 628 C CA . GLY A 1 84 ? -3.119 37.509 -14.338 1.00 17.13 ? 392 GLY A CA 1 ATOM 629 C C . GLY A 1 84 ? -4.393 36.773 -13.962 1.00 18.62 ? 392 GLY A C 1 ATOM 630 O O . GLY A 1 84 ? -4.381 35.909 -13.085 1.00 21.09 ? 392 GLY A O 1 ATOM 631 N N . ASN A 1 85 ? -5.492 37.117 -14.626 1.00 17.05 ? 393 ASN A N 1 ATOM 632 C CA . ASN A 1 85 ? -6.762 36.439 -14.397 1.00 21.14 ? 393 ASN A CA 1 ATOM 633 C C . ASN A 1 85 ? -6.643 34.938 -14.662 1.00 22.01 ? 393 ASN A C 1 ATOM 634 O O . ASN A 1 85 ? -7.146 34.117 -13.891 1.00 24.18 ? 393 ASN A O 1 ATOM 635 C CB . ASN A 1 85 ? -7.868 37.052 -15.256 1.00 24.47 ? 393 ASN A CB 1 ATOM 636 C CG . ASN A 1 85 ? -8.331 38.406 -14.734 1.00 31.50 ? 393 ASN A CG 1 ATOM 637 O OD1 . ASN A 1 85 ? -7.985 38.812 -13.624 1.00 30.86 ? 393 ASN A OD1 1 ATOM 638 N ND2 . ASN A 1 85 ? -9.134 39.099 -15.530 1.00 32.95 ? 393 ASN A ND2 1 ATOM 639 N N . THR A 1 86 ? -5.971 34.588 -15.750 1.00 21.25 ? 394 THR A N 1 ATOM 640 C CA . THR A 1 86 ? -5.734 33.185 -16.089 1.00 18.96 ? 394 THR A CA 1 ATOM 641 C C . THR A 1 86 ? -4.891 32.471 -15.025 1.00 18.98 ? 394 THR A C 1 ATOM 642 O O . THR A 1 86 ? -5.232 31.371 -14.599 1.00 21.80 ? 394 THR A O 1 ATOM 643 C CB . THR A 1 86 ? -5.094 33.057 -17.484 1.00 22.62 ? 394 THR A CB 1 ATOM 644 O OG1 . THR A 1 86 ? -5.972 33.640 -18.453 1.00 24.58 ? 394 THR A OG1 1 ATOM 645 C CG2 . THR A 1 86 ? -4.843 31.588 -17.851 1.00 23.86 ? 394 THR A CG2 1 ATOM 646 N N . LEU A 1 87 ? -3.807 33.102 -14.582 1.00 17.77 ? 395 LEU A N 1 ATOM 647 C CA . LEU A 1 87 ? -2.965 32.507 -13.538 1.00 18.12 ? 395 LEU A CA 1 ATOM 648 C C . LEU A 1 87 ? -3.725 32.324 -12.227 1.00 17.67 ? 395 LEU A C 1 ATOM 649 O O . LEU A 1 87 ? -3.565 31.305 -11.539 1.00 19.77 ? 395 LEU A O 1 ATOM 650 C CB . LEU A 1 87 ? -1.706 33.340 -13.307 1.00 17.61 ? 395 LEU A CB 1 ATOM 651 C CG . LEU A 1 87 ? -0.695 33.337 -14.458 1.00 20.48 ? 395 LEU A CG 1 ATOM 652 C CD1 . LEU A 1 87 ? 0.517 34.214 -14.136 1.00 20.29 ? 395 LEU A CD1 1 ATOM 653 C CD2 . LEU A 1 87 ? -0.265 31.914 -14.775 1.00 20.42 ? 395 LEU A CD2 1 ATOM 654 N N . LYS A 1 88 ? -4.540 33.317 -11.881 1.00 17.30 ? 396 LYS A N 1 ATOM 655 C CA . LYS A 1 88 ? -5.409 33.230 -10.711 1.00 21.37 ? 396 LYS A CA 1 ATOM 656 C C . LYS A 1 88 ? -6.266 31.968 -10.785 1.00 23.59 ? 396 LYS A C 1 ATOM 657 O O . LYS A 1 88 ? -6.377 31.212 -9.811 1.00 23.87 ? 396 LYS A O 1 ATOM 658 C CB . LYS A 1 88 ? -6.291 34.484 -10.618 1.00 23.26 ? 396 LYS A CB 1 ATOM 659 C CG . LYS A 1 88 ? -7.204 34.557 -9.408 1.00 26.95 ? 396 LYS A CG 1 ATOM 660 C CD . LYS A 1 88 ? -8.036 35.838 -9.464 1.00 31.76 ? 396 LYS A CD 1 ATOM 661 C CE . LYS A 1 88 ? -9.202 35.836 -8.480 1.00 37.78 ? 396 LYS A CE 1 ATOM 662 N NZ . LYS A 1 88 ? -8.782 36.106 -7.075 1.00 39.77 ? 396 LYS A NZ 1 ATOM 663 N N . GLU A 1 89 ? -6.863 31.731 -11.946 1.00 22.54 ? 397 GLU A N 1 ATOM 664 C CA . GLU A 1 89 ? -7.718 30.563 -12.121 1.00 27.26 ? 397 GLU A CA 1 ATOM 665 C C . GLU A 1 89 ? -6.917 29.250 -12.089 1.00 27.13 ? 397 GLU A C 1 ATOM 666 O O . GLU A 1 89 ? -7.434 28.211 -11.672 1.00 27.79 ? 397 GLU A O 1 ATOM 667 C CB . GLU A 1 89 ? -8.535 30.683 -13.408 1.00 30.57 ? 397 GLU A CB 1 ATOM 668 C CG . GLU A 1 89 ? -9.539 29.572 -13.607 1.00 38.50 ? 397 GLU A CG 1 ATOM 669 C CD . GLU A 1 89 ? -10.517 29.871 -14.723 1.00 44.03 ? 397 GLU A CD 1 ATOM 670 O OE1 . GLU A 1 89 ? -10.466 30.995 -15.274 1.00 45.28 ? 397 GLU A OE1 1 ATOM 671 O OE2 . GLU A 1 89 ? -11.334 28.982 -15.047 1.00 46.16 ? 397 GLU A OE2 1 ATOM 672 N N . MET A 1 90 ? -5.654 29.303 -12.512 1.00 23.60 ? 398 MET A N 1 ATOM 673 C CA . MET A 1 90 ? -4.765 28.139 -12.426 1.00 26.56 ? 398 MET A CA 1 ATOM 674 C C . MET A 1 90 ? -4.208 27.964 -11.016 1.00 25.15 ? 398 MET A C 1 ATOM 675 O O . MET A 1 90 ? -3.374 27.085 -10.770 1.00 25.85 ? 398 MET A O 1 ATOM 676 C CB . MET A 1 90 ? -3.606 28.270 -13.415 1.00 26.95 ? 398 MET A CB 1 ATOM 677 C CG . MET A 1 90 ? -4.042 28.409 -14.862 1.00 28.32 ? 398 MET A CG 1 ATOM 678 S SD . MET A 1 90 ? -2.655 28.701 -15.977 1.00 30.63 ? 398 MET A SD 1 ATOM 679 C CE . MET A 1 90 ? -1.703 27.203 -15.735 1.00 33.54 ? 398 MET A CE 1 ATOM 680 N N . GLN A 1 91 ? -4.670 28.813 -10.105 1.00 25.41 ? 399 GLN A N 1 ATOM 681 C CA . GLN A 1 91 ? -4.247 28.811 -8.704 1.00 29.03 ? 399 GLN A CA 1 ATOM 682 C C . GLN A 1 91 ? -2.791 29.236 -8.484 1.00 28.13 ? 399 GLN A C 1 ATOM 683 O O . GLN A 1 91 ? -2.214 28.977 -7.425 1.00 27.13 ? 399 GLN A O 1 ATOM 684 C CB . GLN A 1 91 ? -4.565 27.471 -8.019 1.00 33.96 ? 399 GLN A CB 1 ATOM 685 C CG . GLN A 1 91 ? -6.060 27.178 -7.934 1.00 40.09 ? 399 GLN A CG 1 ATOM 686 C CD . GLN A 1 91 ? -6.384 25.917 -7.147 1.00 49.41 ? 399 GLN A CD 1 ATOM 687 O OE1 . GLN A 1 91 ? -5.496 25.135 -6.802 1.00 51.66 ? 399 GLN A OE1 1 ATOM 688 N NE2 . GLN A 1 91 ? -7.667 25.716 -6.858 1.00 52.92 ? 399 GLN A NE2 1 ATOM 689 N N . ASP A 1 92 ? -2.205 29.902 -9.476 1.00 25.13 ? 400 ASP A N 1 ATOM 690 C CA . ASP A 1 92 ? -0.889 30.502 -9.300 1.00 23.96 ? 400 ASP A CA 1 ATOM 691 C C . ASP A 1 92 ? -1.109 31.934 -8.847 1.00 24.03 ? 400 ASP A C 1 ATOM 692 O O . ASP A 1 92 ? -1.183 32.849 -9.667 1.00 21.92 ? 400 ASP A O 1 ATOM 693 C CB . ASP A 1 92 ? -0.068 30.446 -10.599 1.00 23.59 ? 400 ASP A CB 1 ATOM 694 C CG . ASP A 1 92 ? 1.294 31.138 -10.479 1.00 26.81 ? 400 ASP A CG 1 ATOM 695 O OD1 . ASP A 1 92 ? 1.664 31.578 -9.369 1.00 27.15 ? 400 ASP A OD1 1 ATOM 696 O OD2 . ASP A 1 92 ? 2.006 31.241 -11.509 1.00 26.33 ? 400 ASP A OD2 1 ATOM 697 N N . VAL A 1 93 ? -1.215 32.116 -7.533 1.00 23.43 ? 401 VAL A N 1 ATOM 698 C CA . VAL A 1 93 ? -1.540 33.415 -6.958 1.00 28.09 ? 401 VAL A CA 1 ATOM 699 C C . VAL A 1 93 ? -0.387 34.409 -7.035 1.00 26.17 ? 401 VAL A C 1 ATOM 700 O O . VAL A 1 93 ? -0.595 35.581 -7.350 1.00 28.03 ? 401 VAL A O 1 ATOM 701 C CB . VAL A 1 93 ? -2.015 33.283 -5.494 1.00 32.00 ? 401 VAL A CB 1 ATOM 702 C CG1 . VAL A 1 93 ? -2.180 34.652 -4.862 1.00 35.18 ? 401 VAL A CG1 1 ATOM 703 C CG2 . VAL A 1 93 ? -3.320 32.511 -5.441 1.00 34.40 ? 401 VAL A CG2 1 ATOM 704 N N . GLN A 1 94 ? 0.826 33.953 -6.742 1.00 23.54 ? 402 GLN A N 1 ATOM 705 C CA . GLN A 1 94 ? 1.978 34.844 -6.826 1.00 26.04 ? 402 GLN A CA 1 ATOM 706 C C . GLN A 1 94 ? 2.126 35.343 -8.254 1.00 25.45 ? 402 GLN A C 1 ATOM 707 O O . GLN A 1 94 ? 2.389 36.522 -8.481 1.00 27.59 ? 402 GLN A O 1 ATOM 708 C CB . GLN A 1 94 ? 3.263 34.153 -6.376 1.00 32.08 ? 402 GLN A CB 1 ATOM 709 C CG . GLN A 1 94 ? 3.386 33.986 -4.873 1.00 41.13 ? 402 GLN A CG 1 ATOM 710 C CD . GLN A 1 94 ? 4.780 33.554 -4.457 1.00 49.03 ? 402 GLN A CD 1 ATOM 711 O OE1 . GLN A 1 94 ? 5.779 34.029 -5.001 1.00 50.37 ? 402 GLN A OE1 1 ATOM 712 N NE2 . GLN A 1 94 ? 4.853 32.639 -3.496 1.00 53.52 ? 402 GLN A NE2 1 ATOM 713 N N . GLY A 1 95 ? 1.930 34.440 -9.207 1.00 25.54 ? 403 GLY A N 1 ATOM 714 C CA . GLY A 1 95 ? 2.056 34.773 -10.613 1.00 24.37 ? 403 GLY A CA 1 ATOM 715 C C . GLY A 1 95 ? 1.049 35.827 -11.023 1.00 22.01 ? 403 GLY A C 1 ATOM 716 O O . GLY A 1 95 ? 1.407 36.805 -11.682 1.00 19.84 ? 403 GLY A O 1 ATOM 717 N N . ALA A 1 96 ? -0.206 35.629 -10.625 1.00 21.50 ? 404 ALA A N 1 ATOM 718 C CA . ALA A 1 96 ? -1.275 36.569 -10.951 1.00 22.69 ? 404 ALA A CA 1 ATOM 719 C C . ALA A 1 96 ? -0.963 37.946 -10.398 1.00 23.43 ? 404 ALA A C 1 ATOM 720 O O . ALA A 1 96 ? -1.127 38.955 -11.086 1.00 21.30 ? 404 ALA A O 1 ATOM 721 C CB . ALA A 1 96 ? -2.621 36.076 -10.415 1.00 20.27 ? 404 ALA A CB 1 ATOM 722 N N . LEU A 1 97 ? -0.511 37.987 -9.149 1.00 21.14 ? 405 LEU A N 1 ATOM 723 C CA . LEU A 1 97 ? -0.161 39.258 -8.523 1.00 25.59 ? 405 LEU A CA 1 ATOM 724 C C . LEU A 1 97 ? 0.950 39.963 -9.301 1.00 23.86 ? 405 LEU A C 1 ATOM 725 O O . LEU A 1 97 ? 0.906 41.182 -9.472 1.00 24.37 ? 405 LEU A O 1 ATOM 726 C CB . LEU A 1 97 ? 0.245 39.058 -7.058 1.00 29.95 ? 405 LEU A CB 1 ATOM 727 C CG . LEU A 1 97 ? 0.113 40.282 -6.145 1.00 34.54 ? 405 LEU A CG 1 ATOM 728 C CD1 . LEU A 1 97 ? -0.105 39.835 -4.720 1.00 37.61 ? 405 LEU A CD1 1 ATOM 729 C CD2 . LEU A 1 97 ? 1.348 41.169 -6.228 1.00 36.64 ? 405 LEU A CD2 1 ATOM 730 N N . GLN A 1 98 ? 1.938 39.200 -9.768 1.00 25.01 ? 406 GLN A N 1 ATOM 731 C CA . GLN A 1 98 ? 3.036 39.767 -10.556 1.00 26.01 ? 406 GLN A CA 1 ATOM 732 C C . GLN A 1 98 ? 2.512 40.444 -11.815 1.00 22.37 ? 406 GLN A C 1 ATOM 733 O O . GLN A 1 98 ? 2.918 41.555 -12.136 1.00 23.51 ? 406 GLN A O 1 ATOM 734 C CB . GLN A 1 98 ? 4.070 38.703 -10.951 1.00 30.22 ? 406 GLN A CB 1 ATOM 735 C CG . GLN A 1 98 ? 4.779 38.044 -9.785 1.00 35.91 ? 406 GLN A CG 1 ATOM 736 C CD . GLN A 1 98 ? 5.222 39.042 -8.732 1.00 39.92 ? 406 GLN A CD 1 ATOM 737 O OE1 . GLN A 1 98 ? 5.896 40.031 -9.037 1.00 39.08 ? 406 GLN A OE1 1 ATOM 738 N NE2 . GLN A 1 98 ? 4.837 38.790 -7.482 1.00 40.36 ? 406 GLN A NE2 1 ATOM 739 N N . CYS A 1 99 ? 1.618 39.755 -12.521 1.00 18.68 ? 407 CYS A N 1 ATOM 740 C CA . CYS A 1 99 ? 0.959 40.299 -13.704 1.00 20.03 ? 407 CYS A CA 1 ATOM 741 C C . CYS A 1 99 ? 0.152 41.564 -13.435 1.00 19.44 ? 407 CYS A C 1 ATOM 742 O O . CYS A 1 99 ? 0.218 42.521 -14.207 1.00 21.80 ? 407 CYS A O 1 ATOM 743 C CB . CYS A 1 99 ? 0.039 39.247 -14.336 1.00 22.77 ? 407 CYS A CB 1 ATOM 744 S SG . CYS A 1 99 ? 0.893 37.860 -15.133 1.00 26.62 ? 407 CYS A SG 1 ATOM 745 N N . TYR A 1 100 ? -0.663 41.544 -12.383 1.00 19.64 ? 408 TYR A N 1 ATOM 746 C CA . TYR A 1 100 ? -1.451 42.714 -12.015 1.00 20.75 ? 408 TYR A CA 1 ATOM 747 C C . TYR A 1 100 ? -0.530 43.879 -11.668 1.00 19.97 ? 408 TYR A C 1 ATOM 748 O O . TYR A 1 100 ? -0.818 45.031 -11.993 1.00 17.63 ? 408 TYR A O 1 ATOM 749 C CB . TYR A 1 100 ? -2.353 42.415 -10.816 1.00 22.68 ? 408 TYR A CB 1 ATOM 750 C CG . TYR A 1 100 ? -3.401 41.346 -11.052 1.00 20.50 ? 408 TYR A CG 1 ATOM 751 C CD1 . TYR A 1 100 ? -4.068 41.242 -12.270 1.00 20.77 ? 408 TYR A CD1 1 ATOM 752 C CD2 . TYR A 1 100 ? -3.724 40.444 -10.051 1.00 16.49 ? 408 TYR A CD2 1 ATOM 753 C CE1 . TYR A 1 100 ? -5.025 40.257 -12.478 1.00 21.79 ? 408 TYR A CE1 1 ATOM 754 C CE2 . TYR A 1 100 ? -4.680 39.461 -10.250 1.00 19.06 ? 408 TYR A CE2 1 ATOM 755 C CZ . TYR A 1 100 ? -5.325 39.371 -11.460 1.00 22.83 ? 408 TYR A CZ 1 ATOM 756 O OH . TYR A 1 100 ? -6.279 38.390 -11.636 1.00 24.22 ? 408 TYR A OH 1 ATOM 757 N N . THR A 1 101 ? 0.575 43.565 -10.997 1.00 18.12 ? 409 THR A N 1 ATOM 758 C CA . THR A 1 101 ? 1.571 44.569 -10.628 1.00 16.58 ? 409 THR A CA 1 ATOM 759 C C . THR A 1 101 ? 2.211 45.207 -11.858 1.00 19.15 ? 409 THR A C 1 ATOM 760 O O . THR A 1 101 ? 2.345 46.423 -11.934 1.00 21.67 ? 409 THR A O 1 ATOM 761 C CB . THR A 1 101 ? 2.661 43.959 -9.714 1.00 16.27 ? 409 THR A CB 1 ATOM 762 O OG1 . THR A 1 101 ? 2.034 43.390 -8.555 1.00 27.73 ? 409 THR A OG1 1 ATOM 763 C CG2 . THR A 1 101 ? 3.654 45.031 -9.266 1.00 18.42 ? 409 THR A CG2 1 ATOM 764 N N . ARG A 1 102 ? 2.615 44.386 -12.822 1.00 19.91 ? 410 ARG A N 1 ATOM 765 C CA . ARG A 1 102 ? 3.160 44.917 -14.067 1.00 21.10 ? 410 ARG A CA 1 ATOM 766 C C . ARG A 1 102 ? 2.127 45.765 -14.800 1.00 21.61 ? 410 ARG A C 1 ATOM 767 O O . ARG A 1 102 ? 2.456 46.822 -15.333 1.00 22.33 ? 410 ARG A O 1 ATOM 768 C CB . ARG A 1 102 ? 3.670 43.790 -14.974 1.00 21.46 ? 410 ARG A CB 1 ATOM 769 C CG . ARG A 1 102 ? 4.933 43.115 -14.467 1.00 23.71 ? 410 ARG A CG 1 ATOM 770 C CD . ARG A 1 102 ? 6.121 44.071 -14.520 1.00 24.82 ? 410 ARG A CD 1 ATOM 771 N NE . ARG A 1 102 ? 6.437 44.470 -15.891 1.00 23.44 ? 410 ARG A NE 1 ATOM 772 C CZ . ARG A 1 102 ? 6.444 45.725 -16.334 1.00 25.06 ? 410 ARG A CZ 1 ATOM 773 N NH1 . ARG A 1 102 ? 6.160 46.730 -15.520 1.00 23.36 ? 410 ARG A NH1 1 ATOM 774 N NH2 . ARG A 1 102 ? 6.747 45.977 -17.600 1.00 27.25 ? 410 ARG A NH2 1 ATOM 775 N N . ALA A 1 103 ? 0.878 45.310 -14.821 1.00 19.45 ? 411 ALA A N 1 ATOM 776 C CA . ALA A 1 103 ? -0.180 46.066 -15.496 1.00 22.22 ? 411 ALA A CA 1 ATOM 777 C C . ALA A 1 103 ? -0.314 47.486 -14.941 1.00 22.39 ? 411 ALA A C 1 ATOM 778 O O . ALA A 1 103 ? -0.418 48.455 -15.700 1.00 23.44 ? 411 ALA A O 1 ATOM 779 C CB . ALA A 1 103 ? -1.510 45.322 -15.412 1.00 20.56 ? 411 ALA A CB 1 ATOM 780 N N . ILE A 1 104 ? -0.296 47.593 -13.615 1.00 23.35 ? 412 ILE A N 1 ATOM 781 C CA . ILE A 1 104 ? -0.401 48.869 -12.916 1.00 23.74 ? 412 ILE A CA 1 ATOM 782 C C . ILE A 1 104 ? 0.844 49.741 -13.127 1.00 28.09 ? 412 ILE A C 1 ATOM 783 O O . ILE A 1 104 ? 0.753 50.968 -13.201 1.00 28.34 ? 412 ILE A O 1 ATOM 784 C CB . ILE A 1 104 ? -0.689 48.631 -11.407 1.00 32.62 ? 412 ILE A CB 1 ATOM 785 C CG1 . ILE A 1 104 ? -2.130 48.133 -11.220 1.00 28.19 ? 412 ILE A CG1 1 ATOM 786 C CG2 . ILE A 1 104 ? -0.460 49.892 -10.591 1.00 37.20 ? 412 ILE A CG2 1 ATOM 787 C CD1 . ILE A 1 104 ? -2.424 47.539 -9.834 1.00 26.06 ? 412 ILE A CD1 1 ATOM 788 N N . GLN A 1 105 ? 2.006 49.108 -13.259 1.00 27.05 ? 413 GLN A N 1 ATOM 789 C CA . GLN A 1 105 ? 3.237 49.848 -13.529 1.00 27.50 ? 413 GLN A CA 1 ATOM 790 C C . GLN A 1 105 ? 3.235 50.437 -14.939 1.00 29.80 ? 413 GLN A C 1 ATOM 791 O O . GLN A 1 105 ? 3.651 51.576 -15.147 1.00 32.41 ? 413 GLN A O 1 ATOM 792 C CB . GLN A 1 105 ? 4.463 48.951 -13.341 1.00 26.17 ? 413 GLN A CB 1 ATOM 793 C CG . GLN A 1 105 ? 4.776 48.579 -11.899 1.00 30.18 ? 413 GLN A CG 1 ATOM 794 C CD . GLN A 1 105 ? 6.033 47.721 -11.791 1.00 33.25 ? 413 GLN A CD 1 ATOM 795 O OE1 . GLN A 1 105 ? 6.356 46.958 -12.703 1.00 32.72 ? 413 GLN A OE1 1 ATOM 796 N NE2 . GLN A 1 105 ? 6.751 47.855 -10.682 1.00 33.02 ? 413 GLN A NE2 1 ATOM 797 N N . ILE A 1 106 ? 2.765 49.654 -15.904 1.00 27.70 ? 414 ILE A N 1 ATOM 798 C CA . ILE A 1 106 ? 2.660 50.110 -17.282 1.00 28.41 ? 414 ILE A CA 1 ATOM 799 C C . ILE A 1 106 ? 1.634 51.239 -17.414 1.00 30.72 ? 414 ILE A C 1 ATOM 800 O O . ILE A 1 106 ? 1.872 52.232 -18.101 1.00 28.89 ? 414 ILE A O 1 ATOM 801 C CB . ILE A 1 106 ? 2.284 48.945 -18.217 1.00 27.99 ? 414 ILE A CB 1 ATOM 802 C CG1 . ILE A 1 106 ? 3.377 47.875 -18.186 1.00 22.95 ? 414 ILE A CG1 1 ATOM 803 C CG2 . ILE A 1 106 ? 2.072 49.444 -19.644 1.00 28.74 ? 414 ILE A CG2 1 ATOM 804 C CD1 . ILE A 1 106 ? 2.997 46.602 -18.888 1.00 26.50 ? 414 ILE A CD1 1 ATOM 805 N N . ASN A 1 107 ? 0.496 51.078 -16.743 1.00 28.90 ? 415 ASN A N 1 ATOM 806 C CA . ASN A 1 107 ? -0.550 52.096 -16.731 1.00 31.54 ? 415 ASN A CA 1 ATOM 807 C C . ASN A 1 107 ? -1.180 52.248 -15.343 1.00 31.57 ? 415 ASN A C 1 ATOM 808 O O . ASN A 1 107 ? -2.092 51.506 -14.990 1.00 31.04 ? 415 ASN A O 1 ATOM 809 C CB . ASN A 1 107 ? -1.620 51.763 -17.775 1.00 32.89 ? 415 ASN A CB 1 ATOM 810 C CG . ASN A 1 107 ? -2.770 52.763 -17.785 1.00 32.71 ? 415 ASN A CG 1 ATOM 811 O OD1 . ASN A 1 107 ? -2.737 53.784 -17.097 1.00 32.17 ? 415 ASN A OD1 1 ATOM 812 N ND2 . ASN A 1 107 ? -3.792 52.472 -18.582 1.00 32.99 ? 415 ASN A ND2 1 ATOM 813 N N . PRO A 1 108 ? -0.707 53.233 -14.562 1.00 33.16 ? 416 PRO A N 1 ATOM 814 C CA . PRO A 1 108 ? -1.171 53.464 -13.187 1.00 34.66 ? 416 PRO A CA 1 ATOM 815 C C . PRO A 1 108 ? -2.662 53.784 -13.110 1.00 32.76 ? 416 PRO A C 1 ATOM 816 O O . PRO A 1 108 ? -3.265 53.618 -12.051 1.00 34.35 ? 416 PRO A O 1 ATOM 817 C CB . PRO A 1 108 ? -0.348 54.678 -12.742 1.00 38.73 ? 416 PRO A CB 1 ATOM 818 C CG . PRO A 1 108 ? 0.867 54.654 -13.615 1.00 38.14 ? 416 PRO A CG 1 ATOM 819 C CD . PRO A 1 108 ? 0.377 54.157 -14.939 1.00 35.97 ? 416 PRO A CD 1 ATOM 820 N N . ALA A 1 109 ? -3.244 54.218 -14.225 1.00 31.49 ? 417 ALA A N 1 ATOM 821 C CA . ALA A 1 109 ? -4.650 54.607 -14.265 1.00 30.44 ? 417 ALA A CA 1 ATOM 822 C C . ALA A 1 109 ? -5.552 53.459 -14.701 1.00 28.96 ? 417 ALA A C 1 ATOM 823 O O . ALA A 1 109 ? -6.731 53.666 -14.995 1.00 31.56 ? 417 ALA A O 1 ATOM 824 C CB . ALA A 1 109 ? -4.834 55.798 -15.192 1.00 29.25 ? 417 ALA A CB 1 ATOM 825 N N . PHE A 1 110 ? -4.997 52.252 -14.742 1.00 22.62 ? 418 PHE A N 1 ATOM 826 C CA . PHE A 1 110 ? -5.749 51.077 -15.175 1.00 24.01 ? 418 PHE A CA 1 ATOM 827 C C . PHE A 1 110 ? -6.631 50.575 -14.025 1.00 21.56 ? 418 PHE A C 1 ATOM 828 O O . PHE A 1 110 ? -6.186 49.805 -13.176 1.00 23.58 ? 418 PHE A O 1 ATOM 829 C CB . PHE A 1 110 ? -4.783 49.987 -15.663 1.00 25.12 ? 418 PHE A CB 1 ATOM 830 C CG . PHE A 1 110 ? -5.448 48.834 -16.377 1.00 28.48 ? 418 PHE A CG 1 ATOM 831 C CD1 . PHE A 1 110 ? -6.794 48.869 -16.705 1.00 30.08 ? 418 PHE A CD1 1 ATOM 832 C CD2 . PHE A 1 110 ? -4.713 47.709 -16.715 1.00 29.54 ? 418 PHE A CD2 1 ATOM 833 C CE1 . PHE A 1 110 ? -7.394 47.802 -17.355 1.00 33.58 ? 418 PHE A CE1 1 ATOM 834 C CE2 . PHE A 1 110 ? -5.309 46.637 -17.360 1.00 33.47 ? 418 PHE A CE2 1 ATOM 835 C CZ . PHE A 1 110 ? -6.651 46.684 -17.680 1.00 33.63 ? 418 PHE A CZ 1 ATOM 836 N N . ALA A 1 111 ? -7.886 51.019 -14.017 1.00 22.90 ? 419 ALA A N 1 ATOM 837 C CA . ALA A 1 111 ? -8.834 50.703 -12.944 1.00 27.35 ? 419 ALA A CA 1 ATOM 838 C C . ALA A 1 111 ? -9.018 49.205 -12.721 1.00 27.88 ? 419 ALA A C 1 ATOM 839 O O . ALA A 1 111 ? -8.986 48.730 -11.577 1.00 25.32 ? 419 ALA A O 1 ATOM 840 C CB . ALA A 1 111 ? -10.184 51.367 -13.219 1.00 31.86 ? 419 ALA A CB 1 ATOM 841 N N . ASP A 1 112 ? -9.213 48.464 -13.810 1.00 25.64 ? 420 ASP A N 1 ATOM 842 C CA . ASP A 1 112 ? -9.440 47.023 -13.721 1.00 27.68 ? 420 ASP A CA 1 ATOM 843 C C . ASP A 1 112 ? -8.284 46.304 -13.037 1.00 26.56 ? 420 ASP A C 1 ATOM 844 O O . ASP A 1 112 ? -8.494 45.348 -12.283 1.00 24.72 ? 420 ASP A O 1 ATOM 845 C CB . ASP A 1 112 ? -9.666 46.414 -15.108 1.00 34.58 ? 420 ASP A CB 1 ATOM 846 C CG . ASP A 1 112 ? -10.973 46.858 -15.742 1.00 41.74 ? 420 ASP A CG 1 ATOM 847 O OD1 . ASP A 1 112 ? -11.858 47.364 -15.018 1.00 42.53 ? 420 ASP A OD1 1 ATOM 848 O OD2 . ASP A 1 112 ? -11.117 46.688 -16.970 1.00 45.03 ? 420 ASP A OD2 1 ATOM 849 N N . ALA A 1 113 ? -7.060 46.751 -13.310 1.00 24.52 ? 421 ALA A N 1 ATOM 850 C CA . ALA A 1 113 ? -5.884 46.086 -12.746 1.00 21.76 ? 421 ALA A CA 1 ATOM 851 C C . ALA A 1 113 ? -5.799 46.287 -11.237 1.00 19.67 ? 421 ALA A C 1 ATOM 852 O O . ALA A 1 113 ? -5.401 45.381 -10.498 1.00 20.56 ? 421 ALA A O 1 ATOM 853 C CB . ALA A 1 113 ? -4.598 46.554 -13.442 1.00 19.17 ? 421 ALA A CB 1 ATOM 854 N N . HIS A 1 114 ? -6.180 47.474 -10.774 1.00 20.46 ? 422 HIS A N 1 ATOM 855 C CA . HIS A 1 114 ? -6.224 47.737 -9.333 1.00 23.31 ? 422 HIS A CA 1 ATOM 856 C C . HIS A 1 114 ? -7.276 46.880 -8.631 1.00 21.68 ? 422 HIS A C 1 ATOM 857 O O . HIS A 1 114 ? -7.035 46.336 -7.545 1.00 20.25 ? 422 HIS A O 1 ATOM 858 C CB . HIS A 1 114 ? -6.472 49.223 -9.059 1.00 25.10 ? 422 HIS A CB 1 ATOM 859 C CG . HIS A 1 114 ? -5.269 50.087 -9.283 1.00 22.97 ? 422 HIS A CG 1 ATOM 860 N ND1 . HIS A 1 114 ? -4.181 50.079 -8.436 1.00 21.05 ? 422 HIS A ND1 1 ATOM 861 C CD2 . HIS A 1 114 ? -4.984 50.989 -10.252 1.00 23.81 ? 422 HIS A CD2 1 ATOM 862 C CE1 . HIS A 1 114 ? -3.278 50.939 -8.874 1.00 23.35 ? 422 HIS A CE1 1 ATOM 863 N NE2 . HIS A 1 114 ? -3.740 51.503 -9.975 1.00 21.82 ? 422 HIS A NE2 1 ATOM 864 N N . SER A 1 115 ? -8.440 46.748 -9.255 1.00 23.68 ? 423 SER A N 1 ATOM 865 C CA . SER A 1 115 ? -9.505 45.914 -8.703 1.00 20.64 ? 423 SER A CA 1 ATOM 866 C C . SER A 1 115 ? -9.061 44.454 -8.678 1.00 20.32 ? 423 SER A C 1 ATOM 867 O O . SER A 1 115 ? -9.279 43.749 -7.699 1.00 19.06 ? 423 SER A O 1 ATOM 868 C CB . SER A 1 115 ? -10.774 46.059 -9.545 1.00 22.83 ? 423 SER A CB 1 ATOM 869 O OG . SER A 1 115 ? -11.880 45.437 -8.916 1.00 25.83 ? 423 SER A OG 1 ATOM 870 N N . ASN A 1 116 ? -8.427 44.007 -9.757 1.00 17.31 ? 424 ASN A N 1 ATOM 871 C CA . ASN A 1 116 ? -7.943 42.632 -9.828 1.00 19.07 ? 424 ASN A CA 1 ATOM 872 C C . ASN A 1 116 ? -6.895 42.379 -8.750 1.00 20.35 ? 424 ASN A C 1 ATOM 873 O O . ASN A 1 116 ? -6.905 41.324 -8.105 1.00 22.16 ? 424 ASN A O 1 ATOM 874 C CB . ASN A 1 116 ? -7.378 42.312 -11.215 1.00 24.74 ? 424 ASN A CB 1 ATOM 875 C CG . ASN A 1 116 ? -8.458 42.172 -12.280 1.00 27.75 ? 424 ASN A CG 1 ATOM 876 O OD1 . ASN A 1 116 ? -9.629 41.947 -11.979 1.00 28.60 ? 424 ASN A OD1 1 ATOM 877 N ND2 . ASN A 1 116 ? -8.057 42.285 -13.535 1.00 26.62 ? 424 ASN A ND2 1 ATOM 878 N N . LEU A 1 117 ? -6.009 43.355 -8.534 1.00 18.75 ? 425 LEU A N 1 ATOM 879 C CA . LEU A 1 117 ? -5.046 43.253 -7.427 1.00 23.39 ? 425 LEU A CA 1 ATOM 880 C C . LEU A 1 117 ? -5.748 43.204 -6.072 1.00 22.40 ? 425 LEU A C 1 ATOM 881 O O . LEU A 1 117 ? -5.360 42.435 -5.182 1.00 19.65 ? 425 LEU A O 1 ATOM 882 C CB . LEU A 1 117 ? -4.041 44.408 -7.454 1.00 21.24 ? 425 LEU A CB 1 ATOM 883 C CG . LEU A 1 117 ? -3.020 44.454 -6.310 1.00 22.23 ? 425 LEU A CG 1 ATOM 884 C CD1 . LEU A 1 117 ? -2.274 43.133 -6.190 1.00 26.00 ? 425 LEU A CD1 1 ATOM 885 C CD2 . LEU A 1 117 ? -2.046 45.617 -6.496 1.00 18.32 ? 425 LEU A CD2 1 ATOM 886 N N . ALA A 1 118 ? -6.787 44.019 -5.913 1.00 20.03 ? 426 ALA A N 1 ATOM 887 C CA . ALA A 1 118 ? -7.547 44.020 -4.665 1.00 20.87 ? 426 ALA A CA 1 ATOM 888 C C . ALA A 1 118 ? -8.132 42.642 -4.363 1.00 22.17 ? 426 ALA A C 1 ATOM 889 O O . ALA A 1 118 ? -8.108 42.188 -3.218 1.00 22.78 ? 426 ALA A O 1 ATOM 890 C CB . ALA A 1 118 ? -8.634 45.052 -4.708 1.00 20.12 ? 426 ALA A CB 1 ATOM 891 N N . SER A 1 119 ? -8.644 41.977 -5.395 1.00 21.59 ? 427 SER A N 1 ATOM 892 C CA . SER A 1 119 ? -9.233 40.646 -5.234 1.00 24.65 ? 427 SER A CA 1 ATOM 893 C C . SER A 1 119 ? -8.209 39.601 -4.775 1.00 25.78 ? 427 SER A C 1 ATOM 894 O O . SER A 1 119 ? -8.545 38.685 -4.027 1.00 26.84 ? 427 SER A O 1 ATOM 895 C CB . SER A 1 119 ? -9.917 40.205 -6.532 1.00 30.72 ? 427 SER A CB 1 ATOM 896 O OG . SER A 1 119 ? -10.838 41.198 -6.971 1.00 34.10 ? 427 SER A OG 1 ATOM 897 N N . ILE A 1 120 ? -6.961 39.741 -5.219 1.00 24.15 ? 428 ILE A N 1 ATOM 898 C CA . ILE A 1 120 ? -5.885 38.872 -4.749 1.00 24.19 ? 428 ILE A CA 1 ATOM 899 C C . ILE A 1 120 ? -5.636 39.112 -3.269 1.00 27.64 ? 428 ILE A C 1 ATOM 900 O O . ILE A 1 120 ? -5.493 38.165 -2.484 1.00 28.57 ? 428 ILE A O 1 ATOM 901 C CB . ILE A 1 120 ? -4.572 39.079 -5.546 1.00 24.31 ? 428 ILE A CB 1 ATOM 902 C CG1 . ILE A 1 120 ? -4.742 38.588 -6.976 1.00 29.13 ? 428 ILE A CG1 1 ATOM 903 C CG2 . ILE A 1 120 ? -3.426 38.299 -4.902 1.00 27.49 ? 428 ILE A CG2 1 ATOM 904 C CD1 . ILE A 1 120 ? -4.909 37.080 -7.098 1.00 32.72 ? 428 ILE A CD1 1 ATOM 905 N N . HIS A 1 121 ? -5.613 40.382 -2.878 1.00 25.57 ? 429 HIS A N 1 ATOM 906 C CA . HIS A 1 121 ? -5.422 40.725 -1.472 1.00 26.13 ? 429 HIS A CA 1 ATOM 907 C C . HIS A 1 121 ? -6.586 40.197 -0.639 1.00 28.17 ? 429 HIS A C 1 ATOM 908 O O . HIS A 1 121 ? -6.392 39.653 0.457 1.00 29.45 ? 429 HIS A O 1 ATOM 909 C CB . HIS A 1 121 ? -5.283 42.243 -1.298 1.00 26.74 ? 429 HIS A CB 1 ATOM 910 C CG . HIS A 1 121 ? -3.980 42.793 -1.792 1.00 30.28 ? 429 HIS A CG 1 ATOM 911 N ND1 . HIS A 1 121 ? -2.793 42.099 -1.690 1.00 34.67 ? 429 HIS A ND1 1 ATOM 912 C CD2 . HIS A 1 121 ? -3.676 43.967 -2.394 1.00 30.87 ? 429 HIS A CD2 1 ATOM 913 C CE1 . HIS A 1 121 ? -1.815 42.823 -2.207 1.00 32.21 ? 429 HIS A CE1 1 ATOM 914 N NE2 . HIS A 1 121 ? -2.324 43.961 -2.639 1.00 28.71 ? 429 HIS A NE2 1 ATOM 915 N N . LYS A 1 122 ? -7.794 40.346 -1.174 1.00 26.94 ? 430 LYS A N 1 ATOM 916 C CA . LYS A 1 122 ? -9.002 39.889 -0.490 1.00 27.60 ? 430 LYS A CA 1 ATOM 917 C C . LYS A 1 122 ? -8.990 38.376 -0.283 1.00 31.96 ? 430 LYS A C 1 ATOM 918 O O . LYS A 1 122 ? -9.280 37.892 0.809 1.00 30.98 ? 430 LYS A O 1 ATOM 919 C CB . LYS A 1 122 ? -10.252 40.309 -1.270 1.00 27.85 ? 430 LYS A CB 1 ATOM 920 C CG . LYS A 1 122 ? -11.590 39.972 -0.587 1.00 30.67 ? 430 LYS A CG 1 ATOM 921 C CD . LYS A 1 122 ? -12.753 40.334 -1.518 1.00 33.80 ? 430 LYS A CD 1 ATOM 922 C CE . LYS A 1 122 ? -14.082 40.458 -0.778 1.00 37.50 ? 430 LYS A CE 1 ATOM 923 N NZ . LYS A 1 122 ? -14.502 39.180 -0.143 1.00 39.12 ? 430 LYS A NZ 1 ATOM 924 N N . ASP A 1 123 ? -8.651 37.634 -1.332 1.00 32.75 ? 431 ASP A N 1 ATOM 925 C CA . ASP A 1 123 ? -8.600 36.177 -1.246 1.00 38.80 ? 431 ASP A CA 1 ATOM 926 C C . ASP A 1 123 ? -7.454 35.722 -0.347 1.00 41.43 ? 431 ASP A C 1 ATOM 927 O O . ASP A 1 123 ? -7.487 34.627 0.216 1.00 44.11 ? 431 ASP A O 1 ATOM 928 C CB . ASP A 1 123 ? -8.451 35.555 -2.639 1.00 43.11 ? 431 ASP A CB 1 ATOM 929 C CG . ASP A 1 123 ? -9.605 35.904 -3.562 1.00 49.82 ? 431 ASP A CG 1 ATOM 930 O OD1 . ASP A 1 123 ? -10.698 36.229 -3.050 1.00 52.59 ? 431 ASP A OD1 1 ATOM 931 O OD2 . ASP A 1 123 ? -9.416 35.858 -4.799 1.00 51.72 ? 431 ASP A OD2 1 ATOM 932 N N . SER A 1 124 ? -6.444 36.574 -0.210 1.00 38.77 ? 432 SER A N 1 ATOM 933 C CA . SER A 1 124 ? -5.277 36.263 0.606 1.00 40.88 ? 432 SER A CA 1 ATOM 934 C C . SER A 1 124 ? -5.489 36.601 2.081 1.00 43.09 ? 432 SER A C 1 ATOM 935 O O . SER A 1 124 ? -4.629 36.320 2.917 1.00 46.99 ? 432 SER A O 1 ATOM 936 C CB . SER A 1 124 ? -4.048 37.003 0.072 1.00 39.36 ? 432 SER A CB 1 ATOM 937 O OG . SER A 1 124 ? -3.746 36.593 -1.250 1.00 37.63 ? 432 SER A OG 1 ATOM 938 N N . GLY A 1 125 ? -6.629 37.210 2.397 1.00 39.50 ? 433 GLY A N 1 ATOM 939 C CA . GLY A 1 125 ? -6.934 37.580 3.768 1.00 39.64 ? 433 GLY A CA 1 ATOM 940 C C . GLY A 1 125 ? -6.497 38.981 4.163 1.00 40.20 ? 433 GLY A C 1 ATOM 941 O O . GLY A 1 125 ? -6.759 39.423 5.284 1.00 45.56 ? 433 GLY A O 1 ATOM 942 N N . ASN A 1 126 ? -5.837 39.684 3.245 1.00 34.09 ? 434 ASN A N 1 ATOM 943 C CA . ASN A 1 126 ? -5.367 41.044 3.501 1.00 30.91 ? 434 ASN A CA 1 ATOM 944 C C . ASN A 1 126 ? -6.437 42.076 3.147 1.00 28.37 ? 434 ASN A C 1 ATOM 945 O O . ASN A 1 126 ? -6.315 42.813 2.166 1.00 25.47 ? 434 ASN A O 1 ATOM 946 C CB . ASN A 1 126 ? -4.075 41.328 2.722 1.00 32.31 ? 434 ASN A CB 1 ATOM 947 C CG . ASN A 1 126 ? -3.296 42.505 3.287 1.00 33.74 ? 434 ASN A CG 1 ATOM 948 O OD1 . ASN A 1 126 ? -3.870 43.417 3.881 1.00 35.40 ? 434 ASN A OD1 1 ATOM 949 N ND2 . ASN A 1 126 ? -1.981 42.487 3.108 1.00 34.25 ? 434 ASN A ND2 1 ATOM 950 N N . ILE A 1 127 ? -7.485 42.127 3.960 1.00 28.52 ? 435 ILE A N 1 ATOM 951 C CA . ILE A 1 127 ? -8.603 43.034 3.716 1.00 21.16 ? 435 ILE A CA 1 ATOM 952 C C . ILE A 1 127 ? -8.233 44.530 3.673 1.00 18.87 ? 435 ILE A C 1 ATOM 953 O O . ILE A 1 127 ? -8.730 45.254 2.814 1.00 23.03 ? 435 ILE A O 1 ATOM 954 C CB . ILE A 1 127 ? -9.772 42.783 4.716 1.00 26.51 ? 435 ILE A CB 1 ATOM 955 C CG1 . ILE A 1 127 ? -10.156 41.302 4.740 1.00 29.34 ? 435 ILE A CG1 1 ATOM 956 C CG2 . ILE A 1 127 ? -10.978 43.642 4.364 1.00 22.93 ? 435 ILE A CG2 1 ATOM 957 C CD1 . ILE A 1 127 ? -10.712 40.798 3.439 1.00 31.77 ? 435 ILE A CD1 1 ATOM 958 N N . PRO A 1 128 ? -7.373 45.009 4.599 1.00 26.12 ? 436 PRO A N 1 ATOM 959 C CA . PRO A 1 128 ? -7.024 46.434 4.529 1.00 28.56 ? 436 PRO A CA 1 ATOM 960 C C . PRO A 1 128 ? -6.360 46.827 3.210 1.00 28.08 ? 436 PRO A C 1 ATOM 961 O O . PRO A 1 128 ? -6.634 47.906 2.697 1.00 27.83 ? 436 PRO A O 1 ATOM 962 C CB . PRO A 1 128 ? -6.040 46.608 5.688 1.00 32.65 ? 436 PRO A CB 1 ATOM 963 C CG . PRO A 1 128 ? -6.453 45.573 6.673 1.00 34.51 ? 436 PRO A CG 1 ATOM 964 C CD . PRO A 1 128 ? -6.869 44.391 5.844 1.00 30.40 ? 436 PRO A CD 1 ATOM 965 N N . GLU A 1 129 ? -5.506 45.959 2.678 1.00 25.65 ? 437 GLU A N 1 ATOM 966 C CA . GLU A 1 129 ? -4.857 46.208 1.391 1.00 25.31 ? 437 GLU A CA 1 ATOM 967 C C . GLU A 1 129 ? -5.837 46.046 0.232 1.00 26.49 ? 437 GLU A C 1 ATOM 968 O O . GLU A 1 129 ? -5.759 46.766 -0.764 1.00 27.97 ? 437 GLU A O 1 ATOM 969 C CB . GLU A 1 129 ? -3.676 45.257 1.205 1.00 32.36 ? 437 GLU A CB 1 ATOM 970 C CG . GLU A 1 129 ? -2.551 45.827 0.357 1.00 42.04 ? 437 GLU A CG 1 ATOM 971 C CD . GLU A 1 129 ? -1.934 47.071 0.970 1.00 50.19 ? 437 GLU A CD 1 ATOM 972 O OE1 . GLU A 1 129 ? -1.074 46.934 1.870 1.00 54.38 ? 437 GLU A OE1 1 ATOM 973 O OE2 . GLU A 1 129 ? -2.307 48.188 0.551 1.00 51.76 ? 437 GLU A OE2 1 ATOM 974 N N . ALA A 1 130 ? -6.745 45.081 0.357 1.00 22.74 ? 438 ALA A N 1 ATOM 975 C CA . ALA A 1 130 ? -7.831 44.927 -0.600 1.00 19.88 ? 438 ALA A CA 1 ATOM 976 C C . ALA A 1 130 ? -8.695 46.195 -0.665 1.00 21.92 ? 438 ALA A C 1 ATOM 977 O O . ALA A 1 130 ? -8.979 46.701 -1.743 1.00 21.75 ? 438 ALA A O 1 ATOM 978 C CB . ALA A 1 130 ? -8.671 43.728 -0.240 1.00 19.96 ? 438 ALA A CB 1 ATOM 979 N N . ILE A 1 131 ? -9.105 46.708 0.495 1.00 19.95 ? 439 ILE A N 1 ATOM 980 C CA . ILE A 1 131 ? -9.867 47.959 0.549 1.00 20.67 ? 439 ILE A CA 1 ATOM 981 C C . ILE A 1 131 ? -9.121 49.139 -0.097 1.00 22.18 ? 439 ILE A C 1 ATOM 982 O O . ILE A 1 131 ? -9.712 49.920 -0.857 1.00 18.95 ? 439 ILE A O 1 ATOM 983 C CB . ILE A 1 131 ? -10.271 48.313 2.011 1.00 20.51 ? 439 ILE A CB 1 ATOM 984 C CG1 . ILE A 1 131 ? -11.391 47.397 2.500 1.00 17.66 ? 439 ILE A CG1 1 ATOM 985 C CG2 . ILE A 1 131 ? -10.732 49.769 2.120 1.00 21.42 ? 439 ILE A CG2 1 ATOM 986 C CD1 . ILE A 1 131 ? -11.520 47.363 4.030 1.00 19.05 ? 439 ILE A CD1 1 ATOM 987 N N . ALA A 1 132 ? -7.824 49.255 0.188 1.00 21.93 ? 440 ALA A N 1 ATOM 988 C CA . ALA A 1 132 ? -7.012 50.331 -0.384 1.00 24.91 ? 440 ALA A CA 1 ATOM 989 C C . ALA A 1 132 ? -6.993 50.276 -1.912 1.00 27.01 ? 440 ALA A C 1 ATOM 990 O O . ALA A 1 132 ? -7.169 51.296 -2.587 1.00 30.15 ? 440 ALA A O 1 ATOM 991 C CB . ALA A 1 132 ? -5.595 50.282 0.167 1.00 26.54 ? 440 ALA A CB 1 ATOM 992 N N . SER A 1 133 ? -6.791 49.078 -2.452 1.00 22.17 ? 441 SER A N 1 ATOM 993 C CA . SER A 1 133 ? -6.761 48.890 -3.899 1.00 23.41 ? 441 SER A CA 1 ATOM 994 C C . SER A 1 133 ? -8.134 49.074 -4.563 1.00 21.36 ? 441 SER A C 1 ATOM 995 O O . SER A 1 133 ? -8.216 49.643 -5.651 1.00 20.80 ? 441 SER A O 1 ATOM 996 C CB . SER A 1 133 ? -6.131 47.540 -4.268 1.00 23.24 ? 441 SER A CB 1 ATOM 997 O OG . SER A 1 133 ? -4.715 47.581 -4.119 1.00 25.37 ? 441 SER A OG 1 ATOM 998 N N . TYR A 1 134 ? -9.207 48.613 -3.919 1.00 21.33 ? 442 TYR A N 1 ATOM 999 C CA . TYR A 1 134 ? -10.547 48.846 -4.463 1.00 23.19 ? 442 TYR A CA 1 ATOM 1000 C C . TYR A 1 134 ? -10.899 50.333 -4.510 1.00 22.30 ? 442 TYR A C 1 ATOM 1001 O O . TYR A 1 134 ? -11.542 50.787 -5.450 1.00 21.32 ? 442 TYR A O 1 ATOM 1002 C CB . TYR A 1 134 ? -11.624 48.100 -3.676 1.00 24.10 ? 442 TYR A CB 1 ATOM 1003 C CG . TYR A 1 134 ? -11.741 46.641 -4.032 1.00 23.42 ? 442 TYR A CG 1 ATOM 1004 C CD1 . TYR A 1 134 ? -11.836 46.230 -5.356 1.00 23.87 ? 442 TYR A CD1 1 ATOM 1005 C CD2 . TYR A 1 134 ? -11.752 45.669 -3.037 1.00 23.26 ? 442 TYR A CD2 1 ATOM 1006 C CE1 . TYR A 1 134 ? -11.936 44.884 -5.680 1.00 27.08 ? 442 TYR A CE1 1 ATOM 1007 C CE2 . TYR A 1 134 ? -11.844 44.326 -3.351 1.00 25.57 ? 442 TYR A CE2 1 ATOM 1008 C CZ . TYR A 1 134 ? -11.932 43.939 -4.669 1.00 28.04 ? 442 TYR A CZ 1 ATOM 1009 O OH . TYR A 1 134 ? -12.035 42.600 -4.970 1.00 29.57 ? 442 TYR A OH 1 ATOM 1010 N N . ARG A 1 135 ? -10.487 51.084 -3.492 1.00 23.71 ? 443 ARG A N 1 ATOM 1011 C CA . ARG A 1 135 ? -10.744 52.526 -3.459 1.00 26.49 ? 443 ARG A CA 1 ATOM 1012 C C . ARG A 1 135 ? -9.963 53.255 -4.558 1.00 27.36 ? 443 ARG A C 1 ATOM 1013 O O . ARG A 1 135 ? -10.455 54.205 -5.179 1.00 25.49 ? 443 ARG A O 1 ATOM 1014 C CB . ARG A 1 135 ? -10.431 53.093 -2.073 1.00 30.83 ? 443 ARG A CB 1 ATOM 1015 C CG . ARG A 1 135 ? -11.457 52.666 -1.031 1.00 31.67 ? 443 ARG A CG 1 ATOM 1016 C CD . ARG A 1 135 ? -11.139 53.135 0.378 1.00 34.39 ? 443 ARG A CD 1 ATOM 1017 N NE . ARG A 1 135 ? -12.337 53.019 1.206 1.00 33.43 ? 443 ARG A NE 1 ATOM 1018 C CZ . ARG A 1 135 ? -12.358 53.038 2.533 1.00 33.88 ? 443 ARG A CZ 1 ATOM 1019 N NH1 . ARG A 1 135 ? -11.231 53.165 3.223 1.00 38.14 ? 443 ARG A NH1 1 ATOM 1020 N NH2 . ARG A 1 135 ? -13.519 52.924 3.168 1.00 29.50 ? 443 ARG A NH2 1 ATOM 1021 N N . THR A 1 136 ? -8.742 52.801 -4.806 1.00 26.65 ? 444 THR A N 1 ATOM 1022 C CA . THR A 1 136 ? -7.983 53.338 -5.926 1.00 26.38 ? 444 THR A CA 1 ATOM 1023 C C . THR A 1 136 ? -8.716 53.084 -7.252 1.00 23.21 ? 444 THR A C 1 ATOM 1024 O O . THR A 1 136 ? -8.836 53.989 -8.071 1.00 27.85 ? 444 THR A O 1 ATOM 1025 C CB . THR A 1 136 ? -6.536 52.804 -5.943 1.00 27.26 ? 444 THR A CB 1 ATOM 1026 O OG1 . THR A 1 136 ? -5.851 53.280 -4.774 1.00 29.66 ? 444 THR A OG1 1 ATOM 1027 C CG2 . THR A 1 136 ? -5.794 53.279 -7.185 1.00 26.70 ? 444 THR A CG2 1 ATOM 1028 N N . ALA A 1 137 ? -9.228 51.871 -7.447 1.00 22.94 ? 445 ALA A N 1 ATOM 1029 C CA . ALA A 1 137 ? -9.956 51.526 -8.678 1.00 24.33 ? 445 ALA A CA 1 ATOM 1030 C C . ALA A 1 137 ? -11.188 52.404 -8.892 1.00 24.94 ? 445 ALA A C 1 ATOM 1031 O O . ALA A 1 137 ? -11.497 52.805 -10.017 1.00 25.58 ? 445 ALA A O 1 ATOM 1032 C CB . ALA A 1 137 ? -10.361 50.055 -8.671 1.00 23.23 ? 445 ALA A CB 1 ATOM 1033 N N . LEU A 1 138 ? -11.892 52.688 -7.803 1.00 21.88 ? 446 LEU A N 1 ATOM 1034 C CA . LEU A 1 138 ? -13.089 53.517 -7.846 1.00 23.42 ? 446 LEU A CA 1 ATOM 1035 C C . LEU A 1 138 ? -12.762 55.006 -7.973 1.00 28.49 ? 446 LEU A C 1 ATOM 1036 O O . LEU A 1 138 ? -13.566 55.787 -8.490 1.00 30.96 ? 446 LEU A O 1 ATOM 1037 C CB . LEU A 1 138 ? -13.941 53.262 -6.602 1.00 25.84 ? 446 LEU A CB 1 ATOM 1038 C CG . LEU A 1 138 ? -14.594 51.881 -6.590 1.00 26.76 ? 446 LEU A CG 1 ATOM 1039 C CD1 . LEU A 1 138 ? -14.975 51.475 -5.172 1.00 26.91 ? 446 LEU A CD1 1 ATOM 1040 C CD2 . LEU A 1 138 ? -15.814 51.858 -7.522 1.00 26.83 ? 446 LEU A CD2 1 ATOM 1041 N N . LYS A 1 139 ? -11.588 55.394 -7.490 1.00 31.22 ? 447 LYS A N 1 ATOM 1042 C CA . LYS A 1 139 ? -11.111 56.765 -7.634 1.00 36.08 ? 447 LYS A CA 1 ATOM 1043 C C . LYS A 1 139 ? -10.790 57.016 -9.106 1.00 37.16 ? 447 LYS A C 1 ATOM 1044 O O . LYS A 1 139 ? -11.051 58.095 -9.639 1.00 36.91 ? 447 LYS A O 1 ATOM 1045 C CB . LYS A 1 139 ? -9.881 56.988 -6.745 1.00 39.58 ? 447 LYS A CB 1 ATOM 1046 C CG . LYS A 1 139 ? -9.315 58.393 -6.752 1.00 50.04 ? 447 LYS A CG 1 ATOM 1047 C CD . LYS A 1 139 ? -8.111 58.482 -5.823 1.00 56.03 ? 447 LYS A CD 1 ATOM 1048 C CE . LYS A 1 139 ? -7.638 59.918 -5.640 1.00 62.97 ? 447 LYS A CE 1 ATOM 1049 N NZ . LYS A 1 139 ? -6.614 60.030 -4.556 1.00 64.63 ? 447 LYS A NZ 1 ATOM 1050 N N . LEU A 1 140 ? -10.242 55.995 -9.762 1.00 36.05 ? 448 LEU A N 1 ATOM 1051 C CA . LEU A 1 140 ? -9.925 56.059 -11.185 1.00 34.25 ? 448 LEU A CA 1 ATOM 1052 C C . LEU A 1 140 ? -11.153 55.898 -12.072 1.00 36.51 ? 448 LEU A C 1 ATOM 1053 O O . LEU A 1 140 ? -11.238 56.498 -13.147 1.00 35.20 ? 448 LEU A O 1 ATOM 1054 C CB . LEU A 1 140 ? -8.913 54.977 -11.541 1.00 28.26 ? 448 LEU A CB 1 ATOM 1055 C CG . LEU A 1 140 ? -7.478 55.272 -11.132 1.00 27.48 ? 448 LEU A CG 1 ATOM 1056 C CD1 . LEU A 1 140 ? -6.654 53.989 -11.160 1.00 25.97 ? 448 LEU A CD1 1 ATOM 1057 C CD2 . LEU A 1 140 ? -6.892 56.321 -12.064 1.00 22.41 ? 448 LEU A CD2 1 ATOM 1058 N N . LYS A 1 141 ? -12.090 55.067 -11.627 1.00 33.14 ? 449 LYS A N 1 ATOM 1059 C CA . LYS A 1 141 ? -13.312 54.811 -12.373 1.00 32.05 ? 449 LYS A CA 1 ATOM 1060 C C . LYS A 1 141 ? -14.499 54.736 -11.414 1.00 32.32 ? 449 LYS A C 1 ATOM 1061 O O . LYS A 1 141 ? -14.825 53.664 -10.899 1.00 27.10 ? 449 LYS A O 1 ATOM 1062 C CB . LYS A 1 141 ? -13.184 53.521 -13.190 1.00 32.77 ? 449 LYS A CB 1 ATOM 1063 C CG . LYS A 1 141 ? -14.391 53.246 -14.074 1.00 37.57 ? 449 LYS A CG 1 ATOM 1064 C CD . LYS A 1 141 ? -14.068 52.272 -15.190 1.00 38.66 ? 449 LYS A CD 1 ATOM 1065 C CE . LYS A 1 141 ? -13.871 50.869 -14.667 1.00 38.15 ? 449 LYS A CE 1 ATOM 1066 N NZ . LYS A 1 141 ? -13.438 49.953 -15.751 1.00 40.94 ? 449 LYS A NZ 1 ATOM 1067 N N . PRO A 1 142 ? -15.138 55.891 -11.159 1.00 35.10 ? 450 PRO A N 1 ATOM 1068 C CA . PRO A 1 142 ? -16.269 56.025 -10.233 1.00 36.14 ? 450 PRO A CA 1 ATOM 1069 C C . PRO A 1 142 ? -17.406 55.039 -10.511 1.00 34.50 ? 450 PRO A C 1 ATOM 1070 O O . PRO A 1 142 ? -18.012 54.539 -9.563 1.00 34.95 ? 450 PRO A O 1 ATOM 1071 C CB . PRO A 1 142 ? -16.743 57.461 -10.473 1.00 39.96 ? 450 PRO A CB 1 ATOM 1072 C CG . PRO A 1 142 ? -15.517 58.183 -10.904 1.00 42.00 ? 450 PRO A CG 1 ATOM 1073 C CD . PRO A 1 142 ? -14.715 57.193 -11.707 1.00 37.95 ? 450 PRO A CD 1 ATOM 1074 N N . ASP A 1 143 ? -17.690 54.773 -11.784 1.00 35.90 ? 451 ASP A N 1 ATOM 1075 C CA . ASP A 1 143 ? -18.722 53.809 -12.156 1.00 36.81 ? 451 ASP A CA 1 ATOM 1076 C C . ASP A 1 143 ? -18.072 52.467 -12.475 1.00 30.49 ? 451 ASP A C 1 ATOM 1077 O O . ASP A 1 143 ? -17.653 52.215 -13.605 1.00 30.26 ? 451 ASP A O 1 ATOM 1078 C CB . ASP A 1 143 ? -19.548 54.321 -13.344 1.00 44.60 ? 451 ASP A CB 1 ATOM 1079 C CG . ASP A 1 143 ? -20.784 53.469 -13.614 1.00 48.01 ? 451 ASP A CG 1 ATOM 1080 O OD1 . ASP A 1 143 ? -21.173 52.678 -12.734 1.00 48.53 ? 451 ASP A OD1 1 ATOM 1081 O OD2 . ASP A 1 143 ? -21.372 53.591 -14.709 1.00 52.36 ? 451 ASP A OD2 1 ATOM 1082 N N . PHE A 1 144 ? -17.990 51.617 -11.457 1.00 28.66 ? 452 PHE A N 1 ATOM 1083 C CA . PHE A 1 144 ? -17.257 50.356 -11.526 1.00 26.61 ? 452 PHE A CA 1 ATOM 1084 C C . PHE A 1 144 ? -17.952 49.379 -10.568 1.00 23.92 ? 452 PHE A C 1 ATOM 1085 O O . PHE A 1 144 ? -17.498 49.170 -9.448 1.00 21.05 ? 452 PHE A O 1 ATOM 1086 C CB . PHE A 1 144 ? -15.797 50.598 -11.111 1.00 24.96 ? 452 PHE A CB 1 ATOM 1087 C CG . PHE A 1 144 ? -14.839 49.486 -11.478 1.00 23.47 ? 452 PHE A CG 1 ATOM 1088 C CD1 . PHE A 1 144 ? -15.293 48.253 -11.912 1.00 23.86 ? 452 PHE A CD1 1 ATOM 1089 C CD2 . PHE A 1 144 ? -13.472 49.689 -11.376 1.00 23.87 ? 452 PHE A CD2 1 ATOM 1090 C CE1 . PHE A 1 144 ? -14.393 47.236 -12.240 1.00 26.89 ? 452 PHE A CE1 1 ATOM 1091 C CE2 . PHE A 1 144 ? -12.572 48.684 -11.694 1.00 26.77 ? 452 PHE A CE2 1 ATOM 1092 C CZ . PHE A 1 144 ? -13.034 47.452 -12.126 1.00 24.69 ? 452 PHE A CZ 1 ATOM 1093 N N . PRO A 1 145 ? -19.075 48.793 -11.013 1.00 27.08 ? 453 PRO A N 1 ATOM 1094 C CA . PRO A 1 145 ? -19.915 47.943 -10.166 1.00 29.34 ? 453 PRO A CA 1 ATOM 1095 C C . PRO A 1 145 ? -19.151 46.802 -9.504 1.00 27.73 ? 453 PRO A C 1 ATOM 1096 O O . PRO A 1 145 ? -19.318 46.608 -8.300 1.00 23.83 ? 453 PRO A O 1 ATOM 1097 C CB . PRO A 1 145 ? -20.950 47.390 -11.144 1.00 31.02 ? 453 PRO A CB 1 ATOM 1098 C CG . PRO A 1 145 ? -21.032 48.418 -12.215 1.00 33.29 ? 453 PRO A CG 1 ATOM 1099 C CD . PRO A 1 145 ? -19.642 48.954 -12.364 1.00 31.58 ? 453 PRO A CD 1 ATOM 1100 N N . ASP A 1 146 ? -18.336 46.067 -10.261 1.00 24.77 ? 454 ASP A N 1 ATOM 1101 C CA . ASP A 1 146 ? -17.585 44.955 -9.668 1.00 27.81 ? 454 ASP A CA 1 ATOM 1102 C C . ASP A 1 146 ? -16.768 45.430 -8.478 1.00 24.77 ? 454 ASP A C 1 ATOM 1103 O O . ASP A 1 146 ? -16.772 44.803 -7.421 1.00 27.07 ? 454 ASP A O 1 ATOM 1104 C CB . ASP A 1 146 ? -16.654 44.287 -10.684 1.00 28.02 ? 454 ASP A CB 1 ATOM 1105 C CG . ASP A 1 146 ? -17.385 43.386 -11.652 1.00 34.24 ? 454 ASP A CG 1 ATOM 1106 O OD1 . ASP A 1 146 ? -18.571 43.081 -11.418 1.00 36.11 ? 454 ASP A OD1 1 ATOM 1107 O OD2 . ASP A 1 146 ? -16.763 42.969 -12.656 1.00 40.45 ? 454 ASP A OD2 1 ATOM 1108 N N . ALA A 1 147 ? -16.079 46.551 -8.643 1.00 21.98 ? 455 ALA A N 1 ATOM 1109 C CA . ALA A 1 147 ? -15.201 47.048 -7.589 1.00 20.22 ? 455 ALA A CA 1 ATOM 1110 C C . ALA A 1 147 ? -15.977 47.593 -6.399 1.00 20.19 ? 455 ALA A C 1 ATOM 1111 O O . ALA A 1 147 ? -15.558 47.430 -5.246 1.00 18.19 ? 455 ALA A O 1 ATOM 1112 C CB . ALA A 1 147 ? -14.245 48.098 -8.133 1.00 20.82 ? 455 ALA A CB 1 ATOM 1113 N N . TYR A 1 148 ? -17.102 48.244 -6.667 1.00 19.40 ? 456 TYR A N 1 ATOM 1114 C CA . TYR A 1 148 ? -17.904 48.790 -5.575 1.00 20.45 ? 456 TYR A CA 1 ATOM 1115 C C . TYR A 1 148 ? -18.482 47.662 -4.728 1.00 21.26 ? 456 TYR A C 1 ATOM 1116 O O . TYR A 1 148 ? -18.442 47.714 -3.493 1.00 19.16 ? 456 TYR A O 1 ATOM 1117 C CB . TYR A 1 148 ? -19.022 49.690 -6.105 1.00 23.80 ? 456 TYR A CB 1 ATOM 1118 C CG . TYR A 1 148 ? -19.780 50.399 -5.005 1.00 25.42 ? 456 TYR A CG 1 ATOM 1119 C CD1 . TYR A 1 148 ? -19.373 51.643 -4.548 1.00 28.27 ? 456 TYR A CD1 1 ATOM 1120 C CD2 . TYR A 1 148 ? -20.891 49.821 -4.421 1.00 26.41 ? 456 TYR A CD2 1 ATOM 1121 C CE1 . TYR A 1 148 ? -20.061 52.294 -3.539 1.00 29.29 ? 456 TYR A CE1 1 ATOM 1122 C CE2 . TYR A 1 148 ? -21.586 50.462 -3.413 1.00 28.69 ? 456 TYR A CE2 1 ATOM 1123 C CZ . TYR A 1 148 ? -21.166 51.698 -2.979 1.00 28.06 ? 456 TYR A CZ 1 ATOM 1124 O OH . TYR A 1 148 ? -21.851 52.334 -1.976 1.00 29.53 ? 456 TYR A OH 1 ATOM 1125 N N . CYS A 1 149 ? -19.017 46.641 -5.390 1.00 22.04 ? 457 CYS A N 1 ATOM 1126 C CA . CYS A 1 149 ? -19.630 45.523 -4.675 1.00 23.22 ? 457 CYS A CA 1 ATOM 1127 C C . CYS A 1 149 ? -18.601 44.680 -3.938 1.00 22.13 ? 457 CYS A C 1 ATOM 1128 O O . CYS A 1 149 ? -18.858 44.205 -2.829 1.00 20.13 ? 457 CYS A O 1 ATOM 1129 C CB . CYS A 1 149 ? -20.448 44.652 -5.627 1.00 24.35 ? 457 CYS A CB 1 ATOM 1130 S SG . CYS A 1 149 ? -21.868 45.513 -6.322 1.00 28.72 ? 457 CYS A SG 1 ATOM 1131 N N . ASN A 1 150 ? -17.443 44.481 -4.559 1.00 21.67 ? 458 ASN A N 1 ATOM 1132 C CA . ASN A 1 150 ? -16.357 43.770 -3.894 1.00 19.24 ? 458 ASN A CA 1 ATOM 1133 C C . ASN A 1 150 ? -15.883 44.546 -2.680 1.00 20.32 ? 458 ASN A C 1 ATOM 1134 O O . ASN A 1 150 ? -15.572 43.957 -1.637 1.00 22.01 ? 458 ASN A O 1 ATOM 1135 C CB . ASN A 1 150 ? -15.182 43.541 -4.844 1.00 19.48 ? 458 ASN A CB 1 ATOM 1136 C CG . ASN A 1 150 ? -15.456 42.457 -5.873 1.00 26.98 ? 458 ASN A CG 1 ATOM 1137 O OD1 . ASN A 1 150 ? -16.486 41.798 -5.837 1.00 32.26 ? 458 ASN A OD1 1 ATOM 1138 N ND2 . ASN A 1 150 ? -14.528 42.278 -6.801 1.00 32.86 ? 458 ASN A ND2 1 ATOM 1139 N N . LEU A 1 151 ? -15.837 45.869 -2.813 1.00 16.21 ? 459 LEU A N 1 ATOM 1140 C CA . LEU A 1 151 ? -15.429 46.728 -1.700 1.00 19.04 ? 459 LEU A CA 1 ATOM 1141 C C . LEU A 1 151 ? -16.452 46.644 -0.562 1.00 18.22 ? 459 LEU A C 1 ATOM 1142 O O . LEU A 1 151 ? -16.091 46.596 0.617 1.00 18.15 ? 459 LEU A O 1 ATOM 1143 C CB . LEU A 1 151 ? -15.277 48.183 -2.163 1.00 18.75 ? 459 LEU A CB 1 ATOM 1144 C CG . LEU A 1 151 ? -15.043 49.218 -1.053 1.00 21.10 ? 459 LEU A CG 1 ATOM 1145 C CD1 . LEU A 1 151 ? -13.798 48.884 -0.228 1.00 21.85 ? 459 LEU A CD1 1 ATOM 1146 C CD2 . LEU A 1 151 ? -14.953 50.629 -1.630 1.00 25.29 ? 459 LEU A CD2 1 ATOM 1147 N N . ALA A 1 152 ? -17.731 46.631 -0.924 1.00 18.32 ? 460 ALA A N 1 ATOM 1148 C CA . ALA A 1 152 ? -18.804 46.547 0.063 1.00 19.66 ? 460 ALA A CA 1 ATOM 1149 C C . ALA A 1 152 ? -18.681 45.287 0.915 1.00 20.56 ? 460 ALA A C 1 ATOM 1150 O O . ALA A 1 152 ? -18.926 45.318 2.126 1.00 19.77 ? 460 ALA A O 1 ATOM 1151 C CB . ALA A 1 152 ? -20.174 46.600 -0.623 1.00 18.77 ? 460 ALA A CB 1 ATOM 1152 N N . HIS A 1 153 ? -18.304 44.176 0.288 1.00 20.62 ? 461 HIS A N 1 ATOM 1153 C CA . HIS A 1 153 ? -18.161 42.923 1.027 1.00 19.19 ? 461 HIS A CA 1 ATOM 1154 C C . HIS A 1 153 ? -16.922 42.929 1.926 1.00 18.08 ? 461 HIS A C 1 ATOM 1155 O O . HIS A 1 153 ? -16.964 42.415 3.034 1.00 16.88 ? 461 HIS A O 1 ATOM 1156 C CB . HIS A 1 153 ? -18.148 41.708 0.092 1.00 20.51 ? 461 HIS A CB 1 ATOM 1157 C CG . HIS A 1 153 ? -18.217 40.400 0.815 1.00 21.99 ? 461 HIS A CG 1 ATOM 1158 N ND1 . HIS A 1 153 ? -17.179 39.493 0.814 1.00 23.29 ? 461 HIS A ND1 1 ATOM 1159 C CD2 . HIS A 1 153 ? -19.189 39.858 1.587 1.00 23.58 ? 461 HIS A CD2 1 ATOM 1160 C CE1 . HIS A 1 153 ? -17.514 38.442 1.543 1.00 23.14 ? 461 HIS A CE1 1 ATOM 1161 N NE2 . HIS A 1 153 ? -18.728 38.640 2.025 1.00 22.98 ? 461 HIS A NE2 1 ATOM 1162 N N . CYS A 1 154 ? -15.821 43.512 1.458 1.00 20.20 ? 462 CYS A N 1 ATOM 1163 C CA . CYS A 1 154 ? -14.657 43.721 2.329 1.00 18.22 ? 462 CYS A CA 1 ATOM 1164 C C . CYS A 1 154 ? -15.053 44.510 3.578 1.00 16.64 ? 462 CYS A C 1 ATOM 1165 O O . CYS A 1 154 ? -14.690 44.152 4.701 1.00 15.28 ? 462 CYS A O 1 ATOM 1166 C CB . CYS A 1 154 ? -13.553 44.491 1.593 1.00 19.51 ? 462 CYS A CB 1 ATOM 1167 S SG . CYS A 1 154 ? -12.764 43.562 0.278 1.00 24.17 ? 462 CYS A SG 1 ATOM 1168 N N . LEU A 1 155 ? -15.786 45.596 3.371 1.00 17.73 ? 463 LEU A N 1 ATOM 1169 C CA . LEU A 1 155 ? -16.211 46.453 4.477 1.00 17.99 ? 463 LEU A CA 1 ATOM 1170 C C . LEU A 1 155 ? -17.112 45.688 5.444 1.00 16.98 ? 463 LEU A C 1 ATOM 1171 O O . LEU A 1 155 ? -17.024 45.862 6.657 1.00 19.66 ? 463 LEU A O 1 ATOM 1172 C CB . LEU A 1 155 ? -16.893 47.722 3.946 1.00 17.78 ? 463 LEU A CB 1 ATOM 1173 C CG . LEU A 1 155 ? -15.968 48.621 3.110 1.00 20.14 ? 463 LEU A CG 1 ATOM 1174 C CD1 . LEU A 1 155 ? -16.706 49.814 2.519 1.00 20.35 ? 463 LEU A CD1 1 ATOM 1175 C CD2 . LEU A 1 155 ? -14.767 49.099 3.917 1.00 23.22 ? 463 LEU A CD2 1 ATOM 1176 N N . GLN A 1 156 ? -17.965 44.826 4.899 1.00 14.86 ? 464 GLN A N 1 ATOM 1177 C CA . GLN A 1 156 ? -18.825 43.979 5.712 1.00 15.16 ? 464 GLN A CA 1 ATOM 1178 C C . GLN A 1 156 ? -17.993 43.047 6.598 1.00 15.27 ? 464 GLN A C 1 ATOM 1179 O O . GLN A 1 156 ? -18.254 42.903 7.793 1.00 15.81 ? 464 GLN A O 1 ATOM 1180 C CB . GLN A 1 156 ? -19.750 43.156 4.805 1.00 17.46 ? 464 GLN A CB 1 ATOM 1181 C CG . GLN A 1 156 ? -20.819 42.346 5.554 1.00 21.68 ? 464 GLN A CG 1 ATOM 1182 C CD . GLN A 1 156 ? -22.063 43.157 5.865 1.00 24.26 ? 464 GLN A CD 1 ATOM 1183 O OE1 . GLN A 1 156 ? -22.352 44.152 5.198 1.00 25.09 ? 464 GLN A OE1 1 ATOM 1184 N NE2 . GLN A 1 156 ? -22.813 42.729 6.879 1.00 22.36 ? 464 GLN A NE2 1 ATOM 1185 N N . ILE A 1 157 ? -16.990 42.418 5.993 1.00 16.42 ? 465 ILE A N 1 ATOM 1186 C CA . ILE A 1 157 ? -16.112 41.469 6.677 1.00 13.90 ? 465 ILE A CA 1 ATOM 1187 C C . ILE A 1 157 ? -15.469 42.051 7.929 1.00 17.85 ? 465 ILE A C 1 ATOM 1188 O O . ILE A 1 157 ? -15.345 41.357 8.946 1.00 18.98 ? 465 ILE A O 1 ATOM 1189 C CB . ILE A 1 157 ? -14.989 40.978 5.712 1.00 14.64 ? 465 ILE A CB 1 ATOM 1190 C CG1 . ILE A 1 157 ? -15.549 39.968 4.707 1.00 16.16 ? 465 ILE A CG1 1 ATOM 1191 C CG2 . ILE A 1 157 ? -13.816 40.389 6.482 1.00 16.35 ? 465 ILE A CG2 1 ATOM 1192 C CD1 . ILE A 1 157 ? -14.594 39.675 3.544 1.00 17.48 ? 465 ILE A CD1 1 ATOM 1193 N N . VAL A 1 158 ? -15.069 43.321 7.861 1.00 14.23 ? 466 VAL A N 1 ATOM 1194 C CA . VAL A 1 158 ? -14.372 43.956 8.985 1.00 20.40 ? 466 VAL A CA 1 ATOM 1195 C C . VAL A 1 158 ? -15.242 44.904 9.818 1.00 18.75 ? 466 VAL A C 1 ATOM 1196 O O . VAL A 1 158 ? -14.736 45.614 10.686 1.00 19.33 ? 466 VAL A O 1 ATOM 1197 C CB . VAL A 1 158 ? -13.099 44.699 8.518 1.00 19.78 ? 466 VAL A CB 1 ATOM 1198 C CG1 . VAL A 1 158 ? -12.169 43.738 7.794 1.00 19.82 ? 466 VAL A CG1 1 ATOM 1199 C CG2 . VAL A 1 158 ? -13.463 45.887 7.615 1.00 17.13 ? 466 VAL A CG2 1 ATOM 1200 N N . CYS A 1 159 ? -16.544 44.897 9.548 1.00 17.94 ? 467 CYS A N 1 ATOM 1201 C CA . CYS A 1 159 ? -17.516 45.744 10.246 1.00 18.36 ? 467 CYS A CA 1 ATOM 1202 C C . CYS A 1 159 ? -17.204 47.238 10.138 1.00 19.67 ? 467 CYS A C 1 ATOM 1203 O O . CYS A 1 159 ? -17.287 47.976 11.121 1.00 19.78 ? 467 CYS A O 1 ATOM 1204 C CB . CYS A 1 159 ? -17.692 45.321 11.707 1.00 21.16 ? 467 CYS A CB 1 ATOM 1205 S SG . CYS A 1 159 ? -18.289 43.613 11.915 1.00 21.30 ? 467 CYS A SG 1 ATOM 1206 N N . ASP A 1 160 ? -16.843 47.668 8.934 1.00 19.48 ? 468 ASP A N 1 ATOM 1207 C CA . ASP A 1 160 ? -16.717 49.087 8.630 1.00 18.72 ? 468 ASP A CA 1 ATOM 1208 C C . ASP A 1 160 ? -18.065 49.510 8.079 1.00 19.04 ? 468 ASP A C 1 ATOM 1209 O O . ASP A 1 160 ? -18.429 49.137 6.967 1.00 19.56 ? 468 ASP A O 1 ATOM 1210 C CB . ASP A 1 160 ? -15.610 49.313 7.597 1.00 17.90 ? 468 ASP A CB 1 ATOM 1211 C CG . ASP A 1 160 ? -15.324 50.783 7.342 1.00 22.97 ? 468 ASP A CG 1 ATOM 1212 O OD1 . ASP A 1 160 ? -16.255 51.609 7.409 1.00 25.77 ? 468 ASP A OD1 1 ATOM 1213 O OD2 . ASP A 1 160 ? -14.154 51.109 7.076 1.00 28.32 ? 468 ASP A OD2 1 ATOM 1214 N N . TRP A 1 161 ? -18.811 50.272 8.873 1.00 18.55 ? 469 TRP A N 1 ATOM 1215 C CA . TRP A 1 161 ? -20.156 50.683 8.491 1.00 19.29 ? 469 TRP A CA 1 ATOM 1216 C C . TRP A 1 161 ? -20.235 52.170 8.128 1.00 21.42 ? 469 TRP A C 1 ATOM 1217 O O . TRP A 1 161 ? -21.268 52.810 8.317 1.00 19.84 ? 469 TRP A O 1 ATOM 1218 C CB . TRP A 1 161 ? -21.137 50.345 9.618 1.00 20.42 ? 469 TRP A CB 1 ATOM 1219 C CG . TRP A 1 161 ? -21.139 48.866 9.963 1.00 18.26 ? 469 TRP A CG 1 ATOM 1220 C CD1 . TRP A 1 161 ? -20.936 47.823 9.105 1.00 17.26 ? 469 TRP A CD1 1 ATOM 1221 C CD2 . TRP A 1 161 ? -21.327 48.290 11.259 1.00 16.96 ? 469 TRP A CD2 1 ATOM 1222 N NE1 . TRP A 1 161 ? -21.012 46.623 9.788 1.00 18.11 ? 469 TRP A NE1 1 ATOM 1223 C CE2 . TRP A 1 161 ? -21.239 46.889 11.114 1.00 19.28 ? 469 TRP A CE2 1 ATOM 1224 C CE3 . TRP A 1 161 ? -21.569 48.824 12.531 1.00 17.44 ? 469 TRP A CE3 1 ATOM 1225 C CZ2 . TRP A 1 161 ? -21.388 46.017 12.194 1.00 17.38 ? 469 TRP A CZ2 1 ATOM 1226 C CZ3 . TRP A 1 161 ? -21.713 47.958 13.599 1.00 18.54 ? 469 TRP A CZ3 1 ATOM 1227 C CH2 . TRP A 1 161 ? -21.624 46.573 13.425 1.00 17.13 ? 469 TRP A CH2 1 ATOM 1228 N N . THR A 1 162 ? -19.147 52.718 7.598 1.00 25.86 ? 470 THR A N 1 ATOM 1229 C CA . THR A 1 162 ? -19.161 54.118 7.172 1.00 30.46 ? 470 THR A CA 1 ATOM 1230 C C . THR A 1 162 ? -20.143 54.284 6.018 1.00 27.13 ? 470 THR A C 1 ATOM 1231 O O . THR A 1 162 ? -20.107 53.510 5.062 1.00 25.43 ? 470 THR A O 1 ATOM 1232 C CB . THR A 1 162 ? -17.773 54.585 6.718 1.00 35.26 ? 470 THR A CB 1 ATOM 1233 O OG1 . THR A 1 162 ? -16.812 54.294 7.741 1.00 34.41 ? 470 THR A OG1 1 ATOM 1234 C CG2 . THR A 1 162 ? -17.784 56.087 6.436 1.00 39.01 ? 470 THR A CG2 1 ATOM 1235 N N . ASP A 1 163 ? -21.026 55.275 6.124 1.00 29.10 ? 471 ASP A N 1 ATOM 1236 C CA . ASP A 1 163 ? -22.041 55.541 5.099 1.00 33.97 ? 471 ASP A CA 1 ATOM 1237 C C . ASP A 1 163 ? -22.868 54.297 4.759 1.00 32.81 ? 471 ASP A C 1 ATOM 1238 O O . ASP A 1 163 ? -23.238 54.083 3.605 1.00 30.85 ? 471 ASP A O 1 ATOM 1239 C CB . ASP A 1 163 ? -21.397 56.105 3.831 1.00 35.74 ? 471 ASP A CB 1 ATOM 1240 C CG . ASP A 1 163 ? -20.667 57.410 4.077 1.00 42.63 ? 471 ASP A CG 1 ATOM 1241 O OD1 . ASP A 1 163 ? -21.097 58.176 4.964 1.00 45.75 ? 471 ASP A OD1 1 ATOM 1242 O OD2 . ASP A 1 163 ? -19.662 57.673 3.383 1.00 46.55 ? 471 ASP A OD2 1 ATOM 1243 N N . TYR A 1 164 ? -23.162 53.494 5.775 1.00 31.34 ? 472 TYR A N 1 ATOM 1244 C CA . TYR A 1 164 ? -23.777 52.181 5.574 1.00 29.46 ? 472 TYR A CA 1 ATOM 1245 C C . TYR A 1 164 ? -25.105 52.215 4.811 1.00 28.64 ? 472 TYR A C 1 ATOM 1246 O O . TYR A 1 164 ? -25.265 51.519 3.809 1.00 24.15 ? 472 TYR A O 1 ATOM 1247 C CB . TYR A 1 164 ? -23.964 51.477 6.917 1.00 29.72 ? 472 TYR A CB 1 ATOM 1248 C CG . TYR A 1 164 ? -24.581 50.104 6.798 1.00 26.72 ? 472 TYR A CG 1 ATOM 1249 C CD1 . TYR A 1 164 ? -23.813 49.002 6.438 1.00 25.92 ? 472 TYR A CD1 1 ATOM 1250 C CD2 . TYR A 1 164 ? -25.933 49.911 7.044 1.00 28.27 ? 472 TYR A CD2 1 ATOM 1251 C CE1 . TYR A 1 164 ? -24.378 47.751 6.330 1.00 24.75 ? 472 TYR A CE1 1 ATOM 1252 C CE2 . TYR A 1 164 ? -26.501 48.666 6.940 1.00 27.04 ? 472 TYR A CE2 1 ATOM 1253 C CZ . TYR A 1 164 ? -25.723 47.592 6.583 1.00 24.57 ? 472 TYR A CZ 1 ATOM 1254 O OH . TYR A 1 164 ? -26.312 46.354 6.480 1.00 27.03 ? 472 TYR A OH 1 ATOM 1255 N N . ASP A 1 165 ? -26.049 53.021 5.288 1.00 24.92 ? 473 ASP A N 1 ATOM 1256 C CA . ASP A 1 165 ? -27.359 53.124 4.650 1.00 30.91 ? 473 ASP A CA 1 ATOM 1257 C C . ASP A 1 165 ? -27.262 53.531 3.177 1.00 29.88 ? 473 ASP A C 1 ATOM 1258 O O . ASP A 1 165 ? -27.989 53.013 2.331 1.00 31.71 ? 473 ASP A O 1 ATOM 1259 C CB . ASP A 1 165 ? -28.255 54.106 5.409 1.00 38.21 ? 473 ASP A CB 1 ATOM 1260 C CG . ASP A 1 165 ? -28.604 53.623 6.801 1.00 42.44 ? 473 ASP A CG 1 ATOM 1261 O OD1 . ASP A 1 165 ? -28.627 52.393 7.019 1.00 39.37 ? 473 ASP A OD1 1 ATOM 1262 O OD2 . ASP A 1 165 ? -28.861 54.475 7.677 1.00 48.76 ? 473 ASP A OD2 1 ATOM 1263 N N . GLU A 1 166 ? -26.360 54.459 2.876 1.00 27.70 ? 474 GLU A N 1 ATOM 1264 C CA . GLU A 1 166 ? -26.174 54.926 1.509 1.00 30.99 ? 474 GLU A CA 1 ATOM 1265 C C . GLU A 1 166 ? -25.526 53.830 0.679 1.00 26.45 ? 474 GLU A C 1 ATOM 1266 O O . GLU A 1 166 ? -25.873 53.628 -0.485 1.00 28.77 ? 474 GLU A O 1 ATOM 1267 C CB . GLU A 1 166 ? -25.307 56.185 1.498 1.00 39.88 ? 474 GLU A CB 1 ATOM 1268 C CG . GLU A 1 166 ? -25.018 56.747 0.121 1.00 51.62 ? 474 GLU A CG 1 ATOM 1269 C CD . GLU A 1 166 ? -24.122 57.973 0.174 1.00 59.95 ? 474 GLU A CD 1 ATOM 1270 O OE1 . GLU A 1 166 ? -23.462 58.273 -0.844 1.00 62.36 ? 474 GLU A OE1 1 ATOM 1271 O OE2 . GLU A 1 166 ? -24.079 58.637 1.233 1.00 63.83 ? 474 GLU A OE2 1 ATOM 1272 N N . ARG A 1 167 ? -24.579 53.126 1.291 1.00 24.23 ? 475 ARG A N 1 ATOM 1273 C CA . ARG A 1 167 ? -23.899 52.009 0.645 1.00 22.12 ? 475 ARG A CA 1 ATOM 1274 C C . ARG A 1 167 ? -24.917 50.947 0.227 1.00 25.78 ? 475 ARG A C 1 ATOM 1275 O O . ARG A 1 167 ? -24.919 50.498 -0.918 1.00 24.51 ? 475 ARG A O 1 ATOM 1276 C CB . ARG A 1 167 ? -22.861 51.407 1.595 1.00 23.76 ? 475 ARG A CB 1 ATOM 1277 C CG . ARG A 1 167 ? -22.013 50.288 0.994 1.00 24.05 ? 475 ARG A CG 1 ATOM 1278 C CD . ARG A 1 167 ? -21.268 49.526 2.093 1.00 28.07 ? 475 ARG A CD 1 ATOM 1279 N NE . ARG A 1 167 ? -20.498 50.417 2.960 1.00 27.91 ? 475 ARG A NE 1 ATOM 1280 C CZ . ARG A 1 167 ? -19.998 50.071 4.148 1.00 29.47 ? 475 ARG A CZ 1 ATOM 1281 N NH1 . ARG A 1 167 ? -20.181 48.848 4.633 1.00 28.71 ? 475 ARG A NH1 1 ATOM 1282 N NH2 . ARG A 1 167 ? -19.312 50.954 4.855 1.00 28.31 ? 475 ARG A NH2 1 ATOM 1283 N N . MET A 1 168 ? -25.792 50.562 1.159 1.00 24.73 ? 476 MET A N 1 ATOM 1284 C CA . MET A 1 168 ? -26.823 49.567 0.870 1.00 22.72 ? 476 MET A CA 1 ATOM 1285 C C . MET A 1 168 ? -27.738 50.018 -0.263 1.00 22.23 ? 476 MET A C 1 ATOM 1286 O O . MET A 1 168 ? -28.128 49.212 -1.108 1.00 24.91 ? 476 MET A O 1 ATOM 1287 C CB . MET A 1 168 ? -27.662 49.268 2.109 1.00 23.22 ? 476 MET A CB 1 ATOM 1288 C CG . MET A 1 168 ? -26.897 48.654 3.260 1.00 23.12 ? 476 MET A CG 1 ATOM 1289 S SD . MET A 1 168 ? -26.164 47.071 2.813 1.00 24.61 ? 476 MET A SD 1 ATOM 1290 C CE . MET A 1 168 ? -24.435 47.534 2.650 1.00 28.52 ? 476 MET A CE 1 ATOM 1291 N N . LYS A 1 169 ? -28.079 51.303 -0.276 1.00 20.06 ? 477 LYS A N 1 ATOM 1292 C CA . LYS A 1 169 ? -28.928 51.846 -1.334 1.00 25.27 ? 477 LYS A CA 1 ATOM 1293 C C . LYS A 1 169 ? -28.249 51.760 -2.696 1.00 27.11 ? 477 LYS A C 1 ATOM 1294 O O . LYS A 1 169 ? -28.891 51.451 -3.705 1.00 26.82 ? 477 LYS A O 1 ATOM 1295 C CB . LYS A 1 169 ? -29.313 53.293 -1.033 1.00 31.30 ? 477 LYS A CB 1 ATOM 1296 C CG . LYS A 1 169 ? -30.355 53.441 0.058 1.00 37.47 ? 477 LYS A CG 1 ATOM 1297 C CD . LYS A 1 169 ? -30.776 54.891 0.211 1.00 42.95 ? 477 LYS A CD 1 ATOM 1298 C CE . LYS A 1 169 ? -31.852 55.037 1.271 1.00 47.08 ? 477 LYS A CE 1 ATOM 1299 N NZ . LYS A 1 169 ? -32.235 56.463 1.450 1.00 52.44 ? 477 LYS A NZ 1 ATOM 1300 N N . LYS A 1 170 ? -26.949 52.027 -2.721 1.00 26.88 ? 478 LYS A N 1 ATOM 1301 C CA . LYS A 1 170 ? -26.199 51.974 -3.968 1.00 28.42 ? 478 LYS A CA 1 ATOM 1302 C C . LYS A 1 170 ? -26.089 50.546 -4.497 1.00 25.47 ? 478 LYS A C 1 ATOM 1303 O O . LYS A 1 170 ? -26.207 50.324 -5.701 1.00 27.39 ? 478 LYS A O 1 ATOM 1304 C CB . LYS A 1 170 ? -24.816 52.619 -3.820 1.00 31.14 ? 478 LYS A CB 1 ATOM 1305 C CG . LYS A 1 170 ? -24.075 52.750 -5.145 1.00 34.01 ? 478 LYS A CG 1 ATOM 1306 C CD . LYS A 1 170 ? -22.941 53.751 -5.077 1.00 36.67 ? 478 LYS A CD 1 ATOM 1307 C CE . LYS A 1 170 ? -22.230 53.860 -6.425 1.00 40.77 ? 478 LYS A CE 1 ATOM 1308 N NZ . LYS A 1 170 ? -21.139 54.875 -6.414 1.00 41.44 ? 478 LYS A NZ 1 ATOM 1309 N N . LEU A 1 171 ? -25.879 49.584 -3.596 1.00 24.04 ? 479 LEU A N 1 ATOM 1310 C CA . LEU A 1 171 ? -25.786 48.176 -3.977 1.00 24.88 ? 479 LEU A CA 1 ATOM 1311 C C . LEU A 1 171 ? -27.064 47.716 -4.662 1.00 23.44 ? 479 LEU A C 1 ATOM 1312 O O . LEU A 1 171 ? -27.026 47.060 -5.702 1.00 22.94 ? 479 LEU A O 1 ATOM 1313 C CB . LEU A 1 171 ? -25.522 47.298 -2.750 1.00 24.29 ? 479 LEU A CB 1 ATOM 1314 C CG . LEU A 1 171 ? -24.156 47.427 -2.075 1.00 24.32 ? 479 LEU A CG 1 ATOM 1315 C CD1 . LEU A 1 171 ? -24.126 46.614 -0.775 1.00 23.43 ? 479 LEU A CD1 1 ATOM 1316 C CD2 . LEU A 1 171 ? -23.057 46.964 -3.009 1.00 25.77 ? 479 LEU A CD2 1 ATOM 1317 N N . VAL A 1 172 ? -28.197 48.054 -4.063 1.00 24.48 ? 480 VAL A N 1 ATOM 1318 C CA . VAL A 1 172 ? -29.483 47.696 -4.638 1.00 27.23 ? 480 VAL A CA 1 ATOM 1319 C C . VAL A 1 172 ? -29.633 48.363 -5.997 1.00 24.31 ? 480 VAL A C 1 ATOM 1320 O O . VAL A 1 172 ? -30.097 47.746 -6.956 1.00 27.95 ? 480 VAL A O 1 ATOM 1321 C CB . VAL A 1 172 ? -30.653 48.126 -3.729 1.00 29.11 ? 480 VAL A CB 1 ATOM 1322 C CG1 . VAL A 1 172 ? -31.981 47.821 -4.404 1.00 28.17 ? 480 VAL A CG1 1 ATOM 1323 C CG2 . VAL A 1 172 ? -30.558 47.425 -2.381 1.00 28.22 ? 480 VAL A CG2 1 ATOM 1324 N N . SER A 1 173 ? -29.223 49.626 -6.074 1.00 20.63 ? 481 SER A N 1 ATOM 1325 C CA A SER A 1 173 ? -29.295 50.389 -7.310 0.60 23.32 ? 481 SER A CA 1 ATOM 1326 C CA B SER A 1 173 ? -29.316 50.371 -7.321 0.40 23.44 ? 481 SER A CA 1 ATOM 1327 C C . SER A 1 173 ? -28.449 49.758 -8.417 1.00 26.60 ? 481 SER A C 1 ATOM 1328 O O . SER A 1 173 ? -28.856 49.712 -9.582 1.00 26.38 ? 481 SER A O 1 ATOM 1329 C CB A SER A 1 173 ? -28.844 51.826 -7.058 0.60 24.62 ? 481 SER A CB 1 ATOM 1330 C CB B SER A 1 173 ? -28.957 51.839 -7.104 0.40 24.56 ? 481 SER A CB 1 ATOM 1331 O OG A SER A 1 173 ? -28.917 52.594 -8.240 0.60 25.37 ? 481 SER A OG 1 ATOM 1332 O OG B SER A 1 173 ? -29.913 52.461 -6.265 0.40 25.58 ? 481 SER A OG 1 ATOM 1333 N N . ILE A 1 174 ? -27.264 49.279 -8.043 1.00 26.68 ? 482 ILE A N 1 ATOM 1334 C CA . ILE A 1 174 ? -26.363 48.635 -8.994 1.00 29.84 ? 482 ILE A CA 1 ATOM 1335 C C . ILE A 1 174 ? -26.976 47.342 -9.520 1.00 30.08 ? 482 ILE A C 1 ATOM 1336 O O . ILE A 1 174 ? -26.978 47.088 -10.722 1.00 31.24 ? 482 ILE A O 1 ATOM 1337 C CB . ILE A 1 174 ? -24.996 48.323 -8.356 1.00 30.42 ? 482 ILE A CB 1 ATOM 1338 C CG1 . ILE A 1 174 ? -24.205 49.616 -8.154 1.00 33.08 ? 482 ILE A CG1 1 ATOM 1339 C CG2 . ILE A 1 174 ? -24.208 47.333 -9.214 1.00 29.48 ? 482 ILE A CG2 1 ATOM 1340 C CD1 . ILE A 1 174 ? -23.055 49.490 -7.185 1.00 32.39 ? 482 ILE A CD1 1 ATOM 1341 N N . VAL A 1 175 ? -27.505 46.532 -8.610 1.00 30.07 ? 483 VAL A N 1 ATOM 1342 C CA . VAL A 1 175 ? -28.125 45.268 -8.992 1.00 30.54 ? 483 VAL A CA 1 ATOM 1343 C C . VAL A 1 175 ? -29.332 45.479 -9.912 1.00 31.54 ? 483 VAL A C 1 ATOM 1344 O O . VAL A 1 175 ? -29.471 44.795 -10.928 1.00 32.54 ? 483 VAL A O 1 ATOM 1345 C CB . VAL A 1 175 ? -28.513 44.427 -7.750 1.00 28.86 ? 483 VAL A CB 1 ATOM 1346 C CG1 . VAL A 1 175 ? -29.377 43.236 -8.143 1.00 26.24 ? 483 VAL A CG1 1 ATOM 1347 C CG2 . VAL A 1 175 ? -27.260 43.964 -7.028 1.00 26.89 ? 483 VAL A CG2 1 ATOM 1348 N N . ALA A 1 176 ? -30.191 46.433 -9.563 1.00 30.96 ? 484 ALA A N 1 ATOM 1349 C CA . ALA A 1 176 ? -31.361 46.741 -10.381 1.00 33.62 ? 484 ALA A CA 1 ATOM 1350 C C . ALA A 1 176 ? -30.980 47.107 -11.813 1.00 34.22 ? 484 ALA A C 1 ATOM 1351 O O . ALA A 1 176 ? -31.667 46.726 -12.760 1.00 33.52 ? 484 ALA A O 1 ATOM 1352 C CB . ALA A 1 176 ? -32.177 47.866 -9.748 1.00 35.38 ? 484 ALA A CB 1 ATOM 1353 N N . ASP A 1 177 ? -29.880 47.841 -11.960 1.00 34.86 ? 485 ASP A N 1 ATOM 1354 C CA . ASP A 1 177 ? -29.428 48.316 -13.264 1.00 39.21 ? 485 ASP A CA 1 ATOM 1355 C C . ASP A 1 177 ? -28.842 47.173 -14.081 1.00 39.42 ? 485 ASP A C 1 ATOM 1356 O O . ASP A 1 177 ? -29.080 47.064 -15.287 1.00 42.14 ? 485 ASP A O 1 ATOM 1357 C CB . ASP A 1 177 ? -28.391 49.425 -13.086 1.00 43.68 ? 485 ASP A CB 1 ATOM 1358 C CG . ASP A 1 177 ? -27.878 49.964 -14.402 1.00 52.22 ? 485 ASP A CG 1 ATOM 1359 O OD1 . ASP A 1 177 ? -28.698 50.166 -15.325 1.00 57.27 ? 485 ASP A OD1 1 ATOM 1360 O OD2 . ASP A 1 177 ? -26.653 50.186 -14.514 1.00 52.59 ? 485 ASP A OD2 1 ATOM 1361 N N . GLN A 1 178 ? -28.077 46.313 -13.418 1.00 35.65 ? 486 GLN A N 1 ATOM 1362 C CA . GLN A 1 178 ? -27.462 45.182 -14.098 1.00 35.36 ? 486 GLN A CA 1 ATOM 1363 C C . GLN A 1 178 ? -28.496 44.141 -14.522 1.00 37.90 ? 486 GLN A C 1 ATOM 1364 O O . GLN A 1 178 ? -28.378 43.546 -15.591 1.00 44.20 ? 486 GLN A O 1 ATOM 1365 C CB . GLN A 1 178 ? -26.372 44.556 -13.230 1.00 30.84 ? 486 GLN A CB 1 ATOM 1366 C CG . GLN A 1 178 ? -25.203 45.488 -12.971 1.00 29.88 ? 486 GLN A CG 1 ATOM 1367 C CD . GLN A 1 178 ? -24.164 44.882 -12.056 1.00 29.04 ? 486 GLN A CD 1 ATOM 1368 O OE1 . GLN A 1 178 ? -24.492 44.293 -11.025 1.00 27.71 ? 486 GLN A OE1 1 ATOM 1369 N NE2 . GLN A 1 178 ? -22.898 45.023 -12.428 1.00 31.74 ? 486 GLN A NE2 1 ATOM 1370 N N . LEU A 1 179 ? -29.512 43.931 -13.691 1.00 36.83 ? 487 LEU A N 1 ATOM 1371 C CA . LEU A 1 179 ? -30.600 43.025 -14.044 1.00 39.06 ? 487 LEU A CA 1 ATOM 1372 C C . LEU A 1 179 ? -31.383 43.544 -15.248 1.00 45.26 ? 487 LEU A C 1 ATOM 1373 O O . LEU A 1 179 ? -31.835 42.763 -16.082 1.00 46.97 ? 487 LEU A O 1 ATOM 1374 C CB . LEU A 1 179 ? -31.544 42.808 -12.859 1.00 35.67 ? 487 LEU A CB 1 ATOM 1375 C CG . LEU A 1 179 ? -31.027 41.938 -11.714 1.00 34.20 ? 487 LEU A CG 1 ATOM 1376 C CD1 . LEU A 1 179 ? -32.118 41.728 -10.668 1.00 32.16 ? 487 LEU A CD1 1 ATOM 1377 C CD2 . LEU A 1 179 ? -30.520 40.607 -12.252 1.00 33.46 ? 487 LEU A CD2 1 ATOM 1378 N N . GLU A 1 180 ? -31.540 44.862 -15.328 1.00 50.75 ? 488 GLU A N 1 ATOM 1379 C CA . GLU A 1 180 ? -32.231 45.490 -16.452 1.00 59.94 ? 488 GLU A CA 1 ATOM 1380 C C . GLU A 1 180 ? -31.435 45.380 -17.746 1.00 63.95 ? 488 GLU A C 1 ATOM 1381 O O . GLU A 1 180 ? -31.994 45.117 -18.811 1.00 67.00 ? 488 GLU A O 1 ATOM 1382 C CB . GLU A 1 180 ? -32.498 46.968 -16.166 1.00 64.45 ? 488 GLU A CB 1 ATOM 1383 C CG . GLU A 1 180 ? -33.663 47.243 -15.237 1.00 67.97 ? 488 GLU A CG 1 ATOM 1384 C CD . GLU A 1 180 ? -33.995 48.724 -15.161 1.00 72.70 ? 488 GLU A CD 1 ATOM 1385 O OE1 . GLU A 1 180 ? -33.398 49.505 -15.934 1.00 74.40 ? 488 GLU A OE1 1 ATOM 1386 O OE2 . GLU A 1 180 ? -34.849 49.105 -14.332 1.00 74.09 ? 488 GLU A OE2 1 ATOM 1387 N N . LYS A 1 181 ? -30.129 45.597 -17.649 1.00 63.75 ? 489 LYS A N 1 ATOM 1388 C CA . LYS A 1 181 ? -29.269 45.620 -18.825 1.00 67.65 ? 489 LYS A CA 1 ATOM 1389 C C . LYS A 1 181 ? -28.752 44.230 -19.182 1.00 69.24 ? 489 LYS A C 1 ATOM 1390 O O . LYS A 1 181 ? -27.844 44.089 -20.000 1.00 71.48 ? 489 LYS A O 1 ATOM 1391 C CB . LYS A 1 181 ? -28.106 46.594 -18.616 1.00 67.79 ? 489 LYS A CB 1 ATOM 1392 C CG . LYS A 1 181 ? -28.548 48.042 -18.467 1.00 68.23 ? 489 LYS A CG 1 ATOM 1393 C CD . LYS A 1 181 ? -27.368 48.971 -18.244 1.00 69.28 ? 489 LYS A CD 1 ATOM 1394 C CE . LYS A 1 181 ? -27.798 50.427 -18.340 1.00 71.54 ? 489 LYS A CE 1 ATOM 1395 N NZ . LYS A 1 181 ? -26.687 51.362 -18.011 1.00 72.38 ? 489 LYS A NZ 1 ATOM 1396 N N . ASN A 1 182 ? -29.342 43.214 -18.558 1.00 68.82 ? 490 ASN A N 1 ATOM 1397 C CA . ASN A 1 182 ? -29.022 41.817 -18.841 1.00 70.65 ? 490 ASN A CA 1 ATOM 1398 C C . ASN A 1 182 ? -27.543 41.474 -18.657 1.00 69.55 ? 490 ASN A C 1 ATOM 1399 O O . ASN A 1 182 ? -26.907 40.906 -19.547 1.00 72.21 ? 490 ASN A O 1 ATOM 1400 C CB . ASN A 1 182 ? -29.501 41.429 -20.245 1.00 75.96 ? 490 ASN A CB 1 ATOM 1401 C CG . ASN A 1 182 ? -29.490 39.929 -20.473 1.00 78.69 ? 490 ASN A CG 1 ATOM 1402 O OD1 . ASN A 1 182 ? -30.310 39.198 -19.916 1.00 77.76 ? 490 ASN A OD1 1 ATOM 1403 N ND2 . ASN A 1 182 ? -28.560 39.463 -21.301 1.00 81.37 ? 490 ASN A ND2 1 ATOM 1404 N N . ARG A 1 183 ? -26.998 41.828 -17.497 1.00 65.02 ? 491 ARG A N 1 ATOM 1405 C CA . ARG A 1 183 ? -25.621 41.473 -17.168 1.00 63.19 ? 491 ARG A CA 1 ATOM 1406 C C . ARG A 1 183 ? -25.548 40.761 -15.818 1.00 54.81 ? 491 ARG A C 1 ATOM 1407 O O . ARG A 1 183 ? -26.399 40.969 -14.953 1.00 51.25 ? 491 ARG A O 1 ATOM 1408 C CB . ARG A 1 183 ? -24.717 42.710 -17.180 1.00 67.55 ? 491 ARG A CB 1 ATOM 1409 C CG . ARG A 1 183 ? -24.662 43.424 -18.527 1.00 75.85 ? 491 ARG A CG 1 ATOM 1410 C CD . ARG A 1 183 ? -23.350 44.175 -18.717 1.00 80.72 ? 491 ARG A CD 1 ATOM 1411 N NE . ARG A 1 183 ? -22.206 43.267 -18.761 1.00 84.03 ? 491 ARG A NE 1 ATOM 1412 C CZ . ARG A 1 183 ? -20.953 43.649 -18.989 1.00 86.85 ? 491 ARG A CZ 1 ATOM 1413 N NH1 . ARG A 1 183 ? -20.673 44.928 -19.199 1.00 87.91 ? 491 ARG A NH1 1 ATOM 1414 N NH2 . ARG A 1 183 ? -19.978 42.749 -19.011 1.00 88.02 ? 491 ARG A NH2 1 ATOM 1415 N N . LEU A 1 184 ? -24.538 39.909 -15.656 1.00 50.87 ? 492 LEU A N 1 ATOM 1416 C CA . LEU A 1 184 ? -24.327 39.185 -14.407 1.00 46.29 ? 492 LEU A CA 1 ATOM 1417 C C . LEU A 1 184 ? -24.076 40.172 -13.270 1.00 42.47 ? 492 LEU A C 1 ATOM 1418 O O . LEU A 1 184 ? -23.107 40.929 -13.307 1.00 44.11 ? 492 LEU A O 1 ATOM 1419 C CB . LEU A 1 184 ? -23.141 38.228 -14.542 1.00 47.13 ? 492 LEU A CB 1 ATOM 1420 C CG . LEU A 1 184 ? -22.885 37.297 -13.355 1.00 46.95 ? 492 LEU A CG 1 ATOM 1421 C CD1 . LEU A 1 184 ? -23.951 36.218 -13.287 1.00 47.85 ? 492 LEU A CD1 1 ATOM 1422 C CD2 . LEU A 1 184 ? -21.499 36.681 -13.437 1.00 50.36 ? 492 LEU A CD2 1 ATOM 1423 N N . PRO A 1 185 ? -24.964 40.178 -12.263 1.00 36.74 ? 493 PRO A N 1 ATOM 1424 C CA . PRO A 1 185 ? -24.873 41.124 -11.143 1.00 34.50 ? 493 PRO A CA 1 ATOM 1425 C C . PRO A 1 185 ? -23.530 41.064 -10.426 1.00 33.60 ? 493 PRO A C 1 ATOM 1426 O O . PRO A 1 185 ? -22.961 39.981 -10.267 1.00 34.76 ? 493 PRO A O 1 ATOM 1427 C CB . PRO A 1 185 ? -26.000 40.667 -10.216 1.00 32.45 ? 493 PRO A CB 1 ATOM 1428 C CG . PRO A 1 185 ? -27.000 40.037 -11.144 1.00 33.75 ? 493 PRO A CG 1 ATOM 1429 C CD . PRO A 1 185 ? -26.165 39.329 -12.168 1.00 35.70 ? 493 PRO A CD 1 ATOM 1430 N N . SER A 1 186 ? -23.030 42.224 -10.009 1.00 30.29 ? 494 SER A N 1 ATOM 1431 C CA . SER A 1 186 ? -21.739 42.315 -9.332 1.00 27.72 ? 494 SER A CA 1 ATOM 1432 C C . SER A 1 186 ? -21.799 41.793 -7.897 1.00 28.27 ? 494 SER A C 1 ATOM 1433 O O . SER A 1 186 ? -20.764 41.589 -7.261 1.00 29.07 ? 494 SER A O 1 ATOM 1434 C CB . SER A 1 186 ? -21.224 43.758 -9.342 1.00 28.54 ? 494 SER A CB 1 ATOM 1435 O OG . SER A 1 186 ? -20.889 44.171 -10.654 1.00 31.25 ? 494 SER A OG 1 ATOM 1436 N N . VAL A 1 187 ? -23.011 41.597 -7.386 1.00 23.72 ? 495 VAL A N 1 ATOM 1437 C CA . VAL A 1 187 ? -23.191 41.008 -6.062 1.00 25.46 ? 495 VAL A CA 1 ATOM 1438 C C . VAL A 1 187 ? -23.317 39.498 -6.205 1.00 24.80 ? 495 VAL A C 1 ATOM 1439 O O . VAL A 1 187 ? -24.139 39.011 -6.987 1.00 23.18 ? 495 VAL A O 1 ATOM 1440 C CB . VAL A 1 187 ? -24.443 41.563 -5.367 1.00 24.20 ? 495 VAL A CB 1 ATOM 1441 C CG1 . VAL A 1 187 ? -24.732 40.802 -4.078 1.00 18.01 ? 495 VAL A CG1 1 ATOM 1442 C CG2 . VAL A 1 187 ? -24.273 43.055 -5.092 1.00 22.94 ? 495 VAL A CG2 1 ATOM 1443 N N . HIS A 1 188 ? -22.481 38.765 -5.473 1.00 22.92 ? 496 HIS A N 1 ATOM 1444 C CA . HIS A 1 188 ? -22.514 37.305 -5.491 1.00 22.88 ? 496 HIS A CA 1 ATOM 1445 C C . HIS A 1 188 ? -23.786 36.813 -4.807 1.00 21.50 ? 496 HIS A C 1 ATOM 1446 O O . HIS A 1 188 ? -24.195 37.376 -3.792 1.00 21.96 ? 496 HIS A O 1 ATOM 1447 C CB . HIS A 1 188 ? -21.289 36.754 -4.757 1.00 20.52 ? 496 HIS A CB 1 ATOM 1448 C CG . HIS A 1 188 ? -21.023 35.306 -5.025 1.00 20.54 ? 496 HIS A CG 1 ATOM 1449 N ND1 . HIS A 1 188 ? -21.737 34.292 -4.420 1.00 20.88 ? 496 HIS A ND1 1 ATOM 1450 C CD2 . HIS A 1 188 ? -20.109 34.700 -5.822 1.00 20.79 ? 496 HIS A CD2 1 ATOM 1451 C CE1 . HIS A 1 188 ? -21.284 33.126 -4.843 1.00 23.05 ? 496 HIS A CE1 1 ATOM 1452 N NE2 . HIS A 1 188 ? -20.295 33.345 -5.693 1.00 21.40 ? 496 HIS A NE2 1 ATOM 1453 N N . PRO A 1 189 ? -24.423 35.765 -5.362 1.00 20.43 ? 497 PRO A N 1 ATOM 1454 C CA . PRO A 1 189 ? -25.662 35.240 -4.775 1.00 21.46 ? 497 PRO A CA 1 ATOM 1455 C C . PRO A 1 189 ? -25.501 34.835 -3.306 1.00 21.45 ? 497 PRO A C 1 ATOM 1456 O O . PRO A 1 189 ? -26.430 35.016 -2.518 1.00 22.02 ? 497 PRO A O 1 ATOM 1457 C CB . PRO A 1 189 ? -25.984 34.015 -5.644 1.00 23.96 ? 497 PRO A CB 1 ATOM 1458 C CG . PRO A 1 189 ? -24.736 33.722 -6.415 1.00 26.49 ? 497 PRO A CG 1 ATOM 1459 C CD . PRO A 1 189 ? -24.041 35.034 -6.581 1.00 22.11 ? 497 PRO A CD 1 ATOM 1460 N N . HIS A 1 190 ? -24.335 34.315 -2.939 1.00 18.78 ? 498 HIS A N 1 ATOM 1461 C CA . HIS A 1 190 ? -24.095 33.974 -1.539 1.00 21.77 ? 498 HIS A CA 1 ATOM 1462 C C . HIS A 1 190 ? -24.112 35.222 -0.647 1.00 25.75 ? 498 HIS A C 1 ATOM 1463 O O . HIS A 1 190 ? -24.598 35.176 0.478 1.00 30.39 ? 498 HIS A O 1 ATOM 1464 C CB . HIS A 1 190 ? -22.773 33.227 -1.381 1.00 25.79 ? 498 HIS A CB 1 ATOM 1465 C CG . HIS A 1 190 ? -22.593 32.604 -0.032 1.00 29.09 ? 498 HIS A CG 1 ATOM 1466 N ND1 . HIS A 1 190 ? -21.631 33.024 0.860 1.00 31.27 ? 498 HIS A ND1 1 ATOM 1467 C CD2 . HIS A 1 190 ? -23.257 31.593 0.578 1.00 31.61 ? 498 HIS A CD2 1 ATOM 1468 C CE1 . HIS A 1 190 ? -21.706 32.296 1.961 1.00 33.71 ? 498 HIS A CE1 1 ATOM 1469 N NE2 . HIS A 1 190 ? -22.685 31.421 1.816 1.00 33.70 ? 498 HIS A NE2 1 ATOM 1470 N N . HIS A 1 191 ? -23.588 36.336 -1.152 1.00 23.54 ? 499 HIS A N 1 ATOM 1471 C CA . HIS A 1 191 ? -23.531 37.566 -0.361 1.00 23.27 ? 499 HIS A CA 1 ATOM 1472 C C . HIS A 1 191 ? -24.864 38.314 -0.360 1.00 22.59 ? 499 HIS A C 1 ATOM 1473 O O . HIS A 1 191 ? -25.069 39.205 0.459 1.00 22.41 ? 499 HIS A O 1 ATOM 1474 C CB . HIS A 1 191 ? -22.441 38.512 -0.883 1.00 22.95 ? 499 HIS A CB 1 ATOM 1475 C CG . HIS A 1 191 ? -21.070 37.909 -0.924 1.00 25.18 ? 499 HIS A CG 1 ATOM 1476 N ND1 . HIS A 1 191 ? -20.042 38.462 -1.657 1.00 23.62 ? 499 HIS A ND1 1 ATOM 1477 C CD2 . HIS A 1 191 ? -20.555 36.809 -0.322 1.00 25.22 ? 499 HIS A CD2 1 ATOM 1478 C CE1 . HIS A 1 191 ? -18.953 37.726 -1.508 1.00 25.06 ? 499 HIS A CE1 1 ATOM 1479 N NE2 . HIS A 1 191 ? -19.237 36.716 -0.705 1.00 24.48 ? 499 HIS A NE2 1 ATOM 1480 N N . SER A 1 192 ? -25.766 37.961 -1.276 1.00 23.41 ? 500 SER A N 1 ATOM 1481 C CA . SER A 1 192 ? -27.008 38.719 -1.458 1.00 20.99 ? 500 SER A CA 1 ATOM 1482 C C . SER A 1 192 ? -27.905 38.703 -0.217 1.00 21.65 ? 500 SER A C 1 ATOM 1483 O O . SER A 1 192 ? -28.762 39.569 -0.050 1.00 20.58 ? 500 SER A O 1 ATOM 1484 C CB . SER A 1 192 ? -27.775 38.238 -2.699 1.00 20.86 ? 500 SER A CB 1 ATOM 1485 O OG . SER A 1 192 ? -28.342 36.954 -2.496 1.00 24.19 ? 500 SER A OG 1 ATOM 1486 N N . MET A 1 193 ? -27.687 37.725 0.658 1.00 22.19 ? 501 MET A N 1 ATOM 1487 C CA . MET A 1 193 ? -28.395 37.648 1.928 1.00 24.01 ? 501 MET A CA 1 ATOM 1488 C C . MET A 1 193 ? -28.064 38.807 2.875 1.00 20.99 ? 501 MET A C 1 ATOM 1489 O O . MET A 1 193 ? -28.823 39.080 3.796 1.00 22.42 ? 501 MET A O 1 ATOM 1490 C CB . MET A 1 193 ? -28.089 36.317 2.628 1.00 22.79 ? 501 MET A CB 1 ATOM 1491 C CG . MET A 1 193 ? -26.598 36.070 2.851 1.00 19.91 ? 501 MET A CG 1 ATOM 1492 S SD . MET A 1 193 ? -26.268 34.503 3.689 1.00 38.40 ? 501 MET A SD 1 ATOM 1493 C CE . MET A 1 193 ? -24.548 34.731 4.152 1.00 33.26 ? 501 MET A CE 1 ATOM 1494 N N . LEU A 1 194 ? -26.939 39.481 2.648 1.00 17.75 ? 502 LEU A N 1 ATOM 1495 C CA . LEU A 1 194 ? -26.457 40.505 3.571 1.00 17.51 ? 502 LEU A CA 1 ATOM 1496 C C . LEU A 1 194 ? -27.009 41.906 3.290 1.00 21.58 ? 502 LEU A C 1 ATOM 1497 O O . LEU A 1 194 ? -26.855 42.813 4.111 1.00 21.73 ? 502 LEU A O 1 ATOM 1498 C CB . LEU A 1 194 ? -24.926 40.571 3.539 1.00 17.10 ? 502 LEU A CB 1 ATOM 1499 C CG . LEU A 1 194 ? -24.183 39.260 3.828 1.00 19.60 ? 502 LEU A CG 1 ATOM 1500 C CD1 . LEU A 1 194 ? -22.683 39.436 3.624 1.00 21.74 ? 502 LEU A CD1 1 ATOM 1501 C CD2 . LEU A 1 194 ? -24.478 38.776 5.236 1.00 21.81 ? 502 LEU A CD2 1 ATOM 1502 N N . TYR A 1 195 ? -27.641 42.077 2.135 1.00 22.16 ? 503 TYR A N 1 ATOM 1503 C CA . TYR A 1 195 ? -28.042 43.397 1.661 1.00 23.10 ? 503 TYR A CA 1 ATOM 1504 C C . TYR A 1 195 ? -29.553 43.447 1.501 1.00 25.36 ? 503 TYR A C 1 ATOM 1505 O O . TYR A 1 195 ? -30.171 42.429 1.211 1.00 24.84 ? 503 TYR A O 1 ATOM 1506 C CB . TYR A 1 195 ? -27.371 43.682 0.311 1.00 20.14 ? 503 TYR A CB 1 ATOM 1507 C CG . TYR A 1 195 ? -25.868 43.468 0.305 1.00 22.39 ? 503 TYR A CG 1 ATOM 1508 C CD1 . TYR A 1 195 ? -25.079 43.881 1.373 1.00 24.56 ? 503 TYR A CD1 1 ATOM 1509 C CD2 . TYR A 1 195 ? -25.243 42.843 -0.767 1.00 25.38 ? 503 TYR A CD2 1 ATOM 1510 C CE1 . TYR A 1 195 ? -23.706 43.678 1.369 1.00 24.81 ? 503 TYR A CE1 1 ATOM 1511 C CE2 . TYR A 1 195 ? -23.875 42.633 -0.780 1.00 22.84 ? 503 TYR A CE2 1 ATOM 1512 C CZ . TYR A 1 195 ? -23.112 43.057 0.284 1.00 23.11 ? 503 TYR A CZ 1 ATOM 1513 O OH . TYR A 1 195 ? -21.749 42.854 0.262 1.00 21.14 ? 503 TYR A OH 1 ATOM 1514 N N . PRO A 1 196 ? -30.158 44.638 1.676 1.00 27.83 ? 504 PRO A N 1 ATOM 1515 C CA . PRO A 1 196 ? -31.623 44.749 1.677 1.00 27.33 ? 504 PRO A CA 1 ATOM 1516 C C . PRO A 1 196 ? -32.241 44.657 0.283 1.00 27.90 ? 504 PRO A C 1 ATOM 1517 O O . PRO A 1 196 ? -33.091 45.480 -0.083 1.00 28.06 ? 504 PRO A O 1 ATOM 1518 C CB . PRO A 1 196 ? -31.865 46.133 2.287 1.00 29.23 ? 504 PRO A CB 1 ATOM 1519 C CG . PRO A 1 196 ? -30.649 46.912 1.913 1.00 27.42 ? 504 PRO A CG 1 ATOM 1520 C CD . PRO A 1 196 ? -29.509 45.929 1.969 1.00 28.29 ? 504 PRO A CD 1 ATOM 1521 N N . LEU A 1 197 ? -31.803 43.660 -0.480 1.00 28.73 ? 505 LEU A N 1 ATOM 1522 C CA . LEU A 1 197 ? -32.343 43.375 -1.803 1.00 29.28 ? 505 LEU A CA 1 ATOM 1523 C C . LEU A 1 197 ? -33.690 42.676 -1.655 1.00 32.30 ? 505 LEU A C 1 ATOM 1524 O O . LEU A 1 197 ? -33.919 41.966 -0.677 1.00 34.95 ? 505 LEU A O 1 ATOM 1525 C CB . LEU A 1 197 ? -31.382 42.472 -2.581 1.00 25.87 ? 505 LEU A CB 1 ATOM 1526 C CG . LEU A 1 197 ? -29.999 43.033 -2.918 1.00 28.74 ? 505 LEU A CG 1 ATOM 1527 C CD1 . LEU A 1 197 ? -29.034 41.922 -3.296 1.00 29.81 ? 505 LEU A CD1 1 ATOM 1528 C CD2 . LEU A 1 197 ? -30.103 44.043 -4.047 1.00 28.51 ? 505 LEU A CD2 1 ATOM 1529 N N . SER A 1 198 ? -34.578 42.874 -2.622 1.00 34.26 ? 506 SER A N 1 ATOM 1530 C CA . SER A 1 198 ? -35.868 42.196 -2.596 1.00 34.29 ? 506 SER A CA 1 ATOM 1531 C C . SER A 1 198 ? -35.663 40.711 -2.861 1.00 34.07 ? 506 SER A C 1 ATOM 1532 O O . SER A 1 198 ? -34.654 40.311 -3.443 1.00 30.52 ? 506 SER A O 1 ATOM 1533 C CB . SER A 1 198 ? -36.812 42.785 -3.643 1.00 34.91 ? 506 SER A CB 1 ATOM 1534 O OG . SER A 1 198 ? -36.310 42.561 -4.948 1.00 32.60 ? 506 SER A OG 1 ATOM 1535 N N . HIS A 1 199 ? -36.618 39.895 -2.433 1.00 36.29 ? 507 HIS A N 1 ATOM 1536 C CA . HIS A 1 199 ? -36.536 38.460 -2.673 1.00 36.52 ? 507 HIS A CA 1 ATOM 1537 C C . HIS A 1 199 ? -36.497 38.183 -4.169 1.00 31.57 ? 507 HIS A C 1 ATOM 1538 O O . HIS A 1 199 ? -35.851 37.235 -4.617 1.00 27.88 ? 507 HIS A O 1 ATOM 1539 C CB . HIS A 1 199 ? -37.709 37.737 -2.010 1.00 42.67 ? 507 HIS A CB 1 ATOM 1540 C CG . HIS A 1 199 ? -37.791 37.967 -0.535 1.00 49.00 ? 507 HIS A CG 1 ATOM 1541 N ND1 . HIS A 1 199 ? -36.750 37.674 0.320 1.00 50.91 ? 507 HIS A ND1 1 ATOM 1542 C CD2 . HIS A 1 199 ? -38.781 38.475 0.237 1.00 52.95 ? 507 HIS A CD2 1 ATOM 1543 C CE1 . HIS A 1 199 ? -37.097 37.986 1.556 1.00 53.29 ? 507 HIS A CE1 1 ATOM 1544 N NE2 . HIS A 1 199 ? -38.326 38.471 1.533 1.00 55.33 ? 507 HIS A NE2 1 ATOM 1545 N N . GLY A 1 200 ? -37.175 39.033 -4.934 1.00 32.57 ? 508 GLY A N 1 ATOM 1546 C CA . GLY A 1 200 ? -37.168 38.934 -6.379 1.00 32.44 ? 508 GLY A CA 1 ATOM 1547 C C . GLY A 1 200 ? -35.776 39.131 -6.945 1.00 29.49 ? 508 GLY A C 1 ATOM 1548 O O . GLY A 1 200 ? -35.351 38.387 -7.829 1.00 28.91 ? 508 GLY A O 1 ATOM 1549 N N . PHE A 1 201 ? -35.066 40.136 -6.437 1.00 26.48 ? 509 PHE A N 1 ATOM 1550 C CA . PHE A 1 201 ? -33.710 40.419 -6.903 1.00 27.92 ? 509 PHE A CA 1 ATOM 1551 C C . PHE A 1 201 ? -32.743 39.310 -6.508 1.00 28.49 ? 509 PHE A C 1 ATOM 1552 O O . PHE A 1 201 ? -31.878 38.926 -7.295 1.00 29.60 ? 509 PHE A O 1 ATOM 1553 C CB . PHE A 1 201 ? -33.203 41.760 -6.365 1.00 26.82 ? 509 PHE A CB 1 ATOM 1554 C CG . PHE A 1 201 ? -33.701 42.950 -7.132 1.00 28.98 ? 509 PHE A CG 1 ATOM 1555 C CD1 . PHE A 1 201 ? -34.684 42.810 -8.096 1.00 27.98 ? 509 PHE A CD1 1 ATOM 1556 C CD2 . PHE A 1 201 ? -33.167 44.207 -6.902 1.00 32.00 ? 509 PHE A CD2 1 ATOM 1557 C CE1 . PHE A 1 201 ? -35.139 43.908 -8.804 1.00 32.60 ? 509 PHE A CE1 1 ATOM 1558 C CE2 . PHE A 1 201 ? -33.611 45.309 -7.610 1.00 30.92 ? 509 PHE A CE2 1 ATOM 1559 C CZ . PHE A 1 201 ? -34.601 45.160 -8.559 1.00 34.22 ? 509 PHE A CZ 1 ATOM 1560 N N . ARG A 1 202 ? -32.891 38.801 -5.289 1.00 27.16 ? 510 ARG A N 1 ATOM 1561 C CA . ARG A 1 202 ? -32.011 37.740 -4.806 1.00 27.05 ? 510 ARG A CA 1 ATOM 1562 C C . ARG A 1 202 ? -32.164 36.478 -5.642 1.00 25.11 ? 510 ARG A C 1 ATOM 1563 O O . ARG A 1 202 ? -31.180 35.826 -5.983 1.00 23.86 ? 510 ARG A O 1 ATOM 1564 C CB . ARG A 1 202 ? -32.263 37.432 -3.330 1.00 29.68 ? 510 ARG A CB 1 ATOM 1565 C CG . ARG A 1 202 ? -31.896 38.568 -2.379 1.00 30.99 ? 510 ARG A CG 1 ATOM 1566 C CD . ARG A 1 202 ? -31.623 38.027 -0.981 1.00 32.73 ? 510 ARG A CD 1 ATOM 1567 N NE . ARG A 1 202 ? -31.575 39.073 0.038 1.00 32.34 ? 510 ARG A NE 1 ATOM 1568 C CZ . ARG A 1 202 ? -32.630 39.486 0.733 1.00 32.21 ? 510 ARG A CZ 1 ATOM 1569 N NH1 . ARG A 1 202 ? -33.824 38.948 0.517 1.00 30.28 ? 510 ARG A NH1 1 ATOM 1570 N NH2 . ARG A 1 202 ? -32.491 40.437 1.649 1.00 34.66 ? 510 ARG A NH2 1 ATOM 1571 N N . LYS A 1 203 ? -33.401 36.141 -5.983 1.00 26.44 ? 511 LYS A N 1 ATOM 1572 C CA . LYS A 1 203 ? -33.645 34.981 -6.830 1.00 27.87 ? 511 LYS A CA 1 ATOM 1573 C C . LYS A 1 203 ? -33.091 35.224 -8.235 1.00 26.78 ? 511 LYS A C 1 ATOM 1574 O O . LYS A 1 203 ? -32.495 34.335 -8.842 1.00 24.67 ? 511 LYS A O 1 ATOM 1575 C CB . LYS A 1 203 ? -35.142 34.655 -6.882 1.00 30.14 ? 511 LYS A CB 1 ATOM 1576 C CG . LYS A 1 203 ? -35.467 33.378 -7.640 1.00 32.87 ? 511 LYS A CG 1 ATOM 1577 C CD . LYS A 1 203 ? -36.879 32.879 -7.349 1.00 35.98 ? 511 LYS A CD 1 ATOM 1578 C CE . LYS A 1 203 ? -37.932 33.636 -8.128 1.00 39.31 ? 511 LYS A CE 1 ATOM 1579 N NZ . LYS A 1 203 ? -39.263 32.953 -8.044 1.00 41.03 ? 511 LYS A NZ 1 ATOM 1580 N N . ALA A 1 204 ? -33.293 36.437 -8.745 1.00 26.96 ? 512 ALA A N 1 ATOM 1581 C CA . ALA A 1 204 ? -32.808 36.806 -10.072 1.00 25.92 ? 512 ALA A CA 1 ATOM 1582 C C . ALA A 1 204 ? -31.281 36.751 -10.176 1.00 24.81 ? 512 ALA A C 1 ATOM 1583 O O . ALA A 1 204 ? -30.737 36.337 -11.201 1.00 26.45 ? 512 ALA A O 1 ATOM 1584 C CB . ALA A 1 204 ? -33.310 38.184 -10.448 1.00 26.25 ? 512 ALA A CB 1 ATOM 1585 N N . ILE A 1 205 ? -30.593 37.189 -9.127 1.00 23.60 ? 513 ILE A N 1 ATOM 1586 C CA . ILE A 1 205 ? -29.132 37.078 -9.086 1.00 23.77 ? 513 ILE A CA 1 ATOM 1587 C C . ILE A 1 205 ? -28.697 35.613 -9.193 1.00 24.68 ? 513 ILE A C 1 ATOM 1588 O O . ILE A 1 205 ? -27.821 35.262 -9.987 1.00 23.57 ? 513 ILE A O 1 ATOM 1589 C CB . ILE A 1 205 ? -28.558 37.675 -7.786 1.00 22.02 ? 513 ILE A CB 1 ATOM 1590 C CG1 . ILE A 1 205 ? -28.712 39.194 -7.783 1.00 22.45 ? 513 ILE A CG1 1 ATOM 1591 C CG2 . ILE A 1 205 ? -27.089 37.296 -7.620 1.00 21.92 ? 513 ILE A CG2 1 ATOM 1592 C CD1 . ILE A 1 205 ? -28.405 39.840 -6.445 1.00 22.27 ? 513 ILE A CD1 1 ATOM 1593 N N . ALA A 1 206 ? -29.324 34.761 -8.391 1.00 24.10 ? 514 ALA A N 1 ATOM 1594 C CA . ALA A 1 206 ? -29.022 33.336 -8.408 1.00 23.86 ? 514 ALA A CA 1 ATOM 1595 C C . ALA A 1 206 ? -29.321 32.714 -9.769 1.00 27.10 ? 514 ALA A C 1 ATOM 1596 O O . ALA A 1 206 ? -28.564 31.871 -10.255 1.00 30.19 ? 514 ALA A O 1 ATOM 1597 C CB . ALA A 1 206 ? -29.796 32.620 -7.316 1.00 23.27 ? 514 ALA A CB 1 ATOM 1598 N N . GLU A 1 207 ? -30.430 33.129 -10.375 1.00 27.39 ? 515 GLU A N 1 ATOM 1599 C CA . GLU A 1 207 ? -30.842 32.604 -11.675 1.00 31.05 ? 515 GLU A CA 1 ATOM 1600 C C . GLU A 1 207 ? -29.794 32.894 -12.749 1.00 31.77 ? 515 GLU A C 1 ATOM 1601 O O . GLU A 1 207 ? -29.568 32.078 -13.654 1.00 30.77 ? 515 GLU A O 1 ATOM 1602 C CB . GLU A 1 207 ? -32.198 33.195 -12.075 1.00 35.15 ? 515 GLU A CB 1 ATOM 1603 C CG . GLU A 1 207 ? -32.820 32.575 -13.313 1.00 43.83 ? 515 GLU A CG 1 ATOM 1604 C CD . GLU A 1 207 ? -32.387 33.255 -14.602 1.00 52.46 ? 515 GLU A CD 1 ATOM 1605 O OE1 . GLU A 1 207 ? -31.707 34.302 -14.531 1.00 52.53 ? 515 GLU A OE1 1 ATOM 1606 O OE2 . GLU A 1 207 ? -32.732 32.741 -15.690 1.00 58.21 ? 515 GLU A OE2 1 ATOM 1607 N N . ARG A 1 208 ? -29.167 34.064 -12.648 1.00 30.49 ? 516 ARG A N 1 ATOM 1608 C CA . ARG A 1 208 ? -28.113 34.460 -13.576 1.00 32.72 ? 516 ARG A CA 1 ATOM 1609 C C . ARG A 1 208 ? -26.922 33.524 -13.462 1.00 33.39 ? 516 ARG A C 1 ATOM 1610 O O . ARG A 1 208 ? -26.307 33.169 -14.466 1.00 34.04 ? 516 ARG A O 1 ATOM 1611 C CB . ARG A 1 208 ? -27.663 35.890 -13.297 1.00 36.47 ? 516 ARG A CB 1 ATOM 1612 C CG . ARG A 1 208 ? -28.714 36.941 -13.577 1.00 43.55 ? 516 ARG A CG 1 ATOM 1613 C CD . ARG A 1 208 ? -28.974 37.075 -15.063 1.00 50.79 ? 516 ARG A CD 1 ATOM 1614 N NE . ARG A 1 208 ? -29.849 38.204 -15.358 1.00 56.59 ? 516 ARG A NE 1 ATOM 1615 C CZ . ARG A 1 208 ? -30.018 38.714 -16.573 1.00 62.63 ? 516 ARG A CZ 1 ATOM 1616 N NH1 . ARG A 1 208 ? -29.364 38.197 -17.606 1.00 64.98 ? 516 ARG A NH1 1 ATOM 1617 N NH2 . ARG A 1 208 ? -30.835 39.743 -16.754 1.00 64.63 ? 516 ARG A NH2 1 ATOM 1618 N N . HIS A 1 209 ? -26.597 33.126 -12.234 1.00 31.60 ? 517 HIS A N 1 ATOM 1619 C CA . HIS A 1 209 ? -25.494 32.199 -12.014 1.00 34.12 ? 517 HIS A CA 1 ATOM 1620 C C . HIS A 1 209 ? -25.838 30.811 -12.527 1.00 35.63 ? 517 HIS A C 1 ATOM 1621 O O . HIS A 1 209 ? -24.986 30.123 -13.087 1.00 38.14 ? 517 HIS A O 1 ATOM 1622 C CB . HIS A 1 209 ? -25.084 32.170 -10.539 1.00 32.52 ? 517 HIS A CB 1 ATOM 1623 C CG . HIS A 1 209 ? -24.274 33.360 -10.132 1.00 33.84 ? 517 HIS A CG 1 ATOM 1624 N ND1 . HIS A 1 209 ? -22.945 33.270 -9.776 1.00 35.61 ? 517 HIS A ND1 1 ATOM 1625 C CD2 . HIS A 1 209 ? -24.592 34.675 -10.070 1.00 33.05 ? 517 HIS A CD2 1 ATOM 1626 C CE1 . HIS A 1 209 ? -22.486 34.476 -9.494 1.00 35.96 ? 517 HIS A CE1 1 ATOM 1627 N NE2 . HIS A 1 209 ? -23.463 35.347 -9.672 1.00 35.53 ? 517 HIS A NE2 1 ATOM 1628 N N . GLY A 1 210 ? -27.092 30.410 -12.349 1.00 34.10 ? 518 GLY A N 1 ATOM 1629 C CA . GLY A 1 210 ? -27.565 29.154 -12.898 1.00 35.41 ? 518 GLY A CA 1 ATOM 1630 C C . GLY A 1 210 ? -27.411 29.123 -14.409 1.00 37.01 ? 518 GLY A C 1 ATOM 1631 O O . GLY A 1 210 ? -26.971 28.126 -14.978 1.00 36.83 ? 518 GLY A O 1 ATOM 1632 N N . ASN A 1 211 ? -27.759 30.226 -15.062 1.00 38.13 ? 519 ASN A N 1 ATOM 1633 C CA . ASN A 1 211 ? -27.666 30.301 -16.518 1.00 39.09 ? 519 ASN A CA 1 ATOM 1634 C C . ASN A 1 211 ? -26.232 30.313 -17.046 1.00 36.42 ? 519 ASN A C 1 ATOM 1635 O O . ASN A 1 211 ? -25.974 29.859 -18.162 1.00 38.17 ? 519 ASN A O 1 ATOM 1636 C CB . ASN A 1 211 ? -28.462 31.490 -17.055 1.00 46.29 ? 519 ASN A CB 1 ATOM 1637 C CG . ASN A 1 211 ? -29.866 31.101 -17.479 1.00 50.99 ? 519 ASN A CG 1 ATOM 1638 O OD1 . ASN A 1 211 ? -30.737 30.866 -16.641 1.00 51.32 ? 519 ASN A OD1 1 ATOM 1639 N ND2 . ASN A 1 211 ? -30.090 31.025 -18.788 1.00 51.82 ? 519 ASN A ND2 1 ATOM 1640 N N . LEU A 1 212 ? -25.308 30.833 -16.245 1.00 35.24 ? 520 LEU A N 1 ATOM 1641 C CA . LEU A 1 212 ? -23.884 30.728 -16.547 1.00 37.65 ? 520 LEU A CA 1 ATOM 1642 C C . LEU A 1 212 ? -23.482 29.267 -16.705 1.00 36.90 ? 520 LEU A C 1 ATOM 1643 O O . LEU A 1 212 ? -22.821 28.896 -17.678 1.00 36.38 ? 520 LEU A O 1 ATOM 1644 C CB . LEU A 1 212 ? -23.044 31.356 -15.436 1.00 39.62 ? 520 LEU A CB 1 ATOM 1645 C CG . LEU A 1 212 ? -22.574 32.799 -15.586 1.00 46.84 ? 520 LEU A CG 1 ATOM 1646 C CD1 . LEU A 1 212 ? -21.644 33.149 -14.432 1.00 47.26 ? 520 LEU A CD1 1 ATOM 1647 C CD2 . LEU A 1 212 ? -21.886 33.013 -16.929 1.00 49.87 ? 520 LEU A CD2 1 ATOM 1648 N N . CYS A 1 213 ? -23.882 28.442 -15.739 1.00 34.52 ? 521 CYS A N 1 ATOM 1649 C CA . CYS A 1 213 ? -23.590 27.013 -15.782 1.00 34.13 ? 521 CYS A CA 1 ATOM 1650 C C . CYS A 1 213 ? -24.153 26.362 -17.040 1.00 35.29 ? 521 CYS A C 1 ATOM 1651 O O . CYS A 1 213 ? -23.479 25.558 -17.685 1.00 37.14 ? 521 CYS A O 1 ATOM 1652 C CB . CYS A 1 213 ? -24.140 26.313 -14.540 1.00 32.14 ? 521 CYS A CB 1 ATOM 1653 S SG . CYS A 1 213 ? -23.422 26.908 -12.999 1.00 40.16 ? 521 CYS A SG 1 ATOM 1654 N N . LEU A 1 214 ? -25.389 26.712 -17.382 1.00 34.64 ? 522 LEU A N 1 ATOM 1655 C CA . LEU A 1 214 ? -26.014 26.205 -18.601 1.00 38.68 ? 522 LEU A CA 1 ATOM 1656 C C . LEU A 1 214 ? -25.228 26.611 -19.843 1.00 41.95 ? 522 LEU A C 1 ATOM 1657 O O . LEU A 1 214 ? -25.029 25.802 -20.749 1.00 43.98 ? 522 LEU A O 1 ATOM 1658 C CB . LEU A 1 214 ? -27.461 26.688 -18.712 1.00 41.94 ? 522 LEU A CB 1 ATOM 1659 C CG . LEU A 1 214 ? -28.456 26.049 -17.741 1.00 42.70 ? 522 LEU A CG 1 ATOM 1660 C CD1 . LEU A 1 214 ? -29.792 26.778 -17.771 1.00 43.50 ? 522 LEU A CD1 1 ATOM 1661 C CD2 . LEU A 1 214 ? -28.641 24.579 -18.074 1.00 43.55 ? 522 LEU A CD2 1 ATOM 1662 N N . ASP A 1 215 ? -24.780 27.863 -19.880 1.00 41.07 ? 523 ASP A N 1 ATOM 1663 C CA . ASP A 1 215 ? -23.998 28.356 -21.010 1.00 45.59 ? 523 ASP A CA 1 ATOM 1664 C C . ASP A 1 215 ? -22.706 27.569 -21.181 1.00 46.11 ? 523 ASP A C 1 ATOM 1665 O O . ASP A 1 215 ? -22.257 27.333 -22.302 1.00 45.53 ? 523 ASP A O 1 ATOM 1666 C CB . ASP A 1 215 ? -23.674 29.842 -20.845 1.00 46.93 ? 523 ASP A CB 1 ATOM 1667 C CG . ASP A 1 215 ? -24.890 30.728 -21.012 1.00 49.75 ? 523 ASP A CG 1 ATOM 1668 O OD1 . ASP A 1 215 ? -24.811 31.909 -20.620 1.00 51.87 ? 523 ASP A OD1 1 ATOM 1669 O OD2 . ASP A 1 215 ? -25.921 30.246 -21.530 1.00 50.47 ? 523 ASP A OD2 1 ATOM 1670 N N . LYS A 1 216 ? -22.111 27.164 -20.064 1.00 44.87 ? 524 LYS A N 1 ATOM 1671 C CA . LYS A 1 216 ? -20.846 26.443 -20.098 1.00 48.09 ? 524 LYS A CA 1 ATOM 1672 C C . LYS A 1 216 ? -20.996 24.994 -20.555 1.00 48.15 ? 524 LYS A C 1 ATOM 1673 O O . LYS A 1 216 ? -20.088 24.444 -21.178 1.00 52.15 ? 524 LYS A O 1 ATOM 1674 C CB . LYS A 1 216 ? -20.145 26.506 -18.740 1.00 49.29 ? 524 LYS A CB 1 ATOM 1675 C CG . LYS A 1 216 ? -19.706 27.904 -18.341 1.00 53.19 ? 524 LYS A CG 1 ATOM 1676 C CD . LYS A 1 216 ? -19.020 27.907 -16.984 1.00 55.02 ? 524 LYS A CD 1 ATOM 1677 C CE . LYS A 1 216 ? -18.632 29.321 -16.568 1.00 57.68 ? 524 LYS A CE 1 ATOM 1678 N NZ . LYS A 1 216 ? -17.955 29.341 -15.239 1.00 57.77 ? 524 LYS A NZ 1 ATOM 1679 N N . ILE A 1 217 ? -22.132 24.372 -20.252 1.00 41.99 ? 525 ILE A N 1 ATOM 1680 C CA . ILE A 1 217 ? -22.346 22.984 -20.663 1.00 41.16 ? 525 ILE A CA 1 ATOM 1681 C C . ILE A 1 217 ? -23.028 22.844 -22.030 1.00 45.22 ? 525 ILE A C 1 ATOM 1682 O O . ILE A 1 217 ? -22.957 21.785 -22.658 1.00 45.93 ? 525 ILE A O 1 ATOM 1683 C CB . ILE A 1 217 ? -23.093 22.159 -19.587 1.00 39.76 ? 525 ILE A CB 1 ATOM 1684 C CG1 . ILE A 1 217 ? -24.459 22.772 -19.269 1.00 39.71 ? 525 ILE A CG1 1 ATOM 1685 C CG2 . ILE A 1 217 ? -22.249 22.051 -18.332 1.00 36.84 ? 525 ILE A CG2 1 ATOM 1686 C CD1 . ILE A 1 217 ? -25.628 22.035 -19.894 1.00 40.86 ? 525 ILE A CD1 1 ATOM 1687 N N . ASN A 1 218 ? -23.676 23.907 -22.496 1.00 47.71 ? 526 ASN A N 1 ATOM 1688 C CA . ASN A 1 218 ? -24.318 23.871 -23.807 1.00 51.73 ? 526 ASN A CA 1 ATOM 1689 C C . ASN A 1 218 ? -23.300 23.714 -24.935 1.00 51.86 ? 526 ASN A C 1 ATOM 1690 O O . ASN A 1 218 ? -23.606 23.135 -25.978 1.00 53.78 ? 526 ASN A O 1 ATOM 1691 C CB . ASN A 1 218 ? -25.189 25.112 -24.039 1.00 55.87 ? 526 ASN A CB 1 ATOM 1692 C CG . ASN A 1 218 ? -26.451 25.111 -23.188 1.00 58.29 ? 526 ASN A CG 1 ATOM 1693 O OD1 . ASN A 1 218 ? -26.969 24.056 -22.819 1.00 58.67 ? 526 ASN A OD1 1 ATOM 1694 N ND2 . ASN A 1 218 ? -26.947 26.302 -22.868 1.00 58.88 ? 526 ASN A ND2 1 ATOM 1695 N N . VAL A 1 219 ? -22.087 24.215 -24.714 1.00 50.58 ? 527 VAL A N 1 ATOM 1696 C CA . VAL A 1 219 ? -21.027 24.125 -25.715 1.00 53.62 ? 527 VAL A CA 1 ATOM 1697 C C . VAL A 1 219 ? -20.497 22.700 -25.862 1.00 52.94 ? 527 VAL A C 1 ATOM 1698 O O . VAL A 1 219 ? -19.771 22.398 -26.810 1.00 54.53 ? 527 VAL A O 1 ATOM 1699 C CB . VAL A 1 219 ? -19.852 25.073 -25.400 1.00 55.94 ? 527 VAL A CB 1 ATOM 1700 C CG1 . VAL A 1 219 ? -20.367 26.473 -25.105 1.00 58.22 ? 527 VAL A CG1 1 ATOM 1701 C CG2 . VAL A 1 219 ? -19.038 24.547 -24.233 1.00 53.20 ? 527 VAL A CG2 1 ATOM 1702 N N . LEU A 1 220 ? -20.861 21.831 -24.921 1.00 48.90 ? 528 LEU A N 1 ATOM 1703 C CA . LEU A 1 220 ? -20.500 20.419 -24.996 1.00 48.83 ? 528 LEU A CA 1 ATOM 1704 C C . LEU A 1 220 ? -21.442 19.691 -25.947 1.00 50.45 ? 528 LEU A C 1 ATOM 1705 O O . LEU A 1 220 ? -21.133 18.602 -26.432 1.00 50.87 ? 528 LEU A O 1 ATOM 1706 C CB . LEU A 1 220 ? -20.559 19.772 -23.608 1.00 47.62 ? 528 LEU A CB 1 ATOM 1707 C CG . LEU A 1 220 ? -19.552 20.268 -22.569 1.00 48.15 ? 528 LEU A CG 1 ATOM 1708 C CD1 . LEU A 1 220 ? -19.933 19.786 -21.176 1.00 46.55 ? 528 LEU A CD1 1 ATOM 1709 C CD2 . LEU A 1 220 ? -18.150 19.808 -22.926 1.00 50.41 ? 528 LEU A CD2 1 ATOM 1710 N N . HIS A 1 221 ? -22.595 20.307 -26.197 1.00 52.69 ? 529 HIS A N 1 ATOM 1711 C CA . HIS A 1 221 ? -23.607 19.777 -27.111 1.00 55.72 ? 529 HIS A CA 1 ATOM 1712 C C . HIS A 1 221 ? -24.009 18.342 -26.789 1.00 54.28 ? 529 HIS A C 1 ATOM 1713 O O . HIS A 1 221 ? -24.343 17.560 -27.681 1.00 56.85 ? 529 HIS A O 1 ATOM 1714 C CB . HIS A 1 221 ? -23.153 19.908 -28.568 1.00 59.78 ? 529 HIS A CB 1 ATOM 1715 C CG . HIS A 1 221 ? -22.954 21.325 -29.007 1.00 63.81 ? 529 HIS A CG 1 ATOM 1716 N ND1 . HIS A 1 221 ? -21.707 21.898 -29.132 1.00 65.63 ? 529 HIS A ND1 1 ATOM 1717 C CD2 . HIS A 1 221 ? -23.846 22.292 -29.328 1.00 65.24 ? 529 HIS A CD2 1 ATOM 1718 C CE1 . HIS A 1 221 ? -21.839 23.154 -29.522 1.00 66.87 ? 529 HIS A CE1 1 ATOM 1719 N NE2 . HIS A 1 221 ? -23.127 23.418 -29.648 1.00 66.93 ? 529 HIS A NE2 1 ATOM 1720 N N . LYS A 1 222 ? -23.972 18.005 -25.505 1.00 50.45 ? 530 LYS A N 1 ATOM 1721 C CA . LYS A 1 222 ? -24.396 16.692 -25.047 1.00 48.63 ? 530 LYS A CA 1 ATOM 1722 C C . LYS A 1 222 ? -25.914 16.625 -25.042 1.00 49.35 ? 530 LYS A C 1 ATOM 1723 O O . LYS A 1 222 ? -26.584 17.600 -24.687 1.00 49.27 ? 530 LYS A O 1 ATOM 1724 C CB . LYS A 1 222 ? -23.854 16.416 -23.644 1.00 46.58 ? 530 LYS A CB 1 ATOM 1725 C CG . LYS A 1 222 ? -22.343 16.510 -23.541 1.00 47.06 ? 530 LYS A CG 1 ATOM 1726 C CD . LYS A 1 222 ? -21.874 16.331 -22.110 1.00 44.24 ? 530 LYS A CD 1 ATOM 1727 C CE . LYS A 1 222 ? -22.152 14.924 -21.606 1.00 43.65 ? 530 LYS A CE 1 ATOM 1728 N NZ . LYS A 1 222 ? -21.254 13.910 -22.229 1.00 44.49 ? 530 LYS A NZ 1 ATOM 1729 N N . PRO A 1 223 ? -26.464 15.474 -25.445 1.00 50.76 ? 531 PRO A N 1 ATOM 1730 C CA . PRO A 1 223 ? -27.913 15.259 -25.437 1.00 53.19 ? 531 PRO A CA 1 ATOM 1731 C C . PRO A 1 223 ? -28.414 15.090 -24.008 1.00 52.78 ? 531 PRO A C 1 ATOM 1732 O O . PRO A 1 223 ? -27.603 14.888 -23.103 1.00 51.57 ? 531 PRO A O 1 ATOM 1733 C CB . PRO A 1 223 ? -28.063 13.943 -26.202 1.00 56.78 ? 531 PRO A CB 1 ATOM 1734 C CG . PRO A 1 223 ? -26.789 13.217 -25.930 1.00 56.13 ? 531 PRO A CG 1 ATOM 1735 C CD . PRO A 1 223 ? -25.727 14.280 -25.893 1.00 52.93 ? 531 PRO A CD 1 ATOM 1736 N N . PRO A 1 224 ? -29.734 15.187 -23.798 1.00 52.49 ? 532 PRO A N 1 ATOM 1737 C CA . PRO A 1 224 ? -30.267 14.862 -22.472 1.00 50.11 ? 532 PRO A CA 1 ATOM 1738 C C . PRO A 1 224 ? -30.059 13.382 -22.158 1.00 45.34 ? 532 PRO A C 1 ATOM 1739 O O . PRO A 1 224 ? -30.207 12.532 -23.040 1.00 45.17 ? 532 PRO A O 1 ATOM 1740 C CB . PRO A 1 224 ? -31.760 15.186 -22.601 1.00 51.94 ? 532 PRO A CB 1 ATOM 1741 C CG . PRO A 1 224 ? -32.037 15.177 -24.070 1.00 54.45 ? 532 PRO A CG 1 ATOM 1742 C CD . PRO A 1 224 ? -30.781 15.666 -24.716 1.00 54.51 ? 532 PRO A CD 1 ATOM 1743 N N . TYR A 1 225 ? -29.704 13.090 -20.912 1.00 39.56 ? 533 TYR A N 1 ATOM 1744 C CA . TYR A 1 225 ? -29.448 11.725 -20.474 1.00 39.49 ? 533 TYR A CA 1 ATOM 1745 C C . TYR A 1 225 ? -30.732 10.915 -20.348 1.00 41.60 ? 533 TYR A C 1 ATOM 1746 O O . TYR A 1 225 ? -31.777 11.443 -19.964 1.00 42.06 ? 533 TYR A O 1 ATOM 1747 C CB . TYR A 1 225 ? -28.752 11.730 -19.111 1.00 37.18 ? 533 TYR A CB 1 ATOM 1748 C CG . TYR A 1 225 ? -27.314 12.193 -19.123 1.00 37.80 ? 533 TYR A CG 1 ATOM 1749 C CD1 . TYR A 1 225 ? -26.287 11.317 -19.452 1.00 38.93 ? 533 TYR A CD1 1 ATOM 1750 C CD2 . TYR A 1 225 ? -26.979 13.499 -18.780 1.00 36.27 ? 533 TYR A CD2 1 ATOM 1751 C CE1 . TYR A 1 225 ? -24.968 11.728 -19.451 1.00 39.31 ? 533 TYR A CE1 1 ATOM 1752 C CE2 . TYR A 1 225 ? -25.663 13.919 -18.773 1.00 36.83 ? 533 TYR A CE2 1 ATOM 1753 C CZ . TYR A 1 225 ? -24.661 13.029 -19.111 1.00 39.05 ? 533 TYR A CZ 1 ATOM 1754 O OH . TYR A 1 225 ? -23.347 13.439 -19.111 1.00 39.79 ? 533 TYR A OH 1 ATOM 1755 N N . GLU A 1 226 ? -30.649 9.626 -20.662 1.00 41.20 ? 534 GLU A N 1 ATOM 1756 C CA . GLU A 1 226 ? -31.743 8.715 -20.367 1.00 43.63 ? 534 GLU A CA 1 ATOM 1757 C C . GLU A 1 226 ? -31.684 8.367 -18.885 1.00 41.64 ? 534 GLU A C 1 ATOM 1758 O O . GLU A 1 226 ? -30.647 7.931 -18.386 1.00 44.18 ? 534 GLU A O 1 ATOM 1759 C CB . GLU A 1 226 ? -31.644 7.442 -21.212 1.00 48.22 ? 534 GLU A CB 1 ATOM 1760 C CG . GLU A 1 226 ? -31.817 7.666 -22.708 1.00 55.36 ? 534 GLU A CG 1 ATOM 1761 C CD . GLU A 1 226 ? -31.771 6.368 -23.499 1.00 61.06 ? 534 GLU A CD 1 ATOM 1762 O OE1 . GLU A 1 226 ? -31.298 5.350 -22.949 1.00 60.89 ? 534 GLU A OE1 1 ATOM 1763 O OE2 . GLU A 1 226 ? -32.214 6.367 -24.669 1.00 64.81 ? 534 GLU A OE2 1 ATOM 1764 N N . HIS A 1 227 ? -32.793 8.573 -18.182 1.00 37.83 ? 535 HIS A N 1 ATOM 1765 C CA . HIS A 1 227 ? -32.844 8.321 -16.746 1.00 36.74 ? 535 HIS A CA 1 ATOM 1766 C C . HIS A 1 227 ? -33.549 6.999 -16.452 1.00 39.33 ? 535 HIS A C 1 ATOM 1767 O O . HIS A 1 227 ? -34.367 6.538 -17.250 1.00 40.36 ? 535 HIS A O 1 ATOM 1768 C CB . HIS A 1 227 ? -33.559 9.474 -16.030 1.00 34.38 ? 535 HIS A CB 1 ATOM 1769 C CG . HIS A 1 227 ? -32.853 10.789 -16.146 1.00 33.86 ? 535 HIS A CG 1 ATOM 1770 N ND1 . HIS A 1 227 ? -33.523 11.981 -16.322 1.00 36.17 ? 535 HIS A ND1 1 ATOM 1771 C CD2 . HIS A 1 227 ? -31.536 11.101 -16.102 1.00 34.42 ? 535 HIS A CD2 1 ATOM 1772 C CE1 . HIS A 1 227 ? -32.649 12.970 -16.388 1.00 36.41 ? 535 HIS A CE1 1 ATOM 1773 N NE2 . HIS A 1 227 ? -31.436 12.464 -16.253 1.00 35.41 ? 535 HIS A NE2 1 ATOM 1774 N N . PRO A 1 228 ? -33.222 6.372 -15.311 1.00 38.94 ? 536 PRO A N 1 ATOM 1775 C CA . PRO A 1 228 ? -33.955 5.172 -14.894 1.00 40.77 ? 536 PRO A CA 1 ATOM 1776 C C . PRO A 1 228 ? -35.403 5.508 -14.546 1.00 41.88 ? 536 PRO A C 1 ATOM 1777 O O . PRO A 1 228 ? -35.667 6.582 -14.002 1.00 37.90 ? 536 PRO A O 1 ATOM 1778 C CB . PRO A 1 228 ? -33.196 4.710 -13.643 1.00 39.62 ? 536 PRO A CB 1 ATOM 1779 C CG . PRO A 1 228 ? -32.451 5.911 -13.172 1.00 38.48 ? 536 PRO A CG 1 ATOM 1780 C CD . PRO A 1 228 ? -32.101 6.680 -14.407 1.00 38.26 ? 536 PRO A CD 1 ATOM 1781 N N . LYS A 1 229 ? -36.322 4.600 -14.866 1.00 44.18 ? 537 LYS A N 1 ATOM 1782 C CA . LYS A 1 229 ? -37.743 4.800 -14.587 1.00 46.30 ? 537 LYS A CA 1 ATOM 1783 C C . LYS A 1 229 ? -38.218 3.951 -13.412 1.00 43.87 ? 537 LYS A C 1 ATOM 1784 O O . LYS A 1 229 ? -39.380 4.025 -13.010 1.00 44.43 ? 537 LYS A O 1 ATOM 1785 C CB . LYS A 1 229 ? -38.587 4.471 -15.822 1.00 52.12 ? 537 LYS A CB 1 ATOM 1786 C CG . LYS A 1 229 ? -38.668 5.581 -16.854 1.00 55.46 ? 537 LYS A CG 1 ATOM 1787 C CD . LYS A 1 229 ? -39.642 5.202 -17.968 1.00 59.99 ? 537 LYS A CD 1 ATOM 1788 C CE . LYS A 1 229 ? -39.879 6.355 -18.934 1.00 61.61 ? 537 LYS A CE 1 ATOM 1789 N NZ . LYS A 1 229 ? -40.829 5.976 -20.021 1.00 64.45 ? 537 LYS A NZ 1 ATOM 1790 N N . ASP A 1 230 ? -37.317 3.144 -12.866 1.00 41.57 ? 538 ASP A N 1 ATOM 1791 C CA . ASP A 1 230 ? -37.654 2.262 -11.758 1.00 39.68 ? 538 ASP A CA 1 ATOM 1792 C C . ASP A 1 230 ? -36.406 1.887 -10.972 1.00 35.13 ? 538 ASP A C 1 ATOM 1793 O O . ASP A 1 230 ? -35.315 2.381 -11.248 1.00 34.63 ? 538 ASP A O 1 ATOM 1794 C CB . ASP A 1 230 ? -38.355 0.999 -12.273 1.00 45.21 ? 538 ASP A CB 1 ATOM 1795 C CG . ASP A 1 230 ? -37.620 0.357 -13.433 1.00 49.78 ? 538 ASP A CG 1 ATOM 1796 O OD1 . ASP A 1 230 ? -38.143 0.400 -14.567 1.00 56.03 ? 538 ASP A OD1 1 ATOM 1797 O OD2 . ASP A 1 230 ? -36.517 -0.185 -13.216 1.00 48.49 ? 538 ASP A OD2 1 ATOM 1798 N N . LEU A 1 231 ? -36.570 1.007 -9.994 1.00 35.30 ? 539 LEU A N 1 ATOM 1799 C CA . LEU A 1 231 ? -35.453 0.598 -9.151 1.00 36.43 ? 539 LEU A CA 1 ATOM 1800 C C . LEU A 1 231 ? -35.057 -0.851 -9.413 1.00 37.90 ? 539 LEU A C 1 ATOM 1801 O O . LEU A 1 231 ? -34.414 -1.482 -8.575 1.00 38.13 ? 539 LEU A O 1 ATOM 1802 C CB . LEU A 1 231 ? -35.810 0.778 -7.675 1.00 36.12 ? 539 LEU A CB 1 ATOM 1803 C CG . LEU A 1 231 ? -36.424 2.125 -7.296 1.00 36.49 ? 539 LEU A CG 1 ATOM 1804 C CD1 . LEU A 1 231 ? -36.776 2.158 -5.819 1.00 34.74 ? 539 LEU A CD1 1 ATOM 1805 C CD2 . LEU A 1 231 ? -35.481 3.259 -7.654 1.00 34.60 ? 539 LEU A CD2 1 ATOM 1806 N N . LYS A 1 232 ? -35.435 -1.373 -10.577 1.00 40.14 ? 540 LYS A N 1 ATOM 1807 C CA . LYS A 1 232 ? -35.180 -2.775 -10.899 1.00 43.07 ? 540 LYS A CA 1 ATOM 1808 C C . LYS A 1 232 ? -33.696 -3.094 -11.073 1.00 43.30 ? 540 LYS A C 1 ATOM 1809 O O . LYS A 1 232 ? -33.211 -4.110 -10.574 1.00 44.19 ? 540 LYS A O 1 ATOM 1810 C CB . LYS A 1 232 ? -35.960 -3.198 -12.147 1.00 46.11 ? 540 LYS A CB 1 ATOM 1811 C CG . LYS A 1 232 ? -37.466 -3.241 -11.947 1.00 49.52 ? 540 LYS A CG 1 ATOM 1812 C CD . LYS A 1 232 ? -38.172 -3.778 -13.180 1.00 55.82 ? 540 LYS A CD 1 ATOM 1813 C CE . LYS A 1 232 ? -39.669 -3.906 -12.945 1.00 60.02 ? 540 LYS A CE 1 ATOM 1814 N NZ . LYS A 1 232 ? -40.289 -2.597 -12.594 1.00 60.40 ? 540 LYS A NZ 1 ATOM 1815 N N . LEU A 1 233 ? -32.981 -2.227 -11.783 1.00 42.67 ? 541 LEU A N 1 ATOM 1816 C CA . LEU A 1 233 ? -31.562 -2.447 -12.045 1.00 43.12 ? 541 LEU A CA 1 ATOM 1817 C C . LEU A 1 233 ? -30.704 -2.265 -10.797 1.00 40.29 ? 541 LEU A C 1 ATOM 1818 O O . LEU A 1 233 ? -29.570 -2.741 -10.742 1.00 40.61 ? 541 LEU A O 1 ATOM 1819 C CB . LEU A 1 233 ? -31.068 -1.534 -13.169 1.00 45.24 ? 541 LEU A CB 1 ATOM 1820 C CG . LEU A 1 233 ? -31.715 -1.770 -14.536 1.00 49.90 ? 541 LEU A CG 1 ATOM 1821 C CD1 . LEU A 1 233 ? -31.003 -0.971 -15.617 1.00 51.93 ? 541 LEU A CD1 1 ATOM 1822 C CD2 . LEU A 1 233 ? -31.725 -3.252 -14.877 1.00 51.53 ? 541 LEU A CD2 1 ATOM 1823 N N . SER A 1 234 ? -31.246 -1.576 -9.798 1.00 37.45 ? 542 SER A N 1 ATOM 1824 C CA . SER A 1 234 ? -30.534 -1.366 -8.544 1.00 36.95 ? 542 SER A CA 1 ATOM 1825 C C . SER A 1 234 ? -31.066 -2.277 -7.443 1.00 37.25 ? 542 SER A C 1 ATOM 1826 O O . SER A 1 234 ? -30.813 -2.045 -6.261 1.00 34.40 ? 542 SER A O 1 ATOM 1827 C CB . SER A 1 234 ? -30.619 0.102 -8.110 1.00 38.22 ? 542 SER A CB 1 ATOM 1828 O OG . SER A 1 234 ? -31.955 0.572 -8.154 1.00 39.69 ? 542 SER A OG 1 ATOM 1829 N N . ASP A 1 235 ? -31.800 -3.310 -7.851 1.00 41.93 ? 543 ASP A N 1 ATOM 1830 C CA . ASP A 1 235 ? -32.358 -4.305 -6.935 1.00 43.25 ? 543 ASP A CA 1 ATOM 1831 C C . ASP A 1 235 ? -33.259 -3.697 -5.858 1.00 38.65 ? 543 ASP A C 1 ATOM 1832 O O . ASP A 1 235 ? -33.192 -4.082 -4.692 1.00 38.85 ? 543 ASP A O 1 ATOM 1833 C CB . ASP A 1 235 ? -31.247 -5.151 -6.301 1.00 49.01 ? 543 ASP A CB 1 ATOM 1834 C CG . ASP A 1 235 ? -30.558 -6.061 -7.307 1.00 56.39 ? 543 ASP A CG 1 ATOM 1835 O OD1 . ASP A 1 235 ? -31.213 -6.478 -8.287 1.00 58.33 ? 543 ASP A OD1 1 ATOM 1836 O OD2 . ASP A 1 235 ? -29.360 -6.361 -7.117 1.00 58.70 ? 543 ASP A OD2 1 ATOM 1837 N N . GLY A 1 236 ? -34.101 -2.751 -6.262 1.00 33.91 ? 544 GLY A N 1 ATOM 1838 C CA . GLY A 1 236 ? -35.077 -2.156 -5.368 1.00 32.01 ? 544 GLY A CA 1 ATOM 1839 C C . GLY A 1 236 ? -34.538 -0.996 -4.555 1.00 30.59 ? 544 GLY A C 1 ATOM 1840 O O . GLY A 1 236 ? -35.278 -0.365 -3.797 1.00 31.12 ? 544 GLY A O 1 ATOM 1841 N N . ARG A 1 237 ? -33.248 -0.709 -4.713 1.00 27.13 ? 545 ARG A N 1 ATOM 1842 C CA . ARG A 1 237 ? -32.601 0.345 -3.940 1.00 26.68 ? 545 ARG A CA 1 ATOM 1843 C C . ARG A 1 237 ? -32.592 1.673 -4.687 1.00 26.94 ? 545 ARG A C 1 ATOM 1844 O O . ARG A 1 237 ? -32.407 1.713 -5.907 1.00 29.36 ? 545 ARG A O 1 ATOM 1845 C CB . ARG A 1 237 ? -31.168 -0.062 -3.596 1.00 29.70 ? 545 ARG A CB 1 ATOM 1846 C CG . ARG A 1 237 ? -31.063 -1.444 -2.960 1.00 32.29 ? 545 ARG A CG 1 ATOM 1847 C CD . ARG A 1 237 ? -29.630 -1.946 -2.952 1.00 34.31 ? 545 ARG A CD 1 ATOM 1848 N NE . ARG A 1 237 ? -28.785 -1.185 -2.039 1.00 33.28 ? 545 ARG A NE 1 ATOM 1849 C CZ . ARG A 1 237 ? -27.463 -1.316 -1.970 1.00 32.56 ? 545 ARG A CZ 1 ATOM 1850 N NH1 . ARG A 1 237 ? -26.841 -2.175 -2.767 1.00 31.87 ? 545 ARG A NH1 1 ATOM 1851 N NH2 . ARG A 1 237 ? -26.763 -0.588 -1.108 1.00 30.70 ? 545 ARG A NH2 1 ATOM 1852 N N . LEU A 1 238 ? -32.796 2.756 -3.945 1.00 24.70 ? 546 LEU A N 1 ATOM 1853 C CA . LEU A 1 238 ? -32.693 4.101 -4.497 1.00 25.89 ? 546 LEU A CA 1 ATOM 1854 C C . LEU A 1 238 ? -31.230 4.526 -4.472 1.00 25.12 ? 546 LEU A C 1 ATOM 1855 O O . LEU A 1 238 ? -30.564 4.471 -3.434 1.00 25.00 ? 546 LEU A O 1 ATOM 1856 C CB . LEU A 1 238 ? -33.546 5.084 -3.690 1.00 26.48 ? 546 LEU A CB 1 ATOM 1857 C CG . LEU A 1 238 ? -33.888 6.431 -4.338 1.00 28.71 ? 546 LEU A CG 1 ATOM 1858 C CD1 . LEU A 1 238 ? -34.763 6.247 -5.571 1.00 27.27 ? 546 LEU A CD1 1 ATOM 1859 C CD2 . LEU A 1 238 ? -34.577 7.343 -3.330 1.00 28.28 ? 546 LEU A CD2 1 ATOM 1860 N N . ARG A 1 239 ? -30.720 4.926 -5.626 1.00 24.54 ? 547 ARG A N 1 ATOM 1861 C CA . ARG A 1 239 ? -29.328 5.323 -5.731 1.00 23.67 ? 547 ARG A CA 1 ATOM 1862 C C . ARG A 1 239 ? -29.236 6.819 -5.500 1.00 23.15 ? 547 ARG A C 1 ATOM 1863 O O . ARG A 1 239 ? -29.748 7.616 -6.286 1.00 24.28 ? 547 ARG A O 1 ATOM 1864 C CB . ARG A 1 239 ? -28.745 4.915 -7.090 1.00 23.88 ? 547 ARG A CB 1 ATOM 1865 C CG . ARG A 1 239 ? -28.566 3.401 -7.237 1.00 23.49 ? 547 ARG A CG 1 ATOM 1866 C CD . ARG A 1 239 ? -27.902 3.020 -8.553 1.00 26.38 ? 547 ARG A CD 1 ATOM 1867 N NE . ARG A 1 239 ? -27.405 1.645 -8.532 1.00 29.96 ? 547 ARG A NE 1 ATOM 1868 C CZ . ARG A 1 239 ? -27.404 0.829 -9.585 1.00 30.99 ? 547 ARG A CZ 1 ATOM 1869 N NH1 . ARG A 1 239 ? -27.884 1.242 -10.749 1.00 31.04 ? 547 ARG A NH1 1 ATOM 1870 N NH2 . ARG A 1 239 ? -26.926 -0.402 -9.472 1.00 30.12 ? 547 ARG A NH2 1 ATOM 1871 N N . VAL A 1 240 ? -28.601 7.194 -4.397 1.00 21.97 ? 548 VAL A N 1 ATOM 1872 C CA . VAL A 1 240 ? -28.505 8.596 -4.021 1.00 21.95 ? 548 VAL A CA 1 ATOM 1873 C C . VAL A 1 240 ? -27.061 9.058 -4.136 1.00 23.52 ? 548 VAL A C 1 ATOM 1874 O O . VAL A 1 240 ? -26.153 8.423 -3.598 1.00 24.36 ? 548 VAL A O 1 ATOM 1875 C CB . VAL A 1 240 ? -29.026 8.828 -2.588 1.00 22.31 ? 548 VAL A CB 1 ATOM 1876 C CG1 . VAL A 1 240 ? -28.946 10.306 -2.213 1.00 21.65 ? 548 VAL A CG1 1 ATOM 1877 C CG2 . VAL A 1 240 ? -30.461 8.328 -2.468 1.00 23.30 ? 548 VAL A CG2 1 ATOM 1878 N N . GLY A 1 241 ? -26.852 10.150 -4.863 1.00 21.72 ? 549 GLY A N 1 ATOM 1879 C CA . GLY A 1 241 ? -25.523 10.698 -5.037 1.00 22.15 ? 549 GLY A CA 1 ATOM 1880 C C . GLY A 1 241 ? -25.349 12.017 -4.310 1.00 20.40 ? 549 GLY A C 1 ATOM 1881 O O . GLY A 1 241 ? -26.052 12.993 -4.597 1.00 21.22 ? 549 GLY A O 1 ATOM 1882 N N . TYR A 1 242 ? -24.413 12.042 -3.365 1.00 17.12 ? 550 TYR A N 1 ATOM 1883 C CA . TYR A 1 242 ? -24.059 13.265 -2.652 1.00 18.21 ? 550 TYR A CA 1 ATOM 1884 C C . TYR A 1 242 ? -22.831 13.906 -3.295 1.00 22.05 ? 550 TYR A C 1 ATOM 1885 O O . TYR A 1 242 ? -21.753 13.304 -3.325 1.00 19.52 ? 550 TYR A O 1 ATOM 1886 C CB . TYR A 1 242 ? -23.769 12.959 -1.181 1.00 18.92 ? 550 TYR A CB 1 ATOM 1887 C CG . TYR A 1 242 ? -24.983 12.524 -0.388 1.00 18.50 ? 550 TYR A CG 1 ATOM 1888 C CD1 . TYR A 1 242 ? -25.934 13.448 0.020 1.00 18.58 ? 550 TYR A CD1 1 ATOM 1889 C CD2 . TYR A 1 242 ? -25.168 11.192 -0.032 1.00 17.83 ? 550 TYR A CD2 1 ATOM 1890 C CE1 . TYR A 1 242 ? -27.042 13.059 0.747 1.00 16.74 ? 550 TYR A CE1 1 ATOM 1891 C CE2 . TYR A 1 242 ? -26.277 10.792 0.694 1.00 18.39 ? 550 TYR A CE2 1 ATOM 1892 C CZ . TYR A 1 242 ? -27.208 11.733 1.083 1.00 19.28 ? 550 TYR A CZ 1 ATOM 1893 O OH . TYR A 1 242 ? -28.315 11.350 1.805 1.00 19.41 ? 550 TYR A OH 1 ATOM 1894 N N . VAL A 1 243 ? -23.000 15.118 -3.817 1.00 19.90 ? 551 VAL A N 1 ATOM 1895 C CA . VAL A 1 243 ? -21.929 15.822 -4.510 1.00 18.37 ? 551 VAL A CA 1 ATOM 1896 C C . VAL A 1 243 ? -21.435 16.993 -3.663 1.00 19.26 ? 551 VAL A C 1 ATOM 1897 O O . VAL A 1 243 ? -22.184 17.937 -3.398 1.00 17.53 ? 551 VAL A O 1 ATOM 1898 C CB . VAL A 1 243 ? -22.418 16.368 -5.862 1.00 19.39 ? 551 VAL A CB 1 ATOM 1899 C CG1 . VAL A 1 243 ? -21.271 16.997 -6.634 1.00 20.63 ? 551 VAL A CG1 1 ATOM 1900 C CG2 . VAL A 1 243 ? -23.063 15.257 -6.677 1.00 17.17 ? 551 VAL A CG2 1 ATOM 1901 N N . SER A 1 244 ? -20.177 16.938 -3.237 1.00 19.77 ? 552 SER A N 1 ATOM 1902 C CA . SER A 1 244 ? -19.635 17.987 -2.376 1.00 19.79 ? 552 SER A CA 1 ATOM 1903 C C . SER A 1 244 ? -18.143 18.226 -2.579 1.00 20.25 ? 552 SER A C 1 ATOM 1904 O O . SER A 1 244 ? -17.370 17.285 -2.742 1.00 18.17 ? 552 SER A O 1 ATOM 1905 C CB . SER A 1 244 ? -19.887 17.642 -0.910 1.00 20.64 ? 552 SER A CB 1 ATOM 1906 O OG . SER A 1 244 ? -19.373 18.652 -0.053 1.00 20.21 ? 552 SER A OG 1 ATOM 1907 N N . SER A 1 245 ? -17.743 19.494 -2.546 1.00 19.45 ? 553 SER A N 1 ATOM 1908 C CA . SER A 1 245 ? -16.329 19.839 -2.544 1.00 19.62 ? 553 SER A CA 1 ATOM 1909 C C . SER A 1 245 ? -15.778 19.822 -1.121 1.00 20.01 ? 553 SER A C 1 ATOM 1910 O O . SER A 1 245 ? -14.596 20.083 -0.898 1.00 19.20 ? 553 SER A O 1 ATOM 1911 C CB . SER A 1 245 ? -16.114 21.222 -3.167 1.00 20.61 ? 553 SER A CB 1 ATOM 1912 O OG . SER A 1 245 ? -16.721 22.235 -2.379 1.00 22.43 ? 553 SER A OG 1 ATOM 1913 N N . ASP A 1 246 ? -16.636 19.507 -0.156 1.00 18.06 ? 554 ASP A N 1 ATOM 1914 C CA . ASP A 1 246 ? -16.261 19.642 1.246 1.00 18.05 ? 554 ASP A CA 1 ATOM 1915 C C . ASP A 1 246 ? -16.322 18.347 2.050 1.00 18.22 ? 554 ASP A C 1 ATOM 1916 O O . ASP A 1 246 ? -16.672 18.362 3.232 1.00 18.01 ? 554 ASP A O 1 ATOM 1917 C CB . ASP A 1 246 ? -17.117 20.723 1.908 1.00 18.67 ? 554 ASP A CB 1 ATOM 1918 C CG . ASP A 1 246 ? -16.899 22.077 1.280 1.00 22.15 ? 554 ASP A CG 1 ATOM 1919 O OD1 . ASP A 1 246 ? -15.719 22.463 1.117 1.00 22.29 ? 554 ASP A OD1 1 ATOM 1920 O OD2 . ASP A 1 246 ? -17.898 22.737 0.930 1.00 26.29 ? 554 ASP A OD2 1 ATOM 1921 N N . PHE A 1 247 ? -15.978 17.232 1.413 1.00 15.78 ? 555 PHE A N 1 ATOM 1922 C CA . PHE A 1 247 ? -15.776 15.985 2.144 1.00 14.64 ? 555 PHE A CA 1 ATOM 1923 C C . PHE A 1 247 ? -14.356 16.005 2.694 1.00 17.20 ? 555 PHE A C 1 ATOM 1924 O O . PHE A 1 247 ? -13.403 15.640 2.000 1.00 17.65 ? 555 PHE A O 1 ATOM 1925 C CB . PHE A 1 247 ? -15.960 14.771 1.223 1.00 14.91 ? 555 PHE A CB 1 ATOM 1926 C CG . PHE A 1 247 ? -17.381 14.556 0.764 1.00 18.69 ? 555 PHE A CG 1 ATOM 1927 C CD1 . PHE A 1 247 ? -18.439 14.671 1.653 1.00 20.76 ? 555 PHE A CD1 1 ATOM 1928 C CD2 . PHE A 1 247 ? -17.652 14.234 -0.557 1.00 16.95 ? 555 PHE A CD2 1 ATOM 1929 C CE1 . PHE A 1 247 ? -19.740 14.465 1.233 1.00 20.90 ? 555 PHE A CE1 1 ATOM 1930 C CE2 . PHE A 1 247 ? -18.953 14.030 -0.985 1.00 18.68 ? 555 PHE A CE2 1 ATOM 1931 C CZ . PHE A 1 247 ? -19.997 14.144 -0.093 1.00 18.71 ? 555 PHE A CZ 1 ATOM 1932 N N . GLY A 1 248 ? -14.220 16.449 3.938 1.00 18.76 ? 556 GLY A N 1 ATOM 1933 C CA . GLY A 1 248 ? -12.925 16.649 4.561 1.00 13.86 ? 556 GLY A CA 1 ATOM 1934 C C . GLY A 1 248 ? -13.105 17.657 5.679 1.00 15.70 ? 556 GLY A C 1 ATOM 1935 O O . GLY A 1 248 ? -14.209 17.787 6.202 1.00 14.36 ? 556 GLY A O 1 ATOM 1936 N N . ASN A 1 249 ? -12.046 18.373 6.043 1.00 16.63 ? 557 ASN A N 1 ATOM 1937 C CA . ASN A 1 249 ? -12.138 19.336 7.149 1.00 15.94 ? 557 ASN A CA 1 ATOM 1938 C C . ASN A 1 249 ? -12.884 20.599 6.728 1.00 16.17 ? 557 ASN A C 1 ATOM 1939 O O . ASN A 1 249 ? -12.290 21.530 6.181 1.00 16.28 ? 557 ASN A O 1 ATOM 1940 C CB . ASN A 1 249 ? -10.745 19.690 7.681 1.00 18.85 ? 557 ASN A CB 1 ATOM 1941 C CG . ASN A 1 249 ? -10.793 20.518 8.962 1.00 19.34 ? 557 ASN A CG 1 ATOM 1942 O OD1 . ASN A 1 249 ? -11.794 20.525 9.681 1.00 16.12 ? 557 ASN A OD1 1 ATOM 1943 N ND2 . ASN A 1 249 ? -9.698 21.217 9.253 1.00 19.70 ? 557 ASN A ND2 1 ATOM 1944 N N . HIS A 1 250 ? -14.186 20.621 6.995 1.00 14.70 ? 558 HIS A N 1 ATOM 1945 C CA . HIS A 1 250 ? -15.053 21.739 6.627 1.00 15.78 ? 558 HIS A CA 1 ATOM 1946 C C . HIS A 1 250 ? -16.380 21.551 7.355 1.00 14.85 ? 558 HIS A C 1 ATOM 1947 O O . HIS A 1 250 ? -16.795 20.417 7.572 1.00 14.08 ? 558 HIS A O 1 ATOM 1948 C CB . HIS A 1 250 ? -15.276 21.733 5.109 1.00 18.29 ? 558 HIS A CB 1 ATOM 1949 C CG . HIS A 1 250 ? -16.098 22.879 4.604 1.00 16.23 ? 558 HIS A CG 1 ATOM 1950 N ND1 . HIS A 1 250 ? -17.474 22.884 4.645 1.00 14.12 ? 558 HIS A ND1 1 ATOM 1951 C CD2 . HIS A 1 250 ? -15.734 24.053 4.031 1.00 15.43 ? 558 HIS A CD2 1 ATOM 1952 C CE1 . HIS A 1 250 ? -17.924 24.018 4.133 1.00 16.20 ? 558 HIS A CE1 1 ATOM 1953 N NE2 . HIS A 1 250 ? -16.888 24.741 3.746 1.00 15.23 ? 558 HIS A NE2 1 ATOM 1954 N N . PRO A 1 251 ? -17.054 22.658 7.730 1.00 15.05 ? 559 PRO A N 1 ATOM 1955 C CA . PRO A 1 251 ? -18.327 22.574 8.461 1.00 16.05 ? 559 PRO A CA 1 ATOM 1956 C C . PRO A 1 251 ? -19.312 21.555 7.872 1.00 13.76 ? 559 PRO A C 1 ATOM 1957 O O . PRO A 1 251 ? -20.012 20.871 8.617 1.00 13.52 ? 559 PRO A O 1 ATOM 1958 C CB . PRO A 1 251 ? -18.905 23.989 8.336 1.00 17.01 ? 559 PRO A CB 1 ATOM 1959 C CG . PRO A 1 251 ? -17.741 24.882 8.086 1.00 16.10 ? 559 PRO A CG 1 ATOM 1960 C CD . PRO A 1 251 ? -16.583 24.048 7.583 1.00 12.28 ? 559 PRO A CD 1 ATOM 1961 N N . THR A 1 252 ? -19.338 21.426 6.549 1.00 16.30 ? 560 THR A N 1 ATOM 1962 C CA . THR A 1 252 ? -20.267 20.496 5.912 1.00 19.32 ? 560 THR A CA 1 ATOM 1963 C C . THR A 1 252 ? -20.086 19.063 6.419 1.00 18.32 ? 560 THR A C 1 ATOM 1964 O O . THR A 1 252 ? -21.061 18.396 6.773 1.00 16.42 ? 560 THR A O 1 ATOM 1965 C CB . THR A 1 252 ? -20.145 20.532 4.387 1.00 24.07 ? 560 THR A CB 1 ATOM 1966 O OG1 . THR A 1 252 ? -20.568 21.815 3.918 1.00 24.64 ? 560 THR A OG1 1 ATOM 1967 C CG2 . THR A 1 252 ? -21.023 19.470 3.765 1.00 24.70 ? 560 THR A CG2 1 ATOM 1968 N N . SER A 1 253 ? -18.843 18.597 6.472 1.00 16.48 ? 561 SER A N 1 ATOM 1969 C CA . SER A 1 253 ? -18.577 17.269 7.010 1.00 16.49 ? 561 SER A CA 1 ATOM 1970 C C . SER A 1 253 ? -18.771 17.221 8.528 1.00 16.63 ? 561 SER A C 1 ATOM 1971 O O . SER A 1 253 ? -19.174 16.193 9.072 1.00 16.54 ? 561 SER A O 1 ATOM 1972 C CB . SER A 1 253 ? -17.176 16.789 6.628 1.00 16.60 ? 561 SER A CB 1 ATOM 1973 O OG . SER A 1 253 ? -17.079 16.565 5.229 1.00 14.17 ? 561 SER A OG 1 ATOM 1974 N N . HIS A 1 254 ? -18.484 18.330 9.208 1.00 15.56 ? 562 HIS A N 1 ATOM 1975 C CA . HIS A 1 254 ? -18.722 18.420 10.648 1.00 15.27 ? 562 HIS A CA 1 ATOM 1976 C C . HIS A 1 254 ? -20.205 18.250 10.979 1.00 17.38 ? 562 HIS A C 1 ATOM 1977 O O . HIS A 1 254 ? -20.563 17.919 12.108 1.00 18.35 ? 562 HIS A O 1 ATOM 1978 C CB . HIS A 1 254 ? -18.244 19.764 11.210 1.00 13.01 ? 562 HIS A CB 1 ATOM 1979 C CG . HIS A 1 254 ? -16.808 20.069 10.926 1.00 14.88 ? 562 HIS A CG 1 ATOM 1980 N ND1 . HIS A 1 254 ? -16.287 21.341 11.034 1.00 14.46 ? 562 HIS A ND1 1 ATOM 1981 C CD2 . HIS A 1 254 ? -15.786 19.276 10.521 1.00 16.65 ? 562 HIS A CD2 1 ATOM 1982 C CE1 . HIS A 1 254 ? -15.005 21.318 10.714 1.00 12.72 ? 562 HIS A CE1 1 ATOM 1983 N NE2 . HIS A 1 254 ? -14.678 20.078 10.392 1.00 14.67 ? 562 HIS A NE2 1 ATOM 1984 N N . LEU A 1 255 ? -21.069 18.519 10.006 1.00 15.22 ? 563 LEU A N 1 ATOM 1985 C CA . LEU A 1 255 ? -22.497 18.368 10.217 1.00 14.16 ? 563 LEU A CA 1 ATOM 1986 C C . LEU A 1 255 ? -23.003 17.014 9.732 1.00 16.12 ? 563 LEU A C 1 ATOM 1987 O O . LEU A 1 255 ? -23.812 16.382 10.413 1.00 14.70 ? 563 LEU A O 1 ATOM 1988 C CB . LEU A 1 255 ? -23.282 19.488 9.520 1.00 16.76 ? 563 LEU A CB 1 ATOM 1989 C CG . LEU A 1 255 ? -22.996 20.912 10.001 1.00 18.02 ? 563 LEU A CG 1 ATOM 1990 C CD1 . LEU A 1 255 ? -23.924 21.883 9.318 1.00 21.04 ? 563 LEU A CD1 1 ATOM 1991 C CD2 . LEU A 1 255 ? -23.130 21.018 11.507 1.00 17.69 ? 563 LEU A CD2 1 ATOM 1992 N N . MET A 1 256 ? -22.533 16.557 8.569 1.00 14.77 ? 564 MET A N 1 ATOM 1993 C CA . MET A 1 256 ? -23.155 15.373 7.967 1.00 14.13 ? 564 MET A CA 1 ATOM 1994 C C . MET A 1 256 ? -22.295 14.126 7.765 1.00 14.31 ? 564 MET A C 1 ATOM 1995 O O . MET A 1 256 ? -22.733 13.199 7.098 1.00 14.43 ? 564 MET A O 1 ATOM 1996 C CB . MET A 1 256 ? -23.899 15.725 6.660 1.00 13.20 ? 564 MET A CB 1 ATOM 1997 C CG . MET A 1 256 ? -23.062 16.409 5.556 1.00 12.80 ? 564 MET A CG 1 ATOM 1998 S SD . MET A 1 256 ? -21.597 15.495 5.024 1.00 19.23 ? 564 MET A SD 1 ATOM 1999 C CE . MET A 1 256 ? -22.317 14.116 4.126 1.00 20.63 ? 564 MET A CE 1 ATOM 2000 N N . GLN A 1 257 ? -21.100 14.070 8.347 1.00 13.66 ? 565 GLN A N 1 ATOM 2001 C CA . GLN A 1 257 ? -20.205 12.952 8.037 1.00 16.38 ? 565 GLN A CA 1 ATOM 2002 C C . GLN A 1 257 ? -20.773 11.576 8.406 1.00 17.91 ? 565 GLN A C 1 ATOM 2003 O O . GLN A 1 257 ? -20.355 10.569 7.842 1.00 16.41 ? 565 GLN A O 1 ATOM 2004 C CB . GLN A 1 257 ? -18.821 13.136 8.670 1.00 16.66 ? 565 GLN A CB 1 ATOM 2005 C CG . GLN A 1 257 ? -18.828 13.086 10.186 1.00 16.53 ? 565 GLN A CG 1 ATOM 2006 C CD . GLN A 1 257 ? -17.431 13.022 10.770 1.00 18.22 ? 565 GLN A CD 1 ATOM 2007 O OE1 . GLN A 1 257 ? -16.464 12.683 10.075 1.00 15.98 ? 565 GLN A OE1 1 ATOM 2008 N NE2 . GLN A 1 257 ? -17.313 13.356 12.050 1.00 15.95 ? 565 GLN A NE2 1 ATOM 2009 N N . SER A 1 258 ? -21.729 11.523 9.334 1.00 16.41 ? 566 SER A N 1 ATOM 2010 C CA . SER A 1 258 ? -22.268 10.227 9.750 1.00 15.64 ? 566 SER A CA 1 ATOM 2011 C C . SER A 1 258 ? -23.425 9.750 8.871 1.00 16.22 ? 566 SER A C 1 ATOM 2012 O O . SER A 1 258 ? -23.807 8.580 8.919 1.00 16.30 ? 566 SER A O 1 ATOM 2013 C CB . SER A 1 258 ? -22.725 10.263 11.212 1.00 13.87 ? 566 SER A CB 1 ATOM 2014 O OG . SER A 1 258 ? -21.625 10.368 12.104 1.00 15.20 ? 566 SER A OG 1 ATOM 2015 N N . ILE A 1 259 ? -23.992 10.658 8.086 1.00 13.53 ? 567 ILE A N 1 ATOM 2016 C CA . ILE A 1 259 ? -25.204 10.340 7.327 1.00 15.89 ? 567 ILE A CA 1 ATOM 2017 C C . ILE A 1 259 ? -25.064 9.223 6.274 1.00 17.86 ? 567 ILE A C 1 ATOM 2018 O O . ILE A 1 259 ? -25.893 8.315 6.240 1.00 19.86 ? 567 ILE A O 1 ATOM 2019 C CB . ILE A 1 259 ? -25.878 11.605 6.744 1.00 18.65 ? 567 ILE A CB 1 ATOM 2020 C CG1 . ILE A 1 259 ? -26.519 12.411 7.878 1.00 21.19 ? 567 ILE A CG1 1 ATOM 2021 C CG2 . ILE A 1 259 ? -26.931 11.218 5.715 1.00 22.55 ? 567 ILE A CG2 1 ATOM 2022 C CD1 . ILE A 1 259 ? -27.061 13.742 7.441 1.00 22.57 ? 567 ILE A CD1 1 ATOM 2023 N N . PRO A 1 260 ? -24.022 9.275 5.420 1.00 18.95 ? 568 PRO A N 1 ATOM 2024 C CA . PRO A 1 260 ? -23.889 8.192 4.435 1.00 19.74 ? 568 PRO A CA 1 ATOM 2025 C C . PRO A 1 260 ? -23.852 6.792 5.056 1.00 18.07 ? 568 PRO A C 1 ATOM 2026 O O . PRO A 1 260 ? -24.487 5.875 4.534 1.00 21.40 ? 568 PRO A O 1 ATOM 2027 C CB . PRO A 1 260 ? -22.559 8.511 3.752 1.00 20.63 ? 568 PRO A CB 1 ATOM 2028 C CG . PRO A 1 260 ? -22.460 9.998 3.843 1.00 17.20 ? 568 PRO A CG 1 ATOM 2029 C CD . PRO A 1 260 ? -23.010 10.326 5.206 1.00 18.91 ? 568 PRO A CD 1 ATOM 2030 N N . GLY A 1 261 ? -23.139 6.637 6.166 1.00 16.45 ? 569 GLY A N 1 ATOM 2031 C CA . GLY A 1 261 ? -23.043 5.351 6.834 1.00 18.63 ? 569 GLY A CA 1 ATOM 2032 C C . GLY A 1 261 ? -24.319 4.923 7.540 1.00 20.47 ? 569 GLY A C 1 ATOM 2033 O O . GLY A 1 261 ? -24.472 3.757 7.904 1.00 21.31 ? 569 GLY A O 1 ATOM 2034 N N . MET A 1 262 ? -25.234 5.868 7.738 1.00 18.76 ? 570 MET A N 1 ATOM 2035 C CA . MET A 1 262 ? -26.493 5.581 8.421 1.00 18.95 ? 570 MET A CA 1 ATOM 2036 C C . MET A 1 262 ? -27.652 5.253 7.486 1.00 19.00 ? 570 MET A C 1 ATOM 2037 O O . MET A 1 262 ? -28.736 4.873 7.938 1.00 18.22 ? 570 MET A O 1 ATOM 2038 C CB . MET A 1 262 ? -26.873 6.737 9.335 1.00 21.44 ? 570 MET A CB 1 ATOM 2039 C CG . MET A 1 262 ? -25.990 6.815 10.550 1.00 22.55 ? 570 MET A CG 1 ATOM 2040 S SD . MET A 1 262 ? -26.453 8.173 11.613 1.00 23.62 ? 570 MET A SD 1 ATOM 2041 C CE . MET A 1 262 ? -25.440 7.808 13.054 1.00 23.71 ? 570 MET A CE 1 ATOM 2042 N N . HIS A 1 263 ? -27.427 5.391 6.185 1.00 17.42 ? 571 HIS A N 1 ATOM 2043 C CA . HIS A 1 263 ? -28.448 5.000 5.219 1.00 20.54 ? 571 HIS A CA 1 ATOM 2044 C C . HIS A 1 263 ? -28.738 3.501 5.296 1.00 22.81 ? 571 HIS A C 1 ATOM 2045 O O . HIS A 1 263 ? -27.849 2.693 5.565 1.00 23.28 ? 571 HIS A O 1 ATOM 2046 C CB . HIS A 1 263 ? -28.047 5.402 3.797 1.00 21.41 ? 571 HIS A CB 1 ATOM 2047 C CG . HIS A 1 263 ? -28.379 6.823 3.452 1.00 21.93 ? 571 HIS A CG 1 ATOM 2048 N ND1 . HIS A 1 263 ? -29.675 7.276 3.343 1.00 22.81 ? 571 HIS A ND1 1 ATOM 2049 C CD2 . HIS A 1 263 ? -27.585 7.886 3.180 1.00 21.61 ? 571 HIS A CD2 1 ATOM 2050 C CE1 . HIS A 1 263 ? -29.668 8.559 3.024 1.00 22.09 ? 571 HIS A CE1 1 ATOM 2051 N NE2 . HIS A 1 263 ? -28.411 8.954 2.918 1.00 21.63 ? 571 HIS A NE2 1 ATOM 2052 N N . ASN A 1 264 ? -29.996 3.147 5.064 1.00 20.36 ? 572 ASN A N 1 ATOM 2053 C CA . ASN A 1 264 ? -30.446 1.765 5.091 1.00 22.03 ? 572 ASN A CA 1 ATOM 2054 C C . ASN A 1 264 ? -30.045 1.056 3.800 1.00 23.30 ? 572 ASN A C 1 ATOM 2055 O O . ASN A 1 264 ? -30.586 1.350 2.737 1.00 22.81 ? 572 ASN A O 1 ATOM 2056 C CB . ASN A 1 264 ? -31.969 1.744 5.271 1.00 24.38 ? 572 ASN A CB 1 ATOM 2057 C CG . ASN A 1 264 ? -32.558 0.350 5.193 1.00 24.41 ? 572 ASN A CG 1 ATOM 2058 O OD1 . ASN A 1 264 ? -31.842 -0.650 5.254 1.00 25.99 ? 572 ASN A OD1 1 ATOM 2059 N ND2 . ASN A 1 264 ? -33.879 0.280 5.060 1.00 21.22 ? 572 ASN A ND2 1 ATOM 2060 N N . PRO A 1 265 ? -29.100 0.107 3.892 1.00 22.42 ? 573 PRO A N 1 ATOM 2061 C CA . PRO A 1 265 ? -28.583 -0.567 2.691 1.00 23.59 ? 573 PRO A CA 1 ATOM 2062 C C . PRO A 1 265 ? -29.616 -1.420 1.958 1.00 23.37 ? 573 PRO A C 1 ATOM 2063 O O . PRO A 1 265 ? -29.412 -1.732 0.784 1.00 24.22 ? 573 PRO A O 1 ATOM 2064 C CB . PRO A 1 265 ? -27.458 -1.454 3.240 1.00 25.17 ? 573 PRO A CB 1 ATOM 2065 C CG . PRO A 1 265 ? -27.800 -1.653 4.693 1.00 26.50 ? 573 PRO A CG 1 ATOM 2066 C CD . PRO A 1 265 ? -28.450 -0.371 5.126 1.00 21.79 ? 573 PRO A CD 1 ATOM 2067 N N . ASP A 1 266 ? -30.700 -1.797 2.631 1.00 20.92 ? 574 ASP A N 1 ATOM 2068 C CA . ASP A 1 266 ? -31.756 -2.583 1.993 1.00 23.58 ? 574 ASP A CA 1 ATOM 2069 C C . ASP A 1 266 ? -32.559 -1.756 0.982 1.00 25.11 ? 574 ASP A C 1 ATOM 2070 O O . ASP A 1 266 ? -33.172 -2.304 0.059 1.00 24.60 ? 574 ASP A O 1 ATOM 2071 C CB . ASP A 1 266 ? -32.690 -3.179 3.059 1.00 26.97 ? 574 ASP A CB 1 ATOM 2072 C CG . ASP A 1 266 ? -33.757 -4.086 2.469 1.00 30.78 ? 574 ASP A CG 1 ATOM 2073 O OD1 . ASP A 1 266 ? -33.431 -4.905 1.582 1.00 28.07 ? 574 ASP A OD1 1 ATOM 2074 O OD2 . ASP A 1 266 ? -34.927 -3.975 2.895 1.00 31.50 ? 574 ASP A OD2 1 ATOM 2075 N N . LYS A 1 267 ? -32.550 -0.436 1.154 1.00 23.56 ? 575 LYS A N 1 ATOM 2076 C CA . LYS A 1 267 ? -33.387 0.440 0.333 1.00 26.79 ? 575 LYS A CA 1 ATOM 2077 C C . LYS A 1 267 ? -32.600 1.549 -0.358 1.00 26.04 ? 575 LYS A C 1 ATOM 2078 O O . LYS A 1 267 ? -33.118 2.221 -1.252 1.00 26.76 ? 575 LYS A O 1 ATOM 2079 C CB . LYS A 1 267 ? -34.487 1.072 1.190 1.00 27.04 ? 575 LYS A CB 1 ATOM 2080 C CG . LYS A 1 267 ? -35.461 0.081 1.799 1.00 29.75 ? 575 LYS A CG 1 ATOM 2081 C CD . LYS A 1 267 ? -36.288 -0.607 0.734 1.00 33.41 ? 575 LYS A CD 1 ATOM 2082 C CE . LYS A 1 267 ? -37.334 -1.511 1.363 1.00 36.62 ? 575 LYS A CE 1 ATOM 2083 N NZ . LYS A 1 267 ? -38.055 -2.327 0.346 1.00 39.78 ? 575 LYS A NZ 1 ATOM 2084 N N . PHE A 1 268 ? -31.358 1.750 0.066 1.00 22.06 ? 576 PHE A N 1 ATOM 2085 C CA . PHE A 1 268 ? -30.552 2.847 -0.457 1.00 23.76 ? 576 PHE A CA 1 ATOM 2086 C C . PHE A 1 268 ? -29.147 2.401 -0.823 1.00 25.71 ? 576 PHE A C 1 ATOM 2087 O O . PHE A 1 268 ? -28.548 1.572 -0.136 1.00 25.41 ? 576 PHE A O 1 ATOM 2088 C CB . PHE A 1 268 ? -30.526 4.011 0.543 1.00 22.42 ? 576 PHE A CB 1 ATOM 2089 C CG . PHE A 1 268 ? -31.871 4.621 0.757 1.00 21.09 ? 576 PHE A CG 1 ATOM 2090 C CD1 . PHE A 1 268 ? -32.311 5.656 -0.055 1.00 21.77 ? 576 PHE A CD1 1 ATOM 2091 C CD2 . PHE A 1 268 ? -32.727 4.120 1.724 1.00 21.90 ? 576 PHE A CD2 1 ATOM 2092 C CE1 . PHE A 1 268 ? -33.573 6.198 0.113 1.00 23.20 ? 576 PHE A CE1 1 ATOM 2093 C CE2 . PHE A 1 268 ? -33.988 4.655 1.893 1.00 23.36 ? 576 PHE A CE2 1 ATOM 2094 C CZ . PHE A 1 268 ? -34.411 5.699 1.087 1.00 22.25 ? 576 PHE A CZ 1 ATOM 2095 N N . GLU A 1 269 ? -28.641 2.938 -1.927 1.00 22.29 ? 577 GLU A N 1 ATOM 2096 C CA . GLU A 1 269 ? -27.251 2.741 -2.302 1.00 24.59 ? 577 GLU A CA 1 ATOM 2097 C C . GLU A 1 269 ? -26.615 4.118 -2.417 1.00 24.60 ? 577 GLU A C 1 ATOM 2098 O O . GLU A 1 269 ? -27.041 4.941 -3.231 1.00 22.00 ? 577 GLU A O 1 ATOM 2099 C CB . GLU A 1 269 ? -27.142 1.982 -3.624 1.00 27.74 ? 577 GLU A CB 1 ATOM 2100 C CG . GLU A 1 269 ? -25.727 1.529 -3.947 1.00 28.59 ? 577 GLU A CG 1 ATOM 2101 C CD . GLU A 1 269 ? -25.652 0.683 -5.203 1.00 30.90 ? 577 GLU A CD 1 ATOM 2102 O OE1 . GLU A 1 269 ? -26.653 0.627 -5.947 1.00 32.16 ? 577 GLU A OE1 1 ATOM 2103 O OE2 . GLU A 1 269 ? -24.587 0.074 -5.441 1.00 30.29 ? 577 GLU A OE2 1 ATOM 2104 N N . VAL A 1 270 ? -25.601 4.363 -1.593 1.00 22.49 ? 578 VAL A N 1 ATOM 2105 C CA . VAL A 1 270 ? -25.058 5.706 -1.415 1.00 22.03 ? 578 VAL A CA 1 ATOM 2106 C C . VAL A 1 270 ? -23.771 5.915 -2.200 1.00 20.57 ? 578 VAL A C 1 ATOM 2107 O O . VAL A 1 270 ? -22.800 5.178 -2.030 1.00 19.79 ? 578 VAL A O 1 ATOM 2108 C CB . VAL A 1 270 ? -24.786 6.006 0.081 1.00 24.25 ? 578 VAL A CB 1 ATOM 2109 C CG1 . VAL A 1 270 ? -24.232 7.411 0.260 1.00 24.49 ? 578 VAL A CG1 1 ATOM 2110 C CG2 . VAL A 1 270 ? -26.050 5.832 0.887 1.00 22.65 ? 578 VAL A CG2 1 ATOM 2111 N N . PHE A 1 271 ? -23.778 6.928 -3.059 1.00 19.82 ? 579 PHE A N 1 ATOM 2112 C CA . PHE A 1 271 ? -22.611 7.294 -3.837 1.00 19.64 ? 579 PHE A CA 1 ATOM 2113 C C . PHE A 1 271 ? -22.200 8.682 -3.382 1.00 20.58 ? 579 PHE A C 1 ATOM 2114 O O . PHE A 1 271 ? -23.014 9.606 -3.405 1.00 24.83 ? 579 PHE A O 1 ATOM 2115 C CB . PHE A 1 271 ? -22.950 7.355 -5.327 1.00 19.62 ? 579 PHE A CB 1 ATOM 2116 C CG . PHE A 1 271 ? -23.368 6.033 -5.933 1.00 20.94 ? 579 PHE A CG 1 ATOM 2117 C CD1 . PHE A 1 271 ? -22.559 5.400 -6.864 1.00 21.70 ? 579 PHE A CD1 1 ATOM 2118 C CD2 . PHE A 1 271 ? -24.579 5.446 -5.598 1.00 22.02 ? 579 PHE A CD2 1 ATOM 2119 C CE1 . PHE A 1 271 ? -22.943 4.207 -7.444 1.00 23.78 ? 579 PHE A CE1 1 ATOM 2120 C CE2 . PHE A 1 271 ? -24.969 4.241 -6.171 1.00 22.44 ? 579 PHE A CE2 1 ATOM 2121 C CZ . PHE A 1 271 ? -24.148 3.624 -7.095 1.00 23.52 ? 579 PHE A CZ 1 ATOM 2122 N N . CYS A 1 272 ? -20.952 8.842 -2.961 1.00 17.58 ? 580 CYS A N 1 ATOM 2123 C CA . CYS A 1 272 ? -20.452 10.179 -2.652 1.00 17.47 ? 580 CYS A CA 1 ATOM 2124 C C . CYS A 1 272 ? -19.493 10.628 -3.747 1.00 20.94 ? 580 CYS A C 1 ATOM 2125 O O . CYS A 1 272 ? -18.544 9.916 -4.082 1.00 22.53 ? 580 CYS A O 1 ATOM 2126 C CB . CYS A 1 272 ? -19.772 10.220 -1.283 1.00 18.75 ? 580 CYS A CB 1 ATOM 2127 S SG . CYS A 1 272 ? -20.908 10.025 0.120 1.00 22.20 ? 580 CYS A SG 1 ATOM 2128 N N . TYR A 1 273 ? -19.771 11.795 -4.321 1.00 21.42 ? 581 TYR A N 1 ATOM 2129 C CA . TYR A 1 273 ? -18.950 12.357 -5.390 1.00 21.76 ? 581 TYR A CA 1 ATOM 2130 C C . TYR A 1 273 ? -18.161 13.543 -4.863 1.00 22.65 ? 581 TYR A C 1 ATOM 2131 O O . TYR A 1 273 ? -18.713 14.621 -4.646 1.00 22.44 ? 581 TYR A O 1 ATOM 2132 C CB . TYR A 1 273 ? -19.825 12.780 -6.569 1.00 21.24 ? 581 TYR A CB 1 ATOM 2133 C CG . TYR A 1 273 ? -20.512 11.610 -7.230 1.00 22.54 ? 581 TYR A CG 1 ATOM 2134 C CD1 . TYR A 1 273 ? -19.858 10.857 -8.197 1.00 24.47 ? 581 TYR A CD1 1 ATOM 2135 C CD2 . TYR A 1 273 ? -21.805 11.243 -6.874 1.00 21.49 ? 581 TYR A CD2 1 ATOM 2136 C CE1 . TYR A 1 273 ? -20.473 9.777 -8.801 1.00 25.34 ? 581 TYR A CE1 1 ATOM 2137 C CE2 . TYR A 1 273 ? -22.432 10.162 -7.475 1.00 22.69 ? 581 TYR A CE2 1 ATOM 2138 C CZ . TYR A 1 273 ? -21.757 9.434 -8.437 1.00 23.88 ? 581 TYR A CZ 1 ATOM 2139 O OH . TYR A 1 273 ? -22.361 8.356 -9.040 1.00 25.60 ? 581 TYR A OH 1 ATOM 2140 N N . ALA A 1 274 ? -16.868 13.330 -4.640 1.00 22.65 ? 582 ALA A N 1 ATOM 2141 C CA . ALA A 1 274 ? -16.011 14.355 -4.064 1.00 21.95 ? 582 ALA A CA 1 ATOM 2142 C C . ALA A 1 274 ? -15.514 15.303 -5.146 1.00 23.16 ? 582 ALA A C 1 ATOM 2143 O O . ALA A 1 274 ? -14.992 14.865 -6.167 1.00 23.21 ? 582 ALA A O 1 ATOM 2144 C CB . ALA A 1 274 ? -14.832 13.712 -3.344 1.00 20.51 ? 582 ALA A CB 1 ATOM 2145 N N . LEU A 1 275 ? -15.672 16.604 -4.920 1.00 19.49 ? 583 LEU A N 1 ATOM 2146 C CA . LEU A 1 275 ? -15.172 17.589 -5.874 1.00 19.90 ? 583 LEU A CA 1 ATOM 2147 C C . LEU A 1 275 ? -13.786 18.092 -5.476 1.00 23.23 ? 583 LEU A C 1 ATOM 2148 O O . LEU A 1 275 ? -13.178 18.899 -6.186 1.00 29.60 ? 583 LEU A O 1 ATOM 2149 C CB . LEU A 1 275 ? -16.145 18.763 -6.000 1.00 19.74 ? 583 LEU A CB 1 ATOM 2150 C CG . LEU A 1 275 ? -17.567 18.385 -6.414 1.00 22.75 ? 583 LEU A CG 1 ATOM 2151 C CD1 . LEU A 1 275 ? -18.419 19.630 -6.638 1.00 22.88 ? 583 LEU A CD1 1 ATOM 2152 C CD2 . LEU A 1 275 ? -17.548 17.507 -7.663 1.00 23.10 ? 583 LEU A CD2 1 ATOM 2153 N N . SER A 1 276 ? -13.286 17.607 -4.346 1.00 18.45 ? 584 SER A N 1 ATOM 2154 C CA . SER A 1 276 ? -11.981 18.019 -3.847 1.00 22.16 ? 584 SER A CA 1 ATOM 2155 C C . SER A 1 276 ? -11.104 16.796 -3.632 1.00 23.00 ? 584 SER A C 1 ATOM 2156 O O . SER A 1 276 ? -11.616 15.701 -3.384 1.00 22.19 ? 584 SER A O 1 ATOM 2157 C CB . SER A 1 276 ? -12.137 18.793 -2.531 1.00 23.64 ? 584 SER A CB 1 ATOM 2158 O OG . SER A 1 276 ? -12.614 17.948 -1.496 1.00 26.95 ? 584 SER A OG 1 ATOM 2159 N N . PRO A 1 277 ? -9.778 16.968 -3.739 1.00 26.51 ? 585 PRO A N 1 ATOM 2160 C CA . PRO A 1 277 ? -8.867 15.865 -3.419 1.00 27.39 ? 585 PRO A CA 1 ATOM 2161 C C . PRO A 1 277 ? -8.879 15.553 -1.923 1.00 23.82 ? 585 PRO A C 1 ATOM 2162 O O . PRO A 1 277 ? -9.323 16.376 -1.124 1.00 21.74 ? 585 PRO A O 1 ATOM 2163 C CB . PRO A 1 277 ? -7.498 16.414 -3.834 1.00 32.10 ? 585 PRO A CB 1 ATOM 2164 C CG . PRO A 1 277 ? -7.639 17.888 -3.716 1.00 33.96 ? 585 PRO A CG 1 ATOM 2165 C CD . PRO A 1 277 ? -9.053 18.191 -4.124 1.00 29.77 ? 585 PRO A CD 1 ATOM 2166 N N . ASP A 1 278 ? -8.402 14.363 -1.569 1.00 23.76 ? 586 ASP A N 1 ATOM 2167 C CA . ASP A 1 278 ? -8.314 13.904 -0.186 1.00 24.51 ? 586 ASP A CA 1 ATOM 2168 C C . ASP A 1 278 ? -7.411 14.837 0.611 1.00 23.19 ? 586 ASP A C 1 ATOM 2169 O O . ASP A 1 278 ? -6.247 15.014 0.259 1.00 22.98 ? 586 ASP A O 1 ATOM 2170 C CB . ASP A 1 278 ? -7.725 12.485 -0.175 1.00 27.82 ? 586 ASP A CB 1 ATOM 2171 C CG . ASP A 1 278 ? -7.753 11.835 1.202 1.00 29.09 ? 586 ASP A CG 1 ATOM 2172 O OD1 . ASP A 1 278 ? -7.901 12.547 2.221 1.00 26.14 ? 586 ASP A OD1 1 ATOM 2173 O OD2 . ASP A 1 278 ? -7.616 10.595 1.260 1.00 31.34 ? 586 ASP A OD2 1 ATOM 2174 N N . ASP A 1 279 ? -7.936 15.422 1.688 1.00 21.60 ? 587 ASP A N 1 ATOM 2175 C CA . ASP A 1 279 ? -7.137 16.350 2.494 1.00 21.55 ? 587 ASP A CA 1 ATOM 2176 C C . ASP A 1 279 ? -6.403 15.675 3.654 1.00 23.15 ? 587 ASP A C 1 ATOM 2177 O O . ASP A 1 279 ? -5.758 16.349 4.458 1.00 23.75 ? 587 ASP A O 1 ATOM 2178 C CB . ASP A 1 279 ? -7.960 17.568 2.979 1.00 20.70 ? 587 ASP A CB 1 ATOM 2179 C CG . ASP A 1 279 ? -9.047 17.202 3.985 1.00 22.11 ? 587 ASP A CG 1 ATOM 2180 O OD1 . ASP A 1 279 ? -9.135 16.027 4.396 1.00 20.99 ? 587 ASP A OD1 1 ATOM 2181 O OD2 . ASP A 1 279 ? -9.809 18.113 4.388 1.00 20.08 ? 587 ASP A OD2 1 ATOM 2182 N N . GLY A 1 280 ? -6.510 14.348 3.728 1.00 21.58 ? 588 GLY A N 1 ATOM 2183 C CA . GLY A 1 280 ? -5.823 13.566 4.741 1.00 23.27 ? 588 GLY A CA 1 ATOM 2184 C C . GLY A 1 280 ? -6.504 13.504 6.106 1.00 22.60 ? 588 GLY A C 1 ATOM 2185 O O . GLY A 1 280 ? -5.962 12.910 7.035 1.00 22.65 ? 588 GLY A O 1 ATOM 2186 N N . THR A 1 281 ? -7.685 14.100 6.240 1.00 19.82 ? 589 THR A N 1 ATOM 2187 C CA . THR A 1 281 ? -8.344 14.149 7.544 1.00 19.63 ? 589 THR A CA 1 ATOM 2188 C C . THR A 1 281 ? -9.277 12.966 7.786 1.00 19.40 ? 589 THR A C 1 ATOM 2189 O O . THR A 1 281 ? -9.659 12.258 6.851 1.00 18.79 ? 589 THR A O 1 ATOM 2190 C CB . THR A 1 281 ? -9.152 15.444 7.730 1.00 18.81 ? 589 THR A CB 1 ATOM 2191 O OG1 . THR A 1 281 ? -10.252 15.448 6.811 1.00 17.81 ? 589 THR A OG1 1 ATOM 2192 C CG2 . THR A 1 281 ? -8.271 16.664 7.498 1.00 19.48 ? 589 THR A CG2 1 ATOM 2193 N N . ASN A 1 282 ? -9.646 12.763 9.049 1.00 18.85 ? 590 ASN A N 1 ATOM 2194 C CA . ASN A 1 282 ? -10.533 11.661 9.415 1.00 17.79 ? 590 ASN A CA 1 ATOM 2195 C C . ASN A 1 282 ? -11.946 11.837 8.871 1.00 16.91 ? 590 ASN A C 1 ATOM 2196 O O . ASN A 1 282 ? -12.671 10.857 8.691 1.00 18.26 ? 590 ASN A O 1 ATOM 2197 C CB . ASN A 1 282 ? -10.568 11.461 10.928 1.00 17.00 ? 590 ASN A CB 1 ATOM 2198 C CG . ASN A 1 282 ? -9.292 10.839 11.462 1.00 20.82 ? 590 ASN A CG 1 ATOM 2199 O OD1 . ASN A 1 282 ? -8.437 10.402 10.693 1.00 22.76 ? 590 ASN A OD1 1 ATOM 2200 N ND2 . ASN A 1 282 ? -9.169 10.777 12.781 1.00 19.20 ? 590 ASN A ND2 1 ATOM 2201 N N . PHE A 1 283 ? -12.336 13.083 8.616 1.00 15.49 ? 591 PHE A N 1 ATOM 2202 C CA . PHE A 1 283 ? -13.654 13.355 8.048 1.00 15.55 ? 591 PHE A CA 1 ATOM 2203 C C . PHE A 1 283 ? -13.776 12.721 6.668 1.00 17.73 ? 591 PHE A C 1 ATOM 2204 O O . PHE A 1 283 ? -14.787 12.096 6.342 1.00 16.31 ? 591 PHE A O 1 ATOM 2205 C CB . PHE A 1 283 ? -13.904 14.864 7.956 1.00 15.41 ? 591 PHE A CB 1 ATOM 2206 C CG . PHE A 1 283 ? -13.676 15.591 9.255 1.00 16.33 ? 591 PHE A CG 1 ATOM 2207 C CD1 . PHE A 1 283 ? -14.521 15.390 10.333 1.00 16.39 ? 591 PHE A CD1 1 ATOM 2208 C CD2 . PHE A 1 283 ? -12.602 16.453 9.402 1.00 16.88 ? 591 PHE A CD2 1 ATOM 2209 C CE1 . PHE A 1 283 ? -14.304 16.051 11.534 1.00 15.72 ? 591 PHE A CE1 1 ATOM 2210 C CE2 . PHE A 1 283 ? -12.380 17.115 10.592 1.00 17.23 ? 591 PHE A CE2 1 ATOM 2211 C CZ . PHE A 1 283 ? -13.230 16.913 11.663 1.00 14.99 ? 591 PHE A CZ 1 ATOM 2212 N N . ARG A 1 284 ? -12.737 12.891 5.860 1.00 16.59 ? 592 ARG A N 1 ATOM 2213 C CA . ARG A 1 284 ? -12.707 12.286 4.540 1.00 17.90 ? 592 ARG A CA 1 ATOM 2214 C C . ARG A 1 284 ? -12.619 10.765 4.674 1.00 17.15 ? 592 ARG A C 1 ATOM 2215 O O . ARG A 1 284 ? -13.285 10.035 3.946 1.00 18.38 ? 592 ARG A O 1 ATOM 2216 C CB . ARG A 1 284 ? -11.526 12.839 3.736 1.00 20.45 ? 592 ARG A CB 1 ATOM 2217 C CG . ARG A 1 284 ? -11.293 12.189 2.374 1.00 20.00 ? 592 ARG A CG 1 ATOM 2218 C CD . ARG A 1 284 ? -12.353 12.587 1.356 1.00 20.62 ? 592 ARG A CD 1 ATOM 2219 N NE . ARG A 1 284 ? -11.892 12.384 -0.022 1.00 20.87 ? 592 ARG A NE 1 ATOM 2220 C CZ . ARG A 1 284 ? -11.896 13.328 -0.961 1.00 20.94 ? 592 ARG A CZ 1 ATOM 2221 N NH1 . ARG A 1 284 ? -12.350 14.548 -0.685 1.00 20.66 ? 592 ARG A NH1 1 ATOM 2222 N NH2 . ARG A 1 284 ? -11.465 13.051 -2.184 1.00 20.39 ? 592 ARG A NH2 1 ATOM 2223 N N . VAL A 1 285 ? -11.798 10.295 5.609 1.00 15.55 ? 593 VAL A N 1 ATOM 2224 C CA . VAL A 1 285 ? -11.655 8.859 5.839 1.00 17.55 ? 593 VAL A CA 1 ATOM 2225 C C . VAL A 1 285 ? -13.008 8.202 6.107 1.00 17.20 ? 593 VAL A C 1 ATOM 2226 O O . VAL A 1 285 ? -13.335 7.159 5.524 1.00 16.86 ? 593 VAL A O 1 ATOM 2227 C CB . VAL A 1 285 ? -10.710 8.556 7.021 1.00 19.50 ? 593 VAL A CB 1 ATOM 2228 C CG1 . VAL A 1 285 ? -10.729 7.066 7.346 1.00 22.91 ? 593 VAL A CG1 1 ATOM 2229 C CG2 . VAL A 1 285 ? -9.298 9.020 6.705 1.00 21.14 ? 593 VAL A CG2 1 ATOM 2230 N N . LYS A 1 286 ? -13.798 8.828 6.976 1.00 16.04 ? 594 LYS A N 1 ATOM 2231 C CA . LYS A 1 286 ? -15.069 8.252 7.395 1.00 15.42 ? 594 LYS A CA 1 ATOM 2232 C C . LYS A 1 286 ? -16.057 8.134 6.240 1.00 14.75 ? 594 LYS A C 1 ATOM 2233 O O . LYS A 1 286 ? -16.673 7.090 6.056 1.00 17.30 ? 594 LYS A O 1 ATOM 2234 C CB . LYS A 1 286 ? -15.696 9.084 8.518 1.00 16.99 ? 594 LYS A CB 1 ATOM 2235 C CG . LYS A 1 286 ? -16.951 8.467 9.113 1.00 17.50 ? 594 LYS A CG 1 ATOM 2236 C CD . LYS A 1 286 ? -17.594 9.403 10.129 1.00 20.10 ? 594 LYS A CD 1 ATOM 2237 C CE . LYS A 1 286 ? -18.823 8.766 10.768 1.00 21.80 ? 594 LYS A CE 1 ATOM 2238 N NZ . LYS A 1 286 ? -18.451 7.604 11.633 1.00 22.27 ? 594 LYS A NZ 1 ATOM 2239 N N . VAL A 1 287 ? -16.221 9.205 5.470 1.00 13.77 ? 595 VAL A N 1 ATOM 2240 C CA . VAL A 1 287 ? -17.161 9.173 4.352 1.00 15.36 ? 595 VAL A CA 1 ATOM 2241 C C . VAL A 1 287 ? -16.729 8.155 3.290 1.00 17.87 ? 595 VAL A C 1 ATOM 2242 O O . VAL A 1 287 ? -17.548 7.385 2.776 1.00 19.11 ? 595 VAL A O 1 ATOM 2243 C CB . VAL A 1 287 ? -17.359 10.571 3.733 1.00 19.07 ? 595 VAL A CB 1 ATOM 2244 C CG1 . VAL A 1 287 ? -18.251 10.488 2.501 1.00 21.39 ? 595 VAL A CG1 1 ATOM 2245 C CG2 . VAL A 1 287 ? -17.963 11.515 4.763 1.00 21.97 ? 595 VAL A CG2 1 ATOM 2246 N N . MET A 1 288 ? -15.437 8.124 2.983 1.00 20.23 ? 596 MET A N 1 ATOM 2247 C CA . MET A 1 288 ? -14.918 7.125 2.053 1.00 20.29 ? 596 MET A CA 1 ATOM 2248 C C . MET A 1 288 ? -15.143 5.692 2.548 1.00 20.89 ? 596 MET A C 1 ATOM 2249 O O . MET A 1 288 ? -15.369 4.783 1.751 1.00 22.09 ? 596 MET A O 1 ATOM 2250 C CB . MET A 1 288 ? -13.436 7.367 1.774 1.00 22.38 ? 596 MET A CB 1 ATOM 2251 C CG . MET A 1 288 ? -13.162 8.695 1.084 1.00 23.24 ? 596 MET A CG 1 ATOM 2252 S SD . MET A 1 288 ? -11.423 8.933 0.681 1.00 26.12 ? 596 MET A SD 1 ATOM 2253 C CE . MET A 1 288 ? -11.163 7.601 -0.487 1.00 39.39 ? 596 MET A CE 1 ATOM 2254 N N . ALA A 1 289 ? -15.089 5.494 3.861 1.00 19.94 ? 597 ALA A N 1 ATOM 2255 C CA . ALA A 1 289 ? -15.234 4.153 4.431 1.00 20.98 ? 597 ALA A CA 1 ATOM 2256 C C . ALA A 1 289 ? -16.686 3.687 4.558 1.00 20.81 ? 597 ALA A C 1 ATOM 2257 O O . ALA A 1 289 ? -16.963 2.483 4.529 1.00 21.74 ? 597 ALA A O 1 ATOM 2258 C CB . ALA A 1 289 ? -14.537 4.069 5.794 1.00 21.87 ? 597 ALA A CB 1 ATOM 2259 N N . GLU A 1 290 ? -17.610 4.630 4.703 1.00 17.42 ? 598 GLU A N 1 ATOM 2260 C CA . GLU A 1 290 ? -18.987 4.277 5.042 1.00 17.97 ? 598 GLU A CA 1 ATOM 2261 C C . GLU A 1 290 ? -19.981 4.419 3.886 1.00 21.41 ? 598 GLU A C 1 ATOM 2262 O O . GLU A 1 290 ? -21.033 3.779 3.886 1.00 21.02 ? 598 GLU A O 1 ATOM 2263 C CB . GLU A 1 290 ? -19.443 5.061 6.271 1.00 18.00 ? 598 GLU A CB 1 ATOM 2264 C CG . GLU A 1 290 ? -18.559 4.792 7.481 1.00 20.07 ? 598 GLU A CG 1 ATOM 2265 C CD . GLU A 1 290 ? -19.101 5.397 8.767 1.00 21.30 ? 598 GLU A CD 1 ATOM 2266 O OE1 . GLU A 1 290 ? -20.121 6.120 8.721 1.00 19.88 ? 598 GLU A OE1 1 ATOM 2267 O OE2 . GLU A 1 290 ? -18.499 5.145 9.829 1.00 20.91 ? 598 GLU A OE2 1 ATOM 2268 N N . ALA A 1 291 ? -19.647 5.236 2.892 1.00 19.14 ? 599 ALA A N 1 ATOM 2269 C CA . ALA A 1 291 ? -20.464 5.282 1.684 1.00 21.48 ? 599 ALA A CA 1 ATOM 2270 C C . ALA A 1 291 ? -20.330 3.954 0.945 1.00 22.60 ? 599 ALA A C 1 ATOM 2271 O O . ALA A 1 291 ? -19.299 3.278 1.050 1.00 22.76 ? 599 ALA A O 1 ATOM 2272 C CB . ALA A 1 291 ? -20.038 6.433 0.791 1.00 21.20 ? 599 ALA A CB 1 ATOM 2273 N N . ASN A 1 292 ? -21.366 3.565 0.206 1.00 22.73 ? 600 ASN A N 1 ATOM 2274 C CA . ASN A 1 292 ? -21.279 2.346 -0.594 1.00 23.44 ? 600 ASN A CA 1 ATOM 2275 C C . ASN A 1 292 ? -20.267 2.530 -1.717 1.00 24.52 ? 600 ASN A C 1 ATOM 2276 O O . ASN A 1 292 ? -19.549 1.599 -2.086 1.00 24.65 ? 600 ASN A O 1 ATOM 2277 C CB . ASN A 1 292 ? -22.647 1.949 -1.162 1.00 27.30 ? 600 ASN A CB 1 ATOM 2278 C CG . ASN A 1 292 ? -23.686 1.713 -0.075 1.00 29.72 ? 600 ASN A CG 1 ATOM 2279 O OD1 . ASN A 1 292 ? -24.681 2.427 0.007 1.00 27.92 ? 600 ASN A OD1 1 ATOM 2280 N ND2 . ASN A 1 292 ? -23.453 0.709 0.767 1.00 33.03 ? 600 ASN A ND2 1 ATOM 2281 N N . HIS A 1 293 ? -20.210 3.744 -2.254 1.00 23.12 ? 601 HIS A N 1 ATOM 2282 C CA . HIS A 1 293 ? -19.242 4.077 -3.293 1.00 26.48 ? 601 HIS A CA 1 ATOM 2283 C C . HIS A 1 293 ? -18.722 5.489 -3.086 1.00 25.26 ? 601 HIS A C 1 ATOM 2284 O O . HIS A 1 293 ? -19.478 6.390 -2.725 1.00 23.30 ? 601 HIS A O 1 ATOM 2285 C CB . HIS A 1 293 ? -19.875 3.954 -4.680 1.00 28.16 ? 601 HIS A CB 1 ATOM 2286 C CG . HIS A 1 293 ? -20.561 2.646 -4.913 1.00 29.34 ? 601 HIS A CG 1 ATOM 2287 N ND1 . HIS A 1 293 ? -19.880 1.496 -5.249 1.00 31.12 ? 601 HIS A ND1 1 ATOM 2288 C CD2 . HIS A 1 293 ? -21.869 2.303 -4.844 1.00 30.98 ? 601 HIS A CD2 1 ATOM 2289 C CE1 . HIS A 1 293 ? -20.739 0.502 -5.383 1.00 33.34 ? 601 HIS A CE1 1 ATOM 2290 N NE2 . HIS A 1 293 ? -21.953 0.965 -5.141 1.00 32.82 ? 601 HIS A NE2 1 ATOM 2291 N N . PHE A 1 294 ? -17.427 5.678 -3.308 1.00 24.88 ? 602 PHE A N 1 ATOM 2292 C CA . PHE A 1 294 ? -16.825 7.001 -3.213 1.00 24.54 ? 602 PHE A CA 1 ATOM 2293 C C . PHE A 1 294 ? -16.023 7.302 -4.472 1.00 24.85 ? 602 PHE A C 1 ATOM 2294 O O . PHE A 1 294 ? -15.081 6.578 -4.816 1.00 25.19 ? 602 PHE A O 1 ATOM 2295 C CB . PHE A 1 294 ? -15.934 7.115 -1.975 1.00 23.47 ? 602 PHE A CB 1 ATOM 2296 C CG . PHE A 1 294 ? -15.554 8.533 -1.634 1.00 21.83 ? 602 PHE A CG 1 ATOM 2297 C CD1 . PHE A 1 294 ? -16.262 9.240 -0.681 1.00 23.46 ? 602 PHE A CD1 1 ATOM 2298 C CD2 . PHE A 1 294 ? -14.496 9.160 -2.279 1.00 24.95 ? 602 PHE A CD2 1 ATOM 2299 C CE1 . PHE A 1 294 ? -15.921 10.550 -0.364 1.00 22.84 ? 602 PHE A CE1 1 ATOM 2300 C CE2 . PHE A 1 294 ? -14.151 10.468 -1.968 1.00 23.61 ? 602 PHE A CE2 1 ATOM 2301 C CZ . PHE A 1 294 ? -14.867 11.160 -1.007 1.00 23.60 ? 602 PHE A CZ 1 ATOM 2302 N N . ILE A 1 295 ? -16.404 8.377 -5.154 1.00 24.30 ? 603 ILE A N 1 ATOM 2303 C CA . ILE A 1 295 ? -15.822 8.721 -6.446 1.00 24.32 ? 603 ILE A CA 1 ATOM 2304 C C . ILE A 1 295 ? -15.137 10.074 -6.356 1.00 25.32 ? 603 ILE A C 1 ATOM 2305 O O . ILE A 1 295 ? -15.763 11.071 -5.997 1.00 22.55 ? 603 ILE A O 1 ATOM 2306 C CB . ILE A 1 295 ? -16.896 8.791 -7.558 1.00 25.59 ? 603 ILE A CB 1 ATOM 2307 C CG1 . ILE A 1 295 ? -17.649 7.463 -7.683 1.00 25.82 ? 603 ILE A CG1 1 ATOM 2308 C CG2 . ILE A 1 295 ? -16.262 9.175 -8.891 1.00 25.72 ? 603 ILE A CG2 1 ATOM 2309 C CD1 . ILE A 1 295 ? -18.863 7.350 -6.764 1.00 27.31 ? 603 ILE A CD1 1 ATOM 2310 N N . ASP A 1 296 ? -13.849 10.109 -6.676 1.00 28.90 ? 604 ASP A N 1 ATOM 2311 C CA . ASP A 1 296 ? -13.093 11.354 -6.628 1.00 28.38 ? 604 ASP A CA 1 ATOM 2312 C C . ASP A 1 296 ? -13.179 12.072 -7.975 1.00 28.08 ? 604 ASP A C 1 ATOM 2313 O O . ASP A 1 296 ? -12.418 11.778 -8.899 1.00 30.57 ? 604 ASP A O 1 ATOM 2314 C CB . ASP A 1 296 ? -11.641 11.071 -6.230 1.00 30.49 ? 604 ASP A CB 1 ATOM 2315 C CG . ASP A 1 296 ? -10.816 12.340 -6.055 1.00 34.46 ? 604 ASP A CG 1 ATOM 2316 O OD1 . ASP A 1 296 ? -11.361 13.451 -6.233 1.00 30.37 ? 604 ASP A OD1 1 ATOM 2317 O OD2 . ASP A 1 296 ? -9.614 12.219 -5.730 1.00 37.82 ? 604 ASP A OD2 1 ATOM 2318 N N . LEU A 1 297 ? -14.114 13.012 -8.082 1.00 25.94 ? 605 LEU A N 1 ATOM 2319 C CA . LEU A 1 297 ? -14.321 13.743 -9.330 1.00 25.50 ? 605 LEU A CA 1 ATOM 2320 C C . LEU A 1 297 ? -13.310 14.871 -9.518 1.00 27.15 ? 605 LEU A C 1 ATOM 2321 O O . LEU A 1 297 ? -13.246 15.487 -10.588 1.00 29.09 ? 605 LEU A O 1 ATOM 2322 C CB . LEU A 1 297 ? -15.749 14.293 -9.410 1.00 26.44 ? 605 LEU A CB 1 ATOM 2323 C CG . LEU A 1 297 ? -16.854 13.254 -9.611 1.00 25.60 ? 605 LEU A CG 1 ATOM 2324 C CD1 . LEU A 1 297 ? -18.207 13.944 -9.804 1.00 25.36 ? 605 LEU A CD1 1 ATOM 2325 C CD2 . LEU A 1 297 ? -16.528 12.355 -10.791 1.00 25.88 ? 605 LEU A CD2 1 ATOM 2326 N N . SER A 1 298 ? -12.517 15.143 -8.487 1.00 27.26 ? 606 SER A N 1 ATOM 2327 C CA . SER A 1 298 ? -11.464 16.144 -8.613 1.00 30.99 ? 606 SER A CA 1 ATOM 2328 C C . SER A 1 298 ? -10.420 15.663 -9.622 1.00 33.29 ? 606 SER A C 1 ATOM 2329 O O . SER A 1 298 ? -9.682 16.463 -10.187 1.00 32.44 ? 606 SER A O 1 ATOM 2330 C CB . SER A 1 298 ? -10.814 16.453 -7.259 1.00 30.41 ? 606 SER A CB 1 ATOM 2331 O OG . SER A 1 298 ? -9.990 15.391 -6.813 1.00 33.27 ? 606 SER A OG 1 ATOM 2332 N N . GLN A 1 299 ? -10.382 14.351 -9.850 1.00 33.12 ? 607 GLN A N 1 ATOM 2333 C CA . GLN A 1 299 ? -9.485 13.756 -10.844 1.00 36.97 ? 607 GLN A CA 1 ATOM 2334 C C . GLN A 1 299 ? -10.084 13.785 -12.247 1.00 36.30 ? 607 GLN A C 1 ATOM 2335 O O . GLN A 1 299 ? -9.466 13.317 -13.207 1.00 34.84 ? 607 GLN A O 1 ATOM 2336 C CB . GLN A 1 299 ? -9.152 12.307 -10.471 1.00 38.03 ? 607 GLN A CB 1 ATOM 2337 C CG . GLN A 1 299 ? -8.599 12.140 -9.072 1.00 40.74 ? 607 GLN A CG 1 ATOM 2338 C CD . GLN A 1 299 ? -7.449 13.085 -8.790 1.00 45.56 ? 607 GLN A CD 1 ATOM 2339 O OE1 . GLN A 1 299 ? -7.479 13.846 -7.820 1.00 47.94 ? 607 GLN A OE1 1 ATOM 2340 N NE2 . GLN A 1 299 ? -6.428 13.045 -9.639 1.00 45.60 ? 607 GLN A NE2 1 ATOM 2341 N N . ILE A 1 300 ? -11.299 14.312 -12.357 1.00 34.52 ? 608 ILE A N 1 ATOM 2342 C CA . ILE A 1 300 ? -11.990 14.389 -13.638 1.00 36.95 ? 608 ILE A CA 1 ATOM 2343 C C . ILE A 1 300 ? -12.437 15.826 -13.893 1.00 37.46 ? 608 ILE A C 1 ATOM 2344 O O . ILE A 1 300 ? -13.586 16.176 -13.635 1.00 35.47 ? 608 ILE A O 1 ATOM 2345 C CB . ILE A 1 300 ? -13.214 13.441 -13.675 1.00 35.02 ? 608 ILE A CB 1 ATOM 2346 C CG1 . ILE A 1 300 ? -12.819 12.033 -13.224 1.00 37.45 ? 608 ILE A CG1 1 ATOM 2347 C CG2 . ILE A 1 300 ? -13.832 13.409 -15.067 1.00 32.23 ? 608 ILE A CG2 1 ATOM 2348 C CD1 . ILE A 1 300 ? -13.962 11.038 -13.236 1.00 37.70 ? 608 ILE A CD1 1 ATOM 2349 N N . PRO A 1 301 ? -11.515 16.667 -14.392 1.00 42.34 ? 609 PRO A N 1 ATOM 2350 C CA . PRO A 1 301 ? -11.744 18.103 -14.608 1.00 43.89 ? 609 PRO A CA 1 ATOM 2351 C C . PRO A 1 301 ? -12.920 18.397 -15.538 1.00 45.55 ? 609 PRO A C 1 ATOM 2352 O O . PRO A 1 301 ? -13.659 19.356 -15.306 1.00 46.43 ? 609 PRO A O 1 ATOM 2353 C CB . PRO A 1 301 ? -10.440 18.570 -15.263 1.00 48.39 ? 609 PRO A CB 1 ATOM 2354 C CG . PRO A 1 301 ? -9.419 17.575 -14.836 1.00 49.48 ? 609 PRO A CG 1 ATOM 2355 C CD . PRO A 1 301 ? -10.143 16.268 -14.749 1.00 47.18 ? 609 PRO A CD 1 ATOM 2356 N N . CYS A 1 302 ? -13.084 17.588 -16.580 1.00 43.89 ? 610 CYS A N 1 ATOM 2357 C CA . CYS A 1 302 ? -14.150 17.810 -17.551 1.00 43.67 ? 610 CYS A CA 1 ATOM 2358 C C . CYS A 1 302 ? -15.531 17.519 -16.967 1.00 41.97 ? 610 CYS A C 1 ATOM 2359 O O . CYS A 1 302 ? -15.807 16.404 -16.527 1.00 41.07 ? 610 CYS A O 1 ATOM 2360 C CB . CYS A 1 302 ? -13.929 16.962 -18.805 1.00 44.62 ? 610 CYS A CB 1 ATOM 2361 S SG . CYS A 1 302 ? -15.266 17.110 -20.002 1.00 46.51 ? 610 CYS A SG 1 ATOM 2362 N N . ASN A 1 303 ? -16.396 18.528 -16.971 1.00 40.03 ? 611 ASN A N 1 ATOM 2363 C CA . ASN A 1 303 ? -17.748 18.373 -16.439 1.00 35.72 ? 611 ASN A CA 1 ATOM 2364 C C . ASN A 1 303 ? -18.612 17.406 -17.248 1.00 34.47 ? 611 ASN A C 1 ATOM 2365 O O . ASN A 1 303 ? -19.527 16.783 -16.711 1.00 33.82 ? 611 ASN A O 1 ATOM 2366 C CB . ASN A 1 303 ? -18.431 19.734 -16.305 1.00 35.04 ? 611 ASN A CB 1 ATOM 2367 C CG . ASN A 1 303 ? -17.813 20.582 -15.215 1.00 34.92 ? 611 ASN A CG 1 ATOM 2368 O OD1 . ASN A 1 303 ? -17.496 20.083 -14.134 1.00 37.35 ? 611 ASN A OD1 1 ATOM 2369 N ND2 . ASN A 1 303 ? -17.627 21.865 -15.493 1.00 35.38 ? 611 ASN A ND2 1 ATOM 2370 N N . GLY A 1 304 ? -18.314 17.280 -18.537 1.00 33.49 ? 612 GLY A N 1 ATOM 2371 C CA . GLY A 1 304 ? -18.989 16.311 -19.383 1.00 36.29 ? 612 GLY A CA 1 ATOM 2372 C C . GLY A 1 304 ? -18.629 14.882 -19.016 1.00 35.36 ? 612 GLY A C 1 ATOM 2373 O O . GLY A 1 304 ? -19.501 14.021 -18.883 1.00 35.11 ? 612 GLY A O 1 ATOM 2374 N N . LYS A 1 305 ? -17.338 14.624 -18.846 1.00 36.08 ? 613 LYS A N 1 ATOM 2375 C CA . LYS A 1 305 ? -16.879 13.302 -18.435 1.00 37.19 ? 613 LYS A CA 1 ATOM 2376 C C . LYS A 1 305 ? -17.328 12.961 -17.015 1.00 33.29 ? 613 LYS A C 1 ATOM 2377 O O . LYS A 1 305 ? -17.710 11.825 -16.729 1.00 33.87 ? 613 LYS A O 1 ATOM 2378 C CB . LYS A 1 305 ? -15.359 13.199 -18.559 1.00 42.06 ? 613 LYS A CB 1 ATOM 2379 C CG . LYS A 1 305 ? -14.852 13.416 -19.981 1.00 48.13 ? 613 LYS A CG 1 ATOM 2380 C CD . LYS A 1 305 ? -13.344 13.270 -20.074 1.00 51.74 ? 613 LYS A CD 1 ATOM 2381 C CE . LYS A 1 305 ? -12.859 13.530 -21.493 1.00 57.17 ? 613 LYS A CE 1 ATOM 2382 N NZ . LYS A 1 305 ? -11.387 13.341 -21.619 1.00 59.95 ? 613 LYS A NZ 1 ATOM 2383 N N . ALA A 1 306 ? -17.284 13.946 -16.124 1.00 29.41 ? 614 ALA A N 1 ATOM 2384 C CA . ALA A 1 306 ? -17.726 13.733 -14.753 1.00 27.18 ? 614 ALA A CA 1 ATOM 2385 C C . ALA A 1 306 ? -19.226 13.445 -14.690 1.00 28.65 ? 614 ALA A C 1 ATOM 2386 O O . ALA A 1 306 ? -19.659 12.542 -13.973 1.00 30.18 ? 614 ALA A O 1 ATOM 2387 C CB . ALA A 1 306 ? -17.357 14.921 -13.877 1.00 26.18 ? 614 ALA A CB 1 ATOM 2388 N N . ALA A 1 307 ? -20.016 14.200 -15.447 1.00 31.61 ? 615 ALA A N 1 ATOM 2389 C CA . ALA A 1 307 ? -21.453 13.945 -15.523 1.00 32.41 ? 615 ALA A CA 1 ATOM 2390 C C . ALA A 1 307 ? -21.745 12.572 -16.126 1.00 32.93 ? 615 ALA A C 1 ATOM 2391 O O . ALA A 1 307 ? -22.676 11.887 -15.697 1.00 31.73 ? 615 ALA A O 1 ATOM 2392 C CB . ALA A 1 307 ? -22.157 15.031 -16.310 1.00 33.95 ? 615 ALA A CB 1 ATOM 2393 N N . ASP A 1 308 ? -20.953 12.169 -17.118 1.00 33.62 ? 616 ASP A N 1 ATOM 2394 C CA . ASP A 1 308 ? -21.099 10.833 -17.690 1.00 33.02 ? 616 ASP A CA 1 ATOM 2395 C C . ASP A 1 308 ? -20.906 9.776 -16.612 1.00 31.23 ? 616 ASP A C 1 ATOM 2396 O O . ASP A 1 308 ? -21.628 8.780 -16.570 1.00 32.98 ? 616 ASP A O 1 ATOM 2397 C CB . ASP A 1 308 ? -20.111 10.601 -18.837 1.00 35.49 ? 616 ASP A CB 1 ATOM 2398 C CG . ASP A 1 308 ? -20.494 11.351 -20.096 1.00 39.18 ? 616 ASP A CG 1 ATOM 2399 O OD1 . ASP A 1 308 ? -19.651 11.457 -21.011 1.00 39.75 ? 616 ASP A OD1 1 ATOM 2400 O OD2 . ASP A 1 308 ? -21.640 11.841 -20.168 1.00 40.88 ? 616 ASP A OD2 1 ATOM 2401 N N . ARG A 1 309 ? -19.935 10.013 -15.735 1.00 30.24 ? 617 ARG A N 1 ATOM 2402 C CA . ARG A 1 309 ? -19.623 9.082 -14.654 1.00 33.34 ? 617 ARG A CA 1 ATOM 2403 C C . ARG A 1 309 ? -20.784 8.940 -13.673 1.00 32.67 ? 617 ARG A C 1 ATOM 2404 O O . ARG A 1 309 ? -21.114 7.834 -13.236 1.00 32.06 ? 617 ARG A O 1 ATOM 2405 C CB . ARG A 1 309 ? -18.365 9.538 -13.916 1.00 34.68 ? 617 ARG A CB 1 ATOM 2406 C CG . ARG A 1 309 ? -17.972 8.646 -12.762 1.00 36.74 ? 617 ARG A CG 1 ATOM 2407 C CD . ARG A 1 309 ? -17.603 7.247 -13.236 1.00 41.15 ? 617 ARG A CD 1 ATOM 2408 N NE . ARG A 1 309 ? -17.134 6.440 -12.117 1.00 43.44 ? 617 ARG A NE 1 ATOM 2409 C CZ . ARG A 1 309 ? -15.884 6.453 -11.669 1.00 42.59 ? 617 ARG A CZ 1 ATOM 2410 N NH1 . ARG A 1 309 ? -15.542 5.692 -10.639 1.00 43.08 ? 617 ARG A NH1 1 ATOM 2411 N NH2 . ARG A 1 309 ? -14.978 7.225 -12.257 1.00 39.72 ? 617 ARG A NH2 1 ATOM 2412 N N . ILE A 1 310 ? -21.402 10.065 -13.328 1.00 30.19 ? 618 ILE A N 1 ATOM 2413 C CA . ILE A 1 310 ? -22.568 10.052 -12.455 1.00 26.75 ? 618 ILE A CA 1 ATOM 2414 C C . ILE A 1 310 ? -23.725 9.280 -13.077 1.00 28.63 ? 618 ILE A C 1 ATOM 2415 O O . ILE A 1 310 ? -24.365 8.459 -12.417 1.00 30.84 ? 618 ILE A O 1 ATOM 2416 C CB . ILE A 1 310 ? -23.029 11.481 -12.119 1.00 25.75 ? 618 ILE A CB 1 ATOM 2417 C CG1 . ILE A 1 310 ? -21.969 12.185 -11.265 1.00 27.25 ? 618 ILE A CG1 1 ATOM 2418 C CG2 . ILE A 1 310 ? -24.374 11.455 -11.406 1.00 23.19 ? 618 ILE A CG2 1 ATOM 2419 C CD1 . ILE A 1 310 ? -22.237 13.660 -11.046 1.00 28.66 ? 618 ILE A CD1 1 ATOM 2420 N N . HIS A 1 311 ? -23.983 9.535 -14.355 1.00 30.14 ? 619 HIS A N 1 ATOM 2421 C CA . HIS A 1 311 ? -25.081 8.879 -15.053 1.00 32.48 ? 619 HIS A CA 1 ATOM 2422 C C . HIS A 1 311 ? -24.839 7.381 -15.206 1.00 35.17 ? 619 HIS A C 1 ATOM 2423 O O . HIS A 1 311 ? -25.772 6.582 -15.125 1.00 34.41 ? 619 HIS A O 1 ATOM 2424 C CB . HIS A 1 311 ? -25.298 9.513 -16.426 1.00 34.19 ? 619 HIS A CB 1 ATOM 2425 C CG . HIS A 1 311 ? -26.340 8.822 -17.245 1.00 37.15 ? 619 HIS A CG 1 ATOM 2426 N ND1 . HIS A 1 311 ? -26.028 7.926 -18.246 1.00 40.19 ? 619 HIS A ND1 1 ATOM 2427 C CD2 . HIS A 1 311 ? -27.691 8.888 -17.207 1.00 38.69 ? 619 HIS A CD2 1 ATOM 2428 C CE1 . HIS A 1 311 ? -27.142 7.475 -18.793 1.00 41.30 ? 619 HIS A CE1 1 ATOM 2429 N NE2 . HIS A 1 311 ? -28.166 8.042 -18.180 1.00 40.35 ? 619 HIS A NE2 1 ATOM 2430 N N . GLN A 1 312 ? -23.584 7.011 -15.435 1.00 37.96 ? 620 GLN A N 1 ATOM 2431 C CA . GLN A 1 312 ? -23.201 5.606 -15.530 1.00 41.15 ? 620 GLN A CA 1 ATOM 2432 C C . GLN A 1 312 ? -23.569 4.854 -14.248 1.00 36.82 ? 620 GLN A C 1 ATOM 2433 O O . GLN A 1 312 ? -23.994 3.697 -14.290 1.00 32.39 ? 620 GLN A O 1 ATOM 2434 C CB . GLN A 1 312 ? -21.701 5.487 -15.801 1.00 45.67 ? 620 GLN A CB 1 ATOM 2435 C CG . GLN A 1 312 ? -21.156 4.080 -15.654 1.00 52.50 ? 620 GLN A CG 1 ATOM 2436 C CD . GLN A 1 312 ? -19.645 4.037 -15.674 1.00 56.15 ? 620 GLN A CD 1 ATOM 2437 O OE1 . GLN A 1 312 ? -19.023 4.256 -16.711 1.00 60.78 ? 620 GLN A OE1 1 ATOM 2438 N NE2 . GLN A 1 312 ? -19.044 3.752 -14.524 1.00 53.36 ? 620 GLN A NE2 1 ATOM 2439 N N . ASP A 1 313 ? -23.425 5.526 -13.112 1.00 33.92 ? 621 ASP A N 1 ATOM 2440 C CA . ASP A 1 313 ? -23.739 4.913 -11.827 1.00 32.43 ? 621 ASP A CA 1 ATOM 2441 C C . ASP A 1 313 ? -25.236 4.715 -11.615 1.00 30.52 ? 621 ASP A C 1 ATOM 2442 O O . ASP A 1 313 ? -25.645 4.000 -10.702 1.00 32.52 ? 621 ASP A O 1 ATOM 2443 C CB . ASP A 1 313 ? -23.134 5.721 -10.677 1.00 31.35 ? 621 ASP A CB 1 ATOM 2444 C CG . ASP A 1 313 ? -21.625 5.598 -10.617 1.00 34.38 ? 621 ASP A CG 1 ATOM 2445 O OD1 . ASP A 1 313 ? -21.089 4.607 -11.160 1.00 35.79 ? 621 ASP A OD1 1 ATOM 2446 O OD2 . ASP A 1 313 ? -20.975 6.488 -10.031 1.00 35.18 ? 621 ASP A OD2 1 ATOM 2447 N N . GLY A 1 314 ? -26.048 5.348 -12.457 1.00 28.30 ? 622 GLY A N 1 ATOM 2448 C CA . GLY A 1 314 ? -27.485 5.152 -12.417 1.00 28.46 ? 622 GLY A CA 1 ATOM 2449 C C . GLY A 1 314 ? -28.163 5.886 -11.275 1.00 29.27 ? 622 GLY A C 1 ATOM 2450 O O . GLY A 1 314 ? -29.171 5.421 -10.740 1.00 28.73 ? 622 GLY A O 1 ATOM 2451 N N . ILE A 1 315 ? -27.609 7.038 -10.907 1.00 22.56 ? 623 ILE A N 1 ATOM 2452 C CA . ILE A 1 315 ? -28.131 7.836 -9.802 1.00 21.28 ? 623 ILE A CA 1 ATOM 2453 C C . ILE A 1 315 ? -29.580 8.270 -10.032 1.00 26.58 ? 623 ILE A C 1 ATOM 2454 O O . ILE A 1 315 ? -29.919 8.798 -11.091 1.00 25.24 ? 623 ILE A O 1 ATOM 2455 C CB . ILE A 1 315 ? -27.266 9.090 -9.568 1.00 23.91 ? 623 ILE A CB 1 ATOM 2456 C CG1 . ILE A 1 315 ? -25.812 8.692 -9.311 1.00 24.99 ? 623 ILE A CG1 1 ATOM 2457 C CG2 . ILE A 1 315 ? -27.808 9.914 -8.399 1.00 25.94 ? 623 ILE A CG2 1 ATOM 2458 C CD1 . ILE A 1 315 ? -25.632 7.778 -8.113 1.00 26.41 ? 623 ILE A CD1 1 ATOM 2459 N N . HIS A 1 316 ? -30.427 8.037 -9.033 1.00 26.19 ? 624 HIS A N 1 ATOM 2460 C CA . HIS A 1 316 ? -31.823 8.453 -9.088 1.00 27.83 ? 624 HIS A CA 1 ATOM 2461 C C . HIS A 1 316 ? -31.989 9.866 -8.541 1.00 26.16 ? 624 HIS A C 1 ATOM 2462 O O . HIS A 1 316 ? -32.688 10.695 -9.124 1.00 26.86 ? 624 HIS A O 1 ATOM 2463 C CB . HIS A 1 316 ? -32.692 7.495 -8.274 1.00 27.96 ? 624 HIS A CB 1 ATOM 2464 C CG . HIS A 1 316 ? -32.697 6.094 -8.797 1.00 28.42 ? 624 HIS A CG 1 ATOM 2465 N ND1 . HIS A 1 316 ? -31.889 5.104 -8.280 1.00 27.92 ? 624 HIS A ND1 1 ATOM 2466 C CD2 . HIS A 1 316 ? -33.408 5.518 -9.793 1.00 30.77 ? 624 HIS A CD2 1 ATOM 2467 C CE1 . HIS A 1 316 ? -32.104 3.977 -8.934 1.00 28.43 ? 624 HIS A CE1 1 ATOM 2468 N NE2 . HIS A 1 316 ? -33.019 4.202 -9.860 1.00 30.97 ? 624 HIS A NE2 1 ATOM 2469 N N . ILE A 1 317 ? -31.356 10.128 -7.405 1.00 25.03 ? 625 ILE A N 1 ATOM 2470 C CA . ILE A 1 317 ? -31.421 11.445 -6.784 1.00 25.41 ? 625 ILE A CA 1 ATOM 2471 C C . ILE A 1 317 ? -30.015 11.988 -6.575 1.00 25.02 ? 625 ILE A C 1 ATOM 2472 O O . ILE A 1 317 ? -29.227 11.407 -5.828 1.00 22.07 ? 625 ILE A O 1 ATOM 2473 C CB . ILE A 1 317 ? -32.158 11.392 -5.431 1.00 28.04 ? 625 ILE A CB 1 ATOM 2474 C CG1 . ILE A 1 317 ? -33.615 10.969 -5.634 1.00 29.80 ? 625 ILE A CG1 1 ATOM 2475 C CG2 . ILE A 1 317 ? -32.075 12.740 -4.719 1.00 26.93 ? 625 ILE A CG2 1 ATOM 2476 C CD1 . ILE A 1 317 ? -34.401 10.869 -4.341 1.00 30.19 ? 625 ILE A CD1 1 ATOM 2477 N N . LEU A 1 318 ? -29.698 13.090 -7.250 1.00 23.81 ? 626 LEU A N 1 ATOM 2478 C CA . LEU A 1 318 ? -28.382 13.706 -7.118 1.00 21.38 ? 626 LEU A CA 1 ATOM 2479 C C . LEU A 1 318 ? -28.483 14.926 -6.216 1.00 20.54 ? 626 LEU A C 1 ATOM 2480 O O . LEU A 1 318 ? -29.302 15.813 -6.447 1.00 22.42 ? 626 LEU A O 1 ATOM 2481 C CB . LEU A 1 318 ? -27.836 14.118 -8.486 1.00 21.73 ? 626 LEU A CB 1 ATOM 2482 C CG . LEU A 1 318 ? -26.343 14.439 -8.551 1.00 22.40 ? 626 LEU A CG 1 ATOM 2483 C CD1 . LEU A 1 318 ? -25.511 13.191 -8.292 1.00 18.56 ? 626 LEU A CD1 1 ATOM 2484 C CD2 . LEU A 1 318 ? -26.003 15.023 -9.906 1.00 25.28 ? 626 LEU A CD2 1 ATOM 2485 N N . VAL A 1 319 ? -27.635 14.976 -5.199 1.00 18.09 ? 627 VAL A N 1 ATOM 2486 C CA . VAL A 1 319 ? -27.765 15.995 -4.166 1.00 18.49 ? 627 VAL A CA 1 ATOM 2487 C C . VAL A 1 319 ? -26.662 17.049 -4.222 1.00 20.89 ? 627 VAL A C 1 ATOM 2488 O O . VAL A 1 319 ? -25.484 16.744 -4.033 1.00 21.58 ? 627 VAL A O 1 ATOM 2489 C CB . VAL A 1 319 ? -27.813 15.354 -2.772 1.00 20.14 ? 627 VAL A CB 1 ATOM 2490 C CG1 . VAL A 1 319 ? -27.919 16.423 -1.688 1.00 19.55 ? 627 VAL A CG1 1 ATOM 2491 C CG2 . VAL A 1 319 ? -28.989 14.391 -2.692 1.00 18.72 ? 627 VAL A CG2 1 ATOM 2492 N N . ASN A 1 320 ? -27.070 18.288 -4.479 1.00 19.30 ? 628 ASN A N 1 ATOM 2493 C CA . ASN A 1 320 ? -26.162 19.426 -4.536 1.00 19.83 ? 628 ASN A CA 1 ATOM 2494 C C . ASN A 1 320 ? -25.887 20.004 -3.152 1.00 18.85 ? 628 ASN A C 1 ATOM 2495 O O . ASN A 1 320 ? -26.732 20.686 -2.579 1.00 18.35 ? 628 ASN A O 1 ATOM 2496 C CB . ASN A 1 320 ? -26.742 20.502 -5.464 1.00 23.19 ? 628 ASN A CB 1 ATOM 2497 C CG . ASN A 1 320 ? -25.737 21.593 -5.805 1.00 24.10 ? 628 ASN A CG 1 ATOM 2498 O OD1 . ASN A 1 320 ? -24.793 21.843 -5.056 1.00 22.27 ? 628 ASN A OD1 1 ATOM 2499 N ND2 . ASN A 1 320 ? -25.949 22.258 -6.937 1.00 22.04 ? 628 ASN A ND2 1 ATOM 2500 N N . MET A 1 321 ? -24.694 19.736 -2.624 1.00 19.00 ? 629 MET A N 1 ATOM 2501 C CA . MET A 1 321 ? -24.325 20.218 -1.296 1.00 17.29 ? 629 MET A CA 1 ATOM 2502 C C . MET A 1 321 ? -23.493 21.503 -1.318 1.00 18.48 ? 629 MET A C 1 ATOM 2503 O O . MET A 1 321 ? -23.019 21.949 -0.275 1.00 20.80 ? 629 MET A O 1 ATOM 2504 C CB . MET A 1 321 ? -23.565 19.127 -0.527 1.00 16.37 ? 629 MET A CB 1 ATOM 2505 C CG . MET A 1 321 ? -24.366 17.846 -0.340 1.00 17.81 ? 629 MET A CG 1 ATOM 2506 S SD . MET A 1 321 ? -23.371 16.480 0.301 1.00 21.57 ? 629 MET A SD 1 ATOM 2507 C CE . MET A 1 321 ? -22.794 17.185 1.835 1.00 20.10 ? 629 MET A CE 1 ATOM 2508 N N . ASN A 1 322 ? -23.306 22.096 -2.492 1.00 17.26 ? 630 ASN A N 1 ATOM 2509 C CA . ASN A 1 322 ? -22.500 23.314 -2.592 1.00 19.23 ? 630 ASN A CA 1 ATOM 2510 C C . ASN A 1 322 ? -23.273 24.586 -2.925 1.00 19.78 ? 630 ASN A C 1 ATOM 2511 O O . ASN A 1 322 ? -23.057 25.629 -2.306 1.00 18.98 ? 630 ASN A O 1 ATOM 2512 C CB . ASN A 1 322 ? -21.364 23.141 -3.605 1.00 21.38 ? 630 ASN A CB 1 ATOM 2513 C CG . ASN A 1 322 ? -20.155 22.452 -3.008 1.00 25.06 ? 630 ASN A CG 1 ATOM 2514 O OD1 . ASN A 1 322 ? -19.926 21.272 -3.246 1.00 21.61 ? 630 ASN A OD1 1 ATOM 2515 N ND2 . ASN A 1 322 ? -19.380 23.189 -2.216 1.00 27.40 ? 630 ASN A ND2 1 ATOM 2516 N N . GLY A 1 323 ? -24.163 24.510 -3.909 1.00 20.15 ? 631 GLY A N 1 ATOM 2517 C CA . GLY A 1 323 ? -24.780 25.725 -4.415 1.00 19.81 ? 631 GLY A CA 1 ATOM 2518 C C . GLY A 1 323 ? -23.679 26.675 -4.859 1.00 22.36 ? 631 GLY A C 1 ATOM 2519 O O . GLY A 1 323 ? -22.699 26.244 -5.464 1.00 23.60 ? 631 GLY A O 1 ATOM 2520 N N . TYR A 1 324 ? -23.805 27.963 -4.548 1.00 18.56 ? 632 TYR A N 1 ATOM 2521 C CA . TYR A 1 324 ? -22.783 28.905 -5.003 1.00 21.44 ? 632 TYR A CA 1 ATOM 2522 C C . TYR A 1 324 ? -21.697 29.129 -3.950 1.00 22.99 ? 632 TYR A C 1 ATOM 2523 O O . TYR A 1 324 ? -21.490 30.242 -3.472 1.00 22.83 ? 632 TYR A O 1 ATOM 2524 C CB . TYR A 1 324 ? -23.425 30.204 -5.498 1.00 22.92 ? 632 TYR A CB 1 ATOM 2525 C CG . TYR A 1 324 ? -24.457 29.910 -6.562 1.00 22.84 ? 632 TYR A CG 1 ATOM 2526 C CD1 . TYR A 1 324 ? -24.088 29.287 -7.749 1.00 21.41 ? 632 TYR A CD1 1 ATOM 2527 C CD2 . TYR A 1 324 ? -25.797 30.213 -6.369 1.00 23.32 ? 632 TYR A CD2 1 ATOM 2528 C CE1 . TYR A 1 324 ? -25.019 28.992 -8.724 1.00 22.76 ? 632 TYR A CE1 1 ATOM 2529 C CE2 . TYR A 1 324 ? -26.742 29.921 -7.349 1.00 22.99 ? 632 TYR A CE2 1 ATOM 2530 C CZ . TYR A 1 324 ? -26.341 29.310 -8.520 1.00 23.56 ? 632 TYR A CZ 1 ATOM 2531 O OH . TYR A 1 324 ? -27.262 29.009 -9.494 1.00 24.52 ? 632 TYR A OH 1 ATOM 2532 N N . THR A 1 325 ? -21.015 28.042 -3.597 1.00 24.21 ? 633 THR A N 1 ATOM 2533 C CA . THR A 1 325 ? -19.919 28.082 -2.636 1.00 19.82 ? 633 THR A CA 1 ATOM 2534 C C . THR A 1 325 ? -18.646 27.492 -3.244 1.00 22.13 ? 633 THR A C 1 ATOM 2535 O O . THR A 1 325 ? -18.686 26.821 -4.281 1.00 22.78 ? 633 THR A O 1 ATOM 2536 C CB . THR A 1 325 ? -20.266 27.320 -1.338 1.00 23.91 ? 633 THR A CB 1 ATOM 2537 O OG1 . THR A 1 325 ? -20.667 25.981 -1.657 1.00 22.68 ? 633 THR A OG1 1 ATOM 2538 C CG2 . THR A 1 325 ? -21.389 28.026 -0.572 1.00 24.42 ? 633 THR A CG2 1 ATOM 2539 N N . LYS A 1 326 ? -17.519 27.749 -2.587 1.00 23.58 ? 634 LYS A N 1 ATOM 2540 C CA . LYS A 1 326 ? -16.203 27.411 -3.119 1.00 23.98 ? 634 LYS A CA 1 ATOM 2541 C C . LYS A 1 326 ? -16.082 25.935 -3.486 1.00 22.41 ? 634 LYS A C 1 ATOM 2542 O O . LYS A 1 326 ? -16.455 25.058 -2.706 1.00 20.01 ? 634 LYS A O 1 ATOM 2543 C CB . LYS A 1 326 ? -15.121 27.801 -2.107 1.00 25.48 ? 634 LYS A CB 1 ATOM 2544 C CG . LYS A 1 326 ? -13.686 27.546 -2.555 1.00 29.95 ? 634 LYS A CG 1 ATOM 2545 C CD . LYS A 1 326 ? -12.734 27.742 -1.378 1.00 35.53 ? 634 LYS A CD 1 ATOM 2546 C CE . LYS A 1 326 ? -11.306 27.351 -1.723 1.00 39.86 ? 634 LYS A CE 1 ATOM 2547 N NZ . LYS A 1 326 ? -10.682 28.349 -2.627 1.00 44.63 ? 634 LYS A NZ 1 ATOM 2548 N N . GLY A 1 327 ? -15.564 25.671 -4.682 1.00 25.07 ? 635 GLY A N 1 ATOM 2549 C CA . GLY A 1 327 ? -15.356 24.306 -5.140 1.00 25.02 ? 635 GLY A CA 1 ATOM 2550 C C . GLY A 1 327 ? -16.544 23.726 -5.886 1.00 24.61 ? 635 GLY A C 1 ATOM 2551 O O . GLY A 1 327 ? -16.464 22.623 -6.422 1.00 23.94 ? 635 GLY A O 1 ATOM 2552 N N . ALA A 1 328 ? -17.648 24.465 -5.924 1.00 23.31 ? 636 ALA A N 1 ATOM 2553 C CA . ALA A 1 328 ? -18.843 24.003 -6.627 1.00 23.69 ? 636 ALA A CA 1 ATOM 2554 C C . ALA A 1 328 ? -18.560 23.698 -8.088 1.00 23.00 ? 636 ALA A C 1 ATOM 2555 O O . ALA A 1 328 ? -17.763 24.379 -8.736 1.00 24.87 ? 636 ALA A O 1 ATOM 2556 C CB . ALA A 1 328 ? -19.956 25.031 -6.536 1.00 21.54 ? 636 ALA A CB 1 ATOM 2557 N N . ARG A 1 329 ? -19.227 22.670 -8.596 1.00 21.30 ? 637 ARG A N 1 ATOM 2558 C CA . ARG A 1 329 ? -19.230 22.387 -10.020 1.00 25.31 ? 637 ARG A CA 1 ATOM 2559 C C . ARG A 1 329 ? -20.670 22.170 -10.463 1.00 26.77 ? 637 ARG A C 1 ATOM 2560 O O . ARG A 1 329 ? -21.068 21.073 -10.835 1.00 26.06 ? 637 ARG A O 1 ATOM 2561 C CB . ARG A 1 329 ? -18.352 21.177 -10.338 1.00 26.71 ? 637 ARG A CB 1 ATOM 2562 C CG . ARG A 1 329 ? -16.866 21.471 -10.226 1.00 26.11 ? 637 ARG A CG 1 ATOM 2563 C CD . ARG A 1 329 ? -16.035 20.205 -10.347 1.00 26.91 ? 637 ARG A CD 1 ATOM 2564 N NE . ARG A 1 329 ? -16.175 19.566 -11.654 1.00 27.97 ? 637 ARG A NE 1 ATOM 2565 C CZ . ARG A 1 329 ? -15.510 18.474 -12.019 1.00 27.08 ? 637 ARG A CZ 1 ATOM 2566 N NH1 . ARG A 1 329 ? -14.662 17.905 -11.176 1.00 27.91 ? 637 ARG A NH1 1 ATOM 2567 N NH2 . ARG A 1 329 ? -15.695 17.948 -13.220 1.00 26.16 ? 637 ARG A NH2 1 ATOM 2568 N N . ASN A 1 330 ? -21.449 23.245 -10.412 1.00 25.10 ? 638 ASN A N 1 ATOM 2569 C CA . ASN A 1 330 ? -22.871 23.181 -10.720 1.00 25.48 ? 638 ASN A CA 1 ATOM 2570 C C . ASN A 1 330 ? -23.175 22.858 -12.180 1.00 27.23 ? 638 ASN A C 1 ATOM 2571 O O . ASN A 1 330 ? -24.309 22.527 -12.530 1.00 28.74 ? 638 ASN A O 1 ATOM 2572 C CB . ASN A 1 330 ? -23.546 24.466 -10.254 1.00 26.27 ? 638 ASN A CB 1 ATOM 2573 C CG . ASN A 1 330 ? -23.436 24.638 -8.753 1.00 24.36 ? 638 ASN A CG 1 ATOM 2574 O OD1 . ASN A 1 330 ? -23.717 23.707 -8.001 1.00 23.69 ? 638 ASN A OD1 1 ATOM 2575 N ND2 . ASN A 1 330 ? -22.978 25.802 -8.312 1.00 22.95 ? 638 ASN A ND2 1 ATOM 2576 N N . GLU A 1 331 ? -22.146 22.940 -13.018 1.00 26.08 ? 639 GLU A N 1 ATOM 2577 C CA . GLU A 1 331 ? -22.215 22.457 -14.387 1.00 28.82 ? 639 GLU A CA 1 ATOM 2578 C C . GLU A 1 331 ? -22.655 20.992 -14.432 1.00 28.42 ? 639 GLU A C 1 ATOM 2579 O O . GLU A 1 331 ? -23.374 20.580 -15.340 1.00 30.10 ? 639 GLU A O 1 ATOM 2580 C CB . GLU A 1 331 ? -20.856 22.614 -15.072 1.00 34.18 ? 639 GLU A CB 1 ATOM 2581 C CG . GLU A 1 331 ? -20.478 24.051 -15.410 1.00 36.23 ? 639 GLU A CG 1 ATOM 2582 C CD . GLU A 1 331 ? -20.107 24.877 -14.188 1.00 38.85 ? 639 GLU A CD 1 ATOM 2583 O OE1 . GLU A 1 331 ? -20.116 26.122 -14.297 1.00 43.16 ? 639 GLU A OE1 1 ATOM 2584 O OE2 . GLU A 1 331 ? -19.808 24.290 -13.123 1.00 34.46 ? 639 GLU A OE2 1 ATOM 2585 N N . LEU A 1 332 ? -22.220 20.214 -13.442 1.00 26.15 ? 640 LEU A N 1 ATOM 2586 C CA . LEU A 1 332 ? -22.611 18.812 -13.326 1.00 26.84 ? 640 LEU A CA 1 ATOM 2587 C C . LEU A 1 332 ? -24.126 18.673 -13.231 1.00 27.03 ? 640 LEU A C 1 ATOM 2588 O O . LEU A 1 332 ? -24.712 17.798 -13.858 1.00 28.46 ? 640 LEU A O 1 ATOM 2589 C CB . LEU A 1 332 ? -21.965 18.172 -12.091 1.00 24.65 ? 640 LEU A CB 1 ATOM 2590 C CG . LEU A 1 332 ? -20.438 18.146 -12.026 1.00 27.33 ? 640 LEU A CG 1 ATOM 2591 C CD1 . LEU A 1 332 ? -19.969 17.643 -10.667 1.00 26.20 ? 640 LEU A CD1 1 ATOM 2592 C CD2 . LEU A 1 332 ? -19.886 17.271 -13.139 1.00 28.25 ? 640 LEU A CD2 1 ATOM 2593 N N . PHE A 1 333 ? -24.752 19.538 -12.439 1.00 24.69 ? 641 PHE A N 1 ATOM 2594 C CA . PHE A 1 333 ? -26.202 19.505 -12.262 1.00 24.86 ? 641 PHE A CA 1 ATOM 2595 C C . PHE A 1 333 ? -26.936 20.101 -13.462 1.00 25.99 ? 641 PHE A C 1 ATOM 2596 O O . PHE A 1 333 ? -28.040 19.669 -13.804 1.00 25.66 ? 641 PHE A O 1 ATOM 2597 C CB . PHE A 1 333 ? -26.604 20.203 -10.956 1.00 23.02 ? 641 PHE A CB 1 ATOM 2598 C CG . PHE A 1 333 ? -26.172 19.457 -9.727 1.00 21.83 ? 641 PHE A CG 1 ATOM 2599 C CD1 . PHE A 1 333 ? -27.037 18.582 -9.095 1.00 21.18 ? 641 PHE A CD1 1 ATOM 2600 C CD2 . PHE A 1 333 ? -24.885 19.598 -9.231 1.00 21.42 ? 641 PHE A CD2 1 ATOM 2601 C CE1 . PHE A 1 333 ? -26.635 17.876 -7.977 1.00 19.38 ? 641 PHE A CE1 1 ATOM 2602 C CE2 . PHE A 1 333 ? -24.478 18.902 -8.117 1.00 20.79 ? 641 PHE A CE2 1 ATOM 2603 C CZ . PHE A 1 333 ? -25.350 18.030 -7.492 1.00 19.96 ? 641 PHE A CZ 1 ATOM 2604 N N . ALA A 1 334 ? -26.309 21.077 -14.110 1.00 25.91 ? 642 ALA A N 1 ATOM 2605 C CA . ALA A 1 334 ? -26.857 21.670 -15.327 1.00 23.92 ? 642 ALA A CA 1 ATOM 2606 C C . ALA A 1 334 ? -26.997 20.632 -16.441 1.00 27.65 ? 642 ALA A C 1 ATOM 2607 O O . ALA A 1 334 ? -27.863 20.750 -17.315 1.00 28.65 ? 642 ALA A O 1 ATOM 2608 C CB . ALA A 1 334 ? -25.981 22.824 -15.786 1.00 24.72 ? 642 ALA A CB 1 ATOM 2609 N N . LEU A 1 335 ? -26.135 19.620 -16.411 1.00 27.54 ? 643 LEU A N 1 ATOM 2610 C CA . LEU A 1 335 ? -26.174 18.552 -17.408 1.00 31.21 ? 643 LEU A CA 1 ATOM 2611 C C . LEU A 1 335 ? -27.263 17.523 -17.117 1.00 31.54 ? 643 LEU A C 1 ATOM 2612 O O . LEU A 1 335 ? -27.561 16.675 -17.962 1.00 32.45 ? 643 LEU A O 1 ATOM 2613 C CB . LEU A 1 335 ? -24.810 17.869 -17.523 1.00 30.54 ? 643 LEU A CB 1 ATOM 2614 C CG . LEU A 1 335 ? -23.777 18.642 -18.343 1.00 33.08 ? 643 LEU A CG 1 ATOM 2615 C CD1 . LEU A 1 335 ? -22.368 18.178 -18.017 1.00 33.35 ? 643 LEU A CD1 1 ATOM 2616 C CD2 . LEU A 1 335 ? -24.057 18.477 -19.825 1.00 35.34 ? 643 LEU A CD2 1 ATOM 2617 N N . ARG A 1 336 ? -27.852 17.610 -15.925 1.00 29.69 ? 644 ARG A N 1 ATOM 2618 C CA . ARG A 1 336 ? -28.932 16.710 -15.499 1.00 30.96 ? 644 ARG A CA 1 ATOM 2619 C C . ARG A 1 336 ? -28.680 15.212 -15.733 1.00 30.02 ? 644 ARG A C 1 ATOM 2620 O O . ARG A 1 336 ? -29.433 14.562 -16.462 1.00 29.86 ? 644 ARG A O 1 ATOM 2621 C CB . ARG A 1 336 ? -30.259 17.115 -16.154 1.00 37.69 ? 644 ARG A CB 1 ATOM 2622 C CG . ARG A 1 336 ? -30.801 18.461 -15.690 1.00 43.92 ? 644 ARG A CG 1 ATOM 2623 C CD . ARG A 1 336 ? -32.044 18.852 -16.478 1.00 51.80 ? 644 ARG A CD 1 ATOM 2624 N NE . ARG A 1 336 ? -32.441 20.234 -16.222 1.00 56.72 ? 644 ARG A NE 1 ATOM 2625 C CZ . ARG A 1 336 ? -33.485 20.831 -16.790 1.00 60.15 ? 644 ARG A CZ 1 ATOM 2626 N NH1 . ARG A 1 336 ? -34.246 20.166 -17.650 1.00 63.08 ? 644 ARG A NH1 1 ATOM 2627 N NH2 . ARG A 1 336 ? -33.768 22.093 -16.497 1.00 59.82 ? 644 ARG A NH2 1 ATOM 2628 N N . PRO A 1 337 ? -27.630 14.656 -15.107 1.00 28.55 ? 645 PRO A N 1 ATOM 2629 C CA . PRO A 1 337 ? -27.395 13.210 -15.217 1.00 26.88 ? 645 PRO A CA 1 ATOM 2630 C C . PRO A 1 337 ? -28.384 12.387 -14.390 1.00 26.19 ? 645 PRO A C 1 ATOM 2631 O O . PRO A 1 337 ? -28.431 11.164 -14.543 1.00 27.51 ? 645 PRO A O 1 ATOM 2632 C CB . PRO A 1 337 ? -25.984 13.050 -14.647 1.00 25.76 ? 645 PRO A CB 1 ATOM 2633 C CG . PRO A 1 337 ? -25.875 14.158 -13.651 1.00 22.95 ? 645 PRO A CG 1 ATOM 2634 C CD . PRO A 1 337 ? -26.591 15.316 -14.298 1.00 26.11 ? 645 PRO A CD 1 ATOM 2635 N N . ALA A 1 338 ? -29.153 13.038 -13.522 1.00 23.55 ? 646 ALA A N 1 ATOM 2636 C CA . ALA A 1 338 ? -30.123 12.326 -12.695 1.00 28.45 ? 646 ALA A CA 1 ATOM 2637 C C . ALA A 1 338 ? -31.523 12.919 -12.851 1.00 27.74 ? 646 ALA A C 1 ATOM 2638 O O . ALA A 1 338 ? -31.665 14.116 -13.101 1.00 28.45 ? 646 ALA A O 1 ATOM 2639 C CB . ALA A 1 338 ? -29.684 12.325 -11.228 1.00 27.09 ? 646 ALA A CB 1 ATOM 2640 N N . PRO A 1 339 ? -32.563 12.076 -12.723 1.00 29.37 ? 647 PRO A N 1 ATOM 2641 C CA . PRO A 1 339 ? -33.948 12.529 -12.922 1.00 30.26 ? 647 PRO A CA 1 ATOM 2642 C C . PRO A 1 339 ? -34.444 13.465 -11.824 1.00 29.65 ? 647 PRO A C 1 ATOM 2643 O O . PRO A 1 339 ? -35.305 14.309 -12.076 1.00 30.31 ? 647 PRO A O 1 ATOM 2644 C CB . PRO A 1 339 ? -34.752 11.221 -12.916 1.00 30.30 ? 647 PRO A CB 1 ATOM 2645 C CG . PRO A 1 339 ? -33.899 10.248 -12.179 1.00 28.38 ? 647 PRO A CG 1 ATOM 2646 C CD . PRO A 1 339 ? -32.485 10.619 -12.513 1.00 28.49 ? 647 PRO A CD 1 ATOM 2647 N N . ILE A 1 340 ? -33.910 13.311 -10.617 1.00 26.43 ? 648 ILE A N 1 ATOM 2648 C CA . ILE A 1 340 ? -34.257 14.189 -9.509 1.00 25.71 ? 648 ILE A CA 1 ATOM 2649 C C . ILE A 1 340 ? -32.976 14.784 -8.941 1.00 26.18 ? 648 ILE A C 1 ATOM 2650 O O . ILE A 1 340 ? -32.038 14.055 -8.616 1.00 24.64 ? 648 ILE A O 1 ATOM 2651 C CB . ILE A 1 340 ? -34.997 13.426 -8.391 1.00 24.46 ? 648 ILE A CB 1 ATOM 2652 C CG1 . ILE A 1 340 ? -36.264 12.767 -8.944 1.00 28.95 ? 648 ILE A CG1 1 ATOM 2653 C CG2 . ILE A 1 340 ? -35.324 14.355 -7.232 1.00 25.79 ? 648 ILE A CG2 1 ATOM 2654 C CD1 . ILE A 1 340 ? -36.893 11.762 -7.994 1.00 30.63 ? 648 ILE A CD1 1 ATOM 2655 N N . GLN A 1 341 ? -32.931 16.109 -8.841 1.00 25.75 ? 649 GLN A N 1 ATOM 2656 C CA . GLN A 1 341 ? -31.762 16.794 -8.295 1.00 23.50 ? 649 GLN A CA 1 ATOM 2657 C C . GLN A 1 341 ? -32.193 17.777 -7.204 1.00 23.36 ? 649 GLN A C 1 ATOM 2658 O O . GLN A 1 341 ? -33.075 18.605 -7.420 1.00 26.21 ? 649 GLN A O 1 ATOM 2659 C CB . GLN A 1 341 ? -30.981 17.485 -9.425 1.00 24.43 ? 649 GLN A CB 1 ATOM 2660 C CG . GLN A 1 341 ? -30.668 16.521 -10.575 1.00 23.46 ? 649 GLN A CG 1 ATOM 2661 C CD . GLN A 1 341 ? -29.692 17.056 -11.608 1.00 25.02 ? 649 GLN A CD 1 ATOM 2662 O OE1 . GLN A 1 341 ? -28.910 16.293 -12.178 1.00 25.11 ? 649 GLN A OE1 1 ATOM 2663 N NE2 . GLN A 1 341 ? -29.750 18.360 -11.879 1.00 24.17 ? 649 GLN A NE2 1 ATOM 2664 N N . ALA A 1 342 ? -31.578 17.667 -6.029 1.00 20.88 ? 650 ALA A N 1 ATOM 2665 C CA . ALA A 1 342 ? -32.007 18.443 -4.865 1.00 19.12 ? 650 ALA A CA 1 ATOM 2666 C C . ALA A 1 342 ? -30.867 19.229 -4.208 1.00 20.56 ? 650 ALA A C 1 ATOM 2667 O O . ALA A 1 342 ? -29.737 18.747 -4.122 1.00 19.08 ? 650 ALA A O 1 ATOM 2668 C CB . ALA A 1 342 ? -32.657 17.514 -3.837 1.00 17.92 ? 650 ALA A CB 1 ATOM 2669 N N . MET A 1 343 ? -31.174 20.436 -3.742 1.00 20.45 ? 651 MET A N 1 ATOM 2670 C CA . MET A 1 343 ? -30.231 21.223 -2.955 1.00 17.50 ? 651 MET A CA 1 ATOM 2671 C C . MET A 1 343 ? -30.336 20.789 -1.503 1.00 18.83 ? 651 MET A C 1 ATOM 2672 O O . MET A 1 343 ? -31.440 20.640 -0.977 1.00 19.78 ? 651 MET A O 1 ATOM 2673 C CB . MET A 1 343 ? -30.575 22.712 -3.046 1.00 18.40 ? 651 MET A CB 1 ATOM 2674 C CG . MET A 1 343 ? -30.567 23.279 -4.455 1.00 18.79 ? 651 MET A CG 1 ATOM 2675 S SD . MET A 1 343 ? -28.893 23.577 -5.051 1.00 24.74 ? 651 MET A SD 1 ATOM 2676 C CE . MET A 1 343 ? -28.352 24.804 -3.857 1.00 22.42 ? 651 MET A CE 1 ATOM 2677 N N . TRP A 1 344 ? -29.199 20.590 -0.844 1.00 18.52 ? 652 TRP A N 1 ATOM 2678 C CA . TRP A 1 344 ? -29.230 20.164 0.552 1.00 17.46 ? 652 TRP A CA 1 ATOM 2679 C C . TRP A 1 344 ? -28.042 20.646 1.372 1.00 18.61 ? 652 TRP A C 1 ATOM 2680 O O . TRP A 1 344 ? -26.894 20.336 1.053 1.00 17.80 ? 652 TRP A O 1 ATOM 2681 C CB . TRP A 1 344 ? -29.313 18.637 0.648 1.00 18.73 ? 652 TRP A CB 1 ATOM 2682 C CG . TRP A 1 344 ? -29.246 18.119 2.060 1.00 18.98 ? 652 TRP A CG 1 ATOM 2683 C CD1 . TRP A 1 344 ? -30.117 18.392 3.080 1.00 20.42 ? 652 TRP A CD1 1 ATOM 2684 C CD2 . TRP A 1 344 ? -28.257 17.235 2.602 1.00 18.83 ? 652 TRP A CD2 1 ATOM 2685 N NE1 . TRP A 1 344 ? -29.726 17.731 4.226 1.00 18.55 ? 652 TRP A NE1 1 ATOM 2686 C CE2 . TRP A 1 344 ? -28.589 17.013 3.956 1.00 19.39 ? 652 TRP A CE2 1 ATOM 2687 C CE3 . TRP A 1 344 ? -27.126 16.606 2.074 1.00 19.27 ? 652 TRP A CE3 1 ATOM 2688 C CZ2 . TRP A 1 344 ? -27.828 16.194 4.786 1.00 20.27 ? 652 TRP A CZ2 1 ATOM 2689 C CZ3 . TRP A 1 344 ? -26.371 15.790 2.904 1.00 19.52 ? 652 TRP A CZ3 1 ATOM 2690 C CH2 . TRP A 1 344 ? -26.727 15.590 4.239 1.00 20.58 ? 652 TRP A CH2 1 ATOM 2691 N N . LEU A 1 345 ? -28.354 21.424 2.407 1.00 17.67 ? 653 LEU A N 1 ATOM 2692 C CA . LEU A 1 345 ? -27.477 21.676 3.555 1.00 19.97 ? 653 LEU A CA 1 ATOM 2693 C C . LEU A 1 345 ? -26.372 22.722 3.374 1.00 21.67 ? 653 LEU A C 1 ATOM 2694 O O . LEU A 1 345 ? -26.232 23.621 4.204 1.00 20.63 ? 653 LEU A O 1 ATOM 2695 C CB . LEU A 1 345 ? -26.914 20.358 4.124 1.00 20.66 ? 653 LEU A CB 1 ATOM 2696 C CG . LEU A 1 345 ? -26.284 20.448 5.514 1.00 21.50 ? 653 LEU A CG 1 ATOM 2697 C CD1 . LEU A 1 345 ? -27.301 20.986 6.509 1.00 20.90 ? 653 LEU A CD1 1 ATOM 2698 C CD2 . LEU A 1 345 ? -25.739 19.097 5.980 1.00 19.03 ? 653 LEU A CD2 1 ATOM 2699 N N . GLY A 1 346 ? -25.599 22.626 2.299 1.00 19.07 ? 654 GLY A N 1 ATOM 2700 C CA . GLY A 1 346 ? -24.407 23.449 2.175 1.00 18.13 ? 654 GLY A CA 1 ATOM 2701 C C . GLY A 1 346 ? -24.602 24.886 1.714 1.00 22.22 ? 654 GLY A C 1 ATOM 2702 O O . GLY A 1 346 ? -23.701 25.708 1.860 1.00 28.48 ? 654 GLY A O 1 ATOM 2703 N N . TYR A 1 347 ? -25.766 25.199 1.154 1.00 19.48 ? 655 TYR A N 1 ATOM 2704 C CA . TYR A 1 347 ? -26.007 26.541 0.632 1.00 20.48 ? 655 TYR A CA 1 ATOM 2705 C C . TYR A 1 347 ? -27.337 27.116 1.127 1.00 21.99 ? 655 TYR A C 1 ATOM 2706 O O . TYR A 1 347 ? -28.404 26.622 0.759 1.00 20.22 ? 655 TYR A O 1 ATOM 2707 C CB . TYR A 1 347 ? -25.970 26.533 -0.901 1.00 20.14 ? 655 TYR A CB 1 ATOM 2708 C CG . TYR A 1 347 ? -26.118 27.907 -1.503 1.00 18.32 ? 655 TYR A CG 1 ATOM 2709 C CD1 . TYR A 1 347 ? -25.075 28.827 -1.444 1.00 17.78 ? 655 TYR A CD1 1 ATOM 2710 C CD2 . TYR A 1 347 ? -27.306 28.295 -2.119 1.00 19.61 ? 655 TYR A CD2 1 ATOM 2711 C CE1 . TYR A 1 347 ? -25.209 30.091 -1.986 1.00 20.08 ? 655 TYR A CE1 1 ATOM 2712 C CE2 . TYR A 1 347 ? -27.452 29.558 -2.656 1.00 20.91 ? 655 TYR A CE2 1 ATOM 2713 C CZ . TYR A 1 347 ? -26.400 30.450 -2.592 1.00 23.25 ? 655 TYR A CZ 1 ATOM 2714 O OH . TYR A 1 347 ? -26.540 31.709 -3.134 1.00 26.40 ? 655 TYR A OH 1 ATOM 2715 N N . PRO A 1 348 ? -27.274 28.166 1.966 1.00 19.26 ? 656 PRO A N 1 ATOM 2716 C CA . PRO A 1 348 ? -28.481 28.728 2.584 1.00 20.52 ? 656 PRO A CA 1 ATOM 2717 C C . PRO A 1 348 ? -29.214 29.718 1.680 1.00 21.53 ? 656 PRO A C 1 ATOM 2718 O O . PRO A 1 348 ? -29.404 30.878 2.055 1.00 20.15 ? 656 PRO A O 1 ATOM 2719 C CB . PRO A 1 348 ? -27.925 29.455 3.810 1.00 20.07 ? 656 PRO A CB 1 ATOM 2720 C CG . PRO A 1 348 ? -26.585 29.930 3.351 1.00 20.55 ? 656 PRO A CG 1 ATOM 2721 C CD . PRO A 1 348 ? -26.050 28.817 2.468 1.00 16.82 ? 656 PRO A CD 1 ATOM 2722 N N . GLY A 1 349 ? -29.642 29.263 0.509 1.00 18.42 ? 657 GLY A N 1 ATOM 2723 C CA . GLY A 1 349 ? -30.390 30.121 -0.397 1.00 21.24 ? 657 GLY A CA 1 ATOM 2724 C C . GLY A 1 349 ? -30.871 29.334 -1.596 1.00 21.89 ? 657 GLY A C 1 ATOM 2725 O O . GLY A 1 349 ? -30.540 28.157 -1.736 1.00 20.46 ? 657 GLY A O 1 ATOM 2726 N N . THR A 1 350 ? -31.665 29.971 -2.455 1.00 22.79 ? 658 THR A N 1 ATOM 2727 C CA . THR A 1 350 ? -32.110 29.312 -3.676 1.00 24.46 ? 658 THR A CA 1 ATOM 2728 C C . THR A 1 350 ? -30.999 29.289 -4.722 1.00 20.95 ? 658 THR A C 1 ATOM 2729 O O . THR A 1 350 ? -30.181 30.207 -4.796 1.00 20.25 ? 658 THR A O 1 ATOM 2730 C CB . THR A 1 350 ? -33.386 29.967 -4.263 1.00 22.59 ? 658 THR A CB 1 ATOM 2731 O OG1 . THR A 1 350 ? -33.845 29.195 -5.380 1.00 26.41 ? 658 THR A OG1 1 ATOM 2732 C CG2 . THR A 1 350 ? -33.116 31.390 -4.711 1.00 24.51 ? 658 THR A CG2 1 ATOM 2733 N N . SER A 1 351 ? -30.963 28.230 -5.525 1.00 19.99 ? 659 SER A N 1 ATOM 2734 C CA . SER A 1 351 ? -30.033 28.170 -6.650 1.00 21.18 ? 659 SER A CA 1 ATOM 2735 C C . SER A 1 351 ? -30.536 29.050 -7.787 1.00 23.07 ? 659 SER A C 1 ATOM 2736 O O . SER A 1 351 ? -29.767 29.479 -8.649 1.00 24.87 ? 659 SER A O 1 ATOM 2737 C CB . SER A 1 351 ? -29.896 26.736 -7.159 1.00 23.86 ? 659 SER A CB 1 ATOM 2738 O OG . SER A 1 351 ? -31.073 26.336 -7.843 1.00 24.97 ? 659 SER A OG 1 ATOM 2739 N N . GLY A 1 352 ? -31.838 29.309 -7.799 1.00 25.02 ? 660 GLY A N 1 ATOM 2740 C CA . GLY A 1 352 ? -32.442 30.068 -8.882 1.00 25.95 ? 660 GLY A CA 1 ATOM 2741 C C . GLY A 1 352 ? -32.418 29.324 -10.210 1.00 30.35 ? 660 GLY A C 1 ATOM 2742 O O . GLY A 1 352 ? -32.809 29.873 -11.239 1.00 31.80 ? 660 GLY A O 1 ATOM 2743 N N . ALA A 1 353 ? -31.984 28.066 -10.181 1.00 30.13 ? 661 ALA A N 1 ATOM 2744 C CA . ALA A 1 353 ? -31.707 27.307 -11.400 1.00 34.20 ? 661 ALA A CA 1 ATOM 2745 C C . ALA A 1 353 ? -32.774 26.261 -11.708 1.00 34.48 ? 661 ALA A C 1 ATOM 2746 O O . ALA A 1 353 ? -33.175 25.496 -10.833 1.00 35.30 ? 661 ALA A O 1 ATOM 2747 C CB . ALA A 1 353 ? -30.344 26.641 -11.292 1.00 34.84 ? 661 ALA A CB 1 ATOM 2748 N N . LEU A 1 354 ? -33.216 26.212 -12.962 1.00 34.46 ? 662 LEU A N 1 ATOM 2749 C CA . LEU A 1 354 ? -34.256 25.265 -13.356 1.00 36.78 ? 662 LEU A CA 1 ATOM 2750 C C . LEU A 1 354 ? -33.808 23.799 -13.298 1.00 35.54 ? 662 LEU A C 1 ATOM 2751 O O . LEU A 1 354 ? -34.644 22.896 -13.245 1.00 35.93 ? 662 LEU A O 1 ATOM 2752 C CB . LEU A 1 354 ? -34.803 25.600 -14.745 1.00 42.78 ? 662 LEU A CB 1 ATOM 2753 C CG . LEU A 1 354 ? -35.721 26.823 -14.805 1.00 46.54 ? 662 LEU A CG 1 ATOM 2754 C CD1 . LEU A 1 354 ? -36.318 26.981 -16.195 1.00 50.21 ? 662 LEU A CD1 1 ATOM 2755 C CD2 . LEU A 1 354 ? -36.817 26.722 -13.750 1.00 46.20 ? 662 LEU A CD2 1 ATOM 2756 N N . PHE A 1 355 ? -32.500 23.559 -13.302 1.00 33.26 ? 663 PHE A N 1 ATOM 2757 C CA . PHE A 1 355 ? -32.002 22.184 -13.233 1.00 31.75 ? 663 PHE A CA 1 ATOM 2758 C C . PHE A 1 355 ? -31.973 21.618 -11.812 1.00 30.36 ? 663 PHE A C 1 ATOM 2759 O O . PHE A 1 355 ? -31.689 20.436 -11.612 1.00 26.95 ? 663 PHE A O 1 ATOM 2760 C CB . PHE A 1 355 ? -30.636 22.037 -13.915 1.00 31.98 ? 663 PHE A CB 1 ATOM 2761 C CG . PHE A 1 355 ? -29.603 23.020 -13.444 1.00 30.77 ? 663 PHE A CG 1 ATOM 2762 C CD1 . PHE A 1 355 ? -28.896 22.798 -12.274 1.00 28.36 ? 663 PHE A CD1 1 ATOM 2763 C CD2 . PHE A 1 355 ? -29.325 24.159 -14.187 1.00 31.18 ? 663 PHE A CD2 1 ATOM 2764 C CE1 . PHE A 1 355 ? -27.935 23.701 -11.843 1.00 28.82 ? 663 PHE A CE1 1 ATOM 2765 C CE2 . PHE A 1 355 ? -28.366 25.063 -13.763 1.00 29.37 ? 663 PHE A CE2 1 ATOM 2766 C CZ . PHE A 1 355 ? -27.670 24.834 -12.595 1.00 27.09 ? 663 PHE A CZ 1 ATOM 2767 N N . MET A 1 356 ? -32.263 22.460 -10.826 1.00 28.63 ? 664 MET A N 1 ATOM 2768 C CA . MET A 1 356 ? -32.468 21.968 -9.471 1.00 26.42 ? 664 MET A CA 1 ATOM 2769 C C . MET A 1 356 ? -33.965 21.832 -9.231 1.00 27.78 ? 664 MET A C 1 ATOM 2770 O O . MET A 1 356 ? -34.717 22.788 -9.423 1.00 25.86 ? 664 MET A O 1 ATOM 2771 C CB . MET A 1 356 ? -31.833 22.894 -8.430 1.00 21.85 ? 664 MET A CB 1 ATOM 2772 C CG . MET A 1 356 ? -30.311 23.047 -8.554 1.00 22.16 ? 664 MET A CG 1 ATOM 2773 S SD . MET A 1 356 ? -29.364 21.496 -8.645 1.00 24.98 ? 664 MET A SD 1 ATOM 2774 C CE . MET A 1 356 ? -29.907 20.626 -7.177 1.00 17.82 ? 664 MET A CE 1 ATOM 2775 N N . ASP A 1 357 ? -34.393 20.640 -8.821 1.00 26.89 ? 665 ASP A N 1 ATOM 2776 C CA . ASP A 1 357 ? -35.817 20.338 -8.683 1.00 28.06 ? 665 ASP A CA 1 ATOM 2777 C C . ASP A 1 357 ? -36.372 20.714 -7.317 1.00 27.77 ? 665 ASP A C 1 ATOM 2778 O O . ASP A 1 357 ? -37.459 21.301 -7.210 1.00 25.61 ? 665 ASP A O 1 ATOM 2779 C CB . ASP A 1 357 ? -36.066 18.853 -8.945 1.00 29.35 ? 665 ASP A CB 1 ATOM 2780 C CG . ASP A 1 357 ? -35.671 18.442 -10.345 1.00 31.60 ? 665 ASP A CG 1 ATOM 2781 O OD1 . ASP A 1 357 ? -36.326 18.909 -11.298 1.00 32.63 ? 665 ASP A OD1 1 ATOM 2782 O OD2 . ASP A 1 357 ? -34.706 17.663 -10.494 1.00 31.80 ? 665 ASP A OD2 1 ATOM 2783 N N . TYR A 1 358 ? -35.611 20.374 -6.280 1.00 25.42 ? 666 TYR A N 1 ATOM 2784 C CA . TYR A 1 358 ? -36.034 20.564 -4.902 1.00 22.71 ? 666 TYR A CA 1 ATOM 2785 C C . TYR A 1 358 ? -34.978 21.297 -4.092 1.00 22.39 ? 666 TYR A C 1 ATOM 2786 O O . TYR A 1 358 ? -33.797 21.286 -4.433 1.00 23.32 ? 666 TYR A O 1 ATOM 2787 C CB . TYR A 1 358 ? -36.278 19.209 -4.227 1.00 20.96 ? 666 TYR A CB 1 ATOM 2788 C CG . TYR A 1 358 ? -37.437 18.422 -4.795 1.00 26.12 ? 666 TYR A CG 1 ATOM 2789 C CD1 . TYR A 1 358 ? -38.747 18.775 -4.500 1.00 26.68 ? 666 TYR A CD1 1 ATOM 2790 C CD2 . TYR A 1 358 ? -37.219 17.320 -5.615 1.00 26.17 ? 666 TYR A CD2 1 ATOM 2791 C CE1 . TYR A 1 358 ? -39.811 18.061 -5.014 1.00 27.76 ? 666 TYR A CE1 1 ATOM 2792 C CE2 . TYR A 1 358 ? -38.280 16.599 -6.135 1.00 28.56 ? 666 TYR A CE2 1 ATOM 2793 C CZ . TYR A 1 358 ? -39.572 16.976 -5.829 1.00 28.75 ? 666 TYR A CZ 1 ATOM 2794 O OH . TYR A 1 358 ? -40.632 16.265 -6.337 1.00 29.48 ? 666 TYR A OH 1 ATOM 2795 N N . ILE A 1 359 ? -35.423 21.926 -3.014 1.00 21.99 ? 667 ILE A N 1 ATOM 2796 C CA . ILE A 1 359 ? -34.526 22.320 -1.939 1.00 21.31 ? 667 ILE A CA 1 ATOM 2797 C C . ILE A 1 359 ? -35.024 21.669 -0.652 1.00 20.91 ? 667 ILE A C 1 ATOM 2798 O O . ILE A 1 359 ? -36.201 21.777 -0.301 1.00 22.24 ? 667 ILE A O 1 ATOM 2799 C CB . ILE A 1 359 ? -34.411 23.856 -1.788 1.00 21.87 ? 667 ILE A CB 1 ATOM 2800 C CG1 . ILE A 1 359 ? -33.551 24.209 -0.570 1.00 20.98 ? 667 ILE A CG1 1 ATOM 2801 C CG2 . ILE A 1 359 ? -35.786 24.512 -1.698 1.00 21.57 ? 667 ILE A CG2 1 ATOM 2802 C CD1 . ILE A 1 359 ? -33.207 25.692 -0.479 1.00 23.49 ? 667 ILE A CD1 1 ATOM 2803 N N . ILE A 1 360 ? -34.129 20.961 0.027 1.00 17.18 ? 668 ILE A N 1 ATOM 2804 C CA . ILE A 1 360 ? -34.480 20.279 1.263 1.00 18.38 ? 668 ILE A CA 1 ATOM 2805 C C . ILE A 1 360 ? -34.400 21.280 2.409 1.00 20.67 ? 668 ILE A C 1 ATOM 2806 O O . ILE A 1 360 ? -33.337 21.805 2.740 1.00 21.28 ? 668 ILE A O 1 ATOM 2807 C CB . ILE A 1 360 ? -33.596 19.041 1.497 1.00 18.78 ? 668 ILE A CB 1 ATOM 2808 C CG1 . ILE A 1 360 ? -33.834 18.024 0.371 1.00 20.09 ? 668 ILE A CG1 1 ATOM 2809 C CG2 . ILE A 1 360 ? -33.872 18.418 2.871 1.00 18.60 ? 668 ILE A CG2 1 ATOM 2810 C CD1 . ILE A 1 360 ? -32.889 16.835 0.381 1.00 22.45 ? 668 ILE A CD1 1 ATOM 2811 N N . THR A 1 361 ? -35.557 21.576 2.976 1.00 20.36 ? 669 THR A N 1 ATOM 2812 C CA . THR A 1 361 ? -35.661 22.616 3.979 1.00 19.91 ? 669 THR A CA 1 ATOM 2813 C C . THR A 1 361 ? -36.704 22.169 4.990 1.00 19.34 ? 669 THR A C 1 ATOM 2814 O O . THR A 1 361 ? -36.892 20.969 5.198 1.00 20.02 ? 669 THR A O 1 ATOM 2815 C CB . THR A 1 361 ? -35.993 23.987 3.328 1.00 16.53 ? 669 THR A CB 1 ATOM 2816 O OG1 . THR A 1 361 ? -36.136 24.997 4.336 1.00 19.03 ? 669 THR A OG1 1 ATOM 2817 C CG2 . THR A 1 361 ? -37.263 23.912 2.460 1.00 19.09 ? 669 THR A CG2 1 ATOM 2818 N N . ASP A 1 362 ? -37.363 23.112 5.644 1.00 21.31 ? 670 ASP A N 1 ATOM 2819 C CA . ASP A 1 362 ? -38.430 22.753 6.575 1.00 20.14 ? 670 ASP A CA 1 ATOM 2820 C C . ASP A 1 362 ? -39.412 23.907 6.703 1.00 20.13 ? 670 ASP A C 1 ATOM 2821 O O . ASP A 1 362 ? -39.176 24.991 6.165 1.00 19.79 ? 670 ASP A O 1 ATOM 2822 C CB . ASP A 1 362 ? -37.868 22.352 7.942 1.00 18.75 ? 670 ASP A CB 1 ATOM 2823 C CG . ASP A 1 362 ? -37.084 23.468 8.600 1.00 20.29 ? 670 ASP A CG 1 ATOM 2824 O OD1 . ASP A 1 362 ? -37.707 24.367 9.194 1.00 21.27 ? 670 ASP A OD1 1 ATOM 2825 O OD2 . ASP A 1 362 ? -35.842 23.435 8.544 1.00 21.00 ? 670 ASP A OD2 1 ATOM 2826 N N . GLN A 1 363 ? -40.519 23.665 7.397 1.00 20.23 ? 671 GLN A N 1 ATOM 2827 C CA . GLN A 1 363 ? -41.615 24.632 7.458 1.00 24.09 ? 671 GLN A CA 1 ATOM 2828 C C . GLN A 1 363 ? -41.226 25.916 8.193 1.00 22.01 ? 671 GLN A C 1 ATOM 2829 O O . GLN A 1 363 ? -41.715 27.008 7.871 1.00 19.34 ? 671 GLN A O 1 ATOM 2830 C CB . GLN A 1 363 ? -42.851 23.989 8.100 1.00 29.23 ? 671 GLN A CB 1 ATOM 2831 C CG . GLN A 1 363 ? -44.039 24.929 8.264 1.00 38.31 ? 671 GLN A CG 1 ATOM 2832 C CD . GLN A 1 363 ? -45.196 24.286 9.012 1.00 46.10 ? 671 GLN A CD 1 ATOM 2833 O OE1 . GLN A 1 363 ? -45.192 23.081 9.271 1.00 47.87 ? 671 GLN A OE1 1 ATOM 2834 N NE2 . GLN A 1 363 ? -46.193 25.091 9.366 1.00 49.90 ? 671 GLN A NE2 1 ATOM 2835 N N . GLU A 1 364 ? -40.345 25.792 9.180 1.00 20.64 ? 672 GLU A N 1 ATOM 2836 C CA . GLU A 1 364 ? -39.895 26.964 9.932 1.00 23.94 ? 672 GLU A CA 1 ATOM 2837 C C . GLU A 1 364 ? -38.920 27.801 9.106 1.00 22.41 ? 672 GLU A C 1 ATOM 2838 O O . GLU A 1 364 ? -39.015 29.028 9.067 1.00 23.98 ? 672 GLU A O 1 ATOM 2839 C CB . GLU A 1 364 ? -39.230 26.545 11.252 1.00 26.00 ? 672 GLU A CB 1 ATOM 2840 C CG . GLU A 1 364 ? -40.151 25.789 12.195 1.00 28.99 ? 672 GLU A CG 1 ATOM 2841 C CD . GLU A 1 364 ? -41.347 26.613 12.627 1.00 31.40 ? 672 GLU A CD 1 ATOM 2842 O OE1 . GLU A 1 364 ? -41.196 27.849 12.786 1.00 27.97 ? 672 GLU A OE1 1 ATOM 2843 O OE2 . GLU A 1 364 ? -42.439 26.025 12.800 1.00 33.56 ? 672 GLU A OE2 1 ATOM 2844 N N . THR A 1 365 ? -37.980 27.133 8.445 1.00 19.05 ? 673 THR A N 1 ATOM 2845 C CA . THR A 1 365 ? -36.990 27.836 7.633 1.00 17.45 ? 673 THR A CA 1 ATOM 2846 C C . THR A 1 365 ? -37.627 28.436 6.388 1.00 20.89 ? 673 THR A C 1 ATOM 2847 O O . THR A 1 365 ? -37.334 29.570 6.012 1.00 21.73 ? 673 THR A O 1 ATOM 2848 C CB . THR A 1 365 ? -35.859 26.907 7.203 1.00 18.15 ? 673 THR A CB 1 ATOM 2849 O OG1 . THR A 1 365 ? -35.347 26.227 8.352 1.00 20.08 ? 673 THR A OG1 1 ATOM 2850 C CG2 . THR A 1 365 ? -34.745 27.700 6.558 1.00 19.00 ? 673 THR A CG2 1 ATOM 2851 N N . SER A 1 366 ? -38.497 27.666 5.743 1.00 19.33 ? 674 SER A N 1 ATOM 2852 C CA . SER A 1 366 ? -39.092 28.099 4.488 1.00 20.82 ? 674 SER A CA 1 ATOM 2853 C C . SER A 1 366 ? -40.604 27.874 4.485 1.00 21.89 ? 674 SER A C 1 ATOM 2854 O O . SER A 1 366 ? -41.092 26.937 3.856 1.00 23.34 ? 674 SER A O 1 ATOM 2855 C CB . SER A 1 366 ? -38.439 27.348 3.321 1.00 21.94 ? 674 SER A CB 1 ATOM 2856 O OG . SER A 1 366 ? -37.024 27.366 3.432 1.00 21.80 ? 674 SER A OG 1 ATOM 2857 N N . PRO A 1 367 ? -41.352 28.735 5.191 1.00 26.97 ? 675 PRO A N 1 ATOM 2858 C CA . PRO A 1 367 ? -42.814 28.607 5.212 1.00 30.15 ? 675 PRO A CA 1 ATOM 2859 C C . PRO A 1 367 ? -43.385 28.616 3.798 1.00 32.46 ? 675 PRO A C 1 ATOM 2860 O O . PRO A 1 367 ? -42.902 29.360 2.943 1.00 30.86 ? 675 PRO A O 1 ATOM 2861 C CB . PRO A 1 367 ? -43.273 29.843 5.996 1.00 31.84 ? 675 PRO A CB 1 ATOM 2862 C CG . PRO A 1 367 ? -42.081 30.746 6.073 1.00 30.76 ? 675 PRO A CG 1 ATOM 2863 C CD . PRO A 1 367 ? -40.879 29.871 5.998 1.00 26.43 ? 675 PRO A CD 1 ATOM 2864 N N . ALA A 1 368 ? -44.389 27.781 3.554 1.00 32.80 ? 676 ALA A N 1 ATOM 2865 C CA . ALA A 1 368 ? -44.909 27.583 2.202 1.00 36.48 ? 676 ALA A CA 1 ATOM 2866 C C . ALA A 1 368 ? -45.395 28.884 1.568 1.00 39.19 ? 676 ALA A C 1 ATOM 2867 O O . ALA A 1 368 ? -45.494 28.989 0.344 1.00 39.73 ? 676 ALA A O 1 ATOM 2868 C CB . ALA A 1 368 ? -46.018 26.539 2.206 1.00 38.66 ? 676 ALA A CB 1 ATOM 2869 N N . GLU A 1 369 ? -45.682 29.873 2.410 1.00 40.40 ? 677 GLU A N 1 ATOM 2870 C CA . GLU A 1 369 ? -46.111 31.185 1.945 1.00 45.45 ? 677 GLU A CA 1 ATOM 2871 C C . GLU A 1 369 ? -45.035 31.880 1.116 1.00 44.11 ? 677 GLU A C 1 ATOM 2872 O O . GLU A 1 369 ? -45.348 32.649 0.208 1.00 45.28 ? 677 GLU A O 1 ATOM 2873 C CB . GLU A 1 369 ? -46.508 32.077 3.127 1.00 48.85 ? 677 GLU A CB 1 ATOM 2874 C CG . GLU A 1 369 ? -47.530 31.457 4.072 1.00 52.80 ? 677 GLU A CG 1 ATOM 2875 C CD . GLU A 1 369 ? -46.882 30.656 5.191 1.00 53.66 ? 677 GLU A CD 1 ATOM 2876 O OE1 . GLU A 1 369 ? -46.387 31.280 6.155 1.00 54.16 ? 677 GLU A OE1 1 ATOM 2877 O OE2 . GLU A 1 369 ? -46.866 29.408 5.105 1.00 52.05 ? 677 GLU A OE2 1 ATOM 2878 N N . VAL A 1 370 ? -43.769 31.612 1.425 1.00 41.04 ? 678 VAL A N 1 ATOM 2879 C CA . VAL A 1 370 ? -42.671 32.275 0.720 1.00 41.02 ? 678 VAL A CA 1 ATOM 2880 C C . VAL A 1 370 ? -41.991 31.391 -0.324 1.00 39.10 ? 678 VAL A C 1 ATOM 2881 O O . VAL A 1 370 ? -40.824 31.596 -0.654 1.00 40.66 ? 678 VAL A O 1 ATOM 2882 C CB . VAL A 1 370 ? -41.611 32.847 1.691 1.00 40.90 ? 678 VAL A CB 1 ATOM 2883 C CG1 . VAL A 1 370 ? -42.247 33.859 2.627 1.00 43.40 ? 678 VAL A CG1 1 ATOM 2884 C CG2 . VAL A 1 370 ? -40.934 31.731 2.478 1.00 41.06 ? 678 VAL A CG2 1 ATOM 2885 N N . ALA A 1 371 ? -42.732 30.422 -0.855 1.00 37.86 ? 679 ALA A N 1 ATOM 2886 C CA . ALA A 1 371 ? -42.219 29.556 -1.913 1.00 39.73 ? 679 ALA A CA 1 ATOM 2887 C C . ALA A 1 371 ? -41.747 30.358 -3.128 1.00 40.82 ? 679 ALA A C 1 ATOM 2888 O O . ALA A 1 371 ? -40.880 29.907 -3.877 1.00 39.85 ? 679 ALA A O 1 ATOM 2889 C CB . ALA A 1 371 ? -43.275 28.535 -2.327 1.00 41.82 ? 679 ALA A CB 1 ATOM 2890 N N . GLU A 1 372 ? -42.314 31.551 -3.308 1.00 42.24 ? 680 GLU A N 1 ATOM 2891 C CA . GLU A 1 372 ? -41.959 32.425 -4.427 1.00 43.40 ? 680 GLU A CA 1 ATOM 2892 C C . GLU A 1 372 ? -40.522 32.955 -4.357 1.00 40.55 ? 680 GLU A C 1 ATOM 2893 O O . GLU A 1 372 ? -40.009 33.493 -5.339 1.00 41.68 ? 680 GLU A O 1 ATOM 2894 C CB . GLU A 1 372 ? -42.942 33.598 -4.523 1.00 47.23 ? 680 GLU A CB 1 ATOM 2895 C CG . GLU A 1 372 ? -42.920 34.519 -3.311 1.00 50.44 ? 680 GLU A CG 1 ATOM 2896 C CD . GLU A 1 372 ? -43.911 35.663 -3.418 1.00 56.56 ? 680 GLU A CD 1 ATOM 2897 O OE1 . GLU A 1 372 ? -44.366 35.964 -4.543 1.00 58.54 ? 680 GLU A OE1 1 ATOM 2898 O OE2 . GLU A 1 372 ? -44.236 36.262 -2.371 1.00 58.20 ? 680 GLU A OE2 1 ATOM 2899 N N . GLN A 1 373 ? -39.881 32.816 -3.199 1.00 35.14 ? 681 GLN A N 1 ATOM 2900 C CA . GLN A 1 373 ? -38.487 33.220 -3.052 1.00 37.01 ? 681 GLN A CA 1 ATOM 2901 C C . GLN A 1 373 ? -37.546 32.183 -3.654 1.00 32.48 ? 681 GLN A C 1 ATOM 2902 O O . GLN A 1 373 ? -36.377 32.464 -3.902 1.00 32.84 ? 681 GLN A O 1 ATOM 2903 C CB . GLN A 1 373 ? -38.121 33.393 -1.580 1.00 43.60 ? 681 GLN A CB 1 ATOM 2904 C CG . GLN A 1 373 ? -38.873 34.476 -0.838 1.00 52.49 ? 681 GLN A CG 1 ATOM 2905 C CD . GLN A 1 373 ? -38.229 34.784 0.500 1.00 57.65 ? 681 GLN A CD 1 ATOM 2906 O OE1 . GLN A 1 373 ? -37.006 34.697 0.647 1.00 59.86 ? 681 GLN A OE1 1 ATOM 2907 N NE2 . GLN A 1 373 ? -39.047 35.136 1.487 1.00 59.07 ? 681 GLN A NE2 1 ATOM 2908 N N . TYR A 1 374 ? -38.059 30.976 -3.865 1.00 28.92 ? 682 TYR A N 1 ATOM 2909 C CA . TYR A 1 374 ? -37.242 29.869 -4.338 1.00 27.62 ? 682 TYR A CA 1 ATOM 2910 C C . TYR A 1 374 ? -37.644 29.469 -5.748 1.00 28.37 ? 682 TYR A C 1 ATOM 2911 O O . TYR A 1 374 ? -38.819 29.501 -6.098 1.00 30.77 ? 682 TYR A O 1 ATOM 2912 C CB . TYR A 1 374 ? -37.399 28.657 -3.415 1.00 24.42 ? 682 TYR A CB 1 ATOM 2913 C CG . TYR A 1 374 ? -37.082 28.928 -1.967 1.00 23.27 ? 682 TYR A CG 1 ATOM 2914 C CD1 . TYR A 1 374 ? -38.028 29.491 -1.120 1.00 24.68 ? 682 TYR A CD1 1 ATOM 2915 C CD2 . TYR A 1 374 ? -35.841 28.609 -1.442 1.00 23.98 ? 682 TYR A CD2 1 ATOM 2916 C CE1 . TYR A 1 374 ? -37.740 29.735 0.208 1.00 27.14 ? 682 TYR A CE1 1 ATOM 2917 C CE2 . TYR A 1 374 ? -35.544 28.846 -0.117 1.00 26.30 ? 682 TYR A CE2 1 ATOM 2918 C CZ . TYR A 1 374 ? -36.494 29.410 0.703 1.00 25.45 ? 682 TYR A CZ 1 ATOM 2919 O OH . TYR A 1 374 ? -36.191 29.646 2.024 1.00 27.15 ? 682 TYR A OH 1 ATOM 2920 N N . SER A 1 375 ? -36.667 29.082 -6.557 1.00 27.99 ? 683 SER A N 1 ATOM 2921 C CA . SER A 1 375 ? -36.970 28.541 -7.873 1.00 29.50 ? 683 SER A CA 1 ATOM 2922 C C . SER A 1 375 ? -37.324 27.063 -7.734 1.00 28.56 ? 683 SER A C 1 ATOM 2923 O O . SER A 1 375 ? -38.106 26.526 -8.521 1.00 28.01 ? 683 SER A O 1 ATOM 2924 C CB . SER A 1 375 ? -35.783 28.718 -8.818 1.00 31.63 ? 683 SER A CB 1 ATOM 2925 O OG . SER A 1 375 ? -34.652 28.005 -8.342 1.00 30.42 ? 683 SER A OG 1 ATOM 2926 N N . GLU A 1 376 ? -36.739 26.415 -6.728 1.00 26.81 ? 684 GLU A N 1 ATOM 2927 C CA . GLU A 1 376 ? -36.984 25.000 -6.461 1.00 26.81 ? 684 GLU A CA 1 ATOM 2928 C C . GLU A 1 376 ? -38.314 24.767 -5.747 1.00 26.68 ? 684 GLU A C 1 ATOM 2929 O O . GLU A 1 376 ? -38.835 25.654 -5.061 1.00 26.24 ? 684 GLU A O 1 ATOM 2930 C CB . GLU A 1 376 ? -35.864 24.408 -5.588 1.00 25.33 ? 684 GLU A CB 1 ATOM 2931 C CG . GLU A 1 376 ? -34.447 24.659 -6.075 1.00 26.13 ? 684 GLU A CG 1 ATOM 2932 C CD . GLU A 1 376 ? -33.853 25.935 -5.511 1.00 26.80 ? 684 GLU A CD 1 ATOM 2933 O OE1 . GLU A 1 376 ? -34.616 26.777 -4.989 1.00 27.22 ? 684 GLU A OE1 1 ATOM 2934 O OE2 . GLU A 1 376 ? -32.619 26.095 -5.589 1.00 26.12 ? 684 GLU A OE2 1 ATOM 2935 N N . LYS A 1 377 ? -38.853 23.561 -5.894 1.00 25.99 ? 685 LYS A N 1 ATOM 2936 C CA . LYS A 1 377 ? -39.993 23.148 -5.089 1.00 27.11 ? 685 LYS A CA 1 ATOM 2937 C C . LYS A 1 377 ? -39.513 22.849 -3.675 1.00 26.22 ? 685 LYS A C 1 ATOM 2938 O O . LYS A 1 377 ? -38.406 22.342 -3.485 1.00 24.59 ? 685 LYS A O 1 ATOM 2939 C CB . LYS A 1 377 ? -40.655 21.907 -5.683 1.00 25.86 ? 685 LYS A CB 1 ATOM 2940 C CG . LYS A 1 377 ? -41.237 22.114 -7.075 1.00 26.97 ? 685 LYS A CG 1 ATOM 2941 C CD . LYS A 1 377 ? -42.357 23.147 -7.079 1.00 29.65 ? 685 LYS A CD 1 ATOM 2942 C CE . LYS A 1 377 ? -43.009 23.231 -8.455 1.00 32.55 ? 685 LYS A CE 1 ATOM 2943 N NZ . LYS A 1 377 ? -44.051 24.296 -8.537 1.00 33.48 ? 685 LYS A NZ 1 ATOM 2944 N N . LEU A 1 378 ? -40.346 23.159 -2.687 1.00 24.67 ? 686 LEU A N 1 ATOM 2945 C CA . LEU A 1 378 ? -39.993 22.921 -1.293 1.00 25.03 ? 686 LEU A CA 1 ATOM 2946 C C . LEU A 1 378 ? -40.165 21.453 -0.924 1.00 24.78 ? 686 LEU A C 1 ATOM 2947 O O . LEU A 1 378 ? -41.188 20.839 -1.232 1.00 26.14 ? 686 LEU A O 1 ATOM 2948 C CB . LEU A 1 378 ? -40.851 23.787 -0.368 1.00 26.99 ? 686 LEU A CB 1 ATOM 2949 C CG . LEU A 1 378 ? -40.792 25.295 -0.605 1.00 29.45 ? 686 LEU A CG 1 ATOM 2950 C CD1 . LEU A 1 378 ? -41.696 26.029 0.375 1.00 31.66 ? 686 LEU A CD1 1 ATOM 2951 C CD2 . LEU A 1 378 ? -39.356 25.799 -0.516 1.00 28.22 ? 686 LEU A CD2 1 ATOM 2952 N N . ALA A 1 379 ? -39.153 20.897 -0.268 1.00 21.45 ? 687 ALA A N 1 ATOM 2953 C CA . ALA A 1 379 ? -39.222 19.543 0.255 1.00 22.08 ? 687 ALA A CA 1 ATOM 2954 C C . ALA A 1 379 ? -38.886 19.581 1.742 1.00 22.58 ? 687 ALA A C 1 ATOM 2955 O O . ALA A 1 379 ? -37.726 19.778 2.117 1.00 19.57 ? 687 ALA A O 1 ATOM 2956 C CB . ALA A 1 379 ? -38.257 18.633 -0.492 1.00 23.17 ? 687 ALA A CB 1 ATOM 2957 N N . TYR A 1 380 ? -39.903 19.390 2.580 1.00 22.77 ? 688 TYR A N 1 ATOM 2958 C CA . TYR A 1 380 ? -39.763 19.557 4.021 1.00 22.21 ? 688 TYR A CA 1 ATOM 2959 C C . TYR A 1 380 ? -39.293 18.307 4.748 1.00 20.22 ? 688 TYR A C 1 ATOM 2960 O O . TYR A 1 380 ? -39.874 17.231 4.597 1.00 20.87 ? 688 TYR A O 1 ATOM 2961 C CB . TYR A 1 380 ? -41.100 19.949 4.654 1.00 21.56 ? 688 TYR A CB 1 ATOM 2962 C CG . TYR A 1 380 ? -41.557 21.371 4.438 1.00 22.58 ? 688 TYR A CG 1 ATOM 2963 C CD1 . TYR A 1 380 ? -40.742 22.315 3.817 1.00 21.59 ? 688 TYR A CD1 1 ATOM 2964 C CD2 . TYR A 1 380 ? -42.816 21.771 4.871 1.00 22.59 ? 688 TYR A CD2 1 ATOM 2965 C CE1 . TYR A 1 380 ? -41.187 23.624 3.630 1.00 20.69 ? 688 TYR A CE1 1 ATOM 2966 C CE2 . TYR A 1 380 ? -43.260 23.064 4.694 1.00 23.13 ? 688 TYR A CE2 1 ATOM 2967 C CZ . TYR A 1 380 ? -42.448 23.985 4.076 1.00 22.80 ? 688 TYR A CZ 1 ATOM 2968 O OH . TYR A 1 380 ? -42.916 25.271 3.906 1.00 27.00 ? 688 TYR A OH 1 ATOM 2969 N N . MET A 1 381 ? -38.255 18.471 5.554 1.00 19.03 ? 689 MET A N 1 ATOM 2970 C CA . MET A 1 381 ? -37.963 17.543 6.636 1.00 19.91 ? 689 MET A CA 1 ATOM 2971 C C . MET A 1 381 ? -38.954 17.866 7.750 1.00 20.73 ? 689 MET A C 1 ATOM 2972 O O . MET A 1 381 ? -39.430 18.997 7.843 1.00 21.74 ? 689 MET A O 1 ATOM 2973 C CB . MET A 1 381 ? -36.525 17.737 7.122 1.00 16.52 ? 689 MET A CB 1 ATOM 2974 C CG . MET A 1 381 ? -35.490 17.304 6.108 1.00 19.46 ? 689 MET A CG 1 ATOM 2975 S SD . MET A 1 381 ? -35.475 15.511 5.919 1.00 24.67 ? 689 MET A SD 1 ATOM 2976 C CE . MET A 1 381 ? -34.528 15.030 7.354 1.00 18.60 ? 689 MET A CE 1 ATOM 2977 N N . PRO A 1 382 ? -39.276 16.879 8.597 1.00 22.18 ? 690 PRO A N 1 ATOM 2978 C CA . PRO A 1 382 ? -40.372 17.077 9.553 1.00 23.42 ? 690 PRO A CA 1 ATOM 2979 C C . PRO A 1 382 ? -40.047 18.043 10.692 1.00 22.71 ? 690 PRO A C 1 ATOM 2980 O O . PRO A 1 382 ? -40.962 18.630 11.263 1.00 20.81 ? 690 PRO A O 1 ATOM 2981 C CB . PRO A 1 382 ? -40.610 15.667 10.103 1.00 24.82 ? 690 PRO A CB 1 ATOM 2982 C CG . PRO A 1 382 ? -39.308 14.987 9.959 1.00 21.19 ? 690 PRO A CG 1 ATOM 2983 C CD . PRO A 1 382 ? -38.710 15.522 8.684 1.00 21.35 ? 690 PRO A CD 1 ATOM 2984 N N . HIS A 1 383 ? -38.773 18.204 11.028 1.00 20.17 ? 691 HIS A N 1 ATOM 2985 C CA . HIS A 1 383 ? -38.418 19.106 12.119 1.00 21.98 ? 691 HIS A CA 1 ATOM 2986 C C . HIS A 1 383 ? -37.583 20.269 11.604 1.00 21.62 ? 691 HIS A C 1 ATOM 2987 O O . HIS A 1 383 ? -38.135 21.300 11.219 1.00 25.07 ? 691 HIS A O 1 ATOM 2988 C CB . HIS A 1 383 ? -37.751 18.331 13.258 1.00 22.76 ? 691 HIS A CB 1 ATOM 2989 C CG . HIS A 1 383 ? -38.655 17.308 13.872 1.00 28.34 ? 691 HIS A CG 1 ATOM 2990 N ND1 . HIS A 1 383 ? -38.522 15.957 13.636 1.00 29.13 ? 691 HIS A ND1 1 ATOM 2991 C CD2 . HIS A 1 383 ? -39.743 17.445 14.668 1.00 30.48 ? 691 HIS A CD2 1 ATOM 2992 C CE1 . HIS A 1 383 ? -39.469 15.302 14.286 1.00 30.56 ? 691 HIS A CE1 1 ATOM 2993 N NE2 . HIS A 1 383 ? -40.226 16.182 14.916 1.00 32.77 ? 691 HIS A NE2 1 ATOM 2994 N N . THR A 1 384 ? -36.267 20.107 11.561 1.00 17.76 ? 692 THR A N 1 ATOM 2995 C CA . THR A 1 384 ? -35.453 21.061 10.819 1.00 17.87 ? 692 THR A CA 1 ATOM 2996 C C . THR A 1 384 ? -34.651 20.324 9.757 1.00 17.88 ? 692 THR A C 1 ATOM 2997 O O . THR A 1 384 ? -34.423 19.119 9.877 1.00 18.72 ? 692 THR A O 1 ATOM 2998 C CB . THR A 1 384 ? -34.512 21.882 11.737 1.00 19.00 ? 692 THR A CB 1 ATOM 2999 O OG1 . THR A 1 384 ? -33.765 22.806 10.942 1.00 20.83 ? 692 THR A OG1 1 ATOM 3000 C CG2 . THR A 1 384 ? -33.554 20.982 12.499 1.00 19.35 ? 692 THR A CG2 1 ATOM 3001 N N . PHE A 1 385 ? -34.237 21.038 8.712 1.00 15.34 ? 693 PHE A N 1 ATOM 3002 C CA . PHE A 1 385 ? -33.349 20.448 7.717 1.00 16.95 ? 693 PHE A CA 1 ATOM 3003 C C . PHE A 1 385 ? -31.926 20.427 8.261 1.00 15.98 ? 693 PHE A C 1 ATOM 3004 O O . PHE A 1 385 ? -31.078 19.674 7.786 1.00 17.16 ? 693 PHE A O 1 ATOM 3005 C CB . PHE A 1 385 ? -33.401 21.220 6.393 1.00 19.50 ? 693 PHE A CB 1 ATOM 3006 C CG . PHE A 1 385 ? -32.591 22.488 6.392 1.00 18.29 ? 693 PHE A CG 1 ATOM 3007 C CD1 . PHE A 1 385 ? -31.311 22.508 5.851 1.00 18.33 ? 693 PHE A CD1 1 ATOM 3008 C CD2 . PHE A 1 385 ? -33.109 23.662 6.934 1.00 20.58 ? 693 PHE A CD2 1 ATOM 3009 C CE1 . PHE A 1 385 ? -30.555 23.674 5.853 1.00 19.80 ? 693 PHE A CE1 1 ATOM 3010 C CE2 . PHE A 1 385 ? -32.366 24.833 6.934 1.00 17.82 ? 693 PHE A CE2 1 ATOM 3011 C CZ . PHE A 1 385 ? -31.086 24.840 6.393 1.00 17.89 ? 693 PHE A CZ 1 ATOM 3012 N N . PHE A 1 386 ? -31.661 21.258 9.262 1.00 15.56 ? 694 PHE A N 1 ATOM 3013 C CA . PHE A 1 386 ? -30.316 21.306 9.819 1.00 15.09 ? 694 PHE A CA 1 ATOM 3014 C C . PHE A 1 386 ? -29.990 20.064 10.646 1.00 17.89 ? 694 PHE A C 1 ATOM 3015 O O . PHE A 1 386 ? -30.887 19.397 11.174 1.00 18.36 ? 694 PHE A O 1 ATOM 3016 C CB . PHE A 1 386 ? -30.070 22.600 10.607 1.00 16.25 ? 694 PHE A CB 1 ATOM 3017 C CG . PHE A 1 386 ? -28.808 23.288 10.205 1.00 18.24 ? 694 PHE A CG 1 ATOM 3018 C CD1 . PHE A 1 386 ? -27.662 23.163 10.971 1.00 18.38 ? 694 PHE A CD1 1 ATOM 3019 C CD2 . PHE A 1 386 ? -28.748 24.007 9.018 1.00 20.99 ? 694 PHE A CD2 1 ATOM 3020 C CE1 . PHE A 1 386 ? -26.479 23.768 10.581 1.00 21.39 ? 694 PHE A CE1 1 ATOM 3021 C CE2 . PHE A 1 386 ? -27.567 24.612 8.613 1.00 20.48 ? 694 PHE A CE2 1 ATOM 3022 C CZ . PHE A 1 386 ? -26.429 24.496 9.400 1.00 20.09 ? 694 PHE A CZ 1 ATOM 3023 N N . ILE A 1 387 ? -28.700 19.747 10.720 1.00 16.57 ? 695 ILE A N 1 ATOM 3024 C CA . ILE A 1 387 ? -28.220 18.580 11.446 1.00 15.09 ? 695 ILE A CA 1 ATOM 3025 C C . ILE A 1 387 ? -26.760 18.845 11.810 1.00 14.05 ? 695 ILE A C 1 ATOM 3026 O O . ILE A 1 387 ? -26.126 19.745 11.258 1.00 16.87 ? 695 ILE A O 1 ATOM 3027 C CB . ILE A 1 387 ? -28.371 17.292 10.589 1.00 16.80 ? 695 ILE A CB 1 ATOM 3028 C CG1 . ILE A 1 387 ? -28.086 16.019 11.403 1.00 18.70 ? 695 ILE A CG1 1 ATOM 3029 C CG2 . ILE A 1 387 ? -27.493 17.365 9.334 1.00 15.41 ? 695 ILE A CG2 1 ATOM 3030 C CD1 . ILE A 1 387 ? -29.013 15.811 12.600 1.00 16.06 ? 695 ILE A CD1 1 ATOM 3031 N N . GLY A 1 388 ? -26.225 18.087 12.754 1.00 16.10 ? 696 GLY A N 1 ATOM 3032 C CA . GLY A 1 388 ? -24.832 18.242 13.123 1.00 15.78 ? 696 GLY A CA 1 ATOM 3033 C C . GLY A 1 388 ? -24.326 16.942 13.698 1.00 15.95 ? 696 GLY A C 1 ATOM 3034 O O . GLY A 1 388 ? -25.111 16.155 14.232 1.00 17.30 ? 696 GLY A O 1 ATOM 3035 N N . ASP A 1 389 ? -23.023 16.714 13.592 1.00 14.25 ? 697 ASP A N 1 ATOM 3036 C CA . ASP A 1 389 ? -22.445 15.447 14.029 1.00 13.18 ? 697 ASP A CA 1 ATOM 3037 C C . ASP A 1 389 ? -21.918 15.508 15.461 1.00 15.40 ? 697 ASP A C 1 ATOM 3038 O O . ASP A 1 389 ? -21.150 14.639 15.882 1.00 14.82 ? 697 ASP A O 1 ATOM 3039 C CB . ASP A 1 389 ? -21.322 15.006 13.077 1.00 14.39 ? 697 ASP A CB 1 ATOM 3040 C CG . ASP A 1 389 ? -21.006 13.527 13.200 1.00 17.52 ? 697 ASP A CG 1 ATOM 3041 O OD1 . ASP A 1 389 ? -21.957 12.707 13.163 1.00 20.93 ? 697 ASP A OD1 1 ATOM 3042 O OD2 . ASP A 1 389 ? -19.812 13.183 13.341 1.00 15.64 ? 697 ASP A OD2 1 ATOM 3043 N N . HIS A 1 390 ? -22.365 16.513 16.212 1.00 13.54 ? 698 HIS A N 1 ATOM 3044 C CA . HIS A 1 390 ? -21.836 16.791 17.548 1.00 12.13 ? 698 HIS A CA 1 ATOM 3045 C C . HIS A 1 390 ? -21.893 15.620 18.528 1.00 13.02 ? 698 HIS A C 1 ATOM 3046 O O . HIS A 1 390 ? -20.984 15.457 19.341 1.00 13.82 ? 698 HIS A O 1 ATOM 3047 C CB . HIS A 1 390 ? -22.552 18.000 18.155 1.00 14.22 ? 698 HIS A CB 1 ATOM 3048 C CG . HIS A 1 390 ? -22.390 19.251 17.351 1.00 15.21 ? 698 HIS A CG 1 ATOM 3049 N ND1 . HIS A 1 390 ? -22.891 19.384 16.073 1.00 14.31 ? 698 HIS A ND1 1 ATOM 3050 C CD2 . HIS A 1 390 ? -21.766 20.417 17.635 1.00 14.90 ? 698 HIS A CD2 1 ATOM 3051 C CE1 . HIS A 1 390 ? -22.583 20.580 15.606 1.00 14.16 ? 698 HIS A CE1 1 ATOM 3052 N NE2 . HIS A 1 390 ? -21.905 21.228 16.537 1.00 15.05 ? 698 HIS A NE2 1 ATOM 3053 N N . ALA A 1 391 ? -22.949 14.809 18.463 1.00 12.31 ? 699 ALA A N 1 ATOM 3054 C CA . ALA A 1 391 ? -23.076 13.694 19.408 1.00 14.15 ? 699 ALA A CA 1 ATOM 3055 C C . ALA A 1 391 ? -21.977 12.657 19.188 1.00 17.39 ? 699 ALA A C 1 ATOM 3056 O O . ALA A 1 391 ? -21.536 11.987 20.128 1.00 18.20 ? 699 ALA A O 1 ATOM 3057 C CB . ALA A 1 391 ? -24.448 13.040 19.299 1.00 17.47 ? 699 ALA A CB 1 ATOM 3058 N N . ASN A 1 392 ? -21.541 12.534 17.939 1.00 16.14 ? 700 ASN A N 1 ATOM 3059 C CA . ASN A 1 392 ? -20.447 11.634 17.581 1.00 17.96 ? 700 ASN A CA 1 ATOM 3060 C C . ASN A 1 392 ? -19.068 12.282 17.734 1.00 18.69 ? 700 ASN A C 1 ATOM 3061 O O . ASN A 1 392 ? -18.113 11.641 18.172 1.00 17.88 ? 700 ASN A O 1 ATOM 3062 C CB . ASN A 1 392 ? -20.627 11.130 16.144 1.00 21.60 ? 700 ASN A CB 1 ATOM 3063 C CG . ASN A 1 392 ? -19.433 10.320 15.657 1.00 25.04 ? 700 ASN A CG 1 ATOM 3064 O OD1 . ASN A 1 392 ? -19.071 9.313 16.268 1.00 27.75 ? 700 ASN A OD1 1 ATOM 3065 N ND2 . ASN A 1 392 ? -18.823 10.749 14.547 1.00 22.69 ? 700 ASN A ND2 1 ATOM 3066 N N . MET A 1 393 ? -18.970 13.556 17.366 1.00 18.96 ? 701 MET A N 1 ATOM 3067 C CA . MET A 1 393 ? -17.688 14.260 17.380 1.00 17.92 ? 701 MET A CA 1 ATOM 3068 C C . MET A 1 393 ? -17.274 14.733 18.757 1.00 13.83 ? 701 MET A C 1 ATOM 3069 O O . MET A 1 393 ? -16.093 14.709 19.092 1.00 14.65 ? 701 MET A O 1 ATOM 3070 C CB . MET A 1 393 ? -17.726 15.476 16.454 1.00 16.15 ? 701 MET A CB 1 ATOM 3071 C CG . MET A 1 393 ? -17.446 15.167 15.000 1.00 16.51 ? 701 MET A CG 1 ATOM 3072 S SD . MET A 1 393 ? -17.531 16.647 13.975 1.00 17.45 ? 701 MET A SD 1 ATOM 3073 C CE . MET A 1 393 ? -16.078 17.550 14.473 1.00 14.37 ? 701 MET A CE 1 ATOM 3074 N N . PHE A 1 394 ? -18.240 15.196 19.545 1.00 13.42 ? 702 PHE A N 1 ATOM 3075 C CA . PHE A 1 394 ? -17.935 15.738 20.867 1.00 11.37 ? 702 PHE A CA 1 ATOM 3076 C C . PHE A 1 394 ? -18.740 15.071 21.984 1.00 11.71 ? 702 PHE A C 1 ATOM 3077 O O . PHE A 1 394 ? -19.432 15.755 22.736 1.00 14.00 ? 702 PHE A O 1 ATOM 3078 C CB . PHE A 1 394 ? -18.199 17.254 20.895 1.00 11.20 ? 702 PHE A CB 1 ATOM 3079 C CG . PHE A 1 394 ? -17.672 17.991 19.683 1.00 18.72 ? 702 PHE A CG 1 ATOM 3080 C CD1 . PHE A 1 394 ? -16.311 18.051 19.429 1.00 17.90 ? 702 PHE A CD1 1 ATOM 3081 C CD2 . PHE A 1 394 ? -18.541 18.634 18.813 1.00 18.87 ? 702 PHE A CD2 1 ATOM 3082 C CE1 . PHE A 1 394 ? -15.825 18.730 18.318 1.00 19.33 ? 702 PHE A CE1 1 ATOM 3083 C CE2 . PHE A 1 394 ? -18.062 19.320 17.701 1.00 16.32 ? 702 PHE A CE2 1 ATOM 3084 C CZ . PHE A 1 394 ? -16.702 19.371 17.461 1.00 20.02 ? 702 PHE A CZ 1 ATOM 3085 N N . PRO A 1 395 ? -18.636 13.740 22.114 1.00 15.17 ? 703 PRO A N 1 ATOM 3086 C CA . PRO A 1 395 ? -19.442 13.053 23.128 1.00 16.60 ? 703 PRO A CA 1 ATOM 3087 C C . PRO A 1 395 ? -18.970 13.356 24.542 1.00 16.02 ? 703 PRO A C 1 ATOM 3088 O O . PRO A 1 395 ? -19.716 13.109 25.489 1.00 13.30 ? 703 PRO A O 1 ATOM 3089 C CB . PRO A 1 395 ? -19.216 11.574 22.806 1.00 16.09 ? 703 PRO A CB 1 ATOM 3090 C CG . PRO A 1 395 ? -17.836 11.542 22.223 1.00 15.22 ? 703 PRO A CG 1 ATOM 3091 C CD . PRO A 1 395 ? -17.692 12.821 21.445 1.00 14.14 ? 703 PRO A CD 1 ATOM 3092 N N . HIS A 1 396 ? -17.763 13.902 24.683 1.00 12.92 ? 704 HIS A N 1 ATOM 3093 C CA . HIS A 1 396 ? -17.247 14.267 25.998 1.00 15.45 ? 704 HIS A CA 1 ATOM 3094 C C . HIS A 1 396 ? -17.977 15.459 26.588 1.00 13.09 ? 704 HIS A C 1 ATOM 3095 O O . HIS A 1 396 ? -17.846 15.737 27.778 1.00 14.74 ? 704 HIS A O 1 ATOM 3096 C CB . HIS A 1 396 ? -15.735 14.541 25.956 1.00 15.02 ? 704 HIS A CB 1 ATOM 3097 C CG . HIS A 1 396 ? -15.335 15.653 25.027 1.00 16.91 ? 704 HIS A CG 1 ATOM 3098 N ND1 . HIS A 1 396 ? -15.626 15.641 23.679 1.00 16.51 ? 704 HIS A ND1 1 ATOM 3099 C CD2 . HIS A 1 396 ? -14.636 16.794 25.250 1.00 15.12 ? 704 HIS A CD2 1 ATOM 3100 C CE1 . HIS A 1 396 ? -15.138 16.733 23.115 1.00 15.93 ? 704 HIS A CE1 1 ATOM 3101 N NE2 . HIS A 1 396 ? -14.530 17.448 24.045 1.00 15.15 ? 704 HIS A NE2 1 ATOM 3102 N N . LEU A 1 397 ? -18.741 16.164 25.753 1.00 14.91 ? 705 LEU A N 1 ATOM 3103 C CA . LEU A 1 397 ? -19.528 17.310 26.195 1.00 16.73 ? 705 LEU A CA 1 ATOM 3104 C C . LEU A 1 397 ? -20.975 16.946 26.532 1.00 19.79 ? 705 LEU A C 1 ATOM 3105 O O . LEU A 1 397 ? -21.772 17.822 26.855 1.00 18.27 ? 705 LEU A O 1 ATOM 3106 C CB . LEU A 1 397 ? -19.511 18.421 25.132 1.00 14.93 ? 705 LEU A CB 1 ATOM 3107 C CG . LEU A 1 397 ? -18.112 18.877 24.741 1.00 15.00 ? 705 LEU A CG 1 ATOM 3108 C CD1 . LEU A 1 397 ? -18.159 19.910 23.611 1.00 16.43 ? 705 LEU A CD1 1 ATOM 3109 C CD2 . LEU A 1 397 ? -17.384 19.439 25.964 1.00 14.84 ? 705 LEU A CD2 1 ATOM 3110 N N . LYS A 1 398 ? -21.312 15.660 26.449 1.00 19.36 ? 706 LYS A N 1 ATOM 3111 C CA . LYS A 1 398 ? -22.644 15.201 26.841 1.00 22.45 ? 706 LYS A CA 1 ATOM 3112 C C . LYS A 1 398 ? -22.897 15.415 28.326 1.00 21.25 ? 706 LYS A C 1 ATOM 3113 O O . LYS A 1 398 ? -24.020 15.687 28.742 1.00 23.17 ? 706 LYS A O 1 ATOM 3114 C CB . LYS A 1 398 ? -22.828 13.722 26.503 1.00 25.88 ? 706 LYS A CB 1 ATOM 3115 C CG . LYS A 1 398 ? -22.991 13.436 25.031 1.00 29.91 ? 706 LYS A CG 1 ATOM 3116 C CD . LYS A 1 398 ? -23.260 11.952 24.810 1.00 38.00 ? 706 LYS A CD 1 ATOM 3117 C CE . LYS A 1 398 ? -23.647 11.666 23.368 1.00 44.01 ? 706 LYS A CE 1 ATOM 3118 N NZ . LYS A 1 398 ? -22.611 12.155 22.424 1.00 45.05 ? 706 LYS A NZ 1 ATOM 3119 N N . LYS A 1 399 ? -21.847 15.283 29.127 1.00 15.87 ? 707 LYS A N 1 ATOM 3120 C CA . LYS A 1 399 ? -21.965 15.510 30.556 1.00 18.54 ? 707 LYS A CA 1 ATOM 3121 C C . LYS A 1 399 ? -20.869 16.460 31.003 1.00 18.75 ? 707 LYS A C 1 ATOM 3122 O O . LYS A 1 399 ? -19.880 16.662 30.287 1.00 17.63 ? 707 LYS A O 1 ATOM 3123 C CB . LYS A 1 399 ? -21.894 14.186 31.328 1.00 25.17 ? 707 LYS A CB 1 ATOM 3124 C CG . LYS A 1 399 ? -23.037 13.241 31.002 1.00 33.90 ? 707 LYS A CG 1 ATOM 3125 C CD . LYS A 1 399 ? -22.922 11.933 31.765 1.00 40.79 ? 707 LYS A CD 1 ATOM 3126 C CE . LYS A 1 399 ? -23.956 10.935 31.290 1.00 45.75 ? 707 LYS A CE 1 ATOM 3127 N NZ . LYS A 1 399 ? -23.703 9.587 31.865 1.00 51.39 ? 707 LYS A NZ 1 ATOM 3128 N N . LYS A 1 400 ? -21.061 17.067 32.168 1.00 16.92 ? 708 LYS A N 1 ATOM 3129 C CA . LYS A 1 400 ? -20.068 17.986 32.706 1.00 15.75 ? 708 LYS A CA 1 ATOM 3130 C C . LYS A 1 400 ? -20.048 17.914 34.213 1.00 17.94 ? 708 LYS A C 1 ATOM 3131 O O . LYS A 1 400 ? -20.964 17.375 34.828 1.00 20.22 ? 708 LYS A O 1 ATOM 3132 C CB . LYS A 1 400 ? -20.331 19.432 32.251 1.00 16.25 ? 708 LYS A CB 1 ATOM 3133 C CG . LYS A 1 400 ? -21.591 20.080 32.817 1.00 20.66 ? 708 LYS A CG 1 ATOM 3134 C CD . LYS A 1 400 ? -21.649 21.555 32.429 1.00 24.12 ? 708 LYS A CD 1 ATOM 3135 C CE . LYS A 1 400 ? -22.850 22.250 33.040 1.00 27.66 ? 708 LYS A CE 1 ATOM 3136 N NZ . LYS A 1 400 ? -24.125 21.856 32.392 1.00 28.75 ? 708 LYS A NZ 1 ATOM 3137 N N . ALA A 1 401 ? -18.979 18.428 34.806 1.00 19.68 ? 709 ALA A N 1 ATOM 3138 C CA . ALA A 1 401 ? -18.946 18.645 36.244 1.00 18.56 ? 709 ALA A CA 1 ATOM 3139 C C . ALA A 1 401 ? -18.367 20.027 36.476 1.00 17.02 ? 709 ALA A C 1 ATOM 3140 O O . ALA A 1 401 ? -17.732 20.593 35.596 1.00 15.83 ? 709 ALA A O 1 ATOM 3141 C CB . ALA A 1 401 ? -18.111 17.587 36.944 1.00 18.73 ? 709 ALA A CB 1 ATOM 3142 N N . VAL A 1 402 ? -18.612 20.597 37.645 1.00 18.32 ? 710 VAL A N 1 ATOM 3143 C CA . VAL A 1 402 ? -18.047 21.902 37.919 1.00 21.25 ? 710 VAL A CA 1 ATOM 3144 C C . VAL A 1 402 ? -17.231 21.885 39.199 1.00 21.35 ? 710 VAL A C 1 ATOM 3145 O O . VAL A 1 402 ? -17.332 20.963 40.018 1.00 25.91 ? 710 VAL A O 1 ATOM 3146 C CB . VAL A 1 402 ? -19.123 23.012 37.961 1.00 23.01 ? 710 VAL A CB 1 ATOM 3147 C CG1 . VAL A 1 402 ? -19.857 23.088 36.623 1.00 17.47 ? 710 VAL A CG1 1 ATOM 3148 C CG2 . VAL A 1 402 ? -20.096 22.771 39.109 1.00 26.28 ? 710 VAL A CG2 1 ATOM 3149 N N . ILE A 1 403 ? -16.397 22.901 39.354 1.00 22.24 ? 711 ILE A N 1 ATOM 3150 C CA . ILE A 1 403 ? -15.647 23.069 40.582 1.00 24.09 ? 711 ILE A CA 1 ATOM 3151 C C . ILE A 1 403 ? -16.189 24.296 41.290 1.00 28.42 ? 711 ILE A C 1 ATOM 3152 O O . ILE A 1 403 ? -16.201 25.385 40.719 1.00 30.86 ? 711 ILE A O 1 ATOM 3153 C CB . ILE A 1 403 ? -14.150 23.292 40.315 1.00 27.85 ? 711 ILE A CB 1 ATOM 3154 C CG1 . ILE A 1 403 ? -13.513 22.040 39.704 1.00 27.97 ? 711 ILE A CG1 1 ATOM 3155 C CG2 . ILE A 1 403 ? -13.439 23.682 41.604 1.00 32.26 ? 711 ILE A CG2 1 ATOM 3156 C CD1 . ILE A 1 403 ? -11.983 22.099 39.640 1.00 26.93 ? 711 ILE A CD1 1 ATOM 3157 N N . ASP A 1 404 ? -16.648 24.121 42.524 1.00 30.39 ? 712 ASP A N 1 ATOM 3158 C CA . ASP A 1 404 ? -17.103 25.254 43.319 1.00 41.58 ? 712 ASP A CA 1 ATOM 3159 C C . ASP A 1 404 ? -15.904 25.985 43.910 1.00 50.94 ? 712 ASP A C 1 ATOM 3160 O O . ASP A 1 404 ? -15.211 25.458 44.785 1.00 54.66 ? 712 ASP A O 1 ATOM 3161 C CB . ASP A 1 404 ? -18.044 24.798 44.431 1.00 44.89 ? 712 ASP A CB 1 ATOM 3162 C CG . ASP A 1 404 ? -18.598 25.958 45.231 1.00 52.78 ? 712 ASP A CG 1 ATOM 3163 O OD1 . ASP A 1 404 ? -18.849 25.777 46.441 1.00 56.41 ? 712 ASP A OD1 1 ATOM 3164 O OD2 . ASP A 1 404 ? -18.780 27.050 44.648 1.00 53.93 ? 712 ASP A OD2 1 ATOM 3165 N N . PHE A 1 405 ? -15.665 27.199 43.424 1.00 54.52 ? 713 PHE A N 1 ATOM 3166 C CA . PHE A 1 405 ? -14.510 27.983 43.844 1.00 59.78 ? 713 PHE A CA 1 ATOM 3167 C C . PHE A 1 405 ? -14.887 29.051 44.873 1.00 68.92 ? 713 PHE A C 1 ATOM 3168 O O . PHE A 1 405 ? -14.158 30.025 45.069 1.00 73.71 ? 713 PHE A O 1 ATOM 3169 C CB . PHE A 1 405 ? -13.811 28.607 42.628 1.00 58.47 ? 713 PHE A CB 1 ATOM 3170 C CG . PHE A 1 405 ? -14.629 29.652 41.919 1.00 60.09 ? 713 PHE A CG 1 ATOM 3171 C CD1 . PHE A 1 405 ? -15.699 29.290 41.115 1.00 55.81 ? 713 PHE A CD1 1 ATOM 3172 C CD2 . PHE A 1 405 ? -14.318 30.996 42.044 1.00 64.92 ? 713 PHE A CD2 1 ATOM 3173 C CE1 . PHE A 1 405 ? -16.453 30.249 40.464 1.00 56.12 ? 713 PHE A CE1 1 ATOM 3174 C CE2 . PHE A 1 405 ? -15.066 31.963 41.392 1.00 65.71 ? 713 PHE A CE2 1 ATOM 3175 C CZ . PHE A 1 405 ? -16.134 31.589 40.600 1.00 61.63 ? 713 PHE A CZ 1 ATOM 3176 N N . LYS A 1 406 ? -16.024 28.850 45.533 1.00 71.08 ? 714 LYS A N 1 ATOM 3177 C CA . LYS A 1 406 ? -16.484 29.754 46.586 1.00 75.92 ? 714 LYS A CA 1 ATOM 3178 C C . LYS A 1 406 ? -16.824 28.993 47.864 1.00 74.53 ? 714 LYS A C 1 ATOM 3179 O O . LYS A 1 406 ? -17.923 29.128 48.406 1.00 74.14 ? 714 LYS A O 1 ATOM 3180 C CB . LYS A 1 406 ? -17.704 30.551 46.122 1.00 78.02 ? 714 LYS A CB 1 ATOM 3181 C CG . LYS A 1 406 ? -17.441 31.483 44.950 1.00 77.68 ? 714 LYS A CG 1 ATOM 3182 C CD . LYS A 1 406 ? -18.643 32.378 44.693 1.00 79.71 ? 714 LYS A CD 1 ATOM 3183 C CE . LYS A 1 406 ? -18.329 33.450 43.664 1.00 78.82 ? 714 LYS A CE 1 ATOM 3184 N NZ . LYS A 1 406 ? -19.450 34.422 43.519 1.00 80.09 ? 714 LYS A NZ 1 ATOM 3185 N N . HIS A 1 410 ? -22.367 30.739 46.152 1.00 80.41 ? 718 HIS A N 1 ATOM 3186 C CA . HIS A 1 410 ? -23.348 29.899 45.475 1.00 76.64 ? 718 HIS A CA 1 ATOM 3187 C C . HIS A 1 410 ? -22.673 28.967 44.477 1.00 67.28 ? 718 HIS A C 1 ATOM 3188 O O . HIS A 1 410 ? -21.448 28.950 44.366 1.00 67.49 ? 718 HIS A O 1 ATOM 3189 C CB . HIS A 1 410 ? -24.395 30.761 44.766 1.00 80.92 ? 718 HIS A CB 1 ATOM 3190 C CG . HIS A 1 410 ? -25.224 31.592 45.697 1.00 90.53 ? 718 HIS A CG 1 ATOM 3191 N ND1 . HIS A 1 410 ? -26.356 31.109 46.318 1.00 93.26 ? 718 HIS A ND1 1 ATOM 3192 C CD2 . HIS A 1 410 ? -25.085 32.874 46.112 1.00 97.64 ? 718 HIS A CD2 1 ATOM 3193 C CE1 . HIS A 1 410 ? -26.878 32.057 47.076 1.00 100.26 ? 718 HIS A CE1 1 ATOM 3194 N NE2 . HIS A 1 410 ? -26.126 33.138 46.969 1.00 103.04 ? 718 HIS A NE2 1 ATOM 3195 N N . ILE A 1 411 ? -23.477 28.191 43.756 1.00 45.38 ? 719 ILE A N 1 ATOM 3196 C CA . ILE A 1 411 ? -22.950 27.263 42.748 1.00 41.30 ? 719 ILE A CA 1 ATOM 3197 C C . ILE A 1 411 ? -23.222 27.740 41.315 1.00 37.54 ? 719 ILE A C 1 ATOM 3198 O O . ILE A 1 411 ? -24.344 28.102 40.968 1.00 39.63 ? 719 ILE A O 1 ATOM 3199 C CB . ILE A 1 411 ? -23.494 25.834 42.971 1.00 43.65 ? 719 ILE A CB 1 ATOM 3200 C CG1 . ILE A 1 411 ? -23.014 25.302 44.326 1.00 46.16 ? 719 ILE A CG1 1 ATOM 3201 C CG2 . ILE A 1 411 ? -23.065 24.899 41.836 1.00 43.30 ? 719 ILE A CG2 1 ATOM 3202 C CD1 . ILE A 1 411 ? -23.572 23.950 44.697 1.00 47.89 ? 719 ILE A CD1 1 ATOM 3203 N N . TYR A 1 412 ? -22.174 27.754 40.496 1.00 34.26 ? 720 TYR A N 1 ATOM 3204 C CA . TYR A 1 412 ? -22.260 28.201 39.109 1.00 30.77 ? 720 TYR A CA 1 ATOM 3205 C C . TYR A 1 412 ? -22.078 27.005 38.175 1.00 27.22 ? 720 TYR A C 1 ATOM 3206 O O . TYR A 1 412 ? -21.237 26.144 38.441 1.00 26.00 ? 720 TYR A O 1 ATOM 3207 C CB . TYR A 1 412 ? -21.137 29.197 38.814 1.00 31.88 ? 720 TYR A CB 1 ATOM 3208 C CG . TYR A 1 412 ? -21.235 30.537 39.512 1.00 35.29 ? 720 TYR A CG 1 ATOM 3209 C CD1 . TYR A 1 412 ? -22.452 31.188 39.655 1.00 38.38 ? 720 TYR A CD1 1 ATOM 3210 C CD2 . TYR A 1 412 ? -20.095 31.162 40.008 1.00 39.31 ? 720 TYR A CD2 1 ATOM 3211 C CE1 . TYR A 1 412 ? -22.533 32.423 40.292 1.00 42.09 ? 720 TYR A CE1 1 ATOM 3212 C CE2 . TYR A 1 412 ? -20.160 32.392 40.632 1.00 41.07 ? 720 TYR A CE2 1 ATOM 3213 C CZ . TYR A 1 412 ? -21.381 33.019 40.775 1.00 44.23 ? 720 TYR A CZ 1 ATOM 3214 O OH . TYR A 1 412 ? -21.441 34.243 41.406 1.00 46.87 ? 720 TYR A OH 1 ATOM 3215 N N . ASP A 1 413 ? -22.820 26.970 37.069 1.00 20.71 ? 721 ASP A N 1 ATOM 3216 C CA . ASP A 1 413 ? -22.660 25.877 36.098 1.00 20.61 ? 721 ASP A CA 1 ATOM 3217 C C . ASP A 1 413 ? -21.696 26.194 34.951 1.00 22.67 ? 721 ASP A C 1 ATOM 3218 O O . ASP A 1 413 ? -21.521 25.368 34.048 1.00 20.06 ? 721 ASP A O 1 ATOM 3219 C CB . ASP A 1 413 ? -24.019 25.432 35.526 1.00 24.92 ? 721 ASP A CB 1 ATOM 3220 C CG . ASP A 1 413 ? -24.637 26.457 34.575 1.00 27.50 ? 721 ASP A CG 1 ATOM 3221 O OD1 . ASP A 1 413 ? -24.119 27.587 34.475 1.00 25.70 ? 721 ASP A OD1 1 ATOM 3222 O OD2 . ASP A 1 413 ? -25.667 26.140 33.937 1.00 28.94 ? 721 ASP A OD2 1 ATOM 3223 N N . ASN A 1 414 ? -21.069 27.370 34.980 1.00 22.35 ? 722 ASN A N 1 ATOM 3224 C CA . ASN A 1 414 ? -20.304 27.822 33.814 1.00 19.37 ? 722 ASN A CA 1 ATOM 3225 C C . ASN A 1 414 ? -19.095 28.713 34.107 1.00 20.23 ? 722 ASN A C 1 ATOM 3226 O O . ASN A 1 414 ? -18.694 29.541 33.265 1.00 18.64 ? 722 ASN A O 1 ATOM 3227 C CB . ASN A 1 414 ? -21.234 28.517 32.815 1.00 16.86 ? 722 ASN A CB 1 ATOM 3228 C CG . ASN A 1 414 ? -21.899 29.749 33.396 1.00 21.28 ? 722 ASN A CG 1 ATOM 3229 O OD1 . ASN A 1 414 ? -21.639 30.129 34.537 1.00 18.93 ? 722 ASN A OD1 1 ATOM 3230 N ND2 . ASN A 1 414 ? -22.762 30.388 32.606 1.00 22.42 ? 722 ASN A ND2 1 ATOM 3231 N N . ARG A 1 415 ? -18.522 28.542 35.295 1.00 19.31 ? 723 ARG A N 1 ATOM 3232 C CA . ARG A 1 415 ? -17.310 29.261 35.685 1.00 18.87 ? 723 ARG A CA 1 ATOM 3233 C C . ARG A 1 415 ? -16.065 28.381 35.554 1.00 20.15 ? 723 ARG A C 1 ATOM 3234 O O . ARG A 1 415 ? -15.067 28.786 34.945 1.00 16.27 ? 723 ARG A O 1 ATOM 3235 C CB . ARG A 1 415 ? -17.434 29.775 37.120 1.00 23.08 ? 723 ARG A CB 1 ATOM 3236 C CG . ARG A 1 415 ? -17.911 31.218 37.224 1.00 26.77 ? 723 ARG A CG 1 ATOM 3237 C CD . ARG A 1 415 ? -19.300 31.419 36.638 1.00 28.36 ? 723 ARG A CD 1 ATOM 3238 N NE . ARG A 1 415 ? -19.847 32.722 37.020 1.00 26.53 ? 723 ARG A NE 1 ATOM 3239 C CZ . ARG A 1 415 ? -21.069 33.150 36.714 1.00 27.91 ? 723 ARG A CZ 1 ATOM 3240 N NH1 . ARG A 1 415 ? -21.902 32.378 36.023 1.00 26.38 ? 723 ARG A NH1 1 ATOM 3241 N NH2 . ARG A 1 415 ? -21.463 34.354 37.106 1.00 27.20 ? 723 ARG A NH2 1 ATOM 3242 N N . ILE A 1 416 ? -16.131 27.185 36.142 1.00 15.59 ? 724 ILE A N 1 ATOM 3243 C CA . ILE A 1 416 ? -15.063 26.194 36.023 1.00 20.64 ? 724 ILE A CA 1 ATOM 3244 C C . ILE A 1 416 ? -15.667 24.834 35.723 1.00 17.87 ? 724 ILE A C 1 ATOM 3245 O O . ILE A 1 416 ? -16.359 24.258 36.565 1.00 20.73 ? 724 ILE A O 1 ATOM 3246 C CB . ILE A 1 416 ? -14.234 26.071 37.311 1.00 22.92 ? 724 ILE A CB 1 ATOM 3247 C CG1 . ILE A 1 416 ? -13.693 27.445 37.725 1.00 22.68 ? 724 ILE A CG1 1 ATOM 3248 C CG2 . ILE A 1 416 ? -13.089 25.078 37.091 1.00 24.51 ? 724 ILE A CG2 1 ATOM 3249 C CD1 . ILE A 1 416 ? -12.943 27.452 39.032 1.00 22.73 ? 724 ILE A CD1 1 ATOM 3250 N N . VAL A 1 417 ? -15.383 24.325 34.531 1.00 14.50 ? 725 VAL A N 1 ATOM 3251 C CA . VAL A 1 417 ? -16.074 23.161 33.990 1.00 13.32 ? 725 VAL A CA 1 ATOM 3252 C C . VAL A 1 417 ? -15.084 22.054 33.624 1.00 14.56 ? 725 VAL A C 1 ATOM 3253 O O . VAL A 1 417 ? -14.007 22.333 33.120 1.00 17.07 ? 725 VAL A O 1 ATOM 3254 C CB . VAL A 1 417 ? -16.880 23.560 32.724 1.00 17.06 ? 725 VAL A CB 1 ATOM 3255 C CG1 . VAL A 1 417 ? -17.608 22.361 32.120 1.00 15.15 ? 725 VAL A CG1 1 ATOM 3256 C CG2 . VAL A 1 417 ? -17.865 24.679 33.043 1.00 21.11 ? 725 VAL A CG2 1 ATOM 3257 N N . LEU A 1 418 ? -15.448 20.806 33.913 1.00 13.83 ? 726 LEU A N 1 ATOM 3258 C CA . LEU A 1 418 ? -14.677 19.639 33.483 1.00 13.51 ? 726 LEU A CA 1 ATOM 3259 C C . LEU A 1 418 ? -15.541 18.819 32.533 1.00 13.73 ? 726 LEU A C 1 ATOM 3260 O O . LEU A 1 418 ? -16.754 18.713 32.736 1.00 15.01 ? 726 LEU A O 1 ATOM 3261 C CB . LEU A 1 418 ? -14.305 18.752 34.678 1.00 20.71 ? 726 LEU A CB 1 ATOM 3262 C CG . LEU A 1 418 ? -13.457 19.306 35.825 1.00 27.08 ? 726 LEU A CG 1 ATOM 3263 C CD1 . LEU A 1 418 ? -13.311 18.270 36.935 1.00 29.09 ? 726 LEU A CD1 1 ATOM 3264 C CD2 . LEU A 1 418 ? -12.102 19.717 35.339 1.00 26.42 ? 726 LEU A CD2 1 ATOM 3265 N N . ASN A 1 419 ? -14.921 18.240 31.503 1.00 11.38 ? 727 ASN A N 1 ATOM 3266 C CA . ASN A 1 419 ? -15.594 17.310 30.599 1.00 13.71 ? 727 ASN A CA 1 ATOM 3267 C C . ASN A 1 419 ? -14.631 16.176 30.275 1.00 15.91 ? 727 ASN A C 1 ATOM 3268 O O . ASN A 1 419 ? -13.435 16.398 30.122 1.00 17.88 ? 727 ASN A O 1 ATOM 3269 C CB . ASN A 1 419 ? -15.952 17.957 29.259 1.00 15.35 ? 727 ASN A CB 1 ATOM 3270 C CG . ASN A 1 419 ? -16.861 19.163 29.393 1.00 15.18 ? 727 ASN A CG 1 ATOM 3271 O OD1 . ASN A 1 419 ? -16.398 20.302 29.360 1.00 15.49 ? 727 ASN A OD1 1 ATOM 3272 N ND2 . ASN A 1 419 ? -18.168 18.917 29.487 1.00 12.68 ? 727 ASN A ND2 1 ATOM 3273 N N . GLY A 1 420 ? -15.150 14.970 30.122 1.00 16.15 ? 728 GLY A N 1 ATOM 3274 C CA . GLY A 1 420 ? -14.301 13.874 29.689 1.00 15.31 ? 728 GLY A CA 1 ATOM 3275 C C . GLY A 1 420 ? -15.039 12.561 29.631 1.00 16.33 ? 728 GLY A C 1 ATOM 3276 O O . GLY A 1 420 ? -15.970 12.322 30.402 1.00 14.65 ? 728 GLY A O 1 ATOM 3277 N N . ILE A 1 421 ? -14.607 11.705 28.714 1.00 18.00 ? 729 ILE A N 1 ATOM 3278 C CA . ILE A 1 421 ? -15.144 10.355 28.597 1.00 20.41 ? 729 ILE A CA 1 ATOM 3279 C C . ILE A 1 421 ? -14.998 9.598 29.916 1.00 19.88 ? 729 ILE A C 1 ATOM 3280 O O . ILE A 1 421 ? -15.845 8.776 30.268 1.00 19.98 ? 729 ILE A O 1 ATOM 3281 C CB . ILE A 1 421 ? -14.429 9.587 27.465 1.00 23.06 ? 729 ILE A CB 1 ATOM 3282 C CG1 . ILE A 1 421 ? -14.679 10.284 26.123 1.00 22.85 ? 729 ILE A CG1 1 ATOM 3283 C CG2 . ILE A 1 421 ? -14.894 8.136 27.403 1.00 28.17 ? 729 ILE A CG2 1 ATOM 3284 C CD1 . ILE A 1 421 ? -16.140 10.328 25.731 1.00 26.11 ? 729 ILE A CD1 1 ATOM 3285 N N . ASP A 1 422 ? -13.929 9.893 30.653 1.00 17.00 ? 730 ASP A N 1 ATOM 3286 C CA . ASP A 1 422 ? -13.669 9.212 31.917 1.00 18.02 ? 730 ASP A CA 1 ATOM 3287 C C . ASP A 1 422 ? -13.958 10.106 33.135 1.00 16.94 ? 730 ASP A C 1 ATOM 3288 O O . ASP A 1 422 ? -13.469 9.857 34.233 1.00 17.09 ? 730 ASP A O 1 ATOM 3289 C CB . ASP A 1 422 ? -12.223 8.709 31.947 1.00 20.49 ? 730 ASP A CB 1 ATOM 3290 C CG . ASP A 1 422 ? -11.889 7.815 30.755 1.00 23.95 ? 730 ASP A CG 1 ATOM 3291 O OD1 . ASP A 1 422 ? -12.616 6.824 30.531 1.00 24.71 ? 730 ASP A OD1 1 ATOM 3292 O OD2 . ASP A 1 422 ? -10.906 8.113 30.035 1.00 26.51 ? 730 ASP A OD2 1 ATOM 3293 N N . LEU A 1 423 ? -14.764 11.141 32.936 1.00 18.49 ? 731 LEU A N 1 ATOM 3294 C CA . LEU A 1 423 ? -15.095 12.073 34.018 1.00 19.99 ? 731 LEU A CA 1 ATOM 3295 C C . LEU A 1 423 ? -15.757 11.387 35.210 1.00 20.25 ? 731 LEU A C 1 ATOM 3296 O O . LEU A 1 423 ? -15.475 11.718 36.365 1.00 20.27 ? 731 LEU A O 1 ATOM 3297 C CB . LEU A 1 423 ? -16.005 13.191 33.505 1.00 21.48 ? 731 LEU A CB 1 ATOM 3298 C CG . LEU A 1 423 ? -16.429 14.213 34.568 1.00 21.71 ? 731 LEU A CG 1 ATOM 3299 C CD1 . LEU A 1 423 ? -15.206 14.891 35.141 1.00 20.28 ? 731 LEU A CD1 1 ATOM 3300 C CD2 . LEU A 1 423 ? -17.388 15.247 33.999 1.00 22.02 ? 731 LEU A CD2 1 ATOM 3301 N N . LYS A 1 424 ? -16.648 10.438 34.933 1.00 18.58 ? 732 LYS A N 1 ATOM 3302 C CA . LYS A 1 424 ? -17.345 9.744 36.012 1.00 19.85 ? 732 LYS A CA 1 ATOM 3303 C C . LYS A 1 424 ? -16.371 9.025 36.941 1.00 20.32 ? 732 LYS A C 1 ATOM 3304 O O . LYS A 1 424 ? -16.434 9.188 38.158 1.00 21.39 ? 732 LYS A O 1 ATOM 3305 C CB . LYS A 1 424 ? -18.379 8.761 35.469 1.00 23.58 ? 732 LYS A CB 1 ATOM 3306 C CG . LYS A 1 424 ? -19.193 8.075 36.563 1.00 33.20 ? 732 LYS A CG 1 ATOM 3307 C CD . LYS A 1 424 ? -20.222 7.123 35.981 1.00 41.23 ? 732 LYS A CD 1 ATOM 3308 C CE . LYS A 1 424 ? -20.951 6.376 37.083 1.00 47.96 ? 732 LYS A CE 1 ATOM 3309 N NZ . LYS A 1 424 ? -21.861 5.335 36.531 1.00 52.71 ? 732 LYS A NZ 1 ATOM 3310 N N . ALA A 1 425 ? -15.477 8.229 36.360 1.00 21.01 ? 733 ALA A N 1 ATOM 3311 C CA . ALA A 1 425 ? -14.470 7.504 37.131 1.00 22.64 ? 733 ALA A CA 1 ATOM 3312 C C . ALA A 1 425 ? -13.601 8.448 37.971 1.00 19.21 ? 733 ALA A C 1 ATOM 3313 O O . ALA A 1 425 ? -13.291 8.159 39.124 1.00 21.00 ? 733 ALA A O 1 ATOM 3314 C CB . ALA A 1 425 ? -13.602 6.657 36.202 1.00 25.88 ? 733 ALA A CB 1 ATOM 3315 N N . PHE A 1 426 ? -13.216 9.575 37.387 1.00 18.12 ? 734 PHE A N 1 ATOM 3316 C CA . PHE A 1 426 ? -12.441 10.581 38.102 1.00 19.62 ? 734 PHE A CA 1 ATOM 3317 C C . PHE A 1 426 ? -13.219 11.129 39.293 1.00 20.58 ? 734 PHE A C 1 ATOM 3318 O O . PHE A 1 426 ? -12.692 11.197 40.406 1.00 21.98 ? 734 PHE A O 1 ATOM 3319 C CB . PHE A 1 426 ? -12.057 11.727 37.158 1.00 19.84 ? 734 PHE A CB 1 ATOM 3320 C CG . PHE A 1 426 ? -11.481 12.929 37.864 1.00 21.97 ? 734 PHE A CG 1 ATOM 3321 C CD1 . PHE A 1 426 ? -12.118 14.161 37.800 1.00 23.28 ? 734 PHE A CD1 1 ATOM 3322 C CD2 . PHE A 1 426 ? -10.314 12.820 38.605 1.00 23.45 ? 734 PHE A CD2 1 ATOM 3323 C CE1 . PHE A 1 426 ? -11.589 15.266 38.448 1.00 25.32 ? 734 PHE A CE1 1 ATOM 3324 C CE2 . PHE A 1 426 ? -9.784 13.923 39.266 1.00 26.13 ? 734 PHE A CE2 1 ATOM 3325 C CZ . PHE A 1 426 ? -10.420 15.142 39.185 1.00 22.24 ? 734 PHE A CZ 1 ATOM 3326 N N . LEU A 1 427 ? -14.477 11.501 39.060 1.00 22.06 ? 735 LEU A N 1 ATOM 3327 C CA . LEU A 1 427 ? -15.340 11.983 40.137 1.00 25.58 ? 735 LEU A CA 1 ATOM 3328 C C . LEU A 1 427 ? -15.453 10.932 41.237 1.00 28.64 ? 735 LEU A C 1 ATOM 3329 O O . LEU A 1 427 ? -15.388 11.260 42.420 1.00 26.04 ? 735 LEU A O 1 ATOM 3330 C CB . LEU A 1 427 ? -16.730 12.358 39.615 1.00 27.39 ? 735 LEU A CB 1 ATOM 3331 C CG . LEU A 1 427 ? -16.847 13.544 38.646 1.00 26.66 ? 735 LEU A CG 1 ATOM 3332 C CD1 . LEU A 1 427 ? -18.266 13.646 38.104 1.00 27.88 ? 735 LEU A CD1 1 ATOM 3333 C CD2 . LEU A 1 427 ? -16.432 14.861 39.296 1.00 28.30 ? 735 LEU A CD2 1 ATOM 3334 N N . ASP A 1 428 ? -15.594 9.668 40.840 1.00 27.02 ? 736 ASP A N 1 ATOM 3335 C CA . ASP A 1 428 ? -15.725 8.566 41.794 1.00 30.03 ? 736 ASP A CA 1 ATOM 3336 C C . ASP A 1 428 ? -14.496 8.372 42.691 1.00 30.81 ? 736 ASP A C 1 ATOM 3337 O O . ASP A 1 428 ? -14.585 7.728 43.732 1.00 32.99 ? 736 ASP A O 1 ATOM 3338 C CB . ASP A 1 428 ? -16.044 7.245 41.074 1.00 33.53 ? 736 ASP A CB 1 ATOM 3339 C CG . ASP A 1 428 ? -17.475 7.185 40.548 1.00 38.06 ? 736 ASP A CG 1 ATOM 3340 O OD1 . ASP A 1 428 ? -18.318 7.987 40.998 1.00 41.64 ? 736 ASP A OD1 1 ATOM 3341 O OD2 . ASP A 1 428 ? -17.758 6.325 39.684 1.00 37.26 ? 736 ASP A OD2 1 ATOM 3342 N N . SER A 1 429 ? -13.353 8.918 42.284 1.00 26.44 ? 737 SER A N 1 ATOM 3343 C CA . SER A 1 429 ? -12.126 8.765 43.053 1.00 27.45 ? 737 SER A CA 1 ATOM 3344 C C . SER A 1 429 ? -11.997 9.888 44.065 1.00 31.62 ? 737 SER A C 1 ATOM 3345 O O . SER A 1 429 ? -11.113 9.864 44.919 1.00 32.08 ? 737 SER A O 1 ATOM 3346 C CB . SER A 1 429 ? -10.904 8.770 42.131 1.00 27.81 ? 737 SER A CB 1 ATOM 3347 O OG . SER A 1 429 ? -10.618 10.084 41.674 1.00 28.20 ? 737 SER A OG 1 ATOM 3348 N N . LEU A 1 430 ? -12.873 10.881 43.948 1.00 33.46 ? 738 LEU A N 1 ATOM 3349 C CA . LEU A 1 430 ? -12.838 12.050 44.820 1.00 37.86 ? 738 LEU A CA 1 ATOM 3350 C C . LEU A 1 430 ? -13.847 11.940 45.952 1.00 43.42 ? 738 LEU A C 1 ATOM 3351 O O . LEU A 1 430 ? -14.981 11.508 45.743 1.00 44.80 ? 738 LEU A O 1 ATOM 3352 C CB . LEU A 1 430 ? -13.145 13.315 44.022 1.00 36.59 ? 738 LEU A CB 1 ATOM 3353 C CG . LEU A 1 430 ? -12.224 13.671 42.858 1.00 34.89 ? 738 LEU A CG 1 ATOM 3354 C CD1 . LEU A 1 430 ? -12.822 14.824 42.053 1.00 34.48 ? 738 LEU A CD1 1 ATOM 3355 C CD2 . LEU A 1 430 ? -10.843 14.028 43.373 1.00 35.28 ? 738 LEU A CD2 1 ATOM 3356 N N . PRO A 1 431 ? -13.440 12.339 47.159 1.00 48.22 ? 739 PRO A N 1 ATOM 3357 C CA . PRO A 1 431 ? -14.400 12.448 48.258 1.00 54.07 ? 739 PRO A CA 1 ATOM 3358 C C . PRO A 1 431 ? -15.091 13.806 48.206 1.00 56.53 ? 739 PRO A C 1 ATOM 3359 O O . PRO A 1 431 ? -14.590 14.718 47.547 1.00 56.47 ? 739 PRO A O 1 ATOM 3360 C CB . PRO A 1 431 ? -13.510 12.354 49.496 1.00 55.22 ? 739 PRO A CB 1 ATOM 3361 C CG . PRO A 1 431 ? -12.219 12.965 49.058 1.00 53.57 ? 739 PRO A CG 1 ATOM 3362 C CD . PRO A 1 431 ? -12.060 12.618 47.594 1.00 50.72 ? 739 PRO A CD 1 ATOM 3363 N N . ASP A 1 432 ? -16.233 13.920 48.875 1.00 60.82 ? 740 ASP A N 1 ATOM 3364 C CA . ASP A 1 432 ? -16.944 15.190 49.028 1.00 62.21 ? 740 ASP A CA 1 ATOM 3365 C C . ASP A 1 432 ? -17.513 15.771 47.731 1.00 55.19 ? 740 ASP A C 1 ATOM 3366 O O . ASP A 1 432 ? -17.836 16.956 47.679 1.00 54.81 ? 740 ASP A O 1 ATOM 3367 C CB . ASP A 1 432 ? -16.062 16.230 49.730 1.00 68.89 ? 740 ASP A CB 1 ATOM 3368 C CG . ASP A 1 432 ? -15.565 15.755 51.084 1.00 76.67 ? 740 ASP A CG 1 ATOM 3369 O OD1 . ASP A 1 432 ? -16.371 15.184 51.853 1.00 79.07 ? 740 ASP A OD1 1 ATOM 3370 O OD2 . ASP A 1 432 ? -14.365 15.948 51.376 1.00 79.15 ? 740 ASP A OD2 1 ATOM 3371 N N . VAL A 1 433 ? -17.636 14.946 46.694 1.00 47.20 ? 741 VAL A N 1 ATOM 3372 C CA . VAL A 1 433 ? -18.332 15.358 45.478 1.00 41.69 ? 741 VAL A CA 1 ATOM 3373 C C . VAL A 1 433 ? -19.835 15.445 45.744 1.00 40.43 ? 741 VAL A C 1 ATOM 3374 O O . VAL A 1 433 ? -20.429 14.512 46.282 1.00 37.57 ? 741 VAL A O 1 ATOM 3375 C CB . VAL A 1 433 ? -18.080 14.382 44.306 1.00 39.18 ? 741 VAL A CB 1 ATOM 3376 C CG1 . VAL A 1 433 ? -19.003 14.699 43.135 1.00 38.28 ? 741 VAL A CG1 1 ATOM 3377 C CG2 . VAL A 1 433 ? -16.629 14.440 43.869 1.00 39.05 ? 741 VAL A CG2 1 ATOM 3378 N N . LYS A 1 434 ? -20.439 16.569 45.372 1.00 40.47 ? 742 LYS A N 1 ATOM 3379 C CA . LYS A 1 434 ? -21.862 16.795 45.595 1.00 44.54 ? 742 LYS A CA 1 ATOM 3380 C C . LYS A 1 434 ? -22.644 16.775 44.284 1.00 44.75 ? 742 LYS A C 1 ATOM 3381 O O . LYS A 1 434 ? -22.170 17.266 43.261 1.00 42.87 ? 742 LYS A O 1 ATOM 3382 C CB . LYS A 1 434 ? -22.077 18.136 46.304 1.00 48.66 ? 742 LYS A CB 1 ATOM 3383 C CG . LYS A 1 434 ? -23.533 18.461 46.602 1.00 54.39 ? 742 LYS A CG 1 ATOM 3384 C CD . LYS A 1 434 ? -23.703 19.899 47.078 1.00 56.59 ? 742 LYS A CD 1 ATOM 3385 C CE . LYS A 1 434 ? -25.173 20.244 47.275 1.00 58.26 ? 742 LYS A CE 1 ATOM 3386 N NZ . LYS A 1 434 ? -25.372 21.688 47.583 1.00 59.00 ? 742 LYS A NZ 1 ATOM 3387 N N . ILE A 1 435 ? -23.846 16.211 44.321 1.00 46.23 ? 743 ILE A N 1 ATOM 3388 C CA . ILE A 1 435 ? -24.721 16.209 43.155 1.00 43.45 ? 743 ILE A CA 1 ATOM 3389 C C . ILE A 1 435 ? -25.828 17.245 43.314 1.00 44.35 ? 743 ILE A C 1 ATOM 3390 O O . ILE A 1 435 ? -26.607 17.193 44.266 1.00 44.74 ? 743 ILE A O 1 ATOM 3391 C CB . ILE A 1 435 ? -25.350 14.822 42.921 1.00 43.60 ? 743 ILE A CB 1 ATOM 3392 C CG1 . ILE A 1 435 ? -24.260 13.756 42.796 1.00 40.79 ? 743 ILE A CG1 1 ATOM 3393 C CG2 . ILE A 1 435 ? -26.239 14.847 41.686 1.00 44.45 ? 743 ILE A CG2 1 ATOM 3394 C CD1 . ILE A 1 435 ? -23.284 14.003 41.658 1.00 40.84 ? 743 ILE A CD1 1 ATOM 3395 N N . VAL A 1 436 ? -25.890 18.193 42.386 1.00 42.18 ? 744 VAL A N 1 ATOM 3396 C CA . VAL A 1 436 ? -26.912 19.231 42.429 1.00 44.43 ? 744 VAL A CA 1 ATOM 3397 C C . VAL A 1 436 ? -28.020 18.929 41.427 1.00 48.42 ? 744 VAL A C 1 ATOM 3398 O O . VAL A 1 436 ? -27.750 18.662 40.257 1.00 46.06 ? 744 VAL A O 1 ATOM 3399 C CB . VAL A 1 436 ? -26.315 20.629 42.145 1.00 41.15 ? 744 VAL A CB 1 ATOM 3400 C CG1 . VAL A 1 436 ? -27.410 21.688 42.131 1.00 45.03 ? 744 VAL A CG1 1 ATOM 3401 C CG2 . VAL A 1 436 ? -25.264 20.971 43.176 1.00 38.92 ? 744 VAL A CG2 1 ATOM 3402 N N . LYS A 1 437 ? -29.264 18.970 41.900 1.00 53.50 ? 745 LYS A N 1 ATOM 3403 C CA . LYS A 1 437 ? -30.426 18.670 41.068 1.00 55.75 ? 745 LYS A CA 1 ATOM 3404 C C . LYS A 1 437 ? -31.192 19.937 40.697 1.00 55.12 ? 745 LYS A C 1 ATOM 3405 O O . LYS A 1 437 ? -30.717 21.050 40.918 1.00 55.64 ? 745 LYS A O 1 ATOM 3406 C CB . LYS A 1 437 ? -31.364 17.696 41.789 1.00 59.35 ? 745 LYS A CB 1 ATOM 3407 C CG . LYS A 1 437 ? -30.751 16.335 42.100 1.00 59.66 ? 745 LYS A CG 1 ATOM 3408 C CD . LYS A 1 437 ? -31.772 15.411 42.753 1.00 62.45 ? 745 LYS A CD 1 ATOM 3409 C CE . LYS A 1 437 ? -31.166 14.057 43.096 1.00 64.02 ? 745 LYS A CE 1 ATOM 3410 N NZ . LYS A 1 437 ? -32.145 13.155 43.776 1.00 66.91 ? 745 LYS A NZ 1 ATOM 3411 N N . ASN A 1 455 ? -29.061 16.920 36.862 1.00 44.68 ? 763 ASN A N 1 ATOM 3412 C CA . ASN A 1 455 ? -28.026 16.506 37.801 1.00 46.09 ? 763 ASN A CA 1 ATOM 3413 C C . ASN A 1 455 ? -26.640 17.017 37.422 1.00 44.36 ? 763 ASN A C 1 ATOM 3414 O O . ASN A 1 455 ? -26.135 16.727 36.338 1.00 46.12 ? 763 ASN A O 1 ATOM 3415 C CB . ASN A 1 455 ? -28.001 14.981 37.936 1.00 52.86 ? 763 ASN A CB 1 ATOM 3416 C CG . ASN A 1 455 ? -29.200 14.442 38.693 1.00 59.64 ? 763 ASN A CG 1 ATOM 3417 O OD1 . ASN A 1 455 ? -29.132 14.208 39.900 1.00 62.99 ? 763 ASN A OD1 1 ATOM 3418 N ND2 . ASN A 1 455 ? -30.308 14.242 37.987 1.00 62.07 ? 763 ASN A ND2 1 ATOM 3419 N N . MET A 1 456 ? -26.017 17.770 38.323 1.00 39.82 ? 764 MET A N 1 ATOM 3420 C CA . MET A 1 456 ? -24.695 18.315 38.054 1.00 35.98 ? 764 MET A CA 1 ATOM 3421 C C . MET A 1 456 ? -23.735 18.056 39.206 1.00 31.52 ? 764 MET A C 1 ATOM 3422 O O . MET A 1 456 ? -23.933 18.559 40.317 1.00 32.18 ? 764 MET A O 1 ATOM 3423 C CB . MET A 1 456 ? -24.778 19.814 37.758 1.00 34.78 ? 764 MET A CB 1 ATOM 3424 C CG . MET A 1 456 ? -23.427 20.463 37.474 1.00 33.41 ? 764 MET A CG 1 ATOM 3425 S SD . MET A 1 456 ? -23.593 22.198 37.016 1.00 37.15 ? 764 MET A SD 1 ATOM 3426 C CE . MET A 1 456 ? -24.167 22.936 38.542 1.00 32.01 ? 764 MET A CE 1 ATOM 3427 N N . PRO A 1 457 ? -22.693 17.254 38.946 1.00 27.50 ? 765 PRO A N 1 ATOM 3428 C CA . PRO A 1 457 ? -21.674 16.960 39.959 1.00 27.73 ? 765 PRO A CA 1 ATOM 3429 C C . PRO A 1 457 ? -20.828 18.194 40.257 1.00 26.94 ? 765 PRO A C 1 ATOM 3430 O O . PRO A 1 457 ? -20.430 18.922 39.339 1.00 25.13 ? 765 PRO A O 1 ATOM 3431 C CB . PRO A 1 457 ? -20.807 15.883 39.292 1.00 27.14 ? 765 PRO A CB 1 ATOM 3432 C CG . PRO A 1 457 ? -21.633 15.352 38.147 1.00 28.19 ? 765 PRO A CG 1 ATOM 3433 C CD . PRO A 1 457 ? -22.450 16.527 37.688 1.00 24.20 ? 765 PRO A CD 1 ATOM 3434 N N . VAL A 1 458 ? -20.552 18.417 41.536 1.00 25.38 ? 766 VAL A N 1 ATOM 3435 C CA . VAL A 1 458 ? -19.797 19.584 41.968 1.00 29.10 ? 766 VAL A CA 1 ATOM 3436 C C . VAL A 1 458 ? -18.648 19.184 42.888 1.00 29.69 ? 766 VAL A C 1 ATOM 3437 O O . VAL A 1 458 ? -18.857 18.515 43.907 1.00 31.74 ? 766 VAL A O 1 ATOM 3438 C CB . VAL A 1 458 ? -20.701 20.590 42.715 1.00 32.86 ? 766 VAL A CB 1 ATOM 3439 C CG1 . VAL A 1 458 ? -19.880 21.762 43.229 1.00 35.47 ? 766 VAL A CG1 1 ATOM 3440 C CG2 . VAL A 1 458 ? -21.834 21.075 41.815 1.00 31.10 ? 766 VAL A CG2 1 ATOM 3441 N N . ILE A 1 459 ? -17.440 19.605 42.527 1.00 34.77 ? 767 ILE A N 1 ATOM 3442 C CA . ILE A 1 459 ? -16.256 19.395 43.351 1.00 34.77 ? 767 ILE A CA 1 ATOM 3443 C C . ILE A 1 459 ? -16.013 20.608 44.237 1.00 38.63 ? 767 ILE A C 1 ATOM 3444 O O . ILE A 1 459 ? -15.911 21.728 43.737 1.00 37.88 ? 767 ILE A O 1 ATOM 3445 C CB . ILE A 1 459 ? -15.008 19.196 42.478 1.00 33.95 ? 767 ILE A CB 1 ATOM 3446 C CG1 . ILE A 1 459 ? -15.168 17.969 41.583 1.00 32.80 ? 767 ILE A CG1 1 ATOM 3447 C CG2 . ILE A 1 459 ? -13.761 19.084 43.342 1.00 34.05 ? 767 ILE A CG2 1 ATOM 3448 C CD1 . ILE A 1 459 ? -14.149 17.908 40.463 1.00 34.60 ? 767 ILE A CD1 1 ATOM 3449 N N . PRO A 1 460 ? -15.914 20.390 45.560 1.00 43.94 ? 768 PRO A N 1 ATOM 3450 C CA . PRO A 1 460 ? -15.694 21.476 46.525 1.00 48.27 ? 768 PRO A CA 1 ATOM 3451 C C . PRO A 1 460 ? -14.309 22.115 46.404 1.00 50.57 ? 768 PRO A C 1 ATOM 3452 O O . PRO A 1 460 ? -13.447 21.605 45.690 1.00 48.85 ? 768 PRO A O 1 ATOM 3453 C CB . PRO A 1 460 ? -15.841 20.775 47.881 1.00 49.35 ? 768 PRO A CB 1 ATOM 3454 C CG . PRO A 1 460 ? -15.501 19.347 47.605 1.00 48.27 ? 768 PRO A CG 1 ATOM 3455 C CD . PRO A 1 460 ? -16.017 19.077 46.220 1.00 44.76 ? 768 PRO A CD 1 ATOM 3456 N N . MET A 1 461 ? -14.103 23.226 47.105 1.00 56.39 ? 769 MET A N 1 ATOM 3457 C CA . MET A 1 461 ? -12.843 23.962 47.028 1.00 59.98 ? 769 MET A CA 1 ATOM 3458 C C . MET A 1 461 ? -11.779 23.369 47.952 1.00 59.93 ? 769 MET A C 1 ATOM 3459 O O . MET A 1 461 ? -11.417 23.963 48.970 1.00 63.48 ? 769 MET A O 1 ATOM 3460 C CB . MET A 1 461 ? -13.067 25.445 47.345 1.00 64.35 ? 769 MET A CB 1 ATOM 3461 C CG . MET A 1 461 ? -11.879 26.348 47.023 1.00 68.14 ? 769 MET A CG 1 ATOM 3462 S SD . MET A 1 461 ? -11.384 26.278 45.288 1.00 102.36 ? 769 MET A SD 1 ATOM 3463 C CE . MET A 1 461 ? -10.037 27.458 45.271 1.00 109.08 ? 769 MET A CE 1 ATOM 3464 N N . ASN A 1 462 ? -11.283 22.191 47.588 1.00 56.30 ? 770 ASN A N 1 ATOM 3465 C CA . ASN A 1 462 ? -10.242 21.525 48.356 1.00 55.78 ? 770 ASN A CA 1 ATOM 3466 C C . ASN A 1 462 ? -8.909 21.485 47.613 1.00 54.97 ? 770 ASN A C 1 ATOM 3467 O O . ASN A 1 462 ? -8.704 22.220 46.645 1.00 51.09 ? 770 ASN A O 1 ATOM 3468 C CB . ASN A 1 462 ? -10.680 20.108 48.739 1.00 57.86 ? 770 ASN A CB 1 ATOM 3469 C CG . ASN A 1 462 ? -11.145 19.292 47.540 1.00 58.36 ? 770 ASN A CG 1 ATOM 3470 O OD1 . ASN A 1 462 ? -10.800 19.589 46.394 1.00 58.07 ? 770 ASN A OD1 1 ATOM 3471 N ND2 . ASN A 1 462 ? -11.936 18.259 47.802 1.00 58.59 ? 770 ASN A ND2 1 ATOM 3472 N N . THR A 1 463 ? -8.015 20.615 48.078 1.00 56.88 ? 771 THR A N 1 ATOM 3473 C CA . THR A 1 463 ? -6.678 20.464 47.508 1.00 57.68 ? 771 THR A CA 1 ATOM 3474 C C . THR A 1 463 ? -6.717 20.164 46.010 1.00 57.63 ? 771 THR A C 1 ATOM 3475 O O . THR A 1 463 ? -5.925 20.707 45.236 1.00 56.93 ? 771 THR A O 1 ATOM 3476 C CB . THR A 1 463 ? -5.898 19.343 48.222 1.00 57.26 ? 771 THR A CB 1 ATOM 3477 O OG1 . THR A 1 463 ? -5.808 19.637 49.621 1.00 57.85 ? 771 THR A OG1 1 ATOM 3478 C CG2 . THR A 1 463 ? -4.498 19.212 47.643 1.00 59.52 ? 771 THR A CG2 1 ATOM 3479 N N . ILE A 1 464 ? -7.646 19.300 45.613 1.00 57.58 ? 772 ILE A N 1 ATOM 3480 C CA . ILE A 1 464 ? -7.830 18.944 44.211 1.00 59.46 ? 772 ILE A CA 1 ATOM 3481 C C . ILE A 1 464 ? -8.130 20.179 43.359 1.00 60.49 ? 772 ILE A C 1 ATOM 3482 O O . ILE A 1 464 ? -7.520 20.388 42.312 1.00 61.23 ? 772 ILE A O 1 ATOM 3483 C CB . ILE A 1 464 ? -8.975 17.922 44.047 1.00 58.56 ? 772 ILE A CB 1 ATOM 3484 C CG1 . ILE A 1 464 ? -8.768 16.733 44.989 1.00 61.42 ? 772 ILE A CG1 1 ATOM 3485 C CG2 . ILE A 1 464 ? -9.085 17.455 42.604 1.00 57.31 ? 772 ILE A CG2 1 ATOM 3486 C CD1 . ILE A 1 464 ? -7.429 16.038 44.817 1.00 63.86 ? 772 ILE A CD1 1 ATOM 3487 N N . ALA A 1 465 ? -9.060 21.002 43.828 1.00 41.11 ? 773 ALA A N 1 ATOM 3488 C CA . ALA A 1 465 ? -9.492 22.190 43.093 1.00 39.54 ? 773 ALA A CA 1 ATOM 3489 C C . ALA A 1 465 ? -8.429 23.288 43.024 1.00 39.05 ? 773 ALA A C 1 ATOM 3490 O O . ALA A 1 465 ? -8.362 24.037 42.052 1.00 35.31 ? 773 ALA A O 1 ATOM 3491 C CB . ALA A 1 465 ? -10.763 22.737 43.699 1.00 42.16 ? 773 ALA A CB 1 ATOM 3492 N N . GLU A 1 466 ? -7.608 23.405 44.062 1.00 40.77 ? 774 GLU A N 1 ATOM 3493 C CA . GLU A 1 466 ? -6.563 24.422 44.047 1.00 40.00 ? 774 GLU A CA 1 ATOM 3494 C C . GLU A 1 466 ? -5.534 24.069 42.979 1.00 35.29 ? 774 GLU A C 1 ATOM 3495 O O . GLU A 1 466 ? -5.099 24.928 42.207 1.00 30.49 ? 774 GLU A O 1 ATOM 3496 C CB . GLU A 1 466 ? -5.914 24.551 45.420 1.00 43.70 ? 774 GLU A CB 1 ATOM 3497 C CG . GLU A 1 466 ? -6.863 25.078 46.479 1.00 48.80 ? 774 GLU A CG 1 ATOM 3498 C CD . GLU A 1 466 ? -6.347 24.870 47.891 1.00 53.41 ? 774 GLU A CD 1 ATOM 3499 O OE1 . GLU A 1 466 ? -5.264 24.264 48.050 1.00 54.28 ? 774 GLU A OE1 1 ATOM 3500 O OE2 . GLU A 1 466 ? -7.032 25.310 48.839 1.00 54.79 ? 774 GLU A OE2 1 ATOM 3501 N N . ALA A 1 467 ? -5.185 22.787 42.928 1.00 35.25 ? 775 ALA A N 1 ATOM 3502 C CA . ALA A 1 467 ? -4.230 22.266 41.954 1.00 34.66 ? 775 ALA A CA 1 ATOM 3503 C C . ALA A 1 467 ? -4.684 22.520 40.518 1.00 30.26 ? 775 ALA A C 1 ATOM 3504 O O . ALA A 1 467 ? -3.870 22.771 39.632 1.00 32.51 ? 775 ALA A O 1 ATOM 3505 C CB . ALA A 1 467 ? -3.998 20.781 42.190 1.00 33.26 ? 775 ALA A CB 1 ATOM 3506 N N . VAL A 1 468 ? -5.988 22.469 40.288 1.00 31.81 ? 776 VAL A N 1 ATOM 3507 C CA . VAL A 1 468 ? -6.520 22.732 38.958 1.00 29.54 ? 776 VAL A CA 1 ATOM 3508 C C . VAL A 1 468 ? -6.393 24.205 38.572 1.00 31.59 ? 776 VAL A C 1 ATOM 3509 O O . VAL A 1 468 ? -5.943 24.524 37.470 1.00 28.08 ? 776 VAL A O 1 ATOM 3510 C CB . VAL A 1 468 ? -7.976 22.254 38.825 1.00 31.49 ? 776 VAL A CB 1 ATOM 3511 C CG1 . VAL A 1 468 ? -8.538 22.648 37.484 1.00 28.68 ? 776 VAL A CG1 1 ATOM 3512 C CG2 . VAL A 1 468 ? -8.053 20.744 39.032 1.00 32.32 ? 776 VAL A CG2 1 ATOM 3513 N N . ILE A 1 469 ? -6.765 25.101 39.485 1.00 30.94 ? 777 ILE A N 1 ATOM 3514 C CA . ILE A 1 469 ? -6.671 26.535 39.227 1.00 30.13 ? 777 ILE A CA 1 ATOM 3515 C C . ILE A 1 469 ? -5.215 26.976 39.080 1.00 29.04 ? 777 ILE A C 1 ATOM 3516 O O . ILE A 1 469 ? -4.901 27.917 38.346 1.00 26.81 ? 777 ILE A O 1 ATOM 3517 C CB . ILE A 1 469 ? -7.370 27.350 40.342 1.00 37.28 ? 777 ILE A CB 1 ATOM 3518 C CG1 . ILE A 1 469 ? -8.833 26.917 40.471 1.00 39.65 ? 777 ILE A CG1 1 ATOM 3519 C CG2 . ILE A 1 469 ? -7.293 28.845 40.067 1.00 38.82 ? 777 ILE A CG2 1 ATOM 3520 C CD1 . ILE A 1 469 ? -9.602 27.665 41.546 1.00 41.00 ? 777 ILE A CD1 1 ATOM 3521 N N . GLU A 1 470 ? -4.321 26.286 39.776 1.00 32.38 ? 778 GLU A N 1 ATOM 3522 C CA . GLU A 1 470 ? -2.902 26.600 39.689 1.00 34.52 ? 778 GLU A CA 1 ATOM 3523 C C . GLU A 1 470 ? -2.385 26.313 38.283 1.00 30.14 ? 778 GLU A C 1 ATOM 3524 O O . GLU A 1 470 ? -1.632 27.105 37.709 1.00 31.03 ? 778 GLU A O 1 ATOM 3525 C CB . GLU A 1 470 ? -2.111 25.798 40.724 1.00 38.26 ? 778 GLU A CB 1 ATOM 3526 C CG . GLU A 1 470 ? -0.619 26.071 40.698 1.00 45.04 ? 778 GLU A CG 1 ATOM 3527 C CD . GLU A 1 470 ? 0.134 25.321 41.777 1.00 51.26 ? 778 GLU A CD 1 ATOM 3528 O OE1 . GLU A 1 470 ? -0.511 24.853 42.741 1.00 53.55 ? 778 GLU A OE1 1 ATOM 3529 O OE2 . GLU A 1 470 ? 1.372 25.200 41.659 1.00 54.22 ? 778 GLU A OE2 1 ATOM 3530 N N . MET A 1 471 ? -2.799 25.176 37.736 1.00 27.15 ? 779 MET A N 1 ATOM 3531 C CA . MET A 1 471 ? -2.448 24.797 36.371 1.00 25.61 ? 779 MET A CA 1 ATOM 3532 C C . MET A 1 471 ? -2.809 25.908 35.390 1.00 25.61 ? 779 MET A C 1 ATOM 3533 O O . MET A 1 471 ? -1.983 26.333 34.582 1.00 24.51 ? 779 MET A O 1 ATOM 3534 C CB . MET A 1 471 ? -3.179 23.506 35.975 1.00 22.33 ? 779 MET A CB 1 ATOM 3535 C CG . MET A 1 471 ? -2.979 23.103 34.520 1.00 20.64 ? 779 MET A CG 1 ATOM 3536 S SD . MET A 1 471 ? -3.903 21.615 34.060 1.00 26.82 ? 779 MET A SD 1 ATOM 3537 C CE . MET A 1 471 ? -5.588 22.208 34.179 1.00 25.39 ? 779 MET A CE 1 ATOM 3538 N N . ILE A 1 472 ? -4.049 26.378 35.488 1.00 27.31 ? 780 ILE A N 1 ATOM 3539 C CA . ILE A 1 472 ? -4.587 27.392 34.587 1.00 27.88 ? 780 ILE A CA 1 ATOM 3540 C C . ILE A 1 472 ? -3.805 28.709 34.645 1.00 29.25 ? 780 ILE A C 1 ATOM 3541 O O . ILE A 1 472 ? -3.441 29.270 33.610 1.00 31.50 ? 780 ILE A O 1 ATOM 3542 C CB . ILE A 1 472 ? -6.072 27.675 34.904 1.00 30.67 ? 780 ILE A CB 1 ATOM 3543 C CG1 . ILE A 1 472 ? -6.869 26.369 35.003 1.00 28.69 ? 780 ILE A CG1 1 ATOM 3544 C CG2 . ILE A 1 472 ? -6.668 28.646 33.878 1.00 31.16 ? 780 ILE A CG2 1 ATOM 3545 C CD1 . ILE A 1 472 ? -7.080 25.661 33.673 1.00 28.56 ? 780 ILE A CD1 1 ATOM 3546 N N . ASN A 1 473 ? -3.552 29.197 35.854 1.00 32.11 ? 781 ASN A N 1 ATOM 3547 C CA . ASN A 1 473 ? -2.819 30.451 36.038 1.00 34.25 ? 781 ASN A CA 1 ATOM 3548 C C . ASN A 1 473 ? -1.384 30.408 35.523 1.00 35.80 ? 781 ASN A C 1 ATOM 3549 O O . ASN A 1 473 ? -0.901 31.370 34.924 1.00 37.52 ? 781 ASN A O 1 ATOM 3550 C CB . ASN A 1 473 ? -2.828 30.872 37.510 1.00 36.14 ? 781 ASN A CB 1 ATOM 3551 C CG . ASN A 1 473 ? -4.203 31.290 37.982 1.00 35.84 ? 781 ASN A CG 1 ATOM 3552 O OD1 . ASN A 1 473 ? -5.066 31.634 37.175 1.00 35.54 ? 781 ASN A OD1 1 ATOM 3553 N ND2 . ASN A 1 473 ? -4.418 31.261 39.291 1.00 35.04 ? 781 ASN A ND2 1 ATOM 3554 N N . ARG A 1 474 ? -0.707 29.287 35.755 1.00 34.17 ? 782 ARG A N 1 ATOM 3555 C CA . ARG A 1 474 ? 0.680 29.135 35.333 1.00 31.84 ? 782 ARG A CA 1 ATOM 3556 C C . ARG A 1 474 ? 0.780 28.821 33.849 1.00 29.96 ? 782 ARG A C 1 ATOM 3557 O O . ARG A 1 474 ? 1.871 28.787 33.286 1.00 31.29 ? 782 ARG A O 1 ATOM 3558 C CB . ARG A 1 474 ? 1.375 28.045 36.155 1.00 32.48 ? 782 ARG A CB 1 ATOM 3559 C CG . ARG A 1 474 ? 1.485 28.371 37.639 1.00 35.72 ? 782 ARG A CG 1 ATOM 3560 C CD . ARG A 1 474 ? 2.069 27.212 38.431 1.00 38.68 ? 782 ARG A CD 1 ATOM 3561 N NE . ARG A 1 474 ? 3.307 26.711 37.839 1.00 42.66 ? 782 ARG A NE 1 ATOM 3562 C CZ . ARG A 1 474 ? 4.523 27.129 38.177 1.00 44.98 ? 782 ARG A CZ 1 ATOM 3563 N NH1 . ARG A 1 474 ? 4.671 28.061 39.110 1.00 46.46 ? 782 ARG A NH1 1 ATOM 3564 N NH2 . ARG A 1 474 ? 5.593 26.616 37.582 1.00 45.07 ? 782 ARG A NH2 1 ATOM 3565 N N . GLY A 1 475 ? -0.365 28.593 33.216 1.00 29.50 ? 783 GLY A N 1 ATOM 3566 C CA . GLY A 1 475 ? -0.385 28.236 31.813 1.00 29.64 ? 783 GLY A CA 1 ATOM 3567 C C . GLY A 1 475 ? 0.178 26.849 31.573 1.00 29.89 ? 783 GLY A C 1 ATOM 3568 O O . GLY A 1 475 ? 0.652 26.548 30.477 1.00 33.27 ? 783 GLY A O 1 ATOM 3569 N N . GLN A 1 476 ? 0.128 26.008 32.605 1.00 28.95 ? 784 GLN A N 1 ATOM 3570 C CA . GLN A 1 476 ? 0.567 24.616 32.508 1.00 27.54 ? 784 GLN A CA 1 ATOM 3571 C C . GLN A 1 476 ? -0.343 23.825 31.570 1.00 24.49 ? 784 GLN A C 1 ATOM 3572 O O . GLN A 1 476 ? -1.546 24.070 31.509 1.00 22.33 ? 784 GLN A O 1 ATOM 3573 C CB . GLN A 1 476 ? 0.585 23.958 33.893 1.00 30.12 ? 784 GLN A CB 1 ATOM 3574 C CG . GLN A 1 476 ? 1.718 24.430 34.801 1.00 38.34 ? 784 GLN A CG 1 ATOM 3575 C CD . GLN A 1 476 ? 1.547 23.990 36.251 1.00 44.45 ? 784 GLN A CD 1 ATOM 3576 O OE1 . GLN A 1 476 ? 2.344 24.355 37.117 1.00 51.20 ? 784 GLN A OE1 1 ATOM 3577 N NE2 . GLN A 1 476 ? 0.505 23.210 36.521 1.00 42.30 ? 784 GLN A NE2 1 ATOM 3578 N N . ILE A 1 477 ? 0.237 22.866 30.854 1.00 21.04 ? 785 ILE A N 1 ATOM 3579 C CA . ILE A 1 477 ? -0.486 22.118 29.827 1.00 20.35 ? 785 ILE A CA 1 ATOM 3580 C C . ILE A 1 477 ? -1.451 21.081 30.410 1.00 17.53 ? 785 ILE A C 1 ATOM 3581 O O . ILE A 1 477 ? -2.559 20.880 29.905 1.00 15.56 ? 785 ILE A O 1 ATOM 3582 C CB . ILE A 1 477 ? 0.511 21.405 28.889 1.00 26.41 ? 785 ILE A CB 1 ATOM 3583 C CG1 . ILE A 1 477 ? 1.438 22.430 28.228 1.00 31.41 ? 785 ILE A CG1 1 ATOM 3584 C CG2 . ILE A 1 477 ? -0.209 20.574 27.844 1.00 29.18 ? 785 ILE A CG2 1 ATOM 3585 C CD1 . ILE A 1 477 ? 0.721 23.629 27.677 1.00 32.69 ? 785 ILE A CD1 1 ATOM 3586 N N . GLN A 1 478 ? -1.018 20.413 31.468 1.00 19.07 ? 786 GLN A N 1 ATOM 3587 C CA . GLN A 1 478 ? -1.781 19.302 32.016 1.00 18.54 ? 786 GLN A CA 1 ATOM 3588 C C . GLN A 1 478 ? -1.210 18.938 33.374 1.00 21.24 ? 786 GLN A C 1 ATOM 3589 O O . GLN A 1 478 ? -0.063 19.271 33.690 1.00 21.42 ? 786 GLN A O 1 ATOM 3590 C CB . GLN A 1 478 ? -1.688 18.093 31.072 1.00 18.24 ? 786 GLN A CB 1 ATOM 3591 C CG . GLN A 1 478 ? -0.270 17.528 30.977 1.00 22.46 ? 786 GLN A CG 1 ATOM 3592 C CD . GLN A 1 478 ? -0.005 16.738 29.703 1.00 26.76 ? 786 GLN A CD 1 ATOM 3593 O OE1 . GLN A 1 478 ? -0.928 16.318 29.008 1.00 29.10 ? 786 GLN A OE1 1 ATOM 3594 N NE2 . GLN A 1 478 ? 1.273 16.538 29.391 1.00 29.89 ? 786 GLN A NE2 1 ATOM 3595 N N . ILE A 1 479 ? -2.020 18.272 34.187 1.00 21.67 ? 787 ILE A N 1 ATOM 3596 C CA . ILE A 1 479 ? -1.556 17.708 35.444 1.00 21.91 ? 787 ILE A CA 1 ATOM 3597 C C . ILE A 1 479 ? -2.141 16.314 35.602 1.00 20.81 ? 787 ILE A C 1 ATOM 3598 O O . ILE A 1 479 ? -2.876 15.842 34.738 1.00 24.08 ? 787 ILE A O 1 ATOM 3599 C CB . ILE A 1 479 ? -1.960 18.574 36.660 1.00 24.11 ? 787 ILE A CB 1 ATOM 3600 C CG1 . ILE A 1 479 ? -3.482 18.688 36.766 1.00 24.19 ? 787 ILE A CG1 1 ATOM 3601 C CG2 . ILE A 1 479 ? -1.318 19.959 36.578 1.00 22.18 ? 787 ILE A CG2 1 ATOM 3602 C CD1 . ILE A 1 479 ? -3.935 19.646 37.864 1.00 25.03 ? 787 ILE A CD1 1 ATOM 3603 N N . THR A 1 480 ? -1.800 15.656 36.702 1.00 20.75 ? 788 THR A N 1 ATOM 3604 C CA . THR A 1 480 ? -2.326 14.334 37.000 1.00 22.54 ? 788 THR A CA 1 ATOM 3605 C C . THR A 1 480 ? -2.920 14.348 38.400 1.00 24.61 ? 788 THR A C 1 ATOM 3606 O O . THR A 1 480 ? -2.277 14.791 39.345 1.00 26.90 ? 788 THR A O 1 ATOM 3607 C CB . THR A 1 480 ? -1.219 13.263 36.937 1.00 25.36 ? 788 THR A CB 1 ATOM 3608 O OG1 . THR A 1 480 ? -0.652 13.225 35.620 1.00 23.70 ? 788 THR A OG1 1 ATOM 3609 C CG2 . THR A 1 480 ? -1.779 11.891 37.291 1.00 26.80 ? 788 THR A CG2 1 ATOM 3610 N N . ILE A 1 481 ? -4.161 13.891 38.527 1.00 22.54 ? 789 ILE A N 1 ATOM 3611 C CA . ILE A 1 481 ? -4.792 13.753 39.833 1.00 23.08 ? 789 ILE A CA 1 ATOM 3612 C C . ILE A 1 481 ? -5.387 12.357 39.939 1.00 22.57 ? 789 ILE A C 1 ATOM 3613 O O . ILE A 1 481 ? -6.189 11.962 39.097 1.00 22.38 ? 789 ILE A O 1 ATOM 3614 C CB . ILE A 1 481 ? -5.908 14.801 40.060 1.00 22.74 ? 789 ILE A CB 1 ATOM 3615 C CG1 . ILE A 1 481 ? -5.335 16.223 40.016 1.00 24.44 ? 789 ILE A CG1 1 ATOM 3616 C CG2 . ILE A 1 481 ? -6.604 14.558 41.403 1.00 21.61 ? 789 ILE A CG2 1 ATOM 3617 C CD1 . ILE A 1 481 ? -6.390 17.327 40.008 1.00 27.11 ? 789 ILE A CD1 1 ATOM 3618 N N . ASN A 1 482 ? -4.971 11.613 40.959 1.00 25.56 ? 790 ASN A N 1 ATOM 3619 C CA . ASN A 1 482 ? -5.446 10.246 41.181 1.00 26.91 ? 790 ASN A CA 1 ATOM 3620 C C . ASN A 1 482 ? -5.276 9.367 39.946 1.00 25.17 ? 790 ASN A C 1 ATOM 3621 O O . ASN A 1 482 ? -6.088 8.478 39.687 1.00 27.42 ? 790 ASN A O 1 ATOM 3622 C CB . ASN A 1 482 ? -6.909 10.235 41.644 1.00 25.00 ? 790 ASN A CB 1 ATOM 3623 C CG . ASN A 1 482 ? -7.100 10.881 43.005 1.00 26.72 ? 790 ASN A CG 1 ATOM 3624 O OD1 . ASN A 1 482 ? -6.143 11.065 43.759 1.00 28.26 ? 790 ASN A OD1 1 ATOM 3625 N ND2 . ASN A 1 482 ? -8.348 11.215 43.333 1.00 25.41 ? 790 ASN A ND2 1 ATOM 3626 N N . GLY A 1 483 ? -4.220 9.631 39.184 1.00 23.90 ? 791 GLY A N 1 ATOM 3627 C CA . GLY A 1 483 ? -3.894 8.832 38.019 1.00 22.10 ? 791 GLY A CA 1 ATOM 3628 C C . GLY A 1 483 ? -4.592 9.285 36.753 1.00 21.03 ? 791 GLY A C 1 ATOM 3629 O O . GLY A 1 483 ? -4.298 8.783 35.664 1.00 21.41 ? 791 GLY A O 1 ATOM 3630 N N . PHE A 1 484 ? -5.513 10.234 36.889 1.00 18.42 ? 792 PHE A N 1 ATOM 3631 C CA . PHE A 1 484 ? -6.283 10.729 35.753 1.00 20.10 ? 792 PHE A CA 1 ATOM 3632 C C . PHE A 1 484 ? -5.594 11.927 35.111 1.00 22.48 ? 792 PHE A C 1 ATOM 3633 O O . PHE A 1 484 ? -5.059 12.789 35.813 1.00 23.06 ? 792 PHE A O 1 ATOM 3634 C CB . PHE A 1 484 ? -7.697 11.120 36.186 1.00 20.90 ? 792 PHE A CB 1 ATOM 3635 C CG . PHE A 1 484 ? -8.558 9.949 36.573 1.00 22.48 ? 792 PHE A CG 1 ATOM 3636 C CD1 . PHE A 1 484 ? -9.317 9.286 35.619 1.00 22.63 ? 792 PHE A CD1 1 ATOM 3637 C CD2 . PHE A 1 484 ? -8.612 9.515 37.883 1.00 24.04 ? 792 PHE A CD2 1 ATOM 3638 C CE1 . PHE A 1 484 ? -10.110 8.206 35.970 1.00 21.98 ? 792 PHE A CE1 1 ATOM 3639 C CE2 . PHE A 1 484 ? -9.410 8.433 38.244 1.00 25.17 ? 792 PHE A CE2 1 ATOM 3640 C CZ . PHE A 1 484 ? -10.158 7.779 37.280 1.00 22.54 ? 792 PHE A CZ 1 ATOM 3641 N N . SER A 1 485 ? -5.605 11.969 33.780 1.00 18.39 ? 793 SER A N 1 ATOM 3642 C CA . SER A 1 485 ? -5.005 13.068 33.034 1.00 19.93 ? 793 SER A CA 1 ATOM 3643 C C . SER A 1 485 ? -5.955 14.258 32.996 1.00 19.38 ? 793 SER A C 1 ATOM 3644 O O . SER A 1 485 ? -7.055 14.162 32.460 1.00 24.55 ? 793 SER A O 1 ATOM 3645 C CB . SER A 1 485 ? -4.689 12.633 31.598 1.00 25.16 ? 793 SER A CB 1 ATOM 3646 O OG . SER A 1 485 ? -4.116 11.340 31.572 1.00 33.06 ? 793 SER A OG 1 ATOM 3647 N N . ILE A 1 486 ? -5.522 15.380 33.558 1.00 21.47 ? 794 ILE A N 1 ATOM 3648 C CA . ILE A 1 486 ? -6.323 16.598 33.560 1.00 22.21 ? 794 ILE A CA 1 ATOM 3649 C C . ILE A 1 486 ? -5.661 17.644 32.667 1.00 22.49 ? 794 ILE A C 1 ATOM 3650 O O . ILE A 1 486 ? -4.566 18.115 32.972 1.00 24.05 ? 794 ILE A O 1 ATOM 3651 C CB . ILE A 1 486 ? -6.456 17.182 34.982 1.00 24.43 ? 794 ILE A CB 1 ATOM 3652 C CG1 . ILE A 1 486 ? -6.893 16.106 35.985 1.00 27.71 ? 794 ILE A CG1 1 ATOM 3653 C CG2 . ILE A 1 486 ? -7.436 18.324 34.987 1.00 23.42 ? 794 ILE A CG2 1 ATOM 3654 C CD1 . ILE A 1 486 ? -8.223 15.466 35.640 1.00 25.91 ? 794 ILE A CD1 1 ATOM 3655 N N . SER A 1 487 ? -6.333 18.014 31.578 1.00 19.31 ? 795 SER A N 1 ATOM 3656 C CA . SER A 1 487 ? -5.739 18.870 30.560 1.00 18.88 ? 795 SER A CA 1 ATOM 3657 C C . SER A 1 487 ? -6.226 20.313 30.642 1.00 18.91 ? 795 SER A C 1 ATOM 3658 O O . SER A 1 487 ? -7.404 20.562 30.882 1.00 18.25 ? 795 SER A O 1 ATOM 3659 C CB . SER A 1 487 ? -6.073 18.333 29.165 1.00 20.12 ? 795 SER A CB 1 ATOM 3660 O OG . SER A 1 487 ? -5.489 17.066 28.938 1.00 22.94 ? 795 SER A OG 1 ATOM 3661 N N . ASN A 1 488 ? -5.314 21.255 30.426 1.00 16.81 ? 796 ASN A N 1 ATOM 3662 C CA . ASN A 1 488 ? -5.681 22.657 30.242 1.00 17.00 ? 796 ASN A CA 1 ATOM 3663 C C . ASN A 1 488 ? -6.413 22.809 28.911 1.00 15.31 ? 796 ASN A C 1 ATOM 3664 O O . ASN A 1 488 ? -5.858 22.509 27.856 1.00 15.49 ? 796 ASN A O 1 ATOM 3665 C CB . ASN A 1 488 ? -4.413 23.521 30.224 1.00 19.75 ? 796 ASN A CB 1 ATOM 3666 C CG . ASN A 1 488 ? -4.707 25.013 30.268 1.00 18.66 ? 796 ASN A CG 1 ATOM 3667 O OD1 . ASN A 1 488 ? -5.736 25.473 29.782 1.00 18.98 ? 796 ASN A OD1 1 ATOM 3668 N ND2 . ASN A 1 488 ? -3.786 25.779 30.853 1.00 19.33 ? 796 ASN A ND2 1 ATOM 3669 N N . GLY A 1 489 ? -7.644 23.305 28.949 1.00 12.77 ? 797 GLY A N 1 ATOM 3670 C CA . GLY A 1 489 ? -8.441 23.428 27.738 1.00 11.75 ? 797 GLY A CA 1 ATOM 3671 C C . GLY A 1 489 ? -7.867 24.332 26.653 1.00 15.20 ? 797 GLY A C 1 ATOM 3672 O O . GLY A 1 489 ? -8.298 24.258 25.501 1.00 14.06 ? 797 GLY A O 1 ATOM 3673 N N . LEU A 1 490 ? -6.909 25.185 27.014 1.00 15.32 ? 798 LEU A N 1 ATOM 3674 C CA . LEU A 1 490 ? -6.254 26.067 26.041 1.00 14.82 ? 798 LEU A CA 1 ATOM 3675 C C . LEU A 1 490 ? -5.103 25.374 25.312 1.00 17.77 ? 798 LEU A C 1 ATOM 3676 O O . LEU A 1 490 ? -4.515 25.942 24.391 1.00 16.20 ? 798 LEU A O 1 ATOM 3677 C CB . LEU A 1 490 ? -5.708 27.326 26.724 1.00 14.69 ? 798 LEU A CB 1 ATOM 3678 C CG . LEU A 1 490 ? -6.712 28.364 27.222 1.00 15.32 ? 798 LEU A CG 1 ATOM 3679 C CD1 . LEU A 1 490 ? -6.008 29.463 28.029 1.00 14.83 ? 798 LEU A CD1 1 ATOM 3680 C CD2 . LEU A 1 490 ? -7.476 28.944 26.042 1.00 14.62 ? 798 LEU A CD2 1 ATOM 3681 N N . ALA A 1 491 ? -4.781 24.152 25.723 1.00 16.90 ? 799 ALA A N 1 ATOM 3682 C CA . ALA A 1 491 ? -3.572 23.490 25.235 1.00 17.47 ? 799 ALA A CA 1 ATOM 3683 C C . ALA A 1 491 ? -3.827 22.226 24.419 1.00 19.20 ? 799 ALA A C 1 ATOM 3684 O O . ALA A 1 491 ? -2.913 21.427 24.222 1.00 18.43 ? 799 ALA A O 1 ATOM 3685 C CB . ALA A 1 491 ? -2.648 23.167 26.409 1.00 19.18 ? 799 ALA A CB 1 ATOM 3686 N N . THR A 1 492 ? -5.050 22.052 23.932 1.00 17.97 ? 800 THR A N 1 ATOM 3687 C CA . THR A 1 492 ? -5.427 20.815 23.243 1.00 20.19 ? 800 THR A CA 1 ATOM 3688 C C . THR A 1 492 ? -4.522 20.451 22.054 1.00 19.89 ? 800 THR A C 1 ATOM 3689 O O . THR A 1 492 ? -4.229 19.273 21.830 1.00 20.06 ? 800 THR A O 1 ATOM 3690 C CB . THR A 1 492 ? -6.908 20.841 22.796 1.00 23.00 ? 800 THR A CB 1 ATOM 3691 O OG1 . THR A 1 492 ? -7.102 21.852 21.801 1.00 29.11 ? 800 THR A OG1 1 ATOM 3692 C CG2 . THR A 1 492 ? -7.806 21.140 23.979 1.00 22.03 ? 800 THR A CG2 1 ATOM 3693 N N . THR A 1 493 ? -4.057 21.447 21.306 1.00 18.74 ? 801 THR A N 1 ATOM 3694 C CA . THR A 1 493 ? -3.210 21.149 20.150 1.00 16.70 ? 801 THR A CA 1 ATOM 3695 C C . THR A 1 493 ? -1.863 20.557 20.544 1.00 17.53 ? 801 THR A C 1 ATOM 3696 O O . THR A 1 493 ? -1.250 19.832 19.762 1.00 19.80 ? 801 THR A O 1 ATOM 3697 C CB . THR A 1 493 ? -2.974 22.375 19.265 1.00 20.64 ? 801 THR A CB 1 ATOM 3698 O OG1 . THR A 1 493 ? -2.311 23.394 20.023 1.00 21.50 ? 801 THR A OG1 1 ATOM 3699 C CG2 . THR A 1 493 ? -4.299 22.896 18.730 1.00 19.22 ? 801 THR A CG2 1 ATOM 3700 N N . GLN A 1 494 ? -1.410 20.867 21.753 1.00 16.12 ? 802 GLN A N 1 ATOM 3701 C CA . GLN A 1 494 ? -0.134 20.361 22.255 1.00 18.14 ? 802 GLN A CA 1 ATOM 3702 C C . GLN A 1 494 ? -0.257 18.951 22.827 1.00 20.67 ? 802 GLN A C 1 ATOM 3703 O O . GLN A 1 494 ? 0.748 18.249 22.992 1.00 23.01 ? 802 GLN A O 1 ATOM 3704 C CB . GLN A 1 494 ? 0.409 21.292 23.337 1.00 18.98 ? 802 GLN A CB 1 ATOM 3705 C CG . GLN A 1 494 ? 0.734 22.689 22.840 1.00 19.62 ? 802 GLN A CG 1 ATOM 3706 C CD . GLN A 1 494 ? 1.040 23.638 23.969 1.00 22.52 ? 802 GLN A CD 1 ATOM 3707 O OE1 . GLN A 1 494 ? 2.089 23.541 24.610 1.00 28.56 ? 802 GLN A OE1 1 ATOM 3708 N NE2 . GLN A 1 494 ? 0.119 24.559 24.233 1.00 20.96 ? 802 GLN A NE2 1 ATOM 3709 N N . ILE A 1 495 ? -1.485 18.549 23.135 1.00 17.45 ? 803 ILE A N 1 ATOM 3710 C CA . ILE A 1 495 ? -1.742 17.246 23.748 1.00 19.92 ? 803 ILE A CA 1 ATOM 3711 C C . ILE A 1 495 ? -2.155 16.225 22.698 1.00 22.42 ? 803 ILE A C 1 ATOM 3712 O O . ILE A 1 495 ? -1.600 15.127 22.630 1.00 22.49 ? 803 ILE A O 1 ATOM 3713 C CB . ILE A 1 495 ? -2.834 17.355 24.825 1.00 19.90 ? 803 ILE A CB 1 ATOM 3714 C CG1 . ILE A 1 495 ? -2.385 18.345 25.906 1.00 21.94 ? 803 ILE A CG1 1 ATOM 3715 C CG2 . ILE A 1 495 ? -3.133 15.990 25.430 1.00 22.15 ? 803 ILE A CG2 1 ATOM 3716 C CD1 . ILE A 1 495 ? -3.511 18.849 26.780 1.00 20.55 ? 803 ILE A CD1 1 ATOM 3717 N N . ASN A 1 496 ? -3.127 16.604 21.875 1.00 19.00 ? 804 ASN A N 1 ATOM 3718 C CA . ASN A 1 496 ? -3.598 15.758 20.784 1.00 19.31 ? 804 ASN A CA 1 ATOM 3719 C C . ASN A 1 496 ? -4.212 16.638 19.711 1.00 17.54 ? 804 ASN A C 1 ATOM 3720 O O . ASN A 1 496 ? -5.352 17.076 19.847 1.00 17.21 ? 804 ASN A O 1 ATOM 3721 C CB . ASN A 1 496 ? -4.624 14.736 21.292 1.00 18.63 ? 804 ASN A CB 1 ATOM 3722 C CG . ASN A 1 496 ? -5.155 13.830 20.181 1.00 19.06 ? 804 ASN A CG 1 ATOM 3723 O OD1 . ASN A 1 496 ? -4.817 13.996 19.011 1.00 19.51 ? 804 ASN A OD1 1 ATOM 3724 N ND2 . ASN A 1 496 ? -5.981 12.864 20.552 1.00 18.10 ? 804 ASN A ND2 1 ATOM 3725 N N . ASN A 1 497 ? -3.469 16.881 18.632 1.00 19.07 ? 805 ASN A N 1 ATOM 3726 C CA A ASN A 1 497 ? -3.941 17.791 17.597 0.74 18.75 ? 805 ASN A CA 1 ATOM 3727 C CA B ASN A 1 497 ? -3.929 17.780 17.577 0.26 19.93 ? 805 ASN A CA 1 ATOM 3728 C C . ASN A 1 497 ? -5.202 17.301 16.874 1.00 17.80 ? 805 ASN A C 1 ATOM 3729 O O . ASN A 1 497 ? -6.050 18.105 16.486 1.00 18.93 ? 805 ASN A O 1 ATOM 3730 C CB A ASN A 1 497 ? -2.824 18.110 16.599 0.74 22.81 ? 805 ASN A CB 1 ATOM 3731 C CB B ASN A 1 497 ? -2.811 18.051 16.560 0.26 23.48 ? 805 ASN A CB 1 ATOM 3732 C CG A ASN A 1 497 ? -3.121 19.351 15.782 0.74 25.19 ? 805 ASN A CG 1 ATOM 3733 C CG B ASN A 1 497 ? -2.212 16.780 15.987 0.26 24.97 ? 805 ASN A CG 1 ATOM 3734 O OD1 A ASN A 1 497 ? -3.190 20.454 16.321 0.74 28.89 ? 805 ASN A OD1 1 ATOM 3735 O OD1 B ASN A 1 497 ? -2.799 15.703 16.077 0.26 25.61 ? 805 ASN A OD1 1 ATOM 3736 N ND2 A ASN A 1 497 ? -3.310 19.176 14.478 0.74 22.82 ? 805 ASN A ND2 1 ATOM 3737 N ND2 B ASN A 1 497 ? -1.031 16.902 15.390 0.26 28.63 ? 805 ASN A ND2 1 ATOM 3738 N N . LYS A 1 498 ? -5.333 15.987 16.710 1.00 15.17 ? 806 LYS A N 1 ATOM 3739 C CA . LYS A 1 498 ? -6.541 15.416 16.110 1.00 14.48 ? 806 LYS A CA 1 ATOM 3740 C C . LYS A 1 498 ? -7.774 15.638 16.992 1.00 16.62 ? 806 LYS A C 1 ATOM 3741 O O . LYS A 1 498 ? -8.886 15.822 16.491 1.00 18.22 ? 806 LYS A O 1 ATOM 3742 C CB . LYS A 1 498 ? -6.361 13.919 15.852 1.00 17.16 ? 806 LYS A CB 1 ATOM 3743 C CG . LYS A 1 498 ? -5.329 13.584 14.784 1.00 27.12 ? 806 LYS A CG 1 ATOM 3744 C CD . LYS A 1 498 ? -5.958 13.498 13.406 1.00 35.60 ? 806 LYS A CD 1 ATOM 3745 C CE . LYS A 1 498 ? -4.972 12.918 12.394 1.00 41.32 ? 806 LYS A CE 1 ATOM 3746 N NZ . LYS A 1 498 ? -5.575 12.754 11.041 1.00 44.41 ? 806 LYS A NZ 1 ATOM 3747 N N . ALA A 1 499 ? -7.583 15.607 18.305 1.00 15.45 ? 807 ALA A N 1 ATOM 3748 C CA . ALA A 1 499 ? -8.694 15.871 19.215 1.00 17.77 ? 807 ALA A CA 1 ATOM 3749 C C . ALA A 1 499 ? -9.075 17.351 19.170 1.00 17.11 ? 807 ALA A C 1 ATOM 3750 O O . ALA A 1 499 ? -10.246 17.708 19.278 1.00 19.55 ? 807 ALA A O 1 ATOM 3751 C CB . ALA A 1 499 ? -8.342 15.447 20.638 1.00 18.24 ? 807 ALA A CB 1 ATOM 3752 N N . ALA A 1 500 ? -8.080 18.210 18.993 1.00 16.44 ? 808 ALA A N 1 ATOM 3753 C CA . ALA A 1 500 ? -8.336 19.645 18.924 1.00 17.68 ? 808 ALA A CA 1 ATOM 3754 C C . ALA A 1 500 ? -9.216 20.020 17.724 1.00 18.22 ? 808 ALA A C 1 ATOM 3755 O O . ALA A 1 500 ? -10.101 20.867 17.836 1.00 19.15 ? 808 ALA A O 1 ATOM 3756 C CB . ALA A 1 500 ? -7.024 20.417 18.889 1.00 17.40 ? 808 ALA A CB 1 ATOM 3757 N N . THR A 1 501 ? -8.980 19.377 16.585 1.00 14.79 ? 809 THR A N 1 ATOM 3758 C CA . THR A 1 501 ? -9.703 19.690 15.347 1.00 15.90 ? 809 THR A CA 1 ATOM 3759 C C . THR A 1 501 ? -11.019 18.928 15.213 1.00 15.79 ? 809 THR A C 1 ATOM 3760 O O . THR A 1 501 ? -11.778 19.155 14.274 1.00 16.02 ? 809 THR A O 1 ATOM 3761 C CB . THR A 1 501 ? -8.864 19.346 14.114 1.00 22.04 ? 809 THR A CB 1 ATOM 3762 O OG1 . THR A 1 501 ? -8.616 17.936 14.098 1.00 21.43 ? 809 THR A OG1 1 ATOM 3763 C CG2 . THR A 1 501 ? -7.540 20.099 14.138 1.00 26.05 ? 809 THR A CG2 1 ATOM 3764 N N . GLY A 1 502 ? -11.277 18.008 16.135 1.00 16.45 ? 810 GLY A N 1 ATOM 3765 C CA . GLY A 1 502 ? -12.497 17.219 16.101 1.00 15.99 ? 810 GLY A CA 1 ATOM 3766 C C . GLY A 1 502 ? -12.361 15.931 15.299 1.00 17.07 ? 810 GLY A C 1 ATOM 3767 O O . GLY A 1 502 ? -13.333 15.199 15.113 1.00 19.37 ? 810 GLY A O 1 ATOM 3768 N N . GLU A 1 503 ? -11.153 15.639 14.828 1.00 17.31 ? 811 GLU A N 1 ATOM 3769 C CA . GLU A 1 503 ? -10.921 14.392 14.093 1.00 17.62 ? 811 GLU A CA 1 ATOM 3770 C C . GLU A 1 503 ? -10.930 13.162 15.006 1.00 18.82 ? 811 GLU A C 1 ATOM 3771 O O . GLU A 1 503 ? -11.191 12.048 14.551 1.00 19.48 ? 811 GLU A O 1 ATOM 3772 C CB . GLU A 1 503 ? -9.604 14.455 13.329 1.00 18.69 ? 811 GLU A CB 1 ATOM 3773 C CG . GLU A 1 503 ? -9.670 15.273 12.062 1.00 20.44 ? 811 GLU A CG 1 ATOM 3774 C CD . GLU A 1 503 ? -8.346 15.297 11.340 1.00 25.37 ? 811 GLU A CD 1 ATOM 3775 O OE1 . GLU A 1 503 ? -7.673 16.343 11.397 1.00 30.47 ? 811 GLU A OE1 1 ATOM 3776 O OE2 . GLU A 1 503 ? -7.967 14.263 10.743 1.00 26.11 ? 811 GLU A OE2 1 ATOM 3777 N N . GLU A 1 504 ? -10.622 13.380 16.282 1.00 16.29 ? 812 GLU A N 1 ATOM 3778 C CA . GLU A 1 504 ? -10.646 12.335 17.313 1.00 17.21 ? 812 GLU A CA 1 ATOM 3779 C C . GLU A 1 504 ? -11.360 12.865 18.551 1.00 15.94 ? 812 GLU A C 1 ATOM 3780 O O . GLU A 1 504 ? -11.372 14.065 18.794 1.00 15.54 ? 812 GLU A O 1 ATOM 3781 C CB . GLU A 1 504 ? -9.222 11.933 17.720 1.00 17.94 ? 812 GLU A CB 1 ATOM 3782 C CG . GLU A 1 504 ? -8.492 11.070 16.700 1.00 22.49 ? 812 GLU A CG 1 ATOM 3783 C CD . GLU A 1 504 ? -7.089 10.680 17.149 1.00 23.39 ? 812 GLU A CD 1 ATOM 3784 O OE1 . GLU A 1 504 ? -6.349 10.112 16.324 1.00 25.03 ? 812 GLU A OE1 1 ATOM 3785 O OE2 . GLU A 1 504 ? -6.722 10.941 18.318 1.00 22.22 ? 812 GLU A OE2 1 ATOM 3786 N N . VAL A 1 505 ? -11.955 11.971 19.331 1.00 16.12 ? 813 VAL A N 1 ATOM 3787 C CA . VAL A 1 505 ? -12.514 12.357 20.622 1.00 17.64 ? 813 VAL A CA 1 ATOM 3788 C C . VAL A 1 505 ? -11.369 12.463 21.632 1.00 18.07 ? 813 VAL A C 1 ATOM 3789 O O . VAL A 1 505 ? -10.504 11.588 21.668 1.00 17.79 ? 813 VAL A O 1 ATOM 3790 C CB . VAL A 1 505 ? -13.537 11.315 21.098 1.00 18.05 ? 813 VAL A CB 1 ATOM 3791 C CG1 . VAL A 1 505 ? -14.129 11.709 22.449 1.00 17.48 ? 813 VAL A CG1 1 ATOM 3792 C CG2 . VAL A 1 505 ? -14.642 11.150 20.049 1.00 18.99 ? 813 VAL A CG2 1 ATOM 3793 N N . PRO A 1 506 ? -11.342 13.543 22.437 1.00 16.52 ? 814 PRO A N 1 ATOM 3794 C CA . PRO A 1 506 ? -10.275 13.662 23.443 1.00 16.01 ? 814 PRO A CA 1 ATOM 3795 C C . PRO A 1 506 ? -10.269 12.464 24.385 1.00 17.80 ? 814 PRO A C 1 ATOM 3796 O O . PRO A 1 506 ? -11.334 11.931 24.716 1.00 17.38 ? 814 PRO A O 1 ATOM 3797 C CB . PRO A 1 506 ? -10.659 14.922 24.232 1.00 18.72 ? 814 PRO A CB 1 ATOM 3798 C CG . PRO A 1 506 ? -11.583 15.688 23.329 1.00 19.07 ? 814 PRO A CG 1 ATOM 3799 C CD . PRO A 1 506 ? -12.289 14.674 22.481 1.00 17.04 ? 814 PRO A CD 1 ATOM 3800 N N . ARG A 1 507 ? -9.081 12.045 24.808 1.00 16.74 ? 815 ARG A N 1 ATOM 3801 C CA . ARG A 1 507 ? -8.964 10.892 25.687 1.00 17.43 ? 815 ARG A CA 1 ATOM 3802 C C . ARG A 1 507 ? -8.512 11.310 27.083 1.00 17.87 ? 815 ARG A C 1 ATOM 3803 O O . ARG A 1 507 ? -8.245 10.471 27.936 1.00 19.79 ? 815 ARG A O 1 ATOM 3804 C CB . ARG A 1 507 ? -8.042 9.830 25.065 1.00 15.29 ? 815 ARG A CB 1 ATOM 3805 C CG . ARG A 1 507 ? -8.624 9.227 23.784 1.00 15.68 ? 815 ARG A CG 1 ATOM 3806 C CD . ARG A 1 507 ? -7.750 8.120 23.172 1.00 16.88 ? 815 ARG A CD 1 ATOM 3807 N NE . ARG A 1 507 ? -6.401 8.568 22.842 1.00 18.06 ? 815 ARG A NE 1 ATOM 3808 C CZ . ARG A 1 507 ? -6.053 9.152 21.696 1.00 19.42 ? 815 ARG A CZ 1 ATOM 3809 N NH1 . ARG A 1 507 ? -6.955 9.384 20.748 1.00 15.26 ? 815 ARG A NH1 1 ATOM 3810 N NH2 . ARG A 1 507 ? -4.793 9.511 21.503 1.00 20.83 ? 815 ARG A NH2 1 ATOM 3811 N N . THR A 1 508 ? -8.459 12.621 27.315 1.00 16.49 ? 816 THR A N 1 ATOM 3812 C CA . THR A 1 508 ? -8.162 13.146 28.639 1.00 18.38 ? 816 THR A CA 1 ATOM 3813 C C . THR A 1 508 ? -9.365 13.923 29.170 1.00 15.66 ? 816 THR A C 1 ATOM 3814 O O . THR A 1 508 ? -10.320 14.190 28.446 1.00 17.01 ? 816 THR A O 1 ATOM 3815 C CB . THR A 1 508 ? -6.927 14.079 28.629 1.00 20.94 ? 816 THR A CB 1 ATOM 3816 O OG1 . THR A 1 508 ? -7.223 15.261 27.871 1.00 21.35 ? 816 THR A OG1 1 ATOM 3817 C CG2 . THR A 1 508 ? -5.712 13.374 28.023 1.00 20.55 ? 816 THR A CG2 1 ATOM 3818 N N . ILE A 1 509 ? -9.314 14.267 30.448 1.00 17.33 ? 817 ILE A N 1 ATOM 3819 C CA . ILE A 1 509 ? -10.312 15.138 31.047 1.00 17.79 ? 817 ILE A CA 1 ATOM 3820 C C . ILE A 1 509 ? -9.867 16.587 30.867 1.00 19.82 ? 817 ILE A C 1 ATOM 3821 O O . ILE A 1 509 ? -8.732 16.941 31.184 1.00 24.40 ? 817 ILE A O 1 ATOM 3822 C CB . ILE A 1 509 ? -10.485 14.814 32.525 1.00 19.44 ? 817 ILE A CB 1 ATOM 3823 C CG1 . ILE A 1 509 ? -11.146 13.437 32.670 1.00 19.63 ? 817 ILE A CG1 1 ATOM 3824 C CG2 . ILE A 1 509 ? -11.314 15.873 33.221 1.00 19.66 ? 817 ILE A CG2 1 ATOM 3825 C CD1 . ILE A 1 509 ? -10.987 12.840 34.034 1.00 20.35 ? 817 ILE A CD1 1 ATOM 3826 N N . ILE A 1 510 ? -10.762 17.423 30.359 1.00 15.47 ? 818 ILE A N 1 ATOM 3827 C CA . ILE A 1 510 ? -10.386 18.777 29.992 1.00 13.15 ? 818 ILE A CA 1 ATOM 3828 C C . ILE A 1 510 ? -11.039 19.800 30.906 1.00 14.59 ? 818 ILE A C 1 ATOM 3829 O O . ILE A 1 510 ? -12.200 19.644 31.286 1.00 15.58 ? 818 ILE A O 1 ATOM 3830 C CB . ILE A 1 510 ? -10.755 19.070 28.529 1.00 13.82 ? 818 ILE A CB 1 ATOM 3831 C CG1 . ILE A 1 510 ? -10.081 18.048 27.611 1.00 15.02 ? 818 ILE A CG1 1 ATOM 3832 C CG2 . ILE A 1 510 ? -10.339 20.480 28.137 1.00 15.48 ? 818 ILE A CG2 1 ATOM 3833 C CD1 . ILE A 1 510 ? -10.404 18.242 26.141 1.00 20.52 ? 818 ILE A CD1 1 ATOM 3834 N N . VAL A 1 511 ? -10.275 20.829 31.272 1.00 15.80 ? 819 VAL A N 1 ATOM 3835 C CA . VAL A 1 511 ? -10.767 21.910 32.121 1.00 15.68 ? 819 VAL A CA 1 ATOM 3836 C C . VAL A 1 511 ? -10.998 23.154 31.277 1.00 16.42 ? 819 VAL A C 1 ATOM 3837 O O . VAL A 1 511 ? -10.147 23.535 30.473 1.00 16.88 ? 819 VAL A O 1 ATOM 3838 C CB . VAL A 1 511 ? -9.756 22.296 33.207 1.00 19.86 ? 819 VAL A CB 1 ATOM 3839 C CG1 . VAL A 1 511 ? -10.391 23.275 34.211 1.00 23.74 ? 819 VAL A CG1 1 ATOM 3840 C CG2 . VAL A 1 511 ? -9.243 21.079 33.913 1.00 22.75 ? 819 VAL A CG2 1 ATOM 3841 N N . THR A 1 512 ? -12.139 23.799 31.487 1.00 17.07 ? 820 THR A N 1 ATOM 3842 C CA . THR A 1 512 ? -12.483 25.011 30.763 1.00 14.65 ? 820 THR A CA 1 ATOM 3843 C C . THR A 1 512 ? -12.933 26.041 31.787 1.00 15.09 ? 820 THR A C 1 ATOM 3844 O O . THR A 1 512 ? -13.744 25.727 32.668 1.00 15.98 ? 820 THR A O 1 ATOM 3845 C CB . THR A 1 512 ? -13.614 24.724 29.763 1.00 12.78 ? 820 THR A CB 1 ATOM 3846 O OG1 . THR A 1 512 ? -13.294 23.537 29.031 1.00 14.62 ? 820 THR A OG1 1 ATOM 3847 C CG2 . THR A 1 512 ? -13.791 25.899 28.793 1.00 13.95 ? 820 THR A CG2 1 ATOM 3848 N N . THR A 1 513 ? -12.378 27.252 31.725 1.00 14.49 ? 821 THR A N 1 ATOM 3849 C CA . THR A 1 513 ? -12.695 28.244 32.747 1.00 14.04 ? 821 THR A CA 1 ATOM 3850 C C . THR A 1 513 ? -12.877 29.635 32.180 1.00 15.75 ? 821 THR A C 1 ATOM 3851 O O . THR A 1 513 ? -12.287 29.980 31.167 1.00 16.70 ? 821 THR A O 1 ATOM 3852 C CB . THR A 1 513 ? -11.606 28.349 33.849 1.00 23.68 ? 821 THR A CB 1 ATOM 3853 O OG1 . THR A 1 513 ? -10.466 29.042 33.329 1.00 24.66 ? 821 THR A OG1 1 ATOM 3854 C CG2 . THR A 1 513 ? -11.196 26.980 34.374 1.00 21.18 ? 821 THR A CG2 1 ATOM 3855 N N . ARG A 1 514 ? -13.685 30.442 32.861 1.00 15.85 ? 822 ARG A N 1 ATOM 3856 C CA . ARG A 1 514 ? -13.835 31.841 32.481 1.00 13.84 ? 822 ARG A CA 1 ATOM 3857 C C . ARG A 1 514 ? -12.510 32.592 32.543 1.00 16.32 ? 822 ARG A C 1 ATOM 3858 O O . ARG A 1 514 ? -12.264 33.487 31.732 1.00 17.69 ? 822 ARG A O 1 ATOM 3859 C CB . ARG A 1 514 ? -14.901 32.521 33.352 1.00 16.11 ? 822 ARG A CB 1 ATOM 3860 C CG . ARG A 1 514 ? -16.307 32.109 32.928 1.00 18.24 ? 822 ARG A CG 1 ATOM 3861 C CD . ARG A 1 514 ? -17.383 32.971 33.592 1.00 17.60 ? 822 ARG A CD 1 ATOM 3862 N NE . ARG A 1 514 ? -18.678 32.720 32.973 1.00 20.50 ? 822 ARG A NE 1 ATOM 3863 C CZ . ARG A 1 514 ? -19.776 33.427 33.202 1.00 18.52 ? 822 ARG A CZ 1 ATOM 3864 N NH1 . ARG A 1 514 ? -19.741 34.459 34.038 1.00 14.64 ? 822 ARG A NH1 1 ATOM 3865 N NH2 . ARG A 1 514 ? -20.903 33.109 32.581 1.00 18.39 ? 822 ARG A NH2 1 ATOM 3866 N N . SER A 1 515 ? -11.656 32.232 33.499 1.00 14.29 ? 823 SER A N 1 ATOM 3867 C CA . SER A 1 515 ? -10.341 32.866 33.606 1.00 20.63 ? 823 SER A CA 1 ATOM 3868 C C . SER A 1 515 ? -9.441 32.615 32.387 1.00 21.30 ? 823 SER A C 1 ATOM 3869 O O . SER A 1 515 ? -8.543 33.406 32.108 1.00 22.03 ? 823 SER A O 1 ATOM 3870 C CB . SER A 1 515 ? -9.623 32.443 34.897 1.00 22.00 ? 823 SER A CB 1 ATOM 3871 O OG . SER A 1 515 ? -9.328 31.057 34.887 1.00 22.57 ? 823 SER A OG 1 ATOM 3872 N N . GLN A 1 516 ? -9.681 31.523 31.660 1.00 19.26 ? 824 GLN A N 1 ATOM 3873 C CA . GLN A 1 516 ? -8.915 31.229 30.448 1.00 18.76 ? 824 GLN A CA 1 ATOM 3874 C C . GLN A 1 516 ? -9.140 32.287 29.366 1.00 21.96 ? 824 GLN A C 1 ATOM 3875 O O . GLN A 1 516 ? -8.311 32.459 28.480 1.00 21.82 ? 824 GLN A O 1 ATOM 3876 C CB . GLN A 1 516 ? -9.309 29.862 29.878 1.00 17.95 ? 824 GLN A CB 1 ATOM 3877 C CG . GLN A 1 516 ? -8.638 28.676 30.555 1.00 17.44 ? 824 GLN A CG 1 ATOM 3878 C CD . GLN A 1 516 ? -9.244 27.361 30.134 1.00 18.34 ? 824 GLN A CD 1 ATOM 3879 O OE1 . GLN A 1 516 ? -10.380 27.314 29.662 1.00 15.46 ? 824 GLN A OE1 1 ATOM 3880 N NE2 . GLN A 1 516 ? -8.487 26.279 30.289 1.00 20.05 ? 824 GLN A NE2 1 ATOM 3881 N N . TYR A 1 517 ? -10.274 32.975 29.427 1.00 20.42 ? 825 TYR A N 1 ATOM 3882 C CA . TYR A 1 517 ? -10.627 33.927 28.375 1.00 20.67 ? 825 TYR A CA 1 ATOM 3883 C C . TYR A 1 517 ? -10.848 35.331 28.929 1.00 20.04 ? 825 TYR A C 1 ATOM 3884 O O . TYR A 1 517 ? -11.306 36.222 28.213 1.00 18.99 ? 825 TYR A O 1 ATOM 3885 C CB . TYR A 1 517 ? -11.854 33.433 27.599 1.00 18.43 ? 825 TYR A CB 1 ATOM 3886 C CG . TYR A 1 517 ? -11.635 32.045 27.023 1.00 15.86 ? 825 TYR A CG 1 ATOM 3887 C CD1 . TYR A 1 517 ? -10.903 31.871 25.861 1.00 12.02 ? 825 TYR A CD1 1 ATOM 3888 C CD2 . TYR A 1 517 ? -12.117 30.914 27.670 1.00 15.00 ? 825 TYR A CD2 1 ATOM 3889 C CE1 . TYR A 1 517 ? -10.676 30.605 25.340 1.00 16.00 ? 825 TYR A CE1 1 ATOM 3890 C CE2 . TYR A 1 517 ? -11.897 29.642 27.152 1.00 11.14 ? 825 TYR A CE2 1 ATOM 3891 C CZ . TYR A 1 517 ? -11.182 29.498 25.991 1.00 15.11 ? 825 TYR A CZ 1 ATOM 3892 O OH . TYR A 1 517 ? -10.949 28.242 25.472 1.00 14.28 ? 825 TYR A OH 1 ATOM 3893 N N . GLY A 1 518 ? -10.520 35.520 30.207 1.00 18.05 ? 826 GLY A N 1 ATOM 3894 C CA . GLY A 1 518 ? -10.637 36.825 30.832 1.00 20.94 ? 826 GLY A CA 1 ATOM 3895 C C . GLY A 1 518 ? -12.079 37.246 31.048 1.00 22.24 ? 826 GLY A C 1 ATOM 3896 O O . GLY A 1 518 ? -12.387 38.436 31.146 1.00 23.11 ? 826 GLY A O 1 ATOM 3897 N N . LEU A 1 519 ? -12.969 36.264 31.136 1.00 20.15 ? 827 LEU A N 1 ATOM 3898 C CA . LEU A 1 519 ? -14.389 36.540 31.344 1.00 21.70 ? 827 LEU A CA 1 ATOM 3899 C C . LEU A 1 519 ? -14.696 36.775 32.824 1.00 21.10 ? 827 LEU A C 1 ATOM 3900 O O . LEU A 1 519 ? -14.106 36.137 33.696 1.00 18.95 ? 827 LEU A O 1 ATOM 3901 C CB . LEU A 1 519 ? -15.234 35.381 30.821 1.00 19.65 ? 827 LEU A CB 1 ATOM 3902 C CG . LEU A 1 519 ? -15.172 35.130 29.312 1.00 20.00 ? 827 LEU A CG 1 ATOM 3903 C CD1 . LEU A 1 519 ? -15.758 33.756 28.985 1.00 18.06 ? 827 LEU A CD1 1 ATOM 3904 C CD2 . LEU A 1 519 ? -15.899 36.236 28.535 1.00 18.72 ? 827 LEU A CD2 1 ATOM 3905 N N . PRO A 1 520 ? -15.626 37.695 33.113 1.00 23.99 ? 828 PRO A N 1 ATOM 3906 C CA . PRO A 1 520 ? -15.930 38.012 34.514 1.00 26.25 ? 828 PRO A CA 1 ATOM 3907 C C . PRO A 1 520 ? -16.548 36.834 35.262 1.00 23.10 ? 828 PRO A C 1 ATOM 3908 O O . PRO A 1 520 ? -17.427 36.164 34.730 1.00 18.42 ? 828 PRO A O 1 ATOM 3909 C CB . PRO A 1 520 ? -16.936 39.165 34.403 1.00 27.54 ? 828 PRO A CB 1 ATOM 3910 C CG . PRO A 1 520 ? -17.587 38.965 33.070 1.00 26.92 ? 828 PRO A CG 1 ATOM 3911 C CD . PRO A 1 520 ? -16.500 38.416 32.171 1.00 21.95 ? 828 PRO A CD 1 ATOM 3912 N N . GLU A 1 521 ? -16.080 36.599 36.485 1.00 26.02 ? 829 GLU A N 1 ATOM 3913 C CA . GLU A 1 521 ? -16.596 35.527 37.339 1.00 29.75 ? 829 GLU A CA 1 ATOM 3914 C C . GLU A 1 521 ? -17.949 35.862 37.966 1.00 30.48 ? 829 GLU A C 1 ATOM 3915 O O . GLU A 1 521 ? -18.668 34.970 38.416 1.00 33.45 ? 829 GLU A O 1 ATOM 3916 C CB . GLU A 1 521 ? -15.601 35.212 38.461 1.00 35.76 ? 829 GLU A CB 1 ATOM 3917 C CG . GLU A 1 521 ? -14.156 35.067 38.005 1.00 42.72 ? 829 GLU A CG 1 ATOM 3918 C CD . GLU A 1 521 ? -13.918 33.829 37.157 1.00 45.65 ? 829 GLU A CD 1 ATOM 3919 O OE1 . GLU A 1 521 ? -13.266 33.954 36.095 1.00 43.11 ? 829 GLU A OE1 1 ATOM 3920 O OE2 . GLU A 1 521 ? -14.369 32.734 37.562 1.00 46.89 ? 829 GLU A OE2 1 ATOM 3921 N N . ASP A 1 522 ? -18.305 37.139 37.985 1.00 29.94 ? 830 ASP A N 1 ATOM 3922 C CA . ASP A 1 522 ? -19.503 37.571 38.698 1.00 34.89 ? 830 ASP A CA 1 ATOM 3923 C C . ASP A 1 522 ? -20.520 38.292 37.818 1.00 34.81 ? 830 ASP A C 1 ATOM 3924 O O . ASP A 1 522 ? -21.221 39.196 38.286 1.00 38.28 ? 830 ASP A O 1 ATOM 3925 C CB . ASP A 1 522 ? -19.106 38.498 39.850 1.00 40.76 ? 830 ASP A CB 1 ATOM 3926 C CG . ASP A 1 522 ? -18.382 39.746 39.367 1.00 44.07 ? 830 ASP A CG 1 ATOM 3927 O OD1 . ASP A 1 522 ? -17.940 39.763 38.194 1.00 40.24 ? 830 ASP A OD1 1 ATOM 3928 O OD2 . ASP A 1 522 ? -18.246 40.703 40.162 1.00 48.09 ? 830 ASP A OD2 1 ATOM 3929 N N . ALA A 1 523 ? -20.609 37.904 36.555 1.00 28.08 ? 831 ALA A N 1 ATOM 3930 C CA . ALA A 1 523 ? -21.474 38.617 35.627 1.00 28.30 ? 831 ALA A CA 1 ATOM 3931 C C . ALA A 1 523 ? -22.043 37.719 34.534 1.00 22.11 ? 831 ALA A C 1 ATOM 3932 O O . ALA A 1 523 ? -21.550 36.612 34.288 1.00 17.53 ? 831 ALA A O 1 ATOM 3933 C CB . ALA A 1 523 ? -20.728 39.799 35.009 1.00 29.79 ? 831 ALA A CB 1 ATOM 3934 N N . ILE A 1 524 ? -23.094 38.209 33.889 1.00 19.43 ? 832 ILE A N 1 ATOM 3935 C CA . ILE A 1 524 ? -23.710 37.499 32.774 1.00 16.72 ? 832 ILE A CA 1 ATOM 3936 C C . ILE A 1 524 ? -22.836 37.596 31.529 1.00 18.87 ? 832 ILE A C 1 ATOM 3937 O O . ILE A 1 524 ? -22.393 38.678 31.154 1.00 18.78 ? 832 ILE A O 1 ATOM 3938 C CB . ILE A 1 524 ? -25.089 38.099 32.449 1.00 19.70 ? 832 ILE A CB 1 ATOM 3939 C CG1 . ILE A 1 524 ? -26.063 37.866 33.610 1.00 18.44 ? 832 ILE A CG1 1 ATOM 3940 C CG2 . ILE A 1 524 ? -25.626 37.534 31.139 1.00 18.78 ? 832 ILE A CG2 1 ATOM 3941 C CD1 . ILE A 1 524 ? -26.464 36.400 33.825 1.00 19.83 ? 832 ILE A CD1 1 ATOM 3942 N N . VAL A 1 525 ? -22.580 36.464 30.887 1.00 15.19 ? 833 VAL A N 1 ATOM 3943 C CA . VAL A 1 525 ? -21.834 36.468 29.628 1.00 14.53 ? 833 VAL A CA 1 ATOM 3944 C C . VAL A 1 525 ? -22.761 36.200 28.447 1.00 16.32 ? 833 VAL A C 1 ATOM 3945 O O . VAL A 1 525 ? -23.325 35.115 28.332 1.00 16.03 ? 833 VAL A O 1 ATOM 3946 C CB . VAL A 1 525 ? -20.694 35.423 29.645 1.00 14.58 ? 833 VAL A CB 1 ATOM 3947 C CG1 . VAL A 1 525 ? -20.025 35.334 28.279 1.00 16.05 ? 833 VAL A CG1 1 ATOM 3948 C CG2 . VAL A 1 525 ? -19.661 35.765 30.723 1.00 16.20 ? 833 VAL A CG2 1 ATOM 3949 N N . TYR A 1 526 ? -22.944 37.204 27.588 1.00 14.78 ? 834 TYR A N 1 ATOM 3950 C CA . TYR A 1 526 ? -23.642 37.001 26.322 1.00 10.68 ? 834 TYR A CA 1 ATOM 3951 C C . TYR A 1 526 ? -22.592 36.699 25.273 1.00 16.34 ? 834 TYR A C 1 ATOM 3952 O O . TYR A 1 526 ? -21.558 37.364 25.223 1.00 17.31 ? 834 TYR A O 1 ATOM 3953 C CB . TYR A 1 526 ? -24.392 38.256 25.896 1.00 12.23 ? 834 TYR A CB 1 ATOM 3954 C CG . TYR A 1 526 ? -25.553 38.634 26.780 1.00 13.06 ? 834 TYR A CG 1 ATOM 3955 C CD1 . TYR A 1 526 ? -26.778 37.989 26.663 1.00 12.35 ? 834 TYR A CD1 1 ATOM 3956 C CD2 . TYR A 1 526 ? -25.428 39.639 27.727 1.00 16.07 ? 834 TYR A CD2 1 ATOM 3957 C CE1 . TYR A 1 526 ? -27.848 38.334 27.471 1.00 12.80 ? 834 TYR A CE1 1 ATOM 3958 C CE2 . TYR A 1 526 ? -26.495 39.992 28.545 1.00 17.39 ? 834 TYR A CE2 1 ATOM 3959 C CZ . TYR A 1 526 ? -27.701 39.339 28.406 1.00 16.34 ? 834 TYR A CZ 1 ATOM 3960 O OH . TYR A 1 526 ? -28.760 39.693 29.207 1.00 17.90 ? 834 TYR A OH 1 ATOM 3961 N N . CYS A 1 527 ? -22.845 35.714 24.420 1.00 19.00 ? 835 CYS A N 1 ATOM 3962 C CA . CYS A 1 527 ? -21.865 35.394 23.387 1.00 14.03 ? 835 CYS A CA 1 ATOM 3963 C C . CYS A 1 527 ? -22.405 35.432 21.966 1.00 17.35 ? 835 CYS A C 1 ATOM 3964 O O . CYS A 1 527 ? -23.608 35.376 21.725 1.00 18.59 ? 835 CYS A O 1 ATOM 3965 C CB . CYS A 1 527 ? -21.191 34.042 23.656 1.00 14.07 ? 835 CYS A CB 1 ATOM 3966 S SG . CYS A 1 527 ? -22.256 32.605 23.427 1.00 20.72 ? 835 CYS A SG 1 ATOM 3967 N N . ASN A 1 528 ? -21.485 35.566 21.020 1.00 16.11 ? 836 ASN A N 1 ATOM 3968 C CA . ASN A 1 528 ? -21.781 35.243 19.635 1.00 15.78 ? 836 ASN A CA 1 ATOM 3969 C C . ASN A 1 528 ? -20.470 34.850 18.996 1.00 14.14 ? 836 ASN A C 1 ATOM 3970 O O . ASN A 1 528 ? -19.517 35.632 19.005 1.00 12.87 ? 836 ASN A O 1 ATOM 3971 C CB . ASN A 1 528 ? -22.418 36.421 18.890 1.00 17.34 ? 836 ASN A CB 1 ATOM 3972 C CG . ASN A 1 528 ? -22.806 36.051 17.462 1.00 22.24 ? 836 ASN A CG 1 ATOM 3973 O OD1 . ASN A 1 528 ? -21.948 35.739 16.640 1.00 21.36 ? 836 ASN A OD1 1 ATOM 3974 N ND2 . ASN A 1 528 ? -24.101 36.067 17.172 1.00 23.00 ? 836 ASN A ND2 1 ATOM 3975 N N . PHE A 1 529 ? -20.413 33.632 18.467 1.00 12.11 ? 837 PHE A N 1 ATOM 3976 C CA . PHE A 1 529 ? -19.155 33.104 17.928 1.00 13.92 ? 837 PHE A CA 1 ATOM 3977 C C . PHE A 1 529 ? -19.117 33.089 16.402 1.00 15.51 ? 837 PHE A C 1 ATOM 3978 O O . PHE A 1 529 ? -18.330 32.362 15.785 1.00 14.39 ? 837 PHE A O 1 ATOM 3979 C CB . PHE A 1 529 ? -18.914 31.694 18.469 1.00 16.36 ? 837 PHE A CB 1 ATOM 3980 C CG . PHE A 1 529 ? -18.722 31.641 19.956 1.00 15.56 ? 837 PHE A CG 1 ATOM 3981 C CD1 . PHE A 1 529 ? -18.073 32.669 20.624 1.00 16.07 ? 837 PHE A CD1 1 ATOM 3982 C CD2 . PHE A 1 529 ? -19.193 30.566 20.688 1.00 18.85 ? 837 PHE A CD2 1 ATOM 3983 C CE1 . PHE A 1 529 ? -17.894 32.617 22.001 1.00 15.70 ? 837 PHE A CE1 1 ATOM 3984 C CE2 . PHE A 1 529 ? -19.011 30.510 22.057 1.00 18.60 ? 837 PHE A CE2 1 ATOM 3985 C CZ . PHE A 1 529 ? -18.366 31.533 22.710 1.00 16.04 ? 837 PHE A CZ 1 ATOM 3986 N N . ASN A 1 530 ? -19.969 33.893 15.785 1.00 14.68 ? 838 ASN A N 1 ATOM 3987 C CA . ASN A 1 530 ? -19.980 33.977 14.332 1.00 15.45 ? 838 ASN A CA 1 ATOM 3988 C C . ASN A 1 530 ? -18.857 34.831 13.774 1.00 15.62 ? 838 ASN A C 1 ATOM 3989 O O . ASN A 1 530 ? -18.272 35.657 14.481 1.00 12.67 ? 838 ASN A O 1 ATOM 3990 C CB . ASN A 1 530 ? -21.326 34.505 13.831 1.00 17.23 ? 838 ASN A CB 1 ATOM 3991 C CG . ASN A 1 530 ? -22.415 33.455 13.888 1.00 22.14 ? 838 ASN A CG 1 ATOM 3992 O OD1 . ASN A 1 530 ? -22.337 32.434 13.209 1.00 29.56 ? 838 ASN A OD1 1 ATOM 3993 N ND2 . ASN A 1 530 ? -23.452 33.716 14.662 1.00 19.36 ? 838 ASN A ND2 1 ATOM 3994 N N . GLN A 1 531 ? -18.545 34.613 12.500 1.00 13.14 ? 839 GLN A N 1 ATOM 3995 C CA . GLN A 1 531 ? -17.706 35.549 11.777 1.00 11.04 ? 839 GLN A CA 1 ATOM 3996 C C . GLN A 1 531 ? -18.365 36.917 11.879 1.00 13.89 ? 839 GLN A C 1 ATOM 3997 O O . GLN A 1 531 ? -19.589 37.024 11.814 1.00 14.53 ? 839 GLN A O 1 ATOM 3998 C CB . GLN A 1 531 ? -17.612 35.134 10.323 1.00 12.42 ? 839 GLN A CB 1 ATOM 3999 C CG . GLN A 1 531 ? -16.934 33.804 10.107 1.00 13.50 ? 839 GLN A CG 1 ATOM 4000 C CD . GLN A 1 531 ? -16.706 33.541 8.649 1.00 16.44 ? 839 GLN A CD 1 ATOM 4001 O OE1 . GLN A 1 531 ? -15.870 34.187 8.025 1.00 15.92 ? 839 GLN A OE1 1 ATOM 4002 N NE2 . GLN A 1 531 ? -17.479 32.622 8.080 1.00 16.25 ? 839 GLN A NE2 1 ATOM 4003 N N . LEU A 1 532 ? -17.557 37.955 12.062 1.00 12.68 ? 840 LEU A N 1 ATOM 4004 C CA . LEU A 1 532 ? -18.078 39.297 12.322 1.00 13.17 ? 840 LEU A CA 1 ATOM 4005 C C . LEU A 1 532 ? -18.907 39.879 11.173 1.00 15.47 ? 840 LEU A C 1 ATOM 4006 O O . LEU A 1 532 ? -19.685 40.811 11.378 1.00 14.30 ? 840 LEU A O 1 ATOM 4007 C CB . LEU A 1 532 ? -16.926 40.243 12.635 1.00 17.08 ? 840 LEU A CB 1 ATOM 4008 C CG . LEU A 1 532 ? -16.113 39.850 13.865 1.00 16.88 ? 840 LEU A CG 1 ATOM 4009 C CD1 . LEU A 1 532 ? -14.993 40.861 14.078 1.00 11.41 ? 840 LEU A CD1 1 ATOM 4010 C CD2 . LEU A 1 532 ? -17.030 39.760 15.075 1.00 17.48 ? 840 LEU A CD2 1 ATOM 4011 N N . TYR A 1 533 ? -18.750 39.330 9.972 1.00 13.02 ? 841 TYR A N 1 ATOM 4012 C CA . TYR A 1 533 ? -19.460 39.876 8.813 1.00 15.62 ? 841 TYR A CA 1 ATOM 4013 C C . TYR A 1 533 ? -20.982 39.767 8.974 1.00 14.67 ? 841 TYR A C 1 ATOM 4014 O O . TYR A 1 533 ? -21.746 40.510 8.355 1.00 17.52 ? 841 TYR A O 1 ATOM 4015 C CB . TYR A 1 533 ? -18.983 39.213 7.509 1.00 18.93 ? 841 TYR A CB 1 ATOM 4016 C CG . TYR A 1 533 ? -19.601 37.852 7.216 1.00 18.84 ? 841 TYR A CG 1 ATOM 4017 C CD1 . TYR A 1 533 ? -20.842 37.751 6.600 1.00 18.93 ? 841 TYR A CD1 1 ATOM 4018 C CD2 . TYR A 1 533 ? -18.931 36.672 7.535 1.00 20.84 ? 841 TYR A CD2 1 ATOM 4019 C CE1 . TYR A 1 533 ? -21.413 36.529 6.332 1.00 16.91 ? 841 TYR A CE1 1 ATOM 4020 C CE2 . TYR A 1 533 ? -19.497 35.432 7.269 1.00 18.61 ? 841 TYR A CE2 1 ATOM 4021 C CZ . TYR A 1 533 ? -20.740 35.373 6.663 1.00 21.01 ? 841 TYR A CZ 1 ATOM 4022 O OH . TYR A 1 533 ? -21.314 34.155 6.375 1.00 24.68 ? 841 TYR A OH 1 ATOM 4023 N N . LYS A 1 534 ? -21.414 38.834 9.817 1.00 13.69 ? 842 LYS A N 1 ATOM 4024 C CA . LYS A 1 534 ? -22.838 38.603 10.048 1.00 15.22 ? 842 LYS A CA 1 ATOM 4025 C C . LYS A 1 534 ? -23.504 39.689 10.891 1.00 17.63 ? 842 LYS A C 1 ATOM 4026 O O . LYS A 1 534 ? -24.730 39.739 10.982 1.00 17.36 ? 842 LYS A O 1 ATOM 4027 C CB . LYS A 1 534 ? -23.047 37.234 10.703 1.00 13.41 ? 842 LYS A CB 1 ATOM 4028 C CG . LYS A 1 534 ? -22.531 36.077 9.865 1.00 14.07 ? 842 LYS A CG 1 ATOM 4029 C CD . LYS A 1 534 ? -23.062 34.749 10.403 1.00 13.29 ? 842 LYS A CD 1 ATOM 4030 C CE . LYS A 1 534 ? -22.649 33.589 9.510 1.00 13.95 ? 842 LYS A CE 1 ATOM 4031 N NZ . LYS A 1 534 ? -22.999 32.271 10.130 1.00 14.82 ? 842 LYS A NZ 1 ATOM 4032 N N . ILE A 1 535 ? -22.696 40.546 11.513 1.00 17.21 ? 843 ILE A N 1 ATOM 4033 C CA . ILE A 1 535 ? -23.210 41.665 12.299 1.00 17.26 ? 843 ILE A CA 1 ATOM 4034 C C . ILE A 1 535 ? -23.464 42.892 11.424 1.00 19.60 ? 843 ILE A C 1 ATOM 4035 O O . ILE A 1 535 ? -22.715 43.155 10.489 1.00 17.44 ? 843 ILE A O 1 ATOM 4036 C CB . ILE A 1 535 ? -22.212 42.073 13.416 1.00 16.86 ? 843 ILE A CB 1 ATOM 4037 C CG1 . ILE A 1 535 ? -21.683 40.841 14.142 1.00 16.10 ? 843 ILE A CG1 1 ATOM 4038 C CG2 . ILE A 1 535 ? -22.874 43.022 14.411 1.00 16.46 ? 843 ILE A CG2 1 ATOM 4039 C CD1 . ILE A 1 535 ? -20.584 41.155 15.122 1.00 18.39 ? 843 ILE A CD1 1 ATOM 4040 N N . ASP A 1 536 ? -24.517 43.650 11.732 1.00 17.54 ? 844 ASP A N 1 ATOM 4041 C CA . ASP A 1 536 ? -24.757 44.928 11.058 1.00 20.18 ? 844 ASP A CA 1 ATOM 4042 C C . ASP A 1 536 ? -25.052 46.022 12.104 1.00 16.03 ? 844 ASP A C 1 ATOM 4043 O O . ASP A 1 536 ? -25.167 45.711 13.285 1.00 15.79 ? 844 ASP A O 1 ATOM 4044 C CB . ASP A 1 536 ? -25.884 44.793 10.017 1.00 22.42 ? 844 ASP A CB 1 ATOM 4045 C CG . ASP A 1 536 ? -27.198 44.335 10.618 1.00 24.07 ? 844 ASP A CG 1 ATOM 4046 O OD1 . ASP A 1 536 ? -27.314 44.250 11.861 1.00 24.37 ? 844 ASP A OD1 1 ATOM 4047 O OD2 . ASP A 1 536 ? -28.131 44.063 9.835 1.00 24.80 ? 844 ASP A OD2 1 ATOM 4048 N N . PRO A 1 537 ? -25.136 47.300 11.685 1.00 15.51 ? 845 PRO A N 1 ATOM 4049 C CA . PRO A 1 537 ? -25.391 48.351 12.679 1.00 18.96 ? 845 PRO A CA 1 ATOM 4050 C C . PRO A 1 537 ? -26.627 48.116 13.557 1.00 20.25 ? 845 PRO A C 1 ATOM 4051 O O . PRO A 1 537 ? -26.576 48.354 14.767 1.00 21.93 ? 845 PRO A O 1 ATOM 4052 C CB . PRO A 1 537 ? -25.588 49.591 11.811 1.00 21.57 ? 845 PRO A CB 1 ATOM 4053 C CG . PRO A 1 537 ? -24.685 49.361 10.658 1.00 20.31 ? 845 PRO A CG 1 ATOM 4054 C CD . PRO A 1 537 ? -24.735 47.875 10.383 1.00 16.14 ? 845 PRO A CD 1 ATOM 4055 N N . SER A 1 538 ? -27.718 47.652 12.956 1.00 19.42 ? 846 SER A N 1 ATOM 4056 C CA A SER A 1 538 ? -28.944 47.412 13.707 0.32 20.30 ? 846 SER A CA 1 ATOM 4057 C CA B SER A 1 538 ? -28.950 47.398 13.695 0.29 20.50 ? 846 SER A CA 1 ATOM 4058 C CA C SER A 1 538 ? -28.953 47.387 13.687 0.38 20.46 ? 846 SER A CA 1 ATOM 4059 C C . SER A 1 538 ? -28.740 46.332 14.767 1.00 19.11 ? 846 SER A C 1 ATOM 4060 O O . SER A 1 538 ? -29.272 46.433 15.872 1.00 18.83 ? 846 SER A O 1 ATOM 4061 C CB A SER A 1 538 ? -30.094 47.036 12.769 0.32 21.90 ? 846 SER A CB 1 ATOM 4062 C CB B SER A 1 538 ? -30.066 46.972 12.739 0.29 21.84 ? 846 SER A CB 1 ATOM 4063 C CB C SER A 1 538 ? -30.045 46.927 12.718 0.38 22.00 ? 846 SER A CB 1 ATOM 4064 O OG A SER A 1 538 ? -29.810 45.841 12.065 0.32 21.43 ? 846 SER A OG 1 ATOM 4065 O OG B SER A 1 538 ? -31.282 46.765 13.436 0.29 23.06 ? 846 SER A OG 1 ATOM 4066 O OG C SER A 1 538 ? -31.155 46.387 13.412 0.38 22.85 ? 846 SER A OG 1 ATOM 4067 N N . THR A 1 539 ? -27.953 45.312 14.436 1.00 17.45 ? 847 THR A N 1 ATOM 4068 C CA . THR A 1 539 ? -27.672 44.239 15.377 1.00 17.56 ? 847 THR A CA 1 ATOM 4069 C C . THR A 1 539 ? -26.828 44.712 16.562 1.00 16.75 ? 847 THR A C 1 ATOM 4070 O O . THR A 1 539 ? -27.158 44.423 17.709 1.00 16.80 ? 847 THR A O 1 ATOM 4071 C CB . THR A 1 539 ? -26.997 43.041 14.679 1.00 16.59 ? 847 THR A CB 1 ATOM 4072 O OG1 . THR A 1 539 ? -27.884 42.518 13.681 1.00 19.95 ? 847 THR A OG1 1 ATOM 4073 C CG2 . THR A 1 539 ? -26.668 41.943 15.677 1.00 14.40 ? 847 THR A CG2 1 ATOM 4074 N N . LEU A 1 540 ? -25.750 45.446 16.294 1.00 16.24 ? 848 LEU A N 1 ATOM 4075 C CA . LEU A 1 540 ? -24.886 45.897 17.381 1.00 17.17 ? 848 LEU A CA 1 ATOM 4076 C C . LEU A 1 540 ? -25.651 46.854 18.301 1.00 17.86 ? 848 LEU A C 1 ATOM 4077 O O . LEU A 1 540 ? -25.461 46.847 19.515 1.00 17.16 ? 848 LEU A O 1 ATOM 4078 C CB . LEU A 1 540 ? -23.608 46.557 16.846 1.00 18.22 ? 848 LEU A CB 1 ATOM 4079 C CG . LEU A 1 540 ? -22.568 46.923 17.915 1.00 19.82 ? 848 LEU A CG 1 ATOM 4080 C CD1 . LEU A 1 540 ? -22.083 45.678 18.641 1.00 16.94 ? 848 LEU A CD1 1 ATOM 4081 C CD2 . LEU A 1 540 ? -21.380 47.665 17.311 1.00 22.37 ? 848 LEU A CD2 1 ATOM 4082 N N . GLN A 1 541 ? -26.532 47.661 17.718 1.00 18.37 ? 849 GLN A N 1 ATOM 4083 C CA . GLN A 1 541 ? -27.341 48.586 18.510 1.00 19.04 ? 849 GLN A CA 1 ATOM 4084 C C . GLN A 1 541 ? -28.251 47.809 19.464 1.00 18.78 ? 849 GLN A C 1 ATOM 4085 O O . GLN A 1 541 ? -28.405 48.173 20.630 1.00 18.03 ? 849 GLN A O 1 ATOM 4086 C CB . GLN A 1 541 ? -28.158 49.513 17.603 1.00 22.88 ? 849 GLN A CB 1 ATOM 4087 C CG . GLN A 1 541 ? -29.102 50.441 18.366 1.00 30.31 ? 849 GLN A CG 1 ATOM 4088 C CD . GLN A 1 541 ? -28.366 51.502 19.169 1.00 36.49 ? 849 GLN A CD 1 ATOM 4089 O OE1 . GLN A 1 541 ? -27.574 52.274 18.623 1.00 38.04 ? 849 GLN A OE1 1 ATOM 4090 N NE2 . GLN A 1 541 ? -28.626 51.547 20.473 1.00 39.04 ? 849 GLN A NE2 1 ATOM 4091 N N . MET A 1 542 ? -28.847 46.736 18.953 1.00 18.22 ? 850 MET A N 1 ATOM 4092 C CA A MET A 1 542 ? -29.672 45.847 19.760 0.50 18.79 ? 850 MET A CA 1 ATOM 4093 C CA B MET A 1 542 ? -29.676 45.851 19.758 0.50 18.80 ? 850 MET A CA 1 ATOM 4094 C C . MET A 1 542 ? -28.866 45.275 20.916 1.00 17.78 ? 850 MET A C 1 ATOM 4095 O O . MET A 1 542 ? -29.328 45.234 22.060 1.00 17.03 ? 850 MET A O 1 ATOM 4096 C CB A MET A 1 542 ? -30.203 44.693 18.909 0.50 18.88 ? 850 MET A CB 1 ATOM 4097 C CB B MET A 1 542 ? -30.217 44.715 18.887 0.50 18.90 ? 850 MET A CB 1 ATOM 4098 C CG A MET A 1 542 ? -31.473 44.995 18.136 0.50 17.64 ? 850 MET A CG 1 ATOM 4099 C CG B MET A 1 542 ? -31.468 44.042 19.428 0.50 18.08 ? 850 MET A CG 1 ATOM 4100 S SD A MET A 1 542 ? -32.533 43.532 18.129 0.50 33.75 ? 850 MET A SD 1 ATOM 4101 S SD B MET A 1 542 ? -32.275 42.996 18.197 0.50 32.33 ? 850 MET A SD 1 ATOM 4102 C CE A MET A 1 542 ? -31.453 42.330 17.344 0.50 30.38 ? 850 MET A CE 1 ATOM 4103 C CE B MET A 1 542 ? -31.697 43.751 16.669 0.50 13.70 ? 850 MET A CE 1 ATOM 4104 N N . TRP A 1 543 ? -27.655 44.832 20.609 1.00 17.16 ? 851 TRP A N 1 ATOM 4105 C CA . TRP A 1 543 ? -26.786 44.255 21.614 1.00 15.90 ? 851 TRP A CA 1 ATOM 4106 C C . TRP A 1 543 ? -26.377 45.298 22.649 1.00 17.48 ? 851 TRP A C 1 ATOM 4107 O O . TRP A 1 543 ? -26.282 44.991 23.834 1.00 19.99 ? 851 TRP A O 1 ATOM 4108 C CB . TRP A 1 543 ? -25.565 43.633 20.953 1.00 16.61 ? 851 TRP A CB 1 ATOM 4109 C CG . TRP A 1 543 ? -25.884 42.399 20.180 1.00 14.74 ? 851 TRP A CG 1 ATOM 4110 C CD1 . TRP A 1 543 ? -27.073 41.721 20.147 1.00 12.70 ? 851 TRP A CD1 1 ATOM 4111 C CD2 . TRP A 1 543 ? -24.991 41.690 19.322 1.00 15.34 ? 851 TRP A CD2 1 ATOM 4112 N NE1 . TRP A 1 543 ? -26.965 40.626 19.314 1.00 13.87 ? 851 TRP A NE1 1 ATOM 4113 C CE2 . TRP A 1 543 ? -25.696 40.589 18.796 1.00 13.91 ? 851 TRP A CE2 1 ATOM 4114 C CE3 . TRP A 1 543 ? -23.658 41.882 18.946 1.00 16.45 ? 851 TRP A CE3 1 ATOM 4115 C CZ2 . TRP A 1 543 ? -25.105 39.672 17.917 1.00 12.71 ? 851 TRP A CZ2 1 ATOM 4116 C CZ3 . TRP A 1 543 ? -23.079 40.983 18.076 1.00 17.75 ? 851 TRP A CZ3 1 ATOM 4117 C CH2 . TRP A 1 543 ? -23.805 39.888 17.571 1.00 15.45 ? 851 TRP A CH2 1 ATOM 4118 N N . ALA A 1 544 ? -26.161 46.532 22.193 1.00 20.24 ? 852 ALA A N 1 ATOM 4119 C CA . ALA A 1 544 ? -25.821 47.625 23.090 1.00 19.99 ? 852 ALA A CA 1 ATOM 4120 C C . ALA A 1 544 ? -26.986 47.931 24.016 1.00 22.04 ? 852 ALA A C 1 ATOM 4121 O O . ALA A 1 544 ? -26.777 48.257 25.184 1.00 21.48 ? 852 ALA A O 1 ATOM 4122 C CB . ALA A 1 544 ? -25.439 48.874 22.300 1.00 21.51 ? 852 ALA A CB 1 ATOM 4123 N N . ASN A 1 545 ? -28.206 47.844 23.481 1.00 17.06 ? 853 ASN A N 1 ATOM 4124 C CA . ASN A 1 545 ? -29.415 48.074 24.272 1.00 21.60 ? 853 ASN A CA 1 ATOM 4125 C C . ASN A 1 545 ? -29.540 47.056 25.407 1.00 20.13 ? 853 ASN A C 1 ATOM 4126 O O . ASN A 1 545 ? -29.977 47.382 26.512 1.00 19.13 ? 853 ASN A O 1 ATOM 4127 C CB . ASN A 1 545 ? -30.663 48.027 23.380 1.00 18.77 ? 853 ASN A CB 1 ATOM 4128 C CG . ASN A 1 545 ? -30.803 49.262 22.499 1.00 24.70 ? 853 ASN A CG 1 ATOM 4129 O OD1 . ASN A 1 545 ? -30.127 50.269 22.708 1.00 24.53 ? 853 ASN A OD1 1 ATOM 4130 N ND2 . ASN A 1 545 ? -31.701 49.192 21.517 1.00 23.13 ? 853 ASN A ND2 1 ATOM 4131 N N . ILE A 1 546 ? -29.145 45.821 25.120 1.00 18.19 ? 854 ILE A N 1 ATOM 4132 C CA . ILE A 1 546 ? -29.208 44.729 26.091 1.00 17.27 ? 854 ILE A CA 1 ATOM 4133 C C . ILE A 1 546 ? -28.165 44.905 27.187 1.00 19.72 ? 854 ILE A C 1 ATOM 4134 O O . ILE A 1 546 ? -28.474 44.804 28.369 1.00 21.88 ? 854 ILE A O 1 ATOM 4135 C CB . ILE A 1 546 ? -29.022 43.375 25.396 1.00 17.46 ? 854 ILE A CB 1 ATOM 4136 C CG1 . ILE A 1 546 ? -30.225 43.087 24.491 1.00 15.63 ? 854 ILE A CG1 1 ATOM 4137 C CG2 . ILE A 1 546 ? -28.853 42.257 26.420 1.00 19.66 ? 854 ILE A CG2 1 ATOM 4138 C CD1 . ILE A 1 546 ? -29.941 42.063 23.408 1.00 13.35 ? 854 ILE A CD1 1 ATOM 4139 N N . LEU A 1 547 ? -26.933 45.196 26.788 1.00 15.09 ? 855 LEU A N 1 ATOM 4140 C CA . LEU A 1 547 ? -25.849 45.425 27.734 1.00 17.95 ? 855 LEU A CA 1 ATOM 4141 C C . LEU A 1 547 ? -26.152 46.571 28.688 1.00 18.15 ? 855 LEU A C 1 ATOM 4142 O O . LEU A 1 547 ? -25.862 46.487 29.879 1.00 18.92 ? 855 LEU A O 1 ATOM 4143 C CB . LEU A 1 547 ? -24.548 45.720 26.982 1.00 17.68 ? 855 LEU A CB 1 ATOM 4144 C CG . LEU A 1 547 ? -23.992 44.520 26.213 1.00 23.00 ? 855 LEU A CG 1 ATOM 4145 C CD1 . LEU A 1 547 ? -22.732 44.892 25.446 1.00 22.67 ? 855 LEU A CD1 1 ATOM 4146 C CD2 . LEU A 1 547 ? -23.716 43.378 27.164 1.00 21.10 ? 855 LEU A CD2 1 ATOM 4147 N N . LYS A 1 548 ? -26.719 47.648 28.157 1.00 17.89 ? 856 LYS A N 1 ATOM 4148 C CA . LYS A 1 548 ? -27.102 48.789 28.991 1.00 24.21 ? 856 LYS A CA 1 ATOM 4149 C C . LYS A 1 548 ? -28.191 48.434 30.003 1.00 23.39 ? 856 LYS A C 1 ATOM 4150 O O . LYS A 1 548 ? -28.231 48.990 31.101 1.00 24.89 ? 856 LYS A O 1 ATOM 4151 C CB . LYS A 1 548 ? -27.578 49.951 28.125 1.00 26.03 ? 856 LYS A CB 1 ATOM 4152 C CG . LYS A 1 548 ? -26.491 50.602 27.289 1.00 30.95 ? 856 LYS A CG 1 ATOM 4153 C CD . LYS A 1 548 ? -27.113 51.560 26.293 1.00 37.26 ? 856 LYS A CD 1 ATOM 4154 C CE . LYS A 1 548 ? -26.063 52.188 25.416 1.00 43.03 ? 856 LYS A CE 1 ATOM 4155 N NZ . LYS A 1 548 ? -25.052 52.922 26.228 1.00 47.78 ? 856 LYS A NZ 1 ATOM 4156 N N . ARG A 1 549 ? -29.083 47.522 29.628 1.00 20.62 ? 857 ARG A N 1 ATOM 4157 C CA . ARG A 1 549 ? -30.184 47.134 30.516 1.00 22.07 ? 857 ARG A CA 1 ATOM 4158 C C . ARG A 1 549 ? -29.767 46.091 31.544 1.00 21.05 ? 857 ARG A C 1 ATOM 4159 O O . ARG A 1 549 ? -30.466 45.866 32.525 1.00 21.53 ? 857 ARG A O 1 ATOM 4160 C CB . ARG A 1 549 ? -31.382 46.610 29.717 1.00 21.32 ? 857 ARG A CB 1 ATOM 4161 C CG . ARG A 1 549 ? -32.219 47.685 29.054 1.00 23.40 ? 857 ARG A CG 1 ATOM 4162 C CD . ARG A 1 549 ? -33.420 47.053 28.371 1.00 24.70 ? 857 ARG A CD 1 ATOM 4163 N NE . ARG A 1 549 ? -34.240 46.310 29.325 1.00 27.43 ? 857 ARG A NE 1 ATOM 4164 C CZ . ARG A 1 549 ? -35.297 45.569 28.997 1.00 32.98 ? 857 ARG A CZ 1 ATOM 4165 N NH1 . ARG A 1 549 ? -35.672 45.465 27.730 1.00 29.64 ? 857 ARG A NH1 1 ATOM 4166 N NH2 . ARG A 1 549 ? -35.986 44.934 29.943 1.00 35.62 ? 857 ARG A NH2 1 ATOM 4167 N N . VAL A 1 550 ? -28.628 45.453 31.312 1.00 20.32 ? 858 VAL A N 1 ATOM 4168 C CA . VAL A 1 550 ? -28.120 44.424 32.215 1.00 22.20 ? 858 VAL A CA 1 ATOM 4169 C C . VAL A 1 550 ? -26.705 44.827 32.591 1.00 24.73 ? 858 VAL A C 1 ATOM 4170 O O . VAL A 1 550 ? -25.740 44.294 32.047 1.00 25.07 ? 858 VAL A O 1 ATOM 4171 C CB . VAL A 1 550 ? -28.100 43.034 31.518 1.00 22.74 ? 858 VAL A CB 1 ATOM 4172 C CG1 . VAL A 1 550 ? -27.663 41.921 32.490 1.00 17.11 ? 858 VAL A CG1 1 ATOM 4173 C CG2 . VAL A 1 550 ? -29.467 42.717 30.912 1.00 19.72 ? 858 VAL A CG2 1 ATOM 4174 N N . PRO A 1 551 ? -26.574 45.797 33.507 1.00 29.39 ? 859 PRO A N 1 ATOM 4175 C CA . PRO A 1 551 ? -25.270 46.394 33.827 1.00 33.81 ? 859 PRO A CA 1 ATOM 4176 C C . PRO A 1 551 ? -24.216 45.348 34.177 1.00 34.96 ? 859 PRO A C 1 ATOM 4177 O O . PRO A 1 551 ? -23.049 45.501 33.817 1.00 35.35 ? 859 PRO A O 1 ATOM 4178 C CB . PRO A 1 551 ? -25.574 47.289 35.038 1.00 36.03 ? 859 PRO A CB 1 ATOM 4179 C CG . PRO A 1 551 ? -26.895 46.806 35.572 1.00 35.70 ? 859 PRO A CG 1 ATOM 4180 C CD . PRO A 1 551 ? -27.645 46.312 34.376 1.00 33.86 ? 859 PRO A CD 1 ATOM 4181 N N . ASN A 1 552 ? -24.629 44.282 34.848 1.00 32.02 ? 860 ASN A N 1 ATOM 4182 C CA . ASN A 1 552 ? -23.697 43.236 35.217 1.00 33.58 ? 860 ASN A CA 1 ATOM 4183 C C . ASN A 1 552 ? -23.587 42.175 34.123 1.00 30.34 ? 860 ASN A C 1 ATOM 4184 O O . ASN A 1 552 ? -24.000 41.028 34.328 1.00 30.19 ? 860 ASN A O 1 ATOM 4185 C CB . ASN A 1 552 ? -24.107 42.600 36.544 1.00 41.32 ? 860 ASN A CB 1 ATOM 4186 C CG . ASN A 1 552 ? -22.949 41.927 37.248 1.00 46.20 ? 860 ASN A CG 1 ATOM 4187 O OD1 . ASN A 1 552 ? -21.795 42.311 37.064 1.00 49.37 ? 860 ASN A OD1 1 ATOM 4188 N ND2 . ASN A 1 552 ? -23.250 40.917 38.057 1.00 47.95 ? 860 ASN A ND2 1 ATOM 4189 N N . SER A 1 553 ? -23.039 42.563 32.968 1.00 23.72 ? 861 SER A N 1 ATOM 4190 C CA . SER A 1 553 ? -22.893 41.641 31.838 1.00 19.92 ? 861 SER A CA 1 ATOM 4191 C C . SER A 1 553 ? -21.848 42.076 30.807 1.00 20.32 ? 861 SER A C 1 ATOM 4192 O O . SER A 1 553 ? -21.535 43.266 30.665 1.00 21.17 ? 861 SER A O 1 ATOM 4193 C CB . SER A 1 553 ? -24.227 41.452 31.114 1.00 17.55 ? 861 SER A CB 1 ATOM 4194 O OG . SER A 1 553 ? -24.570 42.605 30.361 1.00 18.85 ? 861 SER A OG 1 ATOM 4195 N N . VAL A 1 554 ? -21.337 41.101 30.066 1.00 16.69 ? 862 VAL A N 1 ATOM 4196 C CA . VAL A 1 554 ? -20.403 41.381 28.987 1.00 16.79 ? 862 VAL A CA 1 ATOM 4197 C C . VAL A 1 554 ? -20.835 40.683 27.709 1.00 17.16 ? 862 VAL A C 1 ATOM 4198 O O . VAL A 1 554 ? -21.601 39.714 27.744 1.00 16.98 ? 862 VAL A O 1 ATOM 4199 C CB . VAL A 1 554 ? -18.959 40.969 29.355 1.00 17.71 ? 862 VAL A CB 1 ATOM 4200 C CG1 . VAL A 1 554 ? -18.464 41.773 30.565 1.00 18.88 ? 862 VAL A CG1 1 ATOM 4201 C CG2 . VAL A 1 554 ? -18.880 39.477 29.619 1.00 18.18 ? 862 VAL A CG2 1 ATOM 4202 N N . LEU A 1 555 ? -20.352 41.182 26.577 1.00 17.33 ? 863 LEU A N 1 ATOM 4203 C CA . LEU A 1 555 ? -20.594 40.517 25.308 1.00 17.47 ? 863 LEU A CA 1 ATOM 4204 C C . LEU A 1 555 ? -19.288 39.869 24.881 1.00 18.51 ? 863 LEU A C 1 ATOM 4205 O O . LEU A 1 555 ? -18.237 40.503 24.918 1.00 17.11 ? 863 LEU A O 1 ATOM 4206 C CB . LEU A 1 555 ? -21.082 41.510 24.253 1.00 18.20 ? 863 LEU A CB 1 ATOM 4207 C CG . LEU A 1 555 ? -21.287 40.976 22.830 1.00 17.05 ? 863 LEU A CG 1 ATOM 4208 C CD1 . LEU A 1 555 ? -22.434 39.948 22.772 1.00 18.23 ? 863 LEU A CD1 1 ATOM 4209 C CD2 . LEU A 1 555 ? -21.526 42.141 21.862 1.00 20.34 ? 863 LEU A CD2 1 ATOM 4210 N N . TRP A 1 556 ? -19.359 38.598 24.502 1.00 14.90 ? 864 TRP A N 1 ATOM 4211 C CA . TRP A 1 556 ? -18.175 37.815 24.168 1.00 14.68 ? 864 TRP A CA 1 ATOM 4212 C C . TRP A 1 556 ? -18.164 37.550 22.664 1.00 16.08 ? 864 TRP A C 1 ATOM 4213 O O . TRP A 1 556 ? -19.046 36.859 22.164 1.00 14.88 ? 864 TRP A O 1 ATOM 4214 C CB . TRP A 1 556 ? -18.247 36.489 24.937 1.00 14.62 ? 864 TRP A CB 1 ATOM 4215 C CG . TRP A 1 556 ? -17.018 35.604 24.866 1.00 15.04 ? 864 TRP A CG 1 ATOM 4216 C CD1 . TRP A 1 556 ? -15.776 35.939 24.397 1.00 16.22 ? 864 TRP A CD1 1 ATOM 4217 C CD2 . TRP A 1 556 ? -16.929 34.238 25.297 1.00 12.70 ? 864 TRP A CD2 1 ATOM 4218 N NE1 . TRP A 1 556 ? -14.920 34.866 24.521 1.00 15.14 ? 864 TRP A NE1 1 ATOM 4219 C CE2 . TRP A 1 556 ? -15.606 33.809 25.058 1.00 14.38 ? 864 TRP A CE2 1 ATOM 4220 C CE3 . TRP A 1 556 ? -17.840 33.339 25.866 1.00 17.02 ? 864 TRP A CE3 1 ATOM 4221 C CZ2 . TRP A 1 556 ? -15.170 32.522 25.373 1.00 14.59 ? 864 TRP A CZ2 1 ATOM 4222 C CZ3 . TRP A 1 556 ? -17.408 32.054 26.170 1.00 19.19 ? 864 TRP A CZ3 1 ATOM 4223 C CH2 . TRP A 1 556 ? -16.088 31.658 25.922 1.00 15.11 ? 864 TRP A CH2 1 ATOM 4224 N N . LEU A 1 557 ? -17.190 38.120 21.946 1.00 14.64 ? 865 LEU A N 1 ATOM 4225 C CA . LEU A 1 557 ? -17.084 37.964 20.489 1.00 15.08 ? 865 LEU A CA 1 ATOM 4226 C C . LEU A 1 557 ? -15.699 37.441 20.076 1.00 15.34 ? 865 LEU A C 1 ATOM 4227 O O . LEU A 1 557 ? -14.770 37.405 20.875 1.00 14.54 ? 865 LEU A O 1 ATOM 4228 C CB . LEU A 1 557 ? -17.335 39.301 19.772 1.00 15.80 ? 865 LEU A CB 1 ATOM 4229 C CG . LEU A 1 557 ? -18.611 40.098 20.060 1.00 15.40 ? 865 LEU A CG 1 ATOM 4230 C CD1 . LEU A 1 557 ? -18.547 41.435 19.333 1.00 14.13 ? 865 LEU A CD1 1 ATOM 4231 C CD2 . LEU A 1 557 ? -19.849 39.310 19.629 1.00 16.31 ? 865 LEU A CD2 1 ATOM 4232 N N . LEU A 1 558 ? -15.561 37.048 18.818 1.00 13.93 ? 866 LEU A N 1 ATOM 4233 C CA . LEU A 1 558 ? -14.299 36.487 18.339 1.00 14.07 ? 866 LEU A CA 1 ATOM 4234 C C . LEU A 1 558 ? -13.581 37.428 17.381 1.00 16.34 ? 866 LEU A C 1 ATOM 4235 O O . LEU A 1 558 ? -14.215 38.221 16.690 1.00 17.50 ? 866 LEU A O 1 ATOM 4236 C CB . LEU A 1 558 ? -14.537 35.146 17.648 1.00 13.95 ? 866 LEU A CB 1 ATOM 4237 C CG . LEU A 1 558 ? -15.278 34.108 18.496 1.00 16.27 ? 866 LEU A CG 1 ATOM 4238 C CD1 . LEU A 1 558 ? -15.370 32.784 17.735 1.00 15.89 ? 866 LEU A CD1 1 ATOM 4239 C CD2 . LEU A 1 558 ? -14.558 33.920 19.830 1.00 14.15 ? 866 LEU A CD2 1 ATOM 4240 N N . ARG A 1 559 ? -12.253 37.341 17.363 1.00 14.77 ? 867 ARG A N 1 ATOM 4241 C CA . ARG A 1 559 ? -11.448 38.060 16.380 1.00 16.00 ? 867 ARG A CA 1 ATOM 4242 C C . ARG A 1 559 ? -11.539 37.306 15.056 1.00 15.42 ? 867 ARG A C 1 ATOM 4243 O O . ARG A 1 559 ? -10.668 36.504 14.709 1.00 14.10 ? 867 ARG A O 1 ATOM 4244 C CB . ARG A 1 559 ? -10.003 38.195 16.866 1.00 18.07 ? 867 ARG A CB 1 ATOM 4245 C CG . ARG A 1 559 ? -9.887 38.890 18.224 1.00 20.25 ? 867 ARG A CG 1 ATOM 4246 C CD . ARG A 1 559 ? -8.459 39.284 18.555 1.00 21.80 ? 867 ARG A CD 1 ATOM 4247 N NE . ARG A 1 559 ? -8.346 39.809 19.916 1.00 25.25 ? 867 ARG A NE 1 ATOM 4248 C CZ . ARG A 1 559 ? -7.861 39.111 20.942 1.00 28.58 ? 867 ARG A CZ 1 ATOM 4249 N NH1 . ARG A 1 559 ? -7.427 37.867 20.759 1.00 26.10 ? 867 ARG A NH1 1 ATOM 4250 N NH2 . ARG A 1 559 ? -7.792 39.658 22.146 1.00 30.09 ? 867 ARG A NH2 1 ATOM 4251 N N . PHE A 1 560 ? -12.615 37.578 14.323 1.00 16.55 ? 868 PHE A N 1 ATOM 4252 C CA . PHE A 1 560 ? -13.020 36.747 13.188 1.00 13.67 ? 868 PHE A CA 1 ATOM 4253 C C . PHE A 1 560 ? -13.506 37.643 12.043 1.00 15.27 ? 868 PHE A C 1 ATOM 4254 O O . PHE A 1 560 ? -14.662 37.534 11.629 1.00 12.59 ? 868 PHE A O 1 ATOM 4255 C CB . PHE A 1 560 ? -14.179 35.858 13.658 1.00 12.16 ? 868 PHE A CB 1 ATOM 4256 C CG . PHE A 1 560 ? -14.253 34.495 13.004 1.00 16.06 ? 868 PHE A CG 1 ATOM 4257 C CD1 . PHE A 1 560 ? -15.153 33.545 13.497 1.00 17.46 ? 868 PHE A CD1 1 ATOM 4258 C CD2 . PHE A 1 560 ? -13.453 34.157 11.922 1.00 16.41 ? 868 PHE A CD2 1 ATOM 4259 C CE1 . PHE A 1 560 ? -15.259 32.285 12.921 1.00 16.60 ? 868 PHE A CE1 1 ATOM 4260 C CE2 . PHE A 1 560 ? -13.543 32.886 11.343 1.00 16.91 ? 868 PHE A CE2 1 ATOM 4261 C CZ . PHE A 1 560 ? -14.447 31.951 11.842 1.00 16.12 ? 868 PHE A CZ 1 ATOM 4262 N N . PRO A 1 561 ? -12.626 38.503 11.498 1.00 15.80 ? 869 PRO A N 1 ATOM 4263 C CA . PRO A 1 561 ? -11.182 38.588 11.762 1.00 17.86 ? 869 PRO A CA 1 ATOM 4264 C C . PRO A 1 561 ? -10.809 39.665 12.787 1.00 18.47 ? 869 PRO A C 1 ATOM 4265 O O . PRO A 1 561 ? -11.622 40.557 13.072 1.00 16.83 ? 869 PRO A O 1 ATOM 4266 C CB . PRO A 1 561 ? -10.621 38.946 10.388 1.00 17.53 ? 869 PRO A CB 1 ATOM 4267 C CG . PRO A 1 561 ? -11.712 39.830 9.774 1.00 17.27 ? 869 PRO A CG 1 ATOM 4268 C CD . PRO A 1 561 ? -13.026 39.406 10.402 1.00 17.02 ? 869 PRO A CD 1 ATOM 4269 N N . ALA A 1 562 ? -9.584 39.589 13.315 1.00 15.66 ? 870 ALA A N 1 ATOM 4270 C CA . ALA A 1 562 ? -9.110 40.544 14.318 1.00 16.08 ? 870 ALA A CA 1 ATOM 4271 C C . ALA A 1 562 ? -9.291 41.997 13.880 1.00 15.50 ? 870 ALA A C 1 ATOM 4272 O O . ALA A 1 562 ? -9.616 42.856 14.690 1.00 18.46 ? 870 ALA A O 1 ATOM 4273 C CB . ALA A 1 562 ? -7.649 40.281 14.669 1.00 13.86 ? 870 ALA A CB 1 ATOM 4274 N N . VAL A 1 563 ? -9.088 42.269 12.595 1.00 18.09 ? 871 VAL A N 1 ATOM 4275 C CA . VAL A 1 563 ? -9.201 43.644 12.109 1.00 20.04 ? 871 VAL A CA 1 ATOM 4276 C C . VAL A 1 563 ? -10.626 44.202 12.181 1.00 21.70 ? 871 VAL A C 1 ATOM 4277 O O . VAL A 1 563 ? -10.842 45.394 11.972 1.00 22.11 ? 871 VAL A O 1 ATOM 4278 C CB . VAL A 1 563 ? -8.589 43.825 10.702 1.00 23.03 ? 871 VAL A CB 1 ATOM 4279 C CG1 . VAL A 1 563 ? -7.090 43.605 10.772 1.00 17.66 ? 871 VAL A CG1 1 ATOM 4280 C CG2 . VAL A 1 563 ? -9.231 42.859 9.708 1.00 25.45 ? 871 VAL A CG2 1 ATOM 4281 N N . GLY A 1 564 ? -11.591 43.348 12.507 1.00 21.78 ? 872 GLY A N 1 ATOM 4282 C CA . GLY A 1 564 ? -12.938 43.814 12.779 1.00 19.83 ? 872 GLY A CA 1 ATOM 4283 C C . GLY A 1 564 ? -13.097 44.328 14.200 1.00 21.74 ? 872 GLY A C 1 ATOM 4284 O O . GLY A 1 564 ? -13.998 45.125 14.481 1.00 20.44 ? 872 GLY A O 1 ATOM 4285 N N . GLU A 1 565 ? -12.236 43.856 15.102 1.00 22.10 ? 873 GLU A N 1 ATOM 4286 C CA . GLU A 1 565 ? -12.310 44.233 16.517 1.00 22.72 ? 873 GLU A CA 1 ATOM 4287 C C . GLU A 1 565 ? -12.303 45.745 16.776 1.00 20.47 ? 873 GLU A C 1 ATOM 4288 O O . GLU A 1 565 ? -13.188 46.245 17.470 1.00 22.06 ? 873 GLU A O 1 ATOM 4289 C CB . GLU A 1 565 ? -11.228 43.526 17.357 1.00 24.10 ? 873 GLU A CB 1 ATOM 4290 C CG . GLU A 1 565 ? -11.140 44.030 18.794 1.00 26.26 ? 873 GLU A CG 1 ATOM 4291 C CD . GLU A 1 565 ? -10.170 43.237 19.666 1.00 25.13 ? 873 GLU A CD 1 ATOM 4292 O OE1 . GLU A 1 565 ? -9.566 42.264 19.166 1.00 24.34 ? 873 GLU A OE1 1 ATOM 4293 O OE2 . GLU A 1 565 ? -10.010 43.602 20.854 1.00 22.81 ? 873 GLU A OE2 1 ATOM 4294 N N . PRO A 1 566 ? -11.325 46.485 16.217 1.00 22.87 ? 874 PRO A N 1 ATOM 4295 C CA . PRO A 1 566 ? -11.358 47.921 16.513 1.00 21.77 ? 874 PRO A CA 1 ATOM 4296 C C . PRO A 1 566 ? -12.604 48.630 15.970 1.00 23.13 ? 874 PRO A C 1 ATOM 4297 O O . PRO A 1 566 ? -13.038 49.623 16.554 1.00 24.06 ? 874 PRO A O 1 ATOM 4298 C CB . PRO A 1 566 ? -10.088 48.455 15.830 1.00 22.90 ? 874 PRO A CB 1 ATOM 4299 C CG . PRO A 1 566 ? -9.744 47.455 14.814 1.00 26.40 ? 874 PRO A CG 1 ATOM 4300 C CD . PRO A 1 566 ? -10.163 46.133 15.376 1.00 24.38 ? 874 PRO A CD 1 ATOM 4301 N N . ASN A 1 567 ? -13.176 48.140 14.876 1.00 20.28 ? 875 ASN A N 1 ATOM 4302 C CA . ASN A 1 567 ? -14.387 48.774 14.351 1.00 22.29 ? 875 ASN A CA 1 ATOM 4303 C C . ASN A 1 567 ? -15.591 48.568 15.262 1.00 19.42 ? 875 ASN A C 1 ATOM 4304 O O . ASN A 1 567 ? -16.306 49.518 15.578 1.00 21.86 ? 875 ASN A O 1 ATOM 4305 C CB . ASN A 1 567 ? -14.685 48.306 12.930 1.00 21.16 ? 875 ASN A CB 1 ATOM 4306 C CG . ASN A 1 567 ? -13.730 48.912 11.920 1.00 22.79 ? 875 ASN A CG 1 ATOM 4307 O OD1 . ASN A 1 567 ? -13.228 50.011 12.125 1.00 25.37 ? 875 ASN A OD1 1 ATOM 4308 N ND2 . ASN A 1 567 ? -13.457 48.191 10.843 1.00 21.39 ? 875 ASN A ND2 1 ATOM 4309 N N . ILE A 1 568 ? -15.800 47.325 15.679 1.00 16.18 ? 876 ILE A N 1 ATOM 4310 C CA . ILE A 1 568 ? -16.844 46.993 16.652 1.00 18.23 ? 876 ILE A CA 1 ATOM 4311 C C . ILE A 1 568 ? -16.675 47.810 17.928 1.00 20.79 ? 876 ILE A C 1 ATOM 4312 O O . ILE A 1 568 ? -17.635 48.394 18.431 1.00 21.82 ? 876 ILE A O 1 ATOM 4313 C CB . ILE A 1 568 ? -16.831 45.497 16.989 1.00 16.85 ? 876 ILE A CB 1 ATOM 4314 C CG1 . ILE A 1 568 ? -17.215 44.676 15.758 1.00 21.20 ? 876 ILE A CG1 1 ATOM 4315 C CG2 . ILE A 1 568 ? -17.787 45.177 18.151 1.00 19.95 ? 876 ILE A CG2 1 ATOM 4316 C CD1 . ILE A 1 568 ? -18.592 45.018 15.209 1.00 25.10 ? 876 ILE A CD1 1 ATOM 4317 N N . GLN A 1 569 ? -15.446 47.888 18.434 1.00 22.77 ? 877 GLN A N 1 ATOM 4318 C CA . GLN A 1 569 ? -15.204 48.642 19.661 1.00 23.20 ? 877 GLN A CA 1 ATOM 4319 C C . GLN A 1 569 ? -15.493 50.131 19.492 1.00 23.36 ? 877 GLN A C 1 ATOM 4320 O O . GLN A 1 569 ? -16.036 50.767 20.395 1.00 26.14 ? 877 GLN A O 1 ATOM 4321 C CB . GLN A 1 569 ? -13.783 48.422 20.187 1.00 25.15 ? 877 GLN A CB 1 ATOM 4322 C CG . GLN A 1 569 ? -13.531 47.044 20.799 1.00 29.36 ? 877 GLN A CG 1 ATOM 4323 C CD . GLN A 1 569 ? -14.191 46.846 22.160 1.00 34.63 ? 877 GLN A CD 1 ATOM 4324 O OE1 . GLN A 1 569 ? -15.022 47.647 22.588 1.00 41.79 ? 877 GLN A OE1 1 ATOM 4325 N NE2 . GLN A 1 569 ? -13.815 45.772 22.848 1.00 31.90 ? 877 GLN A NE2 1 ATOM 4326 N N . GLN A 1 570 ? -15.136 50.691 18.341 1.00 21.78 ? 878 GLN A N 1 ATOM 4327 C CA . GLN A 1 570 ? -15.423 52.102 18.102 1.00 25.79 ? 878 GLN A CA 1 ATOM 4328 C C . GLN A 1 570 ? -16.926 52.363 18.062 1.00 24.89 ? 878 GLN A C 1 ATOM 4329 O O . GLN A 1 570 ? -17.414 53.337 18.637 1.00 27.05 ? 878 GLN A O 1 ATOM 4330 C CB . GLN A 1 570 ? -14.769 52.600 16.814 1.00 27.88 ? 878 GLN A CB 1 ATOM 4331 C CG . GLN A 1 570 ? -14.991 54.086 16.572 1.00 33.97 ? 878 GLN A CG 1 ATOM 4332 C CD . GLN A 1 570 ? -14.405 54.951 17.679 1.00 40.97 ? 878 GLN A CD 1 ATOM 4333 O OE1 . GLN A 1 570 ? -13.188 54.983 17.879 1.00 46.59 ? 878 GLN A OE1 1 ATOM 4334 N NE2 . GLN A 1 570 ? -15.269 55.651 18.407 1.00 38.43 ? 878 GLN A NE2 1 ATOM 4335 N N . TYR A 1 571 ? -17.660 51.485 17.386 1.00 23.50 ? 879 TYR A N 1 ATOM 4336 C CA . TYR A 1 571 ? -19.106 51.649 17.264 1.00 24.64 ? 879 TYR A CA 1 ATOM 4337 C C . TYR A 1 571 ? -19.802 51.460 18.606 1.00 23.86 ? 879 TYR A C 1 ATOM 4338 O O . TYR A 1 571 ? -20.780 52.145 18.905 1.00 27.07 ? 879 TYR A O 1 ATOM 4339 C CB . TYR A 1 571 ? -19.675 50.692 16.211 1.00 23.70 ? 879 TYR A CB 1 ATOM 4340 C CG . TYR A 1 571 ? -19.285 51.064 14.797 1.00 26.37 ? 879 TYR A CG 1 ATOM 4341 C CD1 . TYR A 1 571 ? -19.383 52.378 14.349 1.00 32.28 ? 879 TYR A CD1 1 ATOM 4342 C CD2 . TYR A 1 571 ? -18.806 50.106 13.913 1.00 25.15 ? 879 TYR A CD2 1 ATOM 4343 C CE1 . TYR A 1 571 ? -19.014 52.725 13.049 1.00 35.32 ? 879 TYR A CE1 1 ATOM 4344 C CE2 . TYR A 1 571 ? -18.437 50.442 12.621 1.00 27.05 ? 879 TYR A CE2 1 ATOM 4345 C CZ . TYR A 1 571 ? -18.544 51.748 12.192 1.00 32.09 ? 879 TYR A CZ 1 ATOM 4346 O OH . TYR A 1 571 ? -18.178 52.070 10.902 1.00 32.12 ? 879 TYR A OH 1 ATOM 4347 N N . ALA A 1 572 ? -19.288 50.539 19.415 1.00 22.30 ? 880 ALA A N 1 ATOM 4348 C CA . ALA A 1 572 ? -19.832 50.319 20.751 1.00 25.25 ? 880 ALA A CA 1 ATOM 4349 C C . ALA A 1 572 ? -19.582 51.543 21.622 1.00 26.45 ? 880 ALA A C 1 ATOM 4350 O O . ALA A 1 572 ? -20.454 51.963 22.396 1.00 26.33 ? 880 ALA A O 1 ATOM 4351 C CB . ALA A 1 572 ? -19.210 49.085 21.385 1.00 23.17 ? 880 ALA A CB 1 ATOM 4352 N N . GLN A 1 573 ? -18.383 52.106 21.497 1.00 27.72 ? 881 GLN A N 1 ATOM 4353 C CA . GLN A 1 573 ? -18.010 53.287 22.266 1.00 33.01 ? 881 GLN A CA 1 ATOM 4354 C C . GLN A 1 573 ? -18.875 54.474 21.868 1.00 33.68 ? 881 GLN A C 1 ATOM 4355 O O . GLN A 1 573 ? -19.253 55.286 22.711 1.00 34.17 ? 881 GLN A O 1 ATOM 4356 C CB . GLN A 1 573 ? -16.523 53.611 22.087 1.00 39.13 ? 881 GLN A CB 1 ATOM 4357 C CG . GLN A 1 573 ? -16.062 54.873 22.814 1.00 47.89 ? 881 GLN A CG 1 ATOM 4358 C CD . GLN A 1 573 ? -14.557 55.082 22.724 1.00 54.01 ? 881 GLN A CD 1 ATOM 4359 O OE1 . GLN A 1 573 ? -14.089 56.113 22.240 1.00 57.02 ? 881 GLN A OE1 1 ATOM 4360 N NE2 . GLN A 1 573 ? -13.794 54.101 23.195 1.00 54.64 ? 881 GLN A NE2 1 ATOM 4361 N N . ASN A 1 574 ? -19.194 54.564 20.581 1.00 32.89 ? 882 ASN A N 1 ATOM 4362 C CA . ASN A 1 574 ? -20.096 55.598 20.084 1.00 34.77 ? 882 ASN A CA 1 ATOM 4363 C C . ASN A 1 574 ? -21.503 55.422 20.644 1.00 34.04 ? 882 ASN A C 1 ATOM 4364 O O . ASN A 1 574 ? -22.229 56.397 20.834 1.00 35.25 ? 882 ASN A O 1 ATOM 4365 C CB . ASN A 1 574 ? -20.147 55.579 18.556 1.00 34.98 ? 882 ASN A CB 1 ATOM 4366 C CG . ASN A 1 574 ? -18.858 56.067 17.915 1.00 37.41 ? 882 ASN A CG 1 ATOM 4367 O OD1 . ASN A 1 574 ? -17.903 56.433 18.601 1.00 36.47 ? 882 ASN A OD1 1 ATOM 4368 N ND2 . ASN A 1 574 ? -18.825 56.062 16.587 1.00 37.23 ? 882 ASN A ND2 1 ATOM 4369 N N . MET A 1 575 ? -21.880 54.171 20.900 1.00 32.06 ? 883 MET A N 1 ATOM 4370 C CA . MET A 1 575 ? -23.200 53.856 21.443 1.00 36.22 ? 883 MET A CA 1 ATOM 4371 C C . MET A 1 575 ? -23.254 54.038 22.960 1.00 38.38 ? 883 MET A C 1 ATOM 4372 O O . MET A 1 575 ? -24.309 53.884 23.566 1.00 39.29 ? 883 MET A O 1 ATOM 4373 C CB . MET A 1 575 ? -23.614 52.427 21.081 1.00 34.07 ? 883 MET A CB 1 ATOM 4374 C CG . MET A 1 575 ? -23.951 52.204 19.614 1.00 33.62 ? 883 MET A CG 1 ATOM 4375 S SD . MET A 1 575 ? -24.097 50.444 19.229 1.00 45.95 ? 883 MET A SD 1 ATOM 4376 C CE . MET A 1 575 ? -24.292 50.477 17.450 1.00 34.02 ? 883 MET A CE 1 ATOM 4377 N N . GLY A 1 576 ? -22.115 54.351 23.571 1.00 38.70 ? 884 GLY A N 1 ATOM 4378 C CA . GLY A 1 576 ? -22.075 54.619 24.999 1.00 40.15 ? 884 GLY A CA 1 ATOM 4379 C C . GLY A 1 576 ? -21.589 53.469 25.867 1.00 39.50 ? 884 GLY A C 1 ATOM 4380 O O . GLY A 1 576 ? -21.709 53.526 27.093 1.00 39.67 ? 884 GLY A O 1 ATOM 4381 N N . LEU A 1 577 ? -21.040 52.427 25.244 1.00 33.56 ? 885 LEU A N 1 ATOM 4382 C CA . LEU A 1 577 ? -20.496 51.297 25.992 1.00 33.66 ? 885 LEU A CA 1 ATOM 4383 C C . LEU A 1 577 ? -18.990 51.410 26.158 1.00 36.23 ? 885 LEU A C 1 ATOM 4384 O O . LEU A 1 577 ? -18.264 51.562 25.175 1.00 37.22 ? 885 LEU A O 1 ATOM 4385 C CB . LEU A 1 577 ? -20.792 49.975 25.288 1.00 32.28 ? 885 LEU A CB 1 ATOM 4386 C CG . LEU A 1 577 ? -22.214 49.541 24.950 1.00 33.75 ? 885 LEU A CG 1 ATOM 4387 C CD1 . LEU A 1 577 ? -22.133 48.370 23.987 1.00 32.47 ? 885 LEU A CD1 1 ATOM 4388 C CD2 . LEU A 1 577 ? -22.986 49.158 26.203 1.00 35.65 ? 885 LEU A CD2 1 ATOM 4389 N N . PRO A 1 578 ? -18.510 51.330 27.405 1.00 39.04 ? 886 PRO A N 1 ATOM 4390 C CA . PRO A 1 578 ? -17.062 51.289 27.630 1.00 40.07 ? 886 PRO A CA 1 ATOM 4391 C C . PRO A 1 578 ? -16.424 50.005 27.100 1.00 39.13 ? 886 PRO A C 1 ATOM 4392 O O . PRO A 1 578 ? -17.098 48.978 26.958 1.00 35.27 ? 886 PRO A O 1 ATOM 4393 C CB . PRO A 1 578 ? -16.930 51.379 29.156 1.00 42.91 ? 886 PRO A CB 1 ATOM 4394 C CG . PRO A 1 578 ? -18.305 51.116 29.701 1.00 44.34 ? 886 PRO A CG 1 ATOM 4395 C CD . PRO A 1 578 ? -19.263 51.562 28.648 1.00 41.44 ? 886 PRO A CD 1 ATOM 4396 N N . GLN A 1 579 ? -15.127 50.080 26.816 1.00 40.13 ? 887 GLN A N 1 ATOM 4397 C CA . GLN A 1 579 ? -14.380 48.977 26.213 1.00 40.01 ? 887 GLN A CA 1 ATOM 4398 C C . GLN A 1 579 ? -14.529 47.669 26.985 1.00 32.81 ? 887 GLN A C 1 ATOM 4399 O O . GLN A 1 579 ? -14.493 46.582 26.399 1.00 34.05 ? 887 GLN A O 1 ATOM 4400 C CB . GLN A 1 579 ? -12.898 49.353 26.100 1.00 46.83 ? 887 GLN A CB 1 ATOM 4401 C CG . GLN A 1 579 ? -12.025 48.290 25.460 1.00 53.70 ? 887 GLN A CG 1 ATOM 4402 C CD . GLN A 1 579 ? -10.558 48.671 25.454 1.00 61.18 ? 887 GLN A CD 1 ATOM 4403 O OE1 . GLN A 1 579 ? -10.188 49.768 25.873 1.00 65.13 ? 887 GLN A OE1 1 ATOM 4404 N NE2 . GLN A 1 579 ? -9.712 47.764 24.979 1.00 63.20 ? 887 GLN A NE2 1 ATOM 4405 N N . ASN A 1 580 ? -14.716 47.777 28.295 1.00 27.92 ? 888 ASN A N 1 ATOM 4406 C CA . ASN A 1 580 ? -14.792 46.597 29.156 1.00 32.37 ? 888 ASN A CA 1 ATOM 4407 C C . ASN A 1 580 ? -16.097 45.790 29.069 1.00 28.60 ? 888 ASN A C 1 ATOM 4408 O O . ASN A 1 580 ? -16.221 44.748 29.707 1.00 31.89 ? 888 ASN A O 1 ATOM 4409 C CB . ASN A 1 580 ? -14.497 46.976 30.612 1.00 38.21 ? 888 ASN A CB 1 ATOM 4410 C CG . ASN A 1 580 ? -15.680 47.640 31.305 1.00 43.33 ? 888 ASN A CG 1 ATOM 4411 O OD1 . ASN A 1 580 ? -16.561 48.212 30.663 1.00 41.94 ? 888 ASN A OD1 1 ATOM 4412 N ND2 . ASN A 1 580 ? -15.696 47.567 32.630 1.00 49.14 ? 888 ASN A ND2 1 ATOM 4413 N N . ARG A 1 581 ? -17.065 46.271 28.294 1.00 26.16 ? 889 ARG A N 1 ATOM 4414 C CA . ARG A 1 581 ? -18.340 45.560 28.157 1.00 25.26 ? 889 ARG A CA 1 ATOM 4415 C C . ARG A 1 581 ? -18.285 44.537 27.028 1.00 22.97 ? 889 ARG A C 1 ATOM 4416 O O . ARG A 1 581 ? -19.194 43.719 26.881 1.00 20.20 ? 889 ARG A O 1 ATOM 4417 C CB . ARG A 1 581 ? -19.511 46.522 27.916 1.00 26.92 ? 889 ARG A CB 1 ATOM 4418 C CG . ARG A 1 581 ? -19.747 47.596 28.983 1.00 26.75 ? 889 ARG A CG 1 ATOM 4419 C CD . ARG A 1 581 ? -20.052 47.032 30.378 1.00 27.25 ? 889 ARG A CD 1 ATOM 4420 N NE . ARG A 1 581 ? -21.164 46.084 30.390 1.00 25.95 ? 889 ARG A NE 1 ATOM 4421 C CZ . ARG A 1 581 ? -22.450 46.422 30.457 1.00 27.06 ? 889 ARG A CZ 1 ATOM 4422 N NH1 . ARG A 1 581 ? -22.813 47.700 30.501 1.00 26.37 ? 889 ARG A NH1 1 ATOM 4423 N NH2 . ARG A 1 581 ? -23.379 45.475 30.465 1.00 26.23 ? 889 ARG A NH2 1 ATOM 4424 N N . ILE A 1 582 ? -17.226 44.592 26.221 1.00 22.71 ? 890 ILE A N 1 ATOM 4425 C CA . ILE A 1 582 ? -17.067 43.650 25.119 1.00 23.51 ? 890 ILE A CA 1 ATOM 4426 C C . ILE A 1 582 ? -15.709 42.975 25.208 1.00 23.93 ? 890 ILE A C 1 ATOM 4427 O O . ILE A 1 582 ? -14.680 43.639 25.297 1.00 26.63 ? 890 ILE A O 1 ATOM 4428 C CB . ILE A 1 582 ? -17.215 44.327 23.739 1.00 23.20 ? 890 ILE A CB 1 ATOM 4429 C CG1 . ILE A 1 582 ? -18.541 45.081 23.647 1.00 23.84 ? 890 ILE A CG1 1 ATOM 4430 C CG2 . ILE A 1 582 ? -17.153 43.282 22.630 1.00 24.66 ? 890 ILE A CG2 1 ATOM 4431 C CD1 . ILE A 1 582 ? -18.822 45.624 22.254 1.00 27.50 ? 890 ILE A CD1 1 ATOM 4432 N N . ILE A 1 583 ? -15.719 41.650 25.209 1.00 19.96 ? 891 ILE A N 1 ATOM 4433 C CA . ILE A 1 583 ? -14.491 40.875 25.335 1.00 20.80 ? 891 ILE A CA 1 ATOM 4434 C C . ILE A 1 583 ? -14.256 40.041 24.073 1.00 18.29 ? 891 ILE A C 1 ATOM 4435 O O . ILE A 1 583 ? -15.146 39.312 23.628 1.00 15.92 ? 891 ILE A O 1 ATOM 4436 C CB . ILE A 1 583 ? -14.546 39.963 26.585 1.00 21.66 ? 891 ILE A CB 1 ATOM 4437 C CG1 . ILE A 1 583 ? -14.653 40.825 27.853 1.00 27.03 ? 891 ILE A CG1 1 ATOM 4438 C CG2 . ILE A 1 583 ? -13.328 39.052 26.648 1.00 23.56 ? 891 ILE A CG2 1 ATOM 4439 C CD1 . ILE A 1 583 ? -14.852 40.035 29.126 1.00 28.18 ? 891 ILE A CD1 1 ATOM 4440 N N . PHE A 1 584 ? -13.065 40.169 23.488 1.00 14.30 ? 892 PHE A N 1 ATOM 4441 C CA . PHE A 1 584 ? -12.708 39.391 22.304 1.00 18.10 ? 892 PHE A CA 1 ATOM 4442 C C . PHE A 1 584 ? -11.804 38.202 22.636 1.00 19.53 ? 892 PHE A C 1 ATOM 4443 O O . PHE A 1 584 ? -10.940 38.290 23.503 1.00 18.31 ? 892 PHE A O 1 ATOM 4444 C CB . PHE A 1 584 ? -12.044 40.285 21.245 1.00 18.42 ? 892 PHE A CB 1 ATOM 4445 C CG . PHE A 1 584 ? -13.023 41.105 20.447 1.00 20.35 ? 892 PHE A CG 1 ATOM 4446 C CD1 . PHE A 1 584 ? -13.502 40.644 19.229 1.00 18.26 ? 892 PHE A CD1 1 ATOM 4447 C CD2 . PHE A 1 584 ? -13.484 42.325 20.928 1.00 22.15 ? 892 PHE A CD2 1 ATOM 4448 C CE1 . PHE A 1 584 ? -14.419 41.392 18.502 1.00 18.69 ? 892 PHE A CE1 1 ATOM 4449 C CE2 . PHE A 1 584 ? -14.402 43.076 20.205 1.00 20.42 ? 892 PHE A CE2 1 ATOM 4450 C CZ . PHE A 1 584 ? -14.871 42.606 18.995 1.00 20.14 ? 892 PHE A CZ 1 ATOM 4451 N N . SER A 1 585 ? -12.026 37.084 21.953 1.00 15.18 ? 893 SER A N 1 ATOM 4452 C CA . SER A 1 585 ? -11.127 35.941 22.052 1.00 15.44 ? 893 SER A CA 1 ATOM 4453 C C . SER A 1 585 ? -10.634 35.595 20.653 1.00 14.90 ? 893 SER A C 1 ATOM 4454 O O . SER A 1 585 ? -11.270 35.973 19.656 1.00 16.06 ? 893 SER A O 1 ATOM 4455 C CB . SER A 1 585 ? -11.842 34.725 22.665 1.00 13.87 ? 893 SER A CB 1 ATOM 4456 O OG . SER A 1 585 ? -12.177 34.948 24.019 1.00 17.92 ? 893 SER A OG 1 ATOM 4457 N N . PRO A 1 586 ? -9.496 34.893 20.569 1.00 17.40 ? 894 PRO A N 1 ATOM 4458 C CA . PRO A 1 586 ? -9.051 34.379 19.275 1.00 16.92 ? 894 PRO A CA 1 ATOM 4459 C C . PRO A 1 586 ? -9.996 33.289 18.802 1.00 14.87 ? 894 PRO A C 1 ATOM 4460 O O . PRO A 1 586 ? -10.689 32.671 19.621 1.00 13.30 ? 894 PRO A O 1 ATOM 4461 C CB . PRO A 1 586 ? -7.686 33.747 19.587 1.00 20.01 ? 894 PRO A CB 1 ATOM 4462 C CG . PRO A 1 586 ? -7.277 34.287 20.919 1.00 19.73 ? 894 PRO A CG 1 ATOM 4463 C CD . PRO A 1 586 ? -8.544 34.578 21.654 1.00 15.35 ? 894 PRO A CD 1 ATOM 4464 N N . VAL A 1 587 ? -10.041 33.076 17.488 1.00 16.12 ? 895 VAL A N 1 ATOM 4465 C CA . VAL A 1 587 ? -10.699 31.901 16.929 1.00 12.41 ? 895 VAL A CA 1 ATOM 4466 C C . VAL A 1 587 ? -9.943 30.705 17.478 1.00 14.58 ? 895 VAL A C 1 ATOM 4467 O O . VAL A 1 587 ? -8.720 30.756 17.606 1.00 13.10 ? 895 VAL A O 1 ATOM 4468 C CB . VAL A 1 587 ? -10.620 31.910 15.388 1.00 12.55 ? 895 VAL A CB 1 ATOM 4469 C CG1 . VAL A 1 587 ? -11.085 30.576 14.796 1.00 10.35 ? 895 VAL A CG1 1 ATOM 4470 C CG2 . VAL A 1 587 ? -11.439 33.061 14.830 1.00 17.32 ? 895 VAL A CG2 1 ATOM 4471 N N . ALA A 1 588 ? -10.665 29.640 17.820 1.00 13.06 ? 896 ALA A N 1 ATOM 4472 C CA . ALA A 1 588 ? -10.065 28.471 18.445 1.00 13.34 ? 896 ALA A CA 1 ATOM 4473 C C . ALA A 1 588 ? -10.203 27.253 17.543 1.00 12.74 ? 896 ALA A C 1 ATOM 4474 O O . ALA A 1 588 ? -11.091 27.211 16.693 1.00 13.07 ? 896 ALA A O 1 ATOM 4475 C CB . ALA A 1 588 ? -10.757 28.188 19.789 1.00 11.72 ? 896 ALA A CB 1 ATOM 4476 N N . PRO A 1 589 ? -9.351 26.244 17.760 1.00 13.09 ? 897 PRO A N 1 ATOM 4477 C CA . PRO A 1 589 ? -9.585 24.927 17.153 1.00 15.84 ? 897 PRO A CA 1 ATOM 4478 C C . PRO A 1 589 ? -11.009 24.468 17.447 1.00 15.36 ? 897 PRO A C 1 ATOM 4479 O O . PRO A 1 589 ? -11.593 24.861 18.467 1.00 16.73 ? 897 PRO A O 1 ATOM 4480 C CB . PRO A 1 589 ? -8.604 24.013 17.895 1.00 16.90 ? 897 PRO A CB 1 ATOM 4481 C CG . PRO A 1 589 ? -7.569 24.902 18.434 1.00 16.78 ? 897 PRO A CG 1 ATOM 4482 C CD . PRO A 1 589 ? -8.189 26.243 18.668 1.00 14.64 ? 897 PRO A CD 1 ATOM 4483 N N . LYS A 1 590 ? -11.546 23.644 16.555 1.00 13.70 ? 898 LYS A N 1 ATOM 4484 C CA . LYS A 1 590 ? -12.947 23.236 16.577 1.00 12.77 ? 898 LYS A CA 1 ATOM 4485 C C . LYS A 1 590 ? -13.447 22.737 17.939 1.00 15.58 ? 898 LYS A C 1 ATOM 4486 O O . LYS A 1 590 ? -14.480 23.195 18.444 1.00 13.10 ? 898 LYS A O 1 ATOM 4487 C CB . LYS A 1 590 ? -13.159 22.146 15.522 1.00 15.55 ? 898 LYS A CB 1 ATOM 4488 C CG . LYS A 1 590 ? -14.599 21.684 15.375 1.00 17.87 ? 898 LYS A CG 1 ATOM 4489 C CD . LYS A 1 590 ? -15.379 22.588 14.437 1.00 18.04 ? 898 LYS A CD 1 ATOM 4490 C CE . LYS A 1 590 ? -16.804 22.074 14.250 1.00 17.52 ? 898 LYS A CE 1 ATOM 4491 N NZ . LYS A 1 590 ? -17.514 22.833 13.183 1.00 16.54 ? 898 LYS A NZ 1 ATOM 4492 N N . GLU A 1 591 ? -12.721 21.795 18.535 1.00 14.80 ? 899 GLU A N 1 ATOM 4493 C CA . GLU A 1 591 ? -13.159 21.217 19.806 1.00 12.78 ? 899 GLU A CA 1 ATOM 4494 C C . GLU A 1 591 ? -13.202 22.264 20.913 1.00 12.41 ? 899 GLU A C 1 ATOM 4495 O O . GLU A 1 591 ? -14.152 22.296 21.694 1.00 12.55 ? 899 GLU A O 1 ATOM 4496 C CB . GLU A 1 591 ? -12.287 20.018 20.210 1.00 14.90 ? 899 GLU A CB 1 ATOM 4497 C CG . GLU A 1 591 ? -12.810 19.246 21.441 1.00 17.22 ? 899 GLU A CG 1 ATOM 4498 C CD . GLU A 1 591 ? -12.330 19.847 22.755 1.00 19.60 ? 899 GLU A CD 1 ATOM 4499 O OE1 . GLU A 1 591 ? -11.279 20.525 22.732 1.00 18.23 ? 899 GLU A OE1 1 ATOM 4500 O OE2 . GLU A 1 591 ? -13.000 19.647 23.801 1.00 18.03 ? 899 GLU A OE2 1 ATOM 4501 N N . GLU A 1 592 ? -12.184 23.125 20.974 1.00 8.76 ? 900 GLU A N 1 ATOM 4502 C CA . GLU A 1 592 ? -12.148 24.176 21.998 1.00 13.27 ? 900 GLU A CA 1 ATOM 4503 C C . GLU A 1 592 ? -13.280 25.198 21.815 1.00 15.94 ? 900 GLU A C 1 ATOM 4504 O O . GLU A 1 592 ? -13.904 25.630 22.790 1.00 13.85 ? 900 GLU A O 1 ATOM 4505 C CB . GLU A 1 592 ? -10.781 24.887 22.029 1.00 13.49 ? 900 GLU A CB 1 ATOM 4506 C CG . GLU A 1 592 ? -10.713 26.077 22.999 1.00 15.44 ? 900 GLU A CG 1 ATOM 4507 C CD . GLU A 1 592 ? -9.487 26.961 22.781 1.00 18.24 ? 900 GLU A CD 1 ATOM 4508 O OE1 . GLU A 1 592 ? -8.498 26.492 22.153 1.00 15.49 ? 900 GLU A OE1 1 ATOM 4509 O OE2 . GLU A 1 592 ? -9.513 28.130 23.243 1.00 16.69 ? 900 GLU A OE2 1 ATOM 4510 N N . HIS A 1 593 ? -13.541 25.574 20.565 1.00 16.12 ? 901 HIS A N 1 ATOM 4511 C CA . HIS A 1 593 ? -14.651 26.468 20.232 1.00 14.52 ? 901 HIS A CA 1 ATOM 4512 C C . HIS A 1 593 ? -15.991 25.932 20.742 1.00 14.06 ? 901 HIS A C 1 ATOM 4513 O O . HIS A 1 593 ? -16.754 26.659 21.370 1.00 11.10 ? 901 HIS A O 1 ATOM 4514 C CB . HIS A 1 593 ? -14.680 26.702 18.714 1.00 14.44 ? 901 HIS A CB 1 ATOM 4515 C CG . HIS A 1 593 ? -16.029 27.049 18.162 1.00 12.89 ? 901 HIS A CG 1 ATOM 4516 N ND1 . HIS A 1 593 ? -16.677 28.234 18.450 1.00 9.51 ? 901 HIS A ND1 1 ATOM 4517 C CD2 . HIS A 1 593 ? -16.837 26.376 17.307 1.00 13.57 ? 901 HIS A CD2 1 ATOM 4518 C CE1 . HIS A 1 593 ? -17.830 28.268 17.804 1.00 11.20 ? 901 HIS A CE1 1 ATOM 4519 N NE2 . HIS A 1 593 ? -17.953 27.151 17.108 1.00 15.25 ? 901 HIS A NE2 1 ATOM 4520 N N . VAL A 1 594 ? -16.279 24.658 20.491 1.00 12.65 ? 902 VAL A N 1 ATOM 4521 C CA . VAL A 1 594 ? -17.549 24.086 20.937 1.00 11.52 ? 902 VAL A CA 1 ATOM 4522 C C . VAL A 1 594 ? -17.569 23.999 22.466 1.00 14.79 ? 902 VAL A C 1 ATOM 4523 O O . VAL A 1 594 ? -18.529 24.420 23.108 1.00 15.71 ? 902 VAL A O 1 ATOM 4524 C CB . VAL A 1 594 ? -17.819 22.709 20.287 1.00 12.21 ? 902 VAL A CB 1 ATOM 4525 C CG1 . VAL A 1 594 ? -19.152 22.128 20.764 1.00 11.18 ? 902 VAL A CG1 1 ATOM 4526 C CG2 . VAL A 1 594 ? -17.797 22.821 18.756 1.00 13.47 ? 902 VAL A CG2 1 ATOM 4527 N N . ARG A 1 595 ? -16.481 23.491 23.039 1.00 13.76 ? 903 ARG A N 1 ATOM 4528 C CA . ARG A 1 595 ? -16.369 23.310 24.485 1.00 14.60 ? 903 ARG A CA 1 ATOM 4529 C C . ARG A 1 595 ? -16.501 24.623 25.268 1.00 13.48 ? 903 ARG A C 1 ATOM 4530 O O . ARG A 1 595 ? -17.188 24.679 26.291 1.00 13.04 ? 903 ARG A O 1 ATOM 4531 C CB . ARG A 1 595 ? -15.045 22.596 24.821 1.00 13.25 ? 903 ARG A CB 1 ATOM 4532 C CG . ARG A 1 595 ? -14.795 22.359 26.309 1.00 16.75 ? 903 ARG A CG 1 ATOM 4533 C CD . ARG A 1 595 ? -13.632 21.374 26.537 1.00 15.25 ? 903 ARG A CD 1 ATOM 4534 N NE . ARG A 1 595 ? -12.521 21.579 25.606 1.00 14.62 ? 903 ARG A NE 1 ATOM 4535 C CZ . ARG A 1 595 ? -11.671 22.606 25.645 1.00 15.63 ? 903 ARG A CZ 1 ATOM 4536 N NH1 . ARG A 1 595 ? -11.791 23.551 26.573 1.00 15.18 ? 903 ARG A NH1 1 ATOM 4537 N NH2 . ARG A 1 595 ? -10.699 22.691 24.749 1.00 14.34 ? 903 ARG A NH2 1 ATOM 4538 N N . ARG A 1 596 ? -15.873 25.687 24.780 1.00 13.85 ? 904 ARG A N 1 ATOM 4539 C CA . ARG A 1 596 ? -15.870 26.943 25.531 1.00 13.48 ? 904 ARG A CA 1 ATOM 4540 C C . ARG A 1 596 ? -17.226 27.648 25.503 1.00 13.23 ? 904 ARG A C 1 ATOM 4541 O O . ARG A 1 596 ? -17.470 28.567 26.276 1.00 10.69 ? 904 ARG A O 1 ATOM 4542 C CB . ARG A 1 596 ? -14.741 27.883 25.070 1.00 13.65 ? 904 ARG A CB 1 ATOM 4543 C CG . ARG A 1 596 ? -14.966 28.584 23.738 1.00 12.66 ? 904 ARG A CG 1 ATOM 4544 C CD . ARG A 1 596 ? -13.697 29.327 23.296 1.00 14.83 ? 904 ARG A CD 1 ATOM 4545 N NE . ARG A 1 596 ? -13.818 29.875 21.946 1.00 13.92 ? 904 ARG A NE 1 ATOM 4546 C CZ . ARG A 1 596 ? -12.869 30.575 21.328 1.00 15.71 ? 904 ARG A CZ 1 ATOM 4547 N NH1 . ARG A 1 596 ? -11.713 30.837 21.935 1.00 19.21 ? 904 ARG A NH1 1 ATOM 4548 N NH2 . ARG A 1 596 ? -13.077 31.027 20.099 1.00 13.91 ? 904 ARG A NH2 1 ATOM 4549 N N . GLY A 1 597 ? -18.119 27.207 24.626 1.00 13.69 ? 905 GLY A N 1 ATOM 4550 C CA . GLY A 1 597 ? -19.479 27.714 24.644 1.00 12.33 ? 905 GLY A CA 1 ATOM 4551 C C . GLY A 1 597 ? -20.163 27.455 25.975 1.00 14.28 ? 905 GLY A C 1 ATOM 4552 O O . GLY A 1 597 ? -21.102 28.155 26.343 1.00 10.66 ? 905 GLY A O 1 ATOM 4553 N N . GLN A 1 598 ? -19.698 26.448 26.708 1.00 12.92 ? 906 GLN A N 1 ATOM 4554 C CA . GLN A 1 598 ? -20.274 26.139 28.017 1.00 12.42 ? 906 GLN A CA 1 ATOM 4555 C C . GLN A 1 598 ? -20.099 27.266 29.039 1.00 16.20 ? 906 GLN A C 1 ATOM 4556 O O . GLN A 1 598 ? -20.809 27.310 30.042 1.00 16.26 ? 906 GLN A O 1 ATOM 4557 C CB . GLN A 1 598 ? -19.621 24.882 28.586 1.00 15.40 ? 906 GLN A CB 1 ATOM 4558 C CG . GLN A 1 598 ? -19.956 23.617 27.833 1.00 12.81 ? 906 GLN A CG 1 ATOM 4559 C CD . GLN A 1 598 ? -19.227 22.439 28.402 1.00 12.43 ? 906 GLN A CD 1 ATOM 4560 O OE1 . GLN A 1 598 ? -19.828 21.566 29.038 1.00 16.34 ? 906 GLN A OE1 1 ATOM 4561 N NE2 . GLN A 1 598 ? -17.913 22.400 28.184 1.00 12.61 ? 906 GLN A NE2 1 ATOM 4562 N N . LEU A 1 599 ? -19.146 28.163 28.799 1.00 18.19 ? 907 LEU A N 1 ATOM 4563 C CA . LEU A 1 599 ? -18.850 29.233 29.760 1.00 15.01 ? 907 LEU A CA 1 ATOM 4564 C C . LEU A 1 599 ? -19.824 30.401 29.662 1.00 16.17 ? 907 LEU A C 1 ATOM 4565 O O . LEU A 1 599 ? -19.955 31.195 30.594 1.00 17.34 ? 907 LEU A O 1 ATOM 4566 C CB . LEU A 1 599 ? -17.434 29.757 29.561 1.00 14.22 ? 907 LEU A CB 1 ATOM 4567 C CG . LEU A 1 599 ? -16.303 28.740 29.653 1.00 15.76 ? 907 LEU A CG 1 ATOM 4568 C CD1 . LEU A 1 599 ? -14.998 29.404 29.244 1.00 16.26 ? 907 LEU A CD1 1 ATOM 4569 C CD2 . LEU A 1 599 ? -16.215 28.181 31.068 1.00 14.58 ? 907 LEU A CD2 1 ATOM 4570 N N . ALA A 1 600 ? -20.486 30.525 28.521 1.00 14.70 ? 908 ALA A N 1 ATOM 4571 C CA . ALA A 1 600 ? -21.426 31.623 28.337 1.00 15.02 ? 908 ALA A CA 1 ATOM 4572 C C . ALA A 1 600 ? -22.752 31.333 29.033 1.00 18.79 ? 908 ALA A C 1 ATOM 4573 O O . ALA A 1 600 ? -23.066 30.177 29.323 1.00 19.21 ? 908 ALA A O 1 ATOM 4574 C CB . ALA A 1 600 ? -21.642 31.893 26.853 1.00 13.16 ? 908 ALA A CB 1 ATOM 4575 N N . ASP A 1 601 ? -23.525 32.383 29.308 1.00 18.31 ? 909 ASP A N 1 ATOM 4576 C CA . ASP A 1 601 ? -24.881 32.213 29.833 1.00 14.25 ? 909 ASP A CA 1 ATOM 4577 C C . ASP A 1 601 ? -25.901 32.099 28.703 1.00 14.57 ? 909 ASP A C 1 ATOM 4578 O O . ASP A 1 601 ? -26.812 31.268 28.747 1.00 13.99 ? 909 ASP A O 1 ATOM 4579 C CB . ASP A 1 601 ? -25.274 33.384 30.756 1.00 13.75 ? 909 ASP A CB 1 ATOM 4580 C CG . ASP A 1 601 ? -24.452 33.420 32.035 1.00 19.57 ? 909 ASP A CG 1 ATOM 4581 O OD1 . ASP A 1 601 ? -23.536 34.269 32.158 1.00 20.93 ? 909 ASP A OD1 1 ATOM 4582 O OD2 . ASP A 1 601 ? -24.703 32.570 32.905 1.00 21.86 ? 909 ASP A OD2 1 ATOM 4583 N N . VAL A 1 602 ? -25.742 32.957 27.699 1.00 15.38 ? 910 VAL A N 1 ATOM 4584 C CA . VAL A 1 602 ? -26.718 33.133 26.624 1.00 16.36 ? 910 VAL A CA 1 ATOM 4585 C C . VAL A 1 602 ? -25.978 33.510 25.341 1.00 16.02 ? 910 VAL A C 1 ATOM 4586 O O . VAL A 1 602 ? -25.085 34.341 25.377 1.00 18.06 ? 910 VAL A O 1 ATOM 4587 C CB . VAL A 1 602 ? -27.676 34.307 26.928 1.00 15.55 ? 910 VAL A CB 1 ATOM 4588 C CG1 . VAL A 1 602 ? -28.669 34.506 25.792 1.00 12.71 ? 910 VAL A CG1 1 ATOM 4589 C CG2 . VAL A 1 602 ? -28.428 34.110 28.261 1.00 18.05 ? 910 VAL A CG2 1 ATOM 4590 N N . CYS A 1 603 ? -26.359 32.909 24.215 1.00 11.85 ? 911 CYS A N 1 ATOM 4591 C CA . CYS A 1 603 ? -25.866 33.326 22.907 1.00 12.42 ? 911 CYS A CA 1 ATOM 4592 C C . CYS A 1 603 ? -26.834 34.318 22.256 1.00 12.71 ? 911 CYS A C 1 ATOM 4593 O O . CYS A 1 603 ? -28.035 34.090 22.236 1.00 15.65 ? 911 CYS A O 1 ATOM 4594 C CB . CYS A 1 603 ? -25.712 32.105 21.995 1.00 18.07 ? 911 CYS A CB 1 ATOM 4595 S SG . CYS A 1 603 ? -25.234 32.513 20.286 1.00 23.80 ? 911 CYS A SG 1 ATOM 4596 N N . LEU A 1 604 ? -26.315 35.423 21.739 1.00 15.74 ? 912 LEU A N 1 ATOM 4597 C CA . LEU A 1 604 ? -27.160 36.360 21.003 1.00 16.62 ? 912 LEU A CA 1 ATOM 4598 C C . LEU A 1 604 ? -26.934 36.190 19.500 1.00 18.59 ? 912 LEU A C 1 ATOM 4599 O O . LEU A 1 604 ? -25.912 36.622 18.957 1.00 15.52 ? 912 LEU A O 1 ATOM 4600 C CB . LEU A 1 604 ? -26.873 37.802 21.420 1.00 16.97 ? 912 LEU A CB 1 ATOM 4601 C CG . LEU A 1 604 ? -27.022 38.142 22.901 1.00 19.98 ? 912 LEU A CG 1 ATOM 4602 C CD1 . LEU A 1 604 ? -26.566 39.576 23.160 1.00 21.53 ? 912 LEU A CD1 1 ATOM 4603 C CD2 . LEU A 1 604 ? -28.459 37.928 23.375 1.00 19.26 ? 912 LEU A CD2 1 ATOM 4604 N N . ASP A 1 605 ? -27.898 35.562 18.836 1.00 17.36 ? 913 ASP A N 1 ATOM 4605 C CA . ASP A 1 605 ? -27.760 35.224 17.424 1.00 15.47 ? 913 ASP A CA 1 ATOM 4606 C C . ASP A 1 605 ? -27.881 36.458 16.540 1.00 13.76 ? 913 ASP A C 1 ATOM 4607 O O . ASP A 1 605 ? -28.605 37.402 16.859 1.00 20.01 ? 913 ASP A O 1 ATOM 4608 C CB . ASP A 1 605 ? -28.817 34.183 17.029 1.00 16.04 ? 913 ASP A CB 1 ATOM 4609 C CG . ASP A 1 605 ? -28.711 33.761 15.573 1.00 19.61 ? 913 ASP A CG 1 ATOM 4610 O OD1 . ASP A 1 605 ? -27.585 33.455 15.118 1.00 16.90 ? 913 ASP A OD1 1 ATOM 4611 O OD2 . ASP A 1 605 ? -29.758 33.748 14.886 1.00 21.37 ? 913 ASP A OD2 1 ATOM 4612 N N . THR A 1 606 ? -27.154 36.448 15.430 1.00 13.49 ? 914 THR A N 1 ATOM 4613 C CA . THR A 1 606 ? -27.194 37.531 14.449 1.00 13.86 ? 914 THR A CA 1 ATOM 4614 C C . THR A 1 606 ? -28.398 37.412 13.502 1.00 16.40 ? 914 THR A C 1 ATOM 4615 O O . THR A 1 606 ? -28.506 36.442 12.758 1.00 19.92 ? 914 THR A O 1 ATOM 4616 C CB . THR A 1 606 ? -25.898 37.512 13.599 1.00 14.63 ? 914 THR A CB 1 ATOM 4617 O OG1 . THR A 1 606 ? -25.587 36.157 13.246 1.00 16.55 ? 914 THR A OG1 1 ATOM 4618 C CG2 . THR A 1 606 ? -24.736 38.083 14.398 1.00 12.92 ? 914 THR A CG2 1 ATOM 4619 N N . PRO A 1 607 ? -29.302 38.411 13.508 1.00 13.49 ? 915 PRO A N 1 ATOM 4620 C CA . PRO A 1 607 ? -30.515 38.320 12.679 1.00 15.16 ? 915 PRO A CA 1 ATOM 4621 C C . PRO A 1 607 ? -30.276 38.456 11.172 1.00 19.80 ? 915 PRO A C 1 ATOM 4622 O O . PRO A 1 607 ? -31.060 37.913 10.391 1.00 20.79 ? 915 PRO A O 1 ATOM 4623 C CB . PRO A 1 607 ? -31.362 39.503 13.163 1.00 20.06 ? 915 PRO A CB 1 ATOM 4624 C CG . PRO A 1 607 ? -30.854 39.803 14.530 1.00 20.59 ? 915 PRO A CG 1 ATOM 4625 C CD . PRO A 1 607 ? -29.384 39.517 14.478 1.00 16.15 ? 915 PRO A CD 1 ATOM 4626 N N . LEU A 1 608 ? -29.231 39.177 10.770 1.00 19.01 ? 916 LEU A N 1 ATOM 4627 C CA . LEU A 1 608 ? -28.966 39.405 9.352 1.00 18.23 ? 916 LEU A CA 1 ATOM 4628 C C . LEU A 1 608 ? -28.704 38.080 8.638 1.00 17.11 ? 916 LEU A C 1 ATOM 4629 O O . LEU A 1 608 ? -29.304 37.779 7.616 1.00 18.61 ? 916 LEU A O 1 ATOM 4630 C CB . LEU A 1 608 ? -27.773 40.345 9.175 1.00 16.26 ? 916 LEU A CB 1 ATOM 4631 C CG . LEU A 1 608 ? -27.399 40.633 7.722 1.00 19.11 ? 916 LEU A CG 1 ATOM 4632 C CD1 . LEU A 1 608 ? -28.527 41.389 7.023 1.00 19.56 ? 916 LEU A CD1 1 ATOM 4633 C CD2 . LEU A 1 608 ? -26.083 41.398 7.646 1.00 19.05 ? 916 LEU A CD2 1 ATOM 4634 N N . CYS A 1 609 ? -27.792 37.303 9.196 1.00 14.06 ? 917 CYS A N 1 ATOM 4635 C CA . CYS A 1 609 ? -27.547 35.935 8.769 1.00 14.86 ? 917 CYS A CA 1 ATOM 4636 C C . CYS A 1 609 ? -27.236 35.205 10.054 1.00 16.13 ? 917 CYS A C 1 ATOM 4637 O O . CYS A 1 609 ? -26.307 35.590 10.764 1.00 18.31 ? 917 CYS A O 1 ATOM 4638 C CB . CYS A 1 609 ? -26.357 35.858 7.807 1.00 17.32 ? 917 CYS A CB 1 ATOM 4639 S SG . CYS A 1 609 ? -25.851 34.156 7.450 1.00 19.90 ? 917 CYS A SG 1 ATOM 4640 N N . ASN A 1 610 ? -28.035 34.194 10.390 1.00 15.23 ? 918 ASN A N 1 ATOM 4641 C CA . ASN A 1 610 ? -27.871 33.494 11.663 1.00 14.61 ? 918 ASN A CA 1 ATOM 4642 C C . ASN A 1 610 ? -26.590 32.683 11.719 1.00 16.53 ? 918 ASN A C 1 ATOM 4643 O O . ASN A 1 610 ? -25.948 32.428 10.694 1.00 15.69 ? 918 ASN A O 1 ATOM 4644 C CB . ASN A 1 610 ? -29.011 32.496 11.929 1.00 15.23 ? 918 ASN A CB 1 ATOM 4645 C CG . ASN A 1 610 ? -30.401 33.103 11.802 1.00 18.74 ? 918 ASN A CG 1 ATOM 4646 O OD1 . ASN A 1 610 ? -31.365 32.371 11.570 1.00 17.79 ? 918 ASN A OD1 1 ATOM 4647 N ND2 . ASN A 1 610 ? -30.518 34.425 11.964 1.00 16.21 ? 918 ASN A ND2 1 ATOM 4648 N N . GLY A 1 611 ? -26.249 32.247 12.926 1.00 16.69 ? 919 GLY A N 1 ATOM 4649 C CA . GLY A 1 611 ? -25.363 31.114 13.082 1.00 17.33 ? 919 GLY A CA 1 ATOM 4650 C C . GLY A 1 611 ? -26.038 29.881 12.495 1.00 16.41 ? 919 GLY A C 1 ATOM 4651 O O . GLY A 1 611 ? -27.223 29.623 12.738 1.00 14.81 ? 919 GLY A O 1 ATOM 4652 N N . HIS A 1 612 ? -25.301 29.129 11.685 1.00 15.65 ? 920 HIS A N 1 ATOM 4653 C CA . HIS A 1 612 ? -25.849 27.892 11.133 1.00 13.06 ? 920 HIS A CA 1 ATOM 4654 C C . HIS A 1 612 ? -25.114 26.748 11.806 1.00 15.25 ? 920 HIS A C 1 ATOM 4655 O O . HIS A 1 612 ? -25.582 26.240 12.824 1.00 15.93 ? 920 HIS A O 1 ATOM 4656 C CB . HIS A 1 612 ? -25.745 27.857 9.605 1.00 14.19 ? 920 HIS A CB 1 ATOM 4657 C CG . HIS A 1 612 ? -26.520 28.947 8.933 1.00 16.69 ? 920 HIS A CG 1 ATOM 4658 N ND1 . HIS A 1 612 ? -26.431 29.210 7.583 1.00 18.68 ? 920 HIS A ND1 1 ATOM 4659 C CD2 . HIS A 1 612 ? -27.388 29.857 9.437 1.00 15.93 ? 920 HIS A CD2 1 ATOM 4660 C CE1 . HIS A 1 612 ? -27.208 30.236 7.284 1.00 17.41 ? 920 HIS A CE1 1 ATOM 4661 N NE2 . HIS A 1 612 ? -27.798 30.650 8.392 1.00 17.18 ? 920 HIS A NE2 1 ATOM 4662 N N . THR A 1 613 ? -23.959 26.364 11.265 1.00 16.52 ? 921 THR A N 1 ATOM 4663 C CA . THR A 1 613 ? -23.061 25.453 11.982 1.00 13.76 ? 921 THR A CA 1 ATOM 4664 C C . THR A 1 613 ? -22.832 26.008 13.387 1.00 16.61 ? 921 THR A C 1 ATOM 4665 O O . THR A 1 613 ? -22.850 25.281 14.391 1.00 14.82 ? 921 THR A O 1 ATOM 4666 C CB . THR A 1 613 ? -21.696 25.353 11.278 1.00 16.32 ? 921 THR A CB 1 ATOM 4667 O OG1 . THR A 1 613 ? -21.888 24.999 9.905 1.00 17.61 ? 921 THR A OG1 1 ATOM 4668 C CG2 . THR A 1 613 ? -20.802 24.314 11.956 1.00 13.66 ? 921 THR A CG2 1 ATOM 4669 N N . THR A 1 614 ? -22.621 27.317 13.442 1.00 13.61 ? 922 THR A N 1 ATOM 4670 C CA . THR A 1 614 ? -22.307 28.005 14.687 1.00 13.08 ? 922 THR A CA 1 ATOM 4671 C C . THR A 1 614 ? -23.449 27.904 15.697 1.00 15.51 ? 922 THR A C 1 ATOM 4672 O O . THR A 1 614 ? -23.214 27.802 16.899 1.00 14.96 ? 922 THR A O 1 ATOM 4673 C CB . THR A 1 614 ? -21.946 29.489 14.423 1.00 14.09 ? 922 THR A CB 1 ATOM 4674 O OG1 . THR A 1 614 ? -20.897 29.542 13.443 1.00 13.83 ? 922 THR A OG1 1 ATOM 4675 C CG2 . THR A 1 614 ? -21.463 30.175 15.706 1.00 13.20 ? 922 THR A CG2 1 ATOM 4676 N N . GLY A 1 615 ? -24.680 27.921 15.202 1.00 13.48 ? 923 GLY A N 1 ATOM 4677 C CA . GLY A 1 615 ? -25.834 27.751 16.059 1.00 14.69 ? 923 GLY A CA 1 ATOM 4678 C C . GLY A 1 615 ? -25.843 26.366 16.687 1.00 15.16 ? 923 GLY A C 1 ATOM 4679 O O . GLY A 1 615 ? -26.092 26.237 17.889 1.00 12.39 ? 923 GLY A O 1 ATOM 4680 N N . MET A 1 616 ? -25.570 25.338 15.879 1.00 13.66 ? 924 MET A N 1 ATOM 4681 C CA . MET A 1 616 ? -25.508 23.960 16.378 1.00 14.01 ? 924 MET A CA 1 ATOM 4682 C C . MET A 1 616 ? -24.418 23.837 17.440 1.00 13.45 ? 924 MET A C 1 ATOM 4683 O O . MET A 1 616 ? -24.602 23.175 18.468 1.00 15.27 ? 924 MET A O 1 ATOM 4684 C CB . MET A 1 616 ? -25.259 22.959 15.233 1.00 10.77 ? 924 MET A CB 1 ATOM 4685 C CG . MET A 1 616 ? -26.360 22.938 14.171 1.00 12.87 ? 924 MET A CG 1 ATOM 4686 S SD . MET A 1 616 ? -27.989 22.378 14.750 1.00 16.55 ? 924 MET A SD 1 ATOM 4687 C CE . MET A 1 616 ? -27.709 20.615 14.956 1.00 12.09 ? 924 MET A CE 1 ATOM 4688 N N . ASP A 1 617 ? -23.292 24.499 17.202 1.00 11.21 ? 925 ASP A N 1 ATOM 4689 C CA . ASP A 1 617 ? -22.170 24.454 18.138 1.00 12.59 ? 925 ASP A CA 1 ATOM 4690 C C . ASP A 1 617 ? -22.559 24.968 19.533 1.00 11.84 ? 925 ASP A C 1 ATOM 4691 O O . ASP A 1 617 ? -22.229 24.342 20.559 1.00 13.54 ? 925 ASP A O 1 ATOM 4692 C CB . ASP A 1 617 ? -20.984 25.263 17.608 1.00 14.99 ? 925 ASP A CB 1 ATOM 4693 C CG . ASP A 1 617 ? -20.412 24.705 16.308 1.00 17.56 ? 925 ASP A CG 1 ATOM 4694 O OD1 . ASP A 1 617 ? -20.553 23.490 16.031 1.00 15.22 ? 925 ASP A OD1 1 ATOM 4695 O OD2 . ASP A 1 617 ? -19.791 25.498 15.569 1.00 13.74 ? 925 ASP A OD2 1 ATOM 4696 N N . VAL A 1 618 ? -23.233 26.113 19.578 1.00 11.06 ? 926 VAL A N 1 ATOM 4697 C CA . VAL A 1 618 ? -23.570 26.723 20.871 1.00 12.25 ? 926 VAL A CA 1 ATOM 4698 C C . VAL A 1 618 ? -24.644 25.930 21.591 1.00 15.03 ? 926 VAL A C 1 ATOM 4699 O O . VAL A 1 618 ? -24.623 25.832 22.810 1.00 15.04 ? 926 VAL A O 1 ATOM 4700 C CB . VAL A 1 618 ? -23.990 28.215 20.784 1.00 24.91 ? 926 VAL A CB 1 ATOM 4701 C CG1 . VAL A 1 618 ? -22.987 28.991 19.980 1.00 28.97 ? 926 VAL A CG1 1 ATOM 4702 C CG2 . VAL A 1 618 ? -25.404 28.384 20.222 1.00 20.77 ? 926 VAL A CG2 1 ATOM 4703 N N . LEU A 1 619 ? -25.566 25.343 20.838 1.00 12.46 ? 927 LEU A N 1 ATOM 4704 C CA . LEU A 1 619 ? -26.624 24.553 21.460 1.00 14.60 ? 927 LEU A CA 1 ATOM 4705 C C . LEU A 1 619 ? -26.101 23.245 22.031 1.00 15.90 ? 927 LEU A C 1 ATOM 4706 O O . LEU A 1 619 ? -26.632 22.742 23.016 1.00 17.59 ? 927 LEU A O 1 ATOM 4707 C CB . LEU A 1 619 ? -27.754 24.278 20.467 1.00 13.84 ? 927 LEU A CB 1 ATOM 4708 C CG . LEU A 1 619 ? -28.588 25.508 20.098 1.00 15.11 ? 927 LEU A CG 1 ATOM 4709 C CD1 . LEU A 1 619 ? -29.559 25.159 18.984 1.00 15.85 ? 927 LEU A CD1 1 ATOM 4710 C CD2 . LEU A 1 619 ? -29.338 26.069 21.318 1.00 16.24 ? 927 LEU A CD2 1 ATOM 4711 N N . TRP A 1 620 ? -25.075 22.682 21.397 1.00 13.40 ? 928 TRP A N 1 ATOM 4712 C CA . TRP A 1 620 ? -24.493 21.441 21.898 1.00 13.61 ? 928 TRP A CA 1 ATOM 4713 C C . TRP A 1 620 ? -23.793 21.669 23.243 1.00 14.27 ? 928 TRP A C 1 ATOM 4714 O O . TRP A 1 620 ? -23.727 20.770 24.090 1.00 16.68 ? 928 TRP A O 1 ATOM 4715 C CB . TRP A 1 620 ? -23.544 20.809 20.873 1.00 13.99 ? 928 TRP A CB 1 ATOM 4716 C CG . TRP A 1 620 ? -23.046 19.467 21.327 1.00 15.76 ? 928 TRP A CG 1 ATOM 4717 C CD1 . TRP A 1 620 ? -21.778 19.149 21.715 1.00 15.51 ? 928 TRP A CD1 1 ATOM 4718 C CD2 . TRP A 1 620 ? -23.829 18.273 21.484 1.00 14.23 ? 928 TRP A CD2 1 ATOM 4719 N NE1 . TRP A 1 620 ? -21.717 17.823 22.086 1.00 15.58 ? 928 TRP A NE1 1 ATOM 4720 C CE2 . TRP A 1 620 ? -22.962 17.264 21.957 1.00 15.56 ? 928 TRP A CE2 1 ATOM 4721 C CE3 . TRP A 1 620 ? -25.174 17.957 21.259 1.00 15.89 ? 928 TRP A CE3 1 ATOM 4722 C CZ2 . TRP A 1 620 ? -23.396 15.956 22.210 1.00 14.94 ? 928 TRP A CZ2 1 ATOM 4723 C CZ3 . TRP A 1 620 ? -25.606 16.656 21.504 1.00 12.55 ? 928 TRP A CZ3 1 ATOM 4724 C CH2 . TRP A 1 620 ? -24.718 15.676 21.983 1.00 16.09 ? 928 TRP A CH2 1 ATOM 4725 N N . ALA A 1 621 ? -23.302 22.885 23.454 1.00 14.80 ? 929 ALA A N 1 ATOM 4726 C CA . ALA A 1 621 ? -22.715 23.244 24.747 1.00 15.92 ? 929 ALA A CA 1 ATOM 4727 C C . ALA A 1 621 ? -23.783 23.563 25.806 1.00 18.03 ? 929 ALA A C 1 ATOM 4728 O O . ALA A 1 621 ? -23.463 23.811 26.968 1.00 15.44 ? 929 ALA A O 1 ATOM 4729 C CB . ALA A 1 621 ? -21.754 24.402 24.582 1.00 14.12 ? 929 ALA A CB 1 ATOM 4730 N N . GLY A 1 622 ? -25.051 23.559 25.398 1.00 17.31 ? 930 GLY A N 1 ATOM 4731 C CA . GLY A 1 622 ? -26.150 23.768 26.325 1.00 16.78 ? 930 GLY A CA 1 ATOM 4732 C C . GLY A 1 622 ? -26.498 25.236 26.528 1.00 16.75 ? 930 GLY A C 1 ATOM 4733 O O . GLY A 1 622 ? -27.173 25.595 27.489 1.00 16.81 ? 930 GLY A O 1 ATOM 4734 N N . THR A 1 623 ? -26.052 26.081 25.603 1.00 14.54 ? 931 THR A N 1 ATOM 4735 C CA . THR A 1 623 ? -26.241 27.525 25.722 1.00 16.06 ? 931 THR A CA 1 ATOM 4736 C C . THR A 1 623 ? -27.516 27.969 25.019 1.00 16.32 ? 931 THR A C 1 ATOM 4737 O O . THR A 1 623 ? -27.657 27.772 23.818 1.00 16.23 ? 931 THR A O 1 ATOM 4738 C CB . THR A 1 623 ? -25.081 28.267 25.048 1.00 18.67 ? 931 THR A CB 1 ATOM 4739 O OG1 . THR A 1 623 ? -23.843 27.690 25.464 1.00 23.71 ? 931 THR A OG1 1 ATOM 4740 C CG2 . THR A 1 623 ? -25.096 29.765 25.397 1.00 16.42 ? 931 THR A CG2 1 ATOM 4741 N N . PRO A 1 624 ? -28.439 28.592 25.761 1.00 15.83 ? 932 PRO A N 1 ATOM 4742 C CA . PRO A 1 624 ? -29.622 29.160 25.112 1.00 17.90 ? 932 PRO A CA 1 ATOM 4743 C C . PRO A 1 624 ? -29.225 30.213 24.079 1.00 19.91 ? 932 PRO A C 1 ATOM 4744 O O . PRO A 1 624 ? -28.327 31.017 24.320 1.00 19.59 ? 932 PRO A O 1 ATOM 4745 C CB . PRO A 1 624 ? -30.377 29.818 26.277 1.00 17.09 ? 932 PRO A CB 1 ATOM 4746 C CG . PRO A 1 624 ? -29.905 29.057 27.501 1.00 17.43 ? 932 PRO A CG 1 ATOM 4747 C CD . PRO A 1 624 ? -28.445 28.821 27.216 1.00 14.43 ? 932 PRO A CD 1 ATOM 4748 N N . MET A 1 625 ? -29.899 30.197 22.936 1.00 19.55 ? 933 MET A N 1 ATOM 4749 C CA . MET A 1 625 ? -29.631 31.147 21.875 1.00 18.49 ? 933 MET A CA 1 ATOM 4750 C C . MET A 1 625 ? -30.887 31.967 21.607 1.00 16.96 ? 933 MET A C 1 ATOM 4751 O O . MET A 1 625 ? -31.954 31.409 21.393 1.00 16.24 ? 933 MET A O 1 ATOM 4752 C CB . MET A 1 625 ? -29.209 30.386 20.613 1.00 19.97 ? 933 MET A CB 1 ATOM 4753 C CG . MET A 1 625 ? -28.987 31.241 19.388 1.00 21.08 ? 933 MET A CG 1 ATOM 4754 S SD . MET A 1 625 ? -28.163 30.297 18.075 1.00 24.08 ? 933 MET A SD 1 ATOM 4755 C CE . MET A 1 625 ? -29.191 28.830 18.028 1.00 28.34 ? 933 MET A CE 1 ATOM 4756 N N . VAL A 1 626 ? -30.760 33.289 21.644 1.00 16.93 ? 934 VAL A N 1 ATOM 4757 C CA . VAL A 1 626 ? -31.887 34.165 21.330 1.00 16.96 ? 934 VAL A CA 1 ATOM 4758 C C . VAL A 1 626 ? -31.806 34.528 19.848 1.00 15.62 ? 934 VAL A C 1 ATOM 4759 O O . VAL A 1 626 ? -30.759 34.937 19.383 1.00 14.03 ? 934 VAL A O 1 ATOM 4760 C CB . VAL A 1 626 ? -31.837 35.452 22.179 1.00 17.19 ? 934 VAL A CB 1 ATOM 4761 C CG1 . VAL A 1 626 ? -33.006 36.376 21.830 1.00 20.02 ? 934 VAL A CG1 1 ATOM 4762 C CG2 . VAL A 1 626 ? -31.849 35.111 23.663 1.00 16.15 ? 934 VAL A CG2 1 ATOM 4763 N N . THR A 1 627 ? -32.895 34.373 19.100 1.00 15.27 ? 935 THR A N 1 ATOM 4764 C CA . THR A 1 627 ? -32.847 34.690 17.680 1.00 17.38 ? 935 THR A CA 1 ATOM 4765 C C . THR A 1 627 ? -34.077 35.472 17.224 1.00 18.78 ? 935 THR A C 1 ATOM 4766 O O . THR A 1 627 ? -35.103 35.484 17.901 1.00 17.36 ? 935 THR A O 1 ATOM 4767 C CB . THR A 1 627 ? -32.714 33.408 16.822 1.00 22.37 ? 935 THR A CB 1 ATOM 4768 O OG1 . THR A 1 627 ? -32.434 33.761 15.461 1.00 21.30 ? 935 THR A OG1 1 ATOM 4769 C CG2 . THR A 1 627 ? -33.993 32.594 16.890 1.00 21.70 ? 935 THR A CG2 1 ATOM 4770 N N . MET A 1 628 ? -33.953 36.141 16.084 1.00 20.53 ? 936 MET A N 1 ATOM 4771 C CA . MET A 1 628 ? -35.069 36.863 15.478 1.00 21.72 ? 936 MET A CA 1 ATOM 4772 C C . MET A 1 628 ? -35.119 36.497 14.002 1.00 23.43 ? 936 MET A C 1 ATOM 4773 O O . MET A 1 628 ? -34.368 37.058 13.204 1.00 23.82 ? 936 MET A O 1 ATOM 4774 C CB . MET A 1 628 ? -34.882 38.373 15.617 1.00 20.78 ? 936 MET A CB 1 ATOM 4775 C CG . MET A 1 628 ? -36.049 39.190 15.050 1.00 22.12 ? 936 MET A CG 1 ATOM 4776 S SD . MET A 1 628 ? -35.818 40.971 15.200 1.00 26.80 ? 936 MET A SD 1 ATOM 4777 C CE . MET A 1 628 ? -34.516 41.242 13.994 1.00 34.26 ? 936 MET A CE 1 ATOM 4778 N N . PRO A 1 629 ? -35.987 35.541 13.635 1.00 21.66 ? 937 PRO A N 1 ATOM 4779 C CA . PRO A 1 629 ? -36.016 35.078 12.245 1.00 22.44 ? 937 PRO A CA 1 ATOM 4780 C C . PRO A 1 629 ? -36.471 36.179 11.296 1.00 23.02 ? 937 PRO A C 1 ATOM 4781 O O . PRO A 1 629 ? -37.376 36.941 11.630 1.00 22.12 ? 937 PRO A O 1 ATOM 4782 C CB . PRO A 1 629 ? -37.023 33.920 12.268 1.00 23.05 ? 937 PRO A CB 1 ATOM 4783 C CG . PRO A 1 629 ? -37.829 34.117 13.524 1.00 23.31 ? 937 PRO A CG 1 ATOM 4784 C CD . PRO A 1 629 ? -36.896 34.772 14.504 1.00 24.22 ? 937 PRO A CD 1 ATOM 4785 N N . GLY A 1 630 ? -35.826 36.266 10.138 1.00 22.93 ? 938 GLY A N 1 ATOM 4786 C CA . GLY A 1 630 ? -36.160 37.271 9.142 1.00 23.65 ? 938 GLY A CA 1 ATOM 4787 C C . GLY A 1 630 ? -36.919 36.648 7.988 1.00 25.32 ? 938 GLY A C 1 ATOM 4788 O O . GLY A 1 630 ? -37.746 35.765 8.199 1.00 26.43 ? 938 GLY A O 1 ATOM 4789 N N . GLU A 1 631 ? -36.648 37.096 6.767 1.00 25.64 ? 939 GLU A N 1 ATOM 4790 C CA . GLU A 1 631 ? -37.368 36.559 5.617 1.00 30.99 ? 939 GLU A CA 1 ATOM 4791 C C . GLU A 1 631 ? -36.534 35.599 4.764 1.00 32.94 ? 939 GLU A C 1 ATOM 4792 O O . GLU A 1 631 ? -37.070 34.646 4.190 1.00 37.90 ? 939 GLU A O 1 ATOM 4793 C CB . GLU A 1 631 ? -37.959 37.686 4.778 1.00 34.14 ? 939 GLU A CB 1 ATOM 4794 C CG . GLU A 1 631 ? -38.927 38.561 5.566 1.00 39.33 ? 939 GLU A CG 1 ATOM 4795 C CD . GLU A 1 631 ? -39.599 39.617 4.715 1.00 44.16 ? 939 GLU A CD 1 ATOM 4796 O OE1 . GLU A 1 631 ? -39.864 39.345 3.524 1.00 44.20 ? 939 GLU A OE1 1 ATOM 4797 O OE2 . GLU A 1 631 ? -39.860 40.720 5.241 1.00 48.21 ? 939 GLU A OE2 1 ATOM 4798 N N . THR A 1 632 ? -35.226 35.832 4.699 1.00 26.07 ? 940 THR A N 1 ATOM 4799 C CA . THR A 1 632 ? -34.348 34.950 3.933 1.00 21.26 ? 940 THR A CA 1 ATOM 4800 C C . THR A 1 632 ? -34.096 33.659 4.696 1.00 21.32 ? 940 THR A C 1 ATOM 4801 O O . THR A 1 632 ? -34.118 33.649 5.930 1.00 20.79 ? 940 THR A O 1 ATOM 4802 C CB . THR A 1 632 ? -32.985 35.595 3.673 1.00 20.21 ? 940 THR A CB 1 ATOM 4803 O OG1 . THR A 1 632 ? -32.275 35.702 4.913 1.00 19.38 ? 940 THR A OG1 1 ATOM 4804 C CG2 . THR A 1 632 ? -33.145 36.967 3.052 1.00 23.59 ? 940 THR A CG2 1 ATOM 4805 N N . LEU A 1 633 ? -33.827 32.583 3.957 1.00 17.90 ? 941 LEU A N 1 ATOM 4806 C CA . LEU A 1 633 ? -33.474 31.298 4.550 1.00 18.12 ? 941 LEU A CA 1 ATOM 4807 C C . LEU A 1 633 ? -32.393 31.450 5.618 1.00 18.57 ? 941 LEU A C 1 ATOM 4808 O O . LEU A 1 633 ? -32.521 30.909 6.722 1.00 15.13 ? 941 LEU A O 1 ATOM 4809 C CB . LEU A 1 633 ? -32.985 30.334 3.452 1.00 20.33 ? 941 LEU A CB 1 ATOM 4810 C CG . LEU A 1 633 ? -32.885 28.826 3.728 1.00 20.01 ? 941 LEU A CG 1 ATOM 4811 C CD1 . LEU A 1 633 ? -32.734 28.044 2.423 1.00 21.15 ? 941 LEU A CD1 1 ATOM 4812 C CD2 . LEU A 1 633 ? -31.741 28.471 4.673 1.00 20.04 ? 941 LEU A CD2 1 ATOM 4813 N N . ALA A 1 634 ? -31.324 32.172 5.276 1.00 17.46 ? 942 ALA A N 1 ATOM 4814 C CA . ALA A 1 634 ? -30.147 32.287 6.141 1.00 18.23 ? 942 ALA A CA 1 ATOM 4815 C C . ALA A 1 634 ? -30.458 32.992 7.466 1.00 18.80 ? 942 ALA A C 1 ATOM 4816 O O . ALA A 1 634 ? -29.759 32.801 8.460 1.00 16.36 ? 942 ALA A O 1 ATOM 4817 C CB . ALA A 1 634 ? -29.006 33.012 5.393 1.00 17.86 ? 942 ALA A CB 1 ATOM 4818 N N . SER A 1 635 ? -31.508 33.807 7.466 1.00 18.73 ? 943 SER A N 1 ATOM 4819 C CA . SER A 1 635 ? -31.918 34.536 8.660 1.00 17.84 ? 943 SER A CA 1 ATOM 4820 C C . SER A 1 635 ? -32.942 33.757 9.482 1.00 18.20 ? 943 SER A C 1 ATOM 4821 O O . SER A 1 635 ? -33.425 34.255 10.502 1.00 19.76 ? 943 SER A O 1 ATOM 4822 C CB . SER A 1 635 ? -32.506 35.903 8.285 1.00 20.57 ? 943 SER A CB 1 ATOM 4823 O OG . SER A 1 635 ? -33.772 35.767 7.654 1.00 19.58 ? 943 SER A OG 1 ATOM 4824 N N . ARG A 1 636 ? -33.276 32.542 9.049 1.00 14.59 ? 944 ARG A N 1 ATOM 4825 C CA . ARG A 1 636 ? -34.329 31.772 9.724 1.00 13.67 ? 944 ARG A CA 1 ATOM 4826 C C . ARG A 1 636 ? -33.856 30.438 10.283 1.00 15.61 ? 944 ARG A C 1 ATOM 4827 O O . ARG A 1 636 ? -34.623 29.733 10.946 1.00 15.12 ? 944 ARG A O 1 ATOM 4828 C CB . ARG A 1 636 ? -35.521 31.549 8.789 1.00 15.02 ? 944 ARG A CB 1 ATOM 4829 C CG . ARG A 1 636 ? -36.230 32.838 8.364 1.00 18.25 ? 944 ARG A CG 1 ATOM 4830 C CD . ARG A 1 636 ? -37.441 32.546 7.482 1.00 19.04 ? 944 ARG A CD 1 ATOM 4831 N NE . ARG A 1 636 ? -38.460 31.784 8.196 1.00 18.98 ? 944 ARG A NE 1 ATOM 4832 C CZ . ARG A 1 636 ? -39.353 32.330 9.013 1.00 24.15 ? 944 ARG A CZ 1 ATOM 4833 N NH1 . ARG A 1 636 ? -39.353 33.646 9.210 1.00 23.53 ? 944 ARG A NH1 1 ATOM 4834 N NH2 . ARG A 1 636 ? -40.248 31.568 9.630 1.00 26.49 ? 944 ARG A NH2 1 ATOM 4835 N N . VAL A 1 637 ? -32.596 30.094 10.026 1.00 15.60 ? 945 VAL A N 1 ATOM 4836 C CA . VAL A 1 637 ? -32.061 28.784 10.418 1.00 17.07 ? 945 VAL A CA 1 ATOM 4837 C C . VAL A 1 637 ? -32.049 28.563 11.931 1.00 16.49 ? 945 VAL A C 1 ATOM 4838 O O . VAL A 1 637 ? -32.468 27.505 12.426 1.00 13.27 ? 945 VAL A O 1 ATOM 4839 C CB . VAL A 1 637 ? -30.638 28.558 9.842 1.00 16.51 ? 945 VAL A CB 1 ATOM 4840 C CG1 . VAL A 1 637 ? -29.957 27.362 10.508 1.00 16.14 ? 945 VAL A CG1 1 ATOM 4841 C CG2 . VAL A 1 637 ? -30.700 28.371 8.330 1.00 16.54 ? 945 VAL A CG2 1 ATOM 4842 N N . ALA A 1 638 ? -31.570 29.562 12.668 1.00 17.56 ? 946 ALA A N 1 ATOM 4843 C CA . ALA A 1 638 ? -31.504 29.452 14.119 1.00 18.47 ? 946 ALA A CA 1 ATOM 4844 C C . ALA A 1 638 ? -32.887 29.193 14.744 1.00 18.43 ? 946 ALA A C 1 ATOM 4845 O O . ALA A 1 638 ? -33.025 28.365 15.652 1.00 16.29 ? 946 ALA A O 1 ATOM 4846 C CB . ALA A 1 638 ? -30.855 30.691 14.723 1.00 19.70 ? 946 ALA A CB 1 ATOM 4847 N N . ALA A 1 639 ? -33.906 29.884 14.246 1.00 18.15 ? 947 ALA A N 1 ATOM 4848 C CA . ALA A 1 639 ? -35.268 29.678 14.740 1.00 19.43 ? 947 ALA A CA 1 ATOM 4849 C C . ALA A 1 639 ? -35.742 28.258 14.446 1.00 19.95 ? 947 ALA A C 1 ATOM 4850 O O . ALA A 1 639 ? -36.456 27.654 15.247 1.00 18.86 ? 947 ALA A O 1 ATOM 4851 C CB . ALA A 1 639 ? -36.227 30.694 14.124 1.00 20.59 ? 947 ALA A CB 1 ATOM 4852 N N . SER A 1 640 ? -35.355 27.734 13.289 1.00 18.16 ? 948 SER A N 1 ATOM 4853 C CA . SER A 1 640 ? -35.676 26.352 12.941 1.00 18.67 ? 948 SER A CA 1 ATOM 4854 C C . SER A 1 640 ? -35.006 25.375 13.908 1.00 16.15 ? 948 SER A C 1 ATOM 4855 O O . SER A 1 640 ? -35.631 24.415 14.374 1.00 15.33 ? 948 SER A O 1 ATOM 4856 C CB . SER A 1 640 ? -35.240 26.049 11.511 1.00 18.95 ? 948 SER A CB 1 ATOM 4857 O OG . SER A 1 640 ? -35.602 24.731 11.146 1.00 20.59 ? 948 SER A OG 1 ATOM 4858 N N . GLN A 1 641 ? -33.735 25.623 14.208 1.00 12.83 ? 949 GLN A N 1 ATOM 4859 C CA . GLN A 1 641 ? -33.002 24.793 15.159 1.00 13.34 ? 949 GLN A CA 1 ATOM 4860 C C . GLN A 1 641 ? -33.657 24.841 16.541 1.00 14.97 ? 949 GLN A C 1 ATOM 4861 O O . GLN A 1 641 ? -33.798 23.819 17.215 1.00 14.94 ? 949 GLN A O 1 ATOM 4862 C CB . GLN A 1 641 ? -31.554 25.263 15.275 1.00 16.40 ? 949 GLN A CB 1 ATOM 4863 C CG . GLN A 1 641 ? -30.748 25.214 13.984 1.00 15.38 ? 949 GLN A CG 1 ATOM 4864 C CD . GLN A 1 641 ? -29.399 25.891 14.151 1.00 15.86 ? 949 GLN A CD 1 ATOM 4865 O OE1 . GLN A 1 641 ? -29.215 26.691 15.066 1.00 13.28 ? 949 GLN A OE1 1 ATOM 4866 N NE2 . GLN A 1 641 ? -28.451 25.583 13.260 1.00 14.26 ? 949 GLN A NE2 1 ATOM 4867 N N . LEU A 1 642 ? -34.056 26.036 16.964 1.00 13.50 ? 950 LEU A N 1 ATOM 4868 C CA . LEU A 1 642 ? -34.666 26.201 18.284 1.00 15.49 ? 950 LEU A CA 1 ATOM 4869 C C . LEU A 1 642 ? -36.054 25.576 18.366 1.00 19.23 ? 950 LEU A C 1 ATOM 4870 O O . LEU A 1 642 ? -36.485 25.114 19.432 1.00 19.37 ? 950 LEU A O 1 ATOM 4871 C CB . LEU A 1 642 ? -34.719 27.686 18.660 1.00 17.30 ? 950 LEU A CB 1 ATOM 4872 C CG . LEU A 1 642 ? -33.345 28.291 18.954 1.00 18.55 ? 950 LEU A CG 1 ATOM 4873 C CD1 . LEU A 1 642 ? -33.414 29.810 19.055 1.00 19.05 ? 950 LEU A CD1 1 ATOM 4874 C CD2 . LEU A 1 642 ? -32.797 27.707 20.237 1.00 21.37 ? 950 LEU A CD2 1 ATOM 4875 N N . THR A 1 643 ? -36.756 25.558 17.241 1.00 17.63 ? 951 THR A N 1 ATOM 4876 C CA . THR A 1 643 ? -38.089 24.969 17.203 1.00 19.99 ? 951 THR A CA 1 ATOM 4877 C C . THR A 1 643 ? -37.992 23.452 17.334 1.00 20.60 ? 951 THR A C 1 ATOM 4878 O O . THR A 1 643 ? -38.781 22.820 18.042 1.00 19.88 ? 951 THR A O 1 ATOM 4879 C CB . THR A 1 643 ? -38.824 25.351 15.913 1.00 20.29 ? 951 THR A CB 1 ATOM 4880 O OG1 . THR A 1 643 ? -38.943 26.779 15.845 1.00 16.58 ? 951 THR A OG1 1 ATOM 4881 C CG2 . THR A 1 643 ? -40.217 24.731 15.879 1.00 24.62 ? 951 THR A CG2 1 ATOM 4882 N N . CYS A 1 644 ? -37.016 22.873 16.648 1.00 18.61 ? 952 CYS A N 1 ATOM 4883 C CA . CYS A 1 644 ? -36.775 21.438 16.730 1.00 17.96 ? 952 CYS A CA 1 ATOM 4884 C C . CYS A 1 644 ? -36.357 21.065 18.142 1.00 19.74 ? 952 CYS A C 1 ATOM 4885 O O . CYS A 1 644 ? -36.836 20.074 18.708 1.00 20.90 ? 952 CYS A O 1 ATOM 4886 C CB . CYS A 1 644 ? -35.696 21.029 15.728 1.00 19.05 ? 952 CYS A CB 1 ATOM 4887 S SG . CYS A 1 644 ? -35.206 19.294 15.856 1.00 18.87 ? 952 CYS A SG 1 ATOM 4888 N N . LEU A 1 645 ? -35.476 21.883 18.712 1.00 16.68 ? 953 LEU A N 1 ATOM 4889 C CA . LEU A 1 645 ? -34.991 21.698 20.072 1.00 18.91 ? 953 LEU A CA 1 ATOM 4890 C C . LEU A 1 645 ? -36.131 21.761 21.082 1.00 24.30 ? 953 LEU A C 1 ATOM 4891 O O . LEU A 1 645 ? -36.118 21.058 22.100 1.00 24.47 ? 953 LEU A O 1 ATOM 4892 C CB . LEU A 1 645 ? -33.954 22.783 20.406 1.00 19.63 ? 953 LEU A CB 1 ATOM 4893 C CG . LEU A 1 645 ? -33.172 22.618 21.711 1.00 20.18 ? 953 LEU A CG 1 ATOM 4894 C CD1 . LEU A 1 645 ? -32.289 21.388 21.613 1.00 19.24 ? 953 LEU A CD1 1 ATOM 4895 C CD2 . LEU A 1 645 ? -32.327 23.856 22.003 1.00 17.35 ? 953 LEU A CD2 1 ATOM 4896 N N . GLY A 1 646 ? -37.111 22.618 20.802 1.00 23.73 ? 954 GLY A N 1 ATOM 4897 C CA . GLY A 1 646 ? -38.277 22.754 21.654 1.00 25.80 ? 954 GLY A CA 1 ATOM 4898 C C . GLY A 1 646 ? -38.229 23.978 22.551 1.00 28.11 ? 954 GLY A C 1 ATOM 4899 O O . GLY A 1 646 ? -38.832 23.984 23.619 1.00 32.53 ? 954 GLY A O 1 ATOM 4900 N N . CYS A 1 647 ? -37.525 25.018 22.113 1.00 24.85 ? 955 CYS A N 1 ATOM 4901 C CA . CYS A 1 647 ? -37.414 26.252 22.884 1.00 24.21 ? 955 CYS A CA 1 ATOM 4902 C C . CYS A 1 647 ? -38.019 27.434 22.141 1.00 23.27 ? 955 CYS A C 1 ATOM 4903 O O . CYS A 1 647 ? -37.303 28.355 21.733 1.00 23.00 ? 955 CYS A O 1 ATOM 4904 C CB . CYS A 1 647 ? -35.947 26.559 23.213 1.00 23.15 ? 955 CYS A CB 1 ATOM 4905 S SG . CYS A 1 647 ? -35.191 25.421 24.373 1.00 32.19 ? 955 CYS A SG 1 ATOM 4906 N N . LEU A 1 648 ? -39.337 27.415 21.981 1.00 20.90 ? 956 LEU A N 1 ATOM 4907 C CA . LEU A 1 648 ? -40.039 28.474 21.261 1.00 23.60 ? 956 LEU A CA 1 ATOM 4908 C C . LEU A 1 648 ? -39.902 29.840 21.929 1.00 24.41 ? 956 LEU A C 1 ATOM 4909 O O . LEU A 1 648 ? -40.004 30.875 21.269 1.00 23.99 ? 956 LEU A O 1 ATOM 4910 C CB . LEU A 1 648 ? -41.521 28.124 21.121 1.00 27.54 ? 956 LEU A CB 1 ATOM 4911 C CG . LEU A 1 648 ? -41.817 26.866 20.303 1.00 31.67 ? 956 LEU A CG 1 ATOM 4912 C CD1 . LEU A 1 648 ? -43.304 26.532 20.339 1.00 34.45 ? 956 LEU A CD1 1 ATOM 4913 C CD2 . LEU A 1 648 ? -41.343 27.062 18.875 1.00 32.28 ? 956 LEU A CD2 1 ATOM 4914 N N . GLU A 1 649 ? -39.675 29.840 23.238 1.00 23.61 ? 957 GLU A N 1 ATOM 4915 C CA . GLU A 1 649 ? -39.605 31.079 24.012 1.00 26.78 ? 957 GLU A CA 1 ATOM 4916 C C . GLU A 1 649 ? -38.354 31.905 23.696 1.00 23.96 ? 957 GLU A C 1 ATOM 4917 O O . GLU A 1 649 ? -38.215 33.038 24.152 1.00 23.55 ? 957 GLU A O 1 ATOM 4918 C CB . GLU A 1 649 ? -39.643 30.766 25.509 1.00 32.29 ? 957 GLU A CB 1 ATOM 4919 C CG . GLU A 1 649 ? -38.420 29.999 26.015 1.00 36.64 ? 957 GLU A CG 1 ATOM 4920 C CD . GLU A 1 649 ? -38.568 28.492 25.890 1.00 43.43 ? 957 GLU A CD 1 ATOM 4921 O OE1 . GLU A 1 649 ? -39.221 28.017 24.933 1.00 43.56 ? 957 GLU A OE1 1 ATOM 4922 O OE2 . GLU A 1 649 ? -38.039 27.779 26.767 1.00 48.26 ? 957 GLU A OE2 1 ATOM 4923 N N . LEU A 1 650 ? -37.448 31.335 22.914 1.00 21.35 ? 958 LEU A N 1 ATOM 4924 C CA . LEU A 1 650 ? -36.197 32.006 22.582 1.00 18.94 ? 958 LEU A CA 1 ATOM 4925 C C . LEU A 1 650 ? -36.245 32.681 21.222 1.00 20.56 ? 958 LEU A C 1 ATOM 4926 O O . LEU A 1 650 ? -35.263 33.282 20.788 1.00 17.30 ? 958 LEU A O 1 ATOM 4927 C CB . LEU A 1 650 ? -35.036 31.014 22.642 1.00 18.05 ? 958 LEU A CB 1 ATOM 4928 C CG . LEU A 1 650 ? -34.607 30.660 24.066 1.00 20.27 ? 958 LEU A CG 1 ATOM 4929 C CD1 . LEU A 1 650 ? -33.602 29.529 24.091 1.00 16.48 ? 958 LEU A CD1 1 ATOM 4930 C CD2 . LEU A 1 650 ? -34.048 31.899 24.726 1.00 18.37 ? 958 LEU A CD2 1 ATOM 4931 N N . ILE A 1 651 ? -37.399 32.589 20.563 1.00 22.91 ? 959 ILE A N 1 ATOM 4932 C CA . ILE A 1 651 ? -37.568 33.114 19.212 1.00 19.17 ? 959 ILE A CA 1 ATOM 4933 C C . ILE A 1 651 ? -38.344 34.425 19.260 1.00 21.63 ? 959 ILE A C 1 ATOM 4934 O O . ILE A 1 651 ? -39.491 34.455 19.708 1.00 25.14 ? 959 ILE A O 1 ATOM 4935 C CB . ILE A 1 651 ? -38.339 32.109 18.332 1.00 20.17 ? 959 ILE A CB 1 ATOM 4936 C CG1 . ILE A 1 651 ? -37.634 30.751 18.341 1.00 17.32 ? 959 ILE A CG1 1 ATOM 4937 C CG2 . ILE A 1 651 ? -38.478 32.633 16.907 1.00 20.16 ? 959 ILE A CG2 1 ATOM 4938 C CD1 . ILE A 1 651 ? -38.386 29.656 17.596 1.00 18.17 ? 959 ILE A CD1 1 ATOM 4939 N N . ALA A 1 652 ? -37.716 35.505 18.799 1.00 18.94 ? 960 ALA A N 1 ATOM 4940 C CA . ALA A 1 652 ? -38.309 36.837 18.876 1.00 18.95 ? 960 ALA A CA 1 ATOM 4941 C C . ALA A 1 652 ? -39.021 37.220 17.581 1.00 19.49 ? 960 ALA A C 1 ATOM 4942 O O . ALA A 1 652 ? -38.530 36.931 16.493 1.00 21.17 ? 960 ALA A O 1 ATOM 4943 C CB . ALA A 1 652 ? -37.234 37.856 19.197 1.00 16.66 ? 960 ALA A CB 1 ATOM 4944 N N . LYS A 1 653 ? -40.165 37.893 17.697 1.00 20.70 ? 961 LYS A N 1 ATOM 4945 C CA . LYS A 1 653 ? -40.924 38.308 16.521 1.00 27.06 ? 961 LYS A CA 1 ATOM 4946 C C . LYS A 1 653 ? -40.485 39.680 16.015 1.00 26.03 ? 961 LYS A C 1 ATOM 4947 O O . LYS A 1 653 ? -40.790 40.059 14.886 1.00 26.34 ? 961 LYS A O 1 ATOM 4948 C CB . LYS A 1 653 ? -42.431 38.318 16.808 1.00 34.10 ? 961 LYS A CB 1 ATOM 4949 C CG . LYS A 1 653 ? -43.038 36.941 17.018 1.00 40.94 ? 961 LYS A CG 1 ATOM 4950 C CD . LYS A 1 653 ? -44.540 37.028 17.245 1.00 50.06 ? 961 LYS A CD 1 ATOM 4951 C CE . LYS A 1 653 ? -45.100 35.704 17.751 1.00 54.33 ? 961 LYS A CE 1 ATOM 4952 N NZ . LYS A 1 653 ? -44.473 35.297 19.043 1.00 55.88 ? 961 LYS A NZ 1 ATOM 4953 N N . ASN A 1 654 ? -39.783 40.422 16.861 1.00 24.88 ? 962 ASN A N 1 ATOM 4954 C CA . ASN A 1 654 ? -39.272 41.744 16.492 1.00 25.21 ? 962 ASN A CA 1 ATOM 4955 C C . ASN A 1 654 ? -38.103 42.146 17.395 1.00 23.60 ? 962 ASN A C 1 ATOM 4956 O O . ASN A 1 654 ? -37.791 41.435 18.346 1.00 22.02 ? 962 ASN A O 1 ATOM 4957 C CB . ASN A 1 654 ? -40.386 42.798 16.497 1.00 27.56 ? 962 ASN A CB 1 ATOM 4958 C CG . ASN A 1 654 ? -41.077 42.934 17.850 1.00 28.63 ? 962 ASN A CG 1 ATOM 4959 O OD1 . ASN A 1 654 ? -40.447 42.842 18.905 1.00 27.58 ? 962 ASN A OD1 1 ATOM 4960 N ND2 . ASN A 1 654 ? -42.385 43.168 17.819 1.00 31.69 ? 962 ASN A ND2 1 ATOM 4961 N N . ARG A 1 655 ? -37.466 43.277 17.103 1.00 20.72 ? 963 ARG A N 1 ATOM 4962 C CA . ARG A 1 655 ? -36.259 43.681 17.826 1.00 22.35 ? 963 ARG A CA 1 ATOM 4963 C C . ARG A 1 655 ? -36.502 43.933 19.309 1.00 23.84 ? 963 ARG A C 1 ATOM 4964 O O . ARG A 1 655 ? -35.677 43.569 20.155 1.00 21.77 ? 963 ARG A O 1 ATOM 4965 C CB . ARG A 1 655 ? -35.636 44.917 17.170 1.00 27.85 ? 963 ARG A CB 1 ATOM 4966 C CG . ARG A 1 655 ? -35.132 44.634 15.757 1.00 31.77 ? 963 ARG A CG 1 ATOM 4967 C CD . ARG A 1 655 ? -34.566 45.876 15.095 1.00 40.54 ? 963 ARG A CD 1 ATOM 4968 N NE . ARG A 1 655 ? -35.483 47.008 15.206 1.00 50.48 ? 963 ARG A NE 1 ATOM 4969 C CZ . ARG A 1 655 ? -36.539 47.199 14.420 1.00 58.04 ? 963 ARG A CZ 1 ATOM 4970 N NH1 . ARG A 1 655 ? -36.821 46.328 13.457 1.00 60.55 ? 963 ARG A NH1 1 ATOM 4971 N NH2 . ARG A 1 655 ? -37.317 48.260 14.600 1.00 60.25 ? 963 ARG A NH2 1 ATOM 4972 N N . GLN A 1 656 ? -37.633 44.558 19.620 1.00 23.61 ? 964 GLN A N 1 ATOM 4973 C CA . GLN A 1 656 ? -37.999 44.793 21.010 1.00 25.32 ? 964 GLN A CA 1 ATOM 4974 C C . GLN A 1 656 ? -38.132 43.477 21.768 1.00 22.35 ? 964 GLN A C 1 ATOM 4975 O O . GLN A 1 656 ? -37.613 43.357 22.864 1.00 19.27 ? 964 GLN A O 1 ATOM 4976 C CB . GLN A 1 656 ? -39.287 45.613 21.122 1.00 29.88 ? 964 GLN A CB 1 ATOM 4977 C CG . GLN A 1 656 ? -39.678 45.930 22.560 1.00 32.33 ? 964 GLN A CG 1 ATOM 4978 C CD . GLN A 1 656 ? -38.587 46.680 23.311 1.00 37.89 ? 964 GLN A CD 1 ATOM 4979 O OE1 . GLN A 1 656 ? -38.100 46.222 24.347 1.00 42.42 ? 964 GLN A OE1 1 ATOM 4980 N NE2 . GLN A 1 656 ? -38.196 47.836 22.787 1.00 36.07 ? 964 GLN A NE2 1 ATOM 4981 N N . GLU A 1 657 ? -38.804 42.487 21.176 1.00 24.15 ? 965 GLU A N 1 ATOM 4982 C CA . GLU A 1 657 ? -38.939 41.186 21.830 1.00 25.60 ? 965 GLU A CA 1 ATOM 4983 C C . GLU A 1 657 ? -37.588 40.483 22.008 1.00 20.21 ? 965 GLU A C 1 ATOM 4984 O O . GLU A 1 657 ? -37.356 39.814 23.022 1.00 16.16 ? 965 GLU A O 1 ATOM 4985 C CB . GLU A 1 657 ? -39.932 40.270 21.098 1.00 31.74 ? 965 GLU A CB 1 ATOM 4986 C CG . GLU A 1 657 ? -40.086 38.908 21.779 1.00 35.92 ? 965 GLU A CG 1 ATOM 4987 C CD . GLU A 1 657 ? -41.280 38.093 21.293 1.00 37.47 ? 965 GLU A CD 1 ATOM 4988 O OE1 . GLU A 1 657 ? -41.426 37.901 20.071 1.00 30.90 ? 965 GLU A OE1 1 ATOM 4989 O OE2 . GLU A 1 657 ? -42.070 37.634 22.149 1.00 41.46 ? 965 GLU A OE2 1 ATOM 4990 N N . TYR A 1 658 ? -36.704 40.629 21.020 1.00 18.69 ? 966 TYR A N 1 ATOM 4991 C CA . TYR A 1 658 ? -35.339 40.101 21.113 1.00 16.93 ? 966 TYR A CA 1 ATOM 4992 C C . TYR A 1 658 ? -34.605 40.698 22.309 1.00 16.71 ? 966 TYR A C 1 ATOM 4993 O O . TYR A 1 658 ? -33.975 39.978 23.082 1.00 16.93 ? 966 TYR A O 1 ATOM 4994 C CB . TYR A 1 658 ? -34.587 40.398 19.808 1.00 18.08 ? 966 TYR A CB 1 ATOM 4995 C CG . TYR A 1 658 ? -33.167 39.877 19.675 1.00 17.54 ? 966 TYR A CG 1 ATOM 4996 C CD1 . TYR A 1 658 ? -32.873 38.821 18.816 1.00 17.04 ? 966 TYR A CD1 1 ATOM 4997 C CD2 . TYR A 1 658 ? -32.113 40.475 20.353 1.00 16.07 ? 966 TYR A CD2 1 ATOM 4998 C CE1 . TYR A 1 658 ? -31.566 38.363 18.654 1.00 18.69 ? 966 TYR A CE1 1 ATOM 4999 C CE2 . TYR A 1 658 ? -30.805 40.019 20.204 1.00 14.86 ? 966 TYR A CE2 1 ATOM 5000 C CZ . TYR A 1 658 ? -30.536 38.971 19.352 1.00 18.60 ? 966 TYR A CZ 1 ATOM 5001 O OH . TYR A 1 658 ? -29.236 38.525 19.200 1.00 17.53 ? 966 TYR A OH 1 ATOM 5002 N N . GLU A 1 659 ? -34.681 42.015 22.461 1.00 16.77 ? 967 GLU A N 1 ATOM 5003 C CA . GLU A 1 659 ? -34.063 42.676 23.608 1.00 18.26 ? 967 GLU A CA 1 ATOM 5004 C C . GLU A 1 659 ? -34.676 42.211 24.941 1.00 19.30 ? 967 GLU A C 1 ATOM 5005 O O . GLU A 1 659 ? -33.957 41.924 25.902 1.00 21.80 ? 967 GLU A O 1 ATOM 5006 C CB . GLU A 1 659 ? -34.174 44.197 23.461 1.00 22.93 ? 967 GLU A CB 1 ATOM 5007 C CG . GLU A 1 659 ? -33.416 44.752 22.249 1.00 27.49 ? 967 GLU A CG 1 ATOM 5008 C CD . GLU A 1 659 ? -33.611 46.252 22.066 1.00 30.16 ? 967 GLU A CD 1 ATOM 5009 O OE1 . GLU A 1 659 ? -34.190 46.889 22.980 1.00 26.34 ? 967 GLU A OE1 1 ATOM 5010 O OE2 . GLU A 1 659 ? -33.187 46.784 21.010 1.00 28.84 ? 967 GLU A OE2 1 ATOM 5011 N N . ASP A 1 660 ? -36.001 42.134 24.990 1.00 19.42 ? 968 ASP A N 1 ATOM 5012 C CA . ASP A 1 660 ? -36.707 41.756 26.217 1.00 18.43 ? 968 ASP A CA 1 ATOM 5013 C C . ASP A 1 660 ? -36.386 40.318 26.635 1.00 19.61 ? 968 ASP A C 1 ATOM 5014 O O . ASP A 1 660 ? -36.199 40.037 27.825 1.00 19.20 ? 968 ASP A O 1 ATOM 5015 C CB . ASP A 1 660 ? -38.217 41.933 26.051 1.00 21.54 ? 968 ASP A CB 1 ATOM 5016 C CG . ASP A 1 660 ? -38.647 43.396 26.069 1.00 27.80 ? 968 ASP A CG 1 ATOM 5017 O OD1 . ASP A 1 660 ? -37.873 44.251 26.554 1.00 29.19 ? 968 ASP A OD1 1 ATOM 5018 O OD2 . ASP A 1 660 ? -39.767 43.687 25.601 1.00 25.06 ? 968 ASP A OD2 1 ATOM 5019 N N . ILE A 1 661 ? -36.319 39.413 25.659 1.00 19.74 ? 969 ILE A N 1 ATOM 5020 C CA . ILE A 1 661 ? -35.940 38.027 25.930 1.00 21.35 ? 969 ILE A CA 1 ATOM 5021 C C . ILE A 1 661 ? -34.519 37.954 26.475 1.00 19.71 ? 969 ILE A C 1 ATOM 5022 O O . ILE A 1 661 ? -34.277 37.367 27.523 1.00 16.56 ? 969 ILE A O 1 ATOM 5023 C CB . ILE A 1 661 ? -36.030 37.138 24.680 1.00 19.59 ? 969 ILE A CB 1 ATOM 5024 C CG1 . ILE A 1 661 ? -37.496 36.940 24.276 1.00 23.64 ? 969 ILE A CG1 1 ATOM 5025 C CG2 . ILE A 1 661 ? -35.372 35.773 24.949 1.00 17.65 ? 969 ILE A CG2 1 ATOM 5026 C CD1 . ILE A 1 661 ? -37.680 36.319 22.904 1.00 22.19 ? 969 ILE A CD1 1 ATOM 5027 N N . ALA A 1 662 ? -33.581 38.571 25.765 1.00 17.73 ? 970 ALA A N 1 ATOM 5028 C CA . ALA A 1 662 ? -32.188 38.563 26.198 1.00 19.73 ? 970 ALA A CA 1 ATOM 5029 C C . ALA A 1 662 ? -31.988 39.197 27.577 1.00 16.50 ? 970 ALA A C 1 ATOM 5030 O O . ALA A 1 662 ? -31.170 38.722 28.367 1.00 18.98 ? 970 ALA A O 1 ATOM 5031 C CB . ALA A 1 662 ? -31.292 39.253 25.157 1.00 16.52 ? 970 ALA A CB 1 ATOM 5032 N N . VAL A 1 663 ? -32.717 40.270 27.856 1.00 14.86 ? 971 VAL A N 1 ATOM 5033 C CA . VAL A 1 663 ? -32.596 40.951 29.152 1.00 15.39 ? 971 VAL A CA 1 ATOM 5034 C C . VAL A 1 663 ? -33.209 40.098 30.267 1.00 17.06 ? 971 VAL A C 1 ATOM 5035 O O . VAL A 1 663 ? -32.668 40.014 31.374 1.00 18.86 ? 971 VAL A O 1 ATOM 5036 C CB . VAL A 1 663 ? -33.243 42.360 29.132 1.00 24.37 ? 971 VAL A CB 1 ATOM 5037 C CG1 . VAL A 1 663 ? -33.396 42.906 30.543 1.00 19.92 ? 971 VAL A CG1 1 ATOM 5038 C CG2 . VAL A 1 663 ? -32.404 43.321 28.295 1.00 22.87 ? 971 VAL A CG2 1 ATOM 5039 N N . LYS A 1 664 ? -34.334 39.457 29.964 1.00 17.27 ? 972 LYS A N 1 ATOM 5040 C CA . LYS A 1 664 ? -34.978 38.553 30.919 1.00 18.20 ? 972 LYS A CA 1 ATOM 5041 C C . LYS A 1 664 ? -34.029 37.417 31.314 1.00 18.99 ? 972 LYS A C 1 ATOM 5042 O O . LYS A 1 664 ? -33.885 37.104 32.493 1.00 19.27 ? 972 LYS A O 1 ATOM 5043 C CB . LYS A 1 664 ? -36.277 37.975 30.342 1.00 17.28 ? 972 LYS A CB 1 ATOM 5044 C CG . LYS A 1 664 ? -37.024 37.035 31.301 1.00 18.60 ? 972 LYS A CG 1 ATOM 5045 C CD . LYS A 1 664 ? -38.377 36.589 30.730 1.00 21.02 ? 972 LYS A CD 1 ATOM 5046 C CE . LYS A 1 664 ? -39.107 35.668 31.712 1.00 26.48 ? 972 LYS A CE 1 ATOM 5047 N NZ . LYS A 1 664 ? -40.409 35.154 31.186 1.00 26.97 ? 972 LYS A NZ 1 ATOM 5048 N N . LEU A 1 665 ? -33.377 36.812 30.325 1.00 17.48 ? 973 LEU A N 1 ATOM 5049 C CA . LEU A 1 665 ? -32.424 35.736 30.601 1.00 15.28 ? 973 LEU A CA 1 ATOM 5050 C C . LEU A 1 665 ? -31.247 36.229 31.440 1.00 17.27 ? 973 LEU A C 1 ATOM 5051 O O . LEU A 1 665 ? -30.736 35.514 32.298 1.00 20.78 ? 973 LEU A O 1 ATOM 5052 C CB . LEU A 1 665 ? -31.916 35.123 29.290 1.00 13.53 ? 973 LEU A CB 1 ATOM 5053 C CG . LEU A 1 665 ? -32.952 34.286 28.540 1.00 20.18 ? 973 LEU A CG 1 ATOM 5054 C CD1 . LEU A 1 665 ? -32.543 34.094 27.080 1.00 16.71 ? 973 LEU A CD1 1 ATOM 5055 C CD2 . LEU A 1 665 ? -33.115 32.928 29.239 1.00 20.70 ? 973 LEU A CD2 1 ATOM 5056 N N . GLY A 1 666 ? -30.821 37.458 31.195 1.00 13.99 ? 974 GLY A N 1 ATOM 5057 C CA . GLY A 1 666 ? -29.713 38.011 31.951 1.00 15.88 ? 974 GLY A CA 1 ATOM 5058 C C . GLY A 1 666 ? -30.039 38.557 33.336 1.00 18.43 ? 974 GLY A C 1 ATOM 5059 O O . GLY A 1 666 ? -29.130 38.916 34.083 1.00 18.64 ? 974 GLY A O 1 ATOM 5060 N N . THR A 1 667 ? -31.317 38.627 33.693 1.00 18.17 ? 975 THR A N 1 ATOM 5061 C CA . THR A 1 667 ? -31.690 39.255 34.961 1.00 18.52 ? 975 THR A CA 1 ATOM 5062 C C . THR A 1 667 ? -32.558 38.365 35.845 1.00 21.38 ? 975 THR A C 1 ATOM 5063 O O . THR A 1 667 ? -32.480 38.449 37.061 1.00 19.85 ? 975 THR A O 1 ATOM 5064 C CB . THR A 1 667 ? -32.427 40.604 34.756 1.00 18.12 ? 975 THR A CB 1 ATOM 5065 O OG1 . THR A 1 667 ? -33.606 40.394 33.977 1.00 17.21 ? 975 THR A OG1 1 ATOM 5066 C CG2 . THR A 1 667 ? -31.530 41.627 34.053 1.00 20.60 ? 975 THR A CG2 1 ATOM 5067 N N . ASP A 1 668 ? -33.400 37.541 35.229 1.00 18.88 ? 976 ASP A N 1 ATOM 5068 C CA . ASP A 1 668 ? -34.258 36.624 35.978 1.00 17.15 ? 976 ASP A CA 1 ATOM 5069 C C . ASP A 1 668 ? -33.469 35.320 36.099 1.00 20.72 ? 976 ASP A C 1 ATOM 5070 O O . ASP A 1 668 ? -33.594 34.434 35.257 1.00 19.03 ? 976 ASP A O 1 ATOM 5071 C CB . ASP A 1 668 ? -35.559 36.407 35.200 1.00 19.12 ? 976 ASP A CB 1 ATOM 5072 C CG . ASP A 1 668 ? -36.580 35.556 35.955 1.00 21.71 ? 976 ASP A CG 1 ATOM 5073 O OD1 . ASP A 1 668 ? -36.209 34.812 36.886 1.00 23.89 ? 976 ASP A OD1 1 ATOM 5074 O OD2 . ASP A 1 668 ? -37.767 35.625 35.590 1.00 20.94 ? 976 ASP A OD2 1 ATOM 5075 N N . LEU A 1 669 ? -32.654 35.208 37.144 1.00 21.44 ? 977 LEU A N 1 ATOM 5076 C CA . LEU A 1 669 ? -31.700 34.099 37.234 1.00 22.36 ? 977 LEU A CA 1 ATOM 5077 C C . LEU A 1 669 ? -32.350 32.710 37.369 1.00 20.43 ? 977 LEU A C 1 ATOM 5078 O O . LEU A 1 669 ? -31.776 31.709 36.943 1.00 19.08 ? 977 LEU A O 1 ATOM 5079 C CB . LEU A 1 669 ? -30.686 34.356 38.352 1.00 24.27 ? 977 LEU A CB 1 ATOM 5080 C CG . LEU A 1 669 ? -29.898 35.663 38.204 1.00 24.76 ? 977 LEU A CG 1 ATOM 5081 C CD1 . LEU A 1 669 ? -28.736 35.716 39.187 1.00 26.57 ? 977 LEU A CD1 1 ATOM 5082 C CD2 . LEU A 1 669 ? -29.399 35.853 36.778 1.00 27.90 ? 977 LEU A CD2 1 ATOM 5083 N N . GLU A 1 670 ? -33.539 32.645 37.958 1.00 16.54 ? 978 GLU A N 1 ATOM 5084 C CA . GLU A 1 670 ? -34.247 31.374 38.030 1.00 22.27 ? 978 GLU A CA 1 ATOM 5085 C C . GLU A 1 670 ? -34.741 30.974 36.644 1.00 20.01 ? 978 GLU A C 1 ATOM 5086 O O . GLU A 1 670 ? -34.723 29.804 36.291 1.00 20.13 ? 978 GLU A O 1 ATOM 5087 C CB . GLU A 1 670 ? -35.409 31.445 39.019 1.00 25.62 ? 978 GLU A CB 1 ATOM 5088 C CG . GLU A 1 670 ? -34.955 31.549 40.461 1.00 28.98 ? 978 GLU A CG 1 ATOM 5089 C CD . GLU A 1 670 ? -34.094 30.377 40.885 1.00 34.16 ? 978 GLU A CD 1 ATOM 5090 O OE1 . GLU A 1 670 ? -34.636 29.265 41.025 1.00 39.36 ? 978 GLU A OE1 1 ATOM 5091 O OE2 . GLU A 1 670 ? -32.873 30.563 41.068 1.00 34.82 ? 978 GLU A OE2 1 ATOM 5092 N N . TYR A 1 671 ? -35.176 31.958 35.863 1.00 17.29 ? 979 TYR A N 1 ATOM 5093 C CA . TYR A 1 671 ? -35.613 31.711 34.500 1.00 17.53 ? 979 TYR A CA 1 ATOM 5094 C C . TYR A 1 671 ? -34.443 31.209 33.672 1.00 14.68 ? 979 TYR A C 1 ATOM 5095 O O . TYR A 1 671 ? -34.572 30.232 32.926 1.00 16.64 ? 979 TYR A O 1 ATOM 5096 C CB . TYR A 1 671 ? -36.206 32.979 33.876 1.00 16.57 ? 979 TYR A CB 1 ATOM 5097 C CG . TYR A 1 671 ? -36.764 32.767 32.478 1.00 22.29 ? 979 TYR A CG 1 ATOM 5098 C CD1 . TYR A 1 671 ? -37.871 31.947 32.270 1.00 26.36 ? 979 TYR A CD1 1 ATOM 5099 C CD2 . TYR A 1 671 ? -36.191 33.383 31.376 1.00 21.30 ? 979 TYR A CD2 1 ATOM 5100 C CE1 . TYR A 1 671 ? -38.391 31.745 31.004 1.00 25.82 ? 979 TYR A CE1 1 ATOM 5101 C CE2 . TYR A 1 671 ? -36.710 33.189 30.096 1.00 24.17 ? 979 TYR A CE2 1 ATOM 5102 C CZ . TYR A 1 671 ? -37.809 32.368 29.919 1.00 25.36 ? 979 TYR A CZ 1 ATOM 5103 O OH . TYR A 1 671 ? -38.337 32.155 28.657 1.00 22.98 ? 979 TYR A OH 1 ATOM 5104 N N . LEU A 1 672 ? -33.295 31.863 33.833 1.00 14.35 ? 980 LEU A N 1 ATOM 5105 C CA . LEU A 1 672 ? -32.067 31.453 33.152 1.00 18.05 ? 980 LEU A CA 1 ATOM 5106 C C . LEU A 1 672 ? -31.742 29.983 33.433 1.00 13.38 ? 980 LEU A C 1 ATOM 5107 O O . LEU A 1 672 ? -31.442 29.214 32.520 1.00 13.34 ? 980 LEU A O 1 ATOM 5108 C CB . LEU A 1 672 ? -30.896 32.358 33.575 1.00 15.19 ? 980 LEU A CB 1 ATOM 5109 C CG . LEU A 1 672 ? -29.538 32.024 32.953 1.00 18.34 ? 980 LEU A CG 1 ATOM 5110 C CD1 . LEU A 1 672 ? -29.611 32.047 31.426 1.00 14.90 ? 980 LEU A CD1 1 ATOM 5111 C CD2 . LEU A 1 672 ? -28.483 32.985 33.443 1.00 20.12 ? 980 LEU A CD2 1 ATOM 5112 N N . LYS A 1 673 ? -31.810 29.589 34.696 1.00 16.85 ? 981 LYS A N 1 ATOM 5113 C CA . LYS A 1 673 ? -31.526 28.205 35.066 1.00 20.81 ? 981 LYS A CA 1 ATOM 5114 C C . LYS A 1 673 ? -32.481 27.217 34.398 1.00 20.47 ? 981 LYS A C 1 ATOM 5115 O O . LYS A 1 673 ? -32.055 26.157 33.911 1.00 18.32 ? 981 LYS A O 1 ATOM 5116 C CB . LYS A 1 673 ? -31.570 28.039 36.583 1.00 26.50 ? 981 LYS A CB 1 ATOM 5117 C CG . LYS A 1 673 ? -31.289 26.626 37.047 1.00 33.74 ? 981 LYS A CG 1 ATOM 5118 C CD . LYS A 1 673 ? -31.148 26.577 38.567 1.00 42.19 ? 981 LYS A CD 1 ATOM 5119 C CE . LYS A 1 673 ? -30.053 27.526 39.041 1.00 46.57 ? 981 LYS A CE 1 ATOM 5120 N NZ . LYS A 1 673 ? -29.899 27.495 40.519 1.00 53.56 ? 981 LYS A NZ 1 ATOM 5121 N N . LYS A 1 674 ? -33.767 27.564 34.380 1.00 19.00 ? 982 LYS A N 1 ATOM 5122 C CA . LYS A 1 674 ? -34.780 26.747 33.715 1.00 18.36 ? 982 LYS A CA 1 ATOM 5123 C C . LYS A 1 674 ? -34.477 26.540 32.233 1.00 20.37 ? 982 LYS A C 1 ATOM 5124 O O . LYS A 1 674 ? -34.461 25.403 31.741 1.00 18.95 ? 982 LYS A O 1 ATOM 5125 C CB . LYS A 1 674 ? -36.162 27.383 33.857 1.00 20.39 ? 982 LYS A CB 1 ATOM 5126 C CG . LYS A 1 674 ? -37.262 26.623 33.126 1.00 27.90 ? 982 LYS A CG 1 ATOM 5127 C CD . LYS A 1 674 ? -38.592 27.371 33.176 1.00 35.94 ? 982 LYS A CD 1 ATOM 5128 C CE . LYS A 1 674 ? -39.664 26.634 32.387 1.00 42.77 ? 982 LYS A CE 1 ATOM 5129 N NZ . LYS A 1 674 ? -40.875 27.473 32.158 1.00 47.62 ? 982 LYS A NZ 1 ATOM 5130 N N . VAL A 1 675 ? -34.252 27.638 31.516 1.00 19.57 ? 983 VAL A N 1 ATOM 5131 C CA . VAL A 1 675 ? -33.952 27.554 30.085 1.00 19.39 ? 983 VAL A CA 1 ATOM 5132 C C . VAL A 1 675 ? -32.627 26.834 29.782 1.00 20.80 ? 983 VAL A C 1 ATOM 5133 O O . VAL A 1 675 ? -32.549 26.016 28.852 1.00 18.33 ? 983 VAL A O 1 ATOM 5134 C CB . VAL A 1 675 ? -34.000 28.945 29.414 1.00 20.13 ? 983 VAL A CB 1 ATOM 5135 C CG1 . VAL A 1 675 ? -33.561 28.860 27.956 1.00 17.98 ? 983 VAL A CG1 1 ATOM 5136 C CG2 . VAL A 1 675 ? -35.401 29.522 29.506 1.00 23.37 ? 983 VAL A CG2 1 ATOM 5137 N N . ARG A 1 676 ? -31.586 27.121 30.561 1.00 17.70 ? 984 ARG A N 1 ATOM 5138 C CA . ARG A 1 676 ? -30.319 26.412 30.375 1.00 17.03 ? 984 ARG A CA 1 ATOM 5139 C C . ARG A 1 676 ? -30.491 24.918 30.629 1.00 19.08 ? 984 ARG A C 1 ATOM 5140 O O . ARG A 1 676 ? -29.908 24.093 29.926 1.00 19.44 ? 984 ARG A O 1 ATOM 5141 C CB . ARG A 1 676 ? -29.215 26.989 31.260 1.00 19.34 ? 984 ARG A CB 1 ATOM 5142 C CG . ARG A 1 676 ? -28.770 28.382 30.825 1.00 17.76 ? 984 ARG A CG 1 ATOM 5143 C CD . ARG A 1 676 ? -27.622 28.910 31.669 1.00 17.47 ? 984 ARG A CD 1 ATOM 5144 N NE . ARG A 1 676 ? -26.487 27.986 31.697 1.00 17.05 ? 984 ARG A NE 1 ATOM 5145 C CZ . ARG A 1 676 ? -25.569 27.897 30.745 1.00 14.76 ? 984 ARG A CZ 1 ATOM 5146 N NH1 . ARG A 1 676 ? -25.656 28.662 29.666 1.00 16.39 ? 984 ARG A NH1 1 ATOM 5147 N NH2 . ARG A 1 676 ? -24.569 27.033 30.866 1.00 16.38 ? 984 ARG A NH2 1 ATOM 5148 N N . GLY A 1 677 ? -31.306 24.573 31.621 1.00 19.88 ? 985 GLY A N 1 ATOM 5149 C CA . GLY A 1 677 ? -31.568 23.178 31.932 1.00 21.94 ? 985 GLY A CA 1 ATOM 5150 C C . GLY A 1 677 ? -32.344 22.545 30.789 1.00 21.53 ? 985 GLY A C 1 ATOM 5151 O O . GLY A 1 677 ? -32.145 21.382 30.448 1.00 19.67 ? 985 GLY A O 1 ATOM 5152 N N . LYS A 1 678 ? -33.232 23.335 30.196 1.00 18.11 ? 986 LYS A N 1 ATOM 5153 C CA . LYS A 1 678 ? -34.033 22.898 29.068 1.00 22.85 ? 986 LYS A CA 1 ATOM 5154 C C . LYS A 1 678 ? -33.167 22.611 27.843 1.00 20.45 ? 986 LYS A C 1 ATOM 5155 O O . LYS A 1 678 ? -33.306 21.565 27.210 1.00 18.21 ? 986 LYS A O 1 ATOM 5156 C CB . LYS A 1 678 ? -35.106 23.947 28.753 1.00 27.60 ? 986 LYS A CB 1 ATOM 5157 C CG . LYS A 1 678 ? -36.171 23.485 27.796 1.00 31.24 ? 986 LYS A CG 1 ATOM 5158 C CD . LYS A 1 678 ? -37.313 24.496 27.700 1.00 36.97 ? 986 LYS A CD 1 ATOM 5159 C CE . LYS A 1 678 ? -38.361 24.046 26.694 1.00 40.59 ? 986 LYS A CE 1 ATOM 5160 N NZ . LYS A 1 678 ? -39.334 25.129 26.355 1.00 44.08 ? 986 LYS A NZ 1 ATOM 5161 N N . VAL A 1 679 ? -32.264 23.532 27.518 1.00 16.90 ? 987 VAL A N 1 ATOM 5162 C CA . VAL A 1 679 ? -31.353 23.327 26.398 1.00 16.65 ? 987 VAL A CA 1 ATOM 5163 C C . VAL A 1 679 ? -30.460 22.118 26.644 1.00 17.30 ? 987 VAL A C 1 ATOM 5164 O O . VAL A 1 679 ? -30.286 21.279 25.756 1.00 17.36 ? 987 VAL A O 1 ATOM 5165 C CB . VAL A 1 679 ? -30.504 24.592 26.125 1.00 16.74 ? 987 VAL A CB 1 ATOM 5166 C CG1 . VAL A 1 679 ? -29.459 24.329 25.044 1.00 18.52 ? 987 VAL A CG1 1 ATOM 5167 C CG2 . VAL A 1 679 ? -31.416 25.743 25.724 1.00 17.93 ? 987 VAL A CG2 1 ATOM 5168 N N . TRP A 1 680 ? -29.919 22.024 27.858 1.00 18.40 ? 988 TRP A N 1 ATOM 5169 C CA . TRP A 1 680 ? -29.008 20.941 28.236 1.00 18.16 ? 988 TRP A CA 1 ATOM 5170 C C . TRP A 1 680 ? -29.646 19.557 28.045 1.00 18.66 ? 988 TRP A C 1 ATOM 5171 O O . TRP A 1 680 ? -29.025 18.635 27.506 1.00 19.86 ? 988 TRP A O 1 ATOM 5172 C CB . TRP A 1 680 ? -28.571 21.124 29.694 1.00 19.26 ? 988 TRP A CB 1 ATOM 5173 C CG . TRP A 1 680 ? -27.550 20.121 30.167 1.00 20.33 ? 988 TRP A CG 1 ATOM 5174 C CD1 . TRP A 1 680 ? -27.761 19.053 31.000 1.00 23.65 ? 988 TRP A CD1 1 ATOM 5175 C CD2 . TRP A 1 680 ? -26.154 20.108 29.843 1.00 18.63 ? 988 TRP A CD2 1 ATOM 5176 N NE1 . TRP A 1 680 ? -26.578 18.376 31.205 1.00 25.65 ? 988 TRP A NE1 1 ATOM 5177 C CE2 . TRP A 1 680 ? -25.578 19.005 30.507 1.00 24.33 ? 988 TRP A CE2 1 ATOM 5178 C CE3 . TRP A 1 680 ? -25.334 20.927 29.060 1.00 23.39 ? 988 TRP A CE3 1 ATOM 5179 C CZ2 . TRP A 1 680 ? -24.219 18.698 30.405 1.00 25.35 ? 988 TRP A CZ2 1 ATOM 5180 C CZ3 . TRP A 1 680 ? -23.981 20.616 28.955 1.00 23.29 ? 988 TRP A CZ3 1 ATOM 5181 C CH2 . TRP A 1 680 ? -23.438 19.513 29.625 1.00 21.53 ? 988 TRP A CH2 1 ATOM 5182 N N . LYS A 1 681 ? -30.890 19.419 28.480 1.00 18.34 ? 989 LYS A N 1 ATOM 5183 C CA . LYS A 1 681 ? -31.598 18.154 28.335 1.00 20.02 ? 989 LYS A CA 1 ATOM 5184 C C . LYS A 1 681 ? -32.033 17.898 26.900 1.00 18.76 ? 989 LYS A C 1 ATOM 5185 O O . LYS A 1 681 ? -31.833 16.805 26.365 1.00 20.18 ? 989 LYS A O 1 ATOM 5186 C CB . LYS A 1 681 ? -32.834 18.122 29.245 1.00 24.74 ? 989 LYS A CB 1 ATOM 5187 C CG . LYS A 1 681 ? -33.682 16.871 29.050 1.00 32.52 ? 989 LYS A CG 1 ATOM 5188 C CD . LYS A 1 681 ? -35.008 16.949 29.793 1.00 41.21 ? 989 LYS A CD 1 ATOM 5189 C CE . LYS A 1 681 ? -35.849 15.702 29.532 1.00 45.23 ? 989 LYS A CE 1 ATOM 5190 N NZ . LYS A 1 681 ? -36.020 15.457 28.071 1.00 44.48 ? 989 LYS A NZ 1 ATOM 5191 N N . GLN A 1 682 ? -32.619 18.912 26.269 1.00 16.47 ? 990 GLN A N 1 ATOM 5192 C CA A GLN A 1 682 ? -33.244 18.765 24.950 0.49 17.66 ? 990 GLN A CA 1 ATOM 5193 C CA B GLN A 1 682 ? -33.245 18.698 24.971 0.51 17.39 ? 990 GLN A CA 1 ATOM 5194 C C . GLN A 1 682 ? -32.263 18.539 23.806 1.00 18.78 ? 990 GLN A C 1 ATOM 5195 O O . GLN A 1 682 ? -32.627 18.022 22.755 1.00 20.67 ? 990 GLN A O 1 ATOM 5196 C CB A GLN A 1 682 ? -34.114 19.985 24.626 0.49 18.72 ? 990 GLN A CB 1 ATOM 5197 C CB B GLN A 1 682 ? -34.315 19.767 24.708 0.51 19.02 ? 990 GLN A CB 1 ATOM 5198 C CG A GLN A 1 682 ? -35.390 20.078 25.439 0.49 20.69 ? 990 GLN A CG 1 ATOM 5199 C CG B GLN A 1 682 ? -35.508 19.604 25.648 0.51 21.33 ? 990 GLN A CG 1 ATOM 5200 C CD A GLN A 1 682 ? -36.362 18.966 25.121 0.49 23.15 ? 990 GLN A CD 1 ATOM 5201 C CD B GLN A 1 682 ? -36.473 20.773 25.631 0.51 23.95 ? 990 GLN A CD 1 ATOM 5202 O OE1 A GLN A 1 682 ? -36.615 18.095 25.950 0.49 25.80 ? 990 GLN A OE1 1 ATOM 5203 O OE1 B GLN A 1 682 ? -37.310 20.906 26.527 0.51 26.89 ? 990 GLN A OE1 1 ATOM 5204 N NE2 A GLN A 1 682 ? -36.923 18.993 23.916 0.49 23.63 ? 990 GLN A NE2 1 ATOM 5205 N NE2 B GLN A 1 682 ? -36.368 21.621 24.617 0.51 24.08 ? 990 GLN A NE2 1 ATOM 5206 N N . ARG A 1 683 ? -31.012 18.935 23.987 1.00 14.96 ? 991 ARG A N 1 ATOM 5207 C CA . ARG A 1 683 ? -30.066 18.698 22.898 1.00 21.85 ? 991 ARG A CA 1 ATOM 5208 C C . ARG A 1 683 ? -29.886 17.183 22.724 1.00 20.49 ? 991 ARG A C 1 ATOM 5209 O O . ARG A 1 683 ? -29.496 16.709 21.652 1.00 21.86 ? 991 ARG A O 1 ATOM 5210 C CB . ARG A 1 683 ? -28.741 19.427 23.139 1.00 26.88 ? 991 ARG A CB 1 ATOM 5211 C CG . ARG A 1 683 ? -27.848 18.718 24.103 1.00 25.04 ? 991 ARG A CG 1 ATOM 5212 C CD . ARG A 1 683 ? -27.006 19.653 24.961 1.00 20.11 ? 991 ARG A CD 1 ATOM 5213 N NE . ARG A 1 683 ? -26.706 18.912 26.176 1.00 20.24 ? 991 ARG A NE 1 ATOM 5214 C CZ . ARG A 1 683 ? -25.521 18.402 26.486 1.00 22.42 ? 991 ARG A CZ 1 ATOM 5215 N NH1 . ARG A 1 683 ? -24.465 18.607 25.708 1.00 22.61 ? 991 ARG A NH1 1 ATOM 5216 N NH2 . ARG A 1 683 ? -25.391 17.708 27.602 1.00 22.73 ? 991 ARG A NH2 1 ATOM 5217 N N . ILE A 1 684 ? -30.227 16.429 23.773 1.00 17.21 ? 992 ILE A N 1 ATOM 5218 C CA . ILE A 1 684 ? -30.188 14.967 23.748 1.00 19.57 ? 992 ILE A CA 1 ATOM 5219 C C . ILE A 1 684 ? -31.546 14.361 23.396 1.00 20.15 ? 992 ILE A C 1 ATOM 5220 O O . ILE A 1 684 ? -31.635 13.466 22.556 1.00 24.25 ? 992 ILE A O 1 ATOM 5221 C CB . ILE A 1 684 ? -29.734 14.383 25.104 1.00 21.70 ? 992 ILE A CB 1 ATOM 5222 C CG1 . ILE A 1 684 ? -28.358 14.924 25.482 1.00 23.99 ? 992 ILE A CG1 1 ATOM 5223 C CG2 . ILE A 1 684 ? -29.698 12.848 25.049 1.00 24.70 ? 992 ILE A CG2 1 ATOM 5224 C CD1 . ILE A 1 684 ? -27.300 14.629 24.440 1.00 24.57 ? 992 ILE A CD1 1 ATOM 5225 N N . SER A 1 685 ? -32.607 14.850 24.030 1.00 19.39 ? 993 SER A N 1 ATOM 5226 C CA . SER A 1 685 ? -33.915 14.217 23.883 1.00 23.16 ? 993 SER A CA 1 ATOM 5227 C C . SER A 1 685 ? -34.701 14.649 22.638 1.00 20.88 ? 993 SER A C 1 ATOM 5228 O O . SER A 1 685 ? -35.603 13.935 22.200 1.00 19.77 ? 993 SER A O 1 ATOM 5229 C CB . SER A 1 685 ? -34.759 14.410 25.153 1.00 26.07 ? 993 SER A CB 1 ATOM 5230 O OG . SER A 1 685 ? -35.002 15.781 25.399 1.00 26.19 ? 993 SER A OG 1 ATOM 5231 N N . SER A 1 686 ? -34.361 15.806 22.074 1.00 16.46 ? 994 SER A N 1 ATOM 5232 C CA . SER A 1 686 ? -35.004 16.291 20.851 1.00 15.85 ? 994 SER A CA 1 ATOM 5233 C C . SER A 1 686 ? -34.381 15.625 19.616 1.00 19.29 ? 994 SER A C 1 ATOM 5234 O O . SER A 1 686 ? -33.374 14.914 19.732 1.00 17.48 ? 994 SER A O 1 ATOM 5235 C CB . SER A 1 686 ? -34.868 17.820 20.758 1.00 14.90 ? 994 SER A CB 1 ATOM 5236 O OG . SER A 1 686 ? -33.600 18.182 20.226 1.00 17.39 ? 994 SER A OG 1 ATOM 5237 N N . PRO A 1 687 ? -34.966 15.848 18.426 1.00 18.16 ? 995 PRO A N 1 ATOM 5238 C CA . PRO A 1 687 ? -34.322 15.293 17.230 1.00 18.50 ? 995 PRO A CA 1 ATOM 5239 C C . PRO A 1 687 ? -33.106 16.080 16.739 1.00 17.32 ? 995 PRO A C 1 ATOM 5240 O O . PRO A 1 687 ? -32.473 15.616 15.796 1.00 16.66 ? 995 PRO A O 1 ATOM 5241 C CB . PRO A 1 687 ? -35.425 15.383 16.158 1.00 19.06 ? 995 PRO A CB 1 ATOM 5242 C CG . PRO A 1 687 ? -36.711 15.580 16.917 1.00 20.60 ? 995 PRO A CG 1 ATOM 5243 C CD . PRO A 1 687 ? -36.319 16.358 18.133 1.00 21.53 ? 995 PRO A CD 1 ATOM 5244 N N . LEU A 1 688 ? -32.788 17.227 17.340 1.00 16.09 ? 996 LEU A N 1 ATOM 5245 C CA . LEU A 1 688 ? -31.804 18.154 16.743 1.00 14.72 ? 996 LEU A CA 1 ATOM 5246 C C . LEU A 1 688 ? -30.457 17.526 16.374 1.00 15.68 ? 996 LEU A C 1 ATOM 5247 O O . LEU A 1 688 ? -29.928 17.776 15.291 1.00 16.80 ? 996 LEU A O 1 ATOM 5248 C CB . LEU A 1 688 ? -31.571 19.389 17.630 1.00 14.60 ? 996 LEU A CB 1 ATOM 5249 C CG . LEU A 1 688 ? -30.774 20.507 16.950 1.00 14.54 ? 996 LEU A CG 1 ATOM 5250 C CD1 . LEU A 1 688 ? -31.426 20.870 15.604 1.00 15.50 ? 996 LEU A CD1 1 ATOM 5251 C CD2 . LEU A 1 688 ? -30.664 21.753 17.815 1.00 11.47 ? 996 LEU A CD2 1 ATOM 5252 N N . PHE A 1 689 ? -29.909 16.720 17.279 1.00 14.12 ? 997 PHE A N 1 ATOM 5253 C CA . PHE A 1 689 ? -28.591 16.135 17.072 1.00 15.02 ? 997 PHE A CA 1 ATOM 5254 C C . PHE A 1 689 ? -28.670 14.635 16.807 1.00 13.50 ? 997 PHE A C 1 ATOM 5255 O O . PHE A 1 689 ? -27.672 13.936 16.927 1.00 17.90 ? 997 PHE A O 1 ATOM 5256 C CB . PHE A 1 689 ? -27.701 16.401 18.288 1.00 14.83 ? 997 PHE A CB 1 ATOM 5257 C CG . PHE A 1 689 ? -27.333 17.850 18.469 1.00 13.01 ? 997 PHE A CG 1 ATOM 5258 C CD1 . PHE A 1 689 ? -26.239 18.397 17.798 1.00 14.44 ? 997 PHE A CD1 1 ATOM 5259 C CD2 . PHE A 1 689 ? -28.087 18.669 19.296 1.00 12.22 ? 997 PHE A CD2 1 ATOM 5260 C CE1 . PHE A 1 689 ? -25.902 19.752 17.976 1.00 13.44 ? 997 PHE A CE1 1 ATOM 5261 C CE2 . PHE A 1 689 ? -27.753 20.016 19.478 1.00 13.52 ? 997 PHE A CE2 1 ATOM 5262 C CZ . PHE A 1 689 ? -26.668 20.552 18.813 1.00 13.40 ? 997 PHE A CZ 1 ATOM 5263 N N . ASN A 1 690 ? -29.860 14.145 16.460 1.00 14.73 ? 998 ASN A N 1 ATOM 5264 C CA . ASN A 1 690 ? -30.084 12.705 16.287 1.00 16.99 ? 998 ASN A CA 1 ATOM 5265 C C . ASN A 1 690 ? -29.897 12.335 14.819 1.00 14.44 ? 998 ASN A C 1 ATOM 5266 O O . ASN A 1 690 ? -30.825 12.407 14.018 1.00 15.23 ? 998 ASN A O 1 ATOM 5267 C CB . ASN A 1 690 ? -31.491 12.315 16.780 1.00 17.00 ? 998 ASN A CB 1 ATOM 5268 C CG . ASN A 1 690 ? -31.676 10.804 16.946 1.00 21.32 ? 998 ASN A CG 1 ATOM 5269 O OD1 . ASN A 1 690 ? -31.213 10.010 16.134 1.00 19.85 ? 998 ASN A OD1 1 ATOM 5270 N ND2 . ASN A 1 690 ? -32.380 10.411 18.000 1.00 25.20 ? 998 ASN A ND2 1 ATOM 5271 N N . THR A 1 691 ? -28.674 11.967 14.473 1.00 15.70 ? 999 THR A N 1 ATOM 5272 C CA . THR A 1 691 ? -28.304 11.736 13.083 1.00 18.27 ? 999 THR A CA 1 ATOM 5273 C C . THR A 1 691 ? -28.988 10.508 12.478 1.00 16.24 ? 999 THR A C 1 ATOM 5274 O O . THR A 1 691 ? -29.281 10.486 11.276 1.00 18.39 ? 999 THR A O 1 ATOM 5275 C CB . THR A 1 691 ? -26.774 11.637 12.946 1.00 19.36 ? 999 THR A CB 1 ATOM 5276 O OG1 . THR A 1 691 ? -26.262 10.794 13.982 1.00 22.16 ? 999 THR A OG1 1 ATOM 5277 C CG2 . THR A 1 691 ? -26.145 13.017 13.092 1.00 18.37 ? 999 THR A CG2 1 ATOM 5278 N N . LYS A 1 692 ? -29.253 9.492 13.299 1.00 13.71 ? 1000 LYS A N 1 ATOM 5279 C CA . LYS A 1 692 ? -29.972 8.318 12.808 1.00 15.92 ? 1000 LYS A CA 1 ATOM 5280 C C . LYS A 1 692 ? -31.405 8.701 12.466 1.00 15.78 ? 1000 LYS A C 1 ATOM 5281 O O . LYS A 1 692 ? -31.910 8.352 11.408 1.00 14.14 ? 1000 LYS A O 1 ATOM 5282 C CB . LYS A 1 692 ? -29.976 7.187 13.838 1.00 18.68 ? 1000 LYS A CB 1 ATOM 5283 C CG . LYS A 1 692 ? -30.626 5.893 13.324 1.00 19.81 ? 1000 LYS A CG 1 ATOM 5284 C CD . LYS A 1 692 ? -29.904 5.393 12.067 1.00 19.26 ? 1000 LYS A CD 1 ATOM 5285 C CE . LYS A 1 692 ? -30.477 4.076 11.557 1.00 24.63 ? 1000 LYS A CE 1 ATOM 5286 N NZ . LYS A 1 692 ? -29.709 3.579 10.368 1.00 25.55 ? 1000 LYS A NZ 1 ATOM 5287 N N . GLN A 1 693 ? -32.060 9.437 13.359 1.00 13.66 ? 1001 GLN A N 1 ATOM 5288 C CA . GLN A 1 693 ? -33.428 9.867 13.080 1.00 19.03 ? 1001 GLN A CA 1 ATOM 5289 C C . GLN A 1 693 ? -33.472 10.733 11.824 1.00 17.43 ? 1001 GLN A C 1 ATOM 5290 O O . GLN A 1 693 ? -34.354 10.581 10.970 1.00 19.64 ? 1001 GLN A O 1 ATOM 5291 C CB . GLN A 1 693 ? -34.015 10.629 14.269 1.00 19.81 ? 1001 GLN A CB 1 ATOM 5292 C CG . GLN A 1 693 ? -35.461 11.058 14.066 1.00 26.52 ? 1001 GLN A CG 1 ATOM 5293 C CD . GLN A 1 693 ? -36.070 11.681 15.311 1.00 32.68 ? 1001 GLN A CD 1 ATOM 5294 O OE1 . GLN A 1 693 ? -35.411 11.812 16.343 1.00 35.67 ? 1001 GLN A OE1 1 ATOM 5295 N NE2 . GLN A 1 693 ? -37.337 12.066 15.219 1.00 36.06 ? 1001 GLN A NE2 1 ATOM 5296 N N . TYR A 1 694 ? -32.508 11.636 11.718 1.00 16.84 ? 1002 TYR A N 1 ATOM 5297 C CA . TYR A 1 694 ? -32.444 12.563 10.589 1.00 16.48 ? 1002 TYR A CA 1 ATOM 5298 C C . TYR A 1 694 ? -32.324 11.810 9.267 1.00 17.13 ? 1002 TYR A C 1 ATOM 5299 O O . TYR A 1 694 ? -33.055 12.080 8.310 1.00 17.71 ? 1002 TYR A O 1 ATOM 5300 C CB . TYR A 1 694 ? -31.262 13.531 10.749 1.00 14.28 ? 1002 TYR A CB 1 ATOM 5301 C CG . TYR A 1 694 ? -31.240 14.602 9.671 1.00 15.27 ? 1002 TYR A CG 1 ATOM 5302 C CD1 . TYR A 1 694 ? -31.856 15.834 9.872 1.00 15.53 ? 1002 TYR A CD1 1 ATOM 5303 C CD2 . TYR A 1 694 ? -30.625 14.371 8.447 1.00 17.47 ? 1002 TYR A CD2 1 ATOM 5304 C CE1 . TYR A 1 694 ? -31.849 16.812 8.873 1.00 16.39 ? 1002 TYR A CE1 1 ATOM 5305 C CE2 . TYR A 1 694 ? -30.617 15.333 7.446 1.00 18.62 ? 1002 TYR A CE2 1 ATOM 5306 C CZ . TYR A 1 694 ? -31.231 16.551 7.662 1.00 19.16 ? 1002 TYR A CZ 1 ATOM 5307 O OH . TYR A 1 694 ? -31.215 17.501 6.657 1.00 18.71 ? 1002 TYR A OH 1 ATOM 5308 N N . THR A 1 695 ? -31.394 10.864 9.220 1.00 16.22 ? 1003 THR A N 1 ATOM 5309 C CA . THR A 1 695 ? -31.173 10.073 8.016 1.00 17.57 ? 1003 THR A CA 1 ATOM 5310 C C . THR A 1 695 ? -32.444 9.333 7.626 1.00 17.01 ? 1003 THR A C 1 ATOM 5311 O O . THR A 1 695 ? -32.816 9.291 6.448 1.00 16.57 ? 1003 THR A O 1 ATOM 5312 C CB . THR A 1 695 ? -30.017 9.077 8.219 1.00 17.64 ? 1003 THR A CB 1 ATOM 5313 O OG1 . THR A 1 695 ? -28.836 9.807 8.573 1.00 17.93 ? 1003 THR A OG1 1 ATOM 5314 C CG2 . THR A 1 695 ? -29.753 8.286 6.949 1.00 17.61 ? 1003 THR A CG2 1 ATOM 5315 N N . MET A 1 696 ? -33.135 8.781 8.617 1.00 14.48 ? 1004 MET A N 1 ATOM 5316 C CA . MET A 1 696 ? -34.367 8.048 8.340 1.00 18.76 ? 1004 MET A CA 1 ATOM 5317 C C . MET A 1 696 ? -35.461 8.958 7.790 1.00 21.14 ? 1004 MET A C 1 ATOM 5318 O O . MET A 1 696 ? -36.228 8.566 6.910 1.00 19.78 ? 1004 MET A O 1 ATOM 5319 C CB . MET A 1 696 ? -34.843 7.288 9.583 1.00 21.56 ? 1004 MET A CB 1 ATOM 5320 C CG . MET A 1 696 ? -33.922 6.125 9.962 1.00 21.40 ? 1004 MET A CG 1 ATOM 5321 S SD . MET A 1 696 ? -34.409 5.261 11.474 1.00 23.25 ? 1004 MET A SD 1 ATOM 5322 C CE . MET A 1 696 ? -36.051 4.718 11.029 1.00 23.79 ? 1004 MET A CE 1 ATOM 5323 N N . GLU A 1 697 ? -35.532 10.179 8.301 1.00 19.45 ? 1005 GLU A N 1 ATOM 5324 C CA . GLU A 1 697 ? -36.492 11.140 7.768 1.00 22.27 ? 1005 GLU A CA 1 ATOM 5325 C C . GLU A 1 697 ? -36.090 11.619 6.374 1.00 23.22 ? 1005 GLU A C 1 ATOM 5326 O O . GLU A 1 697 ? -36.944 11.854 5.510 1.00 23.14 ? 1005 GLU A O 1 ATOM 5327 C CB . GLU A 1 697 ? -36.677 12.312 8.737 1.00 24.66 ? 1005 GLU A CB 1 ATOM 5328 C CG . GLU A 1 697 ? -37.382 11.922 10.032 1.00 30.50 ? 1005 GLU A CG 1 ATOM 5329 C CD . GLU A 1 697 ? -38.805 11.435 9.803 1.00 39.13 ? 1005 GLU A CD 1 ATOM 5330 O OE1 . GLU A 1 697 ? -39.348 11.648 8.698 1.00 40.15 ? 1005 GLU A OE1 1 ATOM 5331 O OE2 . GLU A 1 697 ? -39.387 10.841 10.734 1.00 46.69 ? 1005 GLU A OE2 1 ATOM 5332 N N . LEU A 1 698 ? -34.786 11.746 6.157 1.00 21.48 ? 1006 LEU A N 1 ATOM 5333 C CA . LEU A 1 698 ? -34.242 12.063 4.838 1.00 22.13 ? 1006 LEU A CA 1 ATOM 5334 C C . LEU A 1 698 ? -34.618 10.974 3.828 1.00 21.27 ? 1006 LEU A C 1 ATOM 5335 O O . LEU A 1 698 ? -35.024 11.259 2.694 1.00 19.89 ? 1006 LEU A O 1 ATOM 5336 C CB . LEU A 1 698 ? -32.720 12.195 4.943 1.00 22.21 ? 1006 LEU A CB 1 ATOM 5337 C CG . LEU A 1 698 ? -31.906 12.862 3.834 1.00 23.96 ? 1006 LEU A CG 1 ATOM 5338 C CD1 . LEU A 1 698 ? -32.456 14.236 3.493 1.00 24.52 ? 1006 LEU A CD1 1 ATOM 5339 C CD2 . LEU A 1 698 ? -30.471 12.978 4.309 1.00 22.79 ? 1006 LEU A CD2 1 ATOM 5340 N N . GLU A 1 699 ? -34.487 9.719 4.250 1.00 19.23 ? 1007 GLU A N 1 ATOM 5341 C CA . GLU A 1 699 ? -34.845 8.581 3.408 1.00 21.25 ? 1007 GLU A CA 1 ATOM 5342 C C . GLU A 1 699 ? -36.333 8.578 3.043 1.00 23.14 ? 1007 GLU A C 1 ATOM 5343 O O . GLU A 1 699 ? -36.704 8.291 1.901 1.00 20.95 ? 1007 GLU A O 1 ATOM 5344 C CB . GLU A 1 699 ? -34.436 7.276 4.105 1.00 20.24 ? 1007 GLU A CB 1 ATOM 5345 C CG . GLU A 1 699 ? -32.924 7.127 4.182 1.00 20.48 ? 1007 GLU A CG 1 ATOM 5346 C CD . GLU A 1 699 ? -32.468 5.892 4.930 1.00 23.18 ? 1007 GLU A CD 1 ATOM 5347 O OE1 . GLU A 1 699 ? -33.117 5.515 5.927 1.00 23.81 ? 1007 GLU A OE1 1 ATOM 5348 O OE2 . GLU A 1 699 ? -31.454 5.299 4.507 1.00 21.36 ? 1007 GLU A OE2 1 ATOM 5349 N N . ARG A 1 700 ? -37.180 8.910 4.012 1.00 23.89 ? 1008 ARG A N 1 ATOM 5350 C CA . ARG A 1 700 ? -38.618 9.003 3.770 1.00 28.30 ? 1008 ARG A CA 1 ATOM 5351 C C . ARG A 1 700 ? -38.922 10.050 2.698 1.00 24.43 ? 1008 ARG A C 1 ATOM 5352 O O . ARG A 1 700 ? -39.777 9.849 1.834 1.00 23.12 ? 1008 ARG A O 1 ATOM 5353 C CB . ARG A 1 700 ? -39.357 9.351 5.068 1.00 32.01 ? 1008 ARG A CB 1 ATOM 5354 C CG . ARG A 1 700 ? -40.877 9.254 4.962 1.00 40.83 ? 1008 ARG A CG 1 ATOM 5355 C CD . ARG A 1 700 ? -41.567 9.870 6.172 1.00 47.08 ? 1008 ARG A CD 1 ATOM 5356 N NE . ARG A 1 700 ? -41.004 9.386 7.430 1.00 52.01 ? 1008 ARG A NE 1 ATOM 5357 C CZ . ARG A 1 700 ? -41.480 8.352 8.116 1.00 57.59 ? 1008 ARG A CZ 1 ATOM 5358 N NH1 . ARG A 1 700 ? -42.539 7.687 7.669 1.00 60.83 ? 1008 ARG A NH1 1 ATOM 5359 N NH2 . ARG A 1 700 ? -40.899 7.984 9.252 1.00 57.23 ? 1008 ARG A NH2 1 ATOM 5360 N N . LEU A 1 701 ? -38.205 11.165 2.757 1.00 22.89 ? 1009 LEU A N 1 ATOM 5361 C CA . LEU A 1 701 ? -38.391 12.258 1.806 1.00 23.34 ? 1009 LEU A CA 1 ATOM 5362 C C . LEU A 1 701 ? -37.915 11.873 0.405 1.00 24.88 ? 1009 LEU A C 1 ATOM 5363 O O . LEU A 1 701 ? -38.590 12.164 -0.586 1.00 26.53 ? 1009 LEU A O 1 ATOM 5364 C CB . LEU A 1 701 ? -37.658 13.508 2.308 1.00 24.56 ? 1009 LEU A CB 1 ATOM 5365 C CG . LEU A 1 701 ? -37.778 14.794 1.493 1.00 26.34 ? 1009 LEU A CG 1 ATOM 5366 C CD1 . LEU A 1 701 ? -39.235 15.145 1.244 1.00 25.95 ? 1009 LEU A CD1 1 ATOM 5367 C CD2 . LEU A 1 701 ? -37.067 15.917 2.229 1.00 26.05 ? 1009 LEU A CD2 1 ATOM 5368 N N . TYR A 1 702 ? -36.754 11.223 0.322 1.00 20.83 ? 1010 TYR A N 1 ATOM 5369 C CA . TYR A 1 702 ? -36.249 10.710 -0.952 1.00 22.34 ? 1010 TYR A CA 1 ATOM 5370 C C . TYR A 1 702 ? -37.283 9.825 -1.645 1.00 26.50 ? 1010 TYR A C 1 ATOM 5371 O O . TYR A 1 702 ? -37.531 9.960 -2.843 1.00 27.85 ? 1010 TYR A O 1 ATOM 5372 C CB . TYR A 1 702 ? -34.955 9.908 -0.752 1.00 22.36 ? 1010 TYR A CB 1 ATOM 5373 C CG . TYR A 1 702 ? -33.730 10.737 -0.415 1.00 20.88 ? 1010 TYR A CG 1 ATOM 5374 C CD1 . TYR A 1 702 ? -33.668 12.092 -0.716 1.00 21.99 ? 1010 TYR A CD1 1 ATOM 5375 C CD2 . TYR A 1 702 ? -32.629 10.154 0.199 1.00 19.52 ? 1010 TYR A CD2 1 ATOM 5376 C CE1 . TYR A 1 702 ? -32.537 12.845 -0.404 1.00 22.12 ? 1010 TYR A CE1 1 ATOM 5377 C CE2 . TYR A 1 702 ? -31.506 10.891 0.511 1.00 18.18 ? 1010 TYR A CE2 1 ATOM 5378 C CZ . TYR A 1 702 ? -31.461 12.229 0.213 1.00 19.03 ? 1010 TYR A CZ 1 ATOM 5379 O OH . TYR A 1 702 ? -30.328 12.951 0.534 1.00 20.44 ? 1010 TYR A OH 1 ATOM 5380 N N . LEU A 1 703 ? -37.888 8.920 -0.882 1.00 27.31 ? 1011 LEU A N 1 ATOM 5381 C CA . LEU A 1 703 ? -38.882 8.003 -1.435 1.00 30.02 ? 1011 LEU A CA 1 ATOM 5382 C C . LEU A 1 703 ? -40.141 8.724 -1.905 1.00 30.96 ? 1011 LEU A C 1 ATOM 5383 O O . LEU A 1 703 ? -40.767 8.310 -2.880 1.00 31.24 ? 1011 LEU A O 1 ATOM 5384 C CB . LEU A 1 703 ? -39.240 6.917 -0.418 1.00 31.92 ? 1011 LEU A CB 1 ATOM 5385 C CG . LEU A 1 703 ? -38.104 5.951 -0.080 1.00 34.02 ? 1011 LEU A CG 1 ATOM 5386 C CD1 . LEU A 1 703 ? -38.472 5.098 1.121 1.00 35.26 ? 1011 LEU A CD1 1 ATOM 5387 C CD2 . LEU A 1 703 ? -37.774 5.074 -1.283 1.00 37.95 ? 1011 LEU A CD2 1 ATOM 5388 N N . GLN A 1 704 ? -40.518 9.794 -1.211 1.00 30.36 ? 1012 GLN A N 1 ATOM 5389 C CA . GLN A 1 704 ? -41.639 10.614 -1.656 1.00 35.79 ? 1012 GLN A CA 1 ATOM 5390 C C . GLN A 1 704 ? -41.310 11.245 -3.007 1.00 32.34 ? 1012 GLN A C 1 ATOM 5391 O O . GLN A 1 704 ? -42.142 11.259 -3.917 1.00 31.72 ? 1012 GLN A O 1 ATOM 5392 C CB . GLN A 1 704 ? -41.979 11.698 -0.629 1.00 41.76 ? 1012 GLN A CB 1 ATOM 5393 C CG . GLN A 1 704 ? -42.660 11.180 0.630 1.00 48.92 ? 1012 GLN A CG 1 ATOM 5394 C CD . GLN A 1 704 ? -42.889 12.270 1.665 1.00 54.89 ? 1012 GLN A CD 1 ATOM 5395 O OE1 . GLN A 1 704 ? -43.015 13.449 1.328 1.00 57.46 ? 1012 GLN A OE1 1 ATOM 5396 N NE2 . GLN A 1 704 ? -42.938 11.879 2.934 1.00 56.03 ? 1012 GLN A NE2 1 ATOM 5397 N N . MET A 1 705 ? -40.088 11.753 -3.131 1.00 29.17 ? 1013 MET A N 1 ATOM 5398 C CA . MET A 1 705 ? -39.629 12.355 -4.379 1.00 30.88 ? 1013 MET A CA 1 ATOM 5399 C C . MET A 1 705 ? -39.650 11.333 -5.504 1.00 32.14 ? 1013 MET A C 1 ATOM 5400 O O . MET A 1 705 ? -40.159 11.606 -6.596 1.00 32.78 ? 1013 MET A O 1 ATOM 5401 C CB . MET A 1 705 ? -38.202 12.885 -4.234 1.00 30.28 ? 1013 MET A CB 1 ATOM 5402 C CG . MET A 1 705 ? -38.033 14.054 -3.291 1.00 30.38 ? 1013 MET A CG 1 ATOM 5403 S SD . MET A 1 705 ? -36.289 14.509 -3.167 1.00 27.70 ? 1013 MET A SD 1 ATOM 5404 C CE . MET A 1 705 ? -36.398 15.988 -2.161 1.00 28.19 ? 1013 MET A CE 1 ATOM 5405 N N . TRP A 1 706 ? -39.094 10.155 -5.233 1.00 30.53 ? 1014 TRP A N 1 ATOM 5406 C CA . TRP A 1 706 ? -38.986 9.130 -6.260 1.00 30.84 ? 1014 TRP A CA 1 ATOM 5407 C C . TRP A 1 706 ? -40.341 8.618 -6.732 1.00 32.60 ? 1014 TRP A C 1 ATOM 5408 O O . TRP A 1 706 ? -40.579 8.511 -7.933 1.00 33.69 ? 1014 TRP A O 1 ATOM 5409 C CB . TRP A 1 706 ? -38.123 7.948 -5.817 1.00 29.15 ? 1014 TRP A CB 1 ATOM 5410 C CG . TRP A 1 706 ? -38.125 6.894 -6.877 1.00 33.58 ? 1014 TRP A CG 1 ATOM 5411 C CD1 . TRP A 1 706 ? -38.789 5.700 -6.853 1.00 36.06 ? 1014 TRP A CD1 1 ATOM 5412 C CD2 . TRP A 1 706 ? -37.483 6.971 -8.154 1.00 34.24 ? 1014 TRP A CD2 1 ATOM 5413 N NE1 . TRP A 1 706 ? -38.579 5.019 -8.030 1.00 37.47 ? 1014 TRP A NE1 1 ATOM 5414 C CE2 . TRP A 1 706 ? -37.780 5.778 -8.844 1.00 36.53 ? 1014 TRP A CE2 1 ATOM 5415 C CE3 . TRP A 1 706 ? -36.676 7.929 -8.778 1.00 34.34 ? 1014 TRP A CE3 1 ATOM 5416 C CZ2 . TRP A 1 706 ? -37.295 5.517 -10.123 1.00 38.41 ? 1014 TRP A CZ2 1 ATOM 5417 C CZ3 . TRP A 1 706 ? -36.195 7.667 -10.047 1.00 36.86 ? 1014 TRP A CZ3 1 ATOM 5418 C CH2 . TRP A 1 706 ? -36.507 6.470 -10.707 1.00 38.31 ? 1014 TRP A CH2 1 ATOM 5419 N N . GLU A 1 707 ? -41.220 8.297 -5.787 1.00 34.81 ? 1015 GLU A N 1 ATOM 5420 C CA . GLU A 1 707 ? -42.551 7.800 -6.124 1.00 39.99 ? 1015 GLU A CA 1 ATOM 5421 C C . GLU A 1 707 ? -43.312 8.820 -6.963 1.00 37.68 ? 1015 GLU A C 1 ATOM 5422 O O . GLU A 1 707 ? -43.998 8.463 -7.919 1.00 37.54 ? 1015 GLU A O 1 ATOM 5423 C CB . GLU A 1 707 ? -43.339 7.447 -4.861 1.00 45.27 ? 1015 GLU A CB 1 ATOM 5424 C CG . GLU A 1 707 ? -42.819 6.212 -4.141 1.00 51.02 ? 1015 GLU A CG 1 ATOM 5425 C CD . GLU A 1 707 ? -43.425 6.038 -2.763 1.00 58.07 ? 1015 GLU A CD 1 ATOM 5426 O OE1 . GLU A 1 707 ? -44.384 6.770 -2.437 1.00 61.95 ? 1015 GLU A OE1 1 ATOM 5427 O OE2 . GLU A 1 707 ? -42.938 5.173 -2.005 1.00 60.02 ? 1015 GLU A OE2 1 ATOM 5428 N N . HIS A 1 708 ? -43.168 10.092 -6.605 1.00 34.22 ? 1016 HIS A N 1 ATOM 5429 C CA . HIS A 1 708 ? -43.787 11.187 -7.351 1.00 35.57 ? 1016 HIS A CA 1 ATOM 5430 C C . HIS A 1 708 ? -43.312 11.200 -8.805 1.00 36.64 ? 1016 HIS A C 1 ATOM 5431 O O . HIS A 1 708 ? -44.116 11.313 -9.732 1.00 40.96 ? 1016 HIS A O 1 ATOM 5432 C CB . HIS A 1 708 ? -43.452 12.522 -6.678 1.00 33.26 ? 1016 HIS A CB 1 ATOM 5433 C CG . HIS A 1 708 ? -44.239 13.682 -7.202 1.00 34.84 ? 1016 HIS A CG 1 ATOM 5434 N ND1 . HIS A 1 708 ? -45.608 13.775 -7.067 1.00 37.04 ? 1016 HIS A ND1 1 ATOM 5435 C CD2 . HIS A 1 708 ? -43.848 14.803 -7.853 1.00 37.07 ? 1016 HIS A CD2 1 ATOM 5436 C CE1 . HIS A 1 708 ? -46.026 14.903 -7.615 1.00 39.46 ? 1016 HIS A CE1 1 ATOM 5437 N NE2 . HIS A 1 708 ? -44.978 15.544 -8.100 1.00 37.18 ? 1016 HIS A NE2 1 ATOM 5438 N N . TYR A 1 709 ? -42.001 11.081 -8.993 1.00 34.58 ? 1017 TYR A N 1 ATOM 5439 C CA . TYR A 1 709 ? -41.406 11.032 -10.323 1.00 36.15 ? 1017 TYR A CA 1 ATOM 5440 C C . TYR A 1 709 ? -41.771 9.748 -11.063 1.00 37.04 ? 1017 TYR A C 1 ATOM 5441 O O . TYR A 1 709 ? -42.117 9.783 -12.243 1.00 36.59 ? 1017 TYR A O 1 ATOM 5442 C CB . TYR A 1 709 ? -39.883 11.153 -10.232 1.00 35.90 ? 1017 TYR A CB 1 ATOM 5443 C CG . TYR A 1 709 ? -39.165 10.852 -11.531 1.00 39.31 ? 1017 TYR A CG 1 ATOM 5444 C CD1 . TYR A 1 709 ? -39.053 11.816 -12.528 1.00 39.95 ? 1017 TYR A CD1 1 ATOM 5445 C CD2 . TYR A 1 709 ? -38.595 9.605 -11.760 1.00 39.28 ? 1017 TYR A CD2 1 ATOM 5446 C CE1 . TYR A 1 709 ? -38.398 11.544 -13.715 1.00 41.43 ? 1017 TYR A CE1 1 ATOM 5447 C CE2 . TYR A 1 709 ? -37.941 9.325 -12.944 1.00 40.76 ? 1017 TYR A CE2 1 ATOM 5448 C CZ . TYR A 1 709 ? -37.843 10.297 -13.915 1.00 42.55 ? 1017 TYR A CZ 1 ATOM 5449 O OH . TYR A 1 709 ? -37.185 10.018 -15.089 1.00 45.72 ? 1017 TYR A OH 1 ATOM 5450 N N . ALA A 1 710 ? -41.675 8.619 -10.365 1.00 34.17 ? 1018 ALA A N 1 ATOM 5451 C CA . ALA A 1 710 ? -41.927 7.313 -10.967 1.00 37.98 ? 1018 ALA A CA 1 ATOM 5452 C C . ALA A 1 710 ? -43.346 7.213 -11.518 1.00 41.04 ? 1018 ALA A C 1 ATOM 5453 O O . ALA A 1 710 ? -43.589 6.531 -12.514 1.00 40.51 ? 1018 ALA A O 1 ATOM 5454 C CB . ALA A 1 710 ? -41.668 6.202 -9.957 1.00 38.54 ? 1018 ALA A CB 1 ATOM 5455 N N . ALA A 1 711 ? -44.274 7.907 -10.865 1.00 41.60 ? 1019 ALA A N 1 ATOM 5456 C CA . ALA A 1 711 ? -45.669 7.928 -11.288 1.00 44.46 ? 1019 ALA A CA 1 ATOM 5457 C C . ALA A 1 711 ? -45.881 8.891 -12.456 1.00 42.21 ? 1019 ALA A C 1 ATOM 5458 O O . ALA A 1 711 ? -46.997 9.046 -12.948 1.00 44.31 ? 1019 ALA A O 1 ATOM 5459 C CB . ALA A 1 711 ? -46.570 8.296 -10.120 1.00 43.57 ? 1019 ALA A CB 1 ATOM 5460 N N . GLY A 1 712 ? -44.803 9.540 -12.888 1.00 41.03 ? 1020 GLY A N 1 ATOM 5461 C CA . GLY A 1 712 ? -44.839 10.387 -14.066 1.00 42.38 ? 1020 GLY A CA 1 ATOM 5462 C C . GLY A 1 712 ? -45.182 11.841 -13.802 1.00 41.69 ? 1020 GLY A C 1 ATOM 5463 O O . GLY A 1 712 ? -45.744 12.513 -14.665 1.00 43.95 ? 1020 GLY A O 1 ATOM 5464 N N . ASN A 1 713 ? -44.847 12.335 -12.615 1.00 39.71 ? 1021 ASN A N 1 ATOM 5465 C CA . ASN A 1 713 ? -45.122 13.730 -12.279 1.00 39.97 ? 1021 ASN A CA 1 ATOM 5466 C C . ASN A 1 713 ? -43.863 14.580 -12.250 1.00 37.74 ? 1021 ASN A C 1 ATOM 5467 O O . ASN A 1 713 ? -42.794 14.111 -11.861 1.00 35.80 ? 1021 ASN A O 1 ATOM 5468 C CB . ASN A 1 713 ? -45.828 13.847 -10.927 1.00 41.60 ? 1021 ASN A CB 1 ATOM 5469 C CG . ASN A 1 713 ? -47.105 13.041 -10.860 1.00 44.50 ? 1021 ASN A CG 1 ATOM 5470 O OD1 . ASN A 1 713 ? -48.128 13.429 -11.424 1.00 42.52 ? 1021 ASN A OD1 1 ATOM 5471 N ND2 . ASN A 1 713 ? -47.057 11.917 -10.152 1.00 44.75 ? 1021 ASN A ND2 1 ATOM 5472 N N . LYS A 1 714 ? -44.000 15.834 -12.666 1.00 38.86 ? 1022 LYS A N 1 ATOM 5473 C CA . LYS A 1 714 ? -42.941 16.817 -12.504 1.00 40.50 ? 1022 LYS A CA 1 ATOM 5474 C C . LYS A 1 714 ? -42.898 17.211 -11.030 1.00 38.70 ? 1022 LYS A C 1 ATOM 5475 O O . LYS A 1 714 ? -43.885 17.024 -10.317 1.00 35.27 ? 1022 LYS A O 1 ATOM 5476 C CB . LYS A 1 714 ? -43.209 18.030 -13.395 1.00 42.86 ? 1022 LYS A CB 1 ATOM 5477 C CG . LYS A 1 714 ? -43.079 17.731 -14.880 1.00 47.08 ? 1022 LYS A CG 1 ATOM 5478 C CD . LYS A 1 714 ? -43.293 18.976 -15.721 1.00 51.69 ? 1022 LYS A CD 1 ATOM 5479 C CE . LYS A 1 714 ? -43.175 18.664 -17.205 1.00 56.10 ? 1022 LYS A CE 1 ATOM 5480 N NZ . LYS A 1 714 ? -43.441 19.865 -18.043 1.00 60.35 ? 1022 LYS A NZ 1 ATOM 5481 N N . PRO A 1 715 ? -41.754 17.738 -10.560 1.00 36.42 ? 1023 PRO A N 1 ATOM 5482 C CA . PRO A 1 715 ? -41.626 18.074 -9.137 1.00 34.07 ? 1023 PRO A CA 1 ATOM 5483 C C . PRO A 1 715 ? -42.739 18.981 -8.621 1.00 32.37 ? 1023 PRO A C 1 ATOM 5484 O O . PRO A 1 715 ? -43.190 19.884 -9.323 1.00 33.87 ? 1023 PRO A O 1 ATOM 5485 C CB . PRO A 1 715 ? -40.280 18.801 -9.074 1.00 31.80 ? 1023 PRO A CB 1 ATOM 5486 C CG . PRO A 1 715 ? -39.492 18.189 -10.173 1.00 33.12 ? 1023 PRO A CG 1 ATOM 5487 C CD . PRO A 1 715 ? -40.484 17.936 -11.283 1.00 36.06 ? 1023 PRO A CD 1 ATOM 5488 N N . ASP A 1 716 ? -43.184 18.716 -7.399 1.00 32.83 ? 1024 ASP A N 1 ATOM 5489 C CA . ASP A 1 716 ? -44.163 19.562 -6.732 1.00 35.01 ? 1024 ASP A CA 1 ATOM 5490 C C . ASP A 1 716 ? -43.765 19.650 -5.268 1.00 31.90 ? 1024 ASP A C 1 ATOM 5491 O O . ASP A 1 716 ? -43.008 18.808 -4.785 1.00 29.06 ? 1024 ASP A O 1 ATOM 5492 C CB . ASP A 1 716 ? -45.563 18.965 -6.857 1.00 41.14 ? 1024 ASP A CB 1 ATOM 5493 C CG . ASP A 1 716 ? -46.658 19.997 -6.663 1.00 46.36 ? 1024 ASP A CG 1 ATOM 5494 O OD1 . ASP A 1 716 ? -46.343 21.146 -6.284 1.00 47.07 ? 1024 ASP A OD1 1 ATOM 5495 O OD2 . ASP A 1 716 ? -47.837 19.655 -6.889 1.00 49.63 ? 1024 ASP A OD2 1 ATOM 5496 N N . HIS A 1 717 ? -44.270 20.660 -4.565 1.00 31.21 ? 1025 HIS A N 1 ATOM 5497 C CA . HIS A 1 717 ? -43.929 20.851 -3.158 1.00 30.16 ? 1025 HIS A CA 1 ATOM 5498 C C . HIS A 1 717 ? -44.247 19.606 -2.329 1.00 31.24 ? 1025 HIS A C 1 ATOM 5499 O O . HIS A 1 717 ? -45.330 19.029 -2.446 1.00 33.82 ? 1025 HIS A O 1 ATOM 5500 C CB . HIS A 1 717 ? -44.655 22.070 -2.579 1.00 31.54 ? 1025 HIS A CB 1 ATOM 5501 C CG . HIS A 1 717 ? -44.361 23.351 -3.297 1.00 32.29 ? 1025 HIS A CG 1 ATOM 5502 N ND1 . HIS A 1 717 ? -43.109 23.928 -3.313 1.00 32.53 ? 1025 HIS A ND1 1 ATOM 5503 C CD2 . HIS A 1 717 ? -45.164 24.177 -4.011 1.00 35.34 ? 1025 HIS A CD2 1 ATOM 5504 C CE1 . HIS A 1 717 ? -43.151 25.049 -4.011 1.00 33.49 ? 1025 HIS A CE1 1 ATOM 5505 N NE2 . HIS A 1 717 ? -44.386 25.223 -4.445 1.00 35.36 ? 1025 HIS A NE2 1 ATOM 5506 N N . MET A 1 718 ? -43.280 19.190 -1.517 1.00 30.05 ? 1026 MET A N 1 ATOM 5507 C CA . MET A 1 718 ? -43.442 18.061 -0.608 1.00 31.34 ? 1026 MET A CA 1 ATOM 5508 C C . MET A 1 718 ? -43.484 18.591 0.815 1.00 33.73 ? 1026 MET A C 1 ATOM 5509 O O . MET A 1 718 ? -42.488 18.529 1.540 1.00 31.62 ? 1026 MET A O 1 ATOM 5510 C CB . MET A 1 718 ? -42.269 17.090 -0.753 1.00 28.40 ? 1026 MET A CB 1 ATOM 5511 C CG . MET A 1 718 ? -42.121 16.487 -2.139 1.00 30.34 ? 1026 MET A CG 1 ATOM 5512 S SD . MET A 1 718 ? -43.450 15.338 -2.544 1.00 49.85 ? 1026 MET A SD 1 ATOM 5513 C CE . MET A 1 718 ? -43.267 15.238 -4.321 1.00 46.42 ? 1026 MET A CE 1 ATOM 5514 N N . ILE A 1 719 ? -44.641 19.111 1.213 1.00 37.02 ? 1027 ILE A N 1 ATOM 5515 C CA . ILE A 1 719 ? -44.747 19.870 2.450 1.00 39.77 ? 1027 ILE A CA 1 ATOM 5516 C C . ILE A 1 719 ? -45.674 19.233 3.485 1.00 44.57 ? 1027 ILE A C 1 ATOM 5517 O O . ILE A 1 719 ? -46.212 19.919 4.356 1.00 44.17 ? 1027 ILE A O 1 ATOM 5518 C CB . ILE A 1 719 ? -45.186 21.320 2.170 1.00 40.69 ? 1027 ILE A CB 1 ATOM 5519 C CG1 . ILE A 1 719 ? -46.501 21.342 1.388 1.00 42.52 ? 1027 ILE A CG1 1 ATOM 5520 C CG2 . ILE A 1 719 ? -44.105 22.056 1.388 1.00 39.27 ? 1027 ILE A CG2 1 ATOM 5521 C CD1 . ILE A 1 719 ? -47.055 22.734 1.177 1.00 44.27 ? 1027 ILE A CD1 1 ATOM 5522 N N . LYS A 1 720 ? -45.842 17.918 3.386 1.00 47.99 ? 1028 LYS A N 1 ATOM 5523 C CA . LYS A 1 720 ? -46.609 17.155 4.366 1.00 53.22 ? 1028 LYS A CA 1 ATOM 5524 C C . LYS A 1 720 ? -45.934 15.816 4.650 1.00 55.09 ? 1028 LYS A C 1 ATOM 5525 O O . LYS A 1 720 ? -45.869 15.373 5.796 1.00 56.98 ? 1028 LYS A O 1 ATOM 5526 C CB . LYS A 1 720 ? -48.039 16.923 3.873 1.00 57.95 ? 1028 LYS A CB 1 ATOM 5527 C CG . LYS A 1 720 ? -48.943 18.137 3.989 1.00 61.99 ? 1028 LYS A CG 1 ATOM 5528 C CD . LYS A 1 720 ? -50.272 17.892 3.297 1.00 66.76 ? 1028 LYS A CD 1 ATOM 5529 C CE . LYS A 1 720 ? -50.952 16.643 3.829 1.00 69.20 ? 1028 LYS A CE 1 ATOM 5530 N NZ . LYS A 1 720 ? -52.190 16.333 3.059 1.00 72.38 ? 1028 LYS A NZ 1 ATOM 5531 N N . TYR B 2 1 ? -7.902 29.094 12.930 1.00 19.96 ? 13 TYR B N 1 ATOM 5532 C CA . TYR B 2 1 ? -7.374 29.610 14.189 1.00 21.24 ? 13 TYR B CA 1 ATOM 5533 C C . TYR B 2 1 ? -5.890 29.917 14.017 1.00 21.29 ? 13 TYR B C 1 ATOM 5534 O O . TYR B 2 1 ? -5.239 29.342 13.149 1.00 21.30 ? 13 TYR B O 1 ATOM 5535 C CB . TYR B 2 1 ? -7.592 28.596 15.324 1.00 17.98 ? 13 TYR B CB 1 ATOM 5536 C CG . TYR B 2 1 ? -6.932 27.247 15.115 1.00 17.71 ? 13 TYR B CG 1 ATOM 5537 C CD1 . TYR B 2 1 ? -5.663 26.985 15.622 1.00 18.75 ? 13 TYR B CD1 1 ATOM 5538 C CD2 . TYR B 2 1 ? -7.587 26.227 14.435 1.00 17.07 ? 13 TYR B CD2 1 ATOM 5539 C CE1 . TYR B 2 1 ? -5.053 25.749 15.442 1.00 23.07 ? 13 TYR B CE1 1 ATOM 5540 C CE2 . TYR B 2 1 ? -6.981 24.979 14.252 1.00 20.87 ? 13 TYR B CE2 1 ATOM 5541 C CZ . TYR B 2 1 ? -5.714 24.752 14.760 1.00 23.45 ? 13 TYR B CZ 1 ATOM 5542 O OH . TYR B 2 1 ? -5.101 23.525 14.587 1.00 23.49 ? 13 TYR B OH 1 ATOM 5543 N N . PRO B 2 2 ? -5.352 30.834 14.833 1.00 19.80 ? 14 PRO B N 1 ATOM 5544 C CA . PRO B 2 2 ? -3.935 31.196 14.700 1.00 24.32 ? 14 PRO B CA 1 ATOM 5545 C C . PRO B 2 2 ? -3.021 29.984 14.877 1.00 26.84 ? 14 PRO B C 1 ATOM 5546 O O . PRO B 2 2 ? -3.117 29.289 15.881 1.00 30.58 ? 14 PRO B O 1 ATOM 5547 C CB . PRO B 2 2 ? -3.726 32.201 15.836 1.00 24.96 ? 14 PRO B CB 1 ATOM 5548 C CG . PRO B 2 2 ? -5.087 32.799 16.050 1.00 24.77 ? 14 PRO B CG 1 ATOM 5549 C CD . PRO B 2 2 ? -6.042 31.658 15.842 1.00 22.32 ? 14 PRO B CD 1 ATOM 5550 N N . GLY B 2 3 ? -2.157 29.737 13.900 1.00 25.70 ? 15 GLY B N 1 ATOM 5551 C CA . GLY B 2 3 ? -1.283 28.576 13.928 1.00 27.52 ? 15 GLY B CA 1 ATOM 5552 C C . GLY B 2 3 ? -1.901 27.375 13.230 1.00 27.86 ? 15 GLY B C 1 ATOM 5553 O O . GLY B 2 3 ? -1.263 26.333 13.070 1.00 31.48 ? 15 GLY B O 1 ATOM 5554 N N . GLY B 2 4 ? -3.150 27.525 12.804 1.00 21.56 ? 16 GLY B N 1 ATOM 5555 C CA . GLY B 2 4 ? -3.861 26.438 12.161 1.00 20.89 ? 16 GLY B CA 1 ATOM 5556 C C . GLY B 2 4 ? -4.777 26.961 11.081 1.00 25.90 ? 16 GLY B C 1 ATOM 5557 O O . GLY B 2 4 ? -4.451 27.925 10.384 1.00 28.71 ? 16 GLY B O 1 ATOM 5558 N N . SER B 2 5 ? -5.927 26.321 10.931 1.00 22.27 ? 17 SER B N 1 ATOM 5559 C CA . SER B 2 5 ? -6.892 26.774 9.946 1.00 26.32 ? 17 SER B CA 1 ATOM 5560 C C . SER B 2 5 ? -8.307 26.499 10.424 1.00 23.98 ? 17 SER B C 1 ATOM 5561 O O . SER B 2 5 ? -8.577 25.503 11.101 1.00 24.92 ? 17 SER B O 1 ATOM 5562 C CB . SER B 2 5 ? -6.643 26.118 8.585 1.00 34.08 ? 17 SER B CB 1 ATOM 5563 O OG . SER B 2 5 ? -7.023 24.756 8.592 1.00 39.09 ? 17 SER B OG 1 ATOM 5564 N N . THR B 2 6 ? -9.207 27.412 10.092 1.00 18.38 ? 18 THR B N 1 ATOM 5565 C CA . THR B 2 6 ? -10.605 27.241 10.411 1.00 16.88 ? 18 THR B CA 1 ATOM 5566 C C . THR B 2 6 ? -11.375 27.456 9.115 1.00 21.09 ? 18 THR B C 1 ATOM 5567 O O . THR B 2 6 ? -11.560 28.596 8.673 1.00 18.24 ? 18 THR B O 1 ATOM 5568 C CB . THR B 2 6 ? -11.064 28.224 11.518 1.00 19.37 ? 18 THR B CB 1 ATOM 5569 O OG1 . THR B 2 6 ? -10.391 27.910 12.749 1.00 18.21 ? 18 THR B OG1 1 ATOM 5570 C CG2 . THR B 2 6 ? -12.559 28.117 11.737 1.00 15.96 ? 18 THR B CG2 1 ATOM 5571 N N . PRO B 2 7 ? -11.769 26.350 8.467 1.00 20.70 ? 19 PRO B N 1 ATOM 5572 C CA . PRO B 2 7 ? -12.548 26.415 7.226 1.00 19.36 ? 19 PRO B CA 1 ATOM 5573 C C . PRO B 2 7 ? -13.939 26.974 7.497 1.00 15.83 ? 19 PRO B C 1 ATOM 5574 O O . PRO B 2 7 ? -14.513 26.714 8.560 1.00 16.75 ? 19 PRO B O 1 ATOM 5575 C CB . PRO B 2 7 ? -12.641 24.952 6.790 1.00 21.28 ? 19 PRO B CB 1 ATOM 5576 C CG . PRO B 2 7 ? -12.392 24.160 8.043 1.00 23.92 ? 19 PRO B CG 1 ATOM 5577 C CD . PRO B 2 7 ? -11.429 24.966 8.843 1.00 18.87 ? 19 PRO B CD 1 ATOM 5578 N N . VAL B 2 8 ? -14.469 27.743 6.549 1.00 13.24 ? 20 VAL B N 1 ATOM 5579 C CA . VAL B 2 8 ? -15.783 28.343 6.712 1.00 12.59 ? 20 VAL B CA 1 ATOM 5580 C C . VAL B 2 8 ? -16.553 28.223 5.408 1.00 12.97 ? 20 VAL B C 1 ATOM 5581 O O . VAL B 2 8 ? -15.984 27.869 4.372 1.00 13.40 ? 20 VAL B O 1 ATOM 5582 C CB . VAL B 2 8 ? -15.663 29.832 7.094 1.00 17.67 ? 20 VAL B CB 1 ATOM 5583 C CG1 . VAL B 2 8 ? -14.999 29.973 8.455 1.00 18.66 ? 20 VAL B CG1 1 ATOM 5584 C CG2 . VAL B 2 8 ? -14.859 30.578 6.032 1.00 19.53 ? 20 VAL B CG2 1 ATOM 5585 N N . SER B 2 9 ? -17.848 28.513 5.454 1.00 13.51 ? 21 SER B N 1 ATOM 5586 C CA . SER B 2 9 ? -18.644 28.560 4.228 1.00 15.95 ? 21 SER B CA 1 ATOM 5587 C C . SER B 2 9 ? -18.224 29.795 3.430 1.00 18.70 ? 21 SER B C 1 ATOM 5588 O O . SER B 2 9 ? -18.221 30.898 3.964 1.00 19.06 ? 21 SER B O 1 ATOM 5589 C CB . SER B 2 9 ? -20.143 28.581 4.546 1.00 19.37 ? 21 SER B CB 1 ATOM 5590 O OG . SER B 2 9 ? -20.590 27.299 4.991 1.00 22.81 ? 21 SER B OG 1 ATOM 5591 N N . SER B 2 10 ? -17.846 29.601 2.168 1.00 18.99 ? 22 SER B N 1 ATOM 5592 C CA . SER B 2 10 ? -17.275 30.671 1.341 1.00 22.27 ? 22 SER B CA 1 ATOM 5593 C C . SER B 2 10 ? -17.915 30.676 -0.043 1.00 21.69 ? 22 SER B C 1 ATOM 5594 O O . SER B 2 10 ? -18.307 29.627 -0.542 1.00 20.26 ? 22 SER B O 1 ATOM 5595 C CB . SER B 2 10 ? -15.763 30.467 1.158 1.00 26.28 ? 22 SER B CB 1 ATOM 5596 O OG . SER B 2 10 ? -15.175 29.778 2.248 1.00 31.40 ? 22 SER B OG 1 ATOM 5597 N N . ALA B 2 11 ? -17.981 31.840 -0.681 1.00 19.00 ? 23 ALA B N 1 ATOM 5598 C CA . ALA B 2 11 ? -18.541 31.935 -2.031 1.00 21.60 ? 23 ALA B CA 1 ATOM 5599 C C . ALA B 2 11 ? -17.579 31.354 -3.064 1.00 23.29 ? 23 ALA B C 1 ATOM 5600 O O . ALA B 2 11 ? -16.370 31.364 -2.853 1.00 23.71 ? 23 ALA B O 1 ATOM 5601 C CB . ALA B 2 11 ? -18.848 33.381 -2.375 1.00 23.33 ? 23 ALA B CB 1 ATOM 5602 N N . ASN B 2 12 ? -18.113 30.859 -4.179 1.00 21.48 ? 24 ASN B N 1 ATOM 5603 C CA . ASN B 2 12 ? -17.263 30.431 -5.289 1.00 24.98 ? 24 ASN B CA 1 ATOM 5604 C C . ASN B 2 12 ? -16.845 31.625 -6.145 1.00 30.04 ? 24 ASN B C 1 ATOM 5605 O O . ASN B 2 12 ? -17.500 32.665 -6.132 1.00 27.88 ? 24 ASN B O 1 ATOM 5606 C CB . ASN B 2 12 ? -17.942 29.356 -6.145 1.00 25.84 ? 24 ASN B CB 1 ATOM 5607 C CG . ASN B 2 12 ? -19.184 29.865 -6.857 1.00 28.77 ? 24 ASN B CG 1 ATOM 5608 O OD1 . ASN B 2 12 ? -19.832 30.805 -6.403 1.00 29.64 ? 24 ASN B OD1 1 ATOM 5609 N ND2 . ASN B 2 12 ? -19.520 29.241 -7.976 1.00 32.67 ? 24 ASN B ND2 1 ATOM 5610 N N . MET B 2 13 ? -15.750 31.473 -6.881 1.00 33.84 ? 25 MET B N 1 ATOM 5611 C CA . MET B 2 13 ? -15.228 32.562 -7.698 1.00 43.76 ? 25 MET B CA 1 ATOM 5612 C C . MET B 2 13 ? -16.162 32.892 -8.856 1.00 46.77 ? 25 MET B C 1 ATOM 5613 O O . MET B 2 13 ? -16.833 32.012 -9.394 1.00 47.04 ? 25 MET B O 1 ATOM 5614 C CB . MET B 2 13 ? -13.836 32.215 -8.231 1.00 51.70 ? 25 MET B CB 1 ATOM 5615 C CG . MET B 2 13 ? -12.759 32.113 -7.157 1.00 54.94 ? 25 MET B CG 1 ATOM 5616 S SD . MET B 2 13 ? -11.640 33.532 -7.116 1.00 101.86 ? 25 MET B SD 1 ATOM 5617 C CE . MET B 2 13 ? -12.710 34.818 -6.471 1.00 87.49 ? 25 MET B CE 1 ATOM 5618 N N . MET B 2 14 ? -16.205 34.166 -9.229 1.00 50.25 ? 26 MET B N 1 ATOM 5619 C CA . MET B 2 14 ? -16.978 34.596 -10.388 1.00 55.19 ? 26 MET B CA 1 ATOM 5620 C C . MET B 2 14 ? -16.254 35.728 -11.106 1.00 62.11 ? 26 MET B C 1 ATOM 5621 O O . MET B 2 14 ? -15.114 36.052 -10.773 1.00 65.01 ? 26 MET B O 1 ATOM 5622 C CB . MET B 2 14 ? -18.387 35.039 -9.981 1.00 54.53 ? 26 MET B CB 1 ATOM 5623 C CG . MET B 2 14 ? -18.442 36.368 -9.237 1.00 56.59 ? 26 MET B CG 1 ATOM 5624 S SD . MET B 2 14 ? -20.130 36.989 -9.050 1.00 57.09 ? 26 MET B SD 1 ATOM 5625 C CE . MET B 2 14 ? -19.837 38.522 -8.172 1.00 65.48 ? 26 MET B CE 1 ATOM 5626 N N . ALA C 1 28 ? 35.706 -19.748 10.460 1.00 83.27 ? 336 ALA C N 1 ATOM 5627 C CA . ALA C 1 28 ? 35.027 -20.844 9.779 1.00 81.10 ? 336 ALA C CA 1 ATOM 5628 C C . ALA C 1 28 ? 34.715 -20.484 8.330 1.00 77.87 ? 336 ALA C C 1 ATOM 5629 O O . ALA C 1 28 ? 35.118 -21.190 7.406 1.00 74.80 ? 336 ALA C O 1 ATOM 5630 C CB . ALA C 1 28 ? 33.753 -21.225 10.520 1.00 80.96 ? 336 ALA C CB 1 ATOM 5631 N N . VAL C 1 29 ? 33.994 -19.382 8.145 1.00 78.13 ? 337 VAL C N 1 ATOM 5632 C CA . VAL C 1 29 ? 33.629 -18.903 6.816 1.00 77.58 ? 337 VAL C CA 1 ATOM 5633 C C . VAL C 1 29 ? 34.863 -18.590 5.970 1.00 79.05 ? 337 VAL C C 1 ATOM 5634 O O . VAL C 1 29 ? 34.946 -18.992 4.808 1.00 77.75 ? 337 VAL C O 1 ATOM 5635 C CB . VAL C 1 29 ? 32.730 -17.652 6.899 1.00 77.06 ? 337 VAL C CB 1 ATOM 5636 C CG1 . VAL C 1 29 ? 32.482 -17.074 5.515 1.00 75.48 ? 337 VAL C CG1 1 ATOM 5637 C CG2 . VAL C 1 29 ? 31.415 -17.990 7.585 1.00 76.54 ? 337 VAL C CG2 1 ATOM 5638 N N . ARG C 1 30 ? 35.822 -17.883 6.561 1.00 80.98 ? 338 ARG C N 1 ATOM 5639 C CA . ARG C 1 30 ? 37.042 -17.503 5.855 1.00 81.59 ? 338 ARG C CA 1 ATOM 5640 C C . ARG C 1 30 ? 37.851 -18.728 5.430 1.00 79.14 ? 338 ARG C C 1 ATOM 5641 O O . ARG C 1 30 ? 38.480 -18.729 4.370 1.00 77.77 ? 338 ARG C O 1 ATOM 5642 C CB . ARG C 1 30 ? 37.903 -16.581 6.720 1.00 85.60 ? 338 ARG C CB 1 ATOM 5643 C CG . ARG C 1 30 ? 39.091 -15.980 5.986 1.00 88.58 ? 338 ARG C CG 1 ATOM 5644 C CD . ARG C 1 30 ? 40.041 -15.283 6.943 1.00 93.88 ? 338 ARG C CD 1 ATOM 5645 N NE . ARG C 1 30 ? 40.608 -16.210 7.918 1.00 96.79 ? 338 ARG C NE 1 ATOM 5646 C CZ . ARG C 1 30 ? 41.685 -16.958 7.699 1.00 99.01 ? 338 ARG C CZ 1 ATOM 5647 N NH1 . ARG C 1 30 ? 42.314 -16.893 6.533 1.00 99.40 ? 338 ARG C NH1 1 ATOM 5648 N NH2 . ARG C 1 30 ? 42.132 -17.775 8.645 1.00 100.23 ? 338 ARG C NH2 1 ATOM 5649 N N . LEU C 1 31 ? 37.826 -19.767 6.259 1.00 78.72 ? 339 LEU C N 1 ATOM 5650 C CA . LEU C 1 31 ? 38.541 -21.005 5.961 1.00 79.23 ? 339 LEU C CA 1 ATOM 5651 C C . LEU C 1 31 ? 37.819 -21.835 4.903 1.00 77.55 ? 339 LEU C C 1 ATOM 5652 O O . LEU C 1 31 ? 38.452 -22.510 4.090 1.00 74.41 ? 339 LEU C O 1 ATOM 5653 C CB . LEU C 1 31 ? 38.749 -21.827 7.235 1.00 80.98 ? 339 LEU C CB 1 ATOM 5654 C CG . LEU C 1 31 ? 39.761 -21.256 8.233 1.00 83.93 ? 339 LEU C CG 1 ATOM 5655 C CD1 . LEU C 1 31 ? 39.904 -22.162 9.449 1.00 85.26 ? 339 LEU C CD1 1 ATOM 5656 C CD2 . LEU C 1 31 ? 41.110 -21.039 7.564 1.00 85.13 ? 339 LEU C CD2 1 ATOM 5657 N N . TYR C 1 32 ? 36.491 -21.784 4.922 1.00 75.54 ? 340 TYR C N 1 ATOM 5658 C CA . TYR C 1 32 ? 35.690 -22.467 3.917 1.00 74.20 ? 340 TYR C CA 1 ATOM 5659 C C . TYR C 1 32 ? 35.932 -21.859 2.540 1.00 74.17 ? 340 TYR C C 1 ATOM 5660 O O . TYR C 1 32 ? 36.136 -22.580 1.562 1.00 71.09 ? 340 TYR C O 1 ATOM 5661 C CB . TYR C 1 32 ? 34.205 -22.387 4.273 1.00 74.50 ? 340 TYR C CB 1 ATOM 5662 C CG . TYR C 1 32 ? 33.760 -23.400 5.303 1.00 76.18 ? 340 TYR C CG 1 ATOM 5663 C CD1 . TYR C 1 32 ? 34.230 -24.707 5.269 1.00 77.43 ? 340 TYR C CD1 1 ATOM 5664 C CD2 . TYR C 1 32 ? 32.869 -23.051 6.310 1.00 77.40 ? 340 TYR C CD2 1 ATOM 5665 C CE1 . TYR C 1 32 ? 33.824 -25.638 6.206 1.00 78.31 ? 340 TYR C CE1 1 ATOM 5666 C CE2 . TYR C 1 32 ? 32.459 -23.974 7.253 1.00 78.90 ? 340 TYR C CE2 1 ATOM 5667 C CZ . TYR C 1 32 ? 32.940 -25.266 7.196 1.00 79.60 ? 340 TYR C CZ 1 ATOM 5668 O OH . TYR C 1 32 ? 32.534 -26.190 8.132 1.00 81.40 ? 340 TYR C OH 1 ATOM 5669 N N . ARG C 1 33 ? 35.912 -20.530 2.475 1.00 73.87 ? 341 ARG C N 1 ATOM 5670 C CA . ARG C 1 33 ? 36.128 -19.816 1.221 1.00 74.77 ? 341 ARG C CA 1 ATOM 5671 C C . ARG C 1 33 ? 37.514 -20.095 0.654 1.00 76.63 ? 341 ARG C C 1 ATOM 5672 O O . ARG C 1 33 ? 37.701 -20.134 -0.563 1.00 75.84 ? 341 ARG C O 1 ATOM 5673 C CB . ARG C 1 33 ? 35.936 -18.311 1.414 1.00 74.94 ? 341 ARG C CB 1 ATOM 5674 C CG . ARG C 1 33 ? 34.531 -17.907 1.829 1.00 73.44 ? 341 ARG C CG 1 ATOM 5675 C CD . ARG C 1 33 ? 34.383 -16.396 1.849 1.00 74.56 ? 341 ARG C CD 1 ATOM 5676 N NE . ARG C 1 33 ? 33.104 -15.978 2.416 1.00 74.50 ? 341 ARG C NE 1 ATOM 5677 C CZ . ARG C 1 33 ? 31.977 -15.871 1.722 1.00 75.03 ? 341 ARG C CZ 1 ATOM 5678 N NH1 . ARG C 1 33 ? 31.961 -16.155 0.426 1.00 75.02 ? 341 ARG C NH1 1 ATOM 5679 N NH2 . ARG C 1 33 ? 30.862 -15.481 2.325 1.00 75.74 ? 341 ARG C NH2 1 ATOM 5680 N N . LYS C 1 34 ? 38.482 -20.287 1.544 1.00 79.58 ? 342 LYS C N 1 ATOM 5681 C CA . LYS C 1 34 ? 39.844 -20.609 1.140 1.00 82.23 ? 342 LYS C CA 1 ATOM 5682 C C . LYS C 1 34 ? 39.898 -22.005 0.525 1.00 81.52 ? 342 LYS C C 1 ATOM 5683 O O . LYS C 1 34 ? 40.663 -22.256 -0.405 1.00 81.09 ? 342 LYS C O 1 ATOM 5684 C CB . LYS C 1 34 ? 40.792 -20.518 2.338 1.00 85.28 ? 342 LYS C CB 1 ATOM 5685 C CG . LYS C 1 34 ? 42.256 -20.715 1.987 1.00 88.79 ? 342 LYS C CG 1 ATOM 5686 C CD . LYS C 1 34 ? 42.732 -19.665 0.996 1.00 90.72 ? 342 LYS C CD 1 ATOM 5687 C CE . LYS C 1 34 ? 44.204 -19.853 0.663 1.00 93.77 ? 342 LYS C CE 1 ATOM 5688 N NZ . LYS C 1 34 ? 44.689 -18.835 -0.310 1.00 95.36 ? 342 LYS C NZ 1 ATOM 5689 N N . ALA C 1 35 ? 39.071 -22.907 1.048 1.00 81.38 ? 343 ALA C N 1 ATOM 5690 C CA . ALA C 1 35 ? 38.987 -24.265 0.524 1.00 80.98 ? 343 ALA C CA 1 ATOM 5691 C C . ALA C 1 35 ? 38.377 -24.270 -0.874 1.00 78.90 ? 343 ALA C C 1 ATOM 5692 O O . ALA C 1 35 ? 38.725 -25.102 -1.712 1.00 76.95 ? 343 ALA C O 1 ATOM 5693 C CB . ALA C 1 35 ? 38.177 -25.147 1.462 1.00 80.64 ? 343 ALA C CB 1 ATOM 5694 N N . LEU C 1 36 ? 37.464 -23.334 -1.116 1.00 79.29 ? 344 LEU C N 1 ATOM 5695 C CA . LEU C 1 36 ? 36.831 -23.197 -2.422 1.00 79.46 ? 344 LEU C CA 1 ATOM 5696 C C . LEU C 1 36 ? 37.786 -22.535 -3.410 1.00 81.24 ? 344 LEU C C 1 ATOM 5697 O O . LEU C 1 36 ? 37.747 -22.810 -4.609 1.00 81.42 ? 344 LEU C O 1 ATOM 5698 C CB . LEU C 1 36 ? 35.537 -22.386 -2.309 1.00 77.45 ? 344 LEU C CB 1 ATOM 5699 C CG . LEU C 1 36 ? 34.452 -22.973 -1.403 1.00 76.07 ? 344 LEU C CG 1 ATOM 5700 C CD1 . LEU C 1 36 ? 33.241 -22.051 -1.335 1.00 73.68 ? 344 LEU C CD1 1 ATOM 5701 C CD2 . LEU C 1 36 ? 34.050 -24.361 -1.877 1.00 76.16 ? 344 LEU C CD2 1 ATOM 5702 N N . GLU C 1 37 ? 38.643 -21.661 -2.892 1.00 83.16 ? 345 GLU C N 1 ATOM 5703 C CA . GLU C 1 37 ? 39.649 -20.985 -3.703 1.00 85.70 ? 345 GLU C CA 1 ATOM 5704 C C . GLU C 1 37 ? 40.684 -21.984 -4.214 1.00 87.53 ? 345 GLU C C 1 ATOM 5705 O O . GLU C 1 37 ? 41.232 -21.824 -5.306 1.00 89.05 ? 345 GLU C O 1 ATOM 5706 C CB . GLU C 1 37 ? 40.333 -19.886 -2.885 1.00 86.97 ? 345 GLU C CB 1 ATOM 5707 C CG . GLU C 1 37 ? 41.300 -19.016 -3.672 1.00 89.52 ? 345 GLU C CG 1 ATOM 5708 C CD . GLU C 1 37 ? 41.926 -17.927 -2.820 1.00 91.60 ? 345 GLU C CD 1 ATOM 5709 O OE1 . GLU C 1 37 ? 42.877 -17.269 -3.292 1.00 93.19 ? 345 GLU C OE1 1 ATOM 5710 O OE2 . GLU C 1 37 ? 41.465 -17.726 -1.676 1.00 91.53 ? 345 GLU C OE2 1 ATOM 5711 N N . VAL C 1 38 ? 40.943 -23.016 -3.417 1.00 87.32 ? 346 VAL C N 1 ATOM 5712 C CA . VAL C 1 38 ? 41.889 -24.062 -3.790 1.00 89.67 ? 346 VAL C CA 1 ATOM 5713 C C . VAL C 1 38 ? 41.225 -25.117 -4.672 1.00 90.04 ? 346 VAL C C 1 ATOM 5714 O O . VAL C 1 38 ? 41.788 -25.543 -5.681 1.00 91.04 ? 346 VAL C O 1 ATOM 5715 C CB . VAL C 1 38 ? 42.489 -24.742 -2.542 1.00 91.05 ? 346 VAL C CB 1 ATOM 5716 C CG1 . VAL C 1 38 ? 43.370 -25.916 -2.942 1.00 92.94 ? 346 VAL C CG1 1 ATOM 5717 C CG2 . VAL C 1 38 ? 43.277 -23.735 -1.717 1.00 91.79 ? 346 VAL C CG2 1 ATOM 5718 N N . PHE C 1 39 ? 40.020 -25.525 -4.287 1.00 89.43 ? 347 PHE C N 1 ATOM 5719 C CA . PHE C 1 39 ? 39.282 -26.553 -5.012 1.00 90.27 ? 347 PHE C CA 1 ATOM 5720 C C . PHE C 1 39 ? 37.807 -26.168 -5.114 1.00 87.13 ? 347 PHE C C 1 ATOM 5721 O O . PHE C 1 39 ? 37.021 -26.485 -4.225 1.00 85.09 ? 347 PHE C O 1 ATOM 5722 C CB . PHE C 1 39 ? 39.426 -27.899 -4.299 1.00 93.48 ? 347 PHE C CB 1 ATOM 5723 C CG . PHE C 1 39 ? 38.862 -29.063 -5.066 1.00 97.13 ? 347 PHE C CG 1 ATOM 5724 C CD1 . PHE C 1 39 ? 38.714 -29.004 -6.443 1.00 98.95 ? 347 PHE C CD1 1 ATOM 5725 C CD2 . PHE C 1 39 ? 38.473 -30.217 -4.404 1.00 98.39 ? 347 PHE C CD2 1 ATOM 5726 C CE1 . PHE C 1 39 ? 38.193 -30.075 -7.145 1.00 100.67 ? 347 PHE C CE1 1 ATOM 5727 C CE2 . PHE C 1 39 ? 37.950 -31.291 -5.101 1.00 99.83 ? 347 PHE C CE2 1 ATOM 5728 C CZ . PHE C 1 39 ? 37.811 -31.220 -6.473 1.00 100.97 ? 347 PHE C CZ 1 ATOM 5729 N N . PRO C 1 40 ? 37.433 -25.481 -6.206 1.00 88.00 ? 348 PRO C N 1 ATOM 5730 C CA . PRO C 1 40 ? 36.073 -24.976 -6.445 1.00 87.41 ? 348 PRO C CA 1 ATOM 5731 C C . PRO C 1 40 ? 35.002 -26.065 -6.540 1.00 87.59 ? 348 PRO C C 1 ATOM 5732 O O . PRO C 1 40 ? 33.818 -25.763 -6.384 1.00 85.43 ? 348 PRO C O 1 ATOM 5733 C CB . PRO C 1 40 ? 36.202 -24.253 -7.791 1.00 88.40 ? 348 PRO C CB 1 ATOM 5734 C CG . PRO C 1 40 ? 37.647 -23.902 -7.897 1.00 89.13 ? 348 PRO C CG 1 ATOM 5735 C CD . PRO C 1 40 ? 38.370 -25.044 -7.255 1.00 89.73 ? 348 PRO C CD 1 ATOM 5736 N N . GLU C 1 41 ? 35.408 -27.305 -6.797 1.00 64.09 ? 349 GLU C N 1 ATOM 5737 C CA . GLU C 1 41 ? 34.455 -28.403 -6.951 1.00 61.53 ? 349 GLU C CA 1 ATOM 5738 C C . GLU C 1 41 ? 34.361 -29.269 -5.697 1.00 59.08 ? 349 GLU C C 1 ATOM 5739 O O . GLU C 1 41 ? 34.443 -30.496 -5.768 1.00 58.93 ? 349 GLU C O 1 ATOM 5740 C CB . GLU C 1 41 ? 34.826 -29.265 -8.159 1.00 64.16 ? 349 GLU C CB 1 ATOM 5741 C CG . GLU C 1 41 ? 34.669 -28.555 -9.488 1.00 65.30 ? 349 GLU C CG 1 ATOM 5742 C CD . GLU C 1 41 ? 33.224 -28.247 -9.811 1.00 64.06 ? 349 GLU C CD 1 ATOM 5743 O OE1 . GLU C 1 41 ? 32.496 -29.179 -10.213 1.00 63.69 ? 349 GLU C OE1 1 ATOM 5744 O OE2 . GLU C 1 41 ? 32.814 -27.076 -9.660 1.00 64.40 ? 349 GLU C OE2 1 ATOM 5745 N N . PHE C 1 42 ? 34.179 -28.619 -4.552 1.00 56.03 ? 350 PHE C N 1 ATOM 5746 C CA . PHE C 1 42 ? 34.101 -29.305 -3.269 1.00 54.26 ? 350 PHE C CA 1 ATOM 5747 C C . PHE C 1 42 ? 32.667 -29.222 -2.739 1.00 51.03 ? 350 PHE C C 1 ATOM 5748 O O . PHE C 1 42 ? 32.287 -28.236 -2.106 1.00 50.25 ? 350 PHE C O 1 ATOM 5749 C CB . PHE C 1 42 ? 35.083 -28.661 -2.286 1.00 55.15 ? 350 PHE C CB 1 ATOM 5750 C CG . PHE C 1 42 ? 35.438 -29.526 -1.102 1.00 54.70 ? 350 PHE C CG 1 ATOM 5751 C CD1 . PHE C 1 42 ? 34.689 -30.648 -0.780 1.00 52.81 ? 350 PHE C CD1 1 ATOM 5752 C CD2 . PHE C 1 42 ? 36.525 -29.205 -0.305 1.00 57.46 ? 350 PHE C CD2 1 ATOM 5753 C CE1 . PHE C 1 42 ? 35.017 -31.432 0.309 1.00 53.68 ? 350 PHE C CE1 1 ATOM 5754 C CE2 . PHE C 1 42 ? 36.861 -29.984 0.786 1.00 58.42 ? 350 PHE C CE2 1 ATOM 5755 C CZ . PHE C 1 42 ? 36.107 -31.100 1.094 1.00 56.79 ? 350 PHE C CZ 1 ATOM 5756 N N . ALA C 1 43 ? 31.885 -30.266 -2.998 1.00 48.46 ? 351 ALA C N 1 ATOM 5757 C CA . ALA C 1 43 ? 30.460 -30.278 -2.673 1.00 47.15 ? 351 ALA C CA 1 ATOM 5758 C C . ALA C 1 43 ? 30.183 -30.145 -1.176 1.00 48.03 ? 351 ALA C C 1 ATOM 5759 O O . ALA C 1 43 ? 29.229 -29.482 -0.769 1.00 45.32 ? 351 ALA C O 1 ATOM 5760 C CB . ALA C 1 43 ? 29.802 -31.536 -3.226 1.00 46.35 ? 351 ALA C CB 1 ATOM 5761 N N . ALA C 1 44 ? 31.018 -30.779 -0.359 1.00 51.32 ? 352 ALA C N 1 ATOM 5762 C CA . ALA C 1 44 ? 30.855 -30.716 1.087 1.00 52.39 ? 352 ALA C CA 1 ATOM 5763 C C . ALA C 1 44 ? 31.198 -29.326 1.619 1.00 52.80 ? 352 ALA C C 1 ATOM 5764 O O . ALA C 1 44 ? 30.526 -28.813 2.511 1.00 54.10 ? 352 ALA C O 1 ATOM 5765 C CB . ALA C 1 44 ? 31.711 -31.775 1.766 1.00 57.94 ? 352 ALA C CB 1 ATOM 5766 N N . ALA C 1 45 ? 32.245 -28.722 1.067 1.00 54.24 ? 353 ALA C N 1 ATOM 5767 C CA . ALA C 1 45 ? 32.663 -27.387 1.485 1.00 55.32 ? 353 ALA C CA 1 ATOM 5768 C C . ALA C 1 45 ? 31.558 -26.361 1.248 1.00 50.71 ? 353 ALA C C 1 ATOM 5769 O O . ALA C 1 45 ? 31.293 -25.516 2.103 1.00 49.55 ? 353 ALA C O 1 ATOM 5770 C CB . ALA C 1 45 ? 33.937 -26.974 0.766 1.00 58.17 ? 353 ALA C CB 1 ATOM 5771 N N . HIS C 1 46 ? 30.921 -26.437 0.084 1.00 47.58 ? 354 HIS C N 1 ATOM 5772 C CA . HIS C 1 46 ? 29.815 -25.543 -0.235 1.00 44.70 ? 354 HIS C CA 1 ATOM 5773 C C . HIS C 1 46 ? 28.644 -25.775 0.713 1.00 44.19 ? 354 HIS C C 1 ATOM 5774 O O . HIS C 1 46 ? 28.069 -24.825 1.246 1.00 46.06 ? 354 HIS C O 1 ATOM 5775 C CB . HIS C 1 46 ? 29.366 -25.725 -1.685 1.00 41.51 ? 354 HIS C CB 1 ATOM 5776 C CG . HIS C 1 46 ? 30.221 -25.000 -2.678 1.00 42.94 ? 354 HIS C CG 1 ATOM 5777 N ND1 . HIS C 1 46 ? 30.162 -23.634 -2.853 1.00 43.16 ? 354 HIS C ND1 1 ATOM 5778 C CD2 . HIS C 1 46 ? 31.150 -25.452 -3.554 1.00 45.18 ? 354 HIS C CD2 1 ATOM 5779 C CE1 . HIS C 1 46 ? 31.019 -23.275 -3.793 1.00 43.86 ? 354 HIS C CE1 1 ATOM 5780 N NE2 . HIS C 1 46 ? 31.633 -24.359 -4.233 1.00 45.15 ? 354 HIS C NE2 1 ATOM 5781 N N . SER C 1 47 ? 28.302 -27.041 0.926 1.00 42.96 ? 355 SER C N 1 ATOM 5782 C CA . SER C 1 47 ? 27.191 -27.389 1.806 1.00 43.17 ? 355 SER C CA 1 ATOM 5783 C C . SER C 1 47 ? 27.465 -26.969 3.249 1.00 43.87 ? 355 SER C C 1 ATOM 5784 O O . SER C 1 47 ? 26.557 -26.538 3.963 1.00 40.15 ? 355 SER C O 1 ATOM 5785 C CB . SER C 1 47 ? 26.900 -28.887 1.738 1.00 46.36 ? 355 SER C CB 1 ATOM 5786 O OG . SER C 1 47 ? 25.927 -29.254 2.698 1.00 50.62 ? 355 SER C OG 1 ATOM 5787 N N . ASN C 1 48 ? 28.720 -27.096 3.671 1.00 48.18 ? 356 ASN C N 1 ATOM 5788 C CA . ASN C 1 48 ? 29.113 -26.692 5.014 1.00 51.27 ? 356 ASN C CA 1 ATOM 5789 C C . ASN C 1 48 ? 29.067 -25.180 5.193 1.00 49.67 ? 356 ASN C C 1 ATOM 5790 O O . ASN C 1 48 ? 28.558 -24.680 6.196 1.00 50.46 ? 356 ASN C O 1 ATOM 5791 C CB . ASN C 1 48 ? 30.510 -27.217 5.352 1.00 58.51 ? 356 ASN C CB 1 ATOM 5792 C CG . ASN C 1 48 ? 30.535 -28.720 5.557 1.00 61.44 ? 356 ASN C CG 1 ATOM 5793 O OD1 . ASN C 1 48 ? 29.516 -29.332 5.887 1.00 59.61 ? 356 ASN C OD1 1 ATOM 5794 N ND2 . ASN C 1 48 ? 31.704 -29.324 5.366 1.00 64.77 ? 356 ASN C ND2 1 ATOM 5795 N N . LEU C 1 49 ? 29.608 -24.458 4.218 1.00 47.70 ? 357 LEU C N 1 ATOM 5796 C CA . LEU C 1 49 ? 29.594 -23.000 4.250 1.00 47.29 ? 357 LEU C CA 1 ATOM 5797 C C . LEU C 1 49 ? 28.159 -22.479 4.195 1.00 43.19 ? 357 LEU C C 1 ATOM 5798 O O . LEU C 1 49 ? 27.812 -21.524 4.889 1.00 44.18 ? 357 LEU C O 1 ATOM 5799 C CB . LEU C 1 49 ? 30.417 -22.430 3.091 1.00 48.79 ? 357 LEU C CB 1 ATOM 5800 C CG . LEU C 1 49 ? 30.532 -20.905 2.999 1.00 49.56 ? 357 LEU C CG 1 ATOM 5801 C CD1 . LEU C 1 49 ? 31.152 -20.324 4.262 1.00 49.94 ? 357 LEU C CD1 1 ATOM 5802 C CD2 . LEU C 1 49 ? 31.336 -20.500 1.771 1.00 50.75 ? 357 LEU C CD2 1 ATOM 5803 N N . ALA C 1 50 ? 27.330 -23.115 3.371 1.00 39.84 ? 358 ALA C N 1 ATOM 5804 C CA . ALA C 1 50 ? 25.925 -22.727 3.242 1.00 38.01 ? 358 ALA C CA 1 ATOM 5805 C C . ALA C 1 50 ? 25.194 -22.849 4.574 1.00 39.57 ? 358 ALA C C 1 ATOM 5806 O O . ALA C 1 50 ? 24.507 -21.922 5.008 1.00 40.19 ? 358 ALA C O 1 ATOM 5807 C CB . ALA C 1 50 ? 25.228 -23.571 2.176 1.00 34.27 ? 358 ALA C CB 1 ATOM 5808 N N . SER C 1 51 ? 25.354 -24.000 5.215 1.00 40.66 ? 359 SER C N 1 ATOM 5809 C CA . SER C 1 51 ? 24.740 -24.258 6.508 1.00 43.65 ? 359 SER C CA 1 ATOM 5810 C C . SER C 1 51 ? 25.176 -23.222 7.547 1.00 46.47 ? 359 SER C C 1 ATOM 5811 O O . SER C 1 51 ? 24.368 -22.770 8.362 1.00 47.18 ? 359 SER C O 1 ATOM 5812 C CB . SER C 1 51 ? 25.091 -25.671 6.976 1.00 47.93 ? 359 SER C CB 1 ATOM 5813 O OG . SER C 1 51 ? 24.528 -25.945 8.244 1.00 53.48 ? 359 SER C OG 1 ATOM 5814 N N . VAL C 1 52 ? 26.452 -22.843 7.504 1.00 46.92 ? 360 VAL C N 1 ATOM 5815 C CA . VAL C 1 52 ? 26.992 -21.843 8.420 1.00 50.14 ? 360 VAL C CA 1 ATOM 5816 C C . VAL C 1 52 ? 26.428 -20.455 8.130 1.00 50.14 ? 360 VAL C C 1 ATOM 5817 O O . VAL C 1 52 ? 25.999 -19.748 9.046 1.00 52.37 ? 360 VAL C O 1 ATOM 5818 C CB . VAL C 1 52 ? 28.535 -21.803 8.374 1.00 55.75 ? 360 VAL C CB 1 ATOM 5819 C CG1 . VAL C 1 52 ? 29.061 -20.514 8.991 1.00 59.16 ? 360 VAL C CG1 1 ATOM 5820 C CG2 . VAL C 1 52 ? 29.115 -23.016 9.088 1.00 57.98 ? 360 VAL C CG2 1 ATOM 5821 N N . LEU C 1 53 ? 26.428 -20.072 6.856 1.00 46.46 ? 361 LEU C N 1 ATOM 5822 C CA . LEU C 1 53 ? 25.840 -18.802 6.445 1.00 45.68 ? 361 LEU C CA 1 ATOM 5823 C C . LEU C 1 53 ? 24.364 -18.750 6.834 1.00 45.24 ? 361 LEU C C 1 ATOM 5824 O O . LEU C 1 53 ? 23.865 -17.710 7.269 1.00 46.46 ? 361 LEU C O 1 ATOM 5825 C CB . LEU C 1 53 ? 26.008 -18.585 4.936 1.00 42.94 ? 361 LEU C CB 1 ATOM 5826 C CG . LEU C 1 53 ? 27.419 -18.264 4.429 1.00 45.30 ? 361 LEU C CG 1 ATOM 5827 C CD1 . LEU C 1 53 ? 27.462 -18.225 2.903 1.00 43.74 ? 361 LEU C CD1 1 ATOM 5828 C CD2 . LEU C 1 53 ? 27.916 -16.947 5.011 1.00 47.08 ? 361 LEU C CD2 1 ATOM 5829 N N . GLN C 1 54 ? 23.678 -19.883 6.689 1.00 43.60 ? 362 GLN C N 1 ATOM 5830 C CA . GLN C 1 54 ? 22.267 -19.986 7.054 1.00 44.20 ? 362 GLN C CA 1 ATOM 5831 C C . GLN C 1 54 ? 22.061 -19.702 8.544 1.00 45.83 ? 362 GLN C C 1 ATOM 5832 O O . GLN C 1 54 ? 21.143 -18.979 8.922 1.00 43.92 ? 362 GLN C O 1 ATOM 5833 C CB . GLN C 1 54 ? 21.703 -21.365 6.687 1.00 44.94 ? 362 GLN C CB 1 ATOM 5834 C CG . GLN C 1 54 ? 20.268 -21.596 7.160 1.00 47.79 ? 362 GLN C CG 1 ATOM 5835 C CD . GLN C 1 54 ? 19.744 -22.995 6.846 1.00 48.75 ? 362 GLN C CD 1 ATOM 5836 O OE1 . GLN C 1 54 ? 20.446 -23.824 6.262 1.00 49.23 ? 362 GLN C OE1 1 ATOM 5837 N NE2 . GLN C 1 54 ? 18.501 -23.259 7.235 1.00 46.99 ? 362 GLN C NE2 1 ATOM 5838 N N . GLN C 1 55 ? 22.928 -20.260 9.382 1.00 50.71 ? 363 GLN C N 1 ATOM 5839 C CA . GLN C 1 55 ? 22.858 -20.015 10.822 1.00 55.44 ? 363 GLN C CA 1 ATOM 5840 C C . GLN C 1 55 ? 23.059 -18.539 11.156 1.00 55.97 ? 363 GLN C C 1 ATOM 5841 O O . GLN C 1 55 ? 22.474 -18.026 12.111 1.00 56.71 ? 363 GLN C O 1 ATOM 5842 C CB . GLN C 1 55 ? 23.893 -20.857 11.566 1.00 61.43 ? 363 GLN C CB 1 ATOM 5843 C CG . GLN C 1 55 ? 23.599 -22.342 11.581 1.00 65.24 ? 363 GLN C CG 1 ATOM 5844 C CD . GLN C 1 55 ? 24.501 -23.097 12.537 1.00 73.37 ? 363 GLN C CD 1 ATOM 5845 O OE1 . GLN C 1 55 ? 25.706 -22.848 12.599 1.00 77.52 ? 363 GLN C OE1 1 ATOM 5846 N NE2 . GLN C 1 55 ? 23.918 -24.015 13.300 1.00 75.71 ? 363 GLN C NE2 1 ATOM 5847 N N . GLN C 1 56 ? 23.886 -17.863 10.364 1.00 54.77 ? 364 GLN C N 1 ATOM 5848 C CA . GLN C 1 56 ? 24.161 -16.444 10.572 1.00 55.56 ? 364 GLN C CA 1 ATOM 5849 C C . GLN C 1 56 ? 23.007 -15.566 10.101 1.00 52.46 ? 364 GLN C C 1 ATOM 5850 O O . GLN C 1 56 ? 22.987 -14.362 10.358 1.00 55.97 ? 364 GLN C O 1 ATOM 5851 C CB . GLN C 1 56 ? 25.448 -16.032 9.853 1.00 57.73 ? 364 GLN C CB 1 ATOM 5852 C CG . GLN C 1 56 ? 26.718 -16.598 10.461 1.00 63.40 ? 364 GLN C CG 1 ATOM 5853 C CD . GLN C 1 56 ? 27.967 -16.073 9.779 1.00 67.41 ? 364 GLN C CD 1 ATOM 5854 O OE1 . GLN C 1 56 ? 28.093 -16.133 8.556 1.00 67.49 ? 364 GLN C OE1 1 ATOM 5855 N NE2 . GLN C 1 56 ? 28.894 -15.545 10.568 1.00 71.35 ? 364 GLN C NE2 1 ATOM 5856 N N . GLY C 1 57 ? 22.049 -16.172 9.408 1.00 45.49 ? 365 GLY C N 1 ATOM 5857 C CA . GLY C 1 57 ? 20.918 -15.433 8.882 1.00 44.50 ? 365 GLY C CA 1 ATOM 5858 C C . GLY C 1 57 ? 21.182 -14.880 7.494 1.00 43.30 ? 365 GLY C C 1 ATOM 5859 O O . GLY C 1 57 ? 20.354 -14.156 6.940 1.00 43.73 ? 365 GLY C O 1 ATOM 5860 N N . LYS C 1 58 ? 22.340 -15.218 6.934 1.00 42.59 ? 366 LYS C N 1 ATOM 5861 C CA . LYS C 1 58 ? 22.684 -14.808 5.576 1.00 40.53 ? 366 LYS C CA 1 ATOM 5862 C C . LYS C 1 58 ? 22.124 -15.824 4.584 1.00 39.84 ? 366 LYS C C 1 ATOM 5863 O O . LYS C 1 58 ? 22.859 -16.615 3.991 1.00 39.26 ? 366 LYS C O 1 ATOM 5864 C CB . LYS C 1 58 ? 24.197 -14.663 5.424 1.00 42.44 ? 366 LYS C CB 1 ATOM 5865 C CG . LYS C 1 58 ? 24.797 -13.629 6.374 1.00 46.68 ? 366 LYS C CG 1 ATOM 5866 C CD . LYS C 1 58 ? 26.294 -13.472 6.179 1.00 49.73 ? 366 LYS C CD 1 ATOM 5867 C CE . LYS C 1 58 ? 26.867 -12.458 7.158 1.00 53.89 ? 366 LYS C CE 1 ATOM 5868 N NZ . LYS C 1 58 ? 28.343 -12.311 7.017 1.00 56.21 ? 366 LYS C NZ 1 ATOM 5869 N N . LEU C 1 59 ? 20.808 -15.787 4.418 1.00 39.29 ? 367 LEU C N 1 ATOM 5870 C CA . LEU C 1 59 ? 20.086 -16.808 3.671 1.00 36.98 ? 367 LEU C CA 1 ATOM 5871 C C . LEU C 1 59 ? 20.364 -16.775 2.169 1.00 38.22 ? 367 LEU C C 1 ATOM 5872 O O . LEU C 1 59 ? 20.552 -17.822 1.548 1.00 39.71 ? 367 LEU C O 1 ATOM 5873 C CB . LEU C 1 59 ? 18.588 -16.681 3.940 1.00 34.06 ? 367 LEU C CB 1 ATOM 5874 C CG . LEU C 1 59 ? 18.216 -16.639 5.426 1.00 36.14 ? 367 LEU C CG 1 ATOM 5875 C CD1 . LEU C 1 59 ? 16.711 -16.527 5.608 1.00 33.28 ? 367 LEU C CD1 1 ATOM 5876 C CD2 . LEU C 1 59 ? 18.761 -17.857 6.156 1.00 37.52 ? 367 LEU C CD2 1 ATOM 5877 N N . GLN C 1 60 ? 20.380 -15.579 1.588 1.00 38.68 ? 368 GLN C N 1 ATOM 5878 C CA . GLN C 1 60 ? 20.649 -15.433 0.160 1.00 36.83 ? 368 GLN C CA 1 ATOM 5879 C C . GLN C 1 60 ? 22.030 -15.972 -0.191 1.00 34.99 ? 368 GLN C C 1 ATOM 5880 O O . GLN C 1 60 ? 22.205 -16.672 -1.192 1.00 32.13 ? 368 GLN C O 1 ATOM 5881 C CB . GLN C 1 60 ? 20.510 -13.973 -0.274 1.00 38.98 ? 368 GLN C CB 1 ATOM 5882 C CG . GLN C 1 60 ? 19.064 -13.537 -0.447 1.00 42.02 ? 368 GLN C CG 1 ATOM 5883 C CD . GLN C 1 60 ? 18.929 -12.068 -0.789 1.00 49.27 ? 368 GLN C CD 1 ATOM 5884 O OE1 . GLN C 1 60 ? 18.118 -11.691 -1.635 1.00 53.26 ? 368 GLN C OE1 1 ATOM 5885 N NE2 . GLN C 1 60 ? 19.714 -11.228 -0.125 1.00 49.91 ? 368 GLN C NE2 1 ATOM 5886 N N . GLU C 1 61 ? 23.004 -15.664 0.654 1.00 35.76 ? 369 GLU C N 1 ATOM 5887 C CA . GLU C 1 61 ? 24.363 -16.133 0.440 1.00 37.48 ? 369 GLU C CA 1 ATOM 5888 C C . GLU C 1 61 ? 24.457 -17.642 0.644 1.00 36.43 ? 369 GLU C C 1 ATOM 5889 O O . GLU C 1 61 ? 25.195 -18.324 -0.059 1.00 36.64 ? 369 GLU C O 1 ATOM 5890 C CB . GLU C 1 61 ? 25.332 -15.403 1.370 1.00 40.50 ? 369 GLU C CB 1 ATOM 5891 C CG . GLU C 1 61 ? 26.722 -15.269 0.801 1.00 42.21 ? 369 GLU C CG 1 ATOM 5892 C CD . GLU C 1 61 ? 27.659 -14.497 1.708 1.00 46.60 ? 369 GLU C CD 1 ATOM 5893 O OE1 . GLU C 1 61 ? 27.182 -13.902 2.702 1.00 46.90 ? 369 GLU C OE1 1 ATOM 5894 O OE2 . GLU C 1 61 ? 28.874 -14.487 1.422 1.00 48.33 ? 369 GLU C OE2 1 ATOM 5895 N N . ALA C 1 62 ? 23.701 -18.158 1.607 1.00 35.85 ? 370 ALA C N 1 ATOM 5896 C CA . ALA C 1 62 ? 23.653 -19.596 1.856 1.00 37.51 ? 370 ALA C CA 1 ATOM 5897 C C . ALA C 1 62 ? 23.080 -20.336 0.646 1.00 38.61 ? 370 ALA C C 1 ATOM 5898 O O . ALA C 1 62 ? 23.523 -21.433 0.305 1.00 40.11 ? 370 ALA C O 1 ATOM 5899 C CB . ALA C 1 62 ? 22.826 -19.891 3.104 1.00 38.15 ? 370 ALA C CB 1 ATOM 5900 N N . LEU C 1 63 ? 22.104 -19.714 -0.005 1.00 35.82 ? 371 LEU C N 1 ATOM 5901 C CA . LEU C 1 63 ? 21.422 -20.315 -1.145 1.00 35.52 ? 371 LEU C CA 1 ATOM 5902 C C . LEU C 1 63 ? 22.386 -20.562 -2.305 1.00 35.83 ? 371 LEU C C 1 ATOM 5903 O O . LEU C 1 63 ? 22.283 -21.571 -3.006 1.00 34.63 ? 371 LEU C O 1 ATOM 5904 C CB . LEU C 1 63 ? 20.274 -19.413 -1.590 1.00 37.21 ? 371 LEU C CB 1 ATOM 5905 C CG . LEU C 1 63 ? 18.984 -20.087 -2.046 1.00 38.36 ? 371 LEU C CG 1 ATOM 5906 C CD1 . LEU C 1 63 ? 18.443 -20.984 -0.945 1.00 39.78 ? 371 LEU C CD1 1 ATOM 5907 C CD2 . LEU C 1 63 ? 17.968 -19.027 -2.440 1.00 36.07 ? 371 LEU C CD2 1 ATOM 5908 N N . MET C 1 64 ? 23.323 -19.634 -2.499 1.00 35.22 ? 372 MET C N 1 ATOM 5909 C CA . MET C 1 64 ? 24.342 -19.762 -3.536 1.00 34.32 ? 372 MET C CA 1 ATOM 5910 C C . MET C 1 64 ? 25.140 -21.050 -3.407 1.00 35.64 ? 372 MET C C 1 ATOM 5911 O O . MET C 1 64 ? 25.400 -21.741 -4.397 1.00 37.07 ? 372 MET C O 1 ATOM 5912 C CB . MET C 1 64 ? 25.320 -18.586 -3.479 1.00 35.72 ? 372 MET C CB 1 ATOM 5913 C CG . MET C 1 64 ? 24.842 -17.322 -4.155 1.00 36.04 ? 372 MET C CG 1 ATOM 5914 S SD . MET C 1 64 ? 26.127 -16.055 -4.116 1.00 43.73 ? 372 MET C SD 1 ATOM 5915 C CE . MET C 1 64 ? 27.333 -16.728 -5.257 1.00 43.15 ? 372 MET C CE 1 ATOM 5916 N N . HIS C 1 65 ? 25.550 -21.358 -2.184 1.00 34.86 ? 373 HIS C N 1 ATOM 5917 C CA . HIS C 1 65 ? 26.420 -22.500 -1.956 1.00 35.05 ? 373 HIS C CA 1 ATOM 5918 C C . HIS C 1 65 ? 25.669 -23.828 -2.016 1.00 33.38 ? 373 HIS C C 1 ATOM 5919 O O . HIS C 1 65 ? 26.218 -24.830 -2.474 1.00 33.39 ? 373 HIS C O 1 ATOM 5920 C CB . HIS C 1 65 ? 27.206 -22.316 -0.660 1.00 35.77 ? 373 HIS C CB 1 ATOM 5921 C CG . HIS C 1 65 ? 28.136 -21.143 -0.704 1.00 40.44 ? 373 HIS C CG 1 ATOM 5922 N ND1 . HIS C 1 65 ? 29.334 -21.173 -1.384 1.00 42.91 ? 373 HIS C ND1 1 ATOM 5923 C CD2 . HIS C 1 65 ? 28.020 -19.891 -0.202 1.00 42.10 ? 373 HIS C CD2 1 ATOM 5924 C CE1 . HIS C 1 65 ? 29.928 -19.998 -1.279 1.00 45.49 ? 373 HIS C CE1 1 ATOM 5925 N NE2 . HIS C 1 65 ? 29.152 -19.202 -0.566 1.00 46.39 ? 373 HIS C NE2 1 ATOM 5926 N N . TYR C 1 66 ? 24.411 -23.825 -1.582 1.00 31.83 ? 374 TYR C N 1 ATOM 5927 C CA . TYR C 1 66 ? 23.562 -25.002 -1.731 1.00 31.58 ? 374 TYR C CA 1 ATOM 5928 C C . TYR C 1 66 ? 23.400 -25.349 -3.208 1.00 32.61 ? 374 TYR C C 1 ATOM 5929 O O . TYR C 1 66 ? 23.438 -26.521 -3.586 1.00 33.94 ? 374 TYR C O 1 ATOM 5930 C CB . TYR C 1 66 ? 22.186 -24.776 -1.086 1.00 31.48 ? 374 TYR C CB 1 ATOM 5931 C CG . TYR C 1 66 ? 22.177 -24.927 0.420 1.00 30.61 ? 374 TYR C CG 1 ATOM 5932 C CD1 . TYR C 1 66 ? 22.769 -26.024 1.031 1.00 31.59 ? 374 TYR C CD1 1 ATOM 5933 C CD2 . TYR C 1 66 ? 21.585 -23.967 1.232 1.00 28.96 ? 374 TYR C CD2 1 ATOM 5934 C CE1 . TYR C 1 66 ? 22.764 -26.164 2.406 1.00 31.49 ? 374 TYR C CE1 1 ATOM 5935 C CE2 . TYR C 1 66 ? 21.578 -24.099 2.603 1.00 30.06 ? 374 TYR C CE2 1 ATOM 5936 C CZ . TYR C 1 66 ? 22.168 -25.198 3.186 1.00 32.49 ? 374 TYR C CZ 1 ATOM 5937 O OH . TYR C 1 66 ? 22.163 -25.331 4.558 1.00 35.05 ? 374 TYR C OH 1 ATOM 5938 N N . LYS C 1 67 ? 23.228 -24.326 -4.044 1.00 29.59 ? 375 LYS C N 1 ATOM 5939 C CA . LYS C 1 67 ? 23.073 -24.540 -5.479 1.00 29.93 ? 375 LYS C CA 1 ATOM 5940 C C . LYS C 1 67 ? 24.352 -25.109 -6.100 1.00 31.56 ? 375 LYS C C 1 ATOM 5941 O O . LYS C 1 67 ? 24.296 -25.978 -6.971 1.00 28.26 ? 375 LYS C O 1 ATOM 5942 C CB . LYS C 1 67 ? 22.636 -23.247 -6.181 1.00 31.58 ? 375 LYS C CB 1 ATOM 5943 C CG . LYS C 1 67 ? 21.232 -22.785 -5.783 1.00 32.38 ? 375 LYS C CG 1 ATOM 5944 C CD . LYS C 1 67 ? 20.861 -21.428 -6.386 1.00 34.66 ? 375 LYS C CD 1 ATOM 5945 C CE . LYS C 1 67 ? 19.485 -20.976 -5.895 1.00 33.06 ? 375 LYS C CE 1 ATOM 5946 N NZ . LYS C 1 67 ? 19.085 -19.620 -6.384 1.00 32.62 ? 375 LYS C NZ 1 ATOM 5947 N N . GLU C 1 68 ? 25.501 -24.624 -5.640 1.00 33.82 ? 376 GLU C N 1 ATOM 5948 C CA . GLU C 1 68 ? 26.778 -25.159 -6.086 1.00 40.45 ? 376 GLU C CA 1 ATOM 5949 C C . GLU C 1 68 ? 26.904 -26.630 -5.705 1.00 40.20 ? 376 GLU C C 1 ATOM 5950 O O . GLU C 1 68 ? 27.266 -27.463 -6.535 1.00 41.00 ? 376 GLU C O 1 ATOM 5951 C CB . GLU C 1 68 ? 27.942 -24.365 -5.490 1.00 47.72 ? 376 GLU C CB 1 ATOM 5952 C CG . GLU C 1 68 ? 28.174 -23.019 -6.144 1.00 53.86 ? 376 GLU C CG 1 ATOM 5953 C CD . GLU C 1 68 ? 28.450 -23.133 -7.633 1.00 58.60 ? 376 GLU C CD 1 ATOM 5954 O OE1 . GLU C 1 68 ? 29.287 -23.976 -8.028 1.00 58.01 ? 376 GLU C OE1 1 ATOM 5955 O OE2 . GLU C 1 68 ? 27.820 -22.383 -8.410 1.00 62.18 ? 376 GLU C OE2 1 ATOM 5956 N N . ALA C 1 69 ? 26.599 -26.940 -4.449 1.00 38.24 ? 377 ALA C N 1 ATOM 5957 C CA . ALA C 1 69 ? 26.707 -28.308 -3.955 1.00 38.08 ? 377 ALA C CA 1 ATOM 5958 C C . ALA C 1 69 ? 25.895 -29.285 -4.802 1.00 36.49 ? 377 ALA C C 1 ATOM 5959 O O . ALA C 1 69 ? 26.397 -30.341 -5.191 1.00 38.12 ? 377 ALA C O 1 ATOM 5960 C CB . ALA C 1 69 ? 26.283 -28.383 -2.492 1.00 37.27 ? 377 ALA C CB 1 ATOM 5961 N N . ILE C 1 70 ? 24.650 -28.923 -5.104 1.00 36.95 ? 378 ILE C N 1 ATOM 5962 C CA . ILE C 1 70 ? 23.754 -29.832 -5.816 1.00 36.70 ? 378 ILE C CA 1 ATOM 5963 C C . ILE C 1 70 ? 24.103 -29.999 -7.293 1.00 37.19 ? 378 ILE C C 1 ATOM 5964 O O . ILE C 1 70 ? 23.744 -31.007 -7.904 1.00 38.95 ? 378 ILE C O 1 ATOM 5965 C CB . ILE C 1 70 ? 22.265 -29.434 -5.674 1.00 35.71 ? 378 ILE C CB 1 ATOM 5966 C CG1 . ILE C 1 70 ? 21.991 -28.092 -6.348 1.00 34.98 ? 378 ILE C CG1 1 ATOM 5967 C CG2 . ILE C 1 70 ? 21.862 -29.395 -4.211 1.00 35.31 ? 378 ILE C CG2 1 ATOM 5968 C CD1 . ILE C 1 70 ? 20.511 -27.749 -6.443 1.00 34.58 ? 378 ILE C CD1 1 ATOM 5969 N N . ARG C 1 71 ? 24.799 -29.020 -7.866 1.00 34.25 ? 379 ARG C N 1 ATOM 5970 C CA . ARG C 1 71 ? 25.234 -29.133 -9.251 1.00 40.57 ? 379 ARG C CA 1 ATOM 5971 C C . ARG C 1 71 ? 26.400 -30.106 -9.351 1.00 44.15 ? 379 ARG C C 1 ATOM 5972 O O . ARG C 1 71 ? 26.447 -30.950 -10.246 1.00 47.33 ? 379 ARG C O 1 ATOM 5973 C CB . ARG C 1 71 ? 25.661 -27.776 -9.813 1.00 40.22 ? 379 ARG C CB 1 ATOM 5974 C CG . ARG C 1 71 ? 26.262 -27.874 -11.205 1.00 45.27 ? 379 ARG C CG 1 ATOM 5975 C CD . ARG C 1 71 ? 26.875 -26.558 -11.650 1.00 47.89 ? 379 ARG C CD 1 ATOM 5976 N NE . ARG C 1 71 ? 27.876 -26.056 -10.712 1.00 47.97 ? 379 ARG C NE 1 ATOM 5977 C CZ . ARG C 1 71 ? 29.122 -26.508 -10.628 1.00 49.96 ? 379 ARG C CZ 1 ATOM 5978 N NH1 . ARG C 1 71 ? 29.535 -27.489 -11.418 1.00 51.15 ? 379 ARG C NH1 1 ATOM 5979 N NH2 . ARG C 1 71 ? 29.957 -25.983 -9.742 1.00 53.42 ? 379 ARG C NH2 1 ATOM 5980 N N . ILE C 1 72 ? 27.343 -29.968 -8.426 1.00 43.13 ? 380 ILE C N 1 ATOM 5981 C CA . ILE C 1 72 ? 28.526 -30.818 -8.385 1.00 40.59 ? 380 ILE C CA 1 ATOM 5982 C C . ILE C 1 72 ? 28.119 -32.261 -8.125 1.00 41.51 ? 380 ILE C C 1 ATOM 5983 O O . ILE C 1 72 ? 28.635 -33.185 -8.752 1.00 42.03 ? 380 ILE C O 1 ATOM 5984 C CB . ILE C 1 72 ? 29.493 -30.348 -7.288 1.00 41.24 ? 380 ILE C CB 1 ATOM 5985 C CG1 . ILE C 1 72 ? 29.927 -28.906 -7.554 1.00 40.98 ? 380 ILE C CG1 1 ATOM 5986 C CG2 . ILE C 1 72 ? 30.706 -31.264 -7.207 1.00 43.76 ? 380 ILE C CG2 1 ATOM 5987 C CD1 . ILE C 1 72 ? 30.771 -28.313 -6.449 1.00 43.69 ? 380 ILE C CD1 1 ATOM 5988 N N . SER C 1 73 ? 27.179 -32.442 -7.200 1.00 42.11 ? 381 SER C N 1 ATOM 5989 C CA . SER C 1 73 ? 26.647 -33.759 -6.876 1.00 44.63 ? 381 SER C CA 1 ATOM 5990 C C . SER C 1 73 ? 25.122 -33.762 -6.986 1.00 46.62 ? 381 SER C C 1 ATOM 5991 O O . SER C 1 73 ? 24.429 -33.268 -6.098 1.00 45.06 ? 381 SER C O 1 ATOM 5992 C CB . SER C 1 73 ? 27.075 -34.177 -5.468 1.00 44.69 ? 381 SER C CB 1 ATOM 5993 O OG . SER C 1 73 ? 26.519 -35.432 -5.118 1.00 43.62 ? 381 SER C OG 1 ATOM 5994 N N . PRO C 1 74 ? 24.597 -34.310 -8.091 1.00 48.95 ? 382 PRO C N 1 ATOM 5995 C CA . PRO C 1 74 ? 23.153 -34.360 -8.343 1.00 47.30 ? 382 PRO C CA 1 ATOM 5996 C C . PRO C 1 74 ? 22.410 -35.343 -7.439 1.00 47.85 ? 382 PRO C C 1 ATOM 5997 O O . PRO C 1 74 ? 21.181 -35.363 -7.458 1.00 48.95 ? 382 PRO C O 1 ATOM 5998 C CB . PRO C 1 74 ? 23.069 -34.828 -9.801 1.00 46.30 ? 382 PRO C CB 1 ATOM 5999 C CG . PRO C 1 74 ? 24.416 -34.506 -10.388 1.00 51.06 ? 382 PRO C CG 1 ATOM 6000 C CD . PRO C 1 74 ? 25.375 -34.735 -9.266 1.00 51.64 ? 382 PRO C CD 1 ATOM 6001 N N . THR C 1 75 ? 23.140 -36.143 -6.670 1.00 48.98 ? 383 THR C N 1 ATOM 6002 C CA . THR C 1 75 ? 22.523 -37.105 -5.760 1.00 49.44 ? 383 THR C CA 1 ATOM 6003 C C . THR C 1 75 ? 22.617 -36.626 -4.316 1.00 48.27 ? 383 THR C C 1 ATOM 6004 O O . THR C 1 75 ? 22.309 -37.369 -3.384 1.00 51.15 ? 383 THR C O 1 ATOM 6005 C CB . THR C 1 75 ? 23.187 -38.502 -5.860 1.00 55.36 ? 383 THR C CB 1 ATOM 6006 O OG1 . THR C 1 75 ? 24.583 -38.399 -5.550 1.00 57.14 ? 383 THR C OG1 1 ATOM 6007 C CG2 . THR C 1 75 ? 23.023 -39.084 -7.255 1.00 54.97 ? 383 THR C CG2 1 ATOM 6008 N N . PHE C 1 76 ? 23.051 -35.381 -4.139 1.00 44.58 ? 384 PHE C N 1 ATOM 6009 C CA . PHE C 1 76 ? 23.274 -34.823 -2.809 1.00 40.46 ? 384 PHE C CA 1 ATOM 6010 C C . PHE C 1 76 ? 21.936 -34.488 -2.147 1.00 34.71 ? 384 PHE C C 1 ATOM 6011 O O . PHE C 1 76 ? 21.544 -33.320 -2.062 1.00 30.75 ? 384 PHE C O 1 ATOM 6012 C CB . PHE C 1 76 ? 24.153 -33.574 -2.909 1.00 38.09 ? 384 PHE C CB 1 ATOM 6013 C CG . PHE C 1 76 ? 24.937 -33.272 -1.665 1.00 36.85 ? 384 PHE C CG 1 ATOM 6014 C CD1 . PHE C 1 76 ? 25.930 -32.307 -1.682 1.00 36.75 ? 384 PHE C CD1 1 ATOM 6015 C CD2 . PHE C 1 76 ? 24.691 -33.952 -0.481 1.00 37.07 ? 384 PHE C CD2 1 ATOM 6016 C CE1 . PHE C 1 76 ? 26.655 -32.018 -0.544 1.00 39.08 ? 384 PHE C CE1 1 ATOM 6017 C CE2 . PHE C 1 76 ? 25.411 -33.668 0.664 1.00 36.76 ? 384 PHE C CE2 1 ATOM 6018 C CZ . PHE C 1 76 ? 26.394 -32.701 0.633 1.00 40.36 ? 384 PHE C CZ 1 ATOM 6019 N N . ALA C 1 77 ? 21.242 -35.521 -1.678 1.00 30.50 ? 385 ALA C N 1 ATOM 6020 C CA . ALA C 1 77 ? 19.911 -35.346 -1.107 1.00 27.86 ? 385 ALA C CA 1 ATOM 6021 C C . ALA C 1 77 ? 19.932 -34.435 0.115 1.00 27.08 ? 385 ALA C C 1 ATOM 6022 O O . ALA C 1 77 ? 19.020 -33.628 0.315 1.00 23.69 ? 385 ALA C O 1 ATOM 6023 C CB . ALA C 1 77 ? 19.301 -36.698 -0.758 1.00 29.89 ? 385 ALA C CB 1 ATOM 6024 N N . ASP C 1 78 ? 20.978 -34.567 0.926 1.00 30.50 ? 386 ASP C N 1 ATOM 6025 C CA . ASP C 1 78 ? 21.098 -33.793 2.162 1.00 32.08 ? 386 ASP C CA 1 ATOM 6026 C C . ASP C 1 78 ? 21.146 -32.298 1.857 1.00 30.40 ? 386 ASP C C 1 ATOM 6027 O O . ASP C 1 78 ? 20.609 -31.481 2.606 1.00 29.37 ? 386 ASP C O 1 ATOM 6028 C CB . ASP C 1 78 ? 22.351 -34.222 2.930 1.00 39.65 ? 386 ASP C CB 1 ATOM 6029 C CG . ASP C 1 78 ? 22.333 -33.762 4.378 1.00 48.69 ? 386 ASP C CG 1 ATOM 6030 O OD1 . ASP C 1 78 ? 21.392 -34.135 5.113 1.00 51.94 ? 386 ASP C OD1 1 ATOM 6031 O OD2 . ASP C 1 78 ? 23.262 -33.028 4.782 1.00 52.51 ? 386 ASP C OD2 1 ATOM 6032 N N . ALA C 1 79 ? 21.782 -31.949 0.742 1.00 30.02 ? 387 ALA C N 1 ATOM 6033 C CA . ALA C 1 79 ? 21.894 -30.555 0.330 1.00 28.76 ? 387 ALA C CA 1 ATOM 6034 C C . ALA C 1 79 ? 20.552 -30.006 -0.140 1.00 27.30 ? 387 ALA C C 1 ATOM 6035 O O . ALA C 1 79 ? 20.194 -28.874 0.186 1.00 26.74 ? 387 ALA C O 1 ATOM 6036 C CB . ALA C 1 79 ? 22.948 -30.399 -0.754 1.00 30.38 ? 387 ALA C CB 1 ATOM 6037 N N . TYR C 1 80 ? 19.816 -30.806 -0.908 1.00 24.25 ? 388 TYR C N 1 ATOM 6038 C CA . TYR C 1 80 ? 18.463 -30.432 -1.312 1.00 23.47 ? 388 TYR C CA 1 ATOM 6039 C C . TYR C 1 80 ? 17.584 -30.173 -0.094 1.00 22.55 ? 388 TYR C C 1 ATOM 6040 O O . TYR C 1 80 ? 16.828 -29.199 -0.054 1.00 22.37 ? 388 TYR C O 1 ATOM 6041 C CB . TYR C 1 80 ? 17.831 -31.518 -2.186 1.00 24.68 ? 388 TYR C CB 1 ATOM 6042 C CG . TYR C 1 80 ? 18.096 -31.344 -3.663 1.00 25.95 ? 388 TYR C CG 1 ATOM 6043 C CD1 . TYR C 1 80 ? 17.440 -30.362 -4.395 1.00 27.05 ? 388 TYR C CD1 1 ATOM 6044 C CD2 . TYR C 1 80 ? 18.992 -32.171 -4.330 1.00 27.03 ? 388 TYR C CD2 1 ATOM 6045 C CE1 . TYR C 1 80 ? 17.682 -30.202 -5.752 1.00 27.93 ? 388 TYR C CE1 1 ATOM 6046 C CE2 . TYR C 1 80 ? 19.234 -32.019 -5.680 1.00 30.20 ? 388 TYR C CE2 1 ATOM 6047 C CZ . TYR C 1 80 ? 18.575 -31.037 -6.387 1.00 31.03 ? 388 TYR C CZ 1 ATOM 6048 O OH . TYR C 1 80 ? 18.828 -30.887 -7.736 1.00 37.40 ? 388 TYR C OH 1 ATOM 6049 N N . SER C 1 81 ? 17.698 -31.042 0.907 1.00 22.54 ? 389 SER C N 1 ATOM 6050 C CA . SER C 1 81 ? 16.885 -30.919 2.106 1.00 23.22 ? 389 SER C CA 1 ATOM 6051 C C . SER C 1 81 ? 17.244 -29.638 2.849 1.00 26.68 ? 389 SER C C 1 ATOM 6052 O O . SER C 1 81 ? 16.366 -28.859 3.226 1.00 25.58 ? 389 SER C O 1 ATOM 6053 C CB . SER C 1 81 ? 17.084 -32.132 3.016 1.00 28.42 ? 389 SER C CB 1 ATOM 6054 O OG . SER C 1 81 ? 16.254 -32.053 4.168 1.00 29.08 ? 389 SER C OG 1 ATOM 6055 N N . ASN C 1 82 ? 18.540 -29.415 3.046 1.00 27.55 ? 390 ASN C N 1 ATOM 6056 C CA . ASN C 1 82 ? 18.985 -28.233 3.765 1.00 28.84 ? 390 ASN C CA 1 ATOM 6057 C C . ASN C 1 82 ? 18.678 -26.948 3.012 1.00 25.75 ? 390 ASN C C 1 ATOM 6058 O O . ASN C 1 82 ? 18.382 -25.920 3.622 1.00 26.18 ? 390 ASN C O 1 ATOM 6059 C CB . ASN C 1 82 ? 20.468 -28.333 4.126 1.00 30.42 ? 390 ASN C CB 1 ATOM 6060 C CG . ASN C 1 82 ? 20.699 -29.152 5.383 1.00 35.79 ? 390 ASN C CG 1 ATOM 6061 O OD1 . ASN C 1 82 ? 19.876 -29.144 6.298 1.00 37.36 ? 390 ASN C OD1 1 ATOM 6062 N ND2 . ASN C 1 82 ? 21.817 -29.864 5.434 1.00 40.69 ? 390 ASN C ND2 1 ATOM 6063 N N . MET C 1 83 ? 18.730 -27.015 1.686 1.00 24.74 ? 391 MET C N 1 ATOM 6064 C CA . MET C 1 83 ? 18.367 -25.873 0.860 1.00 23.65 ? 391 MET C CA 1 ATOM 6065 C C . MET C 1 83 ? 16.884 -25.565 1.052 1.00 22.93 ? 391 MET C C 1 ATOM 6066 O O . MET C 1 83 ? 16.484 -24.406 1.096 1.00 24.55 ? 391 MET C O 1 ATOM 6067 C CB . MET C 1 83 ? 18.689 -26.142 -0.610 1.00 22.62 ? 391 MET C CB 1 ATOM 6068 C CG . MET C 1 83 ? 18.459 -24.949 -1.535 1.00 23.48 ? 391 MET C CG 1 ATOM 6069 S SD . MET C 1 83 ? 18.858 -25.322 -3.250 1.00 31.56 ? 391 MET C SD 1 ATOM 6070 C CE . MET C 1 83 ? 17.941 -24.026 -4.083 1.00 35.17 ? 391 MET C CE 1 ATOM 6071 N N . GLY C 1 84 ? 16.075 -26.613 1.186 1.00 21.31 ? 392 GLY C N 1 ATOM 6072 C CA . GLY C 1 84 ? 14.659 -26.445 1.457 1.00 22.01 ? 392 GLY C CA 1 ATOM 6073 C C . GLY C 1 84 ? 14.435 -25.694 2.760 1.00 21.78 ? 392 GLY C C 1 ATOM 6074 O O . GLY C 1 84 ? 13.582 -24.806 2.830 1.00 22.14 ? 392 GLY C O 1 ATOM 6075 N N . ASN C 1 85 ? 15.209 -26.046 3.786 1.00 21.36 ? 393 ASN C N 1 ATOM 6076 C CA . ASN C 1 85 ? 15.159 -25.354 5.073 1.00 23.55 ? 393 ASN C CA 1 ATOM 6077 C C . ASN C 1 85 ? 15.443 -23.862 4.933 1.00 25.26 ? 393 ASN C C 1 ATOM 6078 O O . ASN C 1 85 ? 14.792 -23.038 5.572 1.00 27.76 ? 393 ASN C O 1 ATOM 6079 C CB . ASN C 1 85 ? 16.149 -25.972 6.062 1.00 24.48 ? 393 ASN C CB 1 ATOM 6080 C CG . ASN C 1 85 ? 15.700 -27.332 6.566 1.00 30.38 ? 393 ASN C CG 1 ATOM 6081 O OD1 . ASN C 1 85 ? 14.537 -27.708 6.415 1.00 31.18 ? 393 ASN C OD1 1 ATOM 6082 N ND2 . ASN C 1 85 ? 16.618 -28.070 7.178 1.00 31.40 ? 393 ASN C ND2 1 ATOM 6083 N N . THR C 1 86 ? 16.425 -23.523 4.104 1.00 23.32 ? 394 THR C N 1 ATOM 6084 C CA . THR C 1 86 ? 16.767 -22.125 3.858 1.00 24.41 ? 394 THR C CA 1 ATOM 6085 C C . THR C 1 86 ? 15.627 -21.381 3.147 1.00 23.95 ? 394 THR C C 1 ATOM 6086 O O . THR C 1 86 ? 15.280 -20.263 3.524 1.00 26.90 ? 394 THR C O 1 ATOM 6087 C CB . THR C 1 86 ? 18.080 -22.004 3.059 1.00 27.71 ? 394 THR C CB 1 ATOM 6088 O OG1 . THR C 1 86 ? 19.151 -22.559 3.832 1.00 29.89 ? 394 THR C OG1 1 ATOM 6089 C CG2 . THR C 1 86 ? 18.392 -20.544 2.746 1.00 28.30 ? 394 THR C CG2 1 ATOM 6090 N N . LEU C 1 87 ? 15.028 -22.012 2.142 1.00 22.72 ? 395 LEU C N 1 ATOM 6091 C CA . LEU C 1 87 ? 13.914 -21.397 1.417 1.00 21.54 ? 395 LEU C CA 1 ATOM 6092 C C . LEU C 1 87 ? 12.694 -21.207 2.309 1.00 23.53 ? 395 LEU C C 1 ATOM 6093 O O . LEU C 1 87 ? 11.991 -20.198 2.207 1.00 25.54 ? 395 LEU C O 1 ATOM 6094 C CB . LEU C 1 87 ? 13.540 -22.222 0.187 1.00 18.47 ? 395 LEU C CB 1 ATOM 6095 C CG . LEU C 1 87 ? 14.576 -22.237 -0.946 1.00 22.00 ? 395 LEU C CG 1 ATOM 6096 C CD1 . LEU C 1 87 ? 14.121 -23.117 -2.109 1.00 23.41 ? 395 LEU C CD1 1 ATOM 6097 C CD2 . LEU C 1 87 ? 14.874 -20.824 -1.427 1.00 22.99 ? 395 LEU C CD2 1 ATOM 6098 N N . LYS C 1 88 ? 12.443 -22.186 3.173 1.00 21.85 ? 396 LYS C N 1 ATOM 6099 C CA . LYS C 1 88 ? 11.381 -22.082 4.167 1.00 22.61 ? 396 LYS C CA 1 ATOM 6100 C C . LYS C 1 88 ? 11.578 -20.827 5.021 1.00 25.26 ? 396 LYS C C 1 ATOM 6101 O O . LYS C 1 88 ? 10.635 -20.073 5.268 1.00 25.50 ? 396 LYS C O 1 ATOM 6102 C CB . LYS C 1 88 ? 11.354 -23.340 5.043 1.00 23.86 ? 396 LYS C CB 1 ATOM 6103 C CG . LYS C 1 88 ? 10.229 -23.390 6.074 1.00 27.61 ? 396 LYS C CG 1 ATOM 6104 C CD . LYS C 1 88 ? 10.331 -24.659 6.926 1.00 32.26 ? 396 LYS C CD 1 ATOM 6105 C CE . LYS C 1 88 ? 9.278 -24.706 8.031 1.00 40.14 ? 396 LYS C CE 1 ATOM 6106 N NZ . LYS C 1 88 ? 7.901 -24.947 7.508 1.00 42.49 ? 396 LYS C NZ 1 ATOM 6107 N N . GLU C 1 89 ? 12.812 -20.599 5.454 1.00 26.94 ? 397 GLU C N 1 ATOM 6108 C CA . GLU C 1 89 ? 13.130 -19.454 6.304 1.00 30.03 ? 397 GLU C CA 1 ATOM 6109 C C . GLU C 1 89 ? 13.049 -18.120 5.546 1.00 29.72 ? 397 GLU C C 1 ATOM 6110 O O . GLU C 1 89 ? 12.827 -17.068 6.149 1.00 30.37 ? 397 GLU C O 1 ATOM 6111 C CB . GLU C 1 89 ? 14.511 -19.635 6.934 1.00 36.12 ? 397 GLU C CB 1 ATOM 6112 C CG . GLU C 1 89 ? 14.851 -18.611 7.998 1.00 44.13 ? 397 GLU C CG 1 ATOM 6113 C CD . GLU C 1 89 ? 16.114 -18.964 8.759 1.00 48.00 ? 397 GLU C CD 1 ATOM 6114 O OE1 . GLU C 1 89 ? 16.588 -20.115 8.624 1.00 47.30 ? 397 GLU C OE1 1 ATOM 6115 O OE2 . GLU C 1 89 ? 16.631 -18.089 9.489 1.00 50.05 ? 397 GLU C OE2 1 ATOM 6116 N N . MET C 1 90 ? 13.231 -18.169 4.227 1.00 26.45 ? 398 MET C N 1 ATOM 6117 C CA . MET C 1 90 ? 13.062 -16.992 3.374 1.00 29.04 ? 398 MET C CA 1 ATOM 6118 C C . MET C 1 90 ? 11.599 -16.804 2.976 1.00 28.68 ? 398 MET C C 1 ATOM 6119 O O . MET C 1 90 ? 11.270 -15.903 2.199 1.00 30.27 ? 398 MET C O 1 ATOM 6120 C CB . MET C 1 90 ? 13.905 -17.127 2.103 1.00 28.36 ? 398 MET C CB 1 ATOM 6121 C CG . MET C 1 90 ? 15.395 -17.229 2.345 1.00 29.96 ? 398 MET C CG 1 ATOM 6122 S SD . MET C 1 90 ? 16.306 -17.593 0.831 1.00 34.24 ? 398 MET C SD 1 ATOM 6123 C CE . MET C 1 90 ? 16.006 -16.107 -0.125 1.00 44.39 ? 398 MET C CE 1 ATOM 6124 N N . GLN C 1 91 ? 10.742 -17.675 3.500 1.00 27.60 ? 399 GLN C N 1 ATOM 6125 C CA . GLN C 1 91 ? 9.299 -17.669 3.239 1.00 32.70 ? 399 GLN C CA 1 ATOM 6126 C C . GLN C 1 91 ? 8.922 -18.094 1.818 1.00 32.94 ? 399 GLN C C 1 ATOM 6127 O O . GLN C 1 91 ? 7.820 -17.806 1.345 1.00 34.50 ? 399 GLN C O 1 ATOM 6128 C CB . GLN C 1 91 ? 8.654 -16.327 3.622 1.00 38.08 ? 399 GLN C CB 1 ATOM 6129 C CG . GLN C 1 91 ? 8.836 -15.968 5.089 1.00 46.44 ? 399 GLN C CG 1 ATOM 6130 C CD . GLN C 1 91 ? 8.086 -14.711 5.496 1.00 54.98 ? 399 GLN C CD 1 ATOM 6131 O OE1 . GLN C 1 91 ? 7.456 -14.048 4.669 1.00 57.32 ? 399 GLN C OE1 1 ATOM 6132 N NE2 . GLN C 1 91 ? 8.152 -14.377 6.781 1.00 57.87 ? 399 GLN C NE2 1 ATOM 6133 N N . ASP C 1 92 ? 9.833 -18.799 1.151 1.00 26.90 ? 400 ASP C N 1 ATOM 6134 C CA . ASP C 1 92 ? 9.524 -19.402 -0.134 1.00 26.84 ? 400 ASP C CA 1 ATOM 6135 C C . ASP C 1 92 ? 9.069 -20.827 0.124 1.00 25.87 ? 400 ASP C C 1 ATOM 6136 O O . ASP C 1 92 ? 9.874 -21.760 0.097 1.00 23.51 ? 400 ASP C O 1 ATOM 6137 C CB . ASP C 1 92 ? 10.745 -19.385 -1.065 1.00 27.09 ? 400 ASP C CB 1 ATOM 6138 C CG . ASP C 1 92 ? 10.466 -20.031 -2.417 1.00 30.52 ? 400 ASP C CG 1 ATOM 6139 O OD1 . ASP C 1 92 ? 9.287 -20.328 -2.713 1.00 30.68 ? 400 ASP C OD1 1 ATOM 6140 O OD2 . ASP C 1 92 ? 11.429 -20.239 -3.194 1.00 27.69 ? 400 ASP C OD2 1 ATOM 6141 N N . VAL C 1 93 ? 7.771 -20.980 0.364 1.00 24.54 ? 401 VAL C N 1 ATOM 6142 C CA . VAL C 1 93 ? 7.198 -22.254 0.775 1.00 27.75 ? 401 VAL C CA 1 ATOM 6143 C C . VAL C 1 93 ? 7.146 -23.266 -0.358 1.00 25.50 ? 401 VAL C C 1 ATOM 6144 O O . VAL C 1 93 ? 7.468 -24.435 -0.156 1.00 27.71 ? 401 VAL C O 1 ATOM 6145 C CB . VAL C 1 93 ? 5.785 -22.066 1.385 1.00 40.73 ? 401 VAL C CB 1 ATOM 6146 C CG1 . VAL C 1 93 ? 5.072 -23.398 1.514 1.00 42.10 ? 401 VAL C CG1 1 ATOM 6147 C CG2 . VAL C 1 93 ? 5.888 -21.370 2.738 1.00 43.16 ? 401 VAL C CG2 1 ATOM 6148 N N . GLN C 1 94 ? 6.740 -22.822 -1.544 1.00 26.06 ? 402 GLN C N 1 ATOM 6149 C CA . GLN C 1 94 ? 6.693 -23.710 -2.705 1.00 28.81 ? 402 GLN C CA 1 ATOM 6150 C C . GLN C 1 94 ? 8.087 -24.229 -3.020 1.00 27.38 ? 402 GLN C C 1 ATOM 6151 O O . GLN C 1 94 ? 8.267 -25.412 -3.318 1.00 29.83 ? 402 GLN C O 1 ATOM 6152 C CB . GLN C 1 94 ? 6.128 -23.003 -3.934 1.00 35.95 ? 402 GLN C CB 1 ATOM 6153 C CG . GLN C 1 94 ? 4.617 -22.872 -3.963 1.00 44.64 ? 402 GLN C CG 1 ATOM 6154 C CD . GLN C 1 94 ? 4.113 -22.335 -5.293 1.00 51.02 ? 402 GLN C CD 1 ATOM 6155 O OE1 . GLN C 1 94 ? 4.581 -22.743 -6.358 1.00 51.89 ? 402 GLN C OE1 1 ATOM 6156 N NE2 . GLN C 1 94 ? 3.164 -21.407 -5.236 1.00 54.18 ? 402 GLN C NE2 1 ATOM 6157 N N . GLY C 1 95 ? 9.064 -23.332 -2.951 1.00 28.60 ? 403 GLY C N 1 ATOM 6158 C CA . GLY C 1 95 ? 10.446 -23.674 -3.233 1.00 26.43 ? 403 GLY C CA 1 ATOM 6159 C C . GLY C 1 95 ? 10.963 -24.712 -2.262 1.00 23.88 ? 403 GLY C C 1 ATOM 6160 O O . GLY C 1 95 ? 11.588 -25.694 -2.669 1.00 23.34 ? 403 GLY C O 1 ATOM 6161 N N . ALA C 1 96 ? 10.698 -24.495 -0.976 1.00 23.64 ? 404 ALA C N 1 ATOM 6162 C CA . ALA C 1 96 ? 11.107 -25.440 0.056 1.00 23.20 ? 404 ALA C CA 1 ATOM 6163 C C . ALA C 1 96 ? 10.502 -26.802 -0.231 1.00 23.49 ? 404 ALA C C 1 ATOM 6164 O O . ALA C 1 96 ? 11.193 -27.818 -0.198 1.00 20.59 ? 404 ALA C O 1 ATOM 6165 C CB . ALA C 1 96 ? 10.690 -24.950 1.443 1.00 20.77 ? 404 ALA C CB 1 ATOM 6166 N N . LEU C 1 97 ? 9.210 -26.817 -0.538 1.00 21.94 ? 405 LEU C N 1 ATOM 6167 C CA . LEU C 1 97 ? 8.532 -28.071 -0.848 1.00 24.88 ? 405 LEU C CA 1 ATOM 6168 C C . LEU C 1 97 ? 9.171 -28.771 -2.042 1.00 21.62 ? 405 LEU C C 1 ATOM 6169 O O . LEU C 1 97 ? 9.326 -29.991 -2.033 1.00 22.03 ? 405 LEU C O 1 ATOM 6170 C CB . LEU C 1 97 ? 7.037 -27.844 -1.099 1.00 30.72 ? 405 LEU C CB 1 ATOM 6171 C CG . LEU C 1 97 ? 6.174 -29.113 -1.082 1.00 36.93 ? 405 LEU C CG 1 ATOM 6172 C CD1 . LEU C 1 97 ? 4.800 -28.801 -0.536 1.00 39.05 ? 405 LEU C CD1 1 ATOM 6173 C CD2 . LEU C 1 97 ? 6.060 -29.737 -2.469 1.00 39.50 ? 405 LEU C CD2 1 ATOM 6174 N N . GLN C 1 98 ? 9.538 -28.007 -3.069 1.00 23.48 ? 406 GLN C N 1 ATOM 6175 C CA . GLN C 1 98 ? 10.193 -28.587 -4.242 1.00 23.53 ? 406 GLN C CA 1 ATOM 6176 C C . GLN C 1 98 ? 11.510 -29.260 -3.866 1.00 21.70 ? 406 GLN C C 1 ATOM 6177 O O . GLN C 1 98 ? 11.797 -30.366 -4.320 1.00 22.46 ? 406 GLN C O 1 ATOM 6178 C CB . GLN C 1 98 ? 10.444 -27.537 -5.336 1.00 29.30 ? 406 GLN C CB 1 ATOM 6179 C CG . GLN C 1 98 ? 9.192 -26.899 -5.915 1.00 32.75 ? 406 GLN C CG 1 ATOM 6180 C CD . GLN C 1 98 ? 8.074 -27.899 -6.156 1.00 37.59 ? 406 GLN C CD 1 ATOM 6181 O OE1 . GLN C 1 98 ? 8.290 -28.972 -6.726 1.00 37.04 ? 406 GLN C OE1 1 ATOM 6182 N NE2 . GLN C 1 98 ? 6.867 -27.549 -5.716 1.00 38.66 ? 406 GLN C NE2 1 ATOM 6183 N N . CYS C 1 99 ? 12.302 -28.588 -3.033 1.00 18.98 ? 407 CYS C N 1 ATOM 6184 C CA . CYS C 1 99 ? 13.553 -29.160 -2.538 1.00 19.82 ? 407 CYS C CA 1 ATOM 6185 C C . CYS C 1 99 ? 13.350 -30.441 -1.746 1.00 18.61 ? 407 CYS C C 1 ATOM 6186 O O . CYS C 1 99 ? 14.062 -31.418 -1.961 1.00 23.23 ? 407 CYS C O 1 ATOM 6187 C CB . CYS C 1 99 ? 14.320 -28.156 -1.674 1.00 19.89 ? 407 CYS C CB 1 ATOM 6188 S SG . CYS C 1 99 ? 14.998 -26.732 -2.565 1.00 25.10 ? 407 CYS C SG 1 ATOM 6189 N N . TYR C 1 100 ? 12.413 -30.432 -0.801 1.00 19.08 ? 408 TYR C N 1 ATOM 6190 C CA . TYR C 1 100 ? 12.177 -31.622 0.014 1.00 19.82 ? 408 TYR C CA 1 ATOM 6191 C C . TYR C 1 100 ? 11.721 -32.774 -0.875 1.00 19.96 ? 408 TYR C C 1 ATOM 6192 O O . TYR C 1 100 ? 12.135 -33.922 -0.689 1.00 20.33 ? 408 TYR C O 1 ATOM 6193 C CB . TYR C 1 100 ? 11.124 -31.361 1.090 1.00 21.14 ? 408 TYR C CB 1 ATOM 6194 C CG . TYR C 1 100 ? 11.468 -30.286 2.103 1.00 18.96 ? 408 TYR C CG 1 ATOM 6195 C CD1 . TYR C 1 100 ? 12.756 -30.157 2.622 1.00 21.04 ? 408 TYR C CD1 1 ATOM 6196 C CD2 . TYR C 1 100 ? 10.497 -29.403 2.544 1.00 17.85 ? 408 TYR C CD2 1 ATOM 6197 C CE1 . TYR C 1 100 ? 13.055 -29.170 3.553 1.00 20.32 ? 408 TYR C CE1 1 ATOM 6198 C CE2 . TYR C 1 100 ? 10.785 -28.422 3.478 1.00 17.77 ? 408 TYR C CE2 1 ATOM 6199 C CZ . TYR C 1 100 ? 12.059 -28.310 3.979 1.00 21.68 ? 408 TYR C CZ 1 ATOM 6200 O OH . TYR C 1 100 ? 12.321 -27.326 4.910 1.00 25.43 ? 408 TYR C OH 1 ATOM 6201 N N . THR C 1 101 ? 10.876 -32.454 -1.850 1.00 19.02 ? 409 THR C N 1 ATOM 6202 C CA . THR C 1 101 ? 10.389 -33.443 -2.807 1.00 17.12 ? 409 THR C CA 1 ATOM 6203 C C . THR C 1 101 ? 11.528 -34.070 -3.605 1.00 19.82 ? 409 THR C C 1 ATOM 6204 O O . THR C 1 101 ? 11.560 -35.284 -3.808 1.00 20.99 ? 409 THR C O 1 ATOM 6205 C CB . THR C 1 101 ? 9.353 -32.826 -3.771 1.00 19.05 ? 409 THR C CB 1 ATOM 6206 O OG1 . THR C 1 101 ? 8.276 -32.257 -3.014 1.00 24.52 ? 409 THR C OG1 1 ATOM 6207 C CG2 . THR C 1 101 ? 8.797 -33.886 -4.713 1.00 25.88 ? 409 THR C CG2 1 ATOM 6208 N N . ARG C 1 102 ? 12.458 -33.243 -4.070 1.00 22.61 ? 410 ARG C N 1 ATOM 6209 C CA . ARG C 1 102 ? 13.623 -33.759 -4.785 1.00 20.78 ? 410 ARG C CA 1 ATOM 6210 C C . ARG C 1 102 ? 14.450 -34.659 -3.873 1.00 21.34 ? 410 ARG C C 1 ATOM 6211 O O . ARG C 1 102 ? 14.915 -35.712 -4.297 1.00 23.27 ? 410 ARG C O 1 ATOM 6212 C CB . ARG C 1 102 ? 14.487 -32.622 -5.346 1.00 22.52 ? 410 ARG C CB 1 ATOM 6213 C CG . ARG C 1 102 ? 13.935 -31.986 -6.605 1.00 22.65 ? 410 ARG C CG 1 ATOM 6214 C CD . ARG C 1 102 ? 13.816 -33.012 -7.724 1.00 26.14 ? 410 ARG C CD 1 ATOM 6215 N NE . ARG C 1 102 ? 15.121 -33.422 -8.239 1.00 26.27 ? 410 ARG C NE 1 ATOM 6216 C CZ . ARG C 1 102 ? 15.523 -34.687 -8.362 1.00 25.94 ? 410 ARG C CZ 1 ATOM 6217 N NH1 . ARG C 1 102 ? 14.725 -35.685 -8.008 1.00 23.98 ? 410 ARG C NH1 1 ATOM 6218 N NH2 . ARG C 1 102 ? 16.726 -34.952 -8.852 1.00 26.07 ? 410 ARG C NH2 1 ATOM 6219 N N . ALA C 1 103 ? 14.621 -34.250 -2.620 1.00 19.84 ? 411 ALA C N 1 ATOM 6220 C CA . ALA C 1 103 ? 15.390 -35.045 -1.667 1.00 22.44 ? 411 ALA C CA 1 ATOM 6221 C C . ALA C 1 103 ? 14.823 -36.459 -1.511 1.00 23.28 ? 411 ALA C C 1 ATOM 6222 O O . ALA C 1 103 ? 15.564 -37.441 -1.534 1.00 25.05 ? 411 ALA C O 1 ATOM 6223 C CB . ALA C 1 103 ? 15.447 -34.342 -0.319 1.00 20.52 ? 411 ALA C CB 1 ATOM 6224 N N . ILE C 1 104 ? 13.503 -36.544 -1.357 1.00 23.31 ? 412 ILE C N 1 ATOM 6225 C CA . ILE C 1 104 ? 12.803 -37.813 -1.161 1.00 21.03 ? 412 ILE C CA 1 ATOM 6226 C C . ILE C 1 104 ? 12.844 -38.675 -2.430 1.00 26.49 ? 412 ILE C C 1 ATOM 6227 O O . ILE C 1 104 ? 12.897 -39.906 -2.367 1.00 29.34 ? 412 ILE C O 1 ATOM 6228 C CB . ILE C 1 104 ? 11.346 -37.549 -0.695 1.00 30.52 ? 412 ILE C CB 1 ATOM 6229 C CG1 . ILE C 1 104 ? 11.345 -37.047 0.758 1.00 29.26 ? 412 ILE C CG1 1 ATOM 6230 C CG2 . ILE C 1 104 ? 10.482 -38.796 -0.833 1.00 33.56 ? 412 ILE C CG2 1 ATOM 6231 C CD1 . ILE C 1 104 ? 10.061 -36.333 1.181 1.00 28.97 ? 412 ILE C CD1 1 ATOM 6232 N N . GLN C 1 105 ? 12.853 -38.024 -3.585 1.00 24.63 ? 413 GLN C N 1 ATOM 6233 C CA . GLN C 1 105 ? 12.946 -38.740 -4.850 1.00 27.44 ? 413 GLN C CA 1 ATOM 6234 C C . GLN C 1 105 ? 14.334 -39.346 -5.031 1.00 30.69 ? 413 GLN C C 1 ATOM 6235 O O . GLN C 1 105 ? 14.476 -40.477 -5.496 1.00 32.46 ? 413 GLN C O 1 ATOM 6236 C CB . GLN C 1 105 ? 12.625 -37.807 -6.014 1.00 25.49 ? 413 GLN C CB 1 ATOM 6237 C CG . GLN C 1 105 ? 11.155 -37.436 -6.136 1.00 31.17 ? 413 GLN C CG 1 ATOM 6238 C CD . GLN C 1 105 ? 10.875 -36.613 -7.386 1.00 32.86 ? 413 GLN C CD 1 ATOM 6239 O OE1 . GLN C 1 105 ? 11.724 -35.846 -7.839 1.00 33.31 ? 413 GLN C OE1 1 ATOM 6240 N NE2 . GLN C 1 105 ? 9.685 -36.779 -7.954 1.00 33.12 ? 413 GLN C NE2 1 ATOM 6241 N N . ILE C 1 106 ? 15.356 -38.585 -4.656 1.00 28.41 ? 414 ILE C N 1 ATOM 6242 C CA . ILE C 1 106 ? 16.731 -39.057 -4.720 1.00 30.57 ? 414 ILE C CA 1 ATOM 6243 C C . ILE C 1 106 ? 16.968 -40.188 -3.721 1.00 32.48 ? 414 ILE C C 1 ATOM 6244 O O . ILE C 1 106 ? 17.621 -41.184 -4.034 1.00 32.36 ? 414 ILE C O 1 ATOM 6245 C CB . ILE C 1 106 ? 17.718 -37.901 -4.459 1.00 31.09 ? 414 ILE C CB 1 ATOM 6246 C CG1 . ILE C 1 106 ? 17.574 -36.834 -5.549 1.00 25.83 ? 414 ILE C CG1 1 ATOM 6247 C CG2 . ILE C 1 106 ? 19.151 -38.419 -4.410 1.00 30.97 ? 414 ILE C CG2 1 ATOM 6248 C CD1 . ILE C 1 106 ? 18.331 -35.563 -5.264 1.00 26.10 ? 414 ILE C CD1 1 ATOM 6249 N N . ASN C 1 107 ? 16.423 -40.029 -2.522 1.00 32.88 ? 415 ASN C N 1 ATOM 6250 C CA . ASN C 1 107 ? 16.560 -41.024 -1.470 1.00 34.12 ? 415 ASN C CA 1 ATOM 6251 C C . ASN C 1 107 ? 15.252 -41.176 -0.702 1.00 31.78 ? 415 ASN C C 1 ATOM 6252 O O . ASN C 1 107 ? 14.999 -40.433 0.243 1.00 29.41 ? 415 ASN C O 1 ATOM 6253 C CB . ASN C 1 107 ? 17.701 -40.632 -0.526 1.00 35.21 ? 415 ASN C CB 1 ATOM 6254 C CG . ASN C 1 107 ? 17.904 -41.628 0.606 1.00 36.66 ? 415 ASN C CG 1 ATOM 6255 O OD1 . ASN C 1 107 ? 17.210 -42.642 0.701 1.00 36.64 ? 415 ASN C OD1 1 ATOM 6256 N ND2 . ASN C 1 107 ? 18.871 -41.341 1.473 1.00 37.46 ? 415 ASN C ND2 1 ATOM 6257 N N . PRO C 1 108 ? 14.419 -42.150 -1.102 1.00 34.72 ? 416 PRO C N 1 ATOM 6258 C CA . PRO C 1 108 ? 13.115 -42.390 -0.467 1.00 34.65 ? 416 PRO C CA 1 ATOM 6259 C C . PRO C 1 108 ? 13.238 -42.719 1.018 1.00 36.06 ? 416 PRO C C 1 ATOM 6260 O O . PRO C 1 108 ? 12.272 -42.557 1.761 1.00 36.30 ? 416 PRO C O 1 ATOM 6261 C CB . PRO C 1 108 ? 12.574 -43.604 -1.226 1.00 39.43 ? 416 PRO C CB 1 ATOM 6262 C CG . PRO C 1 108 ? 13.289 -43.583 -2.546 1.00 38.45 ? 416 PRO C CG 1 ATOM 6263 C CD . PRO C 1 108 ? 14.659 -43.065 -2.232 1.00 36.72 ? 416 PRO C CD 1 ATOM 6264 N N . ALA C 1 109 ? 14.414 -43.169 1.441 1.00 36.25 ? 417 ALA C N 1 ATOM 6265 C CA . ALA C 1 109 ? 14.626 -43.569 2.825 1.00 33.54 ? 417 ALA C CA 1 ATOM 6266 C C . ALA C 1 109 ? 15.131 -42.419 3.685 1.00 30.56 ? 417 ALA C C 1 ATOM 6267 O O . ALA C 1 109 ? 15.548 -42.631 4.819 1.00 33.93 ? 417 ALA C O 1 ATOM 6268 C CB . ALA C 1 109 ? 15.603 -44.737 2.887 1.00 33.43 ? 417 ALA C CB 1 ATOM 6269 N N . PHE C 1 110 ? 15.099 -41.207 3.141 1.00 25.61 ? 418 PHE C N 1 ATOM 6270 C CA . PHE C 1 110 ? 15.616 -40.032 3.839 1.00 26.68 ? 418 PHE C CA 1 ATOM 6271 C C . PHE C 1 110 ? 14.595 -39.518 4.844 1.00 21.55 ? 418 PHE C C 1 ATOM 6272 O O . PHE C 1 110 ? 13.715 -38.727 4.502 1.00 23.45 ? 418 PHE C O 1 ATOM 6273 C CB . PHE C 1 110 ? 15.975 -38.933 2.831 1.00 29.35 ? 418 PHE C CB 1 ATOM 6274 C CG . PHE C 1 110 ? 16.812 -37.813 3.404 1.00 32.06 ? 418 PHE C CG 1 ATOM 6275 C CD1 . PHE C 1 110 ? 17.302 -37.871 4.698 1.00 32.75 ? 418 PHE C CD1 1 ATOM 6276 C CD2 . PHE C 1 110 ? 17.106 -36.698 2.634 1.00 31.80 ? 418 PHE C CD2 1 ATOM 6277 C CE1 . PHE C 1 110 ? 18.065 -36.839 5.213 1.00 35.07 ? 418 PHE C CE1 1 ATOM 6278 C CE2 . PHE C 1 110 ? 17.868 -35.664 3.143 1.00 33.47 ? 418 PHE C CE2 1 ATOM 6279 C CZ . PHE C 1 110 ? 18.348 -35.734 4.435 1.00 34.29 ? 418 PHE C CZ 1 ATOM 6280 N N . ALA C 1 111 ? 14.733 -39.958 6.093 1.00 22.56 ? 419 ALA C N 1 ATOM 6281 C CA . ALA C 1 111 ? 13.772 -39.633 7.151 1.00 25.79 ? 419 ALA C CA 1 ATOM 6282 C C . ALA C 1 111 ? 13.611 -38.131 7.374 1.00 26.59 ? 419 ALA C C 1 ATOM 6283 O O . ALA C 1 111 ? 12.484 -37.631 7.456 1.00 24.00 ? 419 ALA C O 1 ATOM 6284 C CB . ALA C 1 111 ? 14.164 -40.331 8.455 1.00 30.86 ? 419 ALA C CB 1 ATOM 6285 N N . ASP C 1 112 ? 14.733 -37.417 7.468 1.00 27.11 ? 420 ASP C N 1 ATOM 6286 C CA . ASP C 1 112 ? 14.704 -35.971 7.697 1.00 27.87 ? 420 ASP C CA 1 ATOM 6287 C C . ASP C 1 112 ? 13.894 -35.229 6.636 1.00 25.43 ? 420 ASP C C 1 ATOM 6288 O O . ASP C 1 112 ? 13.189 -34.268 6.947 1.00 24.66 ? 420 ASP C O 1 ATOM 6289 C CB . ASP C 1 112 ? 16.116 -35.386 7.740 1.00 33.21 ? 420 ASP C CB 1 ATOM 6290 C CG . ASP C 1 112 ? 16.910 -35.847 8.946 1.00 39.10 ? 420 ASP C CG 1 ATOM 6291 O OD1 . ASP C 1 112 ? 16.306 -36.340 9.921 1.00 39.50 ? 420 ASP C OD1 1 ATOM 6292 O OD2 . ASP C 1 112 ? 18.150 -35.702 8.916 1.00 43.23 ? 420 ASP C OD2 1 ATOM 6293 N N . ALA C 1 113 ? 14.006 -35.661 5.383 1.00 23.44 ? 421 ALA C N 1 ATOM 6294 C CA . ALA C 1 113 ? 13.304 -34.976 4.296 1.00 20.78 ? 421 ALA C CA 1 ATOM 6295 C C . ALA C 1 113 ? 11.795 -35.196 4.371 1.00 20.63 ? 421 ALA C C 1 ATOM 6296 O O . ALA C 1 113 ? 11.011 -34.307 4.036 1.00 20.83 ? 421 ALA C O 1 ATOM 6297 C CB . ALA C 1 113 ? 13.852 -35.400 2.940 1.00 19.81 ? 421 ALA C CB 1 ATOM 6298 N N . HIS C 1 114 ? 11.384 -36.386 4.803 1.00 21.03 ? 422 HIS C N 1 ATOM 6299 C CA . HIS C 1 114 ? 9.959 -36.663 4.985 1.00 22.67 ? 422 HIS C CA 1 ATOM 6300 C C . HIS C 1 114 ? 9.391 -35.807 6.111 1.00 21.49 ? 422 HIS C C 1 ATOM 6301 O O . HIS C 1 114 ? 8.281 -35.267 6.008 1.00 19.98 ? 422 HIS C O 1 ATOM 6302 C CB . HIS C 1 114 ? 9.722 -38.146 5.279 1.00 22.27 ? 422 HIS C CB 1 ATOM 6303 C CG . HIS C 1 114 ? 9.822 -39.027 4.072 1.00 21.56 ? 422 HIS C CG 1 ATOM 6304 N ND1 . HIS C 1 114 ? 8.831 -39.092 3.116 1.00 20.92 ? 422 HIS C ND1 1 ATOM 6305 C CD2 . HIS C 1 114 ? 10.792 -39.880 3.666 1.00 23.46 ? 422 HIS C CD2 1 ATOM 6306 C CE1 . HIS C 1 114 ? 9.185 -39.950 2.175 1.00 21.43 ? 422 HIS C CE1 1 ATOM 6307 N NE2 . HIS C 1 114 ? 10.371 -40.441 2.483 1.00 20.46 ? 422 HIS C NE2 1 ATOM 6308 N N . SER C 1 115 ? 10.158 -35.682 7.187 1.00 20.74 ? 423 SER C N 1 ATOM 6309 C CA . SER C 1 115 ? 9.752 -34.857 8.323 1.00 20.21 ? 423 SER C CA 1 ATOM 6310 C C . SER C 1 115 ? 9.666 -33.393 7.907 1.00 21.52 ? 423 SER C C 1 ATOM 6311 O O . SER C 1 115 ? 8.720 -32.687 8.257 1.00 19.76 ? 423 SER C O 1 ATOM 6312 C CB . SER C 1 115 ? 10.762 -35.010 9.466 1.00 22.24 ? 423 SER C CB 1 ATOM 6313 O OG . SER C 1 115 ? 10.364 -34.266 10.604 1.00 24.77 ? 423 SER C OG 1 ATOM 6314 N N . ASN C 1 116 ? 10.660 -32.934 7.154 1.00 20.20 ? 424 ASN C N 1 ATOM 6315 C CA . ASN C 1 116 ? 10.660 -31.553 6.688 1.00 20.58 ? 424 ASN C CA 1 ATOM 6316 C C . ASN C 1 116 ? 9.464 -31.287 5.784 1.00 20.62 ? 424 ASN C C 1 ATOM 6317 O O . ASN C 1 116 ? 8.825 -30.239 5.890 1.00 23.52 ? 424 ASN C O 1 ATOM 6318 C CB . ASN C 1 116 ? 11.960 -31.216 5.958 1.00 23.49 ? 424 ASN C CB 1 ATOM 6319 C CG . ASN C 1 116 ? 13.148 -31.108 6.892 1.00 26.61 ? 424 ASN C CG 1 ATOM 6320 O OD1 . ASN C 1 116 ? 12.996 -30.897 8.094 1.00 25.50 ? 424 ASN C OD1 1 ATOM 6321 N ND2 . ASN C 1 116 ? 14.343 -31.233 6.335 1.00 25.34 ? 424 ASN C ND2 1 ATOM 6322 N N . LEU C 1 117 ? 9.153 -32.244 4.907 1.00 15.76 ? 425 LEU C N 1 ATOM 6323 C CA . LEU C 1 117 ? 7.958 -32.121 4.066 1.00 20.49 ? 425 LEU C CA 1 ATOM 6324 C C . LEU C 1 117 ? 6.683 -32.069 4.904 1.00 20.48 ? 425 LEU C C 1 ATOM 6325 O O . LEU C 1 117 ? 5.779 -31.272 4.636 1.00 19.70 ? 425 LEU C O 1 ATOM 6326 C CB . LEU C 1 117 ? 7.861 -33.274 3.072 1.00 18.46 ? 425 LEU C CB 1 ATOM 6327 C CG . LEU C 1 117 ? 6.624 -33.245 2.166 1.00 21.51 ? 425 LEU C CG 1 ATOM 6328 C CD1 . LEU C 1 117 ? 6.573 -31.951 1.366 1.00 24.68 ? 425 LEU C CD1 1 ATOM 6329 C CD2 . LEU C 1 117 ? 6.596 -34.463 1.245 1.00 18.84 ? 425 LEU C CD2 1 ATOM 6330 N N . ALA C 1 118 ? 6.614 -32.929 5.914 1.00 18.28 ? 426 ALA C N 1 ATOM 6331 C CA . ALA C 1 118 ? 5.476 -32.925 6.837 1.00 19.75 ? 426 ALA C CA 1 ATOM 6332 C C . ALA C 1 118 ? 5.272 -31.551 7.467 1.00 22.20 ? 426 ALA C C 1 ATOM 6333 O O . ALA C 1 118 ? 4.141 -31.066 7.564 1.00 21.10 ? 426 ALA C O 1 ATOM 6334 C CB . ALA C 1 118 ? 5.664 -33.969 7.905 1.00 19.37 ? 426 ALA C CB 1 ATOM 6335 N N . SER C 1 119 ? 6.369 -30.919 7.880 1.00 21.57 ? 427 SER C N 1 ATOM 6336 C CA . SER C 1 119 ? 6.299 -29.588 8.482 1.00 23.57 ? 427 SER C CA 1 ATOM 6337 C C . SER C 1 119 ? 5.710 -28.538 7.533 1.00 24.76 ? 427 SER C C 1 ATOM 6338 O O . SER C 1 119 ? 5.003 -27.631 7.972 1.00 26.12 ? 427 SER C O 1 ATOM 6339 C CB . SER C 1 119 ? 7.679 -29.148 8.986 1.00 26.98 ? 427 SER C CB 1 ATOM 6340 O OG . SER C 1 119 ? 8.187 -30.072 9.941 1.00 28.08 ? 427 SER C OG 1 ATOM 6341 N N . ILE C 1 120 ? 6.006 -28.661 6.237 1.00 23.57 ? 428 ILE C N 1 ATOM 6342 C CA . ILE C 1 120 ? 5.413 -27.779 5.229 1.00 22.50 ? 428 ILE C CA 1 ATOM 6343 C C . ILE C 1 120 ? 3.911 -27.998 5.154 1.00 25.78 ? 428 ILE C C 1 ATOM 6344 O O . ILE C 1 120 ? 3.128 -27.040 5.078 1.00 28.83 ? 428 ILE C O 1 ATOM 6345 C CB . ILE C 1 120 ? 6.032 -27.997 3.826 1.00 22.89 ? 428 ILE C CB 1 ATOM 6346 C CG1 . ILE C 1 120 ? 7.489 -27.571 3.830 1.00 27.02 ? 428 ILE C CG1 1 ATOM 6347 C CG2 . ILE C 1 120 ? 5.287 -27.171 2.774 1.00 25.75 ? 428 ILE C CG2 1 ATOM 6348 C CD1 . ILE C 1 120 ? 7.696 -26.117 4.220 1.00 32.23 ? 428 ILE C CD1 1 ATOM 6349 N N . HIS C 1 121 ? 3.503 -29.262 5.194 1.00 22.26 ? 429 HIS C N 1 ATOM 6350 C CA . HIS C 1 121 ? 2.080 -29.586 5.161 1.00 23.93 ? 429 HIS C CA 1 ATOM 6351 C C . HIS C 1 121 ? 1.403 -29.090 6.436 1.00 24.43 ? 429 HIS C C 1 ATOM 6352 O O . HIS C 1 121 ? 0.289 -28.563 6.398 1.00 26.68 ? 429 HIS C O 1 ATOM 6353 C CB . HIS C 1 121 ? 1.865 -31.097 4.991 1.00 24.53 ? 429 HIS C CB 1 ATOM 6354 C CG . HIS C 1 121 ? 2.206 -31.609 3.624 1.00 29.63 ? 429 HIS C CG 1 ATOM 6355 N ND1 . HIS C 1 121 ? 1.840 -30.950 2.470 1.00 32.90 ? 429 HIS C ND1 1 ATOM 6356 C CD2 . HIS C 1 121 ? 2.884 -32.713 3.227 1.00 29.57 ? 429 HIS C CD2 1 ATOM 6357 C CE1 . HIS C 1 121 ? 2.279 -31.625 1.421 1.00 30.98 ? 429 HIS C CE1 1 ATOM 6358 N NE2 . HIS C 1 121 ? 2.911 -32.701 1.852 1.00 25.59 ? 429 HIS C NE2 1 ATOM 6359 N N . LYS C 1 122 ? 2.093 -29.252 7.561 1.00 23.87 ? 430 LYS C N 1 ATOM 6360 C CA . LYS C 1 122 ? 1.578 -28.808 8.857 1.00 25.74 ? 430 LYS C CA 1 ATOM 6361 C C . LYS C 1 122 ? 1.380 -27.296 8.891 1.00 29.13 ? 430 LYS C C 1 ATOM 6362 O O . LYS C 1 122 ? 0.345 -26.814 9.332 1.00 28.68 ? 430 LYS C O 1 ATOM 6363 C CB . LYS C 1 122 ? 2.520 -29.233 9.991 1.00 24.16 ? 430 LYS C CB 1 ATOM 6364 C CG . LYS C 1 122 ? 2.011 -28.911 11.409 1.00 28.74 ? 430 LYS C CG 1 ATOM 6365 C CD . LYS C 1 122 ? 3.058 -29.319 12.454 1.00 30.34 ? 430 LYS C CD 1 ATOM 6366 C CE . LYS C 1 122 ? 2.503 -29.315 13.877 1.00 32.11 ? 430 LYS C CE 1 ATOM 6367 N NZ . LYS C 1 122 ? 2.093 -27.953 14.329 1.00 34.66 ? 430 LYS C NZ 1 ATOM 6368 N N . ASP C 1 123 ? 2.376 -26.548 8.428 1.00 30.90 ? 431 ASP C N 1 ATOM 6369 C CA . ASP C 1 123 ? 2.301 -25.090 8.476 1.00 39.02 ? 431 ASP C CA 1 ATOM 6370 C C . ASP C 1 123 ? 1.278 -24.559 7.473 1.00 42.22 ? 431 ASP C C 1 ATOM 6371 O O . ASP C 1 123 ? 0.757 -23.452 7.623 1.00 45.78 ? 431 ASP C O 1 ATOM 6372 C CB . ASP C 1 123 ? 3.673 -24.463 8.220 1.00 43.79 ? 431 ASP C CB 1 ATOM 6373 C CG . ASP C 1 123 ? 4.693 -24.832 9.285 1.00 50.41 ? 431 ASP C CG 1 ATOM 6374 O OD1 . ASP C 1 123 ? 4.283 -25.162 10.420 1.00 52.72 ? 431 ASP C OD1 1 ATOM 6375 O OD2 . ASP C 1 123 ? 5.908 -24.791 8.988 1.00 52.73 ? 431 ASP C OD2 1 ATOM 6376 N N . SER C 1 124 ? 0.989 -25.366 6.458 1.00 38.53 ? 432 SER C N 1 ATOM 6377 C CA . SER C 1 124 ? 0.017 -25.009 5.434 1.00 40.27 ? 432 SER C CA 1 ATOM 6378 C C . SER C 1 124 ? -1.413 -25.370 5.844 1.00 41.01 ? 432 SER C C 1 ATOM 6379 O O . SER C 1 124 ? -2.366 -25.061 5.128 1.00 43.54 ? 432 SER C O 1 ATOM 6380 C CB . SER C 1 124 ? 0.367 -25.701 4.115 1.00 41.02 ? 432 SER C CB 1 ATOM 6381 O OG . SER C 1 124 ? 1.657 -25.321 3.664 1.00 41.01 ? 432 SER C OG 1 ATOM 6382 N N . GLY C 1 125 ? -1.561 -26.035 6.986 1.00 37.90 ? 433 GLY C N 1 ATOM 6383 C CA . GLY C 1 125 ? -2.879 -26.419 7.468 1.00 36.72 ? 433 GLY C CA 1 ATOM 6384 C C . GLY C 1 125 ? -3.381 -27.764 6.966 1.00 36.56 ? 433 GLY C C 1 ATOM 6385 O O . GLY C 1 125 ? -4.520 -28.142 7.246 1.00 41.89 ? 433 GLY C O 1 ATOM 6386 N N . ASN C 1 126 ? -2.542 -28.486 6.223 1.00 30.48 ? 434 ASN C N 1 ATOM 6387 C CA . ASN C 1 126 ? -2.888 -29.823 5.742 1.00 29.20 ? 434 ASN C CA 1 ATOM 6388 C C . ASN C 1 126 ? -2.447 -30.899 6.737 1.00 28.62 ? 434 ASN C C 1 ATOM 6389 O O . ASN C 1 126 ? -1.502 -31.648 6.485 1.00 25.09 ? 434 ASN C O 1 ATOM 6390 C CB . ASN C 1 126 ? -2.261 -30.095 4.367 1.00 30.80 ? 434 ASN C CB 1 ATOM 6391 C CG . ASN C 1 126 ? -2.928 -31.254 3.639 1.00 32.08 ? 434 ASN C CG 1 ATOM 6392 O OD1 . ASN C 1 126 ? -3.637 -32.058 4.244 1.00 36.38 ? 434 ASN C OD1 1 ATOM 6393 N ND2 . ASN C 1 126 ? -2.698 -31.346 2.336 1.00 32.49 ? 434 ASN C ND2 1 ATOM 6394 N N . ILE C 1 127 ? -3.145 -30.976 7.865 1.00 27.62 ? 435 ILE C N 1 ATOM 6395 C CA . ILE C 1 127 ? -2.767 -31.902 8.933 1.00 21.52 ? 435 ILE C CA 1 ATOM 6396 C C . ILE C 1 127 ? -2.748 -33.395 8.540 1.00 17.46 ? 435 ILE C C 1 ATOM 6397 O O . ILE C 1 127 ? -1.822 -34.105 8.913 1.00 19.25 ? 435 ILE C O 1 ATOM 6398 C CB . ILE C 1 127 ? -3.616 -31.674 10.217 1.00 26.69 ? 435 ILE C CB 1 ATOM 6399 C CG1 . ILE C 1 127 ? -3.650 -30.188 10.583 1.00 30.10 ? 435 ILE C CG1 1 ATOM 6400 C CG2 . ILE C 1 127 ? -3.063 -32.484 11.375 1.00 21.73 ? 435 ILE C CG2 1 ATOM 6401 C CD1 . ILE C 1 127 ? -2.293 -29.613 10.908 1.00 30.44 ? 435 ILE C CD1 1 ATOM 6402 N N . PRO C 1 128 ? -3.767 -33.883 7.799 1.00 26.34 ? 436 PRO C N 1 ATOM 6403 C CA . PRO C 1 128 ? -3.717 -35.305 7.427 1.00 27.80 ? 436 PRO C CA 1 ATOM 6404 C C . PRO C 1 128 ? -2.485 -35.670 6.601 1.00 27.69 ? 436 PRO C C 1 ATOM 6405 O O . PRO C 1 128 ? -1.899 -36.725 6.828 1.00 27.61 ? 436 PRO C O 1 ATOM 6406 C CB . PRO C 1 128 ? -4.984 -35.491 6.591 1.00 32.40 ? 436 PRO C CB 1 ATOM 6407 C CG . PRO C 1 128 ? -5.928 -34.462 7.123 1.00 33.78 ? 436 PRO C CG 1 ATOM 6408 C CD . PRO C 1 128 ? -5.065 -33.274 7.439 1.00 29.87 ? 436 PRO C CD 1 ATOM 6409 N N . GLU C 1 129 ? -2.103 -34.806 5.666 1.00 25.04 ? 437 GLU C N 1 ATOM 6410 C CA . GLU C 1 129 ? -0.893 -35.014 4.875 1.00 25.81 ? 437 GLU C CA 1 ATOM 6411 C C . GLU C 1 129 ? 0.364 -34.872 5.734 1.00 23.60 ? 437 GLU C C 1 ATOM 6412 O O . GLU C 1 129 ? 1.343 -35.591 5.538 1.00 23.76 ? 437 GLU C O 1 ATOM 6413 C CB . GLU C 1 129 ? -0.847 -34.019 3.716 1.00 29.88 ? 437 GLU C CB 1 ATOM 6414 C CG . GLU C 1 129 ? -0.049 -34.510 2.511 1.00 37.12 ? 437 GLU C CG 1 ATOM 6415 C CD . GLU C 1 129 ? -0.648 -35.761 1.881 1.00 44.94 ? 437 GLU C CD 1 ATOM 6416 O OE1 . GLU C 1 129 ? -1.570 -35.631 1.043 1.00 49.79 ? 437 GLU C OE1 1 ATOM 6417 O OE2 . GLU C 1 129 ? -0.194 -36.875 2.224 1.00 44.20 ? 437 GLU C OE2 1 ATOM 6418 N N . ALA C 1 130 ? 0.339 -33.933 6.678 1.00 20.57 ? 438 ALA C N 1 ATOM 6419 C CA . ALA C 1 130 ? 1.432 -33.794 7.635 1.00 18.09 ? 438 ALA C CA 1 ATOM 6420 C C . ALA C 1 130 ? 1.587 -35.052 8.502 1.00 20.79 ? 438 ALA C C 1 ATOM 6421 O O . ALA C 1 130 ? 2.695 -35.563 8.670 1.00 21.40 ? 438 ALA C O 1 ATOM 6422 C CB . ALA C 1 130 ? 1.222 -32.569 8.500 1.00 18.62 ? 438 ALA C CB 1 ATOM 6423 N N . ILE C 1 131 ? 0.476 -35.549 9.051 1.00 17.29 ? 439 ILE C N 1 ATOM 6424 C CA . ILE C 1 131 ? 0.506 -36.799 9.803 1.00 18.36 ? 439 ILE C CA 1 ATOM 6425 C C . ILE C 1 131 ? 1.070 -37.957 8.969 1.00 18.06 ? 439 ILE C C 1 ATOM 6426 O O . ILE C 1 131 ? 1.888 -38.745 9.462 1.00 16.49 ? 439 ILE C O 1 ATOM 6427 C CB . ILE C 1 131 ? -0.891 -37.168 10.370 1.00 22.52 ? 439 ILE C CB 1 ATOM 6428 C CG1 . ILE C 1 131 ? -1.253 -36.241 11.538 1.00 20.03 ? 439 ILE C CG1 1 ATOM 6429 C CG2 . ILE C 1 131 ? -0.908 -38.617 10.868 1.00 22.69 ? 439 ILE C CG2 1 ATOM 6430 C CD1 . ILE C 1 131 ? -2.757 -36.191 11.854 1.00 21.44 ? 439 ILE C CD1 1 ATOM 6431 N N . ALA C 1 132 ? 0.654 -38.036 7.703 1.00 18.74 ? 440 ALA C N 1 ATOM 6432 C CA . ALA C 1 132 ? 1.089 -39.111 6.810 1.00 21.43 ? 440 ALA C CA 1 ATOM 6433 C C . ALA C 1 132 ? 2.600 -39.084 6.579 1.00 23.06 ? 440 ALA C C 1 ATOM 6434 O O . ALA C 1 132 ? 3.266 -40.119 6.616 1.00 27.56 ? 440 ALA C O 1 ATOM 6435 C CB . ALA C 1 132 ? 0.345 -39.031 5.477 1.00 22.10 ? 440 ALA C CB 1 ATOM 6436 N N . SER C 1 133 ? 3.139 -37.893 6.353 1.00 20.58 ? 441 SER C N 1 ATOM 6437 C CA . SER C 1 133 ? 4.568 -37.750 6.114 1.00 22.94 ? 441 SER C CA 1 ATOM 6438 C C . SER C 1 133 ? 5.401 -37.951 7.392 1.00 21.88 ? 441 SER C C 1 ATOM 6439 O O . SER C 1 133 ? 6.488 -38.522 7.332 1.00 23.17 ? 441 SER C O 1 ATOM 6440 C CB . SER C 1 133 ? 4.878 -36.413 5.427 1.00 22.14 ? 441 SER C CB 1 ATOM 6441 O OG . SER C 1 133 ? 4.447 -36.412 4.064 1.00 25.34 ? 441 SER C OG 1 ATOM 6442 N N . TYR C 1 134 ? 4.892 -37.509 8.543 1.00 20.68 ? 442 TYR C N 1 ATOM 6443 C CA . TYR C 1 134 ? 5.587 -37.736 9.815 1.00 20.95 ? 442 TYR C CA 1 ATOM 6444 C C . TYR C 1 134 ? 5.646 -39.218 10.184 1.00 21.61 ? 442 TYR C C 1 ATOM 6445 O O . TYR C 1 134 ? 6.625 -39.676 10.769 1.00 20.92 ? 442 TYR C O 1 ATOM 6446 C CB . TYR C 1 134 ? 4.926 -36.975 10.970 1.00 23.43 ? 442 TYR C CB 1 ATOM 6447 C CG . TYR C 1 134 ? 5.298 -35.518 11.053 1.00 23.80 ? 442 TYR C CG 1 ATOM 6448 C CD1 . TYR C 1 134 ? 6.628 -35.112 11.009 1.00 22.88 ? 442 TYR C CD1 1 ATOM 6449 C CD2 . TYR C 1 134 ? 4.313 -34.541 11.173 1.00 24.72 ? 442 TYR C CD2 1 ATOM 6450 C CE1 . TYR C 1 134 ? 6.967 -33.766 11.080 1.00 25.48 ? 442 TYR C CE1 1 ATOM 6451 C CE2 . TYR C 1 134 ? 4.640 -33.198 11.240 1.00 26.14 ? 442 TYR C CE2 1 ATOM 6452 C CZ . TYR C 1 134 ? 5.970 -32.817 11.188 1.00 27.41 ? 442 TYR C CZ 1 ATOM 6453 O OH . TYR C 1 134 ? 6.294 -31.481 11.259 1.00 29.61 ? 442 TYR C OH 1 ATOM 6454 N N . ARG C 1 135 ? 4.589 -39.961 9.861 1.00 22.13 ? 443 ARG C N 1 ATOM 6455 C CA . ARG C 1 135 ? 4.558 -41.397 10.146 1.00 24.52 ? 443 ARG C CA 1 ATOM 6456 C C . ARG C 1 135 ? 5.549 -42.139 9.246 1.00 25.52 ? 443 ARG C C 1 ATOM 6457 O O . ARG C 1 135 ? 6.210 -43.100 9.659 1.00 23.45 ? 443 ARG C O 1 ATOM 6458 C CB . ARG C 1 135 ? 3.135 -41.946 10.001 1.00 29.17 ? 443 ARG C CB 1 ATOM 6459 C CG . ARG C 1 135 ? 2.254 -41.641 11.219 1.00 30.41 ? 443 ARG C CG 1 ATOM 6460 C CD . ARG C 1 135 ? 0.793 -42.045 11.039 1.00 33.28 ? 443 ARG C CD 1 ATOM 6461 N NE . ARG C 1 135 ? 0.070 -41.913 12.303 1.00 33.25 ? 443 ARG C NE 1 ATOM 6462 C CZ . ARG C 1 135 ? -1.254 -41.912 12.431 1.00 33.51 ? 443 ARG C CZ 1 ATOM 6463 N NH1 . ARG C 1 135 ? -2.036 -42.028 11.365 1.00 36.49 ? 443 ARG C NH1 1 ATOM 6464 N NH2 . ARG C 1 135 ? -1.796 -41.786 13.637 1.00 28.15 ? 443 ARG C NH2 1 ATOM 6465 N N . THR C 1 136 ? 5.675 -41.677 8.010 1.00 24.33 ? 444 THR C N 1 ATOM 6466 C CA . THR C 1 136 ? 6.684 -42.249 7.133 1.00 25.93 ? 444 THR C CA 1 ATOM 6467 C C . THR C 1 136 ? 8.090 -42.036 7.717 1.00 23.63 ? 444 THR C C 1 ATOM 6468 O O . THR C 1 136 ? 8.908 -42.958 7.730 1.00 27.49 ? 444 THR C O 1 ATOM 6469 C CB . THR C 1 136 ? 6.555 -41.694 5.713 1.00 27.88 ? 444 THR C CB 1 ATOM 6470 O OG1 . THR C 1 136 ? 5.282 -42.090 5.181 1.00 27.00 ? 444 THR C OG1 1 ATOM 6471 C CG2 . THR C 1 136 ? 7.673 -42.229 4.817 1.00 28.99 ? 444 THR C CG2 1 ATOM 6472 N N . ALA C 1 137 ? 8.347 -40.836 8.227 1.00 21.18 ? 445 ALA C N 1 ATOM 6473 C CA . ALA C 1 137 ? 9.656 -40.483 8.780 1.00 23.72 ? 445 ALA C CA 1 ATOM 6474 C C . ALA C 1 137 ? 10.015 -41.325 9.996 1.00 25.36 ? 445 ALA C C 1 ATOM 6475 O O . ALA C 1 137 ? 11.176 -41.684 10.195 1.00 26.82 ? 445 ALA C O 1 ATOM 6476 C CB . ALA C 1 137 ? 9.708 -39.001 9.137 1.00 23.60 ? 445 ALA C CB 1 ATOM 6477 N N . LEU C 1 138 ? 9.011 -41.627 10.810 1.00 22.24 ? 446 LEU C N 1 ATOM 6478 C CA . LEU C 1 138 ? 9.200 -42.456 11.992 1.00 23.82 ? 446 LEU C CA 1 ATOM 6479 C C . LEU C 1 138 ? 9.264 -43.941 11.649 1.00 29.67 ? 446 LEU C C 1 ATOM 6480 O O . LEU C 1 138 ? 9.843 -44.735 12.392 1.00 31.94 ? 446 LEU C O 1 ATOM 6481 C CB . LEU C 1 138 ? 8.080 -42.194 12.995 1.00 25.44 ? 446 LEU C CB 1 ATOM 6482 C CG . LEU C 1 138 ? 8.143 -40.820 13.661 1.00 22.81 ? 446 LEU C CG 1 ATOM 6483 C CD1 . LEU C 1 138 ? 6.768 -40.407 14.147 1.00 21.06 ? 446 LEU C CD1 1 ATOM 6484 C CD2 . LEU C 1 138 ? 9.154 -40.808 14.807 1.00 24.45 ? 446 LEU C CD2 1 ATOM 6485 N N . LYS C 1 139 ? 8.648 -44.314 10.532 1.00 31.91 ? 447 LYS C N 1 ATOM 6486 C CA . LYS C 1 139 ? 8.730 -45.681 10.030 1.00 36.03 ? 447 LYS C CA 1 ATOM 6487 C C . LYS C 1 139 ? 10.165 -45.916 9.559 1.00 35.88 ? 447 LYS C C 1 ATOM 6488 O O . LYS C 1 139 ? 10.775 -46.943 9.854 1.00 34.06 ? 447 LYS C O 1 ATOM 6489 C CB . LYS C 1 139 ? 7.725 -45.878 8.889 1.00 38.73 ? 447 LYS C CB 1 ATOM 6490 C CG . LYS C 1 139 ? 7.671 -47.275 8.300 1.00 48.79 ? 447 LYS C CG 1 ATOM 6491 C CD . LYS C 1 139 ? 6.557 -47.379 7.266 1.00 53.51 ? 447 LYS C CD 1 ATOM 6492 C CE . LYS C 1 139 ? 6.352 -48.815 6.800 1.00 60.74 ? 447 LYS C CE 1 ATOM 6493 N NZ . LYS C 1 139 ? 5.129 -48.958 5.953 1.00 62.29 ? 447 LYS C NZ 1 ATOM 6494 N N . LEU C 1 140 ? 10.704 -44.929 8.850 1.00 35.45 ? 448 LEU C N 1 ATOM 6495 C CA . LEU C 1 140 ? 12.090 -44.959 8.397 1.00 34.52 ? 448 LEU C CA 1 ATOM 6496 C C . LEU C 1 140 ? 13.096 -44.815 9.541 1.00 36.21 ? 448 LEU C C 1 ATOM 6497 O O . LEU C 1 140 ? 14.127 -45.492 9.556 1.00 37.17 ? 448 LEU C O 1 ATOM 6498 C CB . LEU C 1 140 ? 12.326 -43.867 7.353 1.00 28.85 ? 448 LEU C CB 1 ATOM 6499 C CG . LEU C 1 140 ? 11.777 -44.188 5.965 1.00 30.87 ? 448 LEU C CG 1 ATOM 6500 C CD1 . LEU C 1 140 ? 11.673 -42.929 5.100 1.00 27.15 ? 448 LEU C CD1 1 ATOM 6501 C CD2 . LEU C 1 140 ? 12.654 -45.237 5.294 1.00 22.92 ? 448 LEU C CD2 1 ATOM 6502 N N . LYS C 1 141 ? 12.801 -43.928 10.489 1.00 30.32 ? 449 LYS C N 1 ATOM 6503 C CA . LYS C 1 141 ? 13.683 -43.709 11.634 1.00 28.40 ? 449 LYS C CA 1 ATOM 6504 C C . LYS C 1 141 ? 12.889 -43.633 12.935 1.00 31.10 ? 449 LYS C C 1 ATOM 6505 O O . LYS C 1 141 ? 12.456 -42.554 13.340 1.00 27.38 ? 449 LYS C O 1 ATOM 6506 C CB . LYS C 1 141 ? 14.511 -42.435 11.445 1.00 27.65 ? 449 LYS C CB 1 ATOM 6507 C CG . LYS C 1 141 ? 15.547 -42.217 12.536 1.00 32.85 ? 449 LYS C CG 1 ATOM 6508 C CD . LYS C 1 141 ? 16.668 -41.305 12.068 1.00 36.72 ? 449 LYS C CD 1 ATOM 6509 C CE . LYS C 1 141 ? 16.208 -39.870 11.951 1.00 35.02 ? 449 LYS C CE 1 ATOM 6510 N NZ . LYS C 1 141 ? 17.239 -39.046 11.268 1.00 36.99 ? 449 LYS C NZ 1 ATOM 6511 N N . PRO C 1 142 ? 12.694 -44.789 13.591 1.00 35.90 ? 450 PRO C N 1 ATOM 6512 C CA . PRO C 1 142 ? 11.905 -44.928 14.824 1.00 35.27 ? 450 PRO C CA 1 ATOM 6513 C C . PRO C 1 142 ? 12.306 -43.949 15.934 1.00 32.54 ? 450 PRO C C 1 ATOM 6514 O O . PRO C 1 142 ? 11.435 -43.441 16.648 1.00 31.10 ? 450 PRO C O 1 ATOM 6515 C CB . PRO C 1 142 ? 12.203 -46.366 15.259 1.00 38.68 ? 450 PRO C CB 1 ATOM 6516 C CG . PRO C 1 142 ? 12.482 -47.080 13.992 1.00 42.62 ? 450 PRO C CG 1 ATOM 6517 C CD . PRO C 1 142 ? 13.194 -46.088 13.108 1.00 40.11 ? 450 PRO C CD 1 ATOM 6518 N N . ASP C 1 143 ? 13.606 -43.704 16.077 1.00 32.69 ? 451 ASP C N 1 ATOM 6519 C CA . ASP C 1 143 ? 14.112 -42.749 17.053 1.00 33.49 ? 451 ASP C CA 1 ATOM 6520 C C . ASP C 1 143 ? 14.359 -41.416 16.360 1.00 27.74 ? 451 ASP C C 1 ATOM 6521 O O . ASP C 1 143 ? 15.407 -41.205 15.748 1.00 27.61 ? 451 ASP C O 1 ATOM 6522 C CB . ASP C 1 143 ? 15.395 -43.280 17.706 1.00 42.00 ? 451 ASP C CB 1 ATOM 6523 C CG . ASP C 1 143 ? 15.810 -42.475 18.927 1.00 45.59 ? 451 ASP C CG 1 ATOM 6524 O OD1 . ASP C 1 143 ? 15.033 -41.604 19.367 1.00 45.12 ? 451 ASP C OD1 1 ATOM 6525 O OD2 . ASP C 1 143 ? 16.916 -42.719 19.453 1.00 50.74 ? 451 ASP C OD2 1 ATOM 6526 N N . PHE C 1 144 ? 13.373 -40.527 16.456 1.00 25.78 ? 452 PHE C N 1 ATOM 6527 C CA . PHE C 1 144 ? 13.354 -39.271 15.706 1.00 25.54 ? 452 PHE C CA 1 ATOM 6528 C C . PHE C 1 144 ? 12.505 -38.267 16.496 1.00 23.71 ? 452 PHE C C 1 ATOM 6529 O O . PHE C 1 144 ? 11.335 -38.060 16.186 1.00 22.79 ? 452 PHE C O 1 ATOM 6530 C CB . PHE C 1 144 ? 12.748 -39.521 14.318 1.00 24.68 ? 452 PHE C CB 1 ATOM 6531 C CG . PHE C 1 144 ? 12.997 -38.417 13.311 1.00 22.53 ? 452 PHE C CG 1 ATOM 6532 C CD1 . PHE C 1 144 ? 13.500 -37.184 13.696 1.00 21.69 ? 452 PHE C CD1 1 ATOM 6533 C CD2 . PHE C 1 144 ? 12.719 -38.626 11.972 1.00 23.68 ? 452 PHE C CD2 1 ATOM 6534 C CE1 . PHE C 1 144 ? 13.714 -36.180 12.757 1.00 22.74 ? 452 PHE C CE1 1 ATOM 6535 C CE2 . PHE C 1 144 ? 12.928 -37.632 11.032 1.00 25.81 ? 452 PHE C CE2 1 ATOM 6536 C CZ . PHE C 1 144 ? 13.427 -36.406 11.426 1.00 25.02 ? 452 PHE C CZ 1 ATOM 6537 N N . PRO C 1 145 ? 13.097 -37.654 17.532 1.00 23.98 ? 453 PRO C N 1 ATOM 6538 C CA . PRO C 1 145 ? 12.378 -36.772 18.456 1.00 25.51 ? 453 PRO C CA 1 ATOM 6539 C C . PRO C 1 145 ? 11.623 -35.638 17.769 1.00 25.86 ? 453 PRO C C 1 ATOM 6540 O O . PRO C 1 145 ? 10.467 -35.412 18.120 1.00 23.01 ? 453 PRO C O 1 ATOM 6541 C CB . PRO C 1 145 ? 13.494 -36.213 19.339 1.00 26.86 ? 453 PRO C CB 1 ATOM 6542 C CG . PRO C 1 145 ? 14.540 -37.269 19.320 1.00 28.16 ? 453 PRO C CG 1 ATOM 6543 C CD . PRO C 1 145 ? 14.503 -37.840 17.936 1.00 26.63 ? 453 PRO C CD 1 ATOM 6544 N N . ASP C 1 146 ? 12.245 -34.946 16.816 1.00 25.82 ? 454 ASP C N 1 ATOM 6545 C CA . ASP C 1 146 ? 11.549 -33.862 16.118 1.00 28.90 ? 454 ASP C CA 1 ATOM 6546 C C . ASP C 1 146 ? 10.259 -34.356 15.473 1.00 26.31 ? 454 ASP C C 1 ATOM 6547 O O . ASP C 1 146 ? 9.198 -33.756 15.641 1.00 25.00 ? 454 ASP C O 1 ATOM 6548 C CB . ASP C 1 146 ? 12.433 -33.213 15.050 1.00 30.88 ? 454 ASP C CB 1 ATOM 6549 C CG . ASP C 1 146 ? 13.479 -32.283 15.635 1.00 36.61 ? 454 ASP C CG 1 ATOM 6550 O OD1 . ASP C 1 146 ? 13.378 -31.934 16.831 1.00 36.92 ? 454 ASP C OD1 1 ATOM 6551 O OD2 . ASP C 1 146 ? 14.401 -31.888 14.885 1.00 38.88 ? 454 ASP C OD2 1 ATOM 6552 N N . ALA C 1 147 ? 10.352 -35.457 14.740 1.00 24.02 ? 455 ALA C N 1 ATOM 6553 C CA . ALA C 1 147 ? 9.201 -35.970 14.010 1.00 20.98 ? 455 ALA C CA 1 ATOM 6554 C C . ALA C 1 147 ? 8.115 -36.493 14.948 1.00 19.14 ? 455 ALA C C 1 ATOM 6555 O O . ALA C 1 147 ? 6.925 -36.293 14.695 1.00 17.35 ? 455 ALA C O 1 ATOM 6556 C CB . ALA C 1 147 ? 9.627 -37.046 13.022 1.00 21.85 ? 455 ALA C CB 1 ATOM 6557 N N . TYR C 1 148 ? 8.519 -37.151 16.028 1.00 15.54 ? 456 TYR C N 1 ATOM 6558 C CA . TYR C 1 148 ? 7.535 -37.674 16.978 1.00 17.12 ? 456 TYR C CA 1 ATOM 6559 C C . TYR C 1 148 ? 6.771 -36.537 17.653 1.00 19.48 ? 456 TYR C C 1 ATOM 6560 O O . TYR C 1 148 ? 5.542 -36.571 17.752 1.00 18.00 ? 456 TYR C O 1 ATOM 6561 C CB . TYR C 1 148 ? 8.197 -38.561 18.033 1.00 20.13 ? 456 TYR C CB 1 ATOM 6562 C CG . TYR C 1 148 ? 7.199 -39.294 18.910 1.00 21.78 ? 456 TYR C CG 1 ATOM 6563 C CD1 . TYR C 1 148 ? 6.745 -40.558 18.564 1.00 22.48 ? 456 TYR C CD1 1 ATOM 6564 C CD2 . TYR C 1 148 ? 6.703 -38.714 20.068 1.00 24.10 ? 456 TYR C CD2 1 ATOM 6565 C CE1 . TYR C 1 148 ? 5.826 -41.230 19.354 1.00 26.69 ? 456 TYR C CE1 1 ATOM 6566 C CE2 . TYR C 1 148 ? 5.785 -39.376 20.866 1.00 26.07 ? 456 TYR C CE2 1 ATOM 6567 C CZ . TYR C 1 148 ? 5.355 -40.634 20.505 1.00 27.08 ? 456 TYR C CZ 1 ATOM 6568 O OH . TYR C 1 148 ? 4.443 -41.297 21.289 1.00 26.55 ? 456 TYR C OH 1 ATOM 6569 N N . CYS C 1 149 ? 7.501 -35.535 18.133 1.00 20.42 ? 457 CYS C N 1 ATOM 6570 C CA . CYS C 1 149 ? 6.862 -34.433 18.847 1.00 22.86 ? 457 CYS C CA 1 ATOM 6571 C C . CYS C 1 149 ? 6.005 -33.580 17.928 1.00 22.15 ? 457 CYS C C 1 ATOM 6572 O O . CYS C 1 149 ? 4.958 -33.080 18.338 1.00 19.01 ? 457 CYS C O 1 ATOM 6573 C CB . CYS C 1 149 ? 7.898 -33.570 19.567 1.00 25.32 ? 457 CYS C CB 1 ATOM 6574 S SG . CYS C 1 149 ? 8.774 -34.457 20.879 1.00 25.50 ? 457 CYS C SG 1 ATOM 6575 N N . ASN C 1 150 ? 6.453 -33.398 16.689 1.00 22.03 ? 458 ASN C N 1 ATOM 6576 C CA . ASN C 1 150 ? 5.653 -32.662 15.716 1.00 18.50 ? 458 ASN C CA 1 ATOM 6577 C C . ASN C 1 150 ? 4.406 -33.443 15.336 1.00 19.00 ? 458 ASN C C 1 ATOM 6578 O O . ASN C 1 150 ? 3.335 -32.869 15.122 1.00 19.62 ? 458 ASN C O 1 ATOM 6579 C CB . ASN C 1 150 ? 6.478 -32.318 14.478 1.00 19.79 ? 458 ASN C CB 1 ATOM 6580 C CG . ASN C 1 150 ? 7.344 -31.092 14.682 1.00 27.06 ? 458 ASN C CG 1 ATOM 6581 O OD1 . ASN C 1 150 ? 7.001 -30.203 15.453 1.00 35.50 ? 458 ASN C OD1 1 ATOM 6582 N ND2 . ASN C 1 150 ? 8.471 -31.038 13.987 1.00 32.27 ? 458 ASN C ND2 1 ATOM 6583 N N . LEU C 1 151 ? 4.543 -34.761 15.279 1.00 17.21 ? 459 LEU C N 1 ATOM 6584 C CA . LEU C 1 151 ? 3.398 -35.622 15.008 1.00 18.26 ? 459 LEU C CA 1 ATOM 6585 C C . LEU C 1 151 ? 2.407 -35.546 16.178 1.00 18.15 ? 459 LEU C C 1 ATOM 6586 O O . LEU C 1 151 ? 1.195 -35.491 15.974 1.00 17.73 ? 459 LEU C O 1 ATOM 6587 C CB . LEU C 1 151 ? 3.853 -37.069 14.779 1.00 18.59 ? 459 LEU C CB 1 ATOM 6588 C CG . LEU C 1 151 ? 2.749 -38.130 14.711 1.00 19.53 ? 459 LEU C CG 1 ATOM 6589 C CD1 . LEU C 1 151 ? 1.721 -37.796 13.630 1.00 21.05 ? 459 LEU C CD1 1 ATOM 6590 C CD2 . LEU C 1 151 ? 3.339 -39.520 14.490 1.00 20.95 ? 459 LEU C CD2 1 ATOM 6591 N N . ALA C 1 152 ? 2.927 -35.538 17.403 1.00 17.71 ? 460 ALA C N 1 ATOM 6592 C CA . ALA C 1 152 ? 2.065 -35.439 18.585 1.00 18.84 ? 460 ALA C CA 1 ATOM 6593 C C . ALA C 1 152 ? 1.236 -34.152 18.549 1.00 18.64 ? 460 ALA C C 1 ATOM 6594 O O . ALA C 1 152 ? 0.062 -34.145 18.928 1.00 17.96 ? 460 ALA C O 1 ATOM 6595 C CB . ALA C 1 152 ? 2.891 -35.514 19.874 1.00 17.19 ? 460 ALA C CB 1 ATOM 6596 N N . HIS C 1 153 ? 1.836 -33.063 18.081 1.00 16.25 ? 461 HIS C N 1 ATOM 6597 C CA . HIS C 1 153 ? 1.098 -31.803 18.012 1.00 16.43 ? 461 HIS C CA 1 ATOM 6598 C C . HIS C 1 153 ? 0.011 -31.843 16.944 1.00 18.15 ? 461 HIS C C 1 ATOM 6599 O O . HIS C 1 153 ? -1.097 -31.368 17.170 1.00 18.34 ? 461 HIS C O 1 ATOM 6600 C CB . HIS C 1 153 ? 2.017 -30.601 17.793 1.00 18.66 ? 461 HIS C CB 1 ATOM 6601 C CG . HIS C 1 153 ? 1.337 -29.292 18.038 1.00 20.71 ? 461 HIS C CG 1 ATOM 6602 N ND1 . HIS C 1 153 ? 1.149 -28.351 17.050 1.00 20.91 ? 461 HIS C ND1 1 ATOM 6603 C CD2 . HIS C 1 153 ? 0.757 -28.787 19.154 1.00 23.43 ? 461 HIS C CD2 1 ATOM 6604 C CE1 . HIS C 1 153 ? 0.503 -27.312 17.552 1.00 23.60 ? 461 HIS C CE1 1 ATOM 6605 N NE2 . HIS C 1 153 ? 0.251 -27.554 18.826 1.00 21.31 ? 461 HIS C NE2 1 ATOM 6606 N N . CYS C 1 154 ? 0.326 -32.404 15.778 1.00 20.49 ? 462 CYS C N 1 ATOM 6607 C CA . CYS C 1 154 ? -0.691 -32.627 14.749 1.00 19.64 ? 462 CYS C CA 1 ATOM 6608 C C . CYS C 1 154 ? -1.871 -33.406 15.309 1.00 17.50 ? 462 CYS C C 1 ATOM 6609 O O . CYS C 1 154 ? -3.021 -33.030 15.099 1.00 17.63 ? 462 CYS C O 1 ATOM 6610 C CB . CYS C 1 154 ? -0.114 -33.396 13.554 1.00 17.56 ? 462 CYS C CB 1 ATOM 6611 S SG . CYS C 1 154 ? 1.074 -32.452 12.603 1.00 23.46 ? 462 CYS C SG 1 ATOM 6612 N N . LEU C 1 155 ? -1.580 -34.498 16.009 1.00 17.35 ? 463 LEU C N 1 ATOM 6613 C CA . LEU C 1 155 ? -2.626 -35.345 16.577 1.00 17.76 ? 463 LEU C CA 1 ATOM 6614 C C . LEU C 1 155 ? -3.486 -34.570 17.570 1.00 16.41 ? 463 LEU C C 1 ATOM 6615 O O . LEU C 1 155 ? -4.706 -34.733 17.615 1.00 17.78 ? 463 LEU C O 1 ATOM 6616 C CB . LEU C 1 155 ? -2.017 -36.602 17.220 1.00 16.78 ? 463 LEU C CB 1 ATOM 6617 C CG . LEU C 1 155 ? -1.274 -37.494 16.216 1.00 19.55 ? 463 LEU C CG 1 ATOM 6618 C CD1 . LEU C 1 155 ? -0.580 -38.665 16.894 1.00 20.27 ? 463 LEU C CD1 1 ATOM 6619 C CD2 . LEU C 1 155 ? -2.216 -37.992 15.127 1.00 23.28 ? 463 LEU C CD2 1 ATOM 6620 N N . GLN C 1 156 ? -2.851 -33.701 18.347 1.00 13.01 ? 464 GLN C N 1 ATOM 6621 C CA . GLN C 1 156 ? -3.574 -32.868 19.305 1.00 13.91 ? 464 GLN C CA 1 ATOM 6622 C C . GLN C 1 156 ? -4.538 -31.917 18.585 1.00 14.20 ? 464 GLN C C 1 ATOM 6623 O O . GLN C 1 156 ? -5.685 -31.733 19.000 1.00 16.21 ? 464 GLN C O 1 ATOM 6624 C CB . GLN C 1 156 ? -2.569 -32.061 20.137 1.00 15.69 ? 464 GLN C CB 1 ATOM 6625 C CG . GLN C 1 156 ? -3.191 -31.251 21.266 1.00 21.01 ? 464 GLN C CG 1 ATOM 6626 C CD . GLN C 1 156 ? -3.355 -32.068 22.533 1.00 21.73 ? 464 GLN C CD 1 ATOM 6627 O OE1 . GLN C 1 156 ? -2.640 -33.050 22.748 1.00 24.06 ? 464 GLN C OE1 1 ATOM 6628 N NE2 . GLN C 1 156 ? -4.289 -31.662 23.384 1.00 18.62 ? 464 GLN C NE2 1 ATOM 6629 N N . ILE C 1 157 ? -4.056 -31.314 17.503 1.00 14.01 ? 465 ILE C N 1 ATOM 6630 C CA . ILE C 1 157 ? -4.825 -30.350 16.716 1.00 11.87 ? 465 ILE C CA 1 ATOM 6631 C C . ILE C 1 157 ? -6.142 -30.939 16.213 1.00 15.96 ? 465 ILE C C 1 ATOM 6632 O O . ILE C 1 157 ? -7.166 -30.257 16.175 1.00 17.47 ? 465 ILE C O 1 ATOM 6633 C CB . ILE C 1 157 ? -3.988 -29.864 15.495 1.00 13.95 ? 465 ILE C CB 1 ATOM 6634 C CG1 . ILE C 1 157 ? -2.898 -28.893 15.956 1.00 14.10 ? 465 ILE C CG1 1 ATOM 6635 C CG2 . ILE C 1 157 ? -4.880 -29.239 14.425 1.00 12.58 ? 465 ILE C CG2 1 ATOM 6636 C CD1 . ILE C 1 157 ? -1.863 -28.563 14.881 1.00 15.30 ? 465 ILE C CD1 1 ATOM 6637 N N . VAL C 1 158 ? -6.112 -32.210 15.831 1.00 12.01 ? 466 VAL C N 1 ATOM 6638 C CA . VAL C 1 158 ? -7.304 -32.852 15.276 1.00 16.47 ? 466 VAL C CA 1 ATOM 6639 C C . VAL C 1 158 ? -8.000 -33.806 16.255 1.00 18.14 ? 466 VAL C C 1 ATOM 6640 O O . VAL C 1 158 ? -8.904 -34.547 15.871 1.00 17.21 ? 466 VAL C O 1 ATOM 6641 C CB . VAL C 1 158 ? -6.987 -33.579 13.958 1.00 17.85 ? 466 VAL C CB 1 ATOM 6642 C CG1 . VAL C 1 158 ? -6.385 -32.603 12.954 1.00 15.30 ? 466 VAL C CG1 1 ATOM 6643 C CG2 . VAL C 1 158 ? -6.030 -34.754 14.201 1.00 18.43 ? 466 VAL C CG2 1 ATOM 6644 N N . CYS C 1 159 ? -7.572 -33.778 17.513 1.00 17.21 ? 467 CYS C N 1 ATOM 6645 C CA . CYS C 1 159 ? -8.156 -34.617 18.563 1.00 18.93 ? 467 CYS C CA 1 ATOM 6646 C C . CYS C 1 159 ? -8.090 -36.111 18.242 1.00 18.31 ? 467 CYS C C 1 ATOM 6647 O O . CYS C 1 159 ? -9.056 -36.855 18.450 1.00 16.74 ? 467 CYS C O 1 ATOM 6648 C CB . CYS C 1 159 ? -9.589 -34.182 18.881 1.00 23.80 ? 467 CYS C CB 1 ATOM 6649 S SG . CYS C 1 159 ? -9.703 -32.475 19.502 1.00 21.37 ? 467 CYS C SG 1 ATOM 6650 N N . ASP C 1 160 ? -6.944 -36.538 17.730 1.00 18.55 ? 468 ASP C N 1 ATOM 6651 C CA . ASP C 1 160 ? -6.655 -37.960 17.585 1.00 18.66 ? 468 ASP C CA 1 ATOM 6652 C C . ASP C 1 160 ? -5.946 -38.371 18.861 1.00 18.47 ? 468 ASP C C 1 ATOM 6653 O O . ASP C 1 160 ? -4.812 -37.968 19.106 1.00 19.41 ? 468 ASP C O 1 ATOM 6654 C CB . ASP C 1 160 ? -5.764 -38.207 16.362 1.00 17.72 ? 468 ASP C CB 1 ATOM 6655 C CG . ASP C 1 160 ? -5.593 -39.685 16.047 1.00 23.45 ? 468 ASP C CG 1 ATOM 6656 O OD1 . ASP C 1 160 ? -5.609 -40.509 16.981 1.00 25.93 ? 468 ASP C OD1 1 ATOM 6657 O OD2 . ASP C 1 160 ? -5.441 -40.023 14.856 1.00 27.36 ? 468 ASP C OD2 1 ATOM 6658 N N . TRP C 1 161 ? -6.634 -39.152 19.685 1.00 18.19 ? 469 TRP C N 1 ATOM 6659 C CA . TRP C 1 161 ? -6.094 -39.569 20.974 1.00 19.18 ? 469 TRP C CA 1 ATOM 6660 C C . TRP C 1 161 ? -5.760 -41.063 20.992 1.00 19.06 ? 469 TRP C C 1 ATOM 6661 O O . TRP C 1 161 ? -5.853 -41.717 22.029 1.00 19.94 ? 469 TRP C O 1 ATOM 6662 C CB . TRP C 1 161 ? -7.076 -39.211 22.098 1.00 20.06 ? 469 TRP C CB 1 ATOM 6663 C CG . TRP C 1 161 ? -7.419 -37.730 22.133 1.00 18.16 ? 469 TRP C CG 1 ATOM 6664 C CD1 . TRP C 1 161 ? -6.584 -36.689 21.841 1.00 18.96 ? 469 TRP C CD1 1 ATOM 6665 C CD2 . TRP C 1 161 ? -8.689 -37.149 22.446 1.00 17.94 ? 469 TRP C CD2 1 ATOM 6666 N NE1 . TRP C 1 161 ? -7.254 -35.489 21.979 1.00 17.90 ? 469 TRP C NE1 1 ATOM 6667 C CE2 . TRP C 1 161 ? -8.550 -35.747 22.335 1.00 18.75 ? 469 TRP C CE2 1 ATOM 6668 C CE3 . TRP C 1 161 ? -9.932 -37.675 22.817 1.00 18.31 ? 469 TRP C CE3 1 ATOM 6669 C CZ2 . TRP C 1 161 ? -9.608 -34.868 22.586 1.00 16.21 ? 469 TRP C CZ2 1 ATOM 6670 C CZ3 . TRP C 1 161 ? -10.980 -36.803 23.059 1.00 23.02 ? 469 TRP C CZ3 1 ATOM 6671 C CH2 . TRP C 1 161 ? -10.810 -35.415 22.945 1.00 21.38 ? 469 TRP C CH2 1 ATOM 6672 N N . THR C 1 162 ? -5.362 -41.604 19.845 1.00 22.00 ? 470 THR C N 1 ATOM 6673 C CA . THR C 1 162 ? -4.934 -43.004 19.800 1.00 24.93 ? 470 THR C CA 1 ATOM 6674 C C . THR C 1 162 ? -3.689 -43.160 20.669 1.00 24.25 ? 470 THR C C 1 ATOM 6675 O O . THR C 1 162 ? -2.754 -42.371 20.542 1.00 20.63 ? 470 THR C O 1 ATOM 6676 C CB . THR C 1 162 ? -4.602 -43.447 18.370 1.00 30.94 ? 470 THR C CB 1 ATOM 6677 O OG1 . THR C 1 162 ? -5.691 -43.112 17.502 1.00 30.72 ? 470 THR C OG1 1 ATOM 6678 C CG2 . THR C 1 162 ? -4.346 -44.957 18.320 1.00 32.87 ? 470 THR C CG2 1 ATOM 6679 N N . ASP C 1 163 ? -3.697 -44.148 21.566 1.00 25.53 ? 471 ASP C N 1 ATOM 6680 C CA . ASP C 1 163 ? -2.567 -44.402 22.470 1.00 29.36 ? 471 ASP C CA 1 ATOM 6681 C C . ASP C 1 163 ? -2.124 -43.147 23.228 1.00 29.32 ? 471 ASP C C 1 ATOM 6682 O O . ASP C 1 163 ? -0.927 -42.924 23.441 1.00 23.29 ? 471 ASP C O 1 ATOM 6683 C CB . ASP C 1 163 ? -1.382 -44.981 21.695 1.00 32.83 ? 471 ASP C CB 1 ATOM 6684 C CG . ASP C 1 163 ? -1.732 -46.266 20.977 1.00 40.03 ? 471 ASP C CG 1 ATOM 6685 O OD1 . ASP C 1 163 ? -2.588 -47.016 21.488 1.00 45.02 ? 471 ASP C OD1 1 ATOM 6686 O OD2 . ASP C 1 163 ? -1.155 -46.525 19.899 1.00 44.34 ? 471 ASP C OD2 1 ATOM 6687 N N . TYR C 1 164 ? -3.097 -42.336 23.635 1.00 27.62 ? 472 TYR C N 1 ATOM 6688 C CA . TYR C 1 164 ? -2.812 -41.015 24.187 1.00 26.27 ? 472 TYR C CA 1 ATOM 6689 C C . TYR C 1 164 ? -1.911 -41.046 25.424 1.00 24.83 ? 472 TYR C C 1 ATOM 6690 O O . TYR C 1 164 ? -0.919 -40.318 25.498 1.00 21.62 ? 472 TYR C O 1 ATOM 6691 C CB . TYR C 1 164 ? -4.117 -40.272 24.493 1.00 28.62 ? 472 TYR C CB 1 ATOM 6692 C CG . TYR C 1 164 ? -3.905 -38.908 25.107 1.00 26.53 ? 472 TYR C CG 1 ATOM 6693 C CD1 . TYR C 1 164 ? -3.616 -37.799 24.316 1.00 24.66 ? 472 TYR C CD1 1 ATOM 6694 C CD2 . TYR C 1 164 ? -3.992 -38.731 26.480 1.00 28.72 ? 472 TYR C CD2 1 ATOM 6695 C CE1 . TYR C 1 164 ? -3.421 -36.553 24.887 1.00 25.19 ? 472 TYR C CE1 1 ATOM 6696 C CE2 . TYR C 1 164 ? -3.799 -37.500 27.053 1.00 28.36 ? 472 TYR C CE2 1 ATOM 6697 C CZ . TYR C 1 164 ? -3.514 -36.415 26.258 1.00 27.48 ? 472 TYR C CZ 1 ATOM 6698 O OH . TYR C 1 164 ? -3.325 -35.193 26.863 1.00 29.61 ? 472 TYR C OH 1 ATOM 6699 N N . ASP C 1 165 ? -2.251 -41.891 26.389 1.00 22.71 ? 473 ASP C N 1 ATOM 6700 C CA . ASP C 1 165 ? -1.472 -41.983 27.620 1.00 27.87 ? 473 ASP C CA 1 ATOM 6701 C C . ASP C 1 165 ? -0.023 -42.388 27.362 1.00 27.48 ? 473 ASP C C 1 ATOM 6702 O O . ASP C 1 165 ? 0.892 -41.841 27.968 1.00 29.38 ? 473 ASP C O 1 ATOM 6703 C CB . ASP C 1 165 ? -2.125 -42.950 28.610 1.00 34.99 ? 473 ASP C CB 1 ATOM 6704 C CG . ASP C 1 165 ? -3.421 -42.410 29.171 1.00 39.07 ? 473 ASP C CG 1 ATOM 6705 O OD1 . ASP C 1 165 ? -3.646 -41.188 29.056 1.00 37.05 ? 473 ASP C OD1 1 ATOM 6706 O OD2 . ASP C 1 165 ? -4.209 -43.204 29.728 1.00 43.46 ? 473 ASP C OD2 1 ATOM 6707 N N . GLU C 1 166 ? 0.175 -43.346 26.464 1.00 27.07 ? 474 GLU C N 1 ATOM 6708 C CA . GLU C 1 166 ? 1.516 -43.794 26.106 1.00 29.11 ? 474 GLU C CA 1 ATOM 6709 C C . GLU C 1 166 ? 2.243 -42.707 25.326 1.00 22.88 ? 474 GLU C C 1 ATOM 6710 O O . GLU C 1 166 ? 3.451 -42.503 25.488 1.00 22.67 ? 474 GLU C O 1 ATOM 6711 C CB . GLU C 1 166 ? 1.439 -45.078 25.280 1.00 39.35 ? 474 GLU C CB 1 ATOM 6712 C CG . GLU C 1 166 ? 2.760 -45.510 24.668 1.00 49.03 ? 474 GLU C CG 1 ATOM 6713 C CD . GLU C 1 166 ? 2.597 -46.661 23.691 1.00 55.98 ? 474 GLU C CD 1 ATOM 6714 O OE1 . GLU C 1 166 ? 3.607 -47.069 23.078 1.00 59.38 ? 474 GLU C OE1 1 ATOM 6715 O OE2 . GLU C 1 166 ? 1.460 -47.158 23.538 1.00 57.63 ? 474 GLU C OE2 1 ATOM 6716 N N . ARG C 1 167 ? 1.498 -42.008 24.475 1.00 21.42 ? 475 ARG C N 1 ATOM 6717 C CA . ARG C 1 167 ? 2.051 -40.894 23.713 1.00 21.11 ? 475 ARG C CA 1 ATOM 6718 C C . ARG C 1 167 ? 2.579 -39.811 24.649 1.00 23.06 ? 475 ARG C C 1 ATOM 6719 O O . ARG C 1 167 ? 3.665 -39.278 24.437 1.00 23.02 ? 475 ARG C O 1 ATOM 6720 C CB . ARG C 1 167 ? 0.993 -40.301 22.785 1.00 21.91 ? 475 ARG C CB 1 ATOM 6721 C CG . ARG C 1 167 ? 1.519 -39.183 21.886 1.00 24.95 ? 475 ARG C CG 1 ATOM 6722 C CD . ARG C 1 167 ? 0.365 -38.415 21.262 1.00 29.06 ? 475 ARG C CD 1 ATOM 6723 N NE . ARG C 1 167 ? -0.639 -39.310 20.690 1.00 29.23 ? 475 ARG C NE 1 ATOM 6724 C CZ . ARG C 1 167 ? -1.864 -38.929 20.337 1.00 31.02 ? 475 ARG C CZ 1 ATOM 6725 N NH1 . ARG C 1 167 ? -2.249 -37.667 20.493 1.00 30.34 ? 475 ARG C NH1 1 ATOM 6726 N NH2 . ARG C 1 167 ? -2.708 -39.810 19.827 1.00 31.62 ? 475 ARG C NH2 1 ATOM 6727 N N . MET C 1 168 ? 1.811 -39.496 25.691 1.00 22.61 ? 476 MET C N 1 ATOM 6728 C CA . MET C 1 168 ? 2.223 -38.477 26.651 1.00 20.66 ? 476 MET C CA 1 ATOM 6729 C C . MET C 1 168 ? 3.480 -38.896 27.414 1.00 20.70 ? 476 MET C C 1 ATOM 6730 O O . MET C 1 168 ? 4.364 -38.073 27.652 1.00 23.02 ? 476 MET C O 1 ATOM 6731 C CB . MET C 1 168 ? 1.095 -38.151 27.636 1.00 21.10 ? 476 MET C CB 1 ATOM 6732 C CG . MET C 1 168 ? -0.139 -37.515 27.020 1.00 21.17 ? 476 MET C CG 1 ATOM 6733 S SD . MET C 1 168 ? 0.195 -35.937 26.193 1.00 25.71 ? 476 MET C SD 1 ATOM 6734 C CE . MET C 1 168 ? 0.218 -36.447 24.475 1.00 27.94 ? 476 MET C CE 1 ATOM 6735 N N . LYS C 1 169 ? 3.561 -40.171 27.795 1.00 19.33 ? 477 LYS C N 1 ATOM 6736 C CA . LYS C 1 169 ? 4.739 -40.666 28.506 1.00 23.56 ? 477 LYS C CA 1 ATOM 6737 C C . LYS C 1 169 ? 5.996 -40.586 27.643 1.00 25.70 ? 477 LYS C C 1 ATOM 6738 O O . LYS C 1 169 ? 7.087 -40.274 28.139 1.00 25.15 ? 477 LYS C O 1 ATOM 6739 C CB . LYS C 1 169 ? 4.536 -42.109 28.974 1.00 27.02 ? 477 LYS C CB 1 ATOM 6740 C CG . LYS C 1 169 ? 3.549 -42.279 30.120 1.00 32.01 ? 477 LYS C CG 1 ATOM 6741 C CD . LYS C 1 169 ? 3.500 -43.740 30.563 1.00 37.23 ? 477 LYS C CD 1 ATOM 6742 C CE . LYS C 1 169 ? 2.381 -43.989 31.565 1.00 41.53 ? 477 LYS C CE 1 ATOM 6743 N NZ . LYS C 1 169 ? 2.289 -45.436 31.921 1.00 45.25 ? 477 LYS C NZ 1 ATOM 6744 N N . LYS C 1 170 ? 5.847 -40.879 26.356 1.00 23.10 ? 478 LYS C N 1 ATOM 6745 C CA . LYS C 1 170 ? 6.986 -40.834 25.447 1.00 25.11 ? 478 LYS C CA 1 ATOM 6746 C C . LYS C 1 170 ? 7.506 -39.413 25.270 1.00 23.02 ? 478 LYS C C 1 ATOM 6747 O O . LYS C 1 170 ? 8.719 -39.196 25.254 1.00 25.86 ? 478 LYS C O 1 ATOM 6748 C CB . LYS C 1 170 ? 6.662 -41.470 24.091 1.00 29.28 ? 478 LYS C CB 1 ATOM 6749 C CG . LYS C 1 170 ? 7.890 -41.622 23.201 1.00 33.77 ? 478 LYS C CG 1 ATOM 6750 C CD . LYS C 1 170 ? 7.684 -42.645 22.102 1.00 38.69 ? 478 LYS C CD 1 ATOM 6751 C CE . LYS C 1 170 ? 8.976 -42.879 21.325 1.00 44.54 ? 478 LYS C CE 1 ATOM 6752 N NZ . LYS C 1 170 ? 8.800 -43.866 20.220 1.00 45.67 ? 478 LYS C NZ 1 ATOM 6753 N N . LEU C 1 171 ? 6.586 -38.455 25.141 1.00 21.52 ? 479 LEU C N 1 ATOM 6754 C CA . LEU C 1 171 ? 6.935 -37.041 25.014 1.00 22.49 ? 479 LEU C CA 1 ATOM 6755 C C . LEU C 1 171 ? 7.747 -36.561 26.209 1.00 21.27 ? 479 LEU C C 1 ATOM 6756 O O . LEU C 1 171 ? 8.743 -35.861 26.051 1.00 23.26 ? 479 LEU C O 1 ATOM 6757 C CB . LEU C 1 171 ? 5.673 -36.178 24.897 1.00 22.95 ? 479 LEU C CB 1 ATOM 6758 C CG . LEU C 1 171 ? 4.857 -36.236 23.605 1.00 25.08 ? 479 LEU C CG 1 ATOM 6759 C CD1 . LEU C 1 171 ? 3.583 -35.401 23.747 1.00 21.37 ? 479 LEU C CD1 1 ATOM 6760 C CD2 . LEU C 1 171 ? 5.677 -35.741 22.424 1.00 24.74 ? 479 LEU C CD2 1 ATOM 6761 N N . VAL C 1 172 ? 7.298 -36.921 27.406 1.00 20.98 ? 480 VAL C N 1 ATOM 6762 C CA . VAL C 1 172 ? 8.015 -36.567 28.621 1.00 24.34 ? 480 VAL C CA 1 ATOM 6763 C C . VAL C 1 172 ? 9.391 -37.219 28.620 1.00 24.11 ? 480 VAL C C 1 ATOM 6764 O O . VAL C 1 172 ? 10.390 -36.589 28.979 1.00 26.59 ? 480 VAL C O 1 ATOM 6765 C CB . VAL C 1 172 ? 7.245 -37.008 29.877 1.00 26.87 ? 480 VAL C CB 1 ATOM 6766 C CG1 . VAL C 1 172 ? 8.042 -36.670 31.125 1.00 27.71 ? 480 VAL C CG1 1 ATOM 6767 C CG2 . VAL C 1 172 ? 5.885 -36.342 29.915 1.00 25.28 ? 480 VAL C CG2 1 ATOM 6768 N N . SER C 1 173 ? 9.431 -38.483 28.208 1.00 21.20 ? 481 SER C N 1 ATOM 6769 C CA A SER C 1 173 ? 10.674 -39.237 28.136 0.56 21.55 ? 481 SER C CA 1 ATOM 6770 C CA B SER C 1 173 ? 10.682 -39.230 28.145 0.44 24.43 ? 481 SER C CA 1 ATOM 6771 C C . SER C 1 173 ? 11.662 -38.607 27.155 1.00 25.29 ? 481 SER C C 1 ATOM 6772 O O . SER C 1 173 ? 12.861 -38.524 27.432 1.00 26.44 ? 481 SER C O 1 ATOM 6773 C CB A SER C 1 173 ? 10.386 -40.681 27.729 0.56 22.50 ? 481 SER C CB 1 ATOM 6774 C CB B SER C 1 173 ? 10.422 -40.693 27.784 0.44 22.56 ? 481 SER C CB 1 ATOM 6775 O OG A SER C 1 173 ? 11.589 -41.387 27.508 0.56 24.18 ? 481 SER C OG 1 ATOM 6776 O OG B SER C 1 173 ? 9.765 -41.368 28.842 0.44 26.02 ? 481 SER C OG 1 ATOM 6777 N N . ILE C 1 174 ? 11.148 -38.172 26.006 1.00 23.35 ? 482 ILE C N 1 ATOM 6778 C CA . ILE C 1 174 ? 11.966 -37.535 24.978 1.00 24.61 ? 482 ILE C CA 1 ATOM 6779 C C . ILE C 1 174 ? 12.560 -36.225 25.483 1.00 25.13 ? 482 ILE C C 1 ATOM 6780 O O . ILE C 1 174 ? 13.753 -35.974 25.325 1.00 25.86 ? 482 ILE C O 1 ATOM 6781 C CB . ILE C 1 174 ? 11.143 -37.240 23.701 1.00 25.80 ? 482 ILE C CB 1 ATOM 6782 C CG1 . ILE C 1 174 ? 10.853 -38.534 22.941 1.00 29.38 ? 482 ILE C CG1 1 ATOM 6783 C CG2 . ILE C 1 174 ? 11.877 -36.251 22.802 1.00 24.05 ? 482 ILE C CG2 1 ATOM 6784 C CD1 . ILE C 1 174 ? 9.799 -38.383 21.854 1.00 30.92 ? 482 ILE C CD1 1 ATOM 6785 N N . VAL C 1 175 ? 11.717 -35.390 26.083 1.00 26.02 ? 483 VAL C N 1 ATOM 6786 C CA . VAL C 1 175 ? 12.165 -34.107 26.617 1.00 26.15 ? 483 VAL C CA 1 ATOM 6787 C C . VAL C 1 175 ? 13.228 -34.316 27.693 1.00 26.96 ? 483 VAL C C 1 ATOM 6788 O O . VAL C 1 175 ? 14.257 -33.640 27.698 1.00 27.86 ? 483 VAL C O 1 ATOM 6789 C CB . VAL C 1 175 ? 10.987 -33.277 27.177 1.00 26.31 ? 483 VAL C CB 1 ATOM 6790 C CG1 . VAL C 1 175 ? 11.495 -32.056 27.943 1.00 25.42 ? 483 VAL C CG1 1 ATOM 6791 C CG2 . VAL C 1 175 ? 10.061 -32.855 26.045 1.00 25.66 ? 483 VAL C CG2 1 ATOM 6792 N N . ALA C 1 176 ? 12.983 -35.265 28.590 1.00 26.88 ? 484 ALA C N 1 ATOM 6793 C CA . ALA C 1 176 ? 13.938 -35.577 29.648 1.00 28.93 ? 484 ALA C CA 1 ATOM 6794 C C . ALA C 1 176 ? 15.309 -35.943 29.082 1.00 30.61 ? 484 ALA C C 1 ATOM 6795 O O . ALA C 1 176 ? 16.339 -35.506 29.600 1.00 30.50 ? 484 ALA C O 1 ATOM 6796 C CB . ALA C 1 176 ? 13.407 -36.698 30.535 1.00 29.89 ? 484 ALA C CB 1 ATOM 6797 N N . ASP C 1 177 ? 15.316 -36.736 28.014 1.00 29.72 ? 485 ASP C N 1 ATOM 6798 C CA . ASP C 1 177 ? 16.561 -37.179 27.393 1.00 30.81 ? 485 ASP C CA 1 ATOM 6799 C C . ASP C 1 177 ? 17.279 -36.005 26.736 1.00 30.25 ? 485 ASP C C 1 ATOM 6800 O O . ASP C 1 177 ? 18.494 -35.843 26.880 1.00 32.26 ? 485 ASP C O 1 ATOM 6801 C CB . ASP C 1 177 ? 16.281 -38.275 26.359 1.00 36.12 ? 485 ASP C CB 1 ATOM 6802 C CG . ASP C 1 177 ? 17.549 -38.838 25.734 1.00 46.06 ? 485 ASP C CG 1 ATOM 6803 O OD1 . ASP C 1 177 ? 18.468 -39.237 26.483 1.00 47.56 ? 485 ASP C OD1 1 ATOM 6804 O OD2 . ASP C 1 177 ? 17.624 -38.885 24.487 1.00 49.48 ? 485 ASP C OD2 1 ATOM 6805 N N . GLN C 1 178 ? 16.523 -35.184 26.016 1.00 27.36 ? 486 GLN C N 1 ATOM 6806 C CA . GLN C 1 178 ? 17.109 -34.048 25.308 1.00 28.56 ? 486 GLN C CA 1 ATOM 6807 C C . GLN C 1 178 ? 17.696 -33.029 26.281 1.00 29.79 ? 486 GLN C C 1 ATOM 6808 O O . GLN C 1 178 ? 18.781 -32.493 26.049 1.00 34.82 ? 486 GLN C O 1 ATOM 6809 C CB . GLN C 1 178 ? 16.080 -33.406 24.375 1.00 26.45 ? 486 GLN C CB 1 ATOM 6810 C CG . GLN C 1 178 ? 15.640 -34.338 23.251 1.00 28.35 ? 486 GLN C CG 1 ATOM 6811 C CD . GLN C 1 178 ? 14.651 -33.705 22.297 1.00 29.36 ? 486 GLN C CD 1 ATOM 6812 O OE1 . GLN C 1 178 ? 13.611 -33.193 22.708 1.00 30.35 ? 486 GLN C OE1 1 ATOM 6813 N NE2 . GLN C 1 178 ? 14.968 -33.747 21.008 1.00 30.47 ? 486 GLN C NE2 1 ATOM 6814 N N . LEU C 1 179 ? 16.991 -32.780 27.379 1.00 30.90 ? 487 LEU C N 1 ATOM 6815 C CA . LEU C 1 179 ? 17.498 -31.880 28.412 1.00 33.42 ? 487 LEU C CA 1 ATOM 6816 C C . LEU C 1 179 ? 18.797 -32.413 29.015 1.00 35.70 ? 487 LEU C C 1 ATOM 6817 O O . LEU C 1 179 ? 19.721 -31.648 29.292 1.00 37.95 ? 487 LEU C O 1 ATOM 6818 C CB . LEU C 1 179 ? 16.455 -31.665 29.511 1.00 31.38 ? 487 LEU C CB 1 ATOM 6819 C CG . LEU C 1 179 ? 15.217 -30.837 29.155 1.00 30.55 ? 487 LEU C CG 1 ATOM 6820 C CD1 . LEU C 1 179 ? 14.304 -30.717 30.370 1.00 30.45 ? 487 LEU C CD1 1 ATOM 6821 C CD2 . LEU C 1 179 ? 15.626 -29.461 28.640 1.00 29.79 ? 487 LEU C CD2 1 ATOM 6822 N N . GLU C 1 180 ? 18.859 -33.725 29.220 1.00 37.50 ? 488 GLU C N 1 ATOM 6823 C CA . GLU C 1 180 ? 20.052 -34.359 29.775 1.00 42.74 ? 488 GLU C CA 1 ATOM 6824 C C . GLU C 1 180 ? 21.235 -34.243 28.833 1.00 47.28 ? 488 GLU C C 1 ATOM 6825 O O . GLU C 1 180 ? 22.357 -33.979 29.257 1.00 50.05 ? 488 GLU C O 1 ATOM 6826 C CB . GLU C 1 180 ? 19.801 -35.840 30.055 1.00 46.71 ? 488 GLU C CB 1 ATOM 6827 C CG . GLU C 1 180 ? 18.950 -36.131 31.269 1.00 52.20 ? 488 GLU C CG 1 ATOM 6828 C CD . GLU C 1 180 ? 18.946 -37.609 31.619 1.00 57.94 ? 488 GLU C CD 1 ATOM 6829 O OE1 . GLU C 1 180 ? 19.866 -38.329 31.171 1.00 57.15 ? 488 GLU C OE1 1 ATOM 6830 O OE2 . GLU C 1 180 ? 18.022 -38.050 32.337 1.00 61.72 ? 488 GLU C OE2 1 ATOM 6831 N N . LYS C 1 181 ? 20.981 -34.459 27.549 1.00 48.19 ? 489 LYS C N 1 ATOM 6832 C CA . LYS C 1 181 ? 22.050 -34.487 26.561 1.00 51.26 ? 489 LYS C CA 1 ATOM 6833 C C . LYS C 1 181 ? 22.359 -33.097 26.018 1.00 51.78 ? 489 LYS C C 1 ATOM 6834 O O . LYS C 1 181 ? 23.102 -32.954 25.048 1.00 52.29 ? 489 LYS C O 1 ATOM 6835 C CB . LYS C 1 181 ? 21.701 -35.460 25.434 1.00 53.03 ? 489 LYS C CB 1 ATOM 6836 C CG . LYS C 1 181 ? 21.651 -36.907 25.900 1.00 56.78 ? 489 LYS C CG 1 ATOM 6837 C CD . LYS C 1 181 ? 21.220 -37.848 24.791 1.00 60.62 ? 489 LYS C CD 1 ATOM 6838 C CE . LYS C 1 181 ? 21.374 -39.299 25.223 1.00 63.85 ? 489 LYS C CE 1 ATOM 6839 N NZ . LYS C 1 181 ? 20.859 -40.243 24.193 1.00 65.73 ? 489 LYS C NZ 1 ATOM 6840 N N . ASN C 1 182 ? 21.787 -32.082 26.661 1.00 51.92 ? 490 ASN C N 1 ATOM 6841 C CA . ASN C 1 182 ? 22.036 -30.684 26.316 1.00 54.83 ? 490 ASN C CA 1 ATOM 6842 C C . ASN C 1 182 ? 21.703 -30.359 24.862 1.00 54.47 ? 490 ASN C C 1 ATOM 6843 O O . ASN C 1 182 ? 22.533 -29.829 24.120 1.00 55.67 ? 490 ASN C O 1 ATOM 6844 C CB . ASN C 1 182 ? 23.482 -30.291 26.645 1.00 61.03 ? 490 ASN C CB 1 ATOM 6845 C CG . ASN C 1 182 ? 23.699 -28.790 26.614 1.00 65.14 ? 490 ASN C CG 1 ATOM 6846 O OD1 . ASN C 1 182 ? 23.154 -28.057 27.440 1.00 65.62 ? 490 ASN C OD1 1 ATOM 6847 N ND2 . ASN C 1 182 ? 24.503 -28.326 25.663 1.00 68.06 ? 490 ASN C ND2 1 ATOM 6848 N N . ARG C 1 183 ? 20.482 -30.692 24.459 1.00 51.66 ? 491 ARG C N 1 ATOM 6849 C CA . ARG C 1 183 ? 20.005 -30.369 23.123 1.00 51.04 ? 491 ARG C CA 1 ATOM 6850 C C . ARG C 1 183 ? 18.674 -29.632 23.213 1.00 46.81 ? 491 ARG C C 1 ATOM 6851 O O . ARG C 1 183 ? 17.937 -29.792 24.184 1.00 45.01 ? 491 ARG C O 1 ATOM 6852 C CB . ARG C 1 183 ? 19.868 -31.637 22.278 1.00 54.40 ? 491 ARG C CB 1 ATOM 6853 C CG . ARG C 1 183 ? 21.161 -32.434 22.158 1.00 62.30 ? 491 ARG C CG 1 ATOM 6854 C CD . ARG C 1 183 ? 21.246 -33.161 20.827 1.00 67.66 ? 491 ARG C CD 1 ATOM 6855 N NE . ARG C 1 183 ? 21.084 -32.239 19.706 1.00 71.48 ? 491 ARG C NE 1 ATOM 6856 C CZ . ARG C 1 183 ? 21.177 -32.586 18.427 1.00 73.99 ? 491 ARG C CZ 1 ATOM 6857 N NH1 . ARG C 1 183 ? 21.439 -33.843 18.096 1.00 75.52 ? 491 ARG C NH1 1 ATOM 6858 N NH2 . ARG C 1 183 ? 21.010 -31.674 17.479 1.00 74.77 ? 491 ARG C NH2 1 ATOM 6859 N N . LEU C 1 184 ? 18.381 -28.810 22.210 1.00 44.05 ? 492 LEU C N 1 ATOM 6860 C CA . LEU C 1 184 ? 17.122 -28.079 22.167 1.00 39.08 ? 492 LEU C CA 1 ATOM 6861 C C . LEU C 1 184 ? 15.970 -29.074 22.070 1.00 36.81 ? 492 LEU C C 1 ATOM 6862 O O . LEU C 1 184 ? 15.902 -29.859 21.124 1.00 39.10 ? 492 LEU C O 1 ATOM 6863 C CB . LEU C 1 184 ? 17.096 -27.122 20.975 1.00 41.08 ? 492 LEU C CB 1 ATOM 6864 C CG . LEU C 1 184 ? 15.905 -26.164 20.886 1.00 40.27 ? 492 LEU C CG 1 ATOM 6865 C CD1 . LEU C 1 184 ? 15.975 -25.110 21.980 1.00 40.01 ? 492 LEU C CD1 1 ATOM 6866 C CD2 . LEU C 1 184 ? 15.834 -25.512 19.509 1.00 42.96 ? 492 LEU C CD2 1 ATOM 6867 N N . PRO C 1 185 ? 15.071 -29.060 23.064 1.00 31.68 ? 493 PRO C N 1 ATOM 6868 C CA . PRO C 1 185 ? 13.968 -30.026 23.103 1.00 28.66 ? 493 PRO C CA 1 ATOM 6869 C C . PRO C 1 185 ? 13.078 -29.954 21.867 1.00 30.02 ? 493 PRO C C 1 ATOM 6870 O O . PRO C 1 185 ? 12.903 -28.880 21.285 1.00 29.46 ? 493 PRO C O 1 ATOM 6871 C CB . PRO C 1 185 ? 13.201 -29.622 24.362 1.00 26.09 ? 493 PRO C CB 1 ATOM 6872 C CG . PRO C 1 185 ? 14.252 -29.010 25.240 1.00 28.32 ? 493 PRO C CG 1 ATOM 6873 C CD . PRO C 1 185 ? 15.136 -28.250 24.293 1.00 30.32 ? 493 PRO C CD 1 ATOM 6874 N N . SER C 1 186 ? 12.537 -31.101 21.467 1.00 27.66 ? 494 SER C N 1 ATOM 6875 C CA . SER C 1 186 ? 11.688 -31.177 20.284 1.00 26.18 ? 494 SER C CA 1 ATOM 6876 C C . SER C 1 186 ? 10.272 -30.679 20.572 1.00 24.16 ? 494 SER C C 1 ATOM 6877 O O . SER C 1 186 ? 9.479 -30.476 19.650 1.00 27.28 ? 494 SER C O 1 ATOM 6878 C CB . SER C 1 186 ? 11.656 -32.605 19.737 1.00 25.96 ? 494 SER C CB 1 ATOM 6879 O OG . SER C 1 186 ? 12.957 -33.023 19.354 1.00 28.57 ? 494 SER C OG 1 ATOM 6880 N N . VAL C 1 187 ? 9.956 -30.493 21.851 1.00 20.49 ? 495 VAL C N 1 ATOM 6881 C CA . VAL C 1 187 ? 8.678 -29.896 22.237 1.00 21.22 ? 495 VAL C CA 1 ATOM 6882 C C . VAL C 1 187 ? 8.826 -28.380 22.345 1.00 21.20 ? 495 VAL C C 1 ATOM 6883 O O . VAL C 1 187 ? 9.682 -27.886 23.081 1.00 19.17 ? 495 VAL C O 1 ATOM 6884 C CB . VAL C 1 187 ? 8.159 -30.461 23.567 1.00 23.10 ? 495 VAL C CB 1 ATOM 6885 C CG1 . VAL C 1 187 ? 6.953 -29.657 24.064 1.00 17.60 ? 495 VAL C CG1 1 ATOM 6886 C CG2 . VAL C 1 187 ? 7.795 -31.934 23.405 1.00 23.06 ? 495 VAL C CG2 1 ATOM 6887 N N . HIS C 1 188 ? 8.001 -27.652 21.597 1.00 19.36 ? 496 HIS C N 1 ATOM 6888 C CA . HIS C 1 188 ? 8.041 -26.193 21.606 1.00 21.08 ? 496 HIS C CA 1 ATOM 6889 C C . HIS C 1 188 ? 7.497 -25.690 22.938 1.00 20.11 ? 496 HIS C C 1 ATOM 6890 O O . HIS C 1 188 ? 6.534 -26.257 23.464 1.00 18.40 ? 496 HIS C O 1 ATOM 6891 C CB . HIS C 1 188 ? 7.196 -25.646 20.450 1.00 19.39 ? 496 HIS C CB 1 ATOM 6892 C CG . HIS C 1 188 ? 7.404 -24.188 20.184 1.00 19.53 ? 496 HIS C CG 1 ATOM 6893 N ND1 . HIS C 1 188 ? 6.860 -23.200 20.979 1.00 19.71 ? 496 HIS C ND1 1 ATOM 6894 C CD2 . HIS C 1 188 ? 8.084 -23.549 19.203 1.00 20.49 ? 496 HIS C CD2 1 ATOM 6895 C CE1 . HIS C 1 188 ? 7.211 -22.017 20.508 1.00 23.67 ? 496 HIS C CE1 1 ATOM 6896 N NE2 . HIS C 1 188 ? 7.953 -22.200 19.430 1.00 22.47 ? 496 HIS C NE2 1 ATOM 6897 N N . PRO C 1 189 ? 8.110 -24.630 23.500 1.00 20.70 ? 497 PRO C N 1 ATOM 6898 C CA . PRO C 1 189 ? 7.650 -24.123 24.800 1.00 19.76 ? 497 PRO C CA 1 ATOM 6899 C C . PRO C 1 189 ? 6.178 -23.699 24.790 1.00 20.96 ? 497 PRO C C 1 ATOM 6900 O O . PRO C 1 189 ? 5.493 -23.877 25.796 1.00 20.62 ? 497 PRO C O 1 ATOM 6901 C CB . PRO C 1 189 ? 8.570 -22.918 25.067 1.00 22.07 ? 497 PRO C CB 1 ATOM 6902 C CG . PRO C 1 189 ? 9.196 -22.598 23.748 1.00 24.49 ? 497 PRO C CG 1 ATOM 6903 C CD . PRO C 1 189 ? 9.282 -23.890 23.004 1.00 22.93 ? 497 PRO C CD 1 ATOM 6904 N N . HIS C 1 190 ? 5.689 -23.176 23.670 1.00 19.75 ? 498 HIS C N 1 ATOM 6905 C CA . HIS C 1 190 ? 4.271 -22.819 23.591 1.00 19.10 ? 498 HIS C CA 1 ATOM 6906 C C . HIS C 1 190 ? 3.379 -24.056 23.721 1.00 24.38 ? 498 HIS C C 1 ATOM 6907 O O . HIS C 1 190 ? 2.301 -23.992 24.310 1.00 27.76 ? 498 HIS C O 1 ATOM 6908 C CB . HIS C 1 190 ? 3.950 -22.080 22.296 1.00 22.18 ? 498 HIS C CB 1 ATOM 6909 C CG . HIS C 1 190 ? 2.582 -21.471 22.280 1.00 27.78 ? 498 HIS C CG 1 ATOM 6910 N ND1 . HIS C 1 190 ? 1.541 -21.994 21.544 1.00 29.53 ? 498 HIS C ND1 1 ATOM 6911 C CD2 . HIS C 1 190 ? 2.079 -20.391 22.927 1.00 30.06 ? 498 HIS C CD2 1 ATOM 6912 C CE1 . HIS C 1 190 ? 0.459 -21.257 21.728 1.00 30.39 ? 498 HIS C CE1 1 ATOM 6913 N NE2 . HIS C 1 190 ? 0.759 -20.279 22.563 1.00 32.07 ? 498 HIS C NE2 1 ATOM 6914 N N . HIS C 1 191 ? 3.836 -25.178 23.175 1.00 22.48 ? 499 HIS C N 1 ATOM 6915 C CA . HIS C 1 191 ? 3.048 -26.409 23.201 1.00 20.51 ? 499 HIS C CA 1 ATOM 6916 C C . HIS C 1 191 ? 3.201 -27.166 24.517 1.00 20.07 ? 499 HIS C C 1 ATOM 6917 O O . HIS C 1 191 ? 2.399 -28.053 24.820 1.00 20.44 ? 499 HIS C O 1 ATOM 6918 C CB . HIS C 1 191 ? 3.451 -27.331 22.042 1.00 20.22 ? 499 HIS C CB 1 ATOM 6919 C CG . HIS C 1 191 ? 3.310 -26.707 20.689 1.00 22.57 ? 499 HIS C CG 1 ATOM 6920 N ND1 . HIS C 1 191 ? 3.907 -27.233 19.564 1.00 20.88 ? 499 HIS C ND1 1 ATOM 6921 C CD2 . HIS C 1 191 ? 2.631 -25.608 20.277 1.00 22.36 ? 499 HIS C CD2 1 ATOM 6922 C CE1 . HIS C 1 191 ? 3.609 -26.481 18.519 1.00 23.39 ? 499 HIS C CE1 1 ATOM 6923 N NE2 . HIS C 1 191 ? 2.836 -25.489 18.924 1.00 20.98 ? 499 HIS C NE2 1 ATOM 6924 N N . SER C 1 192 ? 4.225 -26.821 25.300 1.00 20.05 ? 500 SER C N 1 ATOM 6925 C CA . SER C 1 192 ? 4.569 -27.597 26.497 1.00 20.15 ? 500 SER C CA 1 ATOM 6926 C C . SER C 1 192 ? 3.452 -27.600 27.543 1.00 21.06 ? 500 SER C C 1 ATOM 6927 O O . SER C 1 192 ? 3.376 -28.495 28.383 1.00 21.19 ? 500 SER C O 1 ATOM 6928 C CB . SER C 1 192 ? 5.893 -27.118 27.116 1.00 20.46 ? 500 SER C CB 1 ATOM 6929 O OG . SER C 1 192 ? 5.747 -25.857 27.748 1.00 23.59 ? 500 SER C OG 1 ATOM 6930 N N . MET C 1 193 ? 2.577 -26.601 27.473 1.00 21.15 ? 501 MET C N 1 ATOM 6931 C CA . MET C 1 193 ? 1.412 -26.531 28.340 1.00 24.00 ? 501 MET C CA 1 ATOM 6932 C C . MET C 1 193 ? 0.411 -27.666 28.118 1.00 21.11 ? 501 MET C C 1 ATOM 6933 O O . MET C 1 193 ? -0.455 -27.895 28.960 1.00 21.49 ? 501 MET C O 1 ATOM 6934 C CB . MET C 1 193 ? 0.695 -25.194 28.140 1.00 24.29 ? 501 MET C CB 1 ATOM 6935 C CG . MET C 1 193 ? 0.289 -24.936 26.692 1.00 25.40 ? 501 MET C CG 1 ATOM 6936 S SD . MET C 1 193 ? -0.448 -23.307 26.469 1.00 42.54 ? 501 MET C SD 1 ATOM 6937 C CE . MET C 1 193 ? -1.066 -23.445 24.789 1.00 33.03 ? 501 MET C CE 1 ATOM 6938 N N . LEU C 1 194 ? 0.516 -28.361 26.987 1.00 17.44 ? 502 LEU C N 1 ATOM 6939 C CA . LEU C 1 194 ? -0.483 -29.361 26.612 1.00 18.42 ? 502 LEU C CA 1 ATOM 6940 C C . LEU C 1 194 ? -0.141 -30.770 27.093 1.00 20.16 ? 502 LEU C C 1 ATOM 6941 O O . LEU C 1 194 ? -0.968 -31.674 27.007 1.00 16.67 ? 502 LEU C O 1 ATOM 6942 C CB . LEU C 1 194 ? -0.670 -29.399 25.092 1.00 15.61 ? 502 LEU C CB 1 ATOM 6943 C CG . LEU C 1 194 ? -1.050 -28.083 24.399 1.00 18.28 ? 502 LEU C CG 1 ATOM 6944 C CD1 . LEU C 1 194 ? -1.093 -28.274 22.894 1.00 22.89 ? 502 LEU C CD1 1 ATOM 6945 C CD2 . LEU C 1 194 ? -2.374 -27.539 24.914 1.00 21.11 ? 502 LEU C CD2 1 ATOM 6946 N N . TYR C 1 195 ? 1.079 -30.948 27.582 1.00 21.58 ? 503 TYR C N 1 ATOM 6947 C CA . TYR C 1 195 ? 1.592 -32.273 27.924 1.00 20.66 ? 503 TYR C CA 1 ATOM 6948 C C . TYR C 1 195 ? 1.924 -32.313 29.405 1.00 21.75 ? 503 TYR C C 1 ATOM 6949 O O . TYR C 1 195 ? 2.247 -31.283 29.988 1.00 23.06 ? 503 TYR C O 1 ATOM 6950 C CB . TYR C 1 195 ? 2.852 -32.562 27.102 1.00 20.68 ? 503 TYR C CB 1 ATOM 6951 C CG . TYR C 1 195 ? 2.682 -32.339 25.609 1.00 22.80 ? 503 TYR C CG 1 ATOM 6952 C CD1 . TYR C 1 195 ? 1.525 -32.737 24.954 1.00 22.98 ? 503 TYR C CD1 1 ATOM 6953 C CD2 . TYR C 1 195 ? 3.676 -31.713 24.862 1.00 24.15 ? 503 TYR C CD2 1 ATOM 6954 C CE1 . TYR C 1 195 ? 1.364 -32.527 23.595 1.00 23.10 ? 503 TYR C CE1 1 ATOM 6955 C CE2 . TYR C 1 195 ? 3.524 -31.498 23.500 1.00 22.14 ? 503 TYR C CE2 1 ATOM 6956 C CZ . TYR C 1 195 ? 2.369 -31.913 22.873 1.00 22.76 ? 503 TYR C CZ 1 ATOM 6957 O OH . TYR C 1 195 ? 2.214 -31.713 21.520 1.00 21.98 ? 503 TYR C OH 1 ATOM 6958 N N . PRO C 1 196 ? 1.854 -33.506 30.027 1.00 23.20 ? 504 PRO C N 1 ATOM 6959 C CA . PRO C 1 196 ? 2.034 -33.596 31.481 1.00 23.52 ? 504 PRO C CA 1 ATOM 6960 C C . PRO C 1 196 ? 3.495 -33.490 31.922 1.00 26.23 ? 504 PRO C C 1 ATOM 6961 O O . PRO C 1 196 ? 3.969 -34.301 32.731 1.00 25.72 ? 504 PRO C O 1 ATOM 6962 C CB . PRO C 1 196 ? 1.466 -34.980 31.816 1.00 26.07 ? 504 PRO C CB 1 ATOM 6963 C CG . PRO C 1 196 ? 1.673 -35.772 30.578 1.00 22.14 ? 504 PRO C CG 1 ATOM 6964 C CD . PRO C 1 196 ? 1.468 -34.802 29.440 1.00 23.88 ? 504 PRO C CD 1 ATOM 6965 N N . LEU C 1 197 ? 4.188 -32.487 31.394 1.00 26.22 ? 505 LEU C N 1 ATOM 6966 C CA . LEU C 1 197 ? 5.558 -32.181 31.784 1.00 28.77 ? 505 LEU C CA 1 ATOM 6967 C C . LEU C 1 197 ? 5.579 -31.478 33.140 1.00 30.73 ? 505 LEU C C 1 ATOM 6968 O O . LEU C 1 197 ? 4.656 -30.737 33.483 1.00 34.74 ? 505 LEU C O 1 ATOM 6969 C CB . LEU C 1 197 ? 6.208 -31.275 30.733 1.00 26.17 ? 505 LEU C CB 1 ATOM 6970 C CG . LEU C 1 197 ? 6.304 -31.835 29.313 1.00 28.94 ? 505 LEU C CG 1 ATOM 6971 C CD1 . LEU C 1 197 ? 6.461 -30.716 28.300 1.00 29.44 ? 505 LEU C CD1 1 ATOM 6972 C CD2 . LEU C 1 197 ? 7.470 -32.813 29.211 1.00 30.54 ? 505 LEU C CD2 1 ATOM 6973 N N . SER C 1 198 ? 6.637 -31.698 33.907 1.00 30.82 ? 506 SER C N 1 ATOM 6974 C CA . SER C 1 198 ? 6.778 -31.025 35.190 1.00 30.50 ? 506 SER C CA 1 ATOM 6975 C C . SER C 1 198 ? 6.993 -29.536 34.953 1.00 29.11 ? 506 SER C C 1 ATOM 6976 O O . SER C 1 198 ? 7.439 -29.138 33.878 1.00 27.55 ? 506 SER C O 1 ATOM 6977 C CB . SER C 1 198 ? 7.958 -31.604 35.964 1.00 32.05 ? 506 SER C CB 1 ATOM 6978 O OG . SER C 1 198 ? 9.166 -31.428 35.243 1.00 30.40 ? 506 SER C OG 1 ATOM 6979 N N . HIS C 1 199 ? 6.667 -28.710 35.942 1.00 28.70 ? 507 HIS C N 1 ATOM 6980 C CA A HIS C 1 199 ? 6.889 -27.276 35.817 0.53 29.25 ? 507 HIS C CA 1 ATOM 6981 C CA B HIS C 1 199 ? 6.888 -27.273 35.827 0.47 29.22 ? 507 HIS C CA 1 ATOM 6982 C C . HIS C 1 199 ? 8.367 -26.981 35.588 1.00 28.29 ? 507 HIS C C 1 ATOM 6983 O O . HIS C 1 199 ? 8.719 -26.042 34.873 1.00 23.33 ? 507 HIS C O 1 ATOM 6984 C CB A HIS C 1 199 ? 6.371 -26.541 37.052 0.53 30.46 ? 507 HIS C CB 1 ATOM 6985 C CB B HIS C 1 199 ? 6.374 -26.534 37.070 0.47 30.50 ? 507 HIS C CB 1 ATOM 6986 C CG A HIS C 1 199 ? 4.904 -26.723 37.279 0.53 30.36 ? 507 HIS C CG 1 ATOM 6987 C CG B HIS C 1 199 ? 6.946 -27.035 38.360 0.47 32.99 ? 507 HIS C CG 1 ATOM 6988 N ND1 A HIS C 1 199 ? 3.957 -26.330 36.359 0.53 30.17 ? 507 HIS C ND1 1 ATOM 6989 N ND1 B HIS C 1 199 ? 8.087 -26.507 38.925 0.47 34.22 ? 507 HIS C ND1 1 ATOM 6990 C CD2 A HIS C 1 199 ? 4.222 -27.271 38.312 0.53 32.27 ? 507 HIS C CD2 1 ATOM 6991 C CD2 B HIS C 1 199 ? 6.527 -28.010 39.202 0.47 34.59 ? 507 HIS C CD2 1 ATOM 6992 C CE1 A HIS C 1 199 ? 2.754 -26.622 36.818 0.53 31.60 ? 507 HIS C CE1 1 ATOM 6993 C CE1 B HIS C 1 199 ? 8.349 -27.137 40.056 0.47 36.42 ? 507 HIS C CE1 1 ATOM 6994 N NE2 A HIS C 1 199 ? 2.886 -27.192 38.003 0.53 32.67 ? 507 HIS C NE2 1 ATOM 6995 N NE2 B HIS C 1 199 ? 7.418 -28.055 40.247 0.47 36.52 ? 507 HIS C NE2 1 ATOM 6996 N N . GLY C 1 200 ? 9.226 -27.801 36.185 1.00 29.01 ? 508 GLY C N 1 ATOM 6997 C CA . GLY C 1 200 ? 10.658 -27.673 35.998 1.00 30.21 ? 508 GLY C CA 1 ATOM 6998 C C . GLY C 1 200 ? 11.061 -27.928 34.558 1.00 26.99 ? 508 GLY C C 1 ATOM 6999 O O . GLY C 1 200 ? 11.905 -27.217 34.014 1.00 26.50 ? 508 GLY C O 1 ATOM 7000 N N . PHE C 1 201 ? 10.468 -28.948 33.942 1.00 25.48 ? 509 PHE C N 1 ATOM 7001 C CA . PHE C 1 201 ? 10.741 -29.251 32.537 1.00 26.68 ? 509 PHE C CA 1 ATOM 7002 C C . PHE C 1 201 ? 10.245 -28.142 31.622 1.00 25.34 ? 509 PHE C C 1 ATOM 7003 O O . PHE C 1 201 ? 10.904 -27.792 30.642 1.00 24.84 ? 509 PHE C O 1 ATOM 7004 C CB . PHE C 1 201 ? 10.080 -30.562 32.109 1.00 27.97 ? 509 PHE C CB 1 ATOM 7005 C CG . PHE C 1 201 ? 10.869 -31.788 32.453 1.00 29.98 ? 509 PHE C CG 1 ATOM 7006 C CD1 . PHE C 1 201 ? 11.952 -31.718 33.312 1.00 28.96 ? 509 PHE C CD1 1 ATOM 7007 C CD2 . PHE C 1 201 ? 10.533 -33.013 31.900 1.00 32.25 ? 509 PHE C CD2 1 ATOM 7008 C CE1 . PHE C 1 201 ? 12.677 -32.854 33.625 1.00 34.86 ? 509 PHE C CE1 1 ATOM 7009 C CE2 . PHE C 1 201 ? 11.255 -34.152 32.205 1.00 32.46 ? 509 PHE C CE2 1 ATOM 7010 C CZ . PHE C 1 201 ? 12.328 -34.072 33.071 1.00 34.89 ? 509 PHE C CZ 1 ATOM 7011 N N . ARG C 1 202 ? 9.075 -27.597 31.933 1.00 23.25 ? 510 ARG C N 1 ATOM 7012 C CA . ARG C 1 202 ? 8.504 -26.556 31.089 1.00 23.25 ? 510 ARG C CA 1 ATOM 7013 C C . ARG C 1 202 ? 9.366 -25.305 31.119 1.00 21.82 ? 510 ARG C C 1 ATOM 7014 O O . ARG C 1 202 ? 9.604 -24.684 30.083 1.00 21.61 ? 510 ARG C O 1 ATOM 7015 C CB . ARG C 1 202 ? 7.069 -26.231 31.496 1.00 26.87 ? 510 ARG C CB 1 ATOM 7016 C CG . ARG C 1 202 ? 6.091 -27.357 31.222 1.00 30.86 ? 510 ARG C CG 1 ATOM 7017 C CD . ARG C 1 202 ? 4.674 -26.823 31.105 1.00 33.60 ? 510 ARG C CD 1 ATOM 7018 N NE . ARG C 1 202 ? 3.677 -27.887 31.146 1.00 33.62 ? 510 ARG C NE 1 ATOM 7019 C CZ . ARG C 1 202 ? 3.127 -28.350 32.262 1.00 32.57 ? 510 ARG C CZ 1 ATOM 7020 N NH1 . ARG C 1 202 ? 3.486 -27.852 33.439 1.00 28.86 ? 510 ARG C NH1 1 ATOM 7021 N NH2 . ARG C 1 202 ? 2.220 -29.315 32.202 1.00 34.64 ? 510 ARG C NH2 1 ATOM 7022 N N . LYS C 1 203 ? 9.849 -24.948 32.303 1.00 24.55 ? 511 LYS C N 1 ATOM 7023 C CA . LYS C 1 203 ? 10.737 -23.800 32.428 1.00 27.06 ? 511 LYS C CA 1 ATOM 7024 C C . LYS C 1 203 ? 12.055 -24.056 31.696 1.00 25.58 ? 511 LYS C C 1 ATOM 7025 O O . LYS C 1 203 ? 12.579 -23.172 31.017 1.00 24.19 ? 511 LYS C O 1 ATOM 7026 C CB . LYS C 1 203 ? 10.986 -23.464 33.901 1.00 28.93 ? 511 LYS C CB 1 ATOM 7027 C CG . LYS C 1 203 ? 11.835 -22.219 34.109 1.00 31.55 ? 511 LYS C CG 1 ATOM 7028 C CD . LYS C 1 203 ? 11.698 -21.654 35.517 1.00 35.74 ? 511 LYS C CD 1 ATOM 7029 C CE . LYS C 1 203 ? 12.403 -22.501 36.548 1.00 37.48 ? 511 LYS C CE 1 ATOM 7030 N NZ . LYS C 1 203 ? 12.584 -21.749 37.829 1.00 40.02 ? 511 LYS C NZ 1 ATOM 7031 N N . ALA C 1 204 ? 12.580 -25.275 31.828 1.00 24.67 ? 512 ALA C N 1 ATOM 7032 C CA . ALA C 1 204 ? 13.848 -25.635 31.201 1.00 24.93 ? 512 ALA C CA 1 ATOM 7033 C C . ALA C 1 204 ? 13.765 -25.591 29.676 1.00 23.77 ? 512 ALA C C 1 ATOM 7034 O O . ALA C 1 204 ? 14.713 -25.172 29.008 1.00 24.03 ? 512 ALA C O 1 ATOM 7035 C CB . ALA C 1 204 ? 14.303 -27.017 31.670 1.00 23.45 ? 512 ALA C CB 1 ATOM 7036 N N . ILE C 1 205 ? 12.636 -26.035 29.130 1.00 22.07 ? 513 ILE C N 1 ATOM 7037 C CA . ILE C 1 205 ? 12.408 -25.965 27.690 1.00 21.45 ? 513 ILE C CA 1 ATOM 7038 C C . ILE C 1 205 ? 12.451 -24.512 27.235 1.00 24.26 ? 513 ILE C C 1 ATOM 7039 O O . ILE C 1 205 ? 13.091 -24.175 26.236 1.00 25.13 ? 513 ILE C O 1 ATOM 7040 C CB . ILE C 1 205 ? 11.045 -26.560 27.306 1.00 21.20 ? 513 ILE C CB 1 ATOM 7041 C CG1 . ILE C 1 205 ? 11.048 -28.075 27.497 1.00 22.30 ? 513 ILE C CG1 1 ATOM 7042 C CG2 . ILE C 1 205 ? 10.689 -26.212 25.857 1.00 20.51 ? 513 ILE C CG2 1 ATOM 7043 C CD1 . ILE C 1 205 ? 9.689 -28.707 27.302 1.00 22.98 ? 513 ILE C CD1 1 ATOM 7044 N N . ALA C 1 206 ? 11.772 -23.653 27.990 1.00 22.96 ? 514 ALA C N 1 ATOM 7045 C CA . ALA C 1 206 ? 11.723 -22.230 27.677 1.00 22.98 ? 514 ALA C CA 1 ATOM 7046 C C . ALA C 1 206 ? 13.097 -21.582 27.791 1.00 24.41 ? 514 ALA C C 1 ATOM 7047 O O . ALA C 1 206 ? 13.489 -20.793 26.933 1.00 28.44 ? 514 ALA C O 1 ATOM 7048 C CB . ALA C 1 206 ? 10.721 -21.524 28.575 1.00 25.27 ? 514 ALA C CB 1 ATOM 7049 N N . GLU C 1 207 ? 13.820 -21.921 28.853 1.00 25.67 ? 515 GLU C N 1 ATOM 7050 C CA . GLU C 1 207 ? 15.169 -21.405 29.076 1.00 29.77 ? 515 GLU C CA 1 ATOM 7051 C C . GLU C 1 207 ? 16.100 -21.698 27.899 1.00 28.15 ? 515 GLU C C 1 ATOM 7052 O O . GLU C 1 207 ? 16.966 -20.887 27.565 1.00 29.30 ? 515 GLU C O 1 ATOM 7053 C CB . GLU C 1 207 ? 15.751 -21.994 30.367 1.00 34.38 ? 515 GLU C CB 1 ATOM 7054 C CG . GLU C 1 207 ? 17.056 -21.353 30.828 1.00 42.93 ? 515 GLU C CG 1 ATOM 7055 C CD . GLU C 1 207 ? 18.294 -22.005 30.226 1.00 50.57 ? 515 GLU C CD 1 ATOM 7056 O OE1 . GLU C 1 207 ? 18.159 -23.051 29.552 1.00 51.51 ? 515 GLU C OE1 1 ATOM 7057 O OE2 . GLU C 1 207 ? 19.406 -21.472 30.436 1.00 53.79 ? 515 GLU C OE2 1 ATOM 7058 N N . ARG C 1 208 ? 15.925 -22.864 27.284 1.00 25.88 ? 516 ARG C N 1 ATOM 7059 C CA . ARG C 1 208 ? 16.760 -23.272 26.156 1.00 30.49 ? 516 ARG C CA 1 ATOM 7060 C C . ARG C 1 208 ? 16.505 -22.369 24.961 1.00 30.62 ? 516 ARG C C 1 ATOM 7061 O O . ARG C 1 208 ? 17.429 -22.012 24.233 1.00 30.60 ? 516 ARG C O 1 ATOM 7062 C CB . ARG C 1 208 ? 16.479 -24.721 25.771 1.00 32.06 ? 516 ARG C CB 1 ATOM 7063 C CG . ARG C 1 208 ? 16.901 -25.740 26.809 1.00 39.03 ? 516 ARG C CG 1 ATOM 7064 C CD . ARG C 1 208 ? 18.399 -25.952 26.808 1.00 47.47 ? 516 ARG C CD 1 ATOM 7065 N NE . ARG C 1 208 ? 18.773 -27.102 27.625 1.00 53.02 ? 516 ARG C NE 1 ATOM 7066 C CZ . ARG C 1 208 ? 19.983 -27.652 27.636 1.00 59.41 ? 516 ARG C CZ 1 ATOM 7067 N NH1 . ARG C 1 208 ? 20.944 -27.157 26.867 1.00 61.91 ? 516 ARG C NH1 1 ATOM 7068 N NH2 . ARG C 1 208 ? 20.231 -28.698 28.414 1.00 60.18 ? 516 ARG C NH2 1 ATOM 7069 N N . HIS C 1 209 ? 15.242 -22.007 24.761 1.00 29.50 ? 517 HIS C N 1 ATOM 7070 C CA . HIS C 1 209 ? 14.884 -21.072 23.703 1.00 32.01 ? 517 HIS C CA 1 ATOM 7071 C C . HIS C 1 209 ? 15.384 -19.667 24.005 1.00 33.19 ? 517 HIS C C 1 ATOM 7072 O O . HIS C 1 209 ? 15.766 -18.934 23.098 1.00 36.77 ? 517 HIS C O 1 ATOM 7073 C CB . HIS C 1 209 ? 13.374 -21.076 23.463 1.00 29.83 ? 517 HIS C CB 1 ATOM 7074 C CG . HIS C 1 209 ? 12.898 -22.291 22.736 1.00 30.86 ? 517 HIS C CG 1 ATOM 7075 N ND1 . HIS C 1 209 ? 12.403 -22.241 21.451 1.00 35.63 ? 517 HIS C ND1 1 ATOM 7076 C CD2 . HIS C 1 209 ? 12.869 -23.593 23.101 1.00 30.88 ? 517 HIS C CD2 1 ATOM 7077 C CE1 . HIS C 1 209 ? 12.077 -23.459 21.061 1.00 34.81 ? 517 HIS C CE1 1 ATOM 7078 N NE2 . HIS C 1 209 ? 12.356 -24.299 22.041 1.00 34.00 ? 517 HIS C NE2 1 ATOM 7079 N N . GLY C 1 210 ? 15.387 -19.299 25.282 1.00 31.73 ? 518 GLY C N 1 ATOM 7080 C CA . GLY C 1 210 ? 15.962 -18.033 25.695 1.00 32.53 ? 518 GLY C CA 1 ATOM 7081 C C . GLY C 1 210 ? 17.448 -18.001 25.383 1.00 36.65 ? 518 GLY C C 1 ATOM 7082 O O . GLY C 1 210 ? 17.967 -17.004 24.886 1.00 38.83 ? 518 GLY C O 1 ATOM 7083 N N . ASN C 1 211 ? 18.135 -19.103 25.667 1.00 38.47 ? 519 ASN C N 1 ATOM 7084 C CA . ASN C 1 211 ? 19.566 -19.196 25.395 1.00 40.20 ? 519 ASN C CA 1 ATOM 7085 C C . ASN C 1 211 ? 19.894 -19.183 23.904 1.00 38.03 ? 519 ASN C C 1 ATOM 7086 O O . ASN C 1 211 ? 20.960 -18.716 23.503 1.00 38.35 ? 519 ASN C O 1 ATOM 7087 C CB . ASN C 1 211 ? 20.168 -20.426 26.076 1.00 46.78 ? 519 ASN C CB 1 ATOM 7088 C CG . ASN C 1 211 ? 20.742 -20.106 27.442 1.00 52.38 ? 519 ASN C CG 1 ATOM 7089 O OD1 . ASN C 1 211 ? 20.008 -19.784 28.378 1.00 52.40 ? 519 ASN C OD1 1 ATOM 7090 N ND2 . ASN C 1 211 ? 22.064 -20.186 27.561 1.00 54.35 ? 519 ASN C ND2 1 ATOM 7091 N N . LEU C 1 212 ? 18.973 -19.692 23.092 1.00 37.43 ? 520 LEU C N 1 ATOM 7092 C CA . LEU C 1 212 ? 19.094 -19.612 21.641 1.00 40.32 ? 520 LEU C CA 1 ATOM 7093 C C . LEU C 1 212 ? 19.193 -18.161 21.178 1.00 39.20 ? 520 LEU C C 1 ATOM 7094 O O . LEU C 1 212 ? 20.035 -17.828 20.345 1.00 40.20 ? 520 LEU C O 1 ATOM 7095 C CB . LEU C 1 212 ? 17.897 -20.277 20.963 1.00 43.04 ? 520 LEU C CB 1 ATOM 7096 C CG . LEU C 1 212 ? 18.145 -21.586 20.218 1.00 48.76 ? 520 LEU C CG 1 ATOM 7097 C CD1 . LEU C 1 212 ? 16.906 -21.988 19.434 1.00 48.13 ? 520 LEU C CD1 1 ATOM 7098 C CD2 . LEU C 1 212 ? 19.351 -21.466 19.303 1.00 53.01 ? 520 LEU C CD2 1 ATOM 7099 N N . CYS C 1 213 ? 18.328 -17.303 21.717 1.00 34.48 ? 521 CYS C N 1 ATOM 7100 C CA . CYS C 1 213 ? 18.362 -15.881 21.387 1.00 32.01 ? 521 CYS C CA 1 ATOM 7101 C C . CYS C 1 213 ? 19.689 -15.247 21.795 1.00 33.89 ? 521 CYS C C 1 ATOM 7102 O O . CYS C 1 213 ? 20.263 -14.463 21.039 1.00 35.27 ? 521 CYS C O 1 ATOM 7103 C CB . CYS C 1 213 ? 17.202 -15.134 22.052 1.00 27.48 ? 521 CYS C CB 1 ATOM 7104 S SG . CYS C 1 213 ? 15.572 -15.780 21.618 1.00 37.48 ? 521 CYS C SG 1 ATOM 7105 N N . LEU C 1 214 ? 20.166 -15.585 22.991 1.00 33.79 ? 522 LEU C N 1 ATOM 7106 C CA . LEU C 1 214 ? 21.436 -15.061 23.490 1.00 38.88 ? 522 LEU C CA 1 ATOM 7107 C C . LEU C 1 214 ? 22.609 -15.457 22.595 1.00 41.42 ? 522 LEU C C 1 ATOM 7108 O O . LEU C 1 214 ? 23.486 -14.640 22.319 1.00 41.97 ? 522 LEU C O 1 ATOM 7109 C CB . LEU C 1 214 ? 21.692 -15.522 24.929 1.00 42.29 ? 522 LEU C CB 1 ATOM 7110 C CG . LEU C 1 214 ? 20.904 -14.826 26.041 1.00 42.78 ? 522 LEU C CG 1 ATOM 7111 C CD1 . LEU C 1 214 ? 21.000 -15.614 27.339 1.00 44.53 ? 522 LEU C CD1 1 ATOM 7112 C CD2 . LEU C 1 214 ? 21.398 -13.402 26.249 1.00 43.32 ? 522 LEU C CD2 1 ATOM 7113 N N . ASP C 1 215 ? 22.620 -16.708 22.141 1.00 41.47 ? 523 ASP C N 1 ATOM 7114 C CA . ASP C 1 215 ? 23.669 -17.183 21.241 1.00 44.98 ? 523 ASP C CA 1 ATOM 7115 C C . ASP C 1 215 ? 23.679 -16.394 19.937 1.00 44.31 ? 523 ASP C C 1 ATOM 7116 O O . ASP C 1 215 ? 24.735 -16.144 19.362 1.00 45.23 ? 523 ASP C O 1 ATOM 7117 C CB . ASP C 1 215 ? 23.498 -18.672 20.927 1.00 47.70 ? 523 ASP C CB 1 ATOM 7118 C CG . ASP C 1 215 ? 23.778 -19.562 22.122 1.00 51.49 ? 523 ASP C CG 1 ATOM 7119 O OD1 . ASP C 1 215 ? 23.333 -20.728 22.101 1.00 52.57 ? 523 ASP C OD1 1 ATOM 7120 O OD2 . ASP C 1 215 ? 24.438 -19.101 23.078 1.00 52.42 ? 523 ASP C OD2 1 ATOM 7121 N N . LYS C 1 216 ? 22.498 -16.007 19.471 1.00 41.87 ? 524 LYS C N 1 ATOM 7122 C CA . LYS C 1 216 ? 22.383 -15.312 18.194 1.00 44.96 ? 524 LYS C CA 1 ATOM 7123 C C . LYS C 1 216 ? 22.835 -13.857 18.266 1.00 44.58 ? 524 LYS C C 1 ATOM 7124 O O . LYS C 1 216 ? 23.324 -13.310 17.278 1.00 47.68 ? 524 LYS C O 1 ATOM 7125 C CB . LYS C 1 216 ? 20.956 -15.410 17.646 1.00 46.49 ? 524 LYS C CB 1 ATOM 7126 C CG . LYS C 1 216 ? 20.554 -16.824 17.257 1.00 49.52 ? 524 LYS C CG 1 ATOM 7127 C CD . LYS C 1 216 ? 19.116 -16.897 16.774 1.00 50.31 ? 524 LYS C CD 1 ATOM 7128 C CE . LYS C 1 216 ? 18.740 -18.330 16.424 1.00 52.88 ? 524 LYS C CE 1 ATOM 7129 N NZ . LYS C 1 216 ? 17.313 -18.458 16.016 1.00 53.16 ? 524 LYS C NZ 1 ATOM 7130 N N . ILE C 1 217 ? 22.679 -13.228 19.427 1.00 40.06 ? 525 ILE C N 1 ATOM 7131 C CA . ILE C 1 217 ? 23.112 -11.841 19.576 1.00 40.51 ? 525 ILE C CA 1 ATOM 7132 C C . ILE C 1 217 ? 24.550 -11.711 20.084 1.00 43.75 ? 525 ILE C C 1 ATOM 7133 O O . ILE C 1 217 ? 25.191 -10.677 19.887 1.00 43.29 ? 525 ILE C O 1 ATOM 7134 C CB . ILE C 1 217 ? 22.146 -11.013 20.450 1.00 38.60 ? 525 ILE C CB 1 ATOM 7135 C CG1 . ILE C 1 217 ? 22.033 -11.602 21.858 1.00 38.64 ? 525 ILE C CG1 1 ATOM 7136 C CG2 . ILE C 1 217 ? 20.781 -10.930 19.786 1.00 38.17 ? 525 ILE C CG2 1 ATOM 7137 C CD1 . ILE C 1 217 ? 22.803 -10.836 22.913 1.00 39.35 ? 525 ILE C CD1 1 ATOM 7138 N N . ASN C 1 218 ? 25.058 -12.760 20.727 1.00 46.16 ? 526 ASN C N 1 ATOM 7139 C CA . ASN C 1 218 ? 26.437 -12.749 21.211 1.00 51.50 ? 526 ASN C CA 1 ATOM 7140 C C . ASN C 1 218 ? 27.445 -12.603 20.073 1.00 53.54 ? 526 ASN C C 1 ATOM 7141 O O . ASN C 1 218 ? 28.533 -12.055 20.263 1.00 55.90 ? 526 ASN C O 1 ATOM 7142 C CB . ASN C 1 218 ? 26.743 -14.004 22.036 1.00 55.37 ? 526 ASN C CB 1 ATOM 7143 C CG . ASN C 1 218 ? 26.105 -13.967 23.414 1.00 56.99 ? 526 ASN C CG 1 ATOM 7144 O OD1 . ASN C 1 218 ? 25.951 -12.903 24.014 1.00 56.77 ? 526 ASN C OD1 1 ATOM 7145 N ND2 . ASN C 1 218 ? 25.722 -15.135 23.918 1.00 57.50 ? 526 ASN C ND2 1 ATOM 7146 N N . VAL C 1 219 ? 27.073 -13.083 18.890 1.00 52.25 ? 527 VAL C N 1 ATOM 7147 C CA . VAL C 1 219 ? 27.945 -13.012 17.721 1.00 54.34 ? 527 VAL C CA 1 ATOM 7148 C C . VAL C 1 219 ? 28.058 -11.589 17.178 1.00 54.34 ? 527 VAL C C 1 ATOM 7149 O O . VAL C 1 219 ? 28.941 -11.293 16.372 1.00 57.90 ? 527 VAL C O 1 ATOM 7150 C CB . VAL C 1 219 ? 27.465 -13.949 16.596 1.00 55.69 ? 527 VAL C CB 1 ATOM 7151 C CG1 . VAL C 1 219 ? 27.112 -15.317 17.165 1.00 57.27 ? 527 VAL C CG1 1 ATOM 7152 C CG2 . VAL C 1 219 ? 26.273 -13.349 15.870 1.00 51.45 ? 527 VAL C CG2 1 ATOM 7153 N N . LEU C 1 220 ? 27.161 -10.712 17.620 1.00 50.62 ? 528 LEU C N 1 ATOM 7154 C CA . LEU C 1 220 ? 27.209 -9.307 17.235 1.00 49.82 ? 528 LEU C CA 1 ATOM 7155 C C . LEU C 1 220 ? 28.262 -8.580 18.059 1.00 49.94 ? 528 LEU C C 1 ATOM 7156 O O . LEU C 1 220 ? 28.681 -7.477 17.710 1.00 50.03 ? 528 LEU C O 1 ATOM 7157 C CB . LEU C 1 220 ? 25.842 -8.646 17.441 1.00 48.61 ? 528 LEU C CB 1 ATOM 7158 C CG . LEU C 1 220 ? 24.680 -9.157 16.587 1.00 49.15 ? 528 LEU C CG 1 ATOM 7159 C CD1 . LEU C 1 220 ? 23.356 -8.621 17.108 1.00 47.42 ? 528 LEU C CD1 1 ATOM 7160 C CD2 . LEU C 1 220 ? 24.878 -8.766 15.130 1.00 51.58 ? 528 LEU C CD2 1 ATOM 7161 N N . HIS C 1 221 ? 28.671 -9.210 19.159 1.00 51.78 ? 529 HIS C N 1 ATOM 7162 C CA . HIS C 1 221 ? 29.673 -8.668 20.077 1.00 54.85 ? 529 HIS C CA 1 ATOM 7163 C C . HIS C 1 221 ? 29.379 -7.233 20.506 1.00 52.72 ? 529 HIS C C 1 ATOM 7164 O O . HIS C 1 221 ? 30.291 -6.421 20.671 1.00 54.74 ? 529 HIS C O 1 ATOM 7165 C CB . HIS C 1 221 ? 31.079 -8.779 19.480 1.00 60.29 ? 529 HIS C CB 1 ATOM 7166 C CG . HIS C 1 221 ? 31.503 -10.187 19.204 1.00 64.67 ? 529 HIS C CG 1 ATOM 7167 N ND1 . HIS C 1 221 ? 31.387 -10.770 17.960 1.00 66.67 ? 529 HIS C ND1 1 ATOM 7168 C CD2 . HIS C 1 221 ? 32.029 -11.135 20.016 1.00 66.84 ? 529 HIS C CD2 1 ATOM 7169 C CE1 . HIS C 1 221 ? 31.831 -12.013 18.015 1.00 68.68 ? 529 HIS C CE1 1 ATOM 7170 N NE2 . HIS C 1 221 ? 32.226 -12.260 19.252 1.00 69.08 ? 529 HIS C NE2 1 ATOM 7171 N N . LYS C 1 222 ? 28.099 -6.931 20.682 1.00 48.38 ? 530 LYS C N 1 ATOM 7172 C CA . LYS C 1 222 ? 27.682 -5.608 21.117 1.00 47.58 ? 530 LYS C CA 1 ATOM 7173 C C . LYS C 1 222 ? 27.870 -5.475 22.619 1.00 48.75 ? 530 LYS C C 1 ATOM 7174 O O . LYS C 1 222 ? 27.591 -6.411 23.370 1.00 49.83 ? 530 LYS C O 1 ATOM 7175 C CB . LYS C 1 222 ? 26.220 -5.357 20.742 1.00 46.13 ? 530 LYS C CB 1 ATOM 7176 C CG . LYS C 1 222 ? 25.960 -5.393 19.247 1.00 46.41 ? 530 LYS C CG 1 ATOM 7177 C CD . LYS C 1 222 ? 24.493 -5.177 18.935 1.00 42.03 ? 530 LYS C CD 1 ATOM 7178 C CE . LYS C 1 222 ? 24.049 -3.772 19.304 1.00 42.04 ? 530 LYS C CE 1 ATOM 7179 N NZ . LYS C 1 222 ? 24.614 -2.748 18.379 1.00 42.74 ? 530 LYS C NZ 1 ATOM 7180 N N . PRO C 1 223 ? 28.353 -4.309 23.065 1.00 50.07 ? 531 PRO C N 1 ATOM 7181 C CA . PRO C 1 223 ? 28.531 -4.061 24.497 1.00 49.12 ? 531 PRO C CA 1 ATOM 7182 C C . PRO C 1 223 ? 27.176 -3.882 25.164 1.00 45.03 ? 531 PRO C C 1 ATOM 7183 O O . PRO C 1 223 ? 26.187 -3.648 24.466 1.00 41.30 ? 531 PRO C O 1 ATOM 7184 C CB . PRO C 1 223 ? 29.307 -2.742 24.521 1.00 51.78 ? 531 PRO C CB 1 ATOM 7185 C CG . PRO C 1 223 ? 28.880 -2.045 23.277 1.00 51.95 ? 531 PRO C CG 1 ATOM 7186 C CD . PRO C 1 223 ? 28.694 -3.129 22.250 1.00 50.86 ? 531 PRO C CD 1 ATOM 7187 N N . PRO C 1 224 ? 27.120 -4.008 26.497 1.00 45.22 ? 532 PRO C N 1 ATOM 7188 C CA . PRO C 1 224 ? 25.861 -3.712 27.185 1.00 43.75 ? 532 PRO C CA 1 ATOM 7189 C C . PRO C 1 224 ? 25.507 -2.242 27.010 1.00 40.69 ? 532 PRO C C 1 ATOM 7190 O O . PRO C 1 224 ? 26.401 -1.399 26.950 1.00 41.82 ? 532 PRO C O 1 ATOM 7191 C CB . PRO C 1 224 ? 26.178 -4.021 28.653 1.00 45.61 ? 532 PRO C CB 1 ATOM 7192 C CG . PRO C 1 224 ? 27.666 -3.971 28.749 1.00 49.20 ? 532 PRO C CG 1 ATOM 7193 C CD . PRO C 1 224 ? 28.170 -4.454 27.427 1.00 49.04 ? 532 PRO C CD 1 ATOM 7194 N N . TYR C 1 225 ? 24.218 -1.944 26.911 1.00 36.47 ? 533 TYR C N 1 ATOM 7195 C CA . TYR C 1 225 ? 23.767 -0.573 26.714 1.00 37.42 ? 533 TYR C CA 1 ATOM 7196 C C . TYR C 1 225 ? 23.822 0.230 28.007 1.00 39.11 ? 533 TYR C C 1 ATOM 7197 O O . TYR C 1 225 ? 23.615 -0.309 29.096 1.00 39.32 ? 533 TYR C O 1 ATOM 7198 C CB . TYR C 1 225 ? 22.331 -0.555 26.193 1.00 35.05 ? 533 TYR C CB 1 ATOM 7199 C CG . TYR C 1 225 ? 22.160 -0.986 24.756 1.00 35.78 ? 533 TYR C CG 1 ATOM 7200 C CD1 . TYR C 1 225 ? 22.451 -0.117 23.709 1.00 36.34 ? 533 TYR C CD1 1 ATOM 7201 C CD2 . TYR C 1 225 ? 21.677 -2.251 24.444 1.00 34.42 ? 533 TYR C CD2 1 ATOM 7202 C CE1 . TYR C 1 225 ? 22.278 -0.503 22.393 1.00 36.29 ? 533 TYR C CE1 1 ATOM 7203 C CE2 . TYR C 1 225 ? 21.497 -2.644 23.133 1.00 34.11 ? 533 TYR C CE2 1 ATOM 7204 C CZ . TYR C 1 225 ? 21.798 -1.768 22.112 1.00 36.42 ? 533 TYR C CZ 1 ATOM 7205 O OH . TYR C 1 225 ? 21.620 -2.162 20.805 1.00 37.54 ? 533 TYR C OH 1 ATOM 7206 N N . GLU C 1 226 ? 24.103 1.523 27.881 1.00 38.53 ? 534 GLU C N 1 ATOM 7207 C CA . GLU C 1 226 ? 23.957 2.436 29.002 1.00 40.90 ? 534 GLU C CA 1 ATOM 7208 C C . GLU C 1 226 ? 22.489 2.823 29.099 1.00 39.02 ? 534 GLU C C 1 ATOM 7209 O O . GLU C 1 226 ? 21.909 3.326 28.137 1.00 38.94 ? 534 GLU C O 1 ATOM 7210 C CB . GLU C 1 226 ? 24.824 3.680 28.814 1.00 44.80 ? 534 GLU C CB 1 ATOM 7211 C CG . GLU C 1 226 ? 26.318 3.420 28.936 1.00 51.28 ? 534 GLU C CG 1 ATOM 7212 C CD . GLU C 1 226 ? 27.140 4.682 28.761 1.00 57.82 ? 534 GLU C CD 1 ATOM 7213 O OE1 . GLU C 1 226 ? 26.556 5.726 28.398 1.00 58.72 ? 534 GLU C OE1 1 ATOM 7214 O OE2 . GLU C 1 226 ? 28.369 4.631 28.986 1.00 61.97 ? 534 GLU C OE2 1 ATOM 7215 N N . HIS C 1 227 ? 21.887 2.566 30.253 1.00 38.02 ? 535 HIS C N 1 ATOM 7216 C CA . HIS C 1 227 ? 20.456 2.794 30.436 1.00 33.69 ? 535 HIS C CA 1 ATOM 7217 C C . HIS C 1 227 ? 20.210 4.110 31.171 1.00 34.87 ? 535 HIS C C 1 ATOM 7218 O O . HIS C 1 227 ? 21.073 4.572 31.917 1.00 36.58 ? 535 HIS C O 1 ATOM 7219 C CB . HIS C 1 227 ? 19.837 1.628 31.218 1.00 32.64 ? 535 HIS C CB 1 ATOM 7220 C CG . HIS C 1 227 ? 19.886 0.317 30.496 1.00 31.06 ? 535 HIS C CG 1 ATOM 7221 N ND1 . HIS C 1 227 ? 20.223 -0.865 31.119 1.00 34.80 ? 535 HIS C ND1 1 ATOM 7222 C CD2 . HIS C 1 227 ? 19.620 -0.002 29.207 1.00 30.84 ? 535 HIS C CD2 1 ATOM 7223 C CE1 . HIS C 1 227 ? 20.171 -1.854 30.245 1.00 32.91 ? 535 HIS C CE1 1 ATOM 7224 N NE2 . HIS C 1 227 ? 19.804 -1.358 29.077 1.00 30.46 ? 535 HIS C NE2 1 ATOM 7225 N N . PRO C 1 228 ? 19.031 4.723 30.960 1.00 33.50 ? 536 PRO C N 1 ATOM 7226 C CA . PRO C 1 228 ? 18.674 5.934 31.708 1.00 35.70 ? 536 PRO C CA 1 ATOM 7227 C C . PRO C 1 228 ? 18.578 5.644 33.206 1.00 37.72 ? 536 PRO C C 1 ATOM 7228 O O . PRO C 1 228 ? 18.136 4.561 33.586 1.00 37.40 ? 536 PRO C O 1 ATOM 7229 C CB . PRO C 1 228 ? 17.295 6.302 31.142 1.00 33.80 ? 536 PRO C CB 1 ATOM 7230 C CG . PRO C 1 228 ? 16.775 5.037 30.531 1.00 33.25 ? 536 PRO C CG 1 ATOM 7231 C CD . PRO C 1 228 ? 17.983 4.337 30.001 1.00 33.13 ? 536 PRO C CD 1 ATOM 7232 N N . LYS C 1 229 ? 18.998 6.589 34.042 1.00 39.00 ? 537 LYS C N 1 ATOM 7233 C CA . LYS C 1 229 ? 18.947 6.400 35.491 1.00 42.24 ? 537 LYS C CA 1 ATOM 7234 C C . LYS C 1 229 ? 17.844 7.226 36.139 1.00 39.89 ? 537 LYS C C 1 ATOM 7235 O O . LYS C 1 229 ? 17.599 7.120 37.341 1.00 39.16 ? 537 LYS C O 1 ATOM 7236 C CB . LYS C 1 229 ? 20.292 6.748 36.133 1.00 50.09 ? 537 LYS C CB 1 ATOM 7237 C CG . LYS C 1 229 ? 21.299 5.612 36.139 1.00 55.56 ? 537 LYS C CG 1 ATOM 7238 C CD . LYS C 1 229 ? 22.494 5.959 37.017 1.00 60.69 ? 537 LYS C CD 1 ATOM 7239 C CE . LYS C 1 229 ? 23.415 4.764 37.207 1.00 63.49 ? 537 LYS C CE 1 ATOM 7240 N NZ . LYS C 1 229 ? 24.567 5.095 38.092 1.00 66.38 ? 537 LYS C NZ 1 ATOM 7241 N N . ASP C 1 230 ? 17.184 8.052 35.336 1.00 39.31 ? 538 ASP C N 1 ATOM 7242 C CA . ASP C 1 230 ? 16.117 8.913 35.824 1.00 37.96 ? 538 ASP C CA 1 ATOM 7243 C C . ASP C 1 230 ? 15.181 9.286 34.682 1.00 35.40 ? 538 ASP C C 1 ATOM 7244 O O . ASP C 1 230 ? 15.325 8.794 33.564 1.00 34.35 ? 538 ASP C O 1 ATOM 7245 C CB . ASP C 1 230 ? 16.694 10.176 36.475 1.00 39.60 ? 538 ASP C CB 1 ATOM 7246 C CG . ASP C 1 230 ? 17.670 10.907 35.572 1.00 44.06 ? 538 ASP C CG 1 ATOM 7247 O OD1 . ASP C 1 230 ? 18.879 10.940 35.898 1.00 48.87 ? 538 ASP C OD1 1 ATOM 7248 O OD2 . ASP C 1 230 ? 17.235 11.451 34.535 1.00 43.44 ? 538 ASP C OD2 1 ATOM 7249 N N . LEU C 1 231 ? 14.231 10.168 34.966 1.00 36.03 ? 539 LEU C N 1 ATOM 7250 C CA . LEU C 1 231 ? 13.241 10.569 33.973 1.00 36.85 ? 539 LEU C CA 1 ATOM 7251 C C . LEU C 1 231 ? 13.453 12.010 33.501 1.00 39.04 ? 539 LEU C C 1 ATOM 7252 O O . LEU C 1 231 ? 12.582 12.590 32.851 1.00 38.49 ? 539 LEU C O 1 ATOM 7253 C CB . LEU C 1 231 ? 11.830 10.414 34.545 1.00 33.54 ? 539 LEU C CB 1 ATOM 7254 C CG . LEU C 1 231 ? 11.481 9.064 35.172 1.00 34.36 ? 539 LEU C CG 1 ATOM 7255 C CD1 . LEU C 1 231 ? 10.038 9.061 35.671 1.00 33.48 ? 539 LEU C CD1 1 ATOM 7256 C CD2 . LEU C 1 231 ? 11.716 7.926 34.190 1.00 32.68 ? 539 LEU C CD2 1 ATOM 7257 N N . LYS C 1 232 ? 14.614 12.578 33.819 1.00 41.05 ? 540 LYS C N 1 ATOM 7258 C CA . LYS C 1 232 ? 14.890 13.981 33.512 1.00 43.24 ? 540 LYS C CA 1 ATOM 7259 C C . LYS C 1 232 ? 14.903 14.298 32.016 1.00 43.75 ? 540 LYS C C 1 ATOM 7260 O O . LYS C 1 232 ? 14.360 15.320 31.590 1.00 44.51 ? 540 LYS C O 1 ATOM 7261 C CB . LYS C 1 232 ? 16.206 14.434 34.153 1.00 47.50 ? 540 LYS C CB 1 ATOM 7262 C CG . LYS C 1 232 ? 16.221 14.376 35.673 1.00 51.42 ? 540 LYS C CG 1 ATOM 7263 C CD . LYS C 1 232 ? 17.500 14.991 36.229 1.00 57.41 ? 540 LYS C CD 1 ATOM 7264 C CE . LYS C 1 232 ? 17.525 14.967 37.752 1.00 62.12 ? 540 LYS C CE 1 ATOM 7265 N NZ . LYS C 1 232 ? 17.548 13.578 38.297 1.00 63.82 ? 540 LYS C NZ 1 ATOM 7266 N N . LEU C 1 233 ? 15.523 13.433 31.220 1.00 43.20 ? 541 LEU C N 1 ATOM 7267 C CA . LEU C 1 233 ? 15.601 13.663 29.780 1.00 44.23 ? 541 LEU C CA 1 ATOM 7268 C C . LEU C 1 233 ? 14.243 13.503 29.105 1.00 40.85 ? 541 LEU C C 1 ATOM 7269 O O . LEU C 1 233 ? 14.019 14.014 28.008 1.00 42.17 ? 541 LEU C O 1 ATOM 7270 C CB . LEU C 1 233 ? 16.628 12.730 29.132 1.00 47.03 ? 541 LEU C CB 1 ATOM 7271 C CG . LEU C 1 233 ? 18.091 12.987 29.497 1.00 52.02 ? 541 LEU C CG 1 ATOM 7272 C CD1 . LEU C 1 233 ? 19.017 12.133 28.643 1.00 53.52 ? 541 LEU C CD1 1 ATOM 7273 C CD2 . LEU C 1 233 ? 18.431 14.460 29.353 1.00 53.94 ? 541 LEU C CD2 1 ATOM 7274 N N . SER C 1 234 ? 13.336 12.795 29.766 1.00 36.41 ? 542 SER C N 1 ATOM 7275 C CA . SER C 1 234 ? 12.015 12.555 29.207 1.00 35.54 ? 542 SER C CA 1 ATOM 7276 C C . SER C 1 234 ? 10.970 13.445 29.863 1.00 36.45 ? 542 SER C C 1 ATOM 7277 O O . SER C 1 234 ? 9.777 13.145 29.819 1.00 35.48 ? 542 SER C O 1 ATOM 7278 C CB . SER C 1 234 ? 11.629 11.081 29.356 1.00 35.69 ? 542 SER C CB 1 ATOM 7279 O OG . SER C 1 234 ? 11.790 10.648 30.695 1.00 35.01 ? 542 SER C OG 1 ATOM 7280 N N . ASP C 1 235 ? 11.432 14.540 30.464 1.00 39.54 ? 543 ASP C N 1 ATOM 7281 C CA . ASP C 1 235 ? 10.560 15.513 31.124 1.00 43.12 ? 543 ASP C CA 1 ATOM 7282 C C . ASP C 1 235 ? 9.619 14.880 32.150 1.00 39.05 ? 543 ASP C C 1 ATOM 7283 O O . ASP C 1 235 ? 8.447 15.245 32.237 1.00 38.26 ? 543 ASP C O 1 ATOM 7284 C CB . ASP C 1 235 ? 9.763 16.323 30.093 1.00 49.41 ? 543 ASP C CB 1 ATOM 7285 C CG . ASP C 1 235 ? 10.648 17.226 29.244 1.00 56.95 ? 543 ASP C CG 1 ATOM 7286 O OD1 . ASP C 1 235 ? 11.760 17.578 29.694 1.00 57.44 ? 543 ASP C OD1 1 ATOM 7287 O OD2 . ASP C 1 235 ? 10.227 17.589 28.123 1.00 60.38 ? 543 ASP C OD2 1 ATOM 7288 N N . GLY C 1 236 ? 10.139 13.925 32.917 1.00 35.15 ? 544 GLY C N 1 ATOM 7289 C CA . GLY C 1 236 ? 9.387 13.310 33.997 1.00 33.18 ? 544 GLY C CA 1 ATOM 7290 C C . GLY C 1 236 ? 8.501 12.157 33.560 1.00 30.03 ? 544 GLY C C 1 ATOM 7291 O O . GLY C 1 236 ? 7.815 11.549 34.381 1.00 30.62 ? 544 GLY C O 1 ATOM 7292 N N . ARG C 1 237 ? 8.518 11.852 32.267 1.00 27.77 ? 545 ARG C N 1 ATOM 7293 C CA . ARG C 1 237 ? 7.658 10.812 31.718 1.00 26.86 ? 545 ARG C CA 1 ATOM 7294 C C . ARG C 1 237 ? 8.394 9.477 31.637 1.00 27.66 ? 545 ARG C C 1 ATOM 7295 O O . ARG C 1 237 ? 9.575 9.434 31.302 1.00 28.65 ? 545 ARG C O 1 ATOM 7296 C CB . ARG C 1 237 ? 7.173 11.216 30.326 1.00 28.65 ? 545 ARG C CB 1 ATOM 7297 C CG . ARG C 1 237 ? 6.501 12.582 30.281 1.00 29.56 ? 545 ARG C CG 1 ATOM 7298 C CD . ARG C 1 237 ? 6.310 13.055 28.849 1.00 31.98 ? 545 ARG C CD 1 ATOM 7299 N NE . ARG C 1 237 ? 5.264 12.306 28.163 1.00 32.10 ? 545 ARG C NE 1 ATOM 7300 C CZ . ARG C 1 237 ? 5.018 12.394 26.859 1.00 31.51 ? 545 ARG C CZ 1 ATOM 7301 N NH1 . ARG C 1 237 ? 5.755 13.191 26.099 1.00 31.64 ? 545 ARG C NH1 1 ATOM 7302 N NH2 . ARG C 1 237 ? 4.040 11.680 26.314 1.00 29.63 ? 545 ARG C NH2 1 ATOM 7303 N N . LEU C 1 238 ? 7.690 8.392 31.952 1.00 25.37 ? 546 LEU C N 1 ATOM 7304 C CA . LEU C 1 238 ? 8.246 7.051 31.803 1.00 27.19 ? 546 LEU C CA 1 ATOM 7305 C C . LEU C 1 238 ? 8.052 6.600 30.363 1.00 25.77 ? 546 LEU C C 1 ATOM 7306 O O . LEU C 1 238 ? 6.927 6.564 29.859 1.00 24.22 ? 546 LEU C O 1 ATOM 7307 C CB . LEU C 1 238 ? 7.554 6.073 32.757 1.00 28.32 ? 546 LEU C CB 1 ATOM 7308 C CG . LEU C 1 238 ? 8.234 4.728 33.025 1.00 31.69 ? 546 LEU C CG 1 ATOM 7309 C CD1 . LEU C 1 238 ? 9.570 4.932 33.715 1.00 31.60 ? 546 LEU C CD1 1 ATOM 7310 C CD2 . LEU C 1 238 ? 7.327 3.833 33.863 1.00 30.94 ? 546 LEU C CD2 1 ATOM 7311 N N . ARG C 1 239 ? 9.150 6.278 29.692 1.00 25.00 ? 547 ARG C N 1 ATOM 7312 C CA . ARG C 1 239 ? 9.082 5.848 28.302 1.00 22.83 ? 547 ARG C CA 1 ATOM 7313 C C . ARG C 1 239 ? 8.845 4.351 28.224 1.00 20.98 ? 547 ARG C C 1 ATOM 7314 O O . ARG C 1 239 ? 9.696 3.547 28.610 1.00 22.36 ? 547 ARG C O 1 ATOM 7315 C CB . ARG C 1 239 ? 10.349 6.253 27.539 1.00 23.59 ? 547 ARG C CB 1 ATOM 7316 C CG . ARG C 1 239 ? 10.458 7.757 27.317 1.00 24.08 ? 547 ARG C CG 1 ATOM 7317 C CD . ARG C 1 239 ? 11.747 8.160 26.616 1.00 28.46 ? 547 ARG C CD 1 ATOM 7318 N NE . ARG C 1 239 ? 11.665 9.524 26.093 1.00 30.88 ? 547 ARG C NE 1 ATOM 7319 C CZ . ARG C 1 239 ? 12.714 10.318 25.883 1.00 32.62 ? 547 ARG C CZ 1 ATOM 7320 N NH1 . ARG C 1 239 ? 13.942 9.901 26.160 1.00 32.53 ? 547 ARG C NH1 1 ATOM 7321 N NH2 . ARG C 1 239 ? 12.532 11.539 25.402 1.00 33.17 ? 547 ARG C NH2 1 ATOM 7322 N N . VAL C 1 240 ? 7.672 3.977 27.729 1.00 17.15 ? 548 VAL C N 1 ATOM 7323 C CA . VAL C 1 240 ? 7.297 2.574 27.667 1.00 18.93 ? 548 VAL C CA 1 ATOM 7324 C C . VAL C 1 240 ? 7.230 2.121 26.218 1.00 20.25 ? 548 VAL C C 1 ATOM 7325 O O . VAL C 1 240 ? 6.588 2.768 25.387 1.00 22.24 ? 548 VAL C O 1 ATOM 7326 C CB . VAL C 1 240 ? 5.943 2.330 28.363 1.00 21.08 ? 548 VAL C CB 1 ATOM 7327 C CG1 . VAL C 1 240 ? 5.514 0.867 28.229 1.00 19.44 ? 548 VAL C CG1 1 ATOM 7328 C CG2 . VAL C 1 240 ? 6.033 2.738 29.827 1.00 22.47 ? 548 VAL C CG2 1 ATOM 7329 N N . GLY C 1 241 ? 7.908 1.018 25.915 1.00 19.17 ? 549 GLY C N 1 ATOM 7330 C CA . GLY C 1 241 ? 7.905 0.486 24.567 1.00 19.00 ? 549 GLY C CA 1 ATOM 7331 C C . GLY C 1 241 ? 7.170 -0.837 24.481 1.00 19.11 ? 549 GLY C C 1 ATOM 7332 O O . GLY C 1 241 ? 7.530 -1.798 25.163 1.00 23.02 ? 549 GLY C O 1 ATOM 7333 N N . TYR C 1 242 ? 6.134 -0.881 23.650 1.00 17.04 ? 550 TYR C N 1 ATOM 7334 C CA . TYR C 1 242 ? 5.372 -2.104 23.423 1.00 18.34 ? 550 TYR C CA 1 ATOM 7335 C C . TYR C 1 242 ? 5.864 -2.765 22.142 1.00 20.40 ? 550 TYR C C 1 ATOM 7336 O O . TYR C 1 242 ? 5.793 -2.171 21.061 1.00 17.93 ? 550 TYR C O 1 ATOM 7337 C CB . TYR C 1 242 ? 3.878 -1.793 23.310 1.00 17.53 ? 550 TYR C CB 1 ATOM 7338 C CG . TYR C 1 242 ? 3.245 -1.375 24.618 1.00 17.41 ? 550 TYR C CG 1 ATOM 7339 C CD1 . TYR C 1 242 ? 2.958 -2.312 25.602 1.00 15.72 ? 550 TYR C CD1 1 ATOM 7340 C CD2 . TYR C 1 242 ? 2.932 -0.044 24.869 1.00 18.73 ? 550 TYR C CD2 1 ATOM 7341 C CE1 . TYR C 1 242 ? 2.379 -1.933 26.802 1.00 16.09 ? 550 TYR C CE1 1 ATOM 7342 C CE2 . TYR C 1 242 ? 2.358 0.345 26.069 1.00 18.53 ? 550 TYR C CE2 1 ATOM 7343 C CZ . TYR C 1 242 ? 2.083 -0.602 27.027 1.00 17.33 ? 550 TYR C CZ 1 ATOM 7344 O OH . TYR C 1 242 ? 1.508 -0.223 28.217 1.00 19.65 ? 550 TYR C OH 1 ATOM 7345 N N . VAL C 1 243 ? 6.378 -3.982 22.270 1.00 18.63 ? 551 VAL C N 1 ATOM 7346 C CA . VAL C 1 243 ? 6.967 -4.684 21.138 1.00 17.61 ? 551 VAL C CA 1 ATOM 7347 C C . VAL C 1 243 ? 6.099 -5.867 20.737 1.00 17.25 ? 551 VAL C C 1 ATOM 7348 O O . VAL C 1 243 ? 5.898 -6.796 21.521 1.00 16.98 ? 551 VAL C O 1 ATOM 7349 C CB . VAL C 1 243 ? 8.384 -5.179 21.464 1.00 19.74 ? 551 VAL C CB 1 ATOM 7350 C CG1 . VAL C 1 243 ? 9.013 -5.823 20.242 1.00 18.75 ? 551 VAL C CG1 1 ATOM 7351 C CG2 . VAL C 1 243 ? 9.234 -4.022 21.944 1.00 18.79 ? 551 VAL C CG2 1 ATOM 7352 N N . SER C 1 244 ? 5.584 -5.832 19.515 1.00 17.88 ? 552 SER C N 1 ATOM 7353 C CA . SER C 1 244 ? 4.648 -6.857 19.078 1.00 19.01 ? 552 SER C CA 1 ATOM 7354 C C . SER C 1 244 ? 4.664 -7.081 17.575 1.00 18.81 ? 552 SER C C 1 ATOM 7355 O O . SER C 1 244 ? 4.758 -6.135 16.793 1.00 17.34 ? 552 SER C O 1 ATOM 7356 C CB . SER C 1 244 ? 3.228 -6.496 19.525 1.00 19.74 ? 552 SER C CB 1 ATOM 7357 O OG . SER C 1 244 ? 2.294 -7.490 19.129 1.00 18.80 ? 552 SER C OG 1 ATOM 7358 N N . SER C 1 245 ? 4.558 -8.346 17.181 1.00 17.51 ? 553 SER C N 1 ATOM 7359 C CA . SER C 1 245 ? 4.364 -8.698 15.785 1.00 18.98 ? 553 SER C CA 1 ATOM 7360 C C . SER C 1 245 ? 2.877 -8.680 15.420 1.00 18.13 ? 553 SER C C 1 ATOM 7361 O O . SER C 1 245 ? 2.512 -8.953 14.277 1.00 17.50 ? 553 SER C O 1 ATOM 7362 C CB . SER C 1 245 ? 4.939 -10.089 15.515 1.00 19.60 ? 553 SER C CB 1 ATOM 7363 O OG . SER C 1 245 ? 4.257 -11.071 16.282 1.00 20.75 ? 553 SER C OG 1 ATOM 7364 N N . ASP C 1 246 ? 2.020 -8.360 16.389 1.00 16.72 ? 554 ASP C N 1 ATOM 7365 C CA . ASP C 1 246 ? 0.578 -8.491 16.184 1.00 18.22 ? 554 ASP C CA 1 ATOM 7366 C C . ASP C 1 246 ? -0.223 -7.199 16.340 1.00 18.50 ? 554 ASP C C 1 ATOM 7367 O O . ASP C 1 246 ? -1.360 -7.216 16.816 1.00 18.86 ? 554 ASP C O 1 ATOM 7368 C CB . ASP C 1 246 ? 0.019 -9.587 17.095 1.00 18.38 ? 554 ASP C CB 1 ATOM 7369 C CG . ASP C 1 246 ? 0.664 -10.928 16.826 1.00 22.26 ? 554 ASP C CG 1 ATOM 7370 O OD1 . ASP C 1 246 ? 0.704 -11.333 15.646 1.00 24.19 ? 554 ASP C OD1 1 ATOM 7371 O OD2 . ASP C 1 246 ? 1.160 -11.554 17.783 1.00 27.11 ? 554 ASP C OD2 1 ATOM 7372 N N . PHE C 1 247 ? 0.365 -6.079 15.934 1.00 17.73 ? 555 PHE C N 1 ATOM 7373 C CA . PHE C 1 247 ? -0.399 -4.841 15.828 1.00 14.97 ? 555 PHE C CA 1 ATOM 7374 C C . PHE C 1 247 ? -1.107 -4.871 14.483 1.00 17.91 ? 555 PHE C C 1 ATOM 7375 O O . PHE C 1 247 ? -0.530 -4.494 13.459 1.00 18.69 ? 555 PHE C O 1 ATOM 7376 C CB . PHE C 1 247 ? 0.520 -3.616 15.893 1.00 14.84 ? 555 PHE C CB 1 ATOM 7377 C CG . PHE C 1 247 ? 1.174 -3.408 17.233 1.00 17.69 ? 555 PHE C CG 1 ATOM 7378 C CD1 . PHE C 1 247 ? 0.441 -3.493 18.402 1.00 19.30 ? 555 PHE C CD1 1 ATOM 7379 C CD2 . PHE C 1 247 ? 2.528 -3.122 17.314 1.00 16.53 ? 555 PHE C CD2 1 ATOM 7380 C CE1 . PHE C 1 247 ? 1.047 -3.296 19.634 1.00 21.34 ? 555 PHE C CE1 1 ATOM 7381 C CE2 . PHE C 1 247 ? 3.139 -2.921 18.539 1.00 17.70 ? 555 PHE C CE2 1 ATOM 7382 C CZ . PHE C 1 247 ? 2.397 -3.005 19.699 1.00 18.96 ? 555 PHE C CZ 1 ATOM 7383 N N . GLY C 1 248 ? -2.351 -5.333 14.489 1.00 16.80 ? 556 GLY C N 1 ATOM 7384 C CA . GLY C 1 248 ? -3.118 -5.535 13.274 1.00 13.86 ? 556 GLY C CA 1 ATOM 7385 C C . GLY C 1 248 ? -4.229 -6.517 13.582 1.00 16.24 ? 556 GLY C C 1 ATOM 7386 O O . GLY C 1 248 ? -4.642 -6.614 14.734 1.00 14.94 ? 556 GLY C O 1 ATOM 7387 N N . ASN C 1 249 ? -4.709 -7.249 12.576 1.00 15.83 ? 557 ASN C N 1 ATOM 7388 C CA . ASN C 1 249 ? -5.812 -8.192 12.799 1.00 15.56 ? 557 ASN C CA 1 ATOM 7389 C C . ASN C 1 249 ? -5.311 -9.467 13.471 1.00 15.90 ? 557 ASN C C 1 ATOM 7390 O O . ASN C 1 249 ? -4.893 -10.408 12.797 1.00 15.49 ? 557 ASN C O 1 ATOM 7391 C CB . ASN C 1 249 ? -6.521 -8.516 11.479 1.00 17.65 ? 557 ASN C CB 1 ATOM 7392 C CG . ASN C 1 249 ? -7.750 -9.401 11.664 1.00 18.65 ? 557 ASN C CG 1 ATOM 7393 O OD1 . ASN C 1 249 ? -8.359 -9.430 12.736 1.00 16.73 ? 557 ASN C OD1 1 ATOM 7394 N ND2 . ASN C 1 249 ? -8.122 -10.124 10.605 1.00 17.70 ? 557 ASN C ND2 1 ATOM 7395 N N . HIS C 1 250 ? -5.368 -9.484 14.802 1.00 15.10 ? 558 HIS C N 1 ATOM 7396 C CA . HIS C 1 250 ? -4.879 -10.596 15.614 1.00 15.03 ? 558 HIS C CA 1 ATOM 7397 C C . HIS C 1 250 ? -5.474 -10.425 17.007 1.00 14.12 ? 558 HIS C C 1 ATOM 7398 O O . HIS C 1 250 ? -5.688 -9.297 17.438 1.00 13.25 ? 558 HIS C O 1 ATOM 7399 C CB . HIS C 1 250 ? -3.348 -10.550 15.690 1.00 17.91 ? 558 HIS C CB 1 ATOM 7400 C CG . HIS C 1 250 ? -2.736 -11.716 16.404 1.00 16.85 ? 558 HIS C CG 1 ATOM 7401 N ND1 . HIS C 1 250 ? -2.641 -11.782 17.777 1.00 14.26 ? 558 HIS C ND1 1 ATOM 7402 C CD2 . HIS C 1 250 ? -2.180 -12.858 15.933 1.00 17.10 ? 558 HIS C CD2 1 ATOM 7403 C CE1 . HIS C 1 250 ? -2.063 -12.919 18.121 1.00 16.96 ? 558 HIS C CE1 1 ATOM 7404 N NE2 . HIS C 1 250 ? -1.770 -13.589 17.021 1.00 17.79 ? 558 HIS C NE2 1 ATOM 7405 N N . PRO C 1 251 ? -5.737 -11.541 17.717 1.00 13.00 ? 559 PRO C N 1 ATOM 7406 C CA . PRO C 1 251 ? -6.310 -11.455 19.068 1.00 16.14 ? 559 PRO C CA 1 ATOM 7407 C C . PRO C 1 251 ? -5.603 -10.435 19.963 1.00 13.83 ? 559 PRO C C 1 ATOM 7408 O O . PRO C 1 251 ? -6.260 -9.751 20.739 1.00 13.89 ? 559 PRO C O 1 ATOM 7409 C CB . PRO C 1 251 ? -6.107 -12.868 19.624 1.00 16.82 ? 559 PRO C CB 1 ATOM 7410 C CG . PRO C 1 251 ? -6.100 -13.747 18.440 1.00 17.54 ? 559 PRO C CG 1 ATOM 7411 C CD . PRO C 1 251 ? -5.638 -12.936 17.246 1.00 12.78 ? 559 PRO C CD 1 ATOM 7412 N N . THR C 1 252 ? -4.283 -10.313 19.837 1.00 16.95 ? 560 THR C N 1 ATOM 7413 C CA . THR C 1 252 ? -3.544 -9.377 20.682 1.00 17.89 ? 560 THR C CA 1 ATOM 7414 C C . THR C 1 252 ? -4.088 -7.952 20.560 1.00 16.02 ? 560 THR C C 1 ATOM 7415 O O . THR C 1 252 ? -4.382 -7.306 21.568 1.00 15.26 ? 560 THR C O 1 ATOM 7416 C CB . THR C 1 252 ? -2.037 -9.428 20.408 1.00 23.67 ? 560 THR C CB 1 ATOM 7417 O OG1 . THR C 1 252 ? -1.541 -10.707 20.817 1.00 24.83 ? 560 THR C OG1 1 ATOM 7418 C CG2 . THR C 1 252 ? -1.311 -8.346 21.191 1.00 22.22 ? 560 THR C CG2 1 ATOM 7419 N N . SER C 1 253 ? -4.270 -7.476 19.333 1.00 15.56 ? 561 SER C N 1 ATOM 7420 C CA . SER C 1 253 ? -4.851 -6.150 19.142 1.00 14.71 ? 561 SER C CA 1 ATOM 7421 C C . SER C 1 253 ? -6.329 -6.098 19.519 1.00 15.27 ? 561 SER C C 1 ATOM 7422 O O . SER C 1 253 ? -6.818 -5.057 19.960 1.00 15.32 ? 561 SER C O 1 ATOM 7423 C CB . SER C 1 253 ? -4.658 -5.665 17.709 1.00 15.06 ? 561 SER C CB 1 ATOM 7424 O OG . SER C 1 253 ? -3.280 -5.501 17.417 1.00 14.80 ? 561 SER C OG 1 ATOM 7425 N N . HIS C 1 254 ? -7.042 -7.207 19.332 1.00 13.67 ? 562 HIS C N 1 ATOM 7426 C CA . HIS C 1 254 ? -8.448 -7.282 19.730 1.00 15.65 ? 562 HIS C CA 1 ATOM 7427 C C . HIS C 1 254 ? -8.603 -7.117 21.243 1.00 17.32 ? 562 HIS C C 1 ATOM 7428 O O . HIS C 1 254 ? -9.684 -6.794 21.732 1.00 19.06 ? 562 HIS C O 1 ATOM 7429 C CB . HIS C 1 254 ? -9.077 -8.614 19.306 1.00 15.29 ? 562 HIS C CB 1 ATOM 7430 C CG . HIS C 1 254 ? -8.953 -8.905 17.844 1.00 15.55 ? 562 HIS C CG 1 ATOM 7431 N ND1 . HIS C 1 254 ? -9.077 -10.178 17.327 1.00 15.36 ? 562 HIS C ND1 1 ATOM 7432 C CD2 . HIS C 1 254 ? -8.724 -8.088 16.786 1.00 16.34 ? 562 HIS C CD2 1 ATOM 7433 C CE1 . HIS C 1 254 ? -8.918 -10.134 16.015 1.00 13.01 ? 562 HIS C CE1 1 ATOM 7434 N NE2 . HIS C 1 254 ? -8.699 -8.879 15.662 1.00 15.07 ? 562 HIS C NE2 1 ATOM 7435 N N . LEU C 1 255 ? -7.523 -7.364 21.978 1.00 15.91 ? 563 LEU C N 1 ATOM 7436 C CA . LEU C 1 255 ? -7.541 -7.227 23.426 1.00 16.40 ? 563 LEU C CA 1 ATOM 7437 C C . LEU C 1 255 ? -7.037 -5.866 23.884 1.00 16.53 ? 563 LEU C C 1 ATOM 7438 O O . LEU C 1 255 ? -7.616 -5.263 24.790 1.00 14.60 ? 563 LEU C O 1 ATOM 7439 C CB . LEU C 1 255 ? -6.685 -8.317 24.086 1.00 17.81 ? 563 LEU C CB 1 ATOM 7440 C CG . LEU C 1 255 ? -7.145 -9.757 23.869 1.00 19.40 ? 563 LEU C CG 1 ATOM 7441 C CD1 . LEU C 1 255 ? -6.327 -10.690 24.718 1.00 19.96 ? 563 LEU C CD1 1 ATOM 7442 C CD2 . LEU C 1 255 ? -8.623 -9.905 24.180 1.00 18.03 ? 563 LEU C CD2 1 ATOM 7443 N N . MET C 1 256 ? -5.950 -5.388 23.278 1.00 12.52 ? 564 MET C N 1 ATOM 7444 C CA . MET C 1 256 ? -5.276 -4.211 23.829 1.00 13.25 ? 564 MET C CA 1 ATOM 7445 C C . MET C 1 256 ? -5.173 -2.973 22.937 1.00 13.08 ? 564 MET C C 1 ATOM 7446 O O . MET C 1 256 ? -4.452 -2.046 23.282 1.00 13.67 ? 564 MET C O 1 ATOM 7447 C CB . MET C 1 256 ? -3.886 -4.581 24.385 1.00 15.12 ? 564 MET C CB 1 ATOM 7448 C CG . MET C 1 256 ? -2.936 -5.278 23.396 1.00 14.47 ? 564 MET C CG 1 ATOM 7449 S SD . MET C 1 256 ? -2.515 -4.344 21.911 1.00 18.28 ? 564 MET C SD 1 ATOM 7450 C CE . MET C 1 256 ? -1.508 -3.021 22.594 1.00 16.50 ? 564 MET C CE 1 ATOM 7451 N N . GLN C 1 257 ? -5.885 -2.939 21.812 1.00 13.85 ? 565 GLN C N 1 ATOM 7452 C CA . GLN C 1 257 ? -5.724 -1.813 20.887 1.00 16.70 ? 565 GLN C CA 1 ATOM 7453 C C . GLN C 1 257 ? -6.021 -0.441 21.495 1.00 14.67 ? 565 GLN C C 1 ATOM 7454 O O . GLN C 1 257 ? -5.520 0.565 21.002 1.00 14.98 ? 565 GLN C O 1 ATOM 7455 C CB . GLN C 1 257 ? -6.533 -2.003 19.603 1.00 17.37 ? 565 GLN C CB 1 ATOM 7456 C CG . GLN C 1 257 ? -8.030 -1.979 19.794 1.00 15.20 ? 565 GLN C CG 1 ATOM 7457 C CD . GLN C 1 257 ? -8.766 -1.927 18.471 1.00 19.11 ? 565 GLN C CD 1 ATOM 7458 O OE1 . GLN C 1 257 ? -8.185 -1.581 17.437 1.00 15.50 ? 565 GLN C OE1 1 ATOM 7459 N NE2 . GLN C 1 257 ? -10.050 -2.267 18.493 1.00 19.23 ? 565 GLN C NE2 1 ATOM 7460 N N . SER C 1 258 ? -6.800 -0.393 22.576 1.00 16.04 ? 566 SER C N 1 ATOM 7461 C CA . SER C 1 258 ? -7.155 0.899 23.174 1.00 15.89 ? 566 SER C CA 1 ATOM 7462 C C . SER C 1 258 ? -6.141 1.385 24.210 1.00 16.66 ? 566 SER C C 1 ATOM 7463 O O . SER C 1 258 ? -6.135 2.561 24.581 1.00 15.22 ? 566 SER C O 1 ATOM 7464 C CB . SER C 1 258 ? -8.542 0.841 23.828 1.00 15.17 ? 566 SER C CB 1 ATOM 7465 O OG . SER C 1 258 ? -9.580 0.730 22.860 1.00 16.93 ? 566 SER C OG 1 ATOM 7466 N N . ILE C 1 259 ? -5.301 0.477 24.690 1.00 14.05 ? 567 ILE C N 1 ATOM 7467 C CA . ILE C 1 259 ? -4.385 0.804 25.786 1.00 13.96 ? 567 ILE C CA 1 ATOM 7468 C C . ILE C 1 259 ? -3.351 1.916 25.502 1.00 16.31 ? 567 ILE C C 1 ATOM 7469 O O . ILE C 1 259 ? -3.208 2.832 26.313 1.00 17.36 ? 567 ILE C O 1 ATOM 7470 C CB . ILE C 1 259 ? -3.722 -0.464 26.371 1.00 20.45 ? 567 ILE C CB 1 ATOM 7471 C CG1 . ILE C 1 259 ? -4.782 -1.319 27.074 1.00 23.14 ? 567 ILE C CG1 1 ATOM 7472 C CG2 . ILE C 1 259 ? -2.612 -0.089 27.338 1.00 23.68 ? 567 ILE C CG2 1 ATOM 7473 C CD1 . ILE C 1 259 ? -4.225 -2.579 27.700 1.00 25.69 ? 567 ILE C CD1 1 ATOM 7474 N N . PRO C 1 260 ? -2.636 1.851 24.359 1.00 15.87 ? 568 PRO C N 1 ATOM 7475 C CA . PRO C 1 260 ? -1.681 2.934 24.088 1.00 18.25 ? 568 PRO C CA 1 ATOM 7476 C C . PRO C 1 260 ? -2.318 4.320 24.126 1.00 18.18 ? 568 PRO C C 1 ATOM 7477 O O . PRO C 1 260 ? -1.724 5.236 24.685 1.00 19.17 ? 568 PRO C O 1 ATOM 7478 C CB . PRO C 1 260 ? -1.194 2.624 22.673 1.00 16.94 ? 568 PRO C CB 1 ATOM 7479 C CG . PRO C 1 260 ? -1.318 1.146 22.559 1.00 14.96 ? 568 PRO C CG 1 ATOM 7480 C CD . PRO C 1 260 ? -2.575 0.804 23.321 1.00 14.37 ? 568 PRO C CD 1 ATOM 7481 N N . GLY C 1 261 ? -3.512 4.459 23.559 1.00 14.85 ? 569 GLY C N 1 ATOM 7482 C CA . GLY C 1 261 ? -4.200 5.735 23.535 1.00 15.41 ? 569 GLY C CA 1 ATOM 7483 C C . GLY C 1 261 ? -4.735 6.174 24.886 1.00 17.21 ? 569 GLY C C 1 ATOM 7484 O O . GLY C 1 261 ? -5.082 7.336 25.069 1.00 19.24 ? 569 GLY C O 1 ATOM 7485 N N . MET C 1 262 ? -4.802 5.247 25.837 1.00 15.80 ? 570 MET C N 1 ATOM 7486 C CA . MET C 1 262 ? -5.318 5.567 27.164 1.00 17.36 ? 570 MET C CA 1 ATOM 7487 C C . MET C 1 262 ? -4.244 5.904 28.190 1.00 18.07 ? 570 MET C C 1 ATOM 7488 O O . MET C 1 262 ? -4.558 6.304 29.314 1.00 16.98 ? 570 MET C O 1 ATOM 7489 C CB . MET C 1 262 ? -6.194 4.435 27.681 1.00 19.23 ? 570 MET C CB 1 ATOM 7490 C CG . MET C 1 262 ? -7.501 4.339 26.931 1.00 21.56 ? 570 MET C CG 1 ATOM 7491 S SD . MET C 1 262 ? -8.497 2.982 27.541 1.00 23.57 ? 570 MET C SD 1 ATOM 7492 C CE . MET C 1 262 ? -10.041 3.298 26.675 1.00 22.22 ? 570 MET C CE 1 ATOM 7493 N N . HIS C 1 263 ? -2.982 5.746 27.813 1.00 16.08 ? 571 HIS C N 1 ATOM 7494 C CA . HIS C 1 263 ? -1.901 6.138 28.711 1.00 18.06 ? 571 HIS C CA 1 ATOM 7495 C C . HIS C 1 263 ? -1.931 7.643 28.998 1.00 20.57 ? 571 HIS C C 1 ATOM 7496 O O . HIS C 1 263 ? -2.251 8.451 28.120 1.00 20.76 ? 571 HIS C O 1 ATOM 7497 C CB . HIS C 1 263 ? -0.543 5.727 28.144 1.00 20.97 ? 571 HIS C CB 1 ATOM 7498 C CG . HIS C 1 263 ? -0.150 4.320 28.472 1.00 21.34 ? 571 HIS C CG 1 ATOM 7499 N ND1 . HIS C 1 263 ? 0.164 3.917 29.753 1.00 23.52 ? 571 HIS C ND1 1 ATOM 7500 C CD2 . HIS C 1 263 ? -0.013 3.223 27.689 1.00 23.98 ? 571 HIS C CD2 1 ATOM 7501 C CE1 . HIS C 1 263 ? 0.479 2.634 29.744 1.00 24.80 ? 571 HIS C CE1 1 ATOM 7502 N NE2 . HIS C 1 263 ? 0.381 2.189 28.504 1.00 22.86 ? 571 HIS C NE2 1 ATOM 7503 N N . ASN C 1 264 ? -1.600 8.003 30.235 1.00 17.70 ? 572 ASN C N 1 ATOM 7504 C CA . ASN C 1 264 ? -1.575 9.389 30.676 1.00 21.81 ? 572 ASN C CA 1 ATOM 7505 C C . ASN C 1 264 ? -0.350 10.093 30.101 1.00 22.53 ? 572 ASN C C 1 ATOM 7506 O O . ASN C 1 264 ? 0.779 9.762 30.458 1.00 20.62 ? 572 ASN C O 1 ATOM 7507 C CB . ASN C 1 264 ? -1.557 9.433 32.212 1.00 22.58 ? 572 ASN C CB 1 ATOM 7508 C CG . ASN C 1 264 ? -1.343 10.833 32.769 1.00 23.53 ? 572 ASN C CG 1 ATOM 7509 O OD1 . ASN C 1 264 ? -1.508 11.832 32.071 1.00 23.37 ? 572 ASN C OD1 1 ATOM 7510 N ND2 . ASN C 1 264 ? -0.980 10.907 34.047 1.00 21.83 ? 572 ASN C ND2 1 ATOM 7511 N N . PRO C 1 265 ? -0.569 11.062 29.197 1.00 21.85 ? 573 PRO C N 1 ATOM 7512 C CA . PRO C 1 265 ? 0.574 11.710 28.541 1.00 21.90 ? 573 PRO C CA 1 ATOM 7513 C C . PRO C 1 265 ? 1.429 12.568 29.474 1.00 22.91 ? 573 PRO C C 1 ATOM 7514 O O . PRO C 1 265 ? 2.572 12.875 29.124 1.00 23.97 ? 573 PRO C O 1 ATOM 7515 C CB . PRO C 1 265 ? -0.076 12.570 27.450 1.00 22.99 ? 573 PRO C CB 1 ATOM 7516 C CG . PRO C 1 265 ? -1.503 12.744 27.885 1.00 24.39 ? 573 PRO C CG 1 ATOM 7517 C CD . PRO C 1 265 ? -1.863 11.503 28.644 1.00 19.33 ? 573 PRO C CD 1 ATOM 7518 N N . ASP C 1 266 ? 0.895 12.949 30.633 1.00 20.35 ? 574 ASP C N 1 ATOM 7519 C CA . ASP C 1 266 ? 1.660 13.732 31.601 1.00 22.68 ? 574 ASP C CA 1 ATOM 7520 C C . ASP C 1 266 ? 2.747 12.895 32.280 1.00 24.44 ? 574 ASP C C 1 ATOM 7521 O O . ASP C 1 266 ? 3.739 13.434 32.776 1.00 23.84 ? 574 ASP C O 1 ATOM 7522 C CB . ASP C 1 266 ? 0.730 14.339 32.662 1.00 24.42 ? 574 ASP C CB 1 ATOM 7523 C CG . ASP C 1 266 ? 1.466 15.225 33.653 1.00 28.78 ? 574 ASP C CG 1 ATOM 7524 O OD1 . ASP C 1 266 ? 2.295 16.051 33.218 1.00 28.15 ? 574 ASP C OD1 1 ATOM 7525 O OD2 . ASP C 1 266 ? 1.218 15.095 34.871 1.00 29.38 ? 574 ASP C OD2 1 ATOM 7526 N N . LYS C 1 267 ? 2.565 11.578 32.302 1.00 23.27 ? 575 LYS C N 1 ATOM 7527 C CA . LYS C 1 267 ? 3.477 10.723 33.052 1.00 24.45 ? 575 LYS C CA 1 ATOM 7528 C C . LYS C 1 267 ? 4.098 9.623 32.202 1.00 23.54 ? 575 LYS C C 1 ATOM 7529 O O . LYS C 1 267 ? 5.054 8.971 32.628 1.00 23.01 ? 575 LYS C O 1 ATOM 7530 C CB . LYS C 1 267 ? 2.754 10.098 34.245 1.00 29.19 ? 575 LYS C CB 1 ATOM 7531 C CG . LYS C 1 267 ? 2.286 11.099 35.287 1.00 32.23 ? 575 LYS C CG 1 ATOM 7532 C CD . LYS C 1 267 ? 3.452 11.714 36.026 1.00 36.14 ? 575 LYS C CD 1 ATOM 7533 C CE . LYS C 1 267 ? 2.967 12.638 37.131 1.00 39.42 ? 575 LYS C CE 1 ATOM 7534 N NZ . LYS C 1 267 ? 4.097 13.291 37.839 1.00 41.23 ? 575 LYS C NZ 1 ATOM 7535 N N . PHE C 1 268 ? 3.548 9.409 31.011 1.00 20.43 ? 576 PHE C N 1 ATOM 7536 C CA . PHE C 1 268 ? 4.016 8.331 30.148 1.00 21.14 ? 576 PHE C CA 1 ATOM 7537 C C . PHE C 1 268 ? 4.193 8.778 28.708 1.00 24.11 ? 576 PHE C C 1 ATOM 7538 O O . PHE C 1 268 ? 3.435 9.603 28.201 1.00 27.06 ? 576 PHE C O 1 ATOM 7539 C CB . PHE C 1 268 ? 3.068 7.128 30.229 1.00 20.42 ? 576 PHE C CB 1 ATOM 7540 C CG . PHE C 1 268 ? 3.011 6.527 31.590 1.00 20.43 ? 576 PHE C CG 1 ATOM 7541 C CD1 . PHE C 1 268 ? 3.856 5.485 31.934 1.00 21.67 ? 576 PHE C CD1 1 ATOM 7542 C CD2 . PHE C 1 268 ? 2.157 7.042 32.551 1.00 20.70 ? 576 PHE C CD2 1 ATOM 7543 C CE1 . PHE C 1 268 ? 3.830 4.949 33.207 1.00 22.46 ? 576 PHE C CE1 1 ATOM 7544 C CE2 . PHE C 1 268 ? 2.134 6.517 33.825 1.00 21.48 ? 576 PHE C CE2 1 ATOM 7545 C CZ . PHE C 1 268 ? 2.970 5.468 34.153 1.00 20.98 ? 576 PHE C CZ 1 ATOM 7546 N N . GLU C 1 269 ? 5.216 8.231 28.064 1.00 20.22 ? 577 GLU C N 1 ATOM 7547 C CA . GLU C 1 269 ? 5.416 8.420 26.640 1.00 22.69 ? 577 GLU C CA 1 ATOM 7548 C C . GLU C 1 269 ? 5.449 7.037 26.009 1.00 22.21 ? 577 GLU C C 1 ATOM 7549 O O . GLU C 1 269 ? 6.295 6.216 26.351 1.00 21.57 ? 577 GLU C O 1 ATOM 7550 C CB . GLU C 1 269 ? 6.722 9.169 26.370 1.00 22.28 ? 577 GLU C CB 1 ATOM 7551 C CG . GLU C 1 269 ? 6.894 9.575 24.912 1.00 25.79 ? 577 GLU C CG 1 ATOM 7552 C CD . GLU C 1 269 ? 8.108 10.450 24.686 1.00 27.94 ? 577 GLU C CD 1 ATOM 7553 O OE1 . GLU C 1 269 ? 8.982 10.498 25.577 1.00 30.63 ? 577 GLU C OE1 1 ATOM 7554 O OE2 . GLU C 1 269 ? 8.186 11.094 23.617 1.00 27.46 ? 577 GLU C OE2 1 ATOM 7555 N N . VAL C 1 270 ? 4.515 6.784 25.099 1.00 21.75 ? 578 VAL C N 1 ATOM 7556 C CA . VAL C 1 270 ? 4.278 5.437 24.599 1.00 21.44 ? 578 VAL C CA 1 ATOM 7557 C C . VAL C 1 270 ? 4.899 5.226 23.232 1.00 20.83 ? 578 VAL C C 1 ATOM 7558 O O . VAL C 1 270 ? 4.619 5.963 22.290 1.00 19.29 ? 578 VAL C O 1 ATOM 7559 C CB . VAL C 1 270 ? 2.767 5.128 24.492 1.00 22.69 ? 578 VAL C CB 1 ATOM 7560 C CG1 . VAL C 1 270 ? 2.545 3.709 23.980 1.00 22.13 ? 578 VAL C CG1 1 ATOM 7561 C CG2 . VAL C 1 270 ? 2.088 5.320 25.832 1.00 22.46 ? 578 VAL C CG2 1 ATOM 7562 N N . PHE C 1 271 ? 5.732 4.197 23.137 1.00 18.96 ? 579 PHE C N 1 ATOM 7563 C CA . PHE C 1 271 ? 6.379 3.838 21.891 1.00 17.97 ? 579 PHE C CA 1 ATOM 7564 C C . PHE C 1 271 ? 5.887 2.453 21.514 1.00 19.36 ? 579 PHE C C 1 ATOM 7565 O O . PHE C 1 271 ? 6.031 1.521 22.295 1.00 22.51 ? 579 PHE C O 1 ATOM 7566 C CB . PHE C 1 271 ? 7.895 3.773 22.080 1.00 19.40 ? 579 PHE C CB 1 ATOM 7567 C CG . PHE C 1 271 ? 8.547 5.098 22.386 1.00 20.73 ? 579 PHE C CG 1 ATOM 7568 C CD1 . PHE C 1 271 ? 9.323 5.737 21.431 1.00 21.80 ? 579 PHE C CD1 1 ATOM 7569 C CD2 . PHE C 1 271 ? 8.421 5.681 23.636 1.00 20.47 ? 579 PHE C CD2 1 ATOM 7570 C CE1 . PHE C 1 271 ? 9.950 6.934 21.712 1.00 24.30 ? 579 PHE C CE1 1 ATOM 7571 C CE2 . PHE C 1 271 ? 9.042 6.884 23.922 1.00 22.04 ? 579 PHE C CE2 1 ATOM 7572 C CZ . PHE C 1 271 ? 9.807 7.510 22.958 1.00 24.31 ? 579 PHE C CZ 1 ATOM 7573 N N . CYS C 1 272 ? 5.308 2.309 20.328 1.00 19.04 ? 580 CYS C N 1 ATOM 7574 C CA . CYS C 1 272 ? 4.966 0.979 19.830 1.00 17.49 ? 580 CYS C CA 1 ATOM 7575 C C . CYS C 1 272 ? 5.949 0.540 18.750 1.00 20.40 ? 580 CYS C C 1 ATOM 7576 O O . CYS C 1 272 ? 6.196 1.269 17.786 1.00 23.80 ? 580 CYS C O 1 ATOM 7577 C CB . CYS C 1 272 ? 3.529 0.935 19.306 1.00 18.27 ? 580 CYS C CB 1 ATOM 7578 S SG . CYS C 1 272 ? 2.268 1.080 20.603 1.00 21.93 ? 580 CYS C SG 1 ATOM 7579 N N . TYR C 1 273 ? 6.517 -0.646 18.934 1.00 19.80 ? 581 TYR C N 1 ATOM 7580 C CA . TYR C 1 273 ? 7.471 -1.212 17.988 1.00 20.19 ? 581 TYR C CA 1 ATOM 7581 C C . TYR C 1 273 ? 6.839 -2.406 17.300 1.00 21.44 ? 581 TYR C C 1 ATOM 7582 O O . TYR C 1 273 ? 6.692 -3.470 17.896 1.00 20.41 ? 581 TYR C O 1 ATOM 7583 C CB . TYR C 1 273 ? 8.751 -1.632 18.703 1.00 20.94 ? 581 TYR C CB 1 ATOM 7584 C CG . TYR C 1 273 ? 9.484 -0.467 19.325 1.00 22.16 ? 581 TYR C CG 1 ATOM 7585 C CD1 . TYR C 1 273 ? 10.407 0.267 18.590 1.00 23.67 ? 581 TYR C CD1 1 ATOM 7586 C CD2 . TYR C 1 273 ? 9.232 -0.085 20.639 1.00 21.84 ? 581 TYR C CD2 1 ATOM 7587 C CE1 . TYR C 1 273 ? 11.072 1.344 19.152 1.00 25.28 ? 581 TYR C CE1 1 ATOM 7588 C CE2 . TYR C 1 273 ? 9.894 0.987 21.212 1.00 22.03 ? 581 TYR C CE2 1 ATOM 7589 C CZ . TYR C 1 273 ? 10.813 1.697 20.464 1.00 24.04 ? 581 TYR C CZ 1 ATOM 7590 O OH . TYR C 1 273 ? 11.471 2.765 21.026 1.00 24.97 ? 581 TYR C OH 1 ATOM 7591 N N . ALA C 1 274 ? 6.457 -2.218 16.043 1.00 22.32 ? 582 ALA C N 1 ATOM 7592 C CA . ALA C 1 274 ? 5.797 -3.271 15.290 1.00 20.62 ? 582 ALA C CA 1 ATOM 7593 C C . ALA C 1 274 ? 6.828 -4.191 14.644 1.00 22.14 ? 582 ALA C C 1 ATOM 7594 O O . ALA C 1 274 ? 7.784 -3.727 14.019 1.00 22.16 ? 582 ALA C O 1 ATOM 7595 C CB . ALA C 1 274 ? 4.882 -2.663 14.237 1.00 21.21 ? 582 ALA C CB 1 ATOM 7596 N N . LEU C 1 275 ? 6.637 -5.496 14.803 1.00 19.14 ? 583 LEU C N 1 ATOM 7597 C CA . LEU C 1 275 ? 7.526 -6.469 14.184 1.00 18.30 ? 583 LEU C CA 1 ATOM 7598 C C . LEU C 1 275 ? 6.971 -6.966 12.852 1.00 23.66 ? 583 LEU C C 1 ATOM 7599 O O . LEU C 1 275 ? 7.624 -7.732 12.138 1.00 30.11 ? 583 LEU C O 1 ATOM 7600 C CB . LEU C 1 275 ? 7.784 -7.646 15.135 1.00 19.39 ? 583 LEU C CB 1 ATOM 7601 C CG . LEU C 1 275 ? 8.367 -7.252 16.494 1.00 20.10 ? 583 LEU C CG 1 ATOM 7602 C CD1 . LEU C 1 275 ? 8.672 -8.478 17.359 1.00 17.94 ? 583 LEU C CD1 1 ATOM 7603 C CD2 . LEU C 1 275 ? 9.616 -6.381 16.320 1.00 21.20 ? 583 LEU C CD2 1 ATOM 7604 N N . SER C 1 276 ? 5.771 -6.514 12.512 1.00 21.05 ? 584 SER C N 1 ATOM 7605 C CA . SER C 1 276 ? 5.125 -6.924 11.272 1.00 21.60 ? 584 SER C CA 1 ATOM 7606 C C . SER C 1 276 ? 4.813 -5.698 10.433 1.00 20.66 ? 584 SER C C 1 ATOM 7607 O O . SER C 1 276 ? 4.627 -4.605 10.976 1.00 19.07 ? 584 SER C O 1 ATOM 7608 C CB . SER C 1 276 ? 3.828 -7.683 11.575 1.00 22.84 ? 584 SER C CB 1 ATOM 7609 O OG . SER C 1 276 ? 2.879 -6.835 12.203 1.00 26.32 ? 584 SER C OG 1 ATOM 7610 N N . PRO C 1 277 ? 4.755 -5.870 9.104 1.00 22.40 ? 585 PRO C N 1 ATOM 7611 C CA . PRO C 1 277 ? 4.322 -4.759 8.251 1.00 25.84 ? 585 PRO C CA 1 ATOM 7612 C C . PRO C 1 277 ? 2.841 -4.432 8.462 1.00 23.65 ? 585 PRO C C 1 ATOM 7613 O O . PRO C 1 277 ? 2.109 -5.213 9.076 1.00 23.00 ? 585 PRO C O 1 ATOM 7614 C CB . PRO C 1 277 ? 4.573 -5.284 6.831 1.00 29.02 ? 585 PRO C CB 1 ATOM 7615 C CG . PRO C 1 277 ? 4.550 -6.762 6.960 1.00 28.17 ? 585 PRO C CG 1 ATOM 7616 C CD . PRO C 1 277 ? 5.107 -7.070 8.323 1.00 25.76 ? 585 PRO C CD 1 ATOM 7617 N N . ASP C 1 278 ? 2.427 -3.268 7.974 1.00 22.15 ? 586 ASP C N 1 ATOM 7618 C CA . ASP C 1 278 ? 1.048 -2.799 8.068 1.00 23.18 ? 586 ASP C CA 1 ATOM 7619 C C . ASP C 1 278 ? 0.130 -3.712 7.263 1.00 23.36 ? 586 ASP C C 1 ATOM 7620 O O . ASP C 1 278 ? 0.320 -3.870 6.058 1.00 24.63 ? 586 ASP C O 1 ATOM 7621 C CB . ASP C 1 278 ? 0.979 -1.365 7.519 1.00 27.26 ? 586 ASP C CB 1 ATOM 7622 C CG . ASP C 1 278 ? -0.391 -0.719 7.692 1.00 27.79 ? 586 ASP C CG 1 ATOM 7623 O OD1 . ASP C 1 278 ? -1.393 -1.428 7.923 1.00 26.28 ? 586 ASP C OD1 1 ATOM 7624 O OD2 . ASP C 1 278 ? -0.459 0.523 7.586 1.00 30.34 ? 586 ASP C OD2 1 ATOM 7625 N N . ASP C 1 279 ? -0.870 -4.305 7.921 1.00 21.73 ? 587 ASP C N 1 ATOM 7626 C CA . ASP C 1 279 ? -1.768 -5.234 7.235 1.00 22.07 ? 587 ASP C CA 1 ATOM 7627 C C . ASP C 1 279 ? -3.026 -4.573 6.659 1.00 23.96 ? 587 ASP C C 1 ATOM 7628 O O . ASP C 1 279 ? -3.906 -5.258 6.136 1.00 23.69 ? 587 ASP C O 1 ATOM 7629 C CB . ASP C 1 279 ? -2.121 -6.454 8.115 1.00 20.34 ? 587 ASP C CB 1 ATOM 7630 C CG . ASP C 1 279 ? -3.012 -6.103 9.305 1.00 21.20 ? 587 ASP C CG 1 ATOM 7631 O OD1 . ASP C 1 279 ? -3.383 -4.923 9.475 1.00 19.93 ? 587 ASP C OD1 1 ATOM 7632 O OD2 . ASP C 1 279 ? -3.354 -7.033 10.069 1.00 19.28 ? 587 ASP C OD2 1 ATOM 7633 N N . GLY C 1 280 ? -3.097 -3.246 6.758 1.00 23.43 ? 588 GLY C N 1 ATOM 7634 C CA . GLY C 1 280 ? -4.201 -2.481 6.199 1.00 24.09 ? 588 GLY C CA 1 ATOM 7635 C C . GLY C 1 280 ? -5.469 -2.405 7.050 1.00 21.67 ? 588 GLY C C 1 ATOM 7636 O O . GLY C 1 280 ? -6.438 -1.758 6.652 1.00 22.26 ? 588 GLY C O 1 ATOM 7637 N N . THR C 1 281 ? -5.472 -3.047 8.215 1.00 17.49 ? 589 THR C N 1 ATOM 7638 C CA . THR C 1 281 ? -6.680 -3.095 9.052 1.00 16.80 ? 589 THR C CA 1 ATOM 7639 C C . THR C 1 281 ? -6.786 -1.913 10.004 1.00 17.58 ? 589 THR C C 1 ATOM 7640 O O . THR C 1 281 ? -5.791 -1.249 10.288 1.00 18.70 ? 589 THR C O 1 ATOM 7641 C CB . THR C 1 281 ? -6.737 -4.380 9.900 1.00 17.63 ? 589 THR C CB 1 ATOM 7642 O OG1 . THR C 1 281 ? -5.649 -4.376 10.834 1.00 17.06 ? 589 THR C OG1 1 ATOM 7643 C CG2 . THR C 1 281 ? -6.660 -5.610 9.010 1.00 19.88 ? 589 THR C CG2 1 ATOM 7644 N N . ASN C 1 282 ? -7.994 -1.663 10.512 1.00 17.16 ? 590 ASN C N 1 ATOM 7645 C CA . ASN C 1 282 ? -8.221 -0.547 11.430 1.00 17.32 ? 590 ASN C CA 1 ATOM 7646 C C . ASN C 1 282 ? -7.517 -0.727 12.767 1.00 16.82 ? 590 ASN C C 1 ATOM 7647 O O . ASN C 1 282 ? -7.281 0.243 13.484 1.00 18.50 ? 590 ASN C O 1 ATOM 7648 C CB . ASN C 1 282 ? -9.716 -0.323 11.667 1.00 17.78 ? 590 ASN C CB 1 ATOM 7649 C CG . ASN C 1 282 ? -10.406 0.307 10.473 1.00 22.54 ? 590 ASN C CG 1 ATOM 7650 O OD1 . ASN C 1 282 ? -9.753 0.748 9.528 1.00 22.43 ? 590 ASN C OD1 1 ATOM 7651 N ND2 . ASN C 1 282 ? -11.732 0.366 10.518 1.00 19.61 ? 590 ASN C ND2 1 ATOM 7652 N N . PHE C 1 283 ? -7.198 -1.971 13.109 1.00 15.62 ? 591 PHE C N 1 ATOM 7653 C CA . PHE C 1 283 ? -6.484 -2.241 14.345 1.00 15.44 ? 591 PHE C CA 1 ATOM 7654 C C . PHE C 1 283 ? -5.107 -1.595 14.305 1.00 16.49 ? 591 PHE C C 1 ATOM 7655 O O . PHE C 1 283 ? -4.681 -0.947 15.261 1.00 16.83 ? 591 PHE C O 1 ATOM 7656 C CB . PHE C 1 283 ? -6.364 -3.749 14.577 1.00 15.48 ? 591 PHE C CB 1 ATOM 7657 C CG . PHE C 1 283 ? -7.683 -4.470 14.532 1.00 15.63 ? 591 PHE C CG 1 ATOM 7658 C CD1 . PHE C 1 283 ? -8.618 -4.292 15.536 1.00 13.97 ? 591 PHE C CD1 1 ATOM 7659 C CD2 . PHE C 1 283 ? -7.991 -5.312 13.473 1.00 15.88 ? 591 PHE C CD2 1 ATOM 7660 C CE1 . PHE C 1 283 ? -9.835 -4.949 15.491 1.00 14.62 ? 591 PHE C CE1 1 ATOM 7661 C CE2 . PHE C 1 283 ? -9.198 -5.968 13.419 1.00 17.20 ? 591 PHE C CE2 1 ATOM 7662 C CZ . PHE C 1 283 ? -10.129 -5.788 14.426 1.00 15.98 ? 591 PHE C CZ 1 ATOM 7663 N N . ARG C 1 284 ? -4.420 -1.768 13.182 1.00 14.41 ? 592 ARG C N 1 ATOM 7664 C CA . ARG C 1 284 ? -3.121 -1.142 12.978 1.00 17.51 ? 592 ARG C CA 1 ATOM 7665 C C . ARG C 1 284 ? -3.278 0.378 12.948 1.00 16.34 ? 592 ARG C C 1 ATOM 7666 O O . ARG C 1 284 ? -2.503 1.100 13.569 1.00 18.73 ? 592 ARG C O 1 ATOM 7667 C CB . ARG C 1 284 ? -2.498 -1.661 11.674 1.00 19.35 ? 592 ARG C CB 1 ATOM 7668 C CG . ARG C 1 284 ? -1.150 -1.043 11.294 1.00 20.55 ? 592 ARG C CG 1 ATOM 7669 C CD . ARG C 1 284 ? -0.036 -1.481 12.234 1.00 20.05 ? 592 ARG C CD 1 ATOM 7670 N NE . ARG C 1 284 ? 1.286 -1.247 11.648 1.00 20.19 ? 592 ARG C NE 1 ATOM 7671 C CZ . ARG C 1 284 ? 2.244 -2.167 11.587 1.00 20.33 ? 592 ARG C CZ 1 ATOM 7672 N NH1 . ARG C 1 284 ? 2.034 -3.381 12.088 1.00 16.47 ? 592 ARG C NH1 1 ATOM 7673 N NH2 . ARG C 1 284 ? 3.416 -1.873 11.038 1.00 22.22 ? 592 ARG C NH2 1 ATOM 7674 N N . VAL C 1 285 ? -4.295 0.855 12.237 1.00 17.19 ? 593 VAL C N 1 ATOM 7675 C CA . VAL C 1 285 ? -4.552 2.291 12.137 1.00 16.46 ? 593 VAL C CA 1 ATOM 7676 C C . VAL C 1 285 ? -4.660 2.929 13.522 1.00 14.47 ? 593 VAL C C 1 ATOM 7677 O O . VAL C 1 285 ? -4.042 3.962 13.796 1.00 16.13 ? 593 VAL C O 1 ATOM 7678 C CB . VAL C 1 285 ? -5.848 2.590 11.345 1.00 21.32 ? 593 VAL C CB 1 ATOM 7679 C CG1 . VAL C 1 285 ? -6.190 4.072 11.424 1.00 21.07 ? 593 VAL C CG1 1 ATOM 7680 C CG2 . VAL C 1 285 ? -5.705 2.147 9.894 1.00 22.64 ? 593 VAL C CG2 1 ATOM 7681 N N . LYS C 1 286 ? -5.430 2.297 14.401 1.00 16.36 ? 594 LYS C N 1 ATOM 7682 C CA . LYS C 1 286 ? -5.702 2.859 15.717 1.00 17.40 ? 594 LYS C CA 1 ATOM 7683 C C . LYS C 1 286 ? -4.437 2.978 16.563 1.00 18.25 ? 594 LYS C C 1 ATOM 7684 O O . LYS C 1 286 ? -4.201 4.001 17.198 1.00 17.11 ? 594 LYS C O 1 ATOM 7685 C CB . LYS C 1 286 ? -6.719 1.998 16.466 1.00 16.60 ? 594 LYS C CB 1 ATOM 7686 C CG . LYS C 1 286 ? -7.090 2.556 17.828 1.00 18.14 ? 594 LYS C CG 1 ATOM 7687 C CD . LYS C 1 286 ? -8.058 1.638 18.565 1.00 19.04 ? 594 LYS C CD 1 ATOM 7688 C CE . LYS C 1 286 ? -8.517 2.284 19.868 1.00 21.08 ? 594 LYS C CE 1 ATOM 7689 N NZ . LYS C 1 286 ? -9.306 3.524 19.595 1.00 23.74 ? 594 LYS C NZ 1 ATOM 7690 N N . VAL C 1 287 ? -3.639 1.918 16.592 1.00 16.52 ? 595 VAL C N 1 ATOM 7691 C CA . VAL C 1 287 ? -2.423 1.936 17.393 1.00 16.11 ? 595 VAL C CA 1 ATOM 7692 C C . VAL C 1 287 ? -1.418 2.962 16.845 1.00 18.06 ? 595 VAL C C 1 ATOM 7693 O O . VAL C 1 287 ? -0.793 3.705 17.606 1.00 19.52 ? 595 VAL C O 1 ATOM 7694 C CB . VAL C 1 287 ? -1.801 0.529 17.519 1.00 21.46 ? 595 VAL C CB 1 ATOM 7695 C CG1 . VAL C 1 287 ? -0.502 0.595 18.300 1.00 23.81 ? 595 VAL C CG1 1 ATOM 7696 C CG2 . VAL C 1 287 ? -2.781 -0.417 18.215 1.00 22.99 ? 595 VAL C CG2 1 ATOM 7697 N N . MET C 1 288 ? -1.288 3.031 15.526 1.00 18.99 ? 596 MET C N 1 ATOM 7698 C CA . MET C 1 288 ? -0.393 4.017 14.923 1.00 19.01 ? 596 MET C CA 1 ATOM 7699 C C . MET C 1 288 ? -0.861 5.444 15.210 1.00 20.29 ? 596 MET C C 1 ATOM 7700 O O . MET C 1 288 ? -0.045 6.352 15.379 1.00 21.58 ? 596 MET C O 1 ATOM 7701 C CB . MET C 1 288 ? -0.266 3.787 13.419 1.00 18.20 ? 596 MET C CB 1 ATOM 7702 C CG . MET C 1 288 ? 0.351 2.442 13.067 1.00 20.07 ? 596 MET C CG 1 ATOM 7703 S SD . MET C 1 288 ? 0.529 2.218 11.290 1.00 27.25 ? 596 MET C SD 1 ATOM 7704 C CE . MET C 1 288 ? 1.445 3.695 10.862 1.00 44.26 ? 596 MET C CE 1 ATOM 7705 N N . ALA C 1 289 ? -2.175 5.635 15.277 1.00 19.33 ? 597 ALA C N 1 ATOM 7706 C CA . ALA C 1 289 ? -2.732 6.968 15.492 1.00 19.44 ? 597 ALA C CA 1 ATOM 7707 C C . ALA C 1 289 ? -2.676 7.421 16.948 1.00 18.05 ? 597 ALA C C 1 ATOM 7708 O O . ALA C 1 289 ? -2.632 8.617 17.220 1.00 21.34 ? 597 ALA C O 1 ATOM 7709 C CB . ALA C 1 289 ? -4.168 7.047 14.969 1.00 20.31 ? 597 ALA C CB 1 ATOM 7710 N N . GLU C 1 290 ? -2.675 6.476 17.882 1.00 16.90 ? 598 GLU C N 1 ATOM 7711 C CA . GLU C 1 290 ? -2.849 6.833 19.291 1.00 18.02 ? 598 GLU C CA 1 ATOM 7712 C C . GLU C 1 290 ? -1.581 6.695 20.144 1.00 19.90 ? 598 GLU C C 1 ATOM 7713 O O . GLU C 1 290 ? -1.467 7.316 21.200 1.00 19.79 ? 598 GLU C O 1 ATOM 7714 C CB . GLU C 1 290 ? -4.015 6.048 19.892 1.00 17.94 ? 598 GLU C CB 1 ATOM 7715 C CG . GLU C 1 290 ? -5.331 6.312 19.170 1.00 19.97 ? 598 GLU C CG 1 ATOM 7716 C CD . GLU C 1 290 ? -6.526 5.683 19.862 1.00 21.51 ? 598 GLU C CD 1 ATOM 7717 O OE1 . GLU C 1 290 ? -6.331 4.973 20.871 1.00 20.70 ? 598 GLU C OE1 1 ATOM 7718 O OE2 . GLU C 1 290 ? -7.664 5.903 19.396 1.00 21.25 ? 598 GLU C OE2 1 ATOM 7719 N N . ALA C 1 291 ? -0.629 5.888 19.691 1.00 18.61 ? 599 ALA C N 1 ATOM 7720 C CA . ALA C 1 291 ? 0.669 5.839 20.354 1.00 19.72 ? 599 ALA C CA 1 ATOM 7721 C C . ALA C 1 291 ? 1.369 7.177 20.137 1.00 23.37 ? 599 ALA C C 1 ATOM 7722 O O . ALA C 1 291 ? 1.130 7.852 19.131 1.00 23.03 ? 599 ALA C O 1 ATOM 7723 C CB . ALA C 1 291 ? 1.506 4.705 19.794 1.00 20.44 ? 599 ALA C CB 1 ATOM 7724 N N . ASN C 1 292 ? 2.213 7.583 21.081 1.00 24.81 ? 600 ASN C N 1 ATOM 7725 C CA . ASN C 1 292 ? 2.982 8.811 20.887 1.00 24.63 ? 600 ASN C CA 1 ATOM 7726 C C . ASN C 1 292 ? 3.983 8.620 19.762 1.00 24.85 ? 600 ASN C C 1 ATOM 7727 O O . ASN C 1 292 ? 4.268 9.547 19.002 1.00 24.30 ? 600 ASN C O 1 ATOM 7728 C CB . ASN C 1 292 ? 3.689 9.238 22.177 1.00 25.78 ? 600 ASN C CB 1 ATOM 7729 C CG . ASN C 1 292 ? 2.718 9.466 23.324 1.00 28.42 ? 600 ASN C CG 1 ATOM 7730 O OD1 . ASN C 1 292 ? 2.776 8.785 24.343 1.00 25.00 ? 600 ASN C OD1 1 ATOM 7731 N ND2 . ASN C 1 292 ? 1.811 10.425 23.156 1.00 31.83 ? 600 ASN C ND2 1 ATOM 7732 N N . HIS C 1 293 ? 4.518 7.406 19.660 1.00 22.06 ? 601 HIS C N 1 ATOM 7733 C CA . HIS C 1 293 ? 5.444 7.073 18.584 1.00 24.67 ? 601 HIS C CA 1 ATOM 7734 C C . HIS C 1 293 ? 5.166 5.666 18.086 1.00 23.95 ? 601 HIS C C 1 ATOM 7735 O O . HIS C 1 293 ? 4.909 4.759 18.877 1.00 21.98 ? 601 HIS C O 1 ATOM 7736 C CB . HIS C 1 293 ? 6.897 7.173 19.062 1.00 25.34 ? 601 HIS C CB 1 ATOM 7737 C CG . HIS C 1 293 ? 7.225 8.479 19.714 1.00 27.45 ? 601 HIS C CG 1 ATOM 7738 N ND1 . HIS C 1 293 ? 7.488 9.625 18.994 1.00 28.97 ? 601 HIS C ND1 1 ATOM 7739 C CD2 . HIS C 1 293 ? 7.316 8.824 21.019 1.00 28.27 ? 601 HIS C CD2 1 ATOM 7740 C CE1 . HIS C 1 293 ? 7.733 10.618 19.829 1.00 29.97 ? 601 HIS C CE1 1 ATOM 7741 N NE2 . HIS C 1 293 ? 7.636 10.158 21.064 1.00 29.75 ? 601 HIS C NE2 1 ATOM 7742 N N . PHE C 1 294 ? 5.215 5.489 16.773 1.00 23.33 ? 602 PHE C N 1 ATOM 7743 C CA . PHE C 1 294 ? 5.066 4.163 16.188 1.00 22.93 ? 602 PHE C CA 1 ATOM 7744 C C . PHE C 1 294 ? 6.248 3.871 15.269 1.00 21.68 ? 602 PHE C C 1 ATOM 7745 O O . PHE C 1 294 ? 6.525 4.626 14.331 1.00 23.22 ? 602 PHE C O 1 ATOM 7746 C CB . PHE C 1 294 ? 3.750 4.055 15.423 1.00 23.82 ? 602 PHE C CB 1 ATOM 7747 C CG . PHE C 1 294 ? 3.355 2.644 15.104 1.00 21.86 ? 602 PHE C CG 1 ATOM 7748 C CD1 . PHE C 1 294 ? 2.480 1.959 15.925 1.00 22.70 ? 602 PHE C CD1 1 ATOM 7749 C CD2 . PHE C 1 294 ? 3.867 1.999 13.988 1.00 26.80 ? 602 PHE C CD2 1 ATOM 7750 C CE1 . PHE C 1 294 ? 2.115 0.656 15.641 1.00 22.10 ? 602 PHE C CE1 1 ATOM 7751 C CE2 . PHE C 1 294 ? 3.505 0.696 13.699 1.00 24.68 ? 602 PHE C CE2 1 ATOM 7752 C CZ . PHE C 1 294 ? 2.627 0.027 14.527 1.00 24.24 ? 602 PHE C CZ 1 ATOM 7753 N N . ILE C 1 295 ? 6.944 2.773 15.546 1.00 18.25 ? 603 ILE C N 1 ATOM 7754 C CA . ILE C 1 295 ? 8.163 2.429 14.821 1.00 22.21 ? 603 ILE C CA 1 ATOM 7755 C C . ILE C 1 295 ? 8.001 1.074 14.152 1.00 24.06 ? 603 ILE C C 1 ATOM 7756 O O . ILE C 1 295 ? 7.741 0.074 14.820 1.00 22.63 ? 603 ILE C O 1 ATOM 7757 C CB . ILE C 1 295 ? 9.392 2.364 15.757 1.00 24.56 ? 603 ILE C CB 1 ATOM 7758 C CG1 . ILE C 1 295 ? 9.574 3.680 16.525 1.00 25.75 ? 603 ILE C CG1 1 ATOM 7759 C CG2 . ILE C 1 295 ? 10.656 2.037 14.960 1.00 25.08 ? 603 ILE C CG2 1 ATOM 7760 C CD1 . ILE C 1 295 ? 8.844 3.718 17.863 1.00 27.08 ? 603 ILE C CD1 1 ATOM 7761 N N . ASP C 1 296 ? 8.151 1.039 12.834 1.00 27.32 ? 604 ASP C N 1 ATOM 7762 C CA . ASP C 1 296 ? 8.022 -0.212 12.098 1.00 29.04 ? 604 ASP C CA 1 ATOM 7763 C C . ASP C 1 296 ? 9.373 -0.924 12.037 1.00 27.19 ? 604 ASP C C 1 ATOM 7764 O O . ASP C 1 296 ? 10.221 -0.606 11.196 1.00 27.75 ? 604 ASP C O 1 ATOM 7765 C CB . ASP C 1 296 ? 7.459 0.053 10.699 1.00 30.99 ? 604 ASP C CB 1 ATOM 7766 C CG . ASP C 1 296 ? 7.171 -1.224 9.926 1.00 34.53 ? 604 ASP C CG 1 ATOM 7767 O OD1 . ASP C 1 296 ? 7.333 -2.327 10.494 1.00 33.28 ? 604 ASP C OD1 1 ATOM 7768 O OD2 . ASP C 1 296 ? 6.771 -1.119 8.745 1.00 33.50 ? 604 ASP C OD2 1 ATOM 7769 N N . LEU C 1 297 ? 9.577 -1.882 12.939 1.00 24.64 ? 605 LEU C N 1 ATOM 7770 C CA . LEU C 1 297 ? 10.841 -2.619 12.985 1.00 23.95 ? 605 LEU C CA 1 ATOM 7771 C C . LEU C 1 297 ? 10.896 -3.722 11.926 1.00 24.78 ? 605 LEU C C 1 ATOM 7772 O O . LEU C 1 297 ? 11.953 -4.327 11.697 1.00 26.58 ? 605 LEU C O 1 ATOM 7773 C CB . LEU C 1 297 ? 11.093 -3.203 14.379 1.00 23.40 ? 605 LEU C CB 1 ATOM 7774 C CG . LEU C 1 297 ? 11.371 -2.215 15.513 1.00 23.81 ? 605 LEU C CG 1 ATOM 7775 C CD1 . LEU C 1 297 ? 11.740 -2.973 16.785 1.00 23.15 ? 605 LEU C CD1 1 ATOM 7776 C CD2 . LEU C 1 297 ? 12.472 -1.245 15.125 1.00 23.95 ? 605 LEU C CD2 1 ATOM 7777 N N . SER C 1 298 ? 9.768 -3.977 11.268 1.00 24.34 ? 606 SER C N 1 ATOM 7778 C CA . SER C 1 298 ? 9.751 -4.959 10.189 1.00 28.74 ? 606 SER C CA 1 ATOM 7779 C C . SER C 1 298 ? 10.642 -4.488 9.041 1.00 33.52 ? 606 SER C C 1 ATOM 7780 O O . SER C 1 298 ? 11.084 -5.290 8.224 1.00 33.95 ? 606 SER C O 1 ATOM 7781 C CB . SER C 1 298 ? 8.326 -5.240 9.697 1.00 27.61 ? 606 SER C CB 1 ATOM 7782 O OG . SER C 1 298 ? 7.809 -4.166 8.933 1.00 29.67 ? 606 SER C OG 1 ATOM 7783 N N . GLN C 1 299 ? 10.912 -3.185 9.002 1.00 33.40 ? 607 GLN C N 1 ATOM 7784 C CA . GLN C 1 299 ? 11.797 -2.599 7.995 1.00 37.38 ? 607 GLN C CA 1 ATOM 7785 C C . GLN C 1 299 ? 13.260 -2.631 8.429 1.00 36.72 ? 607 GLN C C 1 ATOM 7786 O O . GLN C 1 299 ? 14.144 -2.196 7.689 1.00 35.81 ? 607 GLN C O 1 ATOM 7787 C CB . GLN C 1 299 ? 11.387 -1.153 7.704 1.00 41.17 ? 607 GLN C CB 1 ATOM 7788 C CG . GLN C 1 299 ? 9.920 -0.985 7.367 1.00 42.95 ? 607 GLN C CG 1 ATOM 7789 C CD . GLN C 1 299 ? 9.491 -1.871 6.218 1.00 48.13 ? 607 GLN C CD 1 ATOM 7790 O OE1 . GLN C 1 299 ? 8.586 -2.697 6.359 1.00 51.45 ? 607 GLN C OE1 1 ATOM 7791 N NE2 . GLN C 1 299 ? 10.139 -1.705 5.071 1.00 48.54 ? 607 GLN C NE2 1 ATOM 7792 N N . ILE C 1 300 ? 13.509 -3.129 9.637 1.00 35.08 ? 608 ILE C N 1 ATOM 7793 C CA . ILE C 1 300 ? 14.870 -3.226 10.164 1.00 35.58 ? 608 ILE C CA 1 ATOM 7794 C C . ILE C 1 300 ? 15.168 -4.661 10.604 1.00 35.57 ? 608 ILE C C 1 ATOM 7795 O O . ILE C 1 300 ? 15.055 -4.990 11.783 1.00 35.44 ? 608 ILE C O 1 ATOM 7796 C CB . ILE C 1 300 ? 15.090 -2.250 11.351 1.00 30.08 ? 608 ILE C CB 1 ATOM 7797 C CG1 . ILE C 1 300 ? 14.590 -0.849 10.996 1.00 34.83 ? 608 ILE C CG1 1 ATOM 7798 C CG2 . ILE C 1 300 ? 16.555 -2.207 11.751 1.00 29.26 ? 608 ILE C CG2 1 ATOM 7799 C CD1 . ILE C 1 300 ? 14.719 0.161 12.125 1.00 36.38 ? 608 ILE C CD1 1 ATOM 7800 N N . PRO C 1 301 ? 15.548 -5.522 9.646 1.00 41.89 ? 609 PRO C N 1 ATOM 7801 C CA . PRO C 1 301 ? 15.790 -6.955 9.870 1.00 43.31 ? 609 PRO C CA 1 ATOM 7802 C C . PRO C 1 301 ? 16.911 -7.262 10.867 1.00 41.84 ? 609 PRO C C 1 ATOM 7803 O O . PRO C 1 301 ? 16.831 -8.270 11.573 1.00 40.18 ? 609 PRO C O 1 ATOM 7804 C CB . PRO C 1 301 ? 16.187 -7.464 8.479 1.00 47.30 ? 609 PRO C CB 1 ATOM 7805 C CG . PRO C 1 301 ? 15.608 -6.479 7.532 1.00 48.42 ? 609 PRO C CG 1 ATOM 7806 C CD . PRO C 1 301 ? 15.703 -5.158 8.228 1.00 46.21 ? 609 PRO C CD 1 ATOM 7807 N N . CYS C 1 302 ? 17.944 -6.426 10.915 1.00 40.12 ? 610 CYS C N 1 ATOM 7808 C CA . CYS C 1 302 ? 19.057 -6.664 11.832 1.00 39.16 ? 610 CYS C CA 1 ATOM 7809 C C . CYS C 1 302 ? 18.649 -6.391 13.275 1.00 37.74 ? 610 CYS C C 1 ATOM 7810 O O . CYS C 1 302 ? 18.230 -5.283 13.608 1.00 37.58 ? 610 CYS C O 1 ATOM 7811 C CB . CYS C 1 302 ? 20.265 -5.801 11.465 1.00 39.78 ? 610 CYS C CB 1 ATOM 7812 S SG . CYS C 1 302 ? 21.668 -6.023 12.585 1.00 47.69 ? 610 CYS C SG 1 ATOM 7813 N N . ASN C 1 303 ? 18.774 -7.401 14.132 1.00 35.75 ? 611 ASN C N 1 ATOM 7814 C CA . ASN C 1 303 ? 18.387 -7.251 15.533 1.00 33.94 ? 611 ASN C CA 1 ATOM 7815 C C . ASN C 1 303 ? 19.260 -6.258 16.298 1.00 33.75 ? 611 ASN C C 1 ATOM 7816 O O . ASN C 1 303 ? 18.805 -5.633 17.254 1.00 32.54 ? 611 ASN C O 1 ATOM 7817 C CB . ASN C 1 303 ? 18.357 -8.607 16.240 1.00 32.66 ? 611 ASN C CB 1 ATOM 7818 C CG . ASN C 1 303 ? 17.180 -9.457 15.809 1.00 33.97 ? 611 ASN C CG 1 ATOM 7819 O OD1 . ASN C 1 303 ? 16.057 -8.963 15.682 1.00 34.50 ? 611 ASN C OD1 1 ATOM 7820 N ND2 . ASN C 1 303 ? 17.429 -10.740 15.573 1.00 32.83 ? 611 ASN C ND2 1 ATOM 7821 N N . GLY C 1 304 ? 20.508 -6.106 15.867 1.00 33.54 ? 612 GLY C N 1 ATOM 7822 C CA . GLY C 1 304 ? 21.402 -5.130 16.464 1.00 33.67 ? 612 GLY C CA 1 ATOM 7823 C C . GLY C 1 304 ? 20.996 -3.702 16.147 1.00 33.44 ? 612 GLY C C 1 ATOM 7824 O O . GLY C 1 304 ? 20.954 -2.843 17.032 1.00 32.08 ? 612 GLY C O 1 ATOM 7825 N N . LYS C 1 305 ? 20.697 -3.441 14.878 1.00 33.17 ? 613 LYS C N 1 ATOM 7826 C CA . LYS C 1 305 ? 20.232 -2.120 14.473 1.00 33.75 ? 613 LYS C CA 1 ATOM 7827 C C . LYS C 1 305 ? 18.865 -1.796 15.076 1.00 30.73 ? 613 LYS C C 1 ATOM 7828 O O . LYS C 1 305 ? 18.604 -0.658 15.461 1.00 31.10 ? 613 LYS C O 1 ATOM 7829 C CB . LYS C 1 305 ? 20.175 -2.004 12.949 1.00 37.62 ? 613 LYS C CB 1 ATOM 7830 C CG . LYS C 1 305 ? 21.523 -2.181 12.259 1.00 44.74 ? 613 LYS C CG 1 ATOM 7831 C CD . LYS C 1 305 ? 21.388 -2.020 10.754 1.00 49.12 ? 613 LYS C CD 1 ATOM 7832 C CE . LYS C 1 305 ? 22.680 -2.376 10.039 1.00 54.21 ? 613 LYS C CE 1 ATOM 7833 N NZ . LYS C 1 305 ? 22.559 -2.175 8.566 1.00 56.66 ? 613 LYS C NZ 1 ATOM 7834 N N . ALA C 1 306 ? 17.990 -2.793 15.150 1.00 30.15 ? 614 ALA C N 1 ATOM 7835 C CA . ALA C 1 306 ? 16.676 -2.584 15.744 1.00 27.66 ? 614 ALA C CA 1 ATOM 7836 C C . ALA C 1 306 ? 16.794 -2.285 17.238 1.00 30.15 ? 614 ALA C C 1 ATOM 7837 O O . ALA C 1 306 ? 16.112 -1.401 17.757 1.00 30.82 ? 614 ALA C O 1 ATOM 7838 C CB . ALA C 1 306 ? 15.765 -3.787 15.493 1.00 25.89 ? 614 ALA C CB 1 ATOM 7839 N N . ALA C 1 307 ? 17.671 -3.012 17.924 1.00 31.50 ? 615 ALA C N 1 ATOM 7840 C CA . ALA C 1 307 ? 17.910 -2.773 19.344 1.00 30.76 ? 615 ALA C CA 1 ATOM 7841 C C . ALA C 1 307 ? 18.511 -1.389 19.584 1.00 31.27 ? 615 ALA C C 1 ATOM 7842 O O . ALA C 1 307 ? 18.180 -0.725 20.568 1.00 32.10 ? 615 ALA C O 1 ATOM 7843 C CB . ALA C 1 307 ? 18.807 -3.843 19.923 1.00 30.80 ? 615 ALA C CB 1 ATOM 7844 N N . ASP C 1 308 ? 19.396 -0.956 18.688 1.00 32.86 ? 616 ASP C N 1 ATOM 7845 C CA . ASP C 1 308 ? 19.980 0.377 18.798 1.00 31.94 ? 616 ASP C CA 1 ATOM 7846 C C . ASP C 1 308 ? 18.883 1.423 18.709 1.00 29.93 ? 616 ASP C C 1 ATOM 7847 O O . ASP C 1 308 ? 18.919 2.437 19.406 1.00 31.83 ? 616 ASP C O 1 ATOM 7848 C CB . ASP C 1 308 ? 21.017 0.627 17.698 1.00 35.17 ? 616 ASP C CB 1 ATOM 7849 C CG . ASP C 1 308 ? 22.305 -0.139 17.921 1.00 38.78 ? 616 ASP C CG 1 ATOM 7850 O OD1 . ASP C 1 308 ? 23.094 -0.260 16.961 1.00 40.03 ? 616 ASP C OD1 1 ATOM 7851 O OD2 . ASP C 1 308 ? 22.530 -0.621 19.051 1.00 40.48 ? 616 ASP C OD2 1 ATOM 7852 N N . ARG C 1 309 ? 17.902 1.161 17.850 1.00 28.19 ? 617 ARG C N 1 ATOM 7853 C CA . ARG C 1 309 ? 16.801 2.091 17.636 1.00 29.68 ? 617 ARG C CA 1 ATOM 7854 C C . ARG C 1 309 ? 15.966 2.247 18.895 1.00 31.17 ? 617 ARG C C 1 ATOM 7855 O O . ARG C 1 309 ? 15.608 3.358 19.284 1.00 31.53 ? 617 ARG C O 1 ATOM 7856 C CB . ARG C 1 309 ? 15.921 1.619 16.480 1.00 30.23 ? 617 ARG C CB 1 ATOM 7857 C CG . ARG C 1 309 ? 14.702 2.480 16.255 1.00 32.68 ? 617 ARG C CG 1 ATOM 7858 C CD . ARG C 1 309 ? 15.094 3.901 15.854 1.00 38.67 ? 617 ARG C CD 1 ATOM 7859 N NE . ARG C 1 309 ? 13.904 4.714 15.627 1.00 42.37 ? 617 ARG C NE 1 ATOM 7860 C CZ . ARG C 1 309 ? 13.214 4.717 14.493 1.00 40.62 ? 617 ARG C CZ 1 ATOM 7861 N NH1 . ARG C 1 309 ? 13.602 3.956 13.477 1.00 38.98 ? 617 ARG C NH1 1 ATOM 7862 N NH2 . ARG C 1 309 ? 12.139 5.483 14.375 1.00 40.43 ? 617 ARG C NH2 1 ATOM 7863 N N . ILE C 1 310 ? 15.654 1.123 19.528 1.00 29.48 ? 618 ILE C N 1 ATOM 7864 C CA . ILE C 1 310 ? 14.918 1.134 20.783 1.00 27.02 ? 618 ILE C CA 1 ATOM 7865 C C . ILE C 1 310 ? 15.687 1.890 21.860 1.00 27.71 ? 618 ILE C C 1 ATOM 7866 O O . ILE C 1 310 ? 15.122 2.717 22.580 1.00 27.51 ? 618 ILE C O 1 ATOM 7867 C CB . ILE C 1 310 ? 14.632 -0.302 21.263 1.00 25.37 ? 618 ILE C CB 1 ATOM 7868 C CG1 . ILE C 1 310 ? 13.661 -0.987 20.297 1.00 24.09 ? 618 ILE C CG1 1 ATOM 7869 C CG2 . ILE C 1 310 ? 14.077 -0.295 22.676 1.00 25.69 ? 618 ILE C CG2 1 ATOM 7870 C CD1 . ILE C 1 310 ? 13.464 -2.470 20.562 1.00 27.38 ? 618 ILE C CD1 1 ATOM 7871 N N . HIS C 1 311 ? 16.980 1.606 21.963 1.00 28.22 ? 619 HIS C N 1 ATOM 7872 C CA . HIS C 1 311 ? 17.816 2.258 22.962 1.00 30.46 ? 619 HIS C CA 1 ATOM 7873 C C . HIS C 1 311 ? 17.935 3.754 22.696 1.00 32.87 ? 619 HIS C C 1 ATOM 7874 O O . HIS C 1 311 ? 17.977 4.555 23.627 1.00 34.27 ? 619 HIS C O 1 ATOM 7875 C CB . HIS C 1 311 ? 19.207 1.630 22.990 1.00 29.59 ? 619 HIS C CB 1 ATOM 7876 C CG . HIS C 1 311 ? 20.165 2.341 23.892 1.00 31.92 ? 619 HIS C CG 1 ATOM 7877 N ND1 . HIS C 1 311 ? 21.113 3.224 23.422 1.00 31.95 ? 619 HIS C ND1 1 ATOM 7878 C CD2 . HIS C 1 311 ? 20.320 2.301 25.237 1.00 32.43 ? 619 HIS C CD2 1 ATOM 7879 C CE1 . HIS C 1 311 ? 21.814 3.696 24.438 1.00 34.81 ? 619 HIS C CE1 1 ATOM 7880 N NE2 . HIS C 1 311 ? 21.355 3.150 25.550 1.00 35.61 ? 619 HIS C NE2 1 ATOM 7881 N N . GLN C 1 312 ? 17.997 4.119 21.421 1.00 35.74 ? 620 GLN C N 1 ATOM 7882 C CA . GLN C 1 312 ? 18.082 5.521 21.026 1.00 39.90 ? 620 GLN C CA 1 ATOM 7883 C C . GLN C 1 312 ? 16.853 6.297 21.500 1.00 35.50 ? 620 GLN C C 1 ATOM 7884 O O . GLN C 1 312 ? 16.944 7.474 21.847 1.00 32.47 ? 620 GLN C O 1 ATOM 7885 C CB . GLN C 1 312 ? 18.225 5.631 19.509 1.00 45.16 ? 620 GLN C CB 1 ATOM 7886 C CG . GLN C 1 312 ? 18.175 7.046 18.977 1.00 52.24 ? 620 GLN C CG 1 ATOM 7887 C CD . GLN C 1 312 ? 17.765 7.094 17.523 1.00 56.97 ? 620 GLN C CD 1 ATOM 7888 O OE1 . GLN C 1 312 ? 18.579 6.864 16.631 1.00 61.73 ? 620 GLN C OE1 1 ATOM 7889 N NE2 . GLN C 1 312 ? 16.494 7.388 17.275 1.00 54.98 ? 620 GLN C NE2 1 ATOM 7890 N N . ASP C 1 313 ? 15.708 5.624 21.527 1.00 32.77 ? 621 ASP C N 1 ATOM 7891 C CA . ASP C 1 313 ? 14.464 6.252 21.961 1.00 31.41 ? 621 ASP C CA 1 ATOM 7892 C C . ASP C 1 313 ? 14.409 6.444 23.477 1.00 29.61 ? 621 ASP C C 1 ATOM 7893 O O . ASP C 1 313 ? 13.530 7.139 23.990 1.00 30.44 ? 621 ASP C O 1 ATOM 7894 C CB . ASP C 1 313 ? 13.252 5.449 21.476 1.00 30.06 ? 621 ASP C CB 1 ATOM 7895 C CG . ASP C 1 313 ? 12.999 5.619 19.988 1.00 33.96 ? 621 ASP C CG 1 ATOM 7896 O OD1 . ASP C 1 313 ? 13.382 6.673 19.434 1.00 36.24 ? 621 ASP C OD1 1 ATOM 7897 O OD2 . ASP C 1 313 ? 12.419 4.701 19.372 1.00 33.72 ? 621 ASP C OD2 1 ATOM 7898 N N . GLY C 1 314 ? 15.349 5.828 24.187 1.00 28.02 ? 622 GLY C N 1 ATOM 7899 C CA . GLY C 1 314 ? 15.470 6.016 25.621 1.00 25.78 ? 622 GLY C CA 1 ATOM 7900 C C . GLY C 1 314 ? 14.427 5.282 26.445 1.00 23.71 ? 622 GLY C C 1 ATOM 7901 O O . GLY C 1 314 ? 14.033 5.753 27.513 1.00 24.46 ? 622 GLY C O 1 ATOM 7902 N N . ILE C 1 315 ? 13.985 4.129 25.951 1.00 22.51 ? 623 ILE C N 1 ATOM 7903 C CA . ILE C 1 315 ? 12.958 3.324 26.620 1.00 22.17 ? 623 ILE C CA 1 ATOM 7904 C C . ILE C 1 315 ? 13.362 2.921 28.040 1.00 24.88 ? 623 ILE C C 1 ATOM 7905 O O . ILE C 1 315 ? 14.473 2.432 28.256 1.00 24.43 ? 623 ILE C O 1 ATOM 7906 C CB . ILE C 1 315 ? 12.649 2.044 25.816 1.00 22.34 ? 623 ILE C CB 1 ATOM 7907 C CG1 . ILE C 1 315 ? 12.212 2.400 24.396 1.00 24.31 ? 623 ILE C CG1 1 ATOM 7908 C CG2 . ILE C 1 315 ? 11.571 1.202 26.514 1.00 20.48 ? 623 ILE C CG2 1 ATOM 7909 C CD1 . ILE C 1 315 ? 11.064 3.395 24.338 1.00 24.56 ? 623 ILE C CD1 1 ATOM 7910 N N . HIS C 1 316 ? 12.462 3.130 29.001 1.00 23.08 ? 624 HIS C N 1 ATOM 7911 C CA . HIS C 1 316 ? 12.702 2.720 30.385 1.00 24.19 ? 624 HIS C CA 1 ATOM 7912 C C . HIS C 1 316 ? 12.181 1.304 30.616 1.00 25.43 ? 624 HIS C C 1 ATOM 7913 O O . HIS C 1 316 ? 12.843 0.477 31.246 1.00 25.54 ? 624 HIS C O 1 ATOM 7914 C CB . HIS C 1 316 ? 12.018 3.672 31.370 1.00 22.29 ? 624 HIS C CB 1 ATOM 7915 C CG . HIS C 1 316 ? 12.534 5.078 31.321 1.00 23.53 ? 624 HIS C CG 1 ATOM 7916 N ND1 . HIS C 1 316 ? 11.873 6.091 30.661 1.00 23.78 ? 624 HIS C ND1 1 ATOM 7917 C CD2 . HIS C 1 316 ? 13.642 5.640 31.858 1.00 26.67 ? 624 HIS C CD2 1 ATOM 7918 C CE1 . HIS C 1 316 ? 12.553 7.216 30.788 1.00 24.95 ? 624 HIS C CE1 1 ATOM 7919 N NE2 . HIS C 1 316 ? 13.632 6.970 31.510 1.00 25.57 ? 624 HIS C NE2 1 ATOM 7920 N N . ILE C 1 317 ? 10.978 1.035 30.119 1.00 23.98 ? 625 ILE C N 1 ATOM 7921 C CA . ILE C 1 317 ? 10.391 -0.297 30.246 1.00 25.16 ? 625 ILE C CA 1 ATOM 7922 C C . ILE C 1 317 ? 10.008 -0.838 28.874 1.00 23.45 ? 625 ILE C C 1 ATOM 7923 O O . ILE C 1 317 ? 9.193 -0.245 28.169 1.00 20.63 ? 625 ILE C O 1 ATOM 7924 C CB . ILE C 1 317 ? 9.138 -0.288 31.145 1.00 25.62 ? 625 ILE C CB 1 ATOM 7925 C CG1 . ILE C 1 317 ? 9.490 0.201 32.551 1.00 26.12 ? 625 ILE C CG1 1 ATOM 7926 C CG2 . ILE C 1 317 ? 8.508 -1.683 31.203 1.00 23.52 ? 625 ILE C CG2 1 ATOM 7927 C CD1 . ILE C 1 317 ? 8.302 0.235 33.488 1.00 27.18 ? 625 ILE C CD1 1 ATOM 7928 N N . LEU C 1 318 ? 10.605 -1.961 28.496 1.00 20.77 ? 626 LEU C N 1 ATOM 7929 C CA . LEU C 1 318 ? 10.317 -2.566 27.203 1.00 20.70 ? 626 LEU C CA 1 ATOM 7930 C C . LEU C 1 318 ? 9.456 -3.804 27.399 1.00 20.90 ? 626 LEU C C 1 ATOM 7931 O O . LEU C 1 318 ? 9.816 -4.707 28.149 1.00 21.90 ? 626 LEU C O 1 ATOM 7932 C CB . LEU C 1 318 ? 11.609 -2.937 26.476 1.00 20.57 ? 626 LEU C CB 1 ATOM 7933 C CG . LEU C 1 318 ? 11.474 -3.253 24.985 1.00 20.71 ? 626 LEU C CG 1 ATOM 7934 C CD1 . LEU C 1 318 ? 11.087 -2.003 24.206 1.00 18.76 ? 626 LEU C CD1 1 ATOM 7935 C CD2 . LEU C 1 318 ? 12.776 -3.821 24.455 1.00 22.26 ? 626 LEU C CD2 1 ATOM 7936 N N . VAL C 1 319 ? 8.326 -3.846 26.706 1.00 18.69 ? 627 VAL C N 1 ATOM 7937 C CA . VAL C 1 319 ? 7.319 -4.863 26.967 1.00 20.28 ? 627 VAL C CA 1 ATOM 7938 C C . VAL C 1 319 ? 7.251 -5.915 25.864 1.00 21.17 ? 627 VAL C C 1 ATOM 7939 O O . VAL C 1 319 ? 6.947 -5.611 24.707 1.00 20.00 ? 627 VAL C O 1 ATOM 7940 C CB . VAL C 1 319 ? 5.938 -4.223 27.173 1.00 20.73 ? 627 VAL C CB 1 ATOM 7941 C CG1 . VAL C 1 319 ? 4.897 -5.287 27.489 1.00 15.96 ? 627 VAL C CG1 1 ATOM 7942 C CG2 . VAL C 1 319 ? 6.009 -3.202 28.300 1.00 21.08 ? 627 VAL C CG2 1 ATOM 7943 N N . ASN C 1 320 ? 7.552 -7.153 26.241 1.00 20.90 ? 628 ASN C N 1 ATOM 7944 C CA . ASN C 1 320 ? 7.517 -8.277 25.319 1.00 20.87 ? 628 ASN C CA 1 ATOM 7945 C C . ASN C 1 320 ? 6.109 -8.854 25.206 1.00 19.39 ? 628 ASN C C 1 ATOM 7946 O O . ASN C 1 320 ? 5.633 -9.542 26.111 1.00 18.10 ? 628 ASN C O 1 ATOM 7947 C CB . ASN C 1 320 ? 8.516 -9.353 25.766 1.00 22.24 ? 628 ASN C CB 1 ATOM 7948 C CG . ASN C 1 320 ? 8.701 -10.448 24.733 1.00 22.52 ? 628 ASN C CG 1 ATOM 7949 O OD1 . ASN C 1 320 ? 7.851 -10.656 23.866 1.00 21.94 ? 628 ASN C OD1 1 ATOM 7950 N ND2 . ASN C 1 320 ? 9.823 -11.154 24.818 1.00 22.01 ? 628 ASN C ND2 1 ATOM 7951 N N . MET C 1 321 ? 5.452 -8.577 24.084 1.00 18.50 ? 629 MET C N 1 ATOM 7952 C CA . MET C 1 321 ? 4.085 -9.046 23.874 1.00 17.96 ? 629 MET C CA 1 ATOM 7953 C C . MET C 1 321 ? 3.997 -10.338 23.059 1.00 18.18 ? 629 MET C C 1 ATOM 7954 O O . MET C 1 321 ? 2.899 -10.811 22.776 1.00 20.57 ? 629 MET C O 1 ATOM 7955 C CB . MET C 1 321 ? 3.244 -7.952 23.210 1.00 16.08 ? 629 MET C CB 1 ATOM 7956 C CG . MET C 1 321 ? 3.168 -6.669 24.019 1.00 16.59 ? 629 MET C CG 1 ATOM 7957 S SD . MET C 1 321 ? 2.371 -5.317 23.122 1.00 20.22 ? 629 MET C SD 1 ATOM 7958 C CE . MET C 1 321 ? 0.742 -6.006 22.848 1.00 23.45 ? 629 MET C CE 1 ATOM 7959 N N . ASN C 1 322 ? 5.140 -10.909 22.687 1.00 16.67 ? 630 ASN C N 1 ATOM 7960 C CA . ASN C 1 322 ? 5.141 -12.152 21.907 1.00 18.22 ? 630 ASN C CA 1 ATOM 7961 C C . ASN C 1 322 ? 5.571 -13.418 22.641 1.00 19.49 ? 630 ASN C C 1 ATOM 7962 O O . ASN C 1 322 ? 4.950 -14.471 22.487 1.00 18.51 ? 630 ASN C O 1 ATOM 7963 C CB . ASN C 1 322 ? 5.997 -12.009 20.646 1.00 18.96 ? 630 ASN C CB 1 ATOM 7964 C CG . ASN C 1 322 ? 5.236 -11.389 19.499 1.00 23.59 ? 630 ASN C CG 1 ATOM 7965 O OD1 . ASN C 1 322 ? 5.408 -10.215 19.196 1.00 22.94 ? 630 ASN C OD1 1 ATOM 7966 N ND2 . ASN C 1 322 ? 4.369 -12.173 18.868 1.00 27.71 ? 630 ASN C ND2 1 ATOM 7967 N N . GLY C 1 323 ? 6.651 -13.333 23.411 1.00 20.03 ? 631 GLY C N 1 ATOM 7968 C CA . GLY C 1 323 ? 7.260 -14.542 23.940 1.00 20.61 ? 631 GLY C CA 1 ATOM 7969 C C . GLY C 1 323 ? 7.571 -15.473 22.780 1.00 22.49 ? 631 GLY C C 1 ATOM 7970 O O . GLY C 1 323 ? 8.044 -15.031 21.736 1.00 22.76 ? 631 GLY C O 1 ATOM 7971 N N . TYR C 1 324 ? 7.281 -16.760 22.933 1.00 18.60 ? 632 TYR C N 1 ATOM 7972 C CA . TYR C 1 324 ? 7.611 -17.702 21.866 1.00 18.44 ? 632 TYR C CA 1 ATOM 7973 C C . TYR C 1 324 ? 6.429 -17.941 20.932 1.00 19.70 ? 632 TYR C C 1 ATOM 7974 O O . TYR C 1 324 ? 5.926 -19.056 20.821 1.00 21.93 ? 632 TYR C O 1 ATOM 7975 C CB . TYR C 1 324 ? 8.171 -18.999 22.451 1.00 21.64 ? 632 TYR C CB 1 ATOM 7976 C CG . TYR C 1 324 ? 9.354 -18.717 23.347 1.00 24.58 ? 632 TYR C CG 1 ATOM 7977 C CD1 . TYR C 1 324 ? 10.479 -18.076 22.848 1.00 24.23 ? 632 TYR C CD1 1 ATOM 7978 C CD2 . TYR C 1 324 ? 9.336 -19.058 24.694 1.00 24.80 ? 632 TYR C CD2 1 ATOM 7979 C CE1 . TYR C 1 324 ? 11.557 -17.796 23.655 1.00 24.81 ? 632 TYR C CE1 1 ATOM 7980 C CE2 . TYR C 1 324 ? 10.420 -18.779 25.514 1.00 24.59 ? 632 TYR C CE2 1 ATOM 7981 C CZ . TYR C 1 324 ? 11.525 -18.147 24.985 1.00 24.34 ? 632 TYR C CZ 1 ATOM 7982 O OH . TYR C 1 324 ? 12.607 -17.860 25.781 1.00 23.49 ? 632 TYR C OH 1 ATOM 7983 N N . THR C 1 325 ? 5.996 -16.868 20.273 1.00 20.66 ? 633 THR C N 1 ATOM 7984 C CA . THR C 1 325 ? 4.896 -16.913 19.316 1.00 19.08 ? 633 THR C CA 1 ATOM 7985 C C . THR C 1 325 ? 5.338 -16.341 17.969 1.00 21.46 ? 633 THR C C 1 ATOM 7986 O O . THR C 1 325 ? 6.362 -15.656 17.876 1.00 21.88 ? 633 THR C O 1 ATOM 7987 C CB . THR C 1 325 ? 3.672 -16.107 19.805 1.00 24.66 ? 633 THR C CB 1 ATOM 7988 O OG1 . THR C 1 325 ? 4.074 -14.767 20.105 1.00 25.97 ? 633 THR C OG1 1 ATOM 7989 C CG2 . THR C 1 325 ? 3.054 -16.748 21.046 1.00 26.19 ? 633 THR C CG2 1 ATOM 7990 N N . LYS C 1 326 ? 4.551 -16.625 16.936 1.00 22.47 ? 634 LYS C N 1 ATOM 7991 C CA . LYS C 1 326 ? 4.880 -16.275 15.559 1.00 23.29 ? 634 LYS C CA 1 ATOM 7992 C C . LYS C 1 326 ? 5.237 -14.795 15.392 1.00 21.72 ? 634 LYS C C 1 ATOM 7993 O O . LYS C 1 326 ? 4.517 -13.911 15.857 1.00 17.84 ? 634 LYS C O 1 ATOM 7994 C CB . LYS C 1 326 ? 3.707 -16.651 14.646 1.00 27.80 ? 634 LYS C CB 1 ATOM 7995 C CG . LYS C 1 326 ? 3.968 -16.493 13.157 1.00 32.55 ? 634 LYS C CG 1 ATOM 7996 C CD . LYS C 1 326 ? 2.668 -16.663 12.376 1.00 37.50 ? 634 LYS C CD 1 ATOM 7997 C CE . LYS C 1 326 ? 2.853 -16.353 10.900 1.00 41.10 ? 634 LYS C CE 1 ATOM 7998 N NZ . LYS C 1 326 ? 3.707 -17.373 10.244 1.00 44.62 ? 634 LYS C NZ 1 ATOM 7999 N N . GLY C 1 327 ? 6.363 -14.531 14.736 1.00 24.13 ? 635 GLY C N 1 ATOM 8000 C CA . GLY C 1 327 ? 6.786 -13.165 14.480 1.00 25.70 ? 635 GLY C CA 1 ATOM 8001 C C . GLY C 1 327 ? 7.686 -12.575 15.557 1.00 25.76 ? 635 GLY C C 1 ATOM 8002 O O . GLY C 1 327 ? 8.203 -11.468 15.399 1.00 23.91 ? 635 GLY C O 1 ATOM 8003 N N . ALA C 1 328 ? 7.870 -13.307 16.651 1.00 22.39 ? 636 ALA C N 1 ATOM 8004 C CA . ALA C 1 328 ? 8.729 -12.850 17.743 1.00 22.41 ? 636 ALA C CA 1 ATOM 8005 C C . ALA C 1 328 ? 10.148 -12.528 17.295 1.00 21.83 ? 636 ALA C C 1 ATOM 8006 O O . ALA C 1 328 ? 10.709 -13.189 16.416 1.00 21.12 ? 636 ALA C O 1 ATOM 8007 C CB . ALA C 1 328 ? 8.782 -13.886 18.851 1.00 21.35 ? 636 ALA C CB 1 ATOM 8008 N N . ARG C 1 329 ? 10.726 -11.513 17.924 1.00 20.53 ? 637 ARG C N 1 ATOM 8009 C CA . ARG C 1 329 ? 12.143 -11.227 17.775 1.00 21.68 ? 637 ARG C CA 1 ATOM 8010 C C . ARG C 1 329 ? 12.737 -11.016 19.158 1.00 22.49 ? 637 ARG C C 1 ATOM 8011 O O . ARG C 1 329 ? 13.108 -9.910 19.528 1.00 23.70 ? 637 ARG C O 1 ATOM 8012 C CB . ARG C 1 329 ? 12.364 -9.999 16.894 1.00 23.16 ? 637 ARG C CB 1 ATOM 8013 C CG . ARG C 1 329 ? 12.068 -10.252 15.427 1.00 24.70 ? 637 ARG C CG 1 ATOM 8014 C CD . ARG C 1 329 ? 12.050 -8.957 14.640 1.00 24.25 ? 637 ARG C CD 1 ATOM 8015 N NE . ARG C 1 329 ? 13.375 -8.345 14.559 1.00 24.43 ? 637 ARG C NE 1 ATOM 8016 C CZ . ARG C 1 329 ? 13.652 -7.279 13.816 1.00 25.23 ? 637 ARG C CZ 1 ATOM 8017 N NH1 . ARG C 1 329 ? 12.701 -6.718 13.086 1.00 24.93 ? 637 ARG C NH1 1 ATOM 8018 N NH2 . ARG C 1 329 ? 14.878 -6.776 13.795 1.00 28.13 ? 637 ARG C NH2 1 ATOM 8019 N N . ASN C 1 330 ? 12.817 -12.099 19.923 1.00 23.35 ? 638 ASN C N 1 ATOM 8020 C CA . ASN C 1 330 ? 13.269 -12.020 21.302 1.00 24.60 ? 638 ASN C CA 1 ATOM 8021 C C . ASN C 1 330 ? 14.751 -11.679 21.434 1.00 25.14 ? 638 ASN C C 1 ATOM 8022 O O . ASN C 1 330 ? 15.212 -11.308 22.512 1.00 26.21 ? 638 ASN C O 1 ATOM 8023 C CB . ASN C 1 330 ? 12.898 -13.303 22.044 1.00 25.65 ? 638 ASN C CB 1 ATOM 8024 C CG . ASN C 1 330 ? 11.395 -13.493 22.130 1.00 24.29 ? 638 ASN C CG 1 ATOM 8025 O OD1 . ASN C 1 330 ? 10.663 -12.566 22.482 1.00 23.05 ? 638 ASN C OD1 1 ATOM 8026 N ND2 . ASN C 1 330 ? 10.923 -14.680 21.776 1.00 24.56 ? 638 ASN C ND2 1 ATOM 8027 N N . GLU C 1 331 ? 15.478 -11.790 20.324 1.00 26.02 ? 639 GLU C N 1 ATOM 8028 C CA . GLU C 1 331 ? 16.848 -11.303 20.230 1.00 29.54 ? 639 GLU C CA 1 ATOM 8029 C C . GLU C 1 331 ? 16.948 -9.828 20.630 1.00 28.01 ? 639 GLU C C 1 ATOM 8030 O O . GLU C 1 331 ? 17.967 -9.397 21.171 1.00 29.72 ? 639 GLU C O 1 ATOM 8031 C CB . GLU C 1 331 ? 17.383 -11.490 18.809 1.00 34.72 ? 639 GLU C CB 1 ATOM 8032 C CG . GLU C 1 331 ? 17.673 -12.935 18.417 1.00 36.08 ? 639 GLU C CG 1 ATOM 8033 C CD . GLU C 1 331 ? 16.420 -13.737 18.104 1.00 38.97 ? 639 GLU C CD 1 ATOM 8034 O OE1 . GLU C 1 331 ? 16.527 -14.977 17.994 1.00 43.34 ? 639 GLU C OE1 1 ATOM 8035 O OE2 . GLU C 1 331 ? 15.333 -13.136 17.962 1.00 36.25 ? 639 GLU C OE2 1 ATOM 8036 N N . LEU C 1 332 ? 15.892 -9.063 20.358 1.00 24.77 ? 640 LEU C N 1 ATOM 8037 C CA . LEU C 1 332 ? 15.827 -7.656 20.751 1.00 26.29 ? 640 LEU C CA 1 ATOM 8038 C C . LEU C 1 332 ? 15.927 -7.516 22.262 1.00 27.42 ? 640 LEU C C 1 ATOM 8039 O O . LEU C 1 332 ? 16.629 -6.641 22.769 1.00 27.28 ? 640 LEU C O 1 ATOM 8040 C CB . LEU C 1 332 ? 14.516 -7.018 20.281 1.00 24.22 ? 640 LEU C CB 1 ATOM 8041 C CG . LEU C 1 332 ? 14.243 -6.974 18.778 1.00 26.84 ? 640 LEU C CG 1 ATOM 8042 C CD1 . LEU C 1 332 ? 12.857 -6.417 18.506 1.00 24.87 ? 640 LEU C CD1 1 ATOM 8043 C CD2 . LEU C 1 332 ? 15.304 -6.145 18.088 1.00 29.04 ? 640 LEU C CD2 1 ATOM 8044 N N . PHE C 1 333 ? 15.213 -8.378 22.980 1.00 24.56 ? 641 PHE C N 1 ATOM 8045 C CA . PHE C 1 333 ? 15.231 -8.343 24.437 1.00 23.11 ? 641 PHE C CA 1 ATOM 8046 C C . PHE C 1 333 ? 16.523 -8.919 24.997 1.00 23.31 ? 641 PHE C C 1 ATOM 8047 O O . PHE C 1 333 ? 17.008 -8.469 26.035 1.00 23.58 ? 641 PHE C O 1 ATOM 8048 C CB . PHE C 1 333 ? 14.000 -9.051 25.013 1.00 22.28 ? 641 PHE C CB 1 ATOM 8049 C CG . PHE C 1 333 ? 12.723 -8.315 24.751 1.00 22.15 ? 641 PHE C CG 1 ATOM 8050 C CD1 . PHE C 1 333 ? 12.197 -7.456 25.700 1.00 22.46 ? 641 PHE C CD1 1 ATOM 8051 C CD2 . PHE C 1 333 ? 12.072 -8.446 23.536 1.00 22.79 ? 641 PHE C CD2 1 ATOM 8052 C CE1 . PHE C 1 333 ? 11.029 -6.755 25.452 1.00 21.25 ? 641 PHE C CE1 1 ATOM 8053 C CE2 . PHE C 1 333 ? 10.900 -7.752 23.285 1.00 20.89 ? 641 PHE C CE2 1 ATOM 8054 C CZ . PHE C 1 333 ? 10.387 -6.897 24.240 1.00 21.77 ? 641 PHE C CZ 1 ATOM 8055 N N . ALA C 1 334 ? 17.085 -9.900 24.296 1.00 25.07 ? 642 ALA C N 1 ATOM 8056 C CA . ALA C 1 334 ? 18.361 -10.501 24.694 1.00 24.01 ? 642 ALA C CA 1 ATOM 8057 C C . ALA C 1 334 ? 19.485 -9.469 24.720 1.00 26.33 ? 642 ALA C C 1 ATOM 8058 O O . ALA C 1 334 ? 20.442 -9.598 25.487 1.00 27.65 ? 642 ALA C O 1 ATOM 8059 C CB . ALA C 1 334 ? 18.720 -11.649 23.764 1.00 24.48 ? 642 ALA C CB 1 ATOM 8060 N N . LEU C 1 335 ? 19.367 -8.448 23.875 1.00 25.48 ? 643 LEU C N 1 ATOM 8061 C CA . LEU C 1 335 ? 20.360 -7.374 23.822 1.00 27.80 ? 643 LEU C CA 1 ATOM 8062 C C . LEU C 1 335 ? 20.176 -6.345 24.935 1.00 28.81 ? 643 LEU C C 1 ATOM 8063 O O . LEU C 1 335 ? 21.047 -5.501 25.152 1.00 29.81 ? 643 LEU C O 1 ATOM 8064 C CB . LEU C 1 335 ? 20.331 -6.685 22.456 1.00 26.47 ? 643 LEU C CB 1 ATOM 8065 C CG . LEU C 1 335 ? 20.910 -7.518 21.314 1.00 31.61 ? 643 LEU C CG 1 ATOM 8066 C CD1 . LEU C 1 335 ? 20.413 -7.023 19.966 1.00 33.62 ? 643 LEU C CD1 1 ATOM 8067 C CD2 . LEU C 1 335 ? 22.429 -7.479 21.374 1.00 35.64 ? 643 LEU C CD2 1 ATOM 8068 N N . ARG C 1 336 ? 19.041 -6.424 25.629 1.00 26.89 ? 644 ARG C N 1 ATOM 8069 C CA . ARG C 1 336 ? 18.715 -5.533 26.750 1.00 28.96 ? 644 ARG C CA 1 ATOM 8070 C C . ARG C 1 336 ? 18.913 -4.034 26.478 1.00 29.30 ? 644 ARG C C 1 ATOM 8071 O O . ARG C 1 336 ? 19.732 -3.388 27.140 1.00 28.13 ? 644 ARG C O 1 ATOM 8072 C CB . ARG C 1 336 ? 19.510 -5.932 28.003 1.00 34.63 ? 644 ARG C CB 1 ATOM 8073 C CG . ARG C 1 336 ? 19.125 -7.283 28.593 1.00 39.62 ? 644 ARG C CG 1 ATOM 8074 C CD . ARG C 1 336 ? 20.100 -7.702 29.685 1.00 48.98 ? 644 ARG C CD 1 ATOM 8075 N NE . ARG C 1 336 ? 19.928 -9.102 30.068 1.00 54.95 ? 644 ARG C NE 1 ATOM 8076 C CZ . ARG C 1 336 ? 20.705 -9.743 30.936 1.00 59.43 ? 644 ARG C CZ 1 ATOM 8077 N NH1 . ARG C 1 336 ? 21.717 -9.111 31.518 1.00 63.58 ? 644 ARG C NH1 1 ATOM 8078 N NH2 . ARG C 1 336 ? 20.473 -11.018 31.220 1.00 58.24 ? 644 ARG C NH2 1 ATOM 8079 N N . PRO C 1 337 ? 18.163 -3.474 25.513 1.00 28.00 ? 645 PRO C N 1 ATOM 8080 C CA . PRO C 1 337 ? 18.258 -2.034 25.239 1.00 28.42 ? 645 PRO C CA 1 ATOM 8081 C C . PRO C 1 337 ? 17.578 -1.183 26.311 1.00 26.58 ? 645 PRO C C 1 ATOM 8082 O O . PRO C 1 337 ? 17.769 0.033 26.324 1.00 26.99 ? 645 PRO C O 1 ATOM 8083 C CB . PRO C 1 337 ? 17.505 -1.886 23.913 1.00 27.03 ? 645 PRO C CB 1 ATOM 8084 C CG . PRO C 1 337 ? 16.495 -2.978 23.954 1.00 25.09 ? 645 PRO C CG 1 ATOM 8085 C CD . PRO C 1 337 ? 17.188 -4.133 24.624 1.00 26.64 ? 645 PRO C CD 1 ATOM 8086 N N . ALA C 1 338 ? 16.793 -1.810 27.185 1.00 23.50 ? 646 ALA C N 1 ATOM 8087 C CA . ALA C 1 338 ? 16.108 -1.088 28.258 1.00 24.35 ? 646 ALA C CA 1 ATOM 8088 C C . ALA C 1 338 ? 16.432 -1.700 29.623 1.00 26.40 ? 646 ALA C C 1 ATOM 8089 O O . ALA C 1 338 ? 16.722 -2.896 29.716 1.00 26.86 ? 646 ALA C O 1 ATOM 8090 C CB . ALA C 1 338 ? 14.593 -1.071 28.010 1.00 23.59 ? 646 ALA C CB 1 ATOM 8091 N N . PRO C 1 339 ? 16.405 -0.880 30.689 1.00 28.01 ? 647 PRO C N 1 ATOM 8092 C CA . PRO C 1 339 ? 16.779 -1.381 32.020 1.00 28.79 ? 647 PRO C CA 1 ATOM 8093 C C . PRO C 1 339 ? 15.750 -2.324 32.632 1.00 29.04 ? 647 PRO C C 1 ATOM 8094 O O . PRO C 1 339 ? 16.114 -3.183 33.436 1.00 30.86 ? 647 PRO C O 1 ATOM 8095 C CB . PRO C 1 339 ? 16.910 -0.101 32.858 1.00 29.88 ? 647 PRO C CB 1 ATOM 8096 C CG . PRO C 1 339 ? 16.088 0.914 32.138 1.00 28.71 ? 647 PRO C CG 1 ATOM 8097 C CD . PRO C 1 339 ? 16.203 0.580 30.683 1.00 29.53 ? 647 PRO C CD 1 ATOM 8098 N N . ILE C 1 340 ? 14.484 -2.168 32.255 1.00 26.23 ? 648 ILE C N 1 ATOM 8099 C CA . ILE C 1 340 ? 13.428 -3.050 32.729 1.00 26.83 ? 648 ILE C CA 1 ATOM 8100 C C . ILE C 1 340 ? 12.717 -3.656 31.530 1.00 25.42 ? 648 ILE C C 1 ATOM 8101 O O . ILE C 1 340 ? 12.282 -2.940 30.623 1.00 23.08 ? 648 ILE C O 1 ATOM 8102 C CB . ILE C 1 340 ? 12.397 -2.289 33.587 1.00 27.73 ? 648 ILE C CB 1 ATOM 8103 C CG1 . ILE C 1 340 ? 13.083 -1.638 34.792 1.00 29.04 ? 648 ILE C CG1 1 ATOM 8104 C CG2 . ILE C 1 340 ? 11.275 -3.220 34.028 1.00 27.07 ? 648 ILE C CG2 1 ATOM 8105 C CD1 . ILE C 1 340 ? 12.226 -0.607 35.507 1.00 30.44 ? 648 ILE C CD1 1 ATOM 8106 N N . GLN C 1 341 ? 12.614 -4.979 31.510 1.00 24.26 ? 649 GLN C N 1 ATOM 8107 C CA . GLN C 1 341 ? 11.924 -5.652 30.417 1.00 23.39 ? 649 GLN C CA 1 ATOM 8108 C C . GLN C 1 341 ? 10.882 -6.623 30.970 1.00 22.29 ? 649 GLN C C 1 ATOM 8109 O O . GLN C 1 341 ? 11.185 -7.449 31.831 1.00 23.19 ? 649 GLN C O 1 ATOM 8110 C CB . GLN C 1 341 ? 12.939 -6.336 29.493 1.00 22.60 ? 649 GLN C CB 1 ATOM 8111 C CG . GLN C 1 341 ? 14.027 -5.363 29.016 1.00 22.17 ? 649 GLN C CG 1 ATOM 8112 C CD . GLN C 1 341 ? 14.936 -5.918 27.932 1.00 25.00 ? 649 GLN C CD 1 ATOM 8113 O OE1 . GLN C 1 341 ? 15.409 -5.171 27.076 1.00 25.59 ? 649 GLN C OE1 1 ATOM 8114 N NE2 . GLN C 1 341 ? 15.207 -7.221 27.977 1.00 23.95 ? 649 GLN C NE2 1 ATOM 8115 N N . ALA C 1 342 ? 9.652 -6.507 30.481 1.00 20.59 ? 650 ALA C N 1 ATOM 8116 C CA . ALA C 1 342 ? 8.535 -7.268 31.038 1.00 19.18 ? 650 ALA C CA 1 ATOM 8117 C C . ALA C 1 342 ? 7.772 -8.069 29.981 1.00 18.99 ? 650 ALA C C 1 ATOM 8118 O O . ALA C 1 342 ? 7.584 -7.599 28.855 1.00 18.25 ? 650 ALA C O 1 ATOM 8119 C CB . ALA C 1 342 ? 7.578 -6.321 31.762 1.00 19.64 ? 650 ALA C CB 1 ATOM 8120 N N . MET C 1 343 ? 7.334 -9.270 30.360 1.00 15.82 ? 651 MET C N 1 ATOM 8121 C CA . MET C 1 343 ? 6.445 -10.082 29.537 1.00 15.82 ? 651 MET C CA 1 ATOM 8122 C C . MET C 1 343 ? 5.017 -9.632 29.793 1.00 18.09 ? 651 MET C C 1 ATOM 8123 O O . MET C 1 343 ? 4.631 -9.441 30.942 1.00 20.72 ? 651 MET C O 1 ATOM 8124 C CB . MET C 1 343 ? 6.566 -11.560 29.922 1.00 17.48 ? 651 MET C CB 1 ATOM 8125 C CG . MET C 1 343 ? 7.964 -12.139 29.747 1.00 18.16 ? 651 MET C CG 1 ATOM 8126 S SD . MET C 1 343 ? 8.354 -12.424 28.013 1.00 23.81 ? 651 MET C SD 1 ATOM 8127 C CE . MET C 1 343 ? 7.123 -13.672 27.621 1.00 20.84 ? 651 MET C CE 1 ATOM 8128 N N . TRP C 1 344 ? 4.227 -9.471 28.736 1.00 18.76 ? 652 TRP C N 1 ATOM 8129 C CA . TRP C 1 344 ? 2.847 -9.026 28.916 1.00 18.44 ? 652 TRP C CA 1 ATOM 8130 C C . TRP C 1 344 ? 1.883 -9.535 27.853 1.00 19.27 ? 652 TRP C C 1 ATOM 8131 O O . TRP C 1 344 ? 2.047 -9.254 26.663 1.00 17.61 ? 652 TRP C O 1 ATOM 8132 C CB . TRP C 1 344 ? 2.762 -7.499 28.989 1.00 17.92 ? 652 TRP C CB 1 ATOM 8133 C CG . TRP C 1 344 ? 1.345 -6.968 29.114 1.00 18.92 ? 652 TRP C CG 1 ATOM 8134 C CD1 . TRP C 1 344 ? 0.453 -7.234 30.116 1.00 19.87 ? 652 TRP C CD1 1 ATOM 8135 C CD2 . TRP C 1 344 ? 0.677 -6.076 28.209 1.00 16.74 ? 652 TRP C CD2 1 ATOM 8136 N NE1 . TRP C 1 344 ? -0.731 -6.564 29.887 1.00 17.96 ? 652 TRP C NE1 1 ATOM 8137 C CE2 . TRP C 1 344 ? -0.618 -5.848 28.723 1.00 16.23 ? 652 TRP C CE2 1 ATOM 8138 C CE3 . TRP C 1 344 ? 1.046 -5.451 27.014 1.00 18.44 ? 652 TRP C CE3 1 ATOM 8139 C CZ2 . TRP C 1 344 ? -1.540 -5.020 28.084 1.00 19.79 ? 652 TRP C CZ2 1 ATOM 8140 C CZ3 . TRP C 1 344 ? 0.126 -4.628 26.381 1.00 17.68 ? 652 TRP C CZ3 1 ATOM 8141 C CH2 . TRP C 1 344 ? -1.147 -4.420 26.916 1.00 19.12 ? 652 TRP C CH2 1 ATOM 8142 N N . LEU C 1 345 ? 0.913 -10.319 28.317 1.00 17.07 ? 653 LEU C N 1 ATOM 8143 C CA . LEU C 1 345 ? -0.354 -10.572 27.625 1.00 19.96 ? 653 LEU C CA 1 ATOM 8144 C C . LEU C 1 345 ? -0.341 -11.612 26.504 1.00 21.70 ? 653 LEU C C 1 ATOM 8145 O O . LEU C 1 345 ? -1.238 -12.458 26.438 1.00 21.47 ? 653 LEU C O 1 ATOM 8146 C CB . LEU C 1 345 ? -0.989 -9.256 27.138 1.00 20.21 ? 653 LEU C CB 1 ATOM 8147 C CG . LEU C 1 345 ? -2.432 -9.356 26.633 1.00 21.25 ? 653 LEU C CG 1 ATOM 8148 C CD1 . LEU C 1 345 ? -3.352 -9.862 27.741 1.00 22.42 ? 653 LEU C CD1 1 ATOM 8149 C CD2 . LEU C 1 345 ? -2.925 -8.016 26.083 1.00 18.47 ? 653 LEU C CD2 1 ATOM 8150 N N . GLY C 1 346 ? 0.657 -11.553 25.628 1.00 19.02 ? 654 GLY C N 1 ATOM 8151 C CA . GLY C 1 346 ? 0.627 -12.352 24.414 1.00 19.54 ? 654 GLY C CA 1 ATOM 8152 C C . GLY C 1 346 ? 1.104 -13.786 24.562 1.00 21.79 ? 654 GLY C C 1 ATOM 8153 O O . GLY C 1 346 ? 0.806 -14.632 23.721 1.00 27.13 ? 654 GLY C O 1 ATOM 8154 N N . TYR C 1 347 ? 1.852 -14.068 25.621 1.00 18.67 ? 655 TYR C N 1 ATOM 8155 C CA . TYR C 1 347 ? 2.404 -15.404 25.797 1.00 19.47 ? 655 TYR C CA 1 ATOM 8156 C C . TYR C 1 347 ? 2.049 -15.972 27.171 1.00 20.77 ? 655 TYR C C 1 ATOM 8157 O O . TYR C 1 347 ? 2.525 -15.468 28.191 1.00 20.18 ? 655 TYR C O 1 ATOM 8158 C CB . TYR C 1 347 ? 3.920 -15.384 25.598 1.00 19.64 ? 655 TYR C CB 1 ATOM 8159 C CG . TYR C 1 347 ? 4.533 -16.755 25.658 1.00 18.07 ? 655 TYR C CG 1 ATOM 8160 C CD1 . TYR C 1 347 ? 4.326 -17.670 24.635 1.00 18.79 ? 655 TYR C CD1 1 ATOM 8161 C CD2 . TYR C 1 347 ? 5.303 -17.146 26.748 1.00 17.80 ? 655 TYR C CD2 1 ATOM 8162 C CE1 . TYR C 1 347 ? 4.873 -18.937 24.690 1.00 21.19 ? 655 TYR C CE1 1 ATOM 8163 C CE2 . TYR C 1 347 ? 5.853 -18.409 26.814 1.00 19.43 ? 655 TYR C CE2 1 ATOM 8164 C CZ . TYR C 1 347 ? 5.642 -19.298 25.780 1.00 20.83 ? 655 TYR C CZ 1 ATOM 8165 O OH . TYR C 1 347 ? 6.188 -20.560 25.845 1.00 23.69 ? 655 TYR C OH 1 ATOM 8166 N N . PRO C 1 348 ? 1.208 -17.024 27.199 1.00 19.15 ? 656 PRO C N 1 ATOM 8167 C CA . PRO C 1 348 ? 0.725 -17.605 28.458 1.00 18.76 ? 656 PRO C CA 1 ATOM 8168 C C . PRO C 1 348 ? 1.712 -18.588 29.068 1.00 21.55 ? 656 PRO C C 1 ATOM 8169 O O . PRO C 1 348 ? 1.355 -19.739 29.322 1.00 20.61 ? 656 PRO C O 1 ATOM 8170 C CB . PRO C 1 348 ? -0.541 -18.347 28.028 1.00 19.03 ? 656 PRO C CB 1 ATOM 8171 C CG . PRO C 1 348 ? -0.240 -18.783 26.627 1.00 21.01 ? 656 PRO C CG 1 ATOM 8172 C CD . PRO C 1 348 ? 0.617 -17.690 26.023 1.00 18.57 ? 656 PRO C CD 1 ATOM 8173 N N . GLY C 1 349 ? 2.939 -18.139 29.304 1.00 19.97 ? 657 GLY C N 1 ATOM 8174 C CA . GLY C 1 349 ? 3.929 -18.971 29.960 1.00 19.93 ? 657 GLY C CA 1 ATOM 8175 C C . GLY C 1 349 ? 5.169 -18.176 30.313 1.00 21.33 ? 657 GLY C C 1 ATOM 8176 O O . GLY C 1 349 ? 5.267 -16.990 30.002 1.00 21.53 ? 657 GLY C O 1 ATOM 8177 N N . THR C 1 350 ? 6.116 -18.828 30.978 1.00 22.55 ? 658 THR C N 1 ATOM 8178 C CA . THR C 1 350 ? 7.377 -18.177 31.297 1.00 25.13 ? 658 THR C CA 1 ATOM 8179 C C . THR C 1 350 ? 8.292 -18.161 30.078 1.00 20.18 ? 658 THR C C 1 ATOM 8180 O O . THR C 1 350 ? 8.275 -19.087 29.263 1.00 19.24 ? 658 THR C O 1 ATOM 8181 C CB . THR C 1 350 ? 8.096 -18.850 32.486 1.00 23.36 ? 658 THR C CB 1 ATOM 8182 O OG1 . THR C 1 350 ? 9.269 -18.097 32.822 1.00 26.51 ? 658 THR C OG1 1 ATOM 8183 C CG2 . THR C 1 350 ? 8.493 -20.280 32.151 1.00 26.32 ? 658 THR C CG2 1 ATOM 8184 N N . SER C 1 351 ? 9.081 -17.100 29.949 1.00 19.78 ? 659 SER C N 1 ATOM 8185 C CA . SER C 1 351 ? 10.073 -17.019 28.886 1.00 19.59 ? 659 SER C CA 1 ATOM 8186 C C . SER C 1 351 ? 11.259 -17.908 29.230 1.00 22.58 ? 659 SER C C 1 ATOM 8187 O O . SER C 1 351 ? 12.003 -18.346 28.348 1.00 25.34 ? 659 SER C O 1 ATOM 8188 C CB . SER C 1 351 ? 10.559 -15.581 28.711 1.00 23.80 ? 659 SER C CB 1 ATOM 8189 O OG . SER C 1 351 ? 11.428 -15.199 29.770 1.00 21.86 ? 659 SER C OG 1 ATOM 8190 N N . GLY C 1 352 ? 11.443 -18.165 30.521 1.00 22.41 ? 660 GLY C N 1 ATOM 8191 C CA . GLY C 1 352 ? 12.602 -18.905 30.986 1.00 24.09 ? 660 GLY C CA 1 ATOM 8192 C C . GLY C 1 352 ? 13.895 -18.121 30.805 1.00 28.56 ? 660 GLY C C 1 ATOM 8193 O O . GLY C 1 352 ? 14.977 -18.622 31.108 1.00 28.92 ? 660 GLY C O 1 ATOM 8194 N N . ALA C 1 353 ? 13.784 -16.881 30.332 1.00 26.84 ? 661 ALA C N 1 ATOM 8195 C CA . ALA C 1 353 ? 14.957 -16.117 29.913 1.00 31.70 ? 661 ALA C CA 1 ATOM 8196 C C . ALA C 1 353 ? 15.404 -15.089 30.948 1.00 31.70 ? 661 ALA C C 1 ATOM 8197 O O . ALA C 1 353 ? 14.606 -14.290 31.429 1.00 32.65 ? 661 ALA C O 1 ATOM 8198 C CB . ALA C 1 353 ? 14.682 -15.438 28.591 1.00 33.22 ? 661 ALA C CB 1 ATOM 8199 N N . LEU C 1 354 ? 16.692 -15.094 31.271 1.00 32.74 ? 662 LEU C N 1 ATOM 8200 C CA . LEU C 1 354 ? 17.216 -14.176 32.277 1.00 35.71 ? 662 LEU C CA 1 ATOM 8201 C C . LEU C 1 354 ? 17.141 -12.712 31.841 1.00 34.24 ? 662 LEU C C 1 ATOM 8202 O O . LEU C 1 354 ? 17.159 -11.812 32.680 1.00 34.41 ? 662 LEU C O 1 ATOM 8203 C CB . LEU C 1 354 ? 18.647 -14.552 32.667 1.00 42.69 ? 662 LEU C CB 1 ATOM 8204 C CG . LEU C 1 354 ? 18.789 -15.884 33.413 1.00 46.88 ? 662 LEU C CG 1 ATOM 8205 C CD1 . LEU C 1 354 ? 20.188 -16.032 33.985 1.00 49.77 ? 662 LEU C CD1 1 ATOM 8206 C CD2 . LEU C 1 354 ? 17.737 -16.011 34.512 1.00 47.38 ? 662 LEU C CD2 1 ATOM 8207 N N . PHE C 1 355 ? 17.047 -12.472 30.536 1.00 32.54 ? 663 PHE C N 1 ATOM 8208 C CA . PHE C 1 355 ? 16.934 -11.099 30.039 1.00 29.77 ? 663 PHE C CA 1 ATOM 8209 C C . PHE C 1 355 ? 15.535 -10.497 30.202 1.00 28.36 ? 663 PHE C C 1 ATOM 8210 O O . PHE C 1 355 ? 15.337 -9.301 29.963 1.00 26.76 ? 663 PHE C O 1 ATOM 8211 C CB . PHE C 1 355 ? 17.426 -10.971 28.589 1.00 29.15 ? 663 PHE C CB 1 ATOM 8212 C CG . PHE C 1 355 ? 16.766 -11.921 27.622 1.00 28.99 ? 663 PHE C CG 1 ATOM 8213 C CD1 . PHE C 1 355 ? 15.488 -11.677 27.146 1.00 29.11 ? 663 PHE C CD1 1 ATOM 8214 C CD2 . PHE C 1 355 ? 17.442 -13.042 27.166 1.00 29.97 ? 663 PHE C CD2 1 ATOM 8215 C CE1 . PHE C 1 355 ? 14.885 -12.544 26.247 1.00 28.15 ? 663 PHE C CE1 1 ATOM 8216 C CE2 . PHE C 1 355 ? 16.849 -13.913 26.265 1.00 28.18 ? 663 PHE C CE2 1 ATOM 8217 C CZ . PHE C 1 355 ? 15.571 -13.661 25.802 1.00 28.20 ? 663 PHE C CZ 1 ATOM 8218 N N . MET C 1 356 ? 14.567 -11.319 30.600 1.00 26.82 ? 664 MET C N 1 ATOM 8219 C CA . MET C 1 356 ? 13.244 -10.804 30.947 1.00 24.96 ? 664 MET C CA 1 ATOM 8220 C C . MET C 1 356 ? 13.155 -10.668 32.461 1.00 26.38 ? 664 MET C C 1 ATOM 8221 O O . MET C 1 356 ? 13.399 -11.631 33.187 1.00 28.02 ? 664 MET C O 1 ATOM 8222 C CB . MET C 1 356 ? 12.128 -11.722 30.434 1.00 22.02 ? 664 MET C CB 1 ATOM 8223 C CG . MET C 1 356 ? 12.068 -11.881 28.916 1.00 22.77 ? 664 MET C CG 1 ATOM 8224 S SD . MET C 1 356 ? 12.014 -10.332 27.978 1.00 23.29 ? 664 MET C SD 1 ATOM 8225 C CE . MET C 1 356 ? 10.696 -9.440 28.791 1.00 17.34 ? 664 MET C CE 1 ATOM 8226 N N . ASP C 1 357 ? 12.806 -9.475 32.938 1.00 24.43 ? 665 ASP C N 1 ATOM 8227 C CA . ASP C 1 357 ? 12.812 -9.199 34.376 1.00 26.51 ? 665 ASP C CA 1 ATOM 8228 C C . ASP C 1 357 ? 11.519 -9.586 35.082 1.00 26.07 ? 665 ASP C C 1 ATOM 8229 O O . ASP C 1 357 ? 11.546 -10.169 36.173 1.00 24.10 ? 665 ASP C O 1 ATOM 8230 C CB . ASP C 1 357 ? 13.096 -7.722 34.640 1.00 27.28 ? 665 ASP C CB 1 ATOM 8231 C CG . ASP C 1 357 ? 14.425 -7.277 34.071 1.00 29.65 ? 665 ASP C CG 1 ATOM 8232 O OD1 . ASP C 1 357 ? 15.468 -7.796 34.525 1.00 30.96 ? 665 ASP C OD1 1 ATOM 8233 O OD2 . ASP C 1 357 ? 14.423 -6.408 33.177 1.00 28.76 ? 665 ASP C OD2 1 ATOM 8234 N N . TYR C 1 358 ? 10.396 -9.246 34.453 1.00 23.67 ? 666 TYR C N 1 ATOM 8235 C CA . TYR C 1 358 ? 9.082 -9.407 35.060 1.00 23.02 ? 666 TYR C CA 1 ATOM 8236 C C . TYR C 1 358 ? 8.138 -10.130 34.122 1.00 20.88 ? 666 TYR C C 1 ATOM 8237 O O . TYR C 1 358 ? 8.310 -10.100 32.905 1.00 21.22 ? 666 TYR C O 1 ATOM 8238 C CB . TYR C 1 358 ? 8.464 -8.040 35.372 1.00 21.62 ? 666 TYR C CB 1 ATOM 8239 C CG . TYR C 1 358 ? 9.148 -7.277 36.478 1.00 23.74 ? 666 TYR C CG 1 ATOM 8240 C CD1 . TYR C 1 358 ? 9.017 -7.672 37.803 1.00 24.41 ? 666 TYR C CD1 1 ATOM 8241 C CD2 . TYR C 1 358 ? 9.919 -6.153 36.200 1.00 23.28 ? 666 TYR C CD2 1 ATOM 8242 C CE1 . TYR C 1 358 ? 9.640 -6.972 38.821 1.00 26.16 ? 666 TYR C CE1 1 ATOM 8243 C CE2 . TYR C 1 358 ? 10.547 -5.450 37.211 1.00 25.91 ? 666 TYR C CE2 1 ATOM 8244 C CZ . TYR C 1 358 ? 10.405 -5.864 38.519 1.00 27.11 ? 666 TYR C CZ 1 ATOM 8245 O OH . TYR C 1 358 ? 11.029 -5.167 39.533 1.00 28.37 ? 666 TYR C OH 1 ATOM 8246 N N . ILE C 1 359 ? 7.138 -10.783 34.696 1.00 20.93 ? 667 ILE C N 1 ATOM 8247 C CA . ILE C 1 359 ? 5.977 -11.191 33.921 1.00 19.76 ? 667 ILE C CA 1 ATOM 8248 C C . ILE C 1 359 ? 4.764 -10.526 34.550 1.00 19.60 ? 667 ILE C C 1 ATOM 8249 O O . ILE C 1 359 ? 4.553 -10.602 35.762 1.00 20.16 ? 667 ILE C O 1 ATOM 8250 C CB . ILE C 1 359 ? 5.808 -12.731 33.843 1.00 22.06 ? 667 ILE C CB 1 ATOM 8251 C CG1 . ILE C 1 359 ? 4.556 -13.080 33.034 1.00 23.47 ? 667 ILE C CG1 1 ATOM 8252 C CG2 . ILE C 1 359 ? 5.753 -13.361 35.239 1.00 21.91 ? 667 ILE C CG2 1 ATOM 8253 C CD1 . ILE C 1 359 ? 4.409 -14.556 32.728 1.00 25.51 ? 667 ILE C CD1 1 ATOM 8254 N N . ILE C 1 360 ? 3.989 -9.828 33.733 1.00 18.48 ? 668 ILE C N 1 ATOM 8255 C CA . ILE C 1 360 ? 2.805 -9.161 34.243 1.00 18.57 ? 668 ILE C CA 1 ATOM 8256 C C . ILE C 1 360 ? 1.653 -10.157 34.311 1.00 21.05 ? 668 ILE C C 1 ATOM 8257 O O . ILE C 1 360 ? 1.198 -10.689 33.301 1.00 21.85 ? 668 ILE C O 1 ATOM 8258 C CB . ILE C 1 360 ? 2.461 -7.908 33.430 1.00 17.02 ? 668 ILE C CB 1 ATOM 8259 C CG1 . ILE C 1 360 ? 3.621 -6.903 33.540 1.00 17.10 ? 668 ILE C CG1 1 ATOM 8260 C CG2 . ILE C 1 360 ? 1.153 -7.295 33.928 1.00 19.62 ? 668 ILE C CG2 1 ATOM 8261 C CD1 . ILE C 1 360 ? 3.527 -5.717 32.612 1.00 19.26 ? 668 ILE C CD1 1 ATOM 8262 N N . THR C 1 361 ? 1.215 -10.431 35.530 1.00 19.71 ? 669 THR C N 1 ATOM 8263 C CA . THR C 1 361 ? 0.224 -11.466 35.763 1.00 18.39 ? 669 THR C CA 1 ATOM 8264 C C . THR C 1 361 ? -0.635 -11.017 36.943 1.00 17.58 ? 669 THR C C 1 ATOM 8265 O O . THR C 1 361 ? -0.769 -9.821 37.180 1.00 19.16 ? 669 THR C O 1 ATOM 8266 C CB . THR C 1 361 ? 0.902 -12.847 35.978 1.00 20.54 ? 669 THR C CB 1 ATOM 8267 O OG1 . THR C 1 361 ? -0.086 -13.849 36.256 1.00 19.80 ? 669 THR C OG1 1 ATOM 8268 C CG2 . THR C 1 361 ? 1.943 -12.797 37.111 1.00 20.48 ? 669 THR C CG2 1 ATOM 8269 N N . ASP C 1 362 ? -1.230 -11.949 37.673 1.00 18.45 ? 670 ASP C N 1 ATOM 8270 C CA . ASP C 1 362 ? -2.028 -11.575 38.840 1.00 18.12 ? 670 ASP C CA 1 ATOM 8271 C C . ASP C 1 362 ? -2.058 -12.728 39.824 1.00 18.37 ? 670 ASP C C 1 ATOM 8272 O O . ASP C 1 362 ? -1.576 -13.817 39.517 1.00 19.60 ? 670 ASP C O 1 ATOM 8273 C CB . ASP C 1 362 ? -3.452 -11.194 38.431 1.00 19.23 ? 670 ASP C CB 1 ATOM 8274 C CG . ASP C 1 362 ? -4.170 -12.322 37.730 1.00 18.66 ? 670 ASP C CG 1 ATOM 8275 O OD1 . ASP C 1 362 ? -4.781 -13.162 38.414 1.00 19.56 ? 670 ASP C OD1 1 ATOM 8276 O OD2 . ASP C 1 362 ? -4.125 -12.368 36.490 1.00 20.69 ? 670 ASP C OD2 1 ATOM 8277 N N . GLN C 1 363 ? -2.625 -12.487 41.001 1.00 19.32 ? 671 GLN C N 1 ATOM 8278 C CA . GLN C 1 363 ? -2.568 -13.460 42.092 1.00 25.57 ? 671 GLN C CA 1 ATOM 8279 C C . GLN C 1 363 ? -3.340 -14.751 41.793 1.00 22.13 ? 671 GLN C C 1 ATOM 8280 O O . GLN C 1 363 ? -2.963 -15.831 42.262 1.00 20.42 ? 671 GLN C O 1 ATOM 8281 C CB . GLN C 1 363 ? -3.052 -12.827 43.404 1.00 31.00 ? 671 GLN C CB 1 ATOM 8282 C CG . GLN C 1 363 ? -2.925 -13.735 44.616 1.00 38.25 ? 671 GLN C CG 1 ATOM 8283 C CD . GLN C 1 363 ? -3.633 -13.180 45.843 1.00 44.54 ? 671 GLN C CD 1 ATOM 8284 O OE1 . GLN C 1 363 ? -3.853 -11.973 45.959 1.00 44.06 ? 671 GLN C OE1 1 ATOM 8285 N NE2 . GLN C 1 363 ? -4.001 -14.067 46.762 1.00 48.23 ? 671 GLN C NE2 1 ATOM 8286 N N . GLU C 1 364 ? -4.409 -14.643 41.012 1.00 19.78 ? 672 GLU C N 1 ATOM 8287 C CA . GLU C 1 364 ? -5.211 -15.819 40.663 1.00 21.20 ? 672 GLU C CA 1 ATOM 8288 C C . GLU C 1 364 ? -4.523 -16.665 39.603 1.00 21.65 ? 672 GLU C C 1 ATOM 8289 O O . GLU C 1 364 ? -4.507 -17.894 39.686 1.00 23.17 ? 672 GLU C O 1 ATOM 8290 C CB . GLU C 1 364 ? -6.596 -15.404 40.150 1.00 23.72 ? 672 GLU C CB 1 ATOM 8291 C CG . GLU C 1 364 ? -7.430 -14.648 41.168 1.00 27.98 ? 672 GLU C CG 1 ATOM 8292 C CD . GLU C 1 364 ? -7.642 -15.428 42.449 1.00 31.37 ? 672 GLU C CD 1 ATOM 8293 O OE1 . GLU C 1 364 ? -7.829 -16.668 42.374 1.00 29.14 ? 672 GLU C OE1 1 ATOM 8294 O OE2 . GLU C 1 364 ? -7.628 -14.796 43.534 1.00 32.61 ? 672 GLU C OE2 1 ATOM 8295 N N . THR C 1 365 ? -3.977 -15.992 38.595 1.00 20.17 ? 673 THR C N 1 ATOM 8296 C CA . THR C 1 365 ? -3.294 -16.658 37.493 1.00 18.74 ? 673 THR C CA 1 ATOM 8297 C C . THR C 1 365 ? -1.984 -17.274 37.970 1.00 18.77 ? 673 THR C C 1 ATOM 8298 O O . THR C 1 365 ? -1.661 -18.407 37.625 1.00 20.69 ? 673 THR C O 1 ATOM 8299 C CB . THR C 1 365 ? -2.996 -15.676 36.350 1.00 18.74 ? 673 THR C CB 1 ATOM 8300 O OG1 . THR C 1 365 ? -4.219 -15.084 35.888 1.00 19.62 ? 673 THR C OG1 1 ATOM 8301 C CG2 . THR C 1 365 ? -2.321 -16.396 35.191 1.00 18.91 ? 673 THR C CG2 1 ATOM 8302 N N . SER C 1 366 ? -1.233 -16.524 38.772 1.00 19.06 ? 674 SER C N 1 ATOM 8303 C CA . SER C 1 366 ? 0.090 -16.970 39.206 1.00 21.13 ? 674 SER C CA 1 ATOM 8304 C C . SER C 1 366 ? 0.305 -16.747 40.700 1.00 23.37 ? 674 SER C C 1 ATOM 8305 O O . SER C 1 366 ? 1.003 -15.811 41.093 1.00 24.18 ? 674 SER C O 1 ATOM 8306 C CB . SER C 1 366 ? 1.178 -16.219 38.422 1.00 22.48 ? 674 SER C CB 1 ATOM 8307 O OG . SER C 1 366 ? 0.882 -16.185 37.035 1.00 21.79 ? 674 SER C OG 1 ATOM 8308 N N . PRO C 1 367 ? -0.289 -17.608 41.539 1.00 28.44 ? 675 PRO C N 1 ATOM 8309 C CA . PRO C 1 367 ? -0.129 -17.462 42.988 1.00 29.89 ? 675 PRO C CA 1 ATOM 8310 C C . PRO C 1 367 ? 1.338 -17.457 43.400 1.00 31.23 ? 675 PRO C C 1 ATOM 8311 O O . PRO C 1 367 ? 2.159 -18.142 42.786 1.00 27.56 ? 675 PRO C O 1 ATOM 8312 C CB . PRO C 1 367 ? -0.860 -18.686 43.557 1.00 31.85 ? 675 PRO C CB 1 ATOM 8313 C CG . PRO C 1 367 ? -1.093 -19.602 42.396 1.00 32.06 ? 675 PRO C CG 1 ATOM 8314 C CD . PRO C 1 367 ? -1.172 -18.731 41.187 1.00 27.93 ? 675 PRO C CD 1 ATOM 8315 N N . ALA C 1 368 ? 1.660 -16.675 44.425 1.00 35.04 ? 676 ALA C N 1 ATOM 8316 C CA . ALA C 1 368 ? 3.046 -16.480 44.842 1.00 39.00 ? 676 ALA C CA 1 ATOM 8317 C C . ALA C 1 368 ? 3.736 -17.798 45.178 1.00 40.63 ? 676 ALA C C 1 ATOM 8318 O O . ALA C 1 368 ? 4.960 -17.904 45.089 1.00 40.57 ? 676 ALA C O 1 ATOM 8319 C CB . ALA C 1 368 ? 3.118 -15.520 46.021 1.00 40.00 ? 676 ALA C CB 1 ATOM 8320 N N . GLU C 1 369 ? 2.940 -18.799 45.544 1.00 42.75 ? 677 GLU C N 1 ATOM 8321 C CA . GLU C 1 369 ? 3.454 -20.113 45.919 1.00 47.09 ? 677 GLU C CA 1 ATOM 8322 C C . GLU C 1 369 ? 4.124 -20.829 44.749 1.00 47.61 ? 677 GLU C C 1 ATOM 8323 O O . GLU C 1 369 ? 5.005 -21.665 44.947 1.00 50.25 ? 677 GLU C O 1 ATOM 8324 C CB . GLU C 1 369 ? 2.333 -20.994 46.482 1.00 49.99 ? 677 GLU C CB 1 ATOM 8325 C CG . GLU C 1 369 ? 1.470 -20.327 47.547 1.00 52.92 ? 677 GLU C CG 1 ATOM 8326 C CD . GLU C 1 369 ? 0.267 -19.606 46.960 1.00 52.93 ? 677 GLU C CD 1 ATOM 8327 O OE1 . GLU C 1 369 ? -0.678 -20.291 46.512 1.00 54.12 ? 677 GLU C OE1 1 ATOM 8328 O OE2 . GLU C 1 369 ? 0.265 -18.356 46.946 1.00 51.00 ? 677 GLU C OE2 1 ATOM 8329 N N . VAL C 1 370 ? 3.702 -20.510 43.530 1.00 44.09 ? 678 VAL C N 1 ATOM 8330 C CA . VAL C 1 370 ? 4.258 -21.165 42.350 1.00 42.09 ? 678 VAL C CA 1 ATOM 8331 C C . VAL C 1 370 ? 5.214 -20.268 41.566 1.00 37.45 ? 678 VAL C C 1 ATOM 8332 O O . VAL C 1 370 ? 5.389 -20.443 40.363 1.00 36.80 ? 678 VAL C O 1 ATOM 8333 C CB . VAL C 1 370 ? 3.157 -21.717 41.416 1.00 41.43 ? 678 VAL C CB 1 ATOM 8334 C CG1 . VAL C 1 370 ? 2.275 -22.692 42.172 1.00 44.18 ? 678 VAL C CG1 1 ATOM 8335 C CG2 . VAL C 1 370 ? 2.323 -20.587 40.824 1.00 40.69 ? 678 VAL C CG2 1 ATOM 8336 N N . ALA C 1 371 ? 5.848 -19.325 42.258 1.00 36.29 ? 679 ALA C N 1 ATOM 8337 C CA . ALA C 1 371 ? 6.818 -18.433 41.628 1.00 37.77 ? 679 ALA C CA 1 ATOM 8338 C C . ALA C 1 371 ? 7.967 -19.205 40.973 1.00 38.19 ? 679 ALA C C 1 ATOM 8339 O O . ALA C 1 371 ? 8.559 -18.739 39.997 1.00 37.66 ? 679 ALA C O 1 ATOM 8340 C CB . ALA C 1 371 ? 7.359 -17.429 42.640 1.00 39.46 ? 679 ALA C CB 1 ATOM 8341 N N . GLU C 1 372 ? 8.262 -20.389 41.507 1.00 39.84 ? 680 GLU C N 1 ATOM 8342 C CA . GLU C 1 372 ? 9.345 -21.232 40.998 1.00 43.07 ? 680 GLU C CA 1 ATOM 8343 C C . GLU C 1 372 ? 9.115 -21.730 39.568 1.00 39.39 ? 680 GLU C C 1 ATOM 8344 O O . GLU C 1 372 ? 10.062 -22.137 38.892 1.00 39.37 ? 680 GLU C O 1 ATOM 8345 C CB . GLU C 1 372 ? 9.593 -22.422 41.937 1.00 48.62 ? 680 GLU C CB 1 ATOM 8346 C CG . GLU C 1 372 ? 8.391 -23.349 42.107 1.00 53.93 ? 680 GLU C CG 1 ATOM 8347 C CD . GLU C 1 372 ? 8.666 -24.516 43.047 1.00 61.49 ? 680 GLU C CD 1 ATOM 8348 O OE1 . GLU C 1 372 ? 9.845 -24.743 43.400 1.00 64.02 ? 680 GLU C OE1 1 ATOM 8349 O OE2 . GLU C 1 372 ? 7.699 -25.208 43.435 1.00 63.52 ? 680 GLU C OE2 1 ATOM 8350 N N . GLN C 1 373 ? 7.866 -21.701 39.110 1.00 35.91 ? 681 GLN C N 1 ATOM 8351 C CA . GLN C 1 373 ? 7.549 -22.096 37.737 1.00 35.87 ? 681 GLN C CA 1 ATOM 8352 C C . GLN C 1 373 ? 8.044 -21.059 36.726 1.00 30.17 ? 681 GLN C C 1 ATOM 8353 O O . GLN C 1 373 ? 8.197 -21.354 35.543 1.00 31.01 ? 681 GLN C O 1 ATOM 8354 C CB . GLN C 1 373 ? 6.042 -22.279 37.563 1.00 40.27 ? 681 GLN C CB 1 ATOM 8355 C CG . GLN C 1 373 ? 5.401 -23.283 38.507 1.00 49.29 ? 681 GLN C CG 1 ATOM 8356 C CD . GLN C 1 373 ? 3.891 -23.341 38.342 1.00 54.61 ? 681 GLN C CD 1 ATOM 8357 O OE1 . GLN C 1 373 ? 3.246 -24.301 38.761 1.00 58.12 ? 681 GLN C OE1 1 ATOM 8358 N NE2 . GLN C 1 373 ? 3.322 -22.306 37.728 1.00 56.37 ? 681 GLN C NE2 1 ATOM 8359 N N . TYR C 1 374 ? 8.283 -19.844 37.200 1.00 27.36 ? 682 TYR C N 1 ATOM 8360 C CA . TYR C 1 374 ? 8.644 -18.729 36.330 1.00 24.69 ? 682 TYR C CA 1 ATOM 8361 C C . TYR C 1 374 ? 10.087 -18.313 36.534 1.00 27.34 ? 682 TYR C C 1 ATOM 8362 O O . TYR C 1 374 ? 10.593 -18.330 37.652 1.00 29.48 ? 682 TYR C O 1 ATOM 8363 C CB . TYR C 1 374 ? 7.757 -17.521 36.630 1.00 23.27 ? 682 TYR C CB 1 ATOM 8364 C CG . TYR C 1 374 ? 6.285 -17.780 36.467 1.00 23.21 ? 682 TYR C CG 1 ATOM 8365 C CD1 . TYR C 1 374 ? 5.538 -18.336 37.499 1.00 24.48 ? 682 TYR C CD1 1 ATOM 8366 C CD2 . TYR C 1 374 ? 5.637 -17.460 35.284 1.00 26.35 ? 682 TYR C CD2 1 ATOM 8367 C CE1 . TYR C 1 374 ? 4.187 -18.568 37.352 1.00 24.56 ? 682 TYR C CE1 1 ATOM 8368 C CE2 . TYR C 1 374 ? 4.281 -17.688 35.129 1.00 27.63 ? 682 TYR C CE2 1 ATOM 8369 C CZ . TYR C 1 374 ? 3.563 -18.243 36.166 1.00 25.63 ? 682 TYR C CZ 1 ATOM 8370 O OH . TYR C 1 374 ? 2.215 -18.471 36.012 1.00 25.08 ? 682 TYR C OH 1 ATOM 8371 N N . SER C 1 375 ? 10.752 -17.921 35.455 1.00 25.94 ? 683 SER C N 1 ATOM 8372 C CA . SER C 1 375 ? 12.090 -17.372 35.594 1.00 26.99 ? 683 SER C CA 1 ATOM 8373 C C . SER C 1 375 ? 11.988 -15.892 35.961 1.00 25.39 ? 683 SER C C 1 ATOM 8374 O O . SER C 1 375 ? 12.850 -15.355 36.662 1.00 25.27 ? 683 SER C O 1 ATOM 8375 C CB . SER C 1 375 ? 12.890 -17.561 34.307 1.00 28.46 ? 683 SER C CB 1 ATOM 8376 O OG . SER C 1 375 ? 12.271 -16.871 33.233 1.00 27.60 ? 683 SER C OG 1 ATOM 8377 N N . GLU C 1 376 ? 10.926 -15.241 35.491 1.00 22.01 ? 684 GLU C N 1 ATOM 8378 C CA . GLU C 1 376 ? 10.703 -13.824 35.776 1.00 25.46 ? 684 GLU C CA 1 ATOM 8379 C C . GLU C 1 376 ? 10.174 -13.596 37.194 1.00 26.22 ? 684 GLU C C 1 ATOM 8380 O O . GLU C 1 376 ? 9.554 -14.481 37.786 1.00 25.96 ? 684 GLU C O 1 ATOM 8381 C CB . GLU C 1 376 ? 9.699 -13.219 34.787 1.00 24.17 ? 684 GLU C CB 1 ATOM 8382 C CG . GLU C 1 376 ? 9.999 -13.469 33.315 1.00 24.30 ? 684 GLU C CG 1 ATOM 8383 C CD . GLU C 1 376 ? 9.385 -14.761 32.811 1.00 26.49 ? 684 GLU C CD 1 ATOM 8384 O OE1 . GLU C 1 376 ? 8.828 -15.521 33.633 1.00 26.01 ? 684 GLU C OE1 1 ATOM 8385 O OE2 . GLU C 1 376 ? 9.461 -15.016 31.591 1.00 25.62 ? 684 GLU C OE2 1 ATOM 8386 N N . LYS C 1 377 ? 10.407 -12.401 37.730 1.00 23.91 ? 685 LYS C N 1 ATOM 8387 C CA . LYS C 1 377 ? 9.733 -11.994 38.957 1.00 25.73 ? 685 LYS C CA 1 ATOM 8388 C C . LYS C 1 377 ? 8.274 -11.708 38.629 1.00 24.56 ? 685 LYS C C 1 ATOM 8389 O O . LYS C 1 377 ? 7.972 -11.218 37.545 1.00 21.91 ? 685 LYS C O 1 ATOM 8390 C CB . LYS C 1 377 ? 10.383 -10.741 39.545 1.00 24.88 ? 685 LYS C CB 1 ATOM 8391 C CG . LYS C 1 377 ? 11.825 -10.937 39.985 1.00 27.32 ? 685 LYS C CG 1 ATOM 8392 C CD . LYS C 1 377 ? 11.936 -11.985 41.079 1.00 30.09 ? 685 LYS C CD 1 ATOM 8393 C CE . LYS C 1 377 ? 13.392 -12.191 41.477 1.00 34.16 ? 685 LYS C CE 1 ATOM 8394 N NZ . LYS C 1 377 ? 13.540 -13.221 42.542 1.00 35.46 ? 685 LYS C NZ 1 ATOM 8395 N N . LEU C 1 378 ? 7.376 -12.013 39.563 1.00 23.20 ? 686 LEU C N 1 ATOM 8396 C CA . LEU C 1 378 ? 5.953 -11.776 39.362 1.00 24.11 ? 686 LEU C CA 1 ATOM 8397 C C . LEU C 1 378 ? 5.605 -10.312 39.621 1.00 25.28 ? 686 LEU C C 1 ATOM 8398 O O . LEU C 1 378 ? 6.056 -9.711 40.602 1.00 26.39 ? 686 LEU C O 1 ATOM 8399 C CB . LEU C 1 378 ? 5.122 -12.677 40.280 1.00 25.96 ? 686 LEU C CB 1 ATOM 8400 C CG . LEU C 1 378 ? 5.402 -14.183 40.250 1.00 25.84 ? 686 LEU C CG 1 ATOM 8401 C CD1 . LEU C 1 378 ? 4.632 -14.893 41.358 1.00 26.04 ? 686 LEU C CD1 1 ATOM 8402 C CD2 . LEU C 1 378 ? 5.066 -14.773 38.886 1.00 25.62 ? 686 LEU C CD2 1 ATOM 8403 N N . ALA C 1 379 ? 4.809 -9.745 38.725 1.00 21.85 ? 687 ALA C N 1 ATOM 8404 C CA . ALA C 1 379 ? 4.326 -8.378 38.863 1.00 21.41 ? 687 ALA C CA 1 ATOM 8405 C C . ALA C 1 379 ? 2.813 -8.402 38.703 1.00 21.01 ? 687 ALA C C 1 ATOM 8406 O O . ALA C 1 379 ? 2.303 -8.594 37.600 1.00 18.60 ? 687 ALA C O 1 ATOM 8407 C CB . ALA C 1 379 ? 4.959 -7.484 37.808 1.00 20.96 ? 687 ALA C CB 1 ATOM 8408 N N . TYR C 1 380 ? 2.104 -8.204 39.809 1.00 21.18 ? 688 TYR C N 1 ATOM 8409 C CA . TYR C 1 380 ? 0.660 -8.382 39.844 1.00 21.10 ? 688 TYR C CA 1 ATOM 8410 C C . TYR C 1 380 ? -0.126 -7.145 39.451 1.00 21.02 ? 688 TYR C C 1 ATOM 8411 O O . TYR C 1 380 ? 0.066 -6.067 40.018 1.00 22.40 ? 688 TYR C O 1 ATOM 8412 C CB . TYR C 1 380 ? 0.205 -8.765 41.254 1.00 19.84 ? 688 TYR C CB 1 ATOM 8413 C CG . TYR C 1 380 ? 0.483 -10.189 41.677 1.00 21.74 ? 688 TYR C CG 1 ATOM 8414 C CD1 . TYR C 1 380 ? 1.009 -11.123 40.786 1.00 21.45 ? 688 TYR C CD1 1 ATOM 8415 C CD2 . TYR C 1 380 ? 0.205 -10.603 42.976 1.00 21.32 ? 688 TYR C CD2 1 ATOM 8416 C CE1 . TYR C 1 380 ? 1.259 -12.435 41.190 1.00 19.85 ? 688 TYR C CE1 1 ATOM 8417 C CE2 . TYR C 1 380 ? 0.441 -11.903 43.385 1.00 24.18 ? 688 TYR C CE2 1 ATOM 8418 C CZ . TYR C 1 380 ? 0.967 -12.817 42.490 1.00 23.75 ? 688 TYR C CZ 1 ATOM 8419 O OH . TYR C 1 380 ? 1.207 -14.110 42.912 1.00 25.58 ? 688 TYR C OH 1 ATOM 8420 N N . MET C 1 381 ? -1.039 -7.320 38.505 1.00 19.03 ? 689 MET C N 1 ATOM 8421 C CA . MET C 1 381 ? -2.148 -6.395 38.341 1.00 19.61 ? 689 MET C CA 1 ATOM 8422 C C . MET C 1 381 ? -3.124 -6.714 39.469 1.00 21.38 ? 689 MET C C 1 ATOM 8423 O O . MET C 1 381 ? -3.116 -7.829 39.990 1.00 21.85 ? 689 MET C O 1 ATOM 8424 C CB . MET C 1 381 ? -2.806 -6.587 36.972 1.00 17.41 ? 689 MET C CB 1 ATOM 8425 C CG . MET C 1 381 ? -1.921 -6.148 35.814 1.00 19.77 ? 689 MET C CG 1 ATOM 8426 S SD . MET C 1 381 ? -1.697 -4.358 35.791 1.00 23.19 ? 689 MET C SD 1 ATOM 8427 C CE . MET C 1 381 ? -3.273 -3.821 35.140 1.00 18.10 ? 689 MET C CE 1 ATOM 8428 N N . PRO C 1 382 ? -3.952 -5.737 39.873 1.00 20.72 ? 690 PRO C N 1 ATOM 8429 C CA . PRO C 1 382 ? -4.744 -5.946 41.092 1.00 22.44 ? 690 PRO C CA 1 ATOM 8430 C C . PRO C 1 382 ? -5.904 -6.927 40.935 1.00 21.19 ? 690 PRO C C 1 ATOM 8431 O O . PRO C 1 382 ? -6.338 -7.513 41.922 1.00 19.95 ? 690 PRO C O 1 ATOM 8432 C CB . PRO C 1 382 ? -5.279 -4.545 41.411 1.00 23.89 ? 690 PRO C CB 1 ATOM 8433 C CG . PRO C 1 382 ? -5.290 -3.833 40.108 1.00 21.06 ? 690 PRO C CG 1 ATOM 8434 C CD . PRO C 1 382 ? -4.129 -4.383 39.318 1.00 21.37 ? 690 PRO C CD 1 ATOM 8435 N N . HIS C 1 383 ? -6.415 -7.089 39.721 1.00 19.60 ? 691 HIS C N 1 ATOM 8436 C CA . HIS C 1 383 ? -7.527 -8.009 39.509 1.00 22.27 ? 691 HIS C CA 1 ATOM 8437 C C . HIS C 1 383 ? -7.106 -9.149 38.592 1.00 22.07 ? 691 HIS C C 1 ATOM 8438 O O . HIS C 1 383 ? -6.676 -10.198 39.067 1.00 26.15 ? 691 HIS C O 1 ATOM 8439 C CB . HIS C 1 383 ? -8.754 -7.252 38.999 1.00 23.17 ? 691 HIS C CB 1 ATOM 8440 C CG . HIS C 1 383 ? -9.285 -6.264 39.991 1.00 28.01 ? 691 HIS C CG 1 ATOM 8441 N ND1 . HIS C 1 383 ? -9.117 -4.903 39.853 1.00 29.13 ? 691 HIS C ND1 1 ATOM 8442 C CD2 . HIS C 1 383 ? -9.943 -6.445 41.161 1.00 30.07 ? 691 HIS C CD2 1 ATOM 8443 C CE1 . HIS C 1 383 ? -9.669 -4.286 40.883 1.00 29.35 ? 691 HIS C CE1 1 ATOM 8444 N NE2 . HIS C 1 383 ? -10.175 -5.199 41.693 1.00 31.77 ? 691 HIS C NE2 1 ATOM 8445 N N . THR C 1 384 ? -7.201 -8.945 37.286 1.00 19.79 ? 692 THR C N 1 ATOM 8446 C CA . THR C 1 384 ? -6.596 -9.895 36.359 1.00 17.29 ? 692 THR C CA 1 ATOM 8447 C C . THR C 1 384 ? -5.646 -9.163 35.412 1.00 17.35 ? 692 THR C C 1 ATOM 8448 O O . THR C 1 384 ? -5.820 -7.972 35.160 1.00 17.45 ? 692 THR C O 1 ATOM 8449 C CB . THR C 1 384 ? -7.657 -10.708 35.575 1.00 18.26 ? 692 THR C CB 1 ATOM 8450 O OG1 . THR C 1 384 ? -7.000 -11.640 34.709 1.00 19.02 ? 692 THR C OG1 1 ATOM 8451 C CG2 . THR C 1 384 ? -8.564 -9.794 34.747 1.00 17.57 ? 692 THR C CG2 1 ATOM 8452 N N . PHE C 1 385 ? -4.633 -9.868 34.905 1.00 17.69 ? 693 PHE C N 1 ATOM 8453 C CA . PHE C 1 385 ? -3.749 -9.296 33.891 1.00 17.59 ? 693 PHE C CA 1 ATOM 8454 C C . PHE C 1 385 ? -4.475 -9.272 32.557 1.00 16.94 ? 693 PHE C C 1 ATOM 8455 O O . PHE C 1 385 ? -4.110 -8.520 31.650 1.00 15.34 ? 693 PHE C O 1 ATOM 8456 C CB . PHE C 1 385 ? -2.430 -10.078 33.771 1.00 18.25 ? 693 PHE C CB 1 ATOM 8457 C CG . PHE C 1 385 ? -2.531 -11.340 32.947 1.00 17.66 ? 693 PHE C CG 1 ATOM 8458 C CD1 . PHE C 1 385 ? -2.146 -11.347 31.610 1.00 17.66 ? 693 PHE C CD1 1 ATOM 8459 C CD2 . PHE C 1 385 ? -3.000 -12.520 33.511 1.00 20.85 ? 693 PHE C CD2 1 ATOM 8460 C CE1 . PHE C 1 385 ? -2.243 -12.501 30.844 1.00 18.57 ? 693 PHE C CE1 1 ATOM 8461 C CE2 . PHE C 1 385 ? -3.089 -13.687 32.755 1.00 20.60 ? 693 PHE C CE2 1 ATOM 8462 C CZ . PHE C 1 385 ? -2.714 -13.678 31.419 1.00 19.63 ? 693 PHE C CZ 1 ATOM 8463 N N . PHE C 1 386 ? -5.517 -10.090 32.441 1.00 14.68 ? 694 PHE C N 1 ATOM 8464 C CA . PHE C 1 386 ? -6.261 -10.134 31.191 1.00 15.02 ? 694 PHE C CA 1 ATOM 8465 C C . PHE C 1 386 ? -7.136 -8.907 30.949 1.00 16.66 ? 694 PHE C C 1 ATOM 8466 O O . PHE C 1 386 ? -7.643 -8.285 31.888 1.00 17.60 ? 694 PHE C O 1 ATOM 8467 C CB . PHE C 1 386 ? -7.057 -11.435 31.039 1.00 15.15 ? 694 PHE C CB 1 ATOM 8468 C CG . PHE C 1 386 ? -6.790 -12.120 29.742 1.00 18.38 ? 694 PHE C CG 1 ATOM 8469 C CD1 . PHE C 1 386 ? -7.681 -12.001 28.685 1.00 18.14 ? 694 PHE C CD1 1 ATOM 8470 C CD2 . PHE C 1 386 ? -5.608 -12.818 29.550 1.00 21.09 ? 694 PHE C CD2 1 ATOM 8471 C CE1 . PHE C 1 386 ? -7.412 -12.593 27.465 1.00 19.69 ? 694 PHE C CE1 1 ATOM 8472 C CE2 . PHE C 1 386 ? -5.332 -13.417 28.337 1.00 18.77 ? 694 PHE C CE2 1 ATOM 8473 C CZ . PHE C 1 386 ? -6.238 -13.307 27.290 1.00 18.55 ? 694 PHE C CZ 1 ATOM 8474 N N . ILE C 1 387 ? -7.295 -8.561 29.674 1.00 15.04 ? 695 ILE C N 1 ATOM 8475 C CA . ILE C 1 387 ? -8.092 -7.412 29.277 1.00 15.32 ? 695 ILE C CA 1 ATOM 8476 C C . ILE C 1 387 ? -8.665 -7.696 27.887 1.00 15.41 ? 695 ILE C C 1 ATOM 8477 O O . ILE C 1 387 ? -8.210 -8.606 27.196 1.00 17.67 ? 695 ILE C O 1 ATOM 8478 C CB . ILE C 1 387 ? -7.225 -6.124 29.278 1.00 17.98 ? 695 ILE C CB 1 ATOM 8479 C CG1 . ILE C 1 387 ? -8.080 -4.855 29.123 1.00 18.71 ? 695 ILE C CG1 1 ATOM 8480 C CG2 . ILE C 1 387 ? -6.146 -6.204 28.203 1.00 17.32 ? 695 ILE C CG2 1 ATOM 8481 C CD1 . ILE C 1 387 ? -9.124 -4.658 30.226 1.00 15.73 ? 695 ILE C CD1 1 ATOM 8482 N N . GLY C 1 388 ? -9.674 -6.939 27.481 1.00 15.03 ? 696 GLY C N 1 ATOM 8483 C CA . GLY C 1 388 ? -10.229 -7.093 26.147 1.00 14.21 ? 696 GLY C CA 1 ATOM 8484 C C . GLY C 1 388 ? -10.817 -5.776 25.690 1.00 15.08 ? 696 GLY C C 1 ATOM 8485 O O . GLY C 1 388 ? -11.233 -4.968 26.518 1.00 17.45 ? 696 GLY C O 1 ATOM 8486 N N . ASP C 1 389 ? -10.858 -5.558 24.381 1.00 10.84 ? 697 ASP C N 1 ATOM 8487 C CA . ASP C 1 389 ? -11.374 -4.300 23.839 1.00 10.58 ? 697 ASP C CA 1 ATOM 8488 C C . ASP C 1 389 ? -12.864 -4.358 23.498 1.00 16.12 ? 697 ASP C C 1 ATOM 8489 O O . ASP C 1 389 ? -13.384 -3.486 22.792 1.00 15.16 ? 697 ASP C O 1 ATOM 8490 C CB . ASP C 1 389 ? -10.586 -3.886 22.591 1.00 11.96 ? 697 ASP C CB 1 ATOM 8491 C CG . ASP C 1 389 ? -10.678 -2.404 22.323 1.00 16.89 ? 697 ASP C CG 1 ATOM 8492 O OD1 . ASP C 1 389 ? -10.540 -1.627 23.297 1.00 19.53 ? 697 ASP C OD1 1 ATOM 8493 O OD2 . ASP C 1 389 ? -10.904 -2.017 21.155 1.00 17.79 ? 697 ASP C OD2 1 ATOM 8494 N N . HIS C 1 390 ? -13.545 -5.378 24.016 1.00 13.65 ? 698 HIS C N 1 ATOM 8495 C CA . HIS C 1 390 ? -14.929 -5.667 23.645 1.00 11.26 ? 698 HIS C CA 1 ATOM 8496 C C . HIS C 1 390 ? -15.905 -4.505 23.826 1.00 12.60 ? 698 HIS C C 1 ATOM 8497 O O . HIS C 1 390 ? -16.842 -4.368 23.049 1.00 17.02 ? 698 HIS C O 1 ATOM 8498 C CB . HIS C 1 390 ? -15.441 -6.876 24.430 1.00 14.24 ? 698 HIS C CB 1 ATOM 8499 C CG . HIS C 1 390 ? -14.666 -8.132 24.176 1.00 15.65 ? 698 HIS C CG 1 ATOM 8500 N ND1 . HIS C 1 390 ? -13.339 -8.274 24.527 1.00 15.95 ? 698 HIS C ND1 1 ATOM 8501 C CD2 . HIS C 1 390 ? -15.030 -9.300 23.597 1.00 17.29 ? 698 HIS C CD2 1 ATOM 8502 C CE1 . HIS C 1 390 ? -12.920 -9.477 24.174 1.00 15.78 ? 698 HIS C CE1 1 ATOM 8503 N NE2 . HIS C 1 390 ? -13.927 -10.121 23.610 1.00 15.67 ? 698 HIS C NE2 1 ATOM 8504 N N . ALA C 1 391 ? -15.712 -3.683 24.853 1.00 13.73 ? 699 ALA C N 1 ATOM 8505 C CA . ALA C 1 391 ? -16.651 -2.577 25.086 1.00 16.15 ? 699 ALA C CA 1 ATOM 8506 C C . ALA C 1 391 ? -16.537 -1.528 23.982 1.00 18.67 ? 699 ALA C C 1 ATOM 8507 O O . ALA C 1 391 ? -17.493 -0.807 23.694 1.00 20.75 ? 699 ALA C O 1 ATOM 8508 C CB . ALA C 1 391 ? -16.424 -1.938 26.460 1.00 14.50 ? 699 ALA C CB 1 ATOM 8509 N N . ASN C 1 392 ? -15.364 -1.457 23.359 1.00 16.78 ? 700 ASN C N 1 ATOM 8510 C CA . ASN C 1 392 ? -15.137 -0.536 22.243 1.00 17.94 ? 700 ASN C CA 1 ATOM 8511 C C . ASN C 1 392 ? -15.426 -1.174 20.880 1.00 18.19 ? 700 ASN C C 1 ATOM 8512 O O . ASN C 1 392 ? -15.956 -0.526 19.980 1.00 19.20 ? 700 ASN C O 1 ATOM 8513 C CB . ASN C 1 392 ? -13.699 0.001 22.282 1.00 20.83 ? 700 ASN C CB 1 ATOM 8514 C CG . ASN C 1 392 ? -13.335 0.803 21.041 1.00 27.23 ? 700 ASN C CG 1 ATOM 8515 O OD1 . ASN C 1 392 ? -13.891 1.879 20.801 1.00 29.70 ? 700 ASN C OD1 1 ATOM 8516 N ND2 . ASN C 1 392 ? -12.381 0.294 20.256 1.00 24.12 ? 700 ASN C ND2 1 ATOM 8517 N N . MET C 1 393 ? -15.071 -2.446 20.730 1.00 18.22 ? 701 MET C N 1 ATOM 8518 C CA . MET C 1 393 ? -15.261 -3.139 19.457 1.00 17.78 ? 701 MET C CA 1 ATOM 8519 C C . MET C 1 393 ? -16.692 -3.595 19.233 1.00 13.80 ? 701 MET C C 1 ATOM 8520 O O . MET C 1 393 ? -17.188 -3.556 18.111 1.00 15.21 ? 701 MET C O 1 ATOM 8521 C CB . MET C 1 393 ? -14.348 -4.360 19.361 1.00 16.54 ? 701 MET C CB 1 ATOM 8522 C CG . MET C 1 393 ? -12.919 -4.042 19.012 1.00 18.48 ? 701 MET C CG 1 ATOM 8523 S SD . MET C 1 393 ? -11.904 -5.529 18.947 1.00 17.86 ? 701 MET C SD 1 ATOM 8524 C CE . MET C 1 393 ? -12.591 -6.385 17.539 1.00 16.71 ? 701 MET C CE 1 ATOM 8525 N N . PHE C 1 394 ? -17.344 -4.049 20.298 1.00 13.97 ? 702 PHE C N 1 ATOM 8526 C CA . PHE C 1 394 ? -18.692 -4.595 20.179 1.00 14.03 ? 702 PHE C CA 1 ATOM 8527 C C . PHE C 1 394 ? -19.704 -3.930 21.119 1.00 12.81 ? 702 PHE C C 1 ATOM 8528 O O . PHE C 1 394 ? -20.370 -4.619 21.900 1.00 12.95 ? 702 PHE C O 1 ATOM 8529 C CB . PHE C 1 394 ? -18.669 -6.108 20.444 1.00 14.27 ? 702 PHE C CB 1 ATOM 8530 C CG . PHE C 1 394 ? -17.530 -6.833 19.762 1.00 18.11 ? 702 PHE C CG 1 ATOM 8531 C CD1 . PHE C 1 394 ? -17.446 -6.878 18.376 1.00 17.19 ? 702 PHE C CD1 1 ATOM 8532 C CD2 . PHE C 1 394 ? -16.559 -7.490 20.510 1.00 17.55 ? 702 PHE C CD2 1 ATOM 8533 C CE1 . PHE C 1 394 ? -16.398 -7.561 17.748 1.00 17.40 ? 702 PHE C CE1 1 ATOM 8534 C CE2 . PHE C 1 394 ? -15.512 -8.170 19.892 1.00 17.83 ? 702 PHE C CE2 1 ATOM 8535 C CZ . PHE C 1 394 ? -15.437 -8.207 18.507 1.00 18.84 ? 702 PHE C CZ 1 ATOM 8536 N N . PRO C 1 395 ? -19.858 -2.598 21.024 1.00 15.20 ? 703 PRO C N 1 ATOM 8537 C CA . PRO C 1 395 ? -20.770 -1.905 21.941 1.00 16.28 ? 703 PRO C CA 1 ATOM 8538 C C . PRO C 1 395 ? -22.232 -2.227 21.653 1.00 16.64 ? 703 PRO C C 1 ATOM 8539 O O . PRO C 1 395 ? -23.105 -2.006 22.501 1.00 16.08 ? 703 PRO C O 1 ATOM 8540 C CB . PRO C 1 395 ? -20.496 -0.430 21.647 1.00 14.78 ? 703 PRO C CB 1 ATOM 8541 C CG . PRO C 1 395 ? -20.074 -0.415 20.215 1.00 14.79 ? 703 PRO C CG 1 ATOM 8542 C CD . PRO C 1 395 ? -19.293 -1.680 20.014 1.00 13.12 ? 703 PRO C CD 1 ATOM 8543 N N . HIS C 1 396 ? -22.500 -2.761 20.469 1.00 14.62 ? 704 HIS C N 1 ATOM 8544 C CA . HIS C 1 396 ? -23.868 -3.115 20.110 1.00 13.05 ? 704 HIS C CA 1 ATOM 8545 C C . HIS C 1 396 ? -24.371 -4.316 20.905 1.00 12.11 ? 704 HIS C C 1 ATOM 8546 O O . HIS C 1 396 ? -25.566 -4.605 20.902 1.00 15.65 ? 704 HIS C O 1 ATOM 8547 C CB . HIS C 1 396 ? -23.998 -3.360 18.604 1.00 14.96 ? 704 HIS C CB 1 ATOM 8548 C CG . HIS C 1 396 ? -23.148 -4.485 18.085 1.00 17.87 ? 704 HIS C CG 1 ATOM 8549 N ND1 . HIS C 1 396 ? -21.775 -4.509 18.216 1.00 17.35 ? 704 HIS C ND1 1 ATOM 8550 C CD2 . HIS C 1 396 ? -23.480 -5.606 17.398 1.00 18.94 ? 704 HIS C CD2 1 ATOM 8551 C CE1 . HIS C 1 396 ? -21.300 -5.608 17.651 1.00 15.87 ? 704 HIS C CE1 1 ATOM 8552 N NE2 . HIS C 1 396 ? -22.314 -6.289 17.145 1.00 16.79 ? 704 HIS C NE2 1 ATOM 8553 N N . LEU C 1 397 ? -23.457 -5.007 21.584 1.00 13.23 ? 705 LEU C N 1 ATOM 8554 C CA . LEU C 1 397 ? -23.800 -6.164 22.411 1.00 16.20 ? 705 LEU C CA 1 ATOM 8555 C C . LEU C 1 397 ? -23.970 -5.799 23.885 1.00 18.72 ? 705 LEU C C 1 ATOM 8556 O O . LEU C 1 397 ? -24.200 -6.675 24.715 1.00 17.27 ? 705 LEU C O 1 ATOM 8557 C CB . LEU C 1 397 ? -22.744 -7.278 22.273 1.00 16.39 ? 705 LEU C CB 1 ATOM 8558 C CG . LEU C 1 397 ? -22.475 -7.730 20.838 1.00 15.99 ? 705 LEU C CG 1 ATOM 8559 C CD1 . LEU C 1 397 ? -21.430 -8.850 20.786 1.00 14.20 ? 705 LEU C CD1 1 ATOM 8560 C CD2 . LEU C 1 397 ? -23.771 -8.155 20.144 1.00 15.84 ? 705 LEU C CD2 1 ATOM 8561 N N . LYS C 1 398 ? -23.857 -4.511 24.209 1.00 17.97 ? 706 LYS C N 1 ATOM 8562 C CA . LYS C 1 398 ? -24.069 -4.061 25.584 1.00 17.50 ? 706 LYS C CA 1 ATOM 8563 C C . LYS C 1 398 ? -25.514 -4.266 26.023 1.00 17.41 ? 706 LYS C C 1 ATOM 8564 O O . LYS C 1 398 ? -25.789 -4.471 27.203 1.00 20.37 ? 706 LYS C O 1 ATOM 8565 C CB . LYS C 1 398 ? -23.687 -2.587 25.743 1.00 20.50 ? 706 LYS C CB 1 ATOM 8566 C CG . LYS C 1 398 ? -22.197 -2.316 25.719 1.00 27.67 ? 706 LYS C CG 1 ATOM 8567 C CD . LYS C 1 398 ? -21.929 -0.819 25.864 1.00 35.47 ? 706 LYS C CD 1 ATOM 8568 C CE . LYS C 1 398 ? -20.461 -0.530 26.130 1.00 41.74 ? 706 LYS C CE 1 ATOM 8569 N NZ . LYS C 1 398 ? -19.601 -1.004 25.018 1.00 44.31 ? 706 LYS C NZ 1 ATOM 8570 N N . LYS C 1 399 ? -26.434 -4.207 25.065 1.00 15.57 ? 707 LYS C N 1 ATOM 8571 C CA . LYS C 1 399 ? -27.846 -4.406 25.348 1.00 18.51 ? 707 LYS C CA 1 ATOM 8572 C C . LYS C 1 399 ? -28.435 -5.355 24.316 1.00 18.70 ? 707 LYS C C 1 ATOM 8573 O O . LYS C 1 399 ? -27.862 -5.551 23.241 1.00 15.96 ? 707 LYS C O 1 ATOM 8574 C CB . LYS C 1 399 ? -28.595 -3.068 25.338 1.00 23.97 ? 707 LYS C CB 1 ATOM 8575 C CG . LYS C 1 399 ? -28.162 -2.129 26.450 1.00 31.96 ? 707 LYS C CG 1 ATOM 8576 C CD . LYS C 1 399 ? -28.909 -0.815 26.388 1.00 39.81 ? 707 LYS C CD 1 ATOM 8577 C CE . LYS C 1 399 ? -28.363 0.170 27.401 1.00 45.07 ? 707 LYS C CE 1 ATOM 8578 N NZ . LYS C 1 399 ? -28.981 1.512 27.224 1.00 51.38 ? 707 LYS C NZ 1 ATOM 8579 N N . LYS C 1 400 ? -29.565 -5.967 24.652 1.00 17.86 ? 708 LYS C N 1 ATOM 8580 C CA . LYS C 1 400 ? -30.223 -6.869 23.713 1.00 15.86 ? 708 LYS C CA 1 ATOM 8581 C C . LYS C 1 400 ? -31.723 -6.799 23.876 1.00 17.29 ? 708 LYS C C 1 ATOM 8582 O O . LYS C 1 400 ? -32.221 -6.269 24.863 1.00 19.84 ? 708 LYS C O 1 ATOM 8583 C CB . LYS C 1 400 ? -29.730 -8.313 23.879 1.00 16.47 ? 708 LYS C CB 1 ATOM 8584 C CG . LYS C 1 400 ? -30.182 -9.032 25.154 1.00 21.73 ? 708 LYS C CG 1 ATOM 8585 C CD . LYS C 1 400 ? -29.615 -10.454 25.183 1.00 23.06 ? 708 LYS C CD 1 ATOM 8586 C CE . LYS C 1 400 ? -30.000 -11.202 26.447 1.00 30.54 ? 708 LYS C CE 1 ATOM 8587 N NZ . LYS C 1 400 ? -29.400 -10.602 27.667 1.00 32.65 ? 708 LYS C NZ 1 ATOM 8588 N N . ALA C 1 401 ? -32.441 -7.303 22.882 1.00 18.85 ? 709 ALA C N 1 ATOM 8589 C CA . ALA C 1 401 ? -33.869 -7.544 23.024 1.00 16.35 ? 709 ALA C CA 1 ATOM 8590 C C . ALA C 1 401 ? -34.138 -8.935 22.476 1.00 16.09 ? 709 ALA C C 1 ATOM 8591 O O . ALA C 1 401 ? -33.320 -9.484 21.747 1.00 18.49 ? 709 ALA C O 1 ATOM 8592 C CB . ALA C 1 401 ? -34.684 -6.503 22.277 1.00 17.18 ? 709 ALA C CB 1 ATOM 8593 N N . VAL C 1 402 ? -35.267 -9.522 22.848 1.00 19.17 ? 710 VAL C N 1 ATOM 8594 C CA . VAL C 1 402 ? -35.611 -10.826 22.313 1.00 21.90 ? 710 VAL C CA 1 ATOM 8595 C C . VAL C 1 402 ? -36.989 -10.794 21.679 1.00 22.09 ? 710 VAL C C 1 ATOM 8596 O O . VAL C 1 402 ? -37.776 -9.876 21.909 1.00 25.94 ? 710 VAL C O 1 ATOM 8597 C CB . VAL C 1 402 ? -35.541 -11.931 23.390 1.00 21.91 ? 710 VAL C CB 1 ATOM 8598 C CG1 . VAL C 1 402 ? -34.112 -12.070 23.911 1.00 18.21 ? 710 VAL C CG1 1 ATOM 8599 C CG2 . VAL C 1 402 ? -36.507 -11.629 24.521 1.00 22.08 ? 710 VAL C CG2 1 ATOM 8600 N N . ILE C 1 403 ? -37.268 -11.797 20.859 1.00 24.43 ? 711 ILE C N 1 ATOM 8601 C CA . ILE C 1 403 ? -38.588 -11.949 20.277 1.00 27.00 ? 711 ILE C CA 1 ATOM 8602 C C . ILE C 1 403 ? -39.209 -13.182 20.902 1.00 32.12 ? 711 ILE C C 1 ATOM 8603 O O . ILE C 1 403 ? -38.619 -14.261 20.860 1.00 33.24 ? 711 ILE C O 1 ATOM 8604 C CB . ILE C 1 403 ? -38.524 -12.142 18.751 1.00 29.61 ? 711 ILE C CB 1 ATOM 8605 C CG1 . ILE C 1 403 ? -38.065 -10.855 18.064 1.00 31.21 ? 711 ILE C CG1 1 ATOM 8606 C CG2 . ILE C 1 403 ? -39.881 -12.582 18.214 1.00 33.52 ? 711 ILE C CG2 1 ATOM 8607 C CD1 . ILE C 1 403 ? -38.040 -10.951 16.540 1.00 32.28 ? 711 ILE C CD1 1 ATOM 8608 N N . ASP C 1 404 ? -40.387 -13.020 21.496 1.00 35.73 ? 712 ASP C N 1 ATOM 8609 C CA . ASP C 1 404 ? -41.097 -14.150 22.081 1.00 42.88 ? 712 ASP C CA 1 ATOM 8610 C C . ASP C 1 404 ? -41.852 -14.911 20.995 1.00 50.07 ? 712 ASP C C 1 ATOM 8611 O O . ASP C 1 404 ? -42.902 -14.466 20.526 1.00 55.06 ? 712 ASP C O 1 ATOM 8612 C CB . ASP C 1 404 ? -42.063 -13.680 23.166 1.00 46.40 ? 712 ASP C CB 1 ATOM 8613 C CG . ASP C 1 404 ? -42.797 -14.829 23.823 1.00 53.11 ? 712 ASP C CG 1 ATOM 8614 O OD1 . ASP C 1 404 ? -43.915 -14.604 24.336 1.00 57.60 ? 712 ASP C OD1 1 ATOM 8615 O OD2 . ASP C 1 404 ? -42.254 -15.957 23.823 1.00 52.91 ? 712 ASP C OD2 1 ATOM 8616 N N . PHE C 1 405 ? -41.310 -16.060 20.602 1.00 51.93 ? 713 PHE C N 1 ATOM 8617 C CA . PHE C 1 405 ? -41.871 -16.846 19.509 1.00 57.38 ? 713 PHE C CA 1 ATOM 8618 C C . PHE C 1 405 ? -42.857 -17.906 19.998 1.00 65.88 ? 713 PHE C C 1 ATOM 8619 O O . PHE C 1 405 ? -43.188 -18.841 19.267 1.00 69.77 ? 713 PHE C O 1 ATOM 8620 C CB . PHE C 1 405 ? -40.755 -17.489 18.677 1.00 55.81 ? 713 PHE C CB 1 ATOM 8621 C CG . PHE C 1 405 ? -39.992 -18.561 19.404 1.00 58.13 ? 713 PHE C CG 1 ATOM 8622 C CD1 . PHE C 1 405 ? -39.083 -18.233 20.400 1.00 55.37 ? 713 PHE C CD1 1 ATOM 8623 C CD2 . PHE C 1 405 ? -40.172 -19.897 19.083 1.00 62.30 ? 713 PHE C CD2 1 ATOM 8624 C CE1 . PHE C 1 405 ? -38.381 -19.217 21.069 1.00 55.59 ? 713 PHE C CE1 1 ATOM 8625 C CE2 . PHE C 1 405 ? -39.469 -20.889 19.747 1.00 62.39 ? 713 PHE C CE2 1 ATOM 8626 C CZ . PHE C 1 405 ? -38.572 -20.548 20.740 1.00 59.33 ? 713 PHE C CZ 1 ATOM 8627 N N . LYS C 1 406 ? -43.327 -17.751 21.232 1.00 68.93 ? 714 LYS C N 1 ATOM 8628 C CA . LYS C 1 406 ? -44.326 -18.659 21.794 1.00 74.49 ? 714 LYS C CA 1 ATOM 8629 C C . LYS C 1 406 ? -45.553 -17.897 22.289 1.00 74.86 ? 714 LYS C C 1 ATOM 8630 O O . LYS C 1 406 ? -45.929 -17.994 23.458 1.00 76.52 ? 714 LYS C O 1 ATOM 8631 C CB . LYS C 1 406 ? -43.726 -19.491 22.931 1.00 76.30 ? 714 LYS C CB 1 ATOM 8632 C CG . LYS C 1 406 ? -42.591 -20.410 22.502 1.00 75.59 ? 714 LYS C CG 1 ATOM 8633 C CD . LYS C 1 406 ? -42.158 -21.326 23.639 1.00 77.69 ? 714 LYS C CD 1 ATOM 8634 C CE . LYS C 1 406 ? -41.084 -22.305 23.185 1.00 76.88 ? 714 LYS C CE 1 ATOM 8635 N NZ . LYS C 1 406 ? -40.712 -23.270 24.258 1.00 78.80 ? 714 LYS C NZ 1 ATOM 8636 N N . HIS C 1 410 ? -43.118 -19.783 27.478 1.00 74.00 ? 718 HIS C N 1 ATOM 8637 C CA . HIS C 1 410 ? -42.362 -18.931 28.389 1.00 70.26 ? 718 HIS C CA 1 ATOM 8638 C C . HIS C 1 410 ? -41.443 -17.986 27.628 1.00 58.00 ? 718 HIS C C 1 ATOM 8639 O O . HIS C 1 410 ? -41.396 -18.015 26.400 1.00 56.42 ? 718 HIS C O 1 ATOM 8640 C CB . HIS C 1 410 ? -41.554 -19.780 29.374 1.00 76.02 ? 718 HIS C CB 1 ATOM 8641 C CG . HIS C 1 410 ? -42.401 -20.574 30.319 1.00 85.79 ? 718 HIS C CG 1 ATOM 8642 N ND1 . HIS C 1 410 ? -42.843 -20.071 31.524 1.00 89.40 ? 718 HIS C ND1 1 ATOM 8643 C CD2 . HIS C 1 410 ? -42.892 -21.833 30.234 1.00 92.56 ? 718 HIS C CD2 1 ATOM 8644 C CE1 . HIS C 1 410 ? -43.568 -20.987 32.142 1.00 96.12 ? 718 HIS C CE1 1 ATOM 8645 N NE2 . HIS C 1 410 ? -43.613 -22.066 31.380 1.00 97.97 ? 718 HIS C NE2 1 ATOM 8646 N N . ILE C 1 411 ? -40.717 -17.150 28.364 1.00 51.88 ? 719 ILE C N 1 ATOM 8647 C CA . ILE C 1 411 ? -39.804 -16.181 27.756 1.00 45.33 ? 719 ILE C CA 1 ATOM 8648 C C . ILE C 1 411 ? -38.345 -16.628 27.869 1.00 39.79 ? 719 ILE C C 1 ATOM 8649 O O . ILE C 1 411 ? -37.874 -16.974 28.949 1.00 43.69 ? 719 ILE C O 1 ATOM 8650 C CB . ILE C 1 411 ? -39.989 -14.784 28.379 1.00 45.97 ? 719 ILE C CB 1 ATOM 8651 C CG1 . ILE C 1 411 ? -41.439 -14.325 28.201 1.00 49.67 ? 719 ILE C CG1 1 ATOM 8652 C CG2 . ILE C 1 411 ? -39.012 -13.781 27.766 1.00 41.83 ? 719 ILE C CG2 1 ATOM 8653 C CD1 . ILE C 1 411 ? -41.775 -13.043 28.917 1.00 50.72 ? 719 ILE C CD1 1 ATOM 8654 N N . TYR C 1 412 ? -37.641 -16.628 26.740 1.00 34.79 ? 720 TYR C N 1 ATOM 8655 C CA . TYR C 1 412 ? -36.251 -17.071 26.684 1.00 32.37 ? 720 TYR C CA 1 ATOM 8656 C C . TYR C 1 412 ? -35.347 -15.882 26.395 1.00 29.10 ? 720 TYR C C 1 ATOM 8657 O O . TYR C 1 412 ? -35.703 -15.012 25.596 1.00 24.62 ? 720 TYR C O 1 ATOM 8658 C CB . TYR C 1 412 ? -36.065 -18.081 25.553 1.00 33.15 ? 720 TYR C CB 1 ATOM 8659 C CG . TYR C 1 412 ? -36.773 -19.403 25.723 1.00 38.33 ? 720 TYR C CG 1 ATOM 8660 C CD1 . TYR C 1 412 ? -36.724 -20.099 26.922 1.00 40.13 ? 720 TYR C CD1 1 ATOM 8661 C CD2 . TYR C 1 412 ? -37.473 -19.969 24.665 1.00 43.11 ? 720 TYR C CD2 1 ATOM 8662 C CE1 . TYR C 1 412 ? -37.373 -21.320 27.067 1.00 47.11 ? 720 TYR C CE1 1 ATOM 8663 C CE2 . TYR C 1 412 ? -38.112 -21.182 24.792 1.00 47.02 ? 720 TYR C CE2 1 ATOM 8664 C CZ . TYR C 1 412 ? -38.062 -21.855 25.995 1.00 51.43 ? 720 TYR C CZ 1 ATOM 8665 O OH . TYR C 1 412 ? -38.710 -23.063 26.116 1.00 58.43 ? 720 TYR C OH 1 ATOM 8666 N N . ASP C 1 413 ? -34.170 -15.847 27.010 1.00 23.60 ? 721 ASP C N 1 ATOM 8667 C CA . ASP C 1 413 ? -33.247 -14.740 26.745 1.00 20.46 ? 721 ASP C CA 1 ATOM 8668 C C . ASP C 1 413 ? -32.235 -15.062 25.645 1.00 24.98 ? 721 ASP C C 1 ATOM 8669 O O . ASP C 1 413 ? -31.357 -14.246 25.358 1.00 20.95 ? 721 ASP C O 1 ATOM 8670 C CB . ASP C 1 413 ? -32.509 -14.309 28.020 1.00 27.23 ? 721 ASP C CB 1 ATOM 8671 C CG . ASP C 1 413 ? -31.479 -15.335 28.494 1.00 28.81 ? 721 ASP C CG 1 ATOM 8672 O OD1 . ASP C 1 413 ? -31.482 -16.479 27.997 1.00 28.85 ? 721 ASP C OD1 1 ATOM 8673 O OD2 . ASP C 1 413 ? -30.667 -15.000 29.387 1.00 28.59 ? 721 ASP C OD2 1 ATOM 8674 N N . ASN C 1 414 ? -32.346 -16.238 25.032 1.00 21.81 ? 722 ASN C N 1 ATOM 8675 C CA . ASN C 1 414 ? -31.283 -16.681 24.122 1.00 18.83 ? 722 ASN C CA 1 ATOM 8676 C C . ASN C 1 414 ? -31.714 -17.552 22.943 1.00 19.73 ? 722 ASN C C 1 ATOM 8677 O O . ASN C 1 414 ? -30.926 -18.372 22.435 1.00 18.60 ? 722 ASN C O 1 ATOM 8678 C CB . ASN C 1 414 ? -30.175 -17.387 24.915 1.00 14.30 ? 722 ASN C CB 1 ATOM 8679 C CG . ASN C 1 414 ? -30.675 -18.610 25.663 1.00 19.70 ? 722 ASN C CG 1 ATOM 8680 O OD1 . ASN C 1 414 ? -31.843 -18.983 25.563 1.00 19.18 ? 722 ASN C OD1 1 ATOM 8681 N ND2 . ASN C 1 414 ? -29.780 -19.249 26.414 1.00 18.92 ? 722 ASN C ND2 1 ATOM 8682 N N . ARG C 1 415 ? -32.956 -17.376 22.505 1.00 18.76 ? 723 ARG C N 1 ATOM 8683 C CA . ARG C 1 415 ? -33.472 -18.114 21.355 1.00 18.65 ? 723 ARG C CA 1 ATOM 8684 C C . ARG C 1 415 ? -33.494 -17.251 20.094 1.00 19.60 ? 723 ARG C C 1 ATOM 8685 O O . ARG C 1 415 ? -33.016 -17.664 19.033 1.00 18.14 ? 723 ARG C O 1 ATOM 8686 C CB . ARG C 1 415 ? -34.875 -18.655 21.650 1.00 21.87 ? 723 ARG C CB 1 ATOM 8687 C CG . ARG C 1 415 ? -34.913 -20.092 22.166 1.00 24.07 ? 723 ARG C CG 1 ATOM 8688 C CD . ARG C 1 415 ? -34.150 -20.291 23.470 1.00 25.22 ? 723 ARG C CD 1 ATOM 8689 N NE . ARG C 1 415 ? -34.444 -21.606 24.040 1.00 27.43 ? 723 ARG C NE 1 ATOM 8690 C CZ . ARG C 1 415 ? -33.990 -22.054 25.209 1.00 28.01 ? 723 ARG C CZ 1 ATOM 8691 N NH1 . ARG C 1 415 ? -33.206 -21.296 25.968 1.00 24.88 ? 723 ARG C NH1 1 ATOM 8692 N NH2 . ARG C 1 415 ? -34.327 -23.271 25.623 1.00 28.64 ? 723 ARG C NH2 1 ATOM 8693 N N . ILE C 1 416 ? -34.070 -16.055 20.215 1.00 17.16 ? 724 ILE C N 1 ATOM 8694 C CA . ILE C 1 416 ? -34.077 -15.086 19.128 1.00 19.88 ? 724 ILE C CA 1 ATOM 8695 C C . ILE C 1 416 ? -33.706 -13.734 19.696 1.00 18.39 ? 724 ILE C C 1 ATOM 8696 O O . ILE C 1 416 ? -34.443 -13.173 20.504 1.00 20.41 ? 724 ILE C O 1 ATOM 8697 C CB . ILE C 1 416 ? -35.451 -14.978 18.454 1.00 22.24 ? 724 ILE C CB 1 ATOM 8698 C CG1 . ILE C 1 416 ? -35.872 -16.343 17.898 1.00 21.32 ? 724 ILE C CG1 1 ATOM 8699 C CG2 . ILE C 1 416 ? -35.398 -13.942 17.329 1.00 24.13 ? 724 ILE C CG2 1 ATOM 8700 C CD1 . ILE C 1 416 ? -37.315 -16.407 17.480 1.00 19.84 ? 724 ILE C CD1 1 ATOM 8701 N N . VAL C 1 417 ? -32.563 -13.223 19.259 1.00 13.13 ? 725 VAL C N 1 ATOM 8702 C CA . VAL C 1 417 ? -31.944 -12.067 19.880 1.00 12.78 ? 725 VAL C CA 1 ATOM 8703 C C . VAL C 1 417 ? -31.695 -10.952 18.872 1.00 14.10 ? 725 VAL C C 1 ATOM 8704 O O . VAL C 1 417 ? -31.319 -11.218 17.732 1.00 17.18 ? 725 VAL C O 1 ATOM 8705 C CB . VAL C 1 417 ? -30.586 -12.473 20.504 1.00 13.76 ? 725 VAL C CB 1 ATOM 8706 C CG1 . VAL C 1 417 ? -29.931 -11.299 21.196 1.00 14.45 ? 725 VAL C CG1 1 ATOM 8707 C CG2 . VAL C 1 417 ? -30.769 -13.631 21.484 1.00 17.62 ? 725 VAL C CG2 1 ATOM 8708 N N . LEU C 1 418 ? -31.928 -9.711 19.296 1.00 15.32 ? 726 LEU C N 1 ATOM 8709 C CA A LEU C 1 418 ? -31.607 -8.526 18.503 0.48 15.16 ? 726 LEU C CA 1 ATOM 8710 C CA B LEU C 1 418 ? -31.571 -8.555 18.488 0.52 15.01 ? 726 LEU C CA 1 ATOM 8711 C C . LEU C 1 418 ? -30.558 -7.700 19.243 1.00 14.78 ? 726 LEU C C 1 ATOM 8712 O O . LEU C 1 418 ? -30.609 -7.595 20.471 1.00 15.43 ? 726 LEU C O 1 ATOM 8713 C CB A LEU C 1 418 ? -32.848 -7.652 18.300 0.48 16.71 ? 726 LEU C CB 1 ATOM 8714 C CB B LEU C 1 418 ? -32.806 -7.726 18.123 0.52 16.52 ? 726 LEU C CB 1 ATOM 8715 C CG A LEU C 1 418 ? -34.113 -8.208 17.640 0.48 17.60 ? 726 LEU C CG 1 ATOM 8716 C CG B LEU C 1 418 ? -33.809 -8.324 17.127 0.52 16.76 ? 726 LEU C CG 1 ATOM 8717 C CD1 A LEU C 1 418 ? -35.212 -7.161 17.661 0.48 15.71 ? 726 LEU C CD1 1 ATOM 8718 C CD1 B LEU C 1 418 ? -34.677 -9.403 17.776 0.52 15.26 ? 726 LEU C CD1 1 ATOM 8719 C CD2 A LEU C 1 418 ? -33.837 -8.647 16.222 0.48 16.70 ? 726 LEU C CD2 1 ATOM 8720 C CD2 B LEU C 1 418 ? -34.679 -7.237 16.524 0.52 15.04 ? 726 LEU C CD2 1 ATOM 8721 N N . ASN C 1 419 ? -29.624 -7.106 18.499 1.00 13.15 ? 727 ASN C N 1 ATOM 8722 C CA . ASN C 1 419 ? -28.621 -6.198 19.052 1.00 14.58 ? 727 ASN C CA 1 ATOM 8723 C C . ASN C 1 419 ? -28.424 -5.060 18.061 1.00 16.13 ? 727 ASN C C 1 ATOM 8724 O O . ASN C 1 419 ? -28.399 -5.282 16.856 1.00 17.04 ? 727 ASN C O 1 ATOM 8725 C CB . ASN C 1 419 ? -27.252 -6.875 19.201 1.00 14.17 ? 727 ASN C CB 1 ATOM 8726 C CG . ASN C 1 419 ? -27.275 -8.080 20.126 1.00 15.03 ? 727 ASN C CG 1 ATOM 8727 O OD1 . ASN C 1 419 ? -27.314 -9.216 19.671 1.00 15.12 ? 727 ASN C OD1 1 ATOM 8728 N ND2 . ASN C 1 419 ? -27.205 -7.833 21.426 1.00 15.79 ? 727 ASN C ND2 1 ATOM 8729 N N . GLY C 1 420 ? -28.243 -3.847 18.553 1.00 15.38 ? 728 GLY C N 1 ATOM 8730 C CA . GLY C 1 420 ? -27.893 -2.768 17.651 1.00 16.18 ? 728 GLY C CA 1 ATOM 8731 C C . GLY C 1 420 ? -27.723 -1.448 18.355 1.00 18.21 ? 728 GLY C C 1 ATOM 8732 O O . GLY C 1 420 ? -28.352 -1.191 19.380 1.00 16.82 ? 728 GLY C O 1 ATOM 8733 N N . ILE C 1 421 ? -26.868 -0.606 17.790 1.00 19.26 ? 729 ILE C N 1 ATOM 8734 C CA . ILE C 1 421 ? -26.698 0.751 18.285 1.00 22.13 ? 729 ILE C CA 1 ATOM 8735 C C . ILE C 1 421 ? -28.033 1.493 18.326 1.00 21.78 ? 729 ILE C C 1 ATOM 8736 O O . ILE C 1 421 ? -28.278 2.285 19.238 1.00 21.19 ? 729 ILE C O 1 ATOM 8737 C CB . ILE C 1 421 ? -25.676 1.523 17.430 1.00 24.62 ? 729 ILE C CB 1 ATOM 8738 C CG1 . ILE C 1 421 ? -24.301 0.855 17.541 1.00 27.06 ? 729 ILE C CG1 1 ATOM 8739 C CG2 . ILE C 1 421 ? -25.594 2.982 17.859 1.00 28.83 ? 729 ILE C CG2 1 ATOM 8740 C CD1 . ILE C 1 421 ? -23.793 0.748 18.960 1.00 31.35 ? 729 ILE C CD1 1 ATOM 8741 N N . ASP C 1 422 ? -28.903 1.222 17.354 1.00 16.92 ? 730 ASP C N 1 ATOM 8742 C CA . ASP C 1 422 ? -30.189 1.918 17.281 1.00 17.62 ? 730 ASP C CA 1 ATOM 8743 C C . ASP C 1 422 ? -31.369 1.042 17.723 1.00 18.13 ? 730 ASP C C 1 ATOM 8744 O O . ASP C 1 422 ? -32.522 1.326 17.401 1.00 17.26 ? 730 ASP C O 1 ATOM 8745 C CB . ASP C 1 422 ? -30.419 2.457 15.866 1.00 18.44 ? 730 ASP C CB 1 ATOM 8746 C CG . ASP C 1 422 ? -29.290 3.356 15.401 1.00 24.04 ? 730 ASP C CG 1 ATOM 8747 O OD1 . ASP C 1 422 ? -28.984 4.333 16.117 1.00 24.50 ? 730 ASP C OD1 1 ATOM 8748 O OD2 . ASP C 1 422 ? -28.691 3.077 14.338 1.00 26.83 ? 730 ASP C OD2 1 ATOM 8749 N N . LEU C 1 423 ? -31.072 -0.005 18.480 1.00 19.83 ? 731 LEU C N 1 ATOM 8750 C CA . LEU C 1 423 ? -32.094 -0.948 18.935 1.00 19.82 ? 731 LEU C CA 1 ATOM 8751 C C . LEU C 1 423 ? -33.201 -0.262 19.730 1.00 20.73 ? 731 LEU C C 1 ATOM 8752 O O . LEU C 1 423 ? -34.381 -0.581 19.571 1.00 21.72 ? 731 LEU C O 1 ATOM 8753 C CB . LEU C 1 423 ? -31.459 -2.046 19.790 1.00 19.02 ? 731 LEU C CB 1 ATOM 8754 C CG . LEU C 1 423 ? -32.433 -3.087 20.353 1.00 21.84 ? 731 LEU C CG 1 ATOM 8755 C CD1 . LEU C 1 423 ? -33.206 -3.742 19.231 1.00 20.01 ? 731 LEU C CD1 1 ATOM 8756 C CD2 . LEU C 1 423 ? -31.700 -4.136 21.173 1.00 25.06 ? 731 LEU C CD2 1 ATOM 8757 N N . LYS C 1 424 ? -32.816 0.680 20.585 1.00 19.75 ? 732 LYS C N 1 ATOM 8758 C CA . LYS C 1 424 ? -33.793 1.372 21.413 1.00 20.70 ? 732 LYS C CA 1 ATOM 8759 C C . LYS C 1 424 ? -34.822 2.113 20.562 1.00 20.98 ? 732 LYS C C 1 ATOM 8760 O O . LYS C 1 424 ? -36.020 1.997 20.798 1.00 21.50 ? 732 LYS C O 1 ATOM 8761 C CB . LYS C 1 424 ? -33.112 2.336 22.379 1.00 24.68 ? 732 LYS C CB 1 ATOM 8762 C CG . LYS C 1 424 ? -34.087 3.027 23.329 1.00 32.15 ? 732 LYS C CG 1 ATOM 8763 C CD . LYS C 1 424 ? -33.378 4.029 24.222 1.00 38.86 ? 732 LYS C CD 1 ATOM 8764 C CE . LYS C 1 424 ? -34.370 4.797 25.077 1.00 45.48 ? 732 LYS C CE 1 ATOM 8765 N NZ . LYS C 1 424 ? -33.703 5.884 25.846 1.00 49.63 ? 732 LYS C NZ 1 ATOM 8766 N N . ALA C 1 425 ? -34.347 2.875 19.577 1.00 18.67 ? 733 ALA C N 1 ATOM 8767 C CA . ALA C 1 425 ? -35.235 3.601 18.677 1.00 22.78 ? 733 ALA C CA 1 ATOM 8768 C C . ALA C 1 425 ? -36.156 2.648 17.910 1.00 20.37 ? 733 ALA C C 1 ATOM 8769 O O . ALA C 1 425 ? -37.336 2.932 17.723 1.00 21.38 ? 733 ALA C O 1 ATOM 8770 C CB . ALA C 1 425 ? -34.431 4.471 17.715 1.00 24.79 ? 733 ALA C CB 1 ATOM 8771 N N . PHE C 1 426 ? -35.611 1.522 17.467 1.00 17.76 ? 734 PHE C N 1 ATOM 8772 C CA . PHE C 1 426 ? -36.418 0.499 16.812 1.00 20.87 ? 734 PHE C CA 1 ATOM 8773 C C . PHE C 1 426 ? -37.516 -0.018 17.737 1.00 18.57 ? 734 PHE C C 1 ATOM 8774 O O . PHE C 1 426 ? -38.677 -0.107 17.344 1.00 20.40 ? 734 PHE C O 1 ATOM 8775 C CB . PHE C 1 426 ? -35.542 -0.670 16.361 1.00 21.69 ? 734 PHE C CB 1 ATOM 8776 C CG . PHE C 1 426 ? -36.322 -1.840 15.826 1.00 21.96 ? 734 PHE C CG 1 ATOM 8777 C CD1 . PHE C 1 426 ? -36.258 -3.077 16.450 1.00 23.12 ? 734 PHE C CD1 1 ATOM 8778 C CD2 . PHE C 1 426 ? -37.137 -1.694 14.718 1.00 22.27 ? 734 PHE C CD2 1 ATOM 8779 C CE1 . PHE C 1 426 ? -36.978 -4.150 15.962 1.00 25.71 ? 734 PHE C CE1 1 ATOM 8780 C CE2 . PHE C 1 426 ? -37.868 -2.766 14.228 1.00 25.65 ? 734 PHE C CE2 1 ATOM 8781 C CZ . PHE C 1 426 ? -37.786 -3.993 14.848 1.00 23.16 ? 734 PHE C CZ 1 ATOM 8782 N N . LEU C 1 427 ? -37.139 -0.358 18.966 1.00 21.69 ? 735 LEU C N 1 ATOM 8783 C CA . LEU C 1 427 ? -38.103 -0.832 19.953 1.00 24.08 ? 735 LEU C CA 1 ATOM 8784 C C . LEU C 1 427 ? -39.183 0.217 20.197 1.00 27.94 ? 735 LEU C C 1 ATOM 8785 O O . LEU C 1 427 ? -40.361 -0.117 20.309 1.00 24.72 ? 735 LEU C O 1 ATOM 8786 C CB . LEU C 1 427 ? -37.407 -1.206 21.266 1.00 24.89 ? 735 LEU C CB 1 ATOM 8787 C CG . LEU C 1 427 ? -36.452 -2.408 21.213 1.00 24.05 ? 735 LEU C CG 1 ATOM 8788 C CD1 . LEU C 1 427 ? -35.661 -2.534 22.511 1.00 24.12 ? 735 LEU C CD1 1 ATOM 8789 C CD2 . LEU C 1 427 ? -37.197 -3.707 20.914 1.00 27.76 ? 735 LEU C CD2 1 ATOM 8790 N N . ASP C 1 428 ? -38.785 1.486 20.246 1.00 26.29 ? 736 ASP C N 1 ATOM 8791 C CA . ASP C 1 428 ? -39.742 2.570 20.467 1.00 28.70 ? 736 ASP C CA 1 ATOM 8792 C C . ASP C 1 428 ? -40.736 2.759 19.317 1.00 28.19 ? 736 ASP C C 1 ATOM 8793 O O . ASP C 1 428 ? -41.768 3.393 19.494 1.00 31.03 ? 736 ASP C O 1 ATOM 8794 C CB . ASP C 1 428 ? -39.024 3.895 20.748 1.00 32.56 ? 736 ASP C CB 1 ATOM 8795 C CG . ASP C 1 428 ? -38.365 3.928 22.116 1.00 38.74 ? 736 ASP C CG 1 ATOM 8796 O OD1 . ASP C 1 428 ? -38.711 3.083 22.968 1.00 40.61 ? 736 ASP C OD1 1 ATOM 8797 O OD2 . ASP C 1 428 ? -37.505 4.807 22.342 1.00 42.30 ? 736 ASP C OD2 1 ATOM 8798 N N . SER C 1 429 ? -40.424 2.222 18.141 1.00 23.18 ? 737 SER C N 1 ATOM 8799 C CA . SER C 1 429 ? -41.315 2.350 16.996 1.00 26.62 ? 737 SER C CA 1 ATOM 8800 C C . SER C 1 429 ? -42.382 1.260 17.013 1.00 29.95 ? 737 SER C C 1 ATOM 8801 O O . SER C 1 429 ? -43.327 1.293 16.222 1.00 31.23 ? 737 SER C O 1 ATOM 8802 C CB . SER C 1 429 ? -40.530 2.283 15.681 1.00 27.39 ? 737 SER C CB 1 ATOM 8803 O OG . SER C 1 429 ? -40.169 0.945 15.368 1.00 26.08 ? 737 SER C OG 1 ATOM 8804 N N . LEU C 1 430 ? -42.221 0.297 17.917 1.00 30.21 ? 738 LEU C N 1 ATOM 8805 C CA . LEU C 1 430 ? -43.105 -0.864 17.981 1.00 33.25 ? 738 LEU C CA 1 ATOM 8806 C C . LEU C 1 430 ? -44.136 -0.754 19.099 1.00 39.30 ? 738 LEU C C 1 ATOM 8807 O O . LEU C 1 430 ? -43.838 -0.249 20.181 1.00 41.69 ? 738 LEU C O 1 ATOM 8808 C CB . LEU C 1 430 ? -42.286 -2.134 18.201 1.00 32.26 ? 738 LEU C CB 1 ATOM 8809 C CG . LEU C 1 430 ? -41.216 -2.501 17.180 1.00 32.51 ? 738 LEU C CG 1 ATOM 8810 C CD1 . LEU C 1 430 ? -40.353 -3.639 17.725 1.00 32.29 ? 738 LEU C CD1 1 ATOM 8811 C CD2 . LEU C 1 430 ? -41.854 -2.893 15.858 1.00 34.72 ? 738 LEU C CD2 1 ATOM 8812 N N . PRO C 1 431 ? -45.358 -1.236 18.841 1.00 42.97 ? 739 PRO C N 1 ATOM 8813 C CA . PRO C 1 431 ? -46.349 -1.346 19.912 1.00 47.86 ? 739 PRO C CA 1 ATOM 8814 C C . PRO C 1 431 ? -46.176 -2.665 20.658 1.00 49.98 ? 739 PRO C C 1 ATOM 8815 O O . PRO C 1 431 ? -45.543 -3.587 20.137 1.00 50.10 ? 739 PRO C O 1 ATOM 8816 C CB . PRO C 1 431 ? -47.672 -1.348 19.149 1.00 48.62 ? 739 PRO C CB 1 ATOM 8817 C CG . PRO C 1 431 ? -47.337 -2.015 17.855 1.00 47.40 ? 739 PRO C CG 1 ATOM 8818 C CD . PRO C 1 431 ? -45.915 -1.613 17.529 1.00 44.51 ? 739 PRO C CD 1 ATOM 8819 N N . ASP C 1 432 ? -46.718 -2.739 21.869 1.00 54.76 ? 740 ASP C N 1 ATOM 8820 C CA . ASP C 1 432 ? -46.775 -3.985 22.631 1.00 55.81 ? 740 ASP C CA 1 ATOM 8821 C C . ASP C 1 432 ? -45.412 -4.565 23.027 1.00 49.67 ? 740 ASP C C 1 ATOM 8822 O O . ASP C 1 432 ? -45.318 -5.748 23.344 1.00 50.30 ? 740 ASP C O 1 ATOM 8823 C CB . ASP C 1 432 ? -47.595 -5.040 21.878 1.00 61.13 ? 740 ASP C CB 1 ATOM 8824 C CG . ASP C 1 432 ? -48.981 -4.546 21.503 1.00 68.36 ? 740 ASP C CG 1 ATOM 8825 O OD1 . ASP C 1 432 ? -49.657 -3.941 22.364 1.00 70.42 ? 740 ASP C OD1 1 ATOM 8826 O OD2 . ASP C 1 432 ? -49.394 -4.757 20.342 1.00 70.83 ? 740 ASP C OD2 1 ATOM 8827 N N . VAL C 1 433 ? -44.364 -3.744 23.009 1.00 43.08 ? 741 VAL C N 1 ATOM 8828 C CA . VAL C 1 433 ? -43.069 -4.168 23.538 1.00 39.84 ? 741 VAL C CA 1 ATOM 8829 C C . VAL C 1 433 ? -43.138 -4.247 25.061 1.00 40.32 ? 741 VAL C C 1 ATOM 8830 O O . VAL C 1 433 ? -43.542 -3.290 25.719 1.00 40.81 ? 741 VAL C O 1 ATOM 8831 C CB . VAL C 1 433 ? -41.928 -3.203 23.139 1.00 36.79 ? 741 VAL C CB 1 ATOM 8832 C CG1 . VAL C 1 433 ? -40.656 -3.537 23.906 1.00 35.63 ? 741 VAL C CG1 1 ATOM 8833 C CG2 . VAL C 1 433 ? -41.679 -3.255 21.642 1.00 34.88 ? 741 VAL C CG2 1 ATOM 8834 N N . LYS C 1 434 ? -42.748 -5.390 25.616 1.00 39.02 ? 742 LYS C N 1 ATOM 8835 C CA . LYS C 1 434 ? -42.800 -5.601 27.061 1.00 42.22 ? 742 LYS C CA 1 ATOM 8836 C C . LYS C 1 434 ? -41.401 -5.611 27.678 1.00 41.02 ? 742 LYS C C 1 ATOM 8837 O O . LYS C 1 434 ? -40.459 -6.135 27.087 1.00 35.80 ? 742 LYS C O 1 ATOM 8838 C CB . LYS C 1 434 ? -43.520 -6.917 27.374 1.00 46.22 ? 742 LYS C CB 1 ATOM 8839 C CG . LYS C 1 434 ? -43.622 -7.247 28.855 1.00 52.75 ? 742 LYS C CG 1 ATOM 8840 C CD . LYS C 1 434 ? -44.242 -8.622 29.079 1.00 55.67 ? 742 LYS C CD 1 ATOM 8841 C CE . LYS C 1 434 ? -44.150 -9.040 30.538 1.00 58.39 ? 742 LYS C CE 1 ATOM 8842 N NZ . LYS C 1 434 ? -44.686 -10.412 30.764 1.00 60.24 ? 742 LYS C NZ 1 ATOM 8843 N N . ILE C 1 435 ? -41.268 -5.034 28.868 1.00 42.53 ? 743 ILE C N 1 ATOM 8844 C CA . ILE C 1 435 ? -39.993 -5.053 29.577 1.00 41.63 ? 743 ILE C CA 1 ATOM 8845 C C . ILE C 1 435 ? -40.011 -6.078 30.705 1.00 43.94 ? 743 ILE C C 1 ATOM 8846 O O . ILE C 1 435 ? -40.806 -5.973 31.638 1.00 42.66 ? 743 ILE C O 1 ATOM 8847 C CB . ILE C 1 435 ? -39.640 -3.669 30.159 1.00 43.10 ? 743 ILE C CB 1 ATOM 8848 C CG1 . ILE C 1 435 ? -39.676 -2.599 29.066 1.00 40.15 ? 743 ILE C CG1 1 ATOM 8849 C CG2 . ILE C 1 435 ? -38.276 -3.713 30.836 1.00 43.77 ? 743 ILE C CG2 1 ATOM 8850 C CD1 . ILE C 1 435 ? -38.664 -2.815 27.956 1.00 39.25 ? 743 ILE C CD1 1 ATOM 8851 N N . VAL C 1 436 ? -39.138 -7.076 30.612 1.00 44.35 ? 744 VAL C N 1 ATOM 8852 C CA . VAL C 1 436 ? -39.036 -8.097 31.646 1.00 46.71 ? 744 VAL C CA 1 ATOM 8853 C C . VAL C 1 436 ? -37.926 -7.746 32.632 1.00 50.46 ? 744 VAL C C 1 ATOM 8854 O O . VAL C 1 436 ? -36.810 -7.419 32.225 1.00 47.32 ? 744 VAL C O 1 ATOM 8855 C CB . VAL C 1 436 ? -38.777 -9.496 31.039 1.00 43.89 ? 744 VAL C CB 1 ATOM 8856 C CG1 . VAL C 1 436 ? -38.572 -10.532 32.139 1.00 46.39 ? 744 VAL C CG1 1 ATOM 8857 C CG2 . VAL C 1 436 ? -39.929 -9.901 30.142 1.00 42.20 ? 744 VAL C CG2 1 ATOM 8858 N N . LYS C 1 437 ? -38.245 -7.807 33.924 1.00 55.71 ? 745 LYS C N 1 ATOM 8859 C CA . LYS C 1 437 ? -37.289 -7.494 34.983 1.00 59.70 ? 745 LYS C CA 1 ATOM 8860 C C . LYS C 1 437 ? -36.853 -8.746 35.743 1.00 60.88 ? 745 LYS C C 1 ATOM 8861 O O . LYS C 1 437 ? -37.254 -9.859 35.410 1.00 59.25 ? 745 LYS C O 1 ATOM 8862 C CB . LYS C 1 437 ? -37.894 -6.491 35.971 1.00 64.13 ? 745 LYS C CB 1 ATOM 8863 C CG . LYS C 1 437 ? -38.191 -5.120 35.385 1.00 64.95 ? 745 LYS C CG 1 ATOM 8864 C CD . LYS C 1 437 ? -38.786 -4.197 36.441 1.00 67.47 ? 745 LYS C CD 1 ATOM 8865 C CE . LYS C 1 437 ? -39.070 -2.812 35.879 1.00 68.05 ? 745 LYS C CE 1 ATOM 8866 N NZ . LYS C 1 437 ? -39.666 -1.906 36.905 1.00 71.02 ? 745 LYS C NZ 1 ATOM 8867 N N . MET C 1 438 ? -36.028 -8.547 36.768 1.00 64.77 ? 746 MET C N 1 ATOM 8868 C CA . MET C 1 438 ? -35.572 -9.637 37.628 1.00 66.93 ? 746 MET C CA 1 ATOM 8869 C C . MET C 1 438 ? -35.604 -9.233 39.100 1.00 70.62 ? 746 MET C C 1 ATOM 8870 O O . MET C 1 438 ? -34.576 -9.238 39.779 1.00 71.15 ? 746 MET C O 1 ATOM 8871 C CB . MET C 1 438 ? -34.161 -10.084 37.238 1.00 64.57 ? 746 MET C CB 1 ATOM 8872 C CG . MET C 1 438 ? -34.109 -10.972 36.008 1.00 63.51 ? 746 MET C CG 1 ATOM 8873 S SD . MET C 1 438 ? -32.422 -11.315 35.470 1.00 97.67 ? 746 MET C SD 1 ATOM 8874 C CE . MET C 1 438 ? -31.701 -11.944 36.986 1.00 48.03 ? 746 MET C CE 1 ATOM 8875 N N . ASN C 1 455 ? -33.283 -5.788 33.172 1.00 44.42 ? 763 ASN C N 1 ATOM 8876 C CA . ASN C 1 455 ? -34.298 -5.332 32.232 1.00 45.99 ? 763 ASN C CA 1 ATOM 8877 C C . ASN C 1 455 ? -34.059 -5.833 30.809 1.00 44.19 ? 763 ASN C C 1 ATOM 8878 O O . ASN C 1 455 ? -33.015 -5.571 30.215 1.00 46.92 ? 763 ASN C O 1 ATOM 8879 C CB . ASN C 1 455 ? -34.402 -3.804 32.248 1.00 52.20 ? 763 ASN C CB 1 ATOM 8880 C CG . ASN C 1 455 ? -35.056 -3.277 33.514 1.00 58.05 ? 763 ASN C CG 1 ATOM 8881 O OD1 . ASN C 1 455 ? -36.272 -3.090 33.566 1.00 61.14 ? 763 ASN C OD1 1 ATOM 8882 N ND2 . ASN C 1 455 ? -34.251 -3.035 34.543 1.00 59.87 ? 763 ASN C ND2 1 ATOM 8883 N N . MET C 1 456 ? -35.036 -6.552 30.265 1.00 35.07 ? 764 MET C N 1 ATOM 8884 C CA . MET C 1 456 ? -34.911 -7.113 28.925 1.00 32.12 ? 764 MET C CA 1 ATOM 8885 C C . MET C 1 456 ? -36.185 -6.897 28.116 1.00 31.40 ? 764 MET C C 1 ATOM 8886 O O . MET C 1 456 ? -37.250 -7.413 28.471 1.00 32.84 ? 764 MET C O 1 ATOM 8887 C CB . MET C 1 456 ? -34.574 -8.604 28.999 1.00 30.30 ? 764 MET C CB 1 ATOM 8888 C CG . MET C 1 456 ? -34.429 -9.283 27.638 1.00 29.88 ? 764 MET C CG 1 ATOM 8889 S SD . MET C 1 456 ? -34.041 -11.034 27.785 1.00 38.35 ? 764 MET C SD 1 ATOM 8890 C CE . MET C 1 456 ? -35.604 -11.722 28.324 1.00 36.97 ? 764 MET C CE 1 ATOM 8891 N N . PRO C 1 457 ? -36.080 -6.120 27.027 1.00 27.62 ? 765 PRO C N 1 ATOM 8892 C CA . PRO C 1 457 ? -37.233 -5.841 26.164 1.00 27.46 ? 765 PRO C CA 1 ATOM 8893 C C . PRO C 1 457 ? -37.637 -7.071 25.365 1.00 24.52 ? 765 PRO C C 1 ATOM 8894 O O . PRO C 1 457 ? -36.787 -7.792 24.826 1.00 22.97 ? 765 PRO C O 1 ATOM 8895 C CB . PRO C 1 457 ? -36.713 -4.751 25.219 1.00 30.00 ? 765 PRO C CB 1 ATOM 8896 C CG . PRO C 1 457 ? -35.496 -4.186 25.899 1.00 29.47 ? 765 PRO C CG 1 ATOM 8897 C CD . PRO C 1 457 ? -34.892 -5.356 26.614 1.00 24.78 ? 765 PRO C CD 1 ATOM 8898 N N . VAL C 1 458 ? -38.941 -7.303 25.289 1.00 22.80 ? 766 VAL C N 1 ATOM 8899 C CA . VAL C 1 458 ? -39.463 -8.466 24.593 1.00 25.94 ? 766 VAL C CA 1 ATOM 8900 C C . VAL C 1 458 ? -40.475 -8.046 23.534 1.00 27.87 ? 766 VAL C C 1 ATOM 8901 O O . VAL C 1 458 ? -41.421 -7.310 23.818 1.00 29.05 ? 766 VAL C O 1 ATOM 8902 C CB . VAL C 1 458 ? -40.126 -9.449 25.580 1.00 28.84 ? 766 VAL C CB 1 ATOM 8903 C CG1 . VAL C 1 458 ? -40.798 -10.588 24.833 1.00 31.40 ? 766 VAL C CG1 1 ATOM 8904 C CG2 . VAL C 1 458 ? -39.100 -9.978 26.570 1.00 25.41 ? 766 VAL C CG2 1 ATOM 8905 N N . ILE C 1 459 ? -40.265 -8.522 22.314 1.00 28.02 ? 767 ILE C N 1 ATOM 8906 C CA . ILE C 1 459 ? -41.183 -8.269 21.213 1.00 29.38 ? 767 ILE C CA 1 ATOM 8907 C C . ILE C 1 459 ? -42.131 -9.450 21.052 1.00 33.00 ? 767 ILE C C 1 ATOM 8908 O O . ILE C 1 459 ? -41.687 -10.583 20.862 1.00 30.65 ? 767 ILE C O 1 ATOM 8909 C CB . ILE C 1 459 ? -40.415 -8.061 19.902 1.00 27.70 ? 767 ILE C CB 1 ATOM 8910 C CG1 . ILE C 1 459 ? -39.510 -6.832 20.010 1.00 27.77 ? 767 ILE C CG1 1 ATOM 8911 C CG2 . ILE C 1 459 ? -41.376 -7.939 18.737 1.00 27.24 ? 767 ILE C CG2 1 ATOM 8912 C CD1 . ILE C 1 459 ? -38.547 -6.686 18.847 1.00 30.51 ? 767 ILE C CD1 1 ATOM 8913 N N . PRO C 1 460 ? -43.447 -9.190 21.128 1.00 39.24 ? 768 PRO C N 1 ATOM 8914 C CA . PRO C 1 460 ? -44.455 -10.255 21.051 1.00 43.28 ? 768 PRO C CA 1 ATOM 8915 C C . PRO C 1 460 ? -44.537 -10.886 19.663 1.00 46.18 ? 768 PRO C C 1 ATOM 8916 O O . PRO C 1 460 ? -43.996 -10.340 18.702 1.00 45.69 ? 768 PRO C O 1 ATOM 8917 C CB . PRO C 1 460 ? -45.759 -9.522 21.381 1.00 45.57 ? 768 PRO C CB 1 ATOM 8918 C CG . PRO C 1 460 ? -45.511 -8.113 20.957 1.00 44.57 ? 768 PRO C CG 1 ATOM 8919 C CD . PRO C 1 460 ? -44.058 -7.856 21.263 1.00 41.37 ? 768 PRO C CD 1 ATOM 8920 N N . MET C 1 461 ? -45.214 -12.026 19.566 1.00 50.88 ? 769 MET C N 1 ATOM 8921 C CA . MET C 1 461 ? -45.320 -12.755 18.305 1.00 52.58 ? 769 MET C CA 1 ATOM 8922 C C . MET C 1 461 ? -46.356 -12.123 17.378 1.00 55.32 ? 769 MET C C 1 ATOM 8923 O O . MET C 1 461 ? -47.437 -12.675 17.163 1.00 61.04 ? 769 MET C O 1 ATOM 8924 C CB . MET C 1 461 ? -45.655 -14.228 18.563 1.00 56.05 ? 769 MET C CB 1 ATOM 8925 C CG . MET C 1 461 ? -45.495 -15.133 17.348 1.00 58.97 ? 769 MET C CG 1 ATOM 8926 S SD . MET C 1 461 ? -43.806 -15.166 16.714 1.00 83.82 ? 769 MET C SD 1 ATOM 8927 C CE . MET C 1 461 ? -43.983 -16.308 15.345 1.00 93.55 ? 769 MET C CE 1 ATOM 8928 N N . ASN C 1 462 ? -46.016 -10.959 16.834 1.00 52.85 ? 770 ASN C N 1 ATOM 8929 C CA . ASN C 1 462 ? -46.894 -10.250 15.912 1.00 53.73 ? 770 ASN C CA 1 ATOM 8930 C C . ASN C 1 462 ? -46.373 -10.277 14.477 1.00 52.92 ? 770 ASN C C 1 ATOM 8931 O O . ASN C 1 462 ? -45.491 -11.071 14.143 1.00 50.18 ? 770 ASN C O 1 ATOM 8932 C CB . ASN C 1 462 ? -47.098 -8.804 16.375 1.00 55.70 ? 770 ASN C CB 1 ATOM 8933 C CG . ASN C 1 462 ? -45.784 -8.085 16.654 1.00 55.93 ? 770 ASN C CG 1 ATOM 8934 O OD1 . ASN C 1 462 ? -44.715 -8.527 16.230 1.00 54.93 ? 770 ASN C OD1 1 ATOM 8935 N ND2 . ASN C 1 462 ? -45.861 -6.971 17.373 1.00 56.85 ? 770 ASN C ND2 1 ATOM 8936 N N . THR C 1 463 ? -46.924 -9.401 13.641 1.00 55.11 ? 771 THR C N 1 ATOM 8937 C CA . THR C 1 463 ? -46.531 -9.293 12.237 1.00 56.40 ? 771 THR C CA 1 ATOM 8938 C C . THR C 1 463 ? -45.040 -8.999 12.078 1.00 54.45 ? 771 THR C C 1 ATOM 8939 O O . THR C 1 463 ? -44.366 -9.601 11.240 1.00 54.68 ? 771 THR C O 1 ATOM 8940 C CB . THR C 1 463 ? -47.342 -8.197 11.515 1.00 57.65 ? 771 THR C CB 1 ATOM 8941 O OG1 . THR C 1 463 ? -48.730 -8.551 11.512 1.00 60.17 ? 771 THR C OG1 1 ATOM 8942 C CG2 . THR C 1 463 ? -46.865 -8.030 10.079 1.00 59.68 ? 771 THR C CG2 1 ATOM 8943 N N . ILE C 1 464 ? -44.536 -8.071 12.886 1.00 53.19 ? 772 ILE C N 1 ATOM 8944 C CA . ILE C 1 464 ? -43.118 -7.726 12.893 1.00 53.29 ? 772 ILE C CA 1 ATOM 8945 C C . ILE C 1 464 ? -42.258 -8.962 13.154 1.00 53.52 ? 772 ILE C C 1 ATOM 8946 O O . ILE C 1 464 ? -41.298 -9.231 12.432 1.00 54.01 ? 772 ILE C O 1 ATOM 8947 C CB . ILE C 1 464 ? -42.805 -6.673 13.980 1.00 51.49 ? 772 ILE C CB 1 ATOM 8948 C CG1 . ILE C 1 464 ? -43.710 -5.448 13.822 1.00 55.26 ? 772 ILE C CG1 1 ATOM 8949 C CG2 . ILE C 1 464 ? -41.340 -6.277 13.942 1.00 48.59 ? 772 ILE C CG2 1 ATOM 8950 C CD1 . ILE C 1 464 ? -43.602 -4.767 12.474 1.00 57.26 ? 772 ILE C CD1 1 ATOM 8951 N N . ALA C 1 465 ? -42.624 -9.715 14.186 1.00 41.59 ? 773 ALA C N 1 ATOM 8952 C CA . ALA C 1 465 ? -41.877 -10.909 14.584 1.00 41.28 ? 773 ALA C CA 1 ATOM 8953 C C . ALA C 1 465 ? -41.889 -12.001 13.518 1.00 40.71 ? 773 ALA C C 1 ATOM 8954 O O . ALA C 1 465 ? -40.906 -12.719 13.347 1.00 38.27 ? 773 ALA C O 1 ATOM 8955 C CB . ALA C 1 465 ? -42.418 -11.449 15.893 1.00 44.14 ? 773 ALA C CB 1 ATOM 8956 N N . GLU C 1 466 ? -43.003 -12.130 12.804 1.00 41.85 ? 774 GLU C N 1 ATOM 8957 C CA . GLU C 1 466 ? -43.111 -13.146 11.759 1.00 41.54 ? 774 GLU C CA 1 ATOM 8958 C C . GLU C 1 466 ? -42.193 -12.816 10.584 1.00 37.67 ? 774 GLU C C 1 ATOM 8959 O O . GLU C 1 466 ? -41.525 -13.698 10.039 1.00 33.65 ? 774 GLU C O 1 ATOM 8960 C CB . GLU C 1 466 ? -44.563 -13.289 11.297 1.00 46.85 ? 774 GLU C CB 1 ATOM 8961 C CG . GLU C 1 466 ? -45.493 -13.817 12.381 1.00 51.47 ? 774 GLU C CG 1 ATOM 8962 C CD . GLU C 1 466 ? -46.963 -13.723 12.004 1.00 56.28 ? 774 GLU C CD 1 ATOM 8963 O OE1 . GLU C 1 466 ? -47.270 -13.273 10.878 1.00 58.28 ? 774 GLU C OE1 1 ATOM 8964 O OE2 . GLU C 1 466 ? -47.812 -14.096 12.841 1.00 57.58 ? 774 GLU C OE2 1 ATOM 8965 N N . ALA C 1 467 ? -42.155 -11.539 10.213 1.00 38.16 ? 775 ALA C N 1 ATOM 8966 C CA . ALA C 1 467 ? -41.322 -11.072 9.106 1.00 38.12 ? 775 ALA C CA 1 ATOM 8967 C C . ALA C 1 467 ? -39.838 -11.282 9.390 1.00 34.36 ? 775 ALA C C 1 ATOM 8968 O O . ALA C 1 467 ? -39.050 -11.541 8.483 1.00 33.46 ? 775 ALA C O 1 ATOM 8969 C CB . ALA C 1 467 ? -41.605 -9.610 8.810 1.00 37.10 ? 775 ALA C CB 1 ATOM 8970 N N . VAL C 1 468 ? -39.460 -11.175 10.656 1.00 34.73 ? 776 VAL C N 1 ATOM 8971 C CA . VAL C 1 468 ? -38.078 -11.403 11.051 1.00 32.00 ? 776 VAL C CA 1 ATOM 8972 C C . VAL C 1 468 ? -37.711 -12.879 10.925 1.00 33.29 ? 776 VAL C C 1 ATOM 8973 O O . VAL C 1 468 ? -36.677 -13.222 10.347 1.00 30.84 ? 776 VAL C O 1 ATOM 8974 C CB . VAL C 1 468 ? -37.815 -10.907 12.485 1.00 31.59 ? 776 VAL C CB 1 ATOM 8975 C CG1 . VAL C 1 468 ? -36.450 -11.348 12.953 1.00 26.84 ? 776 VAL C CG1 1 ATOM 8976 C CG2 . VAL C 1 468 ? -37.953 -9.393 12.549 1.00 33.67 ? 776 VAL C CG2 1 ATOM 8977 N N . ILE C 1 469 ? -38.568 -13.753 11.447 1.00 32.12 ? 777 ILE C N 1 ATOM 8978 C CA . ILE C 1 469 ? -38.335 -15.188 11.348 1.00 33.06 ? 777 ILE C CA 1 ATOM 8979 C C . ILE C 1 469 ? -38.373 -15.665 9.900 1.00 33.17 ? 777 ILE C C 1 ATOM 8980 O O . ILE C 1 469 ? -37.673 -16.604 9.529 1.00 32.99 ? 777 ILE C O 1 ATOM 8981 C CB . ILE C 1 469 ? -39.350 -15.986 12.193 1.00 39.38 ? 777 ILE C CB 1 ATOM 8982 C CG1 . ILE C 1 469 ? -39.359 -15.472 13.634 1.00 42.87 ? 777 ILE C CG1 1 ATOM 8983 C CG2 . ILE C 1 469 ? -39.020 -17.471 12.169 1.00 38.88 ? 777 ILE C CG2 1 ATOM 8984 C CD1 . ILE C 1 469 ? -40.374 -16.171 14.529 1.00 45.06 ? 777 ILE C CD1 1 ATOM 8985 N N . GLU C 1 470 ? -39.185 -15.014 9.073 1.00 36.73 ? 778 GLU C N 1 ATOM 8986 C CA . GLU C 1 470 ? -39.239 -15.373 7.658 1.00 36.59 ? 778 GLU C CA 1 ATOM 8987 C C . GLU C 1 470 ? -37.898 -15.100 6.970 1.00 30.69 ? 778 GLU C C 1 ATOM 8988 O O . GLU C 1 470 ? -37.412 -15.921 6.188 1.00 29.63 ? 778 GLU C O 1 ATOM 8989 C CB . GLU C 1 470 ? -40.379 -14.641 6.945 1.00 40.49 ? 778 GLU C CB 1 ATOM 8990 C CG . GLU C 1 470 ? -40.486 -14.991 5.468 1.00 47.16 ? 778 GLU C CG 1 ATOM 8991 C CD . GLU C 1 470 ? -41.617 -14.261 4.766 1.00 53.93 ? 778 GLU C CD 1 ATOM 8992 O OE1 . GLU C 1 470 ? -42.602 -13.891 5.441 1.00 55.82 ? 778 GLU C OE1 1 ATOM 8993 O OE2 . GLU C 1 470 ? -41.518 -14.059 3.536 1.00 56.16 ? 778 GLU C OE2 1 ATOM 8994 N N . MET C 1 471 ? -37.305 -13.949 7.270 1.00 27.16 ? 779 MET C N 1 ATOM 8995 C CA . MET C 1 471 ? -35.974 -13.606 6.767 1.00 25.88 ? 779 MET C CA 1 ATOM 8996 C C . MET C 1 471 ? -34.973 -14.722 7.055 1.00 27.02 ? 779 MET C C 1 ATOM 8997 O O . MET C 1 471 ? -34.250 -15.176 6.165 1.00 26.03 ? 779 MET C O 1 ATOM 8998 C CB . MET C 1 471 ? -35.481 -12.302 7.406 1.00 22.93 ? 779 MET C CB 1 ATOM 8999 C CG . MET C 1 471 ? -34.045 -11.946 7.050 1.00 21.67 ? 779 MET C CG 1 ATOM 9000 S SD . MET C 1 471 ? -33.472 -10.419 7.831 1.00 28.07 ? 779 MET C SD 1 ATOM 9001 C CE . MET C 1 471 ? -33.511 -10.872 9.561 1.00 27.73 ? 779 MET C CE 1 ATOM 9002 N N . ILE C 1 472 ? -34.958 -15.175 8.303 1.00 26.35 ? 780 ILE C N 1 ATOM 9003 C CA . ILE C 1 472 ? -34.021 -16.201 8.737 1.00 29.72 ? 780 ILE C CA 1 ATOM 9004 C C . ILE C 1 472 ? -34.251 -17.531 8.019 1.00 30.46 ? 780 ILE C C 1 ATOM 9005 O O . ILE C 1 472 ? -33.311 -18.144 7.519 1.00 32.48 ? 780 ILE C O 1 ATOM 9006 C CB . ILE C 1 472 ? -34.102 -16.408 10.256 1.00 31.93 ? 780 ILE C CB 1 ATOM 9007 C CG1 . ILE C 1 472 ? -33.958 -15.065 10.980 1.00 32.47 ? 780 ILE C CG1 1 ATOM 9008 C CG2 . ILE C 1 472 ? -33.052 -17.418 10.713 1.00 33.23 ? 780 ILE C CG2 1 ATOM 9009 C CD1 . ILE C 1 472 ? -32.559 -14.488 10.950 1.00 31.79 ? 780 ILE C CD1 1 ATOM 9010 N N . ASN C 1 473 ? -35.502 -17.969 7.958 1.00 34.40 ? 781 ASN C N 1 ATOM 9011 C CA . ASN C 1 473 ? -35.833 -19.220 7.276 1.00 38.31 ? 781 ASN C CA 1 ATOM 9012 C C . ASN C 1 473 ? -35.490 -19.221 5.789 1.00 39.05 ? 781 ASN C C 1 ATOM 9013 O O . ASN C 1 473 ? -34.984 -20.214 5.261 1.00 39.24 ? 781 ASN C O 1 ATOM 9014 C CB . ASN C 1 473 ? -37.307 -19.570 7.478 1.00 41.28 ? 781 ASN C CB 1 ATOM 9015 C CG . ASN C 1 473 ? -37.615 -19.967 8.904 1.00 42.53 ? 781 ASN C CG 1 ATOM 9016 O OD1 . ASN C 1 473 ? -36.720 -20.357 9.656 1.00 42.73 ? 781 ASN C OD1 1 ATOM 9017 N ND2 . ASN C 1 473 ? -38.881 -19.869 9.288 1.00 42.50 ? 781 ASN C ND2 1 ATOM 9018 N N . ARG C 1 474 ? -35.760 -18.106 5.117 1.00 36.88 ? 782 ARG C N 1 ATOM 9019 C CA . ARG C 1 474 ? -35.486 -18.001 3.688 1.00 34.44 ? 782 ARG C CA 1 ATOM 9020 C C . ARG C 1 474 ? -34.018 -17.708 3.407 1.00 33.50 ? 782 ARG C C 1 ATOM 9021 O O . ARG C 1 474 ? -33.579 -17.745 2.260 1.00 35.96 ? 782 ARG C O 1 ATOM 9022 C CB . ARG C 1 474 ? -36.373 -16.930 3.046 1.00 34.97 ? 782 ARG C CB 1 ATOM 9023 C CG . ARG C 1 474 ? -37.857 -17.261 3.081 1.00 36.45 ? 782 ARG C CG 1 ATOM 9024 C CD . ARG C 1 474 ? -38.689 -16.131 2.506 1.00 40.85 ? 782 ARG C CD 1 ATOM 9025 N NE . ARG C 1 474 ? -38.216 -15.714 1.188 1.00 45.09 ? 782 ARG C NE 1 ATOM 9026 C CZ . ARG C 1 474 ? -38.708 -16.162 0.036 1.00 48.67 ? 782 ARG C CZ 1 ATOM 9027 N NH1 . ARG C 1 474 ? -39.696 -17.047 0.032 1.00 51.26 ? 782 ARG C NH1 1 ATOM 9028 N NH2 . ARG C 1 474 ? -38.212 -15.722 -1.114 1.00 48.86 ? 782 ARG C NH2 1 ATOM 9029 N N . GLY C 1 475 ? -33.259 -17.420 4.457 1.00 32.83 ? 783 GLY C N 1 ATOM 9030 C CA . GLY C 1 475 ? -31.855 -17.094 4.298 1.00 32.53 ? 783 GLY C CA 1 ATOM 9031 C C . GLY C 1 475 ? -31.648 -15.746 3.629 1.00 32.38 ? 783 GLY C C 1 ATOM 9032 O O . GLY C 1 475 ? -30.624 -15.515 2.992 1.00 32.75 ? 783 GLY C O 1 ATOM 9033 N N . GLN C 1 476 ? -32.625 -14.855 3.776 1.00 30.68 ? 784 GLN C N 1 ATOM 9034 C CA . GLN C 1 476 ? -32.518 -13.493 3.252 1.00 27.05 ? 784 GLN C CA 1 ATOM 9035 C C . GLN C 1 476 ? -31.453 -12.712 4.022 1.00 22.91 ? 784 GLN C C 1 ATOM 9036 O O . GLN C 1 476 ? -31.211 -12.978 5.195 1.00 23.00 ? 784 GLN C O 1 ATOM 9037 C CB . GLN C 1 476 ? -33.875 -12.784 3.329 1.00 28.75 ? 784 GLN C CB 1 ATOM 9038 C CG . GLN C 1 476 ? -34.914 -13.349 2.352 1.00 36.82 ? 784 GLN C CG 1 ATOM 9039 C CD . GLN C 1 476 ? -36.348 -12.940 2.676 1.00 43.45 ? 784 GLN C CD 1 ATOM 9040 O OE1 . GLN C 1 476 ? -37.287 -13.365 2.001 1.00 50.94 ? 784 GLN C OE1 1 ATOM 9041 N NE2 . GLN C 1 476 ? -36.523 -12.120 3.707 1.00 41.89 ? 784 GLN C NE2 1 ATOM 9042 N N . ILE C 1 477 ? -30.823 -11.748 3.357 1.00 21.17 ? 785 ILE C N 1 ATOM 9043 C CA . ILE C 1 477 ? -29.707 -11.003 3.939 1.00 21.09 ? 785 ILE C CA 1 ATOM 9044 C C . ILE C 1 477 ? -30.163 -9.949 4.952 1.00 19.52 ? 785 ILE C C 1 ATOM 9045 O O . ILE C 1 477 ? -29.530 -9.745 5.990 1.00 16.64 ? 785 ILE C O 1 ATOM 9046 C CB . ILE C 1 477 ? -28.908 -10.289 2.826 1.00 28.07 ? 785 ILE C CB 1 ATOM 9047 C CG1 . ILE C 1 477 ? -28.458 -11.300 1.768 1.00 33.69 ? 785 ILE C CG1 1 ATOM 9048 C CG2 . ILE C 1 477 ? -27.720 -9.537 3.398 1.00 27.63 ? 785 ILE C CG2 1 ATOM 9049 C CD1 . ILE C 1 477 ? -27.734 -12.478 2.348 1.00 35.46 ? 785 ILE C CD1 1 ATOM 9050 N N . GLN C 1 478 ? -31.256 -9.269 4.635 1.00 19.27 ? 786 GLN C N 1 ATOM 9051 C CA . GLN C 1 478 ? -31.718 -8.163 5.459 1.00 19.42 ? 786 GLN C CA 1 ATOM 9052 C C . GLN C 1 478 ? -33.146 -7.814 5.074 1.00 21.87 ? 786 GLN C C 1 ATOM 9053 O O . GLN C 1 478 ? -33.611 -8.166 3.990 1.00 23.28 ? 786 GLN C O 1 ATOM 9054 C CB . GLN C 1 478 ? -30.813 -6.941 5.247 1.00 19.65 ? 786 GLN C CB 1 ATOM 9055 C CG . GLN C 1 478 ? -30.878 -6.389 3.829 1.00 23.74 ? 786 GLN C CG 1 ATOM 9056 C CD . GLN C 1 478 ? -29.635 -5.614 3.423 1.00 28.36 ? 786 GLN C CD 1 ATOM 9057 O OE1 . GLN C 1 478 ? -28.820 -5.238 4.261 1.00 31.75 ? 786 GLN C OE1 1 ATOM 9058 N NE2 . GLN C 1 478 ? -29.486 -5.376 2.124 1.00 31.55 ? 786 GLN C NE2 1 ATOM 9059 N N . ILE C 1 479 ? -33.847 -7.133 5.975 1.00 22.20 ? 787 ILE C N 1 ATOM 9060 C CA . ILE C 1 479 ? -35.153 -6.568 5.664 1.00 23.85 ? 787 ILE C CA 1 ATOM 9061 C C . ILE C 1 479 ? -35.242 -5.175 6.270 1.00 24.20 ? 787 ILE C C 1 ATOM 9062 O O . ILE C 1 479 ? -34.326 -4.730 6.960 1.00 24.32 ? 787 ILE C O 1 ATOM 9063 C CB . ILE C 1 479 ? -36.308 -7.423 6.227 1.00 25.10 ? 787 ILE C CB 1 ATOM 9064 C CG1 . ILE C 1 479 ? -36.192 -7.535 7.748 1.00 25.22 ? 787 ILE C CG1 1 ATOM 9065 C CG2 . ILE C 1 479 ? -36.330 -8.806 5.577 1.00 24.91 ? 787 ILE C CG2 1 ATOM 9066 C CD1 . ILE C 1 479 ? -37.293 -8.374 8.381 1.00 27.45 ? 787 ILE C CD1 1 ATOM 9067 N N . THR C 1 480 ? -36.347 -4.490 6.007 1.00 23.33 ? 788 THR C N 1 ATOM 9068 C CA . THR C 1 480 ? -36.578 -3.173 6.583 1.00 23.68 ? 788 THR C CA 1 ATOM 9069 C C . THR C 1 480 ? -37.879 -3.199 7.365 1.00 25.01 ? 788 THR C C 1 ATOM 9070 O O . THR C 1 480 ? -38.892 -3.699 6.876 1.00 27.15 ? 788 THR C O 1 ATOM 9071 C CB . THR C 1 480 ? -36.662 -2.085 5.492 1.00 24.28 ? 788 THR C CB 1 ATOM 9072 O OG1 . THR C 1 480 ? -35.441 -2.061 4.738 1.00 21.52 ? 788 THR C OG1 1 ATOM 9073 C CG2 . THR C 1 480 ? -36.892 -0.722 6.117 1.00 27.35 ? 788 THR C CG2 1 ATOM 9074 N N . ILE C 1 481 ? -37.842 -2.690 8.593 1.00 23.44 ? 789 ILE C N 1 ATOM 9075 C CA . ILE C 1 481 ? -39.044 -2.575 9.412 1.00 22.05 ? 789 ILE C CA 1 ATOM 9076 C C . ILE C 1 481 ? -39.100 -1.193 10.047 1.00 22.18 ? 789 ILE C C 1 ATOM 9077 O O . ILE C 1 481 ? -38.176 -0.797 10.764 1.00 23.99 ? 789 ILE C O 1 ATOM 9078 C CB . ILE C 1 481 ? -39.086 -3.634 10.531 1.00 23.63 ? 789 ILE C CB 1 ATOM 9079 C CG1 . ILE C 1 481 ? -39.011 -5.047 9.945 1.00 25.55 ? 789 ILE C CG1 1 ATOM 9080 C CG2 . ILE C 1 481 ? -40.351 -3.468 11.368 1.00 23.45 ? 789 ILE C CG2 1 ATOM 9081 C CD1 . ILE C 1 481 ? -39.048 -6.156 10.995 1.00 26.43 ? 789 ILE C CD1 1 ATOM 9082 N N . ASN C 1 482 ? -40.184 -0.470 9.777 1.00 24.99 ? 790 ASN C N 1 ATOM 9083 C CA . ASN C 1 482 ? -40.361 0.903 10.247 1.00 27.37 ? 790 ASN C CA 1 ATOM 9084 C C . ASN C 1 482 ? -39.169 1.790 9.897 1.00 25.33 ? 790 ASN C C 1 ATOM 9085 O O . ASN C 1 482 ? -38.828 2.708 10.638 1.00 26.52 ? 790 ASN C O 1 ATOM 9086 C CB . ASN C 1 482 ? -40.649 0.946 11.754 1.00 26.44 ? 790 ASN C CB 1 ATOM 9087 C CG . ASN C 1 482 ? -41.953 0.251 12.124 1.00 28.83 ? 790 ASN C CG 1 ATOM 9088 O OD1 . ASN C 1 482 ? -42.814 0.031 11.271 1.00 28.41 ? 790 ASN C OD1 1 ATOM 9089 N ND2 . ASN C 1 482 ? -42.104 -0.096 13.405 1.00 26.27 ? 790 ASN C ND2 1 ATOM 9090 N N . GLY C 1 483 ? -38.532 1.497 8.767 1.00 26.01 ? 791 GLY C N 1 ATOM 9091 C CA . GLY C 1 483 ? -37.421 2.296 8.283 1.00 25.00 ? 791 GLY C CA 1 ATOM 9092 C C . GLY C 1 483 ? -36.074 1.874 8.844 1.00 21.77 ? 791 GLY C C 1 ATOM 9093 O O . GLY C 1 483 ? -35.034 2.386 8.430 1.00 20.68 ? 791 GLY C O 1 ATOM 9094 N N . PHE C 1 484 ? -36.090 0.935 9.783 1.00 20.88 ? 792 PHE C N 1 ATOM 9095 C CA . PHE C 1 484 ? -34.853 0.427 10.373 1.00 20.91 ? 792 PHE C CA 1 ATOM 9096 C C . PHE C 1 484 ? -34.295 -0.758 9.593 1.00 24.26 ? 792 PHE C C 1 ATOM 9097 O O . PHE C 1 484 ? -35.050 -1.592 9.089 1.00 24.69 ? 792 PHE C O 1 ATOM 9098 C CB . PHE C 1 484 ? -35.071 0.015 11.829 1.00 20.01 ? 792 PHE C CB 1 ATOM 9099 C CG . PHE C 1 484 ? -35.373 1.168 12.745 1.00 22.62 ? 792 PHE C CG 1 ATOM 9100 C CD1 . PHE C 1 484 ? -34.345 1.882 13.343 1.00 22.20 ? 792 PHE C CD1 1 ATOM 9101 C CD2 . PHE C 1 484 ? -36.677 1.528 13.015 1.00 24.02 ? 792 PHE C CD2 1 ATOM 9102 C CE1 . PHE C 1 484 ? -34.619 2.943 14.189 1.00 22.09 ? 792 PHE C CE1 1 ATOM 9103 C CE2 . PHE C 1 484 ? -36.962 2.588 13.863 1.00 26.30 ? 792 PHE C CE2 1 ATOM 9104 C CZ . PHE C 1 484 ? -35.925 3.297 14.450 1.00 23.88 ? 792 PHE C CZ 1 ATOM 9105 N N . SER C 1 485 ? -32.970 -0.824 9.508 1.00 20.74 ? 793 SER C N 1 ATOM 9106 C CA . SER C 1 485 ? -32.288 -1.920 8.835 1.00 20.57 ? 793 SER C CA 1 ATOM 9107 C C . SER C 1 485 ? -32.147 -3.115 9.771 1.00 20.52 ? 793 SER C C 1 ATOM 9108 O O . SER C 1 485 ? -31.486 -3.026 10.799 1.00 23.31 ? 793 SER C O 1 ATOM 9109 C CB . SER C 1 485 ? -30.894 -1.477 8.381 1.00 25.22 ? 793 SER C CB 1 ATOM 9110 O OG . SER C 1 485 ? -30.924 -0.166 7.851 1.00 31.07 ? 793 SER C OG 1 ATOM 9111 N N . ILE C 1 486 ? -32.763 -4.231 9.402 1.00 22.46 ? 794 ILE C N 1 ATOM 9112 C CA . ILE C 1 486 ? -32.690 -5.453 10.191 1.00 23.09 ? 794 ILE C CA 1 ATOM 9113 C C . ILE C 1 486 ? -31.891 -6.511 9.423 1.00 23.74 ? 794 ILE C C 1 ATOM 9114 O O . ILE C 1 486 ? -32.346 -7.009 8.395 1.00 23.62 ? 794 ILE C O 1 ATOM 9115 C CB . ILE C 1 486 ? -34.090 -6.018 10.481 1.00 22.75 ? 794 ILE C CB 1 ATOM 9116 C CG1 . ILE C 1 486 ? -35.031 -4.926 11.014 1.00 24.25 ? 794 ILE C CG1 1 ATOM 9117 C CG2 . ILE C 1 486 ? -33.997 -7.154 11.471 1.00 22.59 ? 794 ILE C CG2 1 ATOM 9118 C CD1 . ILE C 1 486 ? -34.531 -4.264 12.283 1.00 24.96 ? 794 ILE C CD1 1 ATOM 9119 N N . SER C 1 487 ? -30.715 -6.858 9.937 1.00 20.57 ? 795 SER C N 1 ATOM 9120 C CA . SER C 1 487 ? -29.786 -7.737 9.232 1.00 18.70 ? 795 SER C CA 1 ATOM 9121 C C . SER C 1 487 ? -29.839 -9.178 9.729 1.00 19.24 ? 795 SER C C 1 ATOM 9122 O O . SER C 1 487 ? -29.963 -9.422 10.926 1.00 16.89 ? 795 SER C O 1 ATOM 9123 C CB . SER C 1 487 ? -28.354 -7.228 9.422 1.00 21.32 ? 795 SER C CB 1 ATOM 9124 O OG . SER C 1 487 ? -28.182 -5.948 8.853 1.00 24.12 ? 795 SER C OG 1 ATOM 9125 N N . ASN C 1 488 ? -29.733 -10.125 8.800 1.00 18.91 ? 796 ASN C N 1 ATOM 9126 C CA . ASN C 1 488 ? -29.489 -11.521 9.146 1.00 17.93 ? 796 ASN C CA 1 ATOM 9127 C C . ASN C 1 488 ? -28.071 -11.649 9.696 1.00 14.99 ? 796 ASN C C 1 ATOM 9128 O O . ASN C 1 488 ? -27.100 -11.344 8.999 1.00 15.39 ? 796 ASN C O 1 ATOM 9129 C CB . ASN C 1 488 ? -29.634 -12.401 7.897 1.00 19.68 ? 796 ASN C CB 1 ATOM 9130 C CG . ASN C 1 488 ? -29.659 -13.888 8.215 1.00 17.75 ? 796 ASN C CG 1 ATOM 9131 O OD1 . ASN C 1 488 ? -29.046 -14.343 9.174 1.00 18.60 ? 796 ASN C OD1 1 ATOM 9132 N ND2 . ASN C 1 488 ? -30.376 -14.656 7.398 1.00 21.02 ? 796 ASN C ND2 1 ATOM 9133 N N . GLY C 1 489 ? -27.949 -12.118 10.932 1.00 12.97 ? 797 GLY C N 1 ATOM 9134 C CA . GLY C 1 489 ? -26.648 -12.286 11.565 1.00 11.48 ? 797 GLY C CA 1 ATOM 9135 C C . GLY C 1 489 ? -25.660 -13.209 10.853 1.00 16.63 ? 797 GLY C C 1 ATOM 9136 O O . GLY C 1 489 ? -24.458 -13.167 11.139 1.00 15.30 ? 797 GLY C O 1 ATOM 9137 N N . LEU C 1 490 ? -26.148 -14.042 9.935 1.00 17.05 ? 798 LEU C N 1 ATOM 9138 C CA . LEU C 1 490 ? -25.270 -14.938 9.173 1.00 14.05 ? 798 LEU C CA 1 ATOM 9139 C C . LEU C 1 490 ? -24.681 -14.262 7.937 1.00 16.69 ? 798 LEU C C 1 ATOM 9140 O O . LEU C 1 490 ? -23.828 -14.834 7.253 1.00 17.24 ? 798 LEU C O 1 ATOM 9141 C CB . LEU C 1 490 ? -26.028 -16.188 8.722 1.00 13.86 ? 798 LEU C CB 1 ATOM 9142 C CG . LEU C 1 490 ? -26.406 -17.200 9.805 1.00 13.94 ? 798 LEU C CG 1 ATOM 9143 C CD1 . LEU C 1 490 ? -27.300 -18.293 9.226 1.00 12.98 ? 798 LEU C CD1 1 ATOM 9144 C CD2 . LEU C 1 490 ? -25.146 -17.787 10.432 1.00 14.90 ? 798 LEU C CD2 1 ATOM 9145 N N . ALA C 1 491 ? -25.143 -13.054 7.647 1.00 16.38 ? 799 ALA C N 1 ATOM 9146 C CA . ALA C 1 491 ? -24.776 -12.386 6.400 1.00 16.65 ? 799 ALA C CA 1 ATOM 9147 C C . ALA C 1 491 ? -23.989 -11.088 6.586 1.00 19.16 ? 799 ALA C C 1 ATOM 9148 O O . ALA C 1 491 ? -23.979 -10.233 5.695 1.00 21.22 ? 799 ALA C O 1 ATOM 9149 C CB . ALA C 1 491 ? -26.034 -12.123 5.560 1.00 17.76 ? 799 ALA C CB 1 ATOM 9150 N N . THR C 1 492 ? -23.313 -10.947 7.719 1.00 17.95 ? 800 THR C N 1 ATOM 9151 C CA . THR C 1 492 ? -22.608 -9.702 8.032 1.00 19.79 ? 800 THR C CA 1 ATOM 9152 C C . THR C 1 492 ? -21.536 -9.321 7.002 1.00 20.82 ? 800 THR C C 1 ATOM 9153 O O . THR C 1 492 ? -21.360 -8.138 6.695 1.00 23.15 ? 800 THR C O 1 ATOM 9154 C CB . THR C 1 492 ? -21.978 -9.737 9.444 1.00 21.39 ? 800 THR C CB 1 ATOM 9155 O OG1 . THR C 1 492 ? -21.008 -10.787 9.513 1.00 27.28 ? 800 THR C OG1 1 ATOM 9156 C CG2 . THR C 1 492 ? -23.043 -9.977 10.492 1.00 20.03 ? 800 THR C CG2 1 ATOM 9157 N N . THR C 1 493 ? -20.834 -10.309 6.453 1.00 17.99 ? 801 THR C N 1 ATOM 9158 C CA . THR C 1 493 ? -19.809 -10.004 5.454 1.00 19.88 ? 801 THR C CA 1 ATOM 9159 C C . THR C 1 493 ? -20.386 -9.433 4.162 1.00 19.21 ? 801 THR C C 1 ATOM 9160 O O . THR C 1 493 ? -19.695 -8.717 3.437 1.00 21.45 ? 801 THR C O 1 ATOM 9161 C CB . THR C 1 493 ? -18.916 -11.214 5.128 1.00 22.45 ? 801 THR C CB 1 ATOM 9162 O OG1 . THR C 1 493 ? -19.697 -12.234 4.495 1.00 23.17 ? 801 THR C OG1 1 ATOM 9163 C CG2 . THR C 1 493 ? -18.290 -11.758 6.394 1.00 19.81 ? 801 THR C CG2 1 ATOM 9164 N N . GLN C 1 494 ? -21.644 -9.746 3.876 1.00 18.84 ? 802 GLN C N 1 ATOM 9165 C CA . GLN C 1 494 ? -22.301 -9.250 2.671 1.00 21.98 ? 802 GLN C CA 1 ATOM 9166 C C . GLN C 1 494 ? -22.873 -7.846 2.875 1.00 23.12 ? 802 GLN C C 1 ATOM 9167 O O . GLN C 1 494 ? -23.206 -7.154 1.909 1.00 25.04 ? 802 GLN C O 1 ATOM 9168 C CB . GLN C 1 494 ? -23.414 -10.205 2.235 1.00 21.52 ? 802 GLN C CB 1 ATOM 9169 C CG . GLN C 1 494 ? -22.940 -11.626 1.966 1.00 22.15 ? 802 GLN C CG 1 ATOM 9170 C CD . GLN C 1 494 ? -24.085 -12.588 1.749 1.00 23.97 ? 802 GLN C CD 1 ATOM 9171 O OE1 . GLN C 1 494 ? -24.842 -12.467 0.786 1.00 27.98 ? 802 GLN C OE1 1 ATOM 9172 N NE2 . GLN C 1 494 ? -24.229 -13.546 2.656 1.00 25.03 ? 802 GLN C NE2 1 ATOM 9173 N N . ILE C 1 495 ? -22.988 -7.433 4.131 1.00 19.94 ? 803 ILE C N 1 ATOM 9174 C CA . ILE C 1 495 ? -23.558 -6.128 4.460 1.00 19.49 ? 803 ILE C CA 1 ATOM 9175 C C . ILE C 1 495 ? -22.469 -5.103 4.751 1.00 20.19 ? 803 ILE C C 1 ATOM 9176 O O . ILE C 1 495 ? -22.499 -3.980 4.242 1.00 21.27 ? 803 ILE C O 1 ATOM 9177 C CB . ILE C 1 495 ? -24.512 -6.239 5.655 1.00 20.58 ? 803 ILE C CB 1 ATOM 9178 C CG1 . ILE C 1 495 ? -25.673 -7.169 5.290 1.00 23.02 ? 803 ILE C CG1 1 ATOM 9179 C CG2 . ILE C 1 495 ? -25.029 -4.861 6.064 1.00 20.94 ? 803 ILE C CG2 1 ATOM 9180 C CD1 . ILE C 1 495 ? -26.422 -7.716 6.478 1.00 22.92 ? 803 ILE C CD1 1 ATOM 9181 N N . ASN C 1 496 ? -21.506 -5.504 5.572 1.00 19.66 ? 804 ASN C N 1 ATOM 9182 C CA . ASN C 1 496 ? -20.370 -4.654 5.908 1.00 21.43 ? 804 ASN C CA 1 ATOM 9183 C C . ASN C 1 496 ? -19.244 -5.537 6.401 1.00 19.08 ? 804 ASN C C 1 ATOM 9184 O O . ASN C 1 496 ? -19.262 -5.984 7.543 1.00 17.50 ? 804 ASN C O 1 ATOM 9185 C CB . ASN C 1 496 ? -20.761 -3.630 6.981 1.00 20.00 ? 804 ASN C CB 1 ATOM 9186 C CG . ASN C 1 496 ? -19.596 -2.734 7.400 1.00 19.83 ? 804 ASN C CG 1 ATOM 9187 O OD1 . ASN C 1 496 ? -18.468 -2.894 6.939 1.00 19.61 ? 804 ASN C OD1 1 ATOM 9188 N ND2 . ASN C 1 496 ? -19.879 -1.776 8.269 1.00 18.75 ? 804 ASN C ND2 1 ATOM 9189 N N . ASN C 1 497 ? -18.256 -5.780 5.543 1.00 19.36 ? 805 ASN C N 1 ATOM 9190 C CA . ASN C 1 497 ? -17.180 -6.706 5.893 1.00 20.87 ? 805 ASN C CA 1 ATOM 9191 C C . ASN C 1 497 ? -16.296 -6.223 7.050 1.00 20.02 ? 805 ASN C C 1 ATOM 9192 O O . ASN C 1 497 ? -15.819 -7.026 7.855 1.00 20.11 ? 805 ASN C O 1 ATOM 9193 C CB . ASN C 1 497 ? -16.330 -7.049 4.661 1.00 26.05 ? 805 ASN C CB 1 ATOM 9194 C CG . ASN C 1 497 ? -15.480 -8.288 4.875 1.00 32.36 ? 805 ASN C CG 1 ATOM 9195 O OD1 . ASN C 1 497 ? -16.004 -9.372 5.137 1.00 34.95 ? 805 ASN C OD1 1 ATOM 9196 N ND2 . ASN C 1 497 ? -14.163 -8.135 4.770 1.00 34.81 ? 805 ASN C ND2 1 ATOM 9197 N N . LYS C 1 498 ? -16.080 -4.913 7.131 1.00 16.79 ? 806 LYS C N 1 ATOM 9198 C CA . LYS C 1 498 ? -15.335 -4.328 8.247 1.00 17.23 ? 806 LYS C CA 1 ATOM 9199 C C . LYS C 1 498 ? -16.049 -4.535 9.580 1.00 17.27 ? 806 LYS C C 1 ATOM 9200 O O . LYS C 1 498 ? -15.407 -4.720 10.618 1.00 19.03 ? 806 LYS C O 1 ATOM 9201 C CB . LYS C 1 498 ? -15.109 -2.833 8.021 1.00 20.20 ? 806 LYS C CB 1 ATOM 9202 C CG . LYS C 1 498 ? -14.123 -2.501 6.906 1.00 28.35 ? 806 LYS C CG 1 ATOM 9203 C CD . LYS C 1 498 ? -12.694 -2.458 7.414 1.00 34.48 ? 806 LYS C CD 1 ATOM 9204 C CE . LYS C 1 498 ? -11.745 -1.926 6.345 1.00 39.36 ? 806 LYS C CE 1 ATOM 9205 N NZ . LYS C 1 498 ? -10.325 -1.908 6.808 1.00 42.54 ? 806 LYS C NZ 1 ATOM 9206 N N . ALA C 1 499 ? -17.377 -4.502 9.560 1.00 15.07 ? 807 ALA C N 1 ATOM 9207 C CA . ALA C 1 499 ? -18.140 -4.756 10.781 1.00 19.21 ? 807 ALA C CA 1 ATOM 9208 C C . ALA C 1 499 ? -18.090 -6.235 11.168 1.00 16.22 ? 807 ALA C C 1 ATOM 9209 O O . ALA C 1 499 ? -18.100 -6.585 12.350 1.00 18.11 ? 807 ALA C O 1 ATOM 9210 C CB . ALA C 1 499 ? -19.580 -4.291 10.624 1.00 19.23 ? 807 ALA C CB 1 ATOM 9211 N N . ALA C 1 500 ? -18.040 -7.101 10.166 1.00 16.41 ? 808 ALA C N 1 ATOM 9212 C CA . ALA C 1 500 ? -17.951 -8.539 10.411 1.00 19.01 ? 808 ALA C CA 1 ATOM 9213 C C . ALA C 1 500 ? -16.650 -8.913 11.135 1.00 17.48 ? 808 ALA C C 1 ATOM 9214 O O . ALA C 1 500 ? -16.637 -9.795 11.989 1.00 19.54 ? 808 ALA C O 1 ATOM 9215 C CB . ALA C 1 500 ? -18.071 -9.302 9.101 1.00 18.99 ? 808 ALA C CB 1 ATOM 9216 N N . THR C 1 501 ? -15.563 -8.227 10.799 1.00 13.83 ? 809 THR C N 1 ATOM 9217 C CA . THR C 1 501 ? -14.244 -8.546 11.355 1.00 15.86 ? 809 THR C CA 1 ATOM 9218 C C . THR C 1 501 ? -13.937 -7.803 12.653 1.00 17.06 ? 809 THR C C 1 ATOM 9219 O O . THR C 1 501 ? -12.918 -8.060 13.291 1.00 16.60 ? 809 THR C O 1 ATOM 9220 C CB . THR C 1 501 ? -13.122 -8.202 10.364 1.00 21.02 ? 809 THR C CB 1 ATOM 9221 O OG1 . THR C 1 501 ? -13.111 -6.785 10.150 1.00 21.74 ? 809 THR C OG1 1 ATOM 9222 C CG2 . THR C 1 501 ? -13.338 -8.918 9.037 1.00 25.22 ? 809 THR C CG2 1 ATOM 9223 N N . GLY C 1 502 ? -14.804 -6.874 13.038 1.00 17.95 ? 810 GLY C N 1 ATOM 9224 C CA . GLY C 1 502 ? -14.574 -6.089 14.237 1.00 17.45 ? 810 GLY C CA 1 ATOM 9225 C C . GLY C 1 502 ? -13.804 -4.796 13.995 1.00 17.63 ? 810 GLY C C 1 ATOM 9226 O O . GLY C 1 502 ? -13.491 -4.076 14.939 1.00 18.98 ? 810 GLY C O 1 ATOM 9227 N N . GLU C 1 503 ? -13.503 -4.489 12.738 1.00 16.97 ? 811 GLU C N 1 ATOM 9228 C CA . GLU C 1 503 ? -12.814 -3.233 12.418 1.00 18.64 ? 811 GLU C CA 1 ATOM 9229 C C . GLU C 1 503 ? -13.734 -2.020 12.545 1.00 19.64 ? 811 GLU C C 1 ATOM 9230 O O . GLU C 1 503 ? -13.269 -0.898 12.764 1.00 18.92 ? 811 GLU C O 1 ATOM 9231 C CB . GLU C 1 503 ? -12.228 -3.281 11.010 1.00 20.43 ? 811 GLU C CB 1 ATOM 9232 C CG . GLU C 1 503 ? -11.012 -4.178 10.876 1.00 19.46 ? 811 GLU C CG 1 ATOM 9233 C CD . GLU C 1 503 ? -10.449 -4.158 9.475 1.00 24.86 ? 811 GLU C CD 1 ATOM 9234 O OE1 . GLU C 1 503 ? -10.597 -5.173 8.769 1.00 31.65 ? 811 GLU C OE1 1 ATOM 9235 O OE2 . GLU C 1 503 ? -9.882 -3.121 9.072 1.00 23.49 ? 811 GLU C OE2 1 ATOM 9236 N N . GLU C 1 504 ? -15.033 -2.251 12.373 1.00 17.34 ? 812 GLU C N 1 ATOM 9237 C CA . GLU C 1 504 ? -16.047 -1.204 12.507 1.00 17.14 ? 812 GLU C CA 1 ATOM 9238 C C . GLU C 1 504 ? -17.198 -1.726 13.355 1.00 16.71 ? 812 GLU C C 1 ATOM 9239 O O . GLU C 1 504 ? -17.462 -2.924 13.378 1.00 13.91 ? 812 GLU C O 1 ATOM 9240 C CB . GLU C 1 504 ? -16.610 -0.796 11.135 1.00 20.26 ? 812 GLU C CB 1 ATOM 9241 C CG . GLU C 1 504 ? -15.674 0.034 10.267 1.00 23.79 ? 812 GLU C CG 1 ATOM 9242 C CD . GLU C 1 504 ? -16.309 0.447 8.939 1.00 25.88 ? 812 GLU C CD 1 ATOM 9243 O OE1 . GLU C 1 504 ? -15.603 1.054 8.107 1.00 28.88 ? 812 GLU C OE1 1 ATOM 9244 O OE2 . GLU C 1 504 ? -17.508 0.166 8.726 1.00 21.66 ? 812 GLU C OE2 1 ATOM 9245 N N . VAL C 1 505 ? -17.887 -0.827 14.048 1.00 18.60 ? 813 VAL C N 1 ATOM 9246 C CA . VAL C 1 505 ? -19.091 -1.209 14.774 1.00 18.88 ? 813 VAL C CA 1 ATOM 9247 C C . VAL C 1 505 ? -20.231 -1.322 13.763 1.00 19.35 ? 813 VAL C C 1 ATOM 9248 O O . VAL C 1 505 ? -20.375 -0.448 12.900 1.00 19.09 ? 813 VAL C O 1 ATOM 9249 C CB . VAL C 1 505 ? -19.436 -0.162 15.842 1.00 18.23 ? 813 VAL C CB 1 ATOM 9250 C CG1 . VAL C 1 505 ? -20.717 -0.542 16.575 1.00 17.87 ? 813 VAL C CG1 1 ATOM 9251 C CG2 . VAL C 1 505 ? -18.276 -0.022 16.829 1.00 15.75 ? 813 VAL C CG2 1 ATOM 9252 N N . PRO C 1 506 ? -21.025 -2.406 13.839 1.00 16.71 ? 814 PRO C N 1 ATOM 9253 C CA . PRO C 1 506 ? -22.150 -2.551 12.903 1.00 15.71 ? 814 PRO C CA 1 ATOM 9254 C C . PRO C 1 506 ? -23.100 -1.365 13.004 1.00 15.85 ? 814 PRO C C 1 ATOM 9255 O O . PRO C 1 506 ? -23.328 -0.864 14.110 1.00 18.03 ? 814 PRO C O 1 ATOM 9256 C CB . PRO C 1 506 ? -22.869 -3.815 13.399 1.00 17.49 ? 814 PRO C CB 1 ATOM 9257 C CG . PRO C 1 506 ? -21.832 -4.576 14.173 1.00 18.37 ? 814 PRO C CG 1 ATOM 9258 C CD . PRO C 1 506 ? -20.908 -3.552 14.764 1.00 16.96 ? 814 PRO C CD 1 ATOM 9259 N N . ARG C 1 507 ? -23.650 -0.924 11.873 1.00 15.75 ? 815 ARG C N 1 ATOM 9260 C CA . ARG C 1 507 ? -24.565 0.216 11.870 1.00 16.50 ? 815 ARG C CA 1 ATOM 9261 C C . ARG C 1 507 ? -26.010 -0.197 11.582 1.00 19.11 ? 815 ARG C C 1 ATOM 9262 O O . ARG C 1 507 ? -26.884 0.651 11.402 1.00 20.51 ? 815 ARG C O 1 ATOM 9263 C CB . ARG C 1 507 ? -24.082 1.299 10.890 1.00 14.94 ? 815 ARG C CB 1 ATOM 9264 C CG . ARG C 1 507 ? -22.726 1.876 11.278 1.00 16.02 ? 815 ARG C CG 1 ATOM 9265 C CD . ARG C 1 507 ? -22.273 3.007 10.342 1.00 17.66 ? 815 ARG C CD 1 ATOM 9266 N NE . ARG C 1 507 ? -22.087 2.575 8.958 1.00 19.00 ? 815 ARG C NE 1 ATOM 9267 C CZ . ARG C 1 507 ? -20.979 2.008 8.484 1.00 21.32 ? 815 ARG C CZ 1 ATOM 9268 N NH1 . ARG C 1 507 ? -19.940 1.776 9.282 1.00 17.95 ? 815 ARG C NH1 1 ATOM 9269 N NH2 . ARG C 1 507 ? -20.912 1.666 7.204 1.00 21.67 ? 815 ARG C NH2 1 ATOM 9270 N N . THR C 1 508 ? -26.254 -1.505 11.555 1.00 16.25 ? 816 THR C N 1 ATOM 9271 C CA . THR C 1 508 ? -27.603 -2.030 11.409 1.00 19.61 ? 816 THR C CA 1 ATOM 9272 C C . THR C 1 508 ? -27.991 -2.818 12.665 1.00 18.15 ? 816 THR C C 1 ATOM 9273 O O . THR C 1 508 ? -27.157 -3.104 13.520 1.00 17.53 ? 816 THR C O 1 ATOM 9274 C CB . THR C 1 508 ? -27.738 -2.973 10.185 1.00 18.87 ? 816 THR C CB 1 ATOM 9275 O OG1 . THR C 1 508 ? -27.021 -4.191 10.433 1.00 20.85 ? 816 THR C OG1 1 ATOM 9276 C CG2 . THR C 1 508 ? -27.209 -2.320 8.909 1.00 21.15 ? 816 THR C CG2 1 ATOM 9277 N N . ILE C 1 509 ? -29.269 -3.155 12.770 1.00 17.90 ? 817 ILE C N 1 ATOM 9278 C CA . ILE C 1 509 ? -29.747 -4.029 13.834 1.00 18.23 ? 817 ILE C CA 1 ATOM 9279 C C . ILE C 1 509 ? -29.618 -5.479 13.368 1.00 19.31 ? 817 ILE C C 1 ATOM 9280 O O . ILE C 1 509 ? -30.091 -5.833 12.294 1.00 22.64 ? 817 ILE C O 1 ATOM 9281 C CB . ILE C 1 509 ? -31.198 -3.702 14.183 1.00 20.69 ? 817 ILE C CB 1 ATOM 9282 C CG1 . ILE C 1 509 ? -31.257 -2.344 14.892 1.00 19.84 ? 817 ILE C CG1 1 ATOM 9283 C CG2 . ILE C 1 509 ? -31.816 -4.785 15.053 1.00 18.39 ? 817 ILE C CG2 1 ATOM 9284 C CD1 . ILE C 1 509 ? -32.611 -1.717 14.862 1.00 20.95 ? 817 ILE C CD1 1 ATOM 9285 N N . ILE C 1 510 ? -28.969 -6.308 14.176 1.00 16.13 ? 818 ILE C N 1 ATOM 9286 C CA . ILE C 1 510 ? -28.640 -7.665 13.766 1.00 16.39 ? 818 ILE C CA 1 ATOM 9287 C C . ILE C 1 510 ? -29.488 -8.689 14.516 1.00 15.65 ? 818 ILE C C 1 ATOM 9288 O O . ILE C 1 510 ? -29.745 -8.533 15.704 1.00 15.42 ? 818 ILE C O 1 ATOM 9289 C CB . ILE C 1 510 ? -27.149 -7.954 13.991 1.00 16.38 ? 818 ILE C CB 1 ATOM 9290 C CG1 . ILE C 1 510 ? -26.300 -6.944 13.211 1.00 16.83 ? 818 ILE C CG1 1 ATOM 9291 C CG2 . ILE C 1 510 ? -26.799 -9.370 13.565 1.00 18.54 ? 818 ILE C CG2 1 ATOM 9292 C CD1 . ILE C 1 510 ? -24.809 -7.114 13.404 1.00 22.29 ? 818 ILE C CD1 1 ATOM 9293 N N . VAL C 1 511 ? -29.935 -9.721 13.801 1.00 14.36 ? 819 VAL C N 1 ATOM 9294 C CA . VAL C 1 511 ? -30.752 -10.777 14.380 1.00 15.11 ? 819 VAL C CA 1 ATOM 9295 C C . VAL C 1 511 ? -29.918 -12.043 14.521 1.00 16.76 ? 819 VAL C C 1 ATOM 9296 O O . VAL C 1 511 ? -29.267 -12.471 13.567 1.00 17.51 ? 819 VAL C O 1 ATOM 9297 C CB . VAL C 1 511 ? -31.947 -11.117 13.486 1.00 19.20 ? 819 VAL C CB 1 ATOM 9298 C CG1 . VAL C 1 511 ? -32.846 -12.150 14.162 1.00 23.20 ? 819 VAL C CG1 1 ATOM 9299 C CG2 . VAL C 1 511 ? -32.720 -9.879 13.160 1.00 23.69 ? 819 VAL C CG2 1 ATOM 9300 N N . THR C 1 512 ? -29.952 -12.642 15.707 1.00 15.70 ? 820 THR C N 1 ATOM 9301 C CA . THR C 1 512 ? -29.187 -13.856 15.980 1.00 16.11 ? 820 THR C CA 1 ATOM 9302 C C . THR C 1 512 ? -30.124 -14.899 16.563 1.00 16.09 ? 820 THR C C 1 ATOM 9303 O O . THR C 1 512 ? -30.885 -14.604 17.492 1.00 14.48 ? 820 THR C O 1 ATOM 9304 C CB . THR C 1 512 ? -28.063 -13.572 16.979 1.00 13.95 ? 820 THR C CB 1 ATOM 9305 O OG1 . THR C 1 512 ? -27.346 -12.413 16.548 1.00 14.53 ? 820 THR C OG1 1 ATOM 9306 C CG2 . THR C 1 512 ? -27.104 -14.766 17.079 1.00 16.30 ? 820 THR C CG2 1 ATOM 9307 N N . THR C 1 513 ? -30.113 -16.107 16.004 1.00 14.98 ? 821 THR C N 1 ATOM 9308 C CA . THR C 1 513 ? -31.093 -17.103 16.421 1.00 14.05 ? 821 THR C CA 1 ATOM 9309 C C . THR C 1 513 ? -30.513 -18.496 16.521 1.00 16.44 ? 821 THR C C 1 ATOM 9310 O O . THR C 1 513 ? -29.602 -18.852 15.789 1.00 15.72 ? 821 THR C O 1 ATOM 9311 C CB . THR C 1 513 ? -32.309 -17.189 15.459 1.00 23.98 ? 821 THR C CB 1 ATOM 9312 O OG1 . THR C 1 513 ? -31.949 -17.950 14.299 1.00 25.62 ? 821 THR C OG1 1 ATOM 9313 C CG2 . THR C 1 513 ? -32.793 -15.812 15.051 1.00 21.30 ? 821 THR C CG2 1 ATOM 9314 N N . ARG C 1 514 ? -31.062 -19.297 17.427 1.00 16.76 ? 822 ARG C N 1 ATOM 9315 C CA . ARG C 1 514 ? -30.661 -20.693 17.516 1.00 14.89 ? 822 ARG C CA 1 ATOM 9316 C C . ARG C 1 514 ? -30.887 -21.438 16.201 1.00 16.46 ? 822 ARG C C 1 ATOM 9317 O O . ARG C 1 514 ? -30.109 -22.322 15.848 1.00 17.92 ? 822 ARG C O 1 ATOM 9318 C CB . ARG C 1 514 ? -31.390 -21.377 18.675 1.00 19.43 ? 822 ARG C CB 1 ATOM 9319 C CG . ARG C 1 514 ? -30.777 -20.998 20.008 1.00 19.91 ? 822 ARG C CG 1 ATOM 9320 C CD . ARG C 1 514 ? -31.372 -21.800 21.155 1.00 20.65 ? 822 ARG C CD 1 ATOM 9321 N NE . ARG C 1 514 ? -30.584 -21.596 22.360 1.00 21.07 ? 822 ARG C NE 1 ATOM 9322 C CZ . ARG C 1 514 ? -30.691 -22.326 23.463 1.00 20.15 ? 822 ARG C CZ 1 ATOM 9323 N NH1 . ARG C 1 514 ? -31.555 -23.336 23.517 1.00 14.41 ? 822 ARG C NH1 1 ATOM 9324 N NH2 . ARG C 1 514 ? -29.915 -22.056 24.502 1.00 18.24 ? 822 ARG C NH2 1 ATOM 9325 N N . SER C 1 515 ? -31.949 -21.081 15.480 1.00 15.85 ? 823 SER C N 1 ATOM 9326 C CA . SER C 1 515 ? -32.256 -21.744 14.214 1.00 20.41 ? 823 SER C CA 1 ATOM 9327 C C . SER C 1 515 ? -31.170 -21.518 13.157 1.00 21.85 ? 823 SER C C 1 ATOM 9328 O O . SER C 1 515 ? -31.000 -22.339 12.259 1.00 21.25 ? 823 SER C O 1 ATOM 9329 C CB . SER C 1 515 ? -33.626 -21.302 13.671 1.00 21.52 ? 823 SER C CB 1 ATOM 9330 O OG . SER C 1 515 ? -33.601 -19.946 13.265 1.00 24.34 ? 823 SER C OG 1 ATOM 9331 N N . GLN C 1 516 ? -30.440 -20.407 13.264 1.00 20.63 ? 824 GLN C N 1 ATOM 9332 C CA . GLN C 1 516 ? -29.334 -20.122 12.349 1.00 18.72 ? 824 GLN C CA 1 ATOM 9333 C C . GLN C 1 516 ? -28.212 -21.160 12.472 1.00 22.57 ? 824 GLN C C 1 ATOM 9334 O O . GLN C 1 516 ? -27.396 -21.312 11.563 1.00 24.76 ? 824 GLN C O 1 ATOM 9335 C CB . GLN C 1 516 ? -28.736 -18.741 12.645 1.00 20.27 ? 824 GLN C CB 1 ATOM 9336 C CG . GLN C 1 516 ? -29.522 -17.556 12.104 1.00 18.29 ? 824 GLN C CG 1 ATOM 9337 C CD . GLN C 1 516 ? -29.006 -16.236 12.646 1.00 18.25 ? 824 GLN C CD 1 ATOM 9338 O OE1 . GLN C 1 516 ? -28.363 -16.192 13.696 1.00 15.92 ? 824 GLN C OE1 1 ATOM 9339 N NE2 . GLN C 1 516 ? -29.276 -15.155 11.927 1.00 20.73 ? 824 GLN C NE2 1 ATOM 9340 N N . TYR C 1 517 ? -28.152 -21.852 13.608 1.00 18.39 ? 825 TYR C N 1 ATOM 9341 C CA . TYR C 1 517 ? -27.051 -22.785 13.852 1.00 18.00 ? 825 TYR C CA 1 ATOM 9342 C C . TYR C 1 517 ? -27.547 -24.197 14.148 1.00 18.66 ? 825 TYR C C 1 ATOM 9343 O O . TYR C 1 517 ? -26.768 -25.071 14.548 1.00 16.01 ? 825 TYR C O 1 ATOM 9344 C CB . TYR C 1 517 ? -26.158 -22.272 14.985 1.00 15.75 ? 825 TYR C CB 1 ATOM 9345 C CG . TYR C 1 517 ? -25.592 -20.894 14.699 1.00 15.58 ? 825 TYR C CG 1 ATOM 9346 C CD1 . TYR C 1 517 ? -24.509 -20.735 13.850 1.00 15.53 ? 825 TYR C CD1 1 ATOM 9347 C CD2 . TYR C 1 517 ? -26.163 -19.753 15.259 1.00 15.45 ? 825 TYR C CD2 1 ATOM 9348 C CE1 . TYR C 1 517 ? -24.000 -19.474 13.572 1.00 17.43 ? 825 TYR C CE1 1 ATOM 9349 C CE2 . TYR C 1 517 ? -25.657 -18.491 14.989 1.00 11.91 ? 825 TYR C CE2 1 ATOM 9350 C CZ . TYR C 1 517 ? -24.576 -18.360 14.154 1.00 15.26 ? 825 TYR C CZ 1 ATOM 9351 O OH . TYR C 1 517 ? -24.074 -17.111 13.868 1.00 14.28 ? 825 TYR C OH 1 ATOM 9352 N N . GLY C 1 518 ? -28.847 -24.410 13.951 1.00 15.79 ? 826 GLY C N 1 ATOM 9353 C CA . GLY C 1 518 ? -29.439 -25.716 14.158 1.00 20.86 ? 826 GLY C CA 1 ATOM 9354 C C . GLY C 1 518 ? -29.455 -26.136 15.618 1.00 22.17 ? 826 GLY C C 1 ATOM 9355 O O . GLY C 1 518 ? -29.457 -27.329 15.931 1.00 22.02 ? 826 GLY C O 1 ATOM 9356 N N . LEU C 1 519 ? -29.472 -25.158 16.517 1.00 18.59 ? 827 LEU C N 1 ATOM 9357 C CA . LEU C 1 519 ? -29.523 -25.447 17.953 1.00 20.67 ? 827 LEU C CA 1 ATOM 9358 C C . LEU C 1 519 ? -30.963 -25.679 18.428 1.00 22.03 ? 827 LEU C C 1 ATOM 9359 O O . LEU C 1 519 ? -31.904 -25.065 17.922 1.00 20.07 ? 827 LEU C O 1 ATOM 9360 C CB . LEU C 1 519 ? -28.890 -24.305 18.747 1.00 18.55 ? 827 LEU C CB 1 ATOM 9361 C CG . LEU C 1 519 ? -27.402 -24.060 18.484 1.00 20.28 ? 827 LEU C CG 1 ATOM 9362 C CD1 . LEU C 1 519 ? -26.997 -22.669 18.968 1.00 17.06 ? 827 LEU C CD1 1 ATOM 9363 C CD2 . LEU C 1 519 ? -26.536 -25.140 19.142 1.00 19.95 ? 827 LEU C CD2 1 ATOM 9364 N N . PRO C 1 520 ? -31.142 -26.566 19.414 1.00 25.02 ? 828 PRO C N 1 ATOM 9365 C CA . PRO C 1 520 ? -32.511 -26.864 19.850 1.00 26.70 ? 828 PRO C CA 1 ATOM 9366 C C . PRO C 1 520 ? -33.160 -25.675 20.556 1.00 23.66 ? 828 PRO C C 1 ATOM 9367 O O . PRO C 1 520 ? -32.518 -25.020 21.369 1.00 21.19 ? 828 PRO C O 1 ATOM 9368 C CB . PRO C 1 520 ? -32.321 -28.036 20.820 1.00 27.31 ? 828 PRO C CB 1 ATOM 9369 C CG . PRO C 1 520 ? -30.937 -27.854 21.358 1.00 25.68 ? 828 PRO C CG 1 ATOM 9370 C CD . PRO C 1 520 ? -30.128 -27.267 20.221 1.00 21.60 ? 828 PRO C CD 1 ATOM 9371 N N . GLU C 1 521 ? -34.417 -25.397 20.221 1.00 26.18 ? 829 GLU C N 1 ATOM 9372 C CA . GLU C 1 521 ? -35.181 -24.323 20.855 1.00 30.58 ? 829 GLU C CA 1 ATOM 9373 C C . GLU C 1 521 ? -35.631 -24.696 22.266 1.00 31.04 ? 829 GLU C C 1 ATOM 9374 O O . GLU C 1 521 ? -36.028 -23.832 23.045 1.00 32.65 ? 829 GLU C O 1 ATOM 9375 C CB . GLU C 1 521 ? -36.430 -23.990 20.030 1.00 38.15 ? 829 GLU C CB 1 ATOM 9376 C CG . GLU C 1 521 ? -36.189 -23.843 18.536 1.00 45.88 ? 829 GLU C CG 1 ATOM 9377 C CD . GLU C 1 521 ? -35.554 -22.518 18.160 1.00 48.07 ? 829 GLU C CD 1 ATOM 9378 O OE1 . GLU C 1 521 ? -34.455 -22.539 17.562 1.00 47.73 ? 829 GLU C OE1 1 ATOM 9379 O OE2 . GLU C 1 521 ? -36.163 -21.462 18.445 1.00 48.10 ? 829 GLU C OE2 1 ATOM 9380 N N . ASP C 1 522 ? -35.571 -25.978 22.601 1.00 29.96 ? 830 ASP C N 1 ATOM 9381 C CA . ASP C 1 522 ? -36.158 -26.435 23.857 1.00 32.08 ? 830 ASP C CA 1 ATOM 9382 C C . ASP C 1 522 ? -35.180 -27.179 24.756 1.00 31.79 ? 830 ASP C C 1 ATOM 9383 O O . ASP C 1 522 ? -35.574 -28.080 25.499 1.00 36.72 ? 830 ASP C O 1 ATOM 9384 C CB . ASP C 1 522 ? -37.361 -27.334 23.567 1.00 36.88 ? 830 ASP C CB 1 ATOM 9385 C CG . ASP C 1 522 ? -36.966 -28.627 22.870 1.00 41.57 ? 830 ASP C CG 1 ATOM 9386 O OD1 . ASP C 1 522 ? -35.838 -28.700 22.329 1.00 38.99 ? 830 ASP C OD1 1 ATOM 9387 O OD2 . ASP C 1 522 ? -37.789 -29.566 22.856 1.00 45.53 ? 830 ASP C OD2 1 ATOM 9388 N N . ALA C 1 523 ? -33.909 -26.812 24.691 1.00 29.10 ? 831 ALA C N 1 ATOM 9389 C CA . ALA C 1 523 ? -32.906 -27.513 25.473 1.00 28.34 ? 831 ALA C CA 1 ATOM 9390 C C . ALA C 1 523 ? -31.767 -26.602 25.905 1.00 22.55 ? 831 ALA C C 1 ATOM 9391 O O . ALA C 1 523 ? -31.598 -25.494 25.389 1.00 19.72 ? 831 ALA C O 1 ATOM 9392 C CB . ALA C 1 523 ? -32.369 -28.712 24.698 1.00 29.03 ? 831 ALA C CB 1 ATOM 9393 N N . ILE C 1 524 ? -30.996 -27.080 26.872 1.00 19.10 ? 832 ILE C N 1 ATOM 9394 C CA . ILE C 1 524 ? -29.827 -26.358 27.355 1.00 15.46 ? 832 ILE C CA 1 ATOM 9395 C C . ILE C 1 524 ? -28.707 -26.468 26.331 1.00 20.01 ? 832 ILE C C 1 ATOM 9396 O O . ILE C 1 524 ? -28.418 -27.553 25.843 1.00 18.92 ? 832 ILE C O 1 ATOM 9397 C CB . ILE C 1 524 ? -29.347 -26.967 28.685 1.00 18.36 ? 832 ILE C CB 1 ATOM 9398 C CG1 . ILE C 1 524 ? -30.383 -26.712 29.785 1.00 19.35 ? 832 ILE C CG1 1 ATOM 9399 C CG2 . ILE C 1 524 ? -27.981 -26.424 29.072 1.00 15.16 ? 832 ILE C CG2 1 ATOM 9400 C CD1 . ILE C 1 524 ? -30.523 -25.246 30.176 1.00 21.64 ? 832 ILE C CD1 1 ATOM 9401 N N . VAL C 1 525 ? -28.091 -25.340 25.994 1.00 15.28 ? 833 VAL C N 1 ATOM 9402 C CA . VAL C 1 525 ? -26.930 -25.330 25.104 1.00 12.09 ? 833 VAL C CA 1 ATOM 9403 C C . VAL C 1 525 ? -25.654 -25.050 25.893 1.00 15.65 ? 833 VAL C C 1 ATOM 9404 O O . VAL C 1 525 ? -25.482 -23.957 26.431 1.00 15.68 ? 833 VAL C O 1 ATOM 9405 C CB . VAL C 1 525 ? -27.093 -24.271 23.983 1.00 14.58 ? 833 VAL C CB 1 ATOM 9406 C CG1 . VAL C 1 525 ? -25.780 -24.083 23.211 1.00 17.60 ? 833 VAL C CG1 1 ATOM 9407 C CG2 . VAL C 1 525 ? -28.229 -24.662 23.032 1.00 16.00 ? 833 VAL C CG2 1 ATOM 9408 N N . TYR C 1 526 ? -24.779 -26.051 25.993 1.00 15.05 ? 834 TYR C N 1 ATOM 9409 C CA . TYR C 1 526 ? -23.430 -25.845 26.518 1.00 10.82 ? 834 TYR C CA 1 ATOM 9410 C C . TYR C 1 526 ? -22.527 -25.545 25.335 1.00 16.08 ? 834 TYR C C 1 ATOM 9411 O O . TYR C 1 526 ? -22.615 -26.208 24.307 1.00 15.15 ? 834 TYR C O 1 ATOM 9412 C CB . TYR C 1 526 ? -22.902 -27.089 27.224 1.00 11.18 ? 834 TYR C CB 1 ATOM 9413 C CG . TYR C 1 526 ? -23.646 -27.464 28.497 1.00 12.03 ? 834 TYR C CG 1 ATOM 9414 C CD1 . TYR C 1 526 ? -23.377 -26.822 29.700 1.00 12.19 ? 834 TYR C CD1 1 ATOM 9415 C CD2 . TYR C 1 526 ? -24.606 -28.467 28.488 1.00 16.48 ? 834 TYR C CD2 1 ATOM 9416 C CE1 . TYR C 1 526 ? -24.055 -27.168 30.865 1.00 14.15 ? 834 TYR C CE1 1 ATOM 9417 C CE2 . TYR C 1 526 ? -25.291 -28.817 29.647 1.00 17.32 ? 834 TYR C CE2 1 ATOM 9418 C CZ . TYR C 1 526 ? -25.009 -28.166 30.828 1.00 16.54 ? 834 TYR C CZ 1 ATOM 9419 O OH . TYR C 1 526 ? -25.682 -28.523 31.972 1.00 18.78 ? 834 TYR C OH 1 ATOM 9420 N N . CYS C 1 527 ? -21.656 -24.555 25.465 1.00 17.38 ? 835 CYS C N 1 ATOM 9421 C CA . CYS C 1 527 ? -20.748 -24.257 24.362 1.00 16.18 ? 835 CYS C CA 1 ATOM 9422 C C . CYS C 1 527 ? -19.281 -24.295 24.748 1.00 16.65 ? 835 CYS C C 1 ATOM 9423 O O . CYS C 1 527 ? -18.924 -24.246 25.916 1.00 20.59 ? 835 CYS C O 1 ATOM 9424 C CB . CYS C 1 527 ? -21.076 -22.905 23.726 1.00 16.02 ? 835 CYS C CB 1 ATOM 9425 S SG . CYS C 1 527 ? -20.782 -21.479 24.805 1.00 21.05 ? 835 CYS C SG 1 ATOM 9426 N N . ASN C 1 528 ? -18.429 -24.410 23.734 1.00 15.37 ? 836 ASN C N 1 ATOM 9427 C CA . ASN C 1 528 ? -17.021 -24.090 23.884 1.00 15.26 ? 836 ASN C CA 1 ATOM 9428 C C . ASN C 1 528 ? -16.531 -23.714 22.502 1.00 14.01 ? 836 ASN C C 1 ATOM 9429 O O . ASN C 1 528 ? -16.630 -24.514 21.571 1.00 11.20 ? 836 ASN C O 1 ATOM 9430 C CB . ASN C 1 528 ? -16.210 -25.265 24.438 1.00 16.35 ? 836 ASN C CB 1 ATOM 9431 C CG . ASN C 1 528 ? -14.728 -24.918 24.585 1.00 22.48 ? 836 ASN C CG 1 ATOM 9432 O OD1 . ASN C 1 528 ? -14.032 -24.694 23.593 1.00 19.29 ? 836 ASN C OD1 1 ATOM 9433 N ND2 . ASN C 1 528 ? -14.252 -24.847 25.824 1.00 20.10 ? 836 ASN C ND2 1 ATOM 9434 N N . PHE C 1 529 ? -16.030 -22.493 22.362 1.00 11.78 ? 837 PHE C N 1 ATOM 9435 C CA . PHE C 1 529 ? -15.666 -21.983 21.044 1.00 13.03 ? 837 PHE C CA 1 ATOM 9436 C C . PHE C 1 529 ? -14.159 -21.966 20.806 1.00 13.56 ? 837 PHE C C 1 ATOM 9437 O O . PHE C 1 529 ? -13.661 -21.220 19.962 1.00 13.72 ? 837 PHE C O 1 ATOM 9438 C CB . PHE C 1 529 ? -16.237 -20.577 20.864 1.00 15.77 ? 837 PHE C CB 1 ATOM 9439 C CG . PHE C 1 529 ? -17.736 -20.530 20.841 1.00 17.15 ? 837 PHE C CG 1 ATOM 9440 C CD1 . PHE C 1 529 ? -18.465 -21.553 20.258 1.00 17.73 ? 837 PHE C CD1 1 ATOM 9441 C CD2 . PHE C 1 529 ? -18.418 -19.464 21.398 1.00 19.39 ? 837 PHE C CD2 1 ATOM 9442 C CE1 . PHE C 1 529 ? -19.851 -21.504 20.231 1.00 16.49 ? 837 PHE C CE1 1 ATOM 9443 C CE2 . PHE C 1 529 ? -19.799 -19.414 21.368 1.00 18.90 ? 837 PHE C CE2 1 ATOM 9444 C CZ . PHE C 1 529 ? -20.512 -20.429 20.788 1.00 16.13 ? 837 PHE C CZ 1 ATOM 9445 N N . ASN C 1 530 ? -13.431 -22.788 21.550 1.00 13.16 ? 838 ASN C N 1 ATOM 9446 C CA . ASN C 1 530 ? -11.987 -22.846 21.397 1.00 14.72 ? 838 ASN C CA 1 ATOM 9447 C C . ASN C 1 530 ? -11.553 -23.711 20.225 1.00 14.29 ? 838 ASN C C 1 ATOM 9448 O O . ASN C 1 530 ? -12.308 -24.559 19.746 1.00 13.31 ? 838 ASN C O 1 ATOM 9449 C CB . ASN C 1 530 ? -11.332 -23.369 22.677 1.00 14.68 ? 838 ASN C CB 1 ATOM 9450 C CG . ASN C 1 530 ? -11.309 -22.335 23.782 1.00 20.08 ? 838 ASN C CG 1 ATOM 9451 O OD1 . ASN C 1 530 ? -10.647 -21.309 23.663 1.00 27.52 ? 838 ASN C OD1 1 ATOM 9452 N ND2 . ASN C 1 530 ? -11.996 -22.617 24.878 1.00 20.76 ? 838 ASN C ND2 1 ATOM 9453 N N . GLN C 1 531 ? -10.328 -23.486 19.761 1.00 13.43 ? 839 GLN C N 1 ATOM 9454 C CA . GLN C 1 531 ? -9.692 -24.431 18.864 1.00 11.42 ? 839 GLN C CA 1 ATOM 9455 C C . GLN C 1 531 ? -9.711 -25.792 19.544 1.00 14.86 ? 839 GLN C C 1 ATOM 9456 O O . GLN C 1 531 ? -9.480 -25.887 20.745 1.00 14.74 ? 839 GLN C O 1 ATOM 9457 C CB . GLN C 1 531 ? -8.255 -24.015 18.604 1.00 13.62 ? 839 GLN C CB 1 ATOM 9458 C CG . GLN C 1 531 ? -8.127 -22.696 17.873 1.00 14.20 ? 839 GLN C CG 1 ATOM 9459 C CD . GLN C 1 531 ? -6.709 -22.424 17.474 1.00 16.95 ? 839 GLN C CD 1 ATOM 9460 O OE1 . GLN C 1 531 ? -6.192 -23.052 16.557 1.00 16.92 ? 839 GLN C OE1 1 ATOM 9461 N NE2 . GLN C 1 531 ? -6.055 -21.510 18.182 1.00 14.83 ? 839 GLN C NE2 1 ATOM 9462 N N . LEU C 1 532 ? -9.991 -26.837 18.774 1.00 13.97 ? 840 LEU C N 1 ATOM 9463 C CA . LEU C 1 532 ? -10.177 -28.175 19.327 1.00 15.07 ? 840 LEU C CA 1 ATOM 9464 C C . LEU C 1 532 ? -8.936 -28.746 20.014 1.00 14.92 ? 840 LEU C C 1 ATOM 9465 O O . LEU C 1 532 ? -9.043 -29.666 20.825 1.00 14.79 ? 840 LEU C O 1 ATOM 9466 C CB . LEU C 1 532 ? -10.619 -29.126 18.220 1.00 16.32 ? 840 LEU C CB 1 ATOM 9467 C CG . LEU C 1 532 ? -11.931 -28.715 17.553 1.00 16.74 ? 840 LEU C CG 1 ATOM 9468 C CD1 . LEU C 1 532 ? -12.274 -29.718 16.470 1.00 11.57 ? 840 LEU C CD1 1 ATOM 9469 C CD2 . LEU C 1 532 ? -13.041 -28.635 18.597 1.00 15.73 ? 840 LEU C CD2 1 ATOM 9470 N N . TYR C 1 533 ? -7.762 -28.211 19.695 1.00 13.10 ? 841 TYR C N 1 ATOM 9471 C CA . TYR C 1 533 ? -6.532 -28.736 20.291 1.00 16.09 ? 841 TYR C CA 1 ATOM 9472 C C . TYR C 1 533 ? -6.536 -28.620 21.826 1.00 16.36 ? 841 TYR C C 1 ATOM 9473 O O . TYR C 1 533 ? -5.847 -29.370 22.518 1.00 17.19 ? 841 TYR C O 1 ATOM 9474 C CB . TYR C 1 533 ? -5.284 -28.083 19.670 1.00 18.44 ? 841 TYR C CB 1 ATOM 9475 C CG . TYR C 1 533 ? -4.894 -26.730 20.248 1.00 17.12 ? 841 TYR C CG 1 ATOM 9476 C CD1 . TYR C 1 533 ? -4.150 -26.642 21.419 1.00 16.84 ? 841 TYR C CD1 1 ATOM 9477 C CD2 . TYR C 1 533 ? -5.250 -25.545 19.607 1.00 18.34 ? 841 TYR C CD2 1 ATOM 9478 C CE1 . TYR C 1 533 ? -3.787 -25.429 21.946 1.00 17.38 ? 841 TYR C CE1 1 ATOM 9479 C CE2 . TYR C 1 533 ? -4.883 -24.313 20.128 1.00 19.07 ? 841 TYR C CE2 1 ATOM 9480 C CZ . TYR C 1 533 ? -4.149 -24.266 21.300 1.00 19.76 ? 841 TYR C CZ 1 ATOM 9481 O OH . TYR C 1 533 ? -3.773 -23.054 21.829 1.00 20.90 ? 841 TYR C OH 1 ATOM 9482 N N . LYS C 1 534 ? -7.328 -27.687 22.351 1.00 13.16 ? 842 LYS C N 1 ATOM 9483 C CA . LYS C 1 534 ? -7.386 -27.453 23.791 1.00 15.95 ? 842 LYS C CA 1 ATOM 9484 C C . LYS C 1 534 ? -8.118 -28.556 24.555 1.00 17.65 ? 842 LYS C C 1 ATOM 9485 O O . LYS C 1 534 ? -8.043 -28.626 25.789 1.00 16.76 ? 842 LYS C O 1 ATOM 9486 C CB . LYS C 1 534 ? -8.025 -26.088 24.081 1.00 14.61 ? 842 LYS C CB 1 ATOM 9487 C CG . LYS C 1 534 ? -7.266 -24.926 23.441 1.00 14.51 ? 842 LYS C CG 1 ATOM 9488 C CD . LYS C 1 534 ? -7.733 -23.579 23.990 1.00 15.02 ? 842 LYS C CD 1 ATOM 9489 C CE . LYS C 1 534 ? -6.886 -22.435 23.444 1.00 16.37 ? 842 LYS C CE 1 ATOM 9490 N NZ . LYS C 1 534 ? -7.386 -21.111 23.935 1.00 14.65 ? 842 LYS C NZ 1 ATOM 9491 N N . ILE C 1 535 ? -8.832 -29.409 23.822 1.00 16.03 ? 843 ILE C N 1 ATOM 9492 C CA . ILE C 1 535 ? -9.570 -30.520 24.419 1.00 14.76 ? 843 ILE C CA 1 ATOM 9493 C C . ILE C 1 535 ? -8.671 -31.748 24.572 1.00 17.58 ? 843 ILE C C 1 ATOM 9494 O O . ILE C 1 535 ? -7.823 -32.015 23.724 1.00 16.71 ? 843 ILE C O 1 ATOM 9495 C CB . ILE C 1 535 ? -10.799 -30.905 23.550 1.00 16.82 ? 843 ILE C CB 1 ATOM 9496 C CG1 . ILE C 1 535 ? -11.616 -29.667 23.189 1.00 16.35 ? 843 ILE C CG1 1 ATOM 9497 C CG2 . ILE C 1 535 ? -11.675 -31.912 24.274 1.00 15.92 ? 843 ILE C CG2 1 ATOM 9498 C CD1 . ILE C 1 535 ? -12.708 -29.938 22.178 1.00 18.98 ? 843 ILE C CD1 1 ATOM 9499 N N . ASP C 1 536 ? -8.857 -32.499 25.654 1.00 15.79 ? 844 ASP C N 1 ATOM 9500 C CA . ASP C 1 536 ? -8.150 -33.768 25.817 1.00 17.87 ? 844 ASP C CA 1 ATOM 9501 C C . ASP C 1 536 ? -9.143 -34.860 26.250 1.00 16.79 ? 844 ASP C C 1 ATOM 9502 O O . ASP C 1 536 ? -10.301 -34.548 26.521 1.00 16.92 ? 844 ASP C O 1 ATOM 9503 C CB . ASP C 1 536 ? -6.968 -33.613 26.791 1.00 18.03 ? 844 ASP C CB 1 ATOM 9504 C CG . ASP C 1 536 ? -7.389 -33.152 28.173 1.00 21.99 ? 844 ASP C CG 1 ATOM 9505 O OD1 . ASP C 1 536 ? -8.602 -33.119 28.474 1.00 21.16 ? 844 ASP C OD1 1 ATOM 9506 O OD2 . ASP C 1 536 ? -6.489 -32.833 28.976 1.00 24.46 ? 844 ASP C OD2 1 ATOM 9507 N N . PRO C 1 537 ? -8.710 -36.137 26.285 1.00 15.42 ? 845 PRO C N 1 ATOM 9508 C CA . PRO C 1 537 ? -9.690 -37.182 26.610 1.00 17.86 ? 845 PRO C CA 1 ATOM 9509 C C . PRO C 1 537 ? -10.425 -36.960 27.934 1.00 20.21 ? 845 PRO C C 1 ATOM 9510 O O . PRO C 1 537 ? -11.632 -37.188 27.992 1.00 21.22 ? 845 PRO C O 1 ATOM 9511 C CB . PRO C 1 537 ? -8.835 -38.445 26.674 1.00 19.12 ? 845 PRO C CB 1 ATOM 9512 C CG . PRO C 1 537 ? -7.758 -38.198 25.666 1.00 18.34 ? 845 PRO C CG 1 ATOM 9513 C CD . PRO C 1 537 ? -7.455 -36.716 25.754 1.00 16.94 ? 845 PRO C CD 1 ATOM 9514 N N . SER C 1 538 ? -9.712 -36.517 28.966 1.00 18.02 ? 846 SER C N 1 ATOM 9515 C CA A SER C 1 538 ? -10.334 -36.310 30.270 0.51 20.50 ? 846 SER C CA 1 ATOM 9516 C CA B SER C 1 538 ? -10.302 -36.278 30.278 0.49 20.76 ? 846 SER C CA 1 ATOM 9517 C C . SER C 1 538 ? -11.390 -35.207 30.204 1.00 19.17 ? 846 SER C C 1 ATOM 9518 O O . SER C 1 538 ? -12.436 -35.301 30.852 1.00 18.79 ? 846 SER C O 1 ATOM 9519 C CB A SER C 1 538 ? -9.284 -35.992 31.337 0.51 22.37 ? 846 SER C CB 1 ATOM 9520 C CB B SER C 1 538 ? -9.207 -35.852 31.260 0.49 22.43 ? 846 SER C CB 1 ATOM 9521 O OG A SER C 1 538 ? -8.683 -34.734 31.102 0.51 23.24 ? 846 SER C OG 1 ATOM 9522 O OG B SER C 1 538 ? -9.754 -35.387 32.477 0.49 22.60 ? 846 SER C OG 1 ATOM 9523 N N . THR C 1 539 ? -11.130 -34.179 29.406 1.00 16.39 ? 847 THR C N 1 ATOM 9524 C CA . THR C 1 539 ? -12.085 -33.093 29.243 1.00 16.62 ? 847 THR C CA 1 ATOM 9525 C C . THR C 1 539 ? -13.365 -33.555 28.550 1.00 14.94 ? 847 THR C C 1 ATOM 9526 O O . THR C 1 539 ? -14.462 -33.272 29.025 1.00 18.86 ? 847 THR C O 1 ATOM 9527 C CB . THR C 1 539 ? -11.459 -31.905 28.488 1.00 17.75 ? 847 THR C CB 1 ATOM 9528 O OG1 . THR C 1 539 ? -10.376 -31.377 29.266 1.00 19.89 ? 847 THR C OG1 1 ATOM 9529 C CG2 . THR C 1 539 ? -12.481 -30.805 28.256 1.00 15.57 ? 847 THR C CG2 1 ATOM 9530 N N . LEU C 1 540 ? -13.229 -34.286 27.446 1.00 15.39 ? 848 LEU C N 1 ATOM 9531 C CA . LEU C 1 540 ? -14.406 -34.751 26.721 1.00 16.10 ? 848 LEU C CA 1 ATOM 9532 C C . LEU C 1 540 ? -15.208 -35.728 27.588 1.00 16.73 ? 848 LEU C C 1 ATOM 9533 O O . LEU C 1 540 ? -16.441 -35.757 27.536 1.00 15.77 ? 848 LEU C O 1 ATOM 9534 C CB . LEU C 1 540 ? -14.017 -35.399 25.385 1.00 17.46 ? 848 LEU C CB 1 ATOM 9535 C CG . LEU C 1 540 ? -15.199 -35.770 24.483 1.00 19.12 ? 848 LEU C CG 1 ATOM 9536 C CD1 . LEU C 1 540 ? -16.003 -34.530 24.119 1.00 17.68 ? 848 LEU C CD1 1 ATOM 9537 C CD2 . LEU C 1 540 ? -14.735 -36.491 23.224 1.00 21.95 ? 848 LEU C CD2 1 ATOM 9538 N N . GLN C 1 541 ? -14.510 -36.521 28.393 1.00 16.29 ? 849 GLN C N 1 ATOM 9539 C CA . GLN C 1 541 ? -15.191 -37.444 29.296 1.00 17.71 ? 849 GLN C CA 1 ATOM 9540 C C . GLN C 1 541 ? -16.034 -36.663 30.304 1.00 18.73 ? 849 GLN C C 1 ATOM 9541 O O . GLN C 1 541 ? -17.163 -37.040 30.596 1.00 18.74 ? 849 GLN C O 1 ATOM 9542 C CB . GLN C 1 541 ? -14.196 -38.348 30.021 1.00 22.56 ? 849 GLN C CB 1 ATOM 9543 C CG . GLN C 1 541 ? -14.843 -39.275 31.052 1.00 30.34 ? 849 GLN C CG 1 ATOM 9544 C CD . GLN C 1 541 ? -15.732 -40.340 30.425 1.00 38.37 ? 849 GLN C CD 1 ATOM 9545 O OE1 . GLN C 1 541 ? -15.268 -41.174 29.642 1.00 39.69 ? 849 GLN C OE1 1 ATOM 9546 N NE2 . GLN C 1 541 ? -17.016 -40.320 30.773 1.00 41.23 ? 849 GLN C NE2 1 ATOM 9547 N N . MET C 1 542 ? -15.472 -35.575 30.824 1.00 17.24 ? 850 MET C N 1 ATOM 9548 C CA A MET C 1 542 ? -16.190 -34.700 31.744 0.55 18.62 ? 850 MET C CA 1 ATOM 9549 C CA B MET C 1 542 ? -16.187 -34.706 31.749 0.45 18.54 ? 850 MET C CA 1 ATOM 9550 C C . MET C 1 542 ? -17.440 -34.140 31.088 1.00 18.22 ? 850 MET C C 1 ATOM 9551 O O . MET C 1 542 ? -18.520 -34.128 31.685 1.00 18.46 ? 850 MET C O 1 ATOM 9552 C CB A MET C 1 542 ? -15.302 -33.539 32.191 0.55 17.60 ? 850 MET C CB 1 ATOM 9553 C CB B MET C 1 542 ? -15.271 -33.571 32.208 0.45 17.61 ? 850 MET C CB 1 ATOM 9554 C CG A MET C 1 542 ? -14.387 -33.847 33.359 0.55 17.01 ? 850 MET C CG 1 ATOM 9555 C CG B MET C 1 542 ? -15.743 -32.828 33.444 0.45 16.71 ? 850 MET C CG 1 ATOM 9556 S SD A MET C 1 542 ? -14.259 -32.387 34.411 0.55 34.82 ? 850 MET C SD 1 ATOM 9557 S SD B MET C 1 542 ? -14.404 -31.918 34.246 0.45 29.79 ? 850 MET C SD 1 ATOM 9558 C CE A MET C 1 542 ? -13.565 -31.201 33.256 0.55 22.71 ? 850 MET C CE 1 ATOM 9559 C CE B MET C 1 542 ? -12.981 -32.480 33.301 0.45 18.99 ? 850 MET C CE 1 ATOM 9560 N N . TRP C 1 543 ? -17.286 -33.684 29.853 1.00 16.92 ? 851 TRP C N 1 ATOM 9561 C CA . TRP C 1 543 ? -18.387 -33.109 29.100 1.00 16.37 ? 851 TRP C CA 1 ATOM 9562 C C . TRP C 1 543 ? -19.459 -34.154 28.814 1.00 18.42 ? 851 TRP C C 1 ATOM 9563 O O . TRP C 1 543 ? -20.650 -33.856 28.887 1.00 21.29 ? 851 TRP C O 1 ATOM 9564 C CB . TRP C 1 543 ? -17.871 -32.492 27.802 1.00 16.81 ? 851 TRP C CB 1 ATOM 9565 C CG . TRP C 1 543 ? -17.056 -31.259 28.035 1.00 15.38 ? 851 TRP C CG 1 ATOM 9566 C CD1 . TRP C 1 543 ? -16.891 -30.590 29.219 1.00 14.83 ? 851 TRP C CD1 1 ATOM 9567 C CD2 . TRP C 1 543 ? -16.300 -30.540 27.058 1.00 16.07 ? 851 TRP C CD2 1 ATOM 9568 N NE1 . TRP C 1 543 ? -16.071 -29.500 29.030 1.00 15.17 ? 851 TRP C NE1 1 ATOM 9569 C CE2 . TRP C 1 543 ? -15.693 -29.452 27.714 1.00 14.96 ? 851 TRP C CE2 1 ATOM 9570 C CE3 . TRP C 1 543 ? -16.069 -30.717 25.689 1.00 15.33 ? 851 TRP C CE3 1 ATOM 9571 C CZ2 . TRP C 1 543 ? -14.884 -28.528 27.041 1.00 15.86 ? 851 TRP C CZ2 1 ATOM 9572 C CZ3 . TRP C 1 543 ? -15.265 -29.813 25.028 1.00 18.90 ? 851 TRP C CZ3 1 ATOM 9573 C CH2 . TRP C 1 543 ? -14.678 -28.731 25.705 1.00 16.65 ? 851 TRP C CH2 1 ATOM 9574 N N . ALA C 1 544 ? -19.030 -35.375 28.500 1.00 17.03 ? 852 ALA C N 1 ATOM 9575 C CA . ALA C 1 544 ? -19.971 -36.461 28.268 1.00 18.11 ? 852 ALA C CA 1 ATOM 9576 C C . ALA C 1 544 ? -20.755 -36.761 29.538 1.00 20.59 ? 852 ALA C C 1 ATOM 9577 O O . ALA C 1 544 ? -21.936 -37.102 29.469 1.00 20.81 ? 852 ALA C O 1 ATOM 9578 C CB . ALA C 1 544 ? -19.249 -37.715 27.791 1.00 20.05 ? 852 ALA C CB 1 ATOM 9579 N N . ASN C 1 545 ? -20.089 -36.649 30.688 1.00 16.63 ? 853 ASN C N 1 ATOM 9580 C CA . ASN C 1 545 ? -20.730 -36.912 31.976 1.00 21.78 ? 853 ASN C CA 1 ATOM 9581 C C . ASN C 1 545 ? -21.810 -35.883 32.281 1.00 21.00 ? 853 ASN C C 1 ATOM 9582 O O . ASN C 1 545 ? -22.839 -36.194 32.891 1.00 19.58 ? 853 ASN C O 1 ATOM 9583 C CB . ASN C 1 545 ? -19.697 -36.930 33.107 1.00 19.43 ? 853 ASN C CB 1 ATOM 9584 C CG . ASN C 1 545 ? -18.856 -38.194 33.105 1.00 26.86 ? 853 ASN C CG 1 ATOM 9585 O OD1 . ASN C 1 545 ? -19.204 -39.180 32.458 1.00 28.07 ? 853 ASN C OD1 1 ATOM 9586 N ND2 . ASN C 1 545 ? -17.750 -38.174 33.844 1.00 26.62 ? 853 ASN C ND2 1 ATOM 9587 N N . ILE C 1 546 ? -21.564 -34.652 31.851 1.00 18.78 ? 854 ILE C N 1 ATOM 9588 C CA . ILE C 1 546 ? -22.522 -33.569 32.033 1.00 17.06 ? 854 ILE C CA 1 ATOM 9589 C C . ILE C 1 546 ? -23.730 -33.789 31.133 1.00 17.80 ? 854 ILE C C 1 ATOM 9590 O O . ILE C 1 546 ? -24.867 -33.764 31.593 1.00 19.12 ? 854 ILE C O 1 ATOM 9591 C CB . ILE C 1 546 ? -21.870 -32.204 31.753 1.00 16.92 ? 854 ILE C CB 1 ATOM 9592 C CG1 . ILE C 1 546 ? -20.824 -31.896 32.834 1.00 17.62 ? 854 ILE C CG1 1 ATOM 9593 C CG2 . ILE C 1 546 ? -22.920 -31.104 31.722 1.00 19.05 ? 854 ILE C CG2 1 ATOM 9594 C CD1 . ILE C 1 546 ? -19.790 -30.857 32.411 1.00 13.84 ? 854 ILE C CD1 1 ATOM 9595 N N . LEU C 1 547 ? -23.473 -34.043 29.854 1.00 15.16 ? 855 LEU C N 1 ATOM 9596 C CA . LEU C 1 547 ? -24.534 -34.290 28.883 1.00 20.96 ? 855 LEU C CA 1 ATOM 9597 C C . LEU C 1 547 ? -25.451 -35.446 29.282 1.00 20.23 ? 855 LEU C C 1 ATOM 9598 O O . LEU C 1 547 ? -26.662 -35.380 29.088 1.00 20.70 ? 855 LEU C O 1 ATOM 9599 C CB . LEU C 1 547 ? -23.937 -34.562 27.502 1.00 20.89 ? 855 LEU C CB 1 ATOM 9600 C CG . LEU C 1 547 ? -23.253 -33.367 26.833 1.00 21.86 ? 855 LEU C CG 1 ATOM 9601 C CD1 . LEU C 1 547 ? -22.604 -33.772 25.511 1.00 21.80 ? 855 LEU C CD1 1 ATOM 9602 C CD2 . LEU C 1 547 ? -24.237 -32.235 26.609 1.00 19.35 ? 855 LEU C CD2 1 ATOM 9603 N N . LYS C 1 548 ? -24.871 -36.510 29.825 1.00 20.14 ? 856 LYS C N 1 ATOM 9604 C CA . LYS C 1 548 ? -25.677 -37.640 30.301 1.00 23.24 ? 856 LYS C CA 1 ATOM 9605 C C . LYS C 1 548 ? -26.550 -37.268 31.499 1.00 24.07 ? 856 LYS C C 1 ATOM 9606 O O . LYS C 1 548 ? -27.664 -37.773 31.645 1.00 26.35 ? 856 LYS C O 1 ATOM 9607 C CB . LYS C 1 548 ? -24.789 -38.828 30.658 1.00 24.54 ? 856 LYS C CB 1 ATOM 9608 C CG . LYS C 1 548 ? -24.061 -39.423 29.472 1.00 28.91 ? 856 LYS C CG 1 ATOM 9609 C CD . LYS C 1 548 ? -22.947 -40.334 29.940 1.00 37.12 ? 856 LYS C CD 1 ATOM 9610 C CE . LYS C 1 548 ? -22.028 -40.688 28.797 1.00 42.68 ? 856 LYS C CE 1 ATOM 9611 N NZ . LYS C 1 548 ? -22.762 -41.382 27.699 1.00 47.76 ? 856 LYS C NZ 1 ATOM 9612 N N . ARG C 1 549 ? -26.048 -36.383 32.353 1.00 21.96 ? 857 ARG C N 1 ATOM 9613 C CA . ARG C 1 549 ? -26.797 -35.981 33.544 1.00 21.69 ? 857 ARG C CA 1 ATOM 9614 C C . ARG C 1 549 ? -27.866 -34.941 33.234 1.00 19.99 ? 857 ARG C C 1 ATOM 9615 O O . ARG C 1 549 ? -28.752 -34.698 34.043 1.00 21.25 ? 857 ARG C O 1 ATOM 9616 C CB . ARG C 1 549 ? -25.861 -35.450 34.634 1.00 20.36 ? 857 ARG C CB 1 ATOM 9617 C CG . ARG C 1 549 ? -25.086 -36.523 35.385 1.00 23.11 ? 857 ARG C CG 1 ATOM 9618 C CD . ARG C 1 549 ? -24.285 -35.895 36.520 1.00 25.62 ? 857 ARG C CD 1 ATOM 9619 N NE . ARG C 1 549 ? -25.152 -35.141 37.425 1.00 28.73 ? 857 ARG C NE 1 ATOM 9620 C CZ . ARG C 1 549 ? -24.724 -34.423 38.460 1.00 32.66 ? 857 ARG C CZ 1 ATOM 9621 N NH1 . ARG C 1 549 ? -23.429 -34.358 38.739 1.00 29.96 ? 857 ARG C NH1 1 ATOM 9622 N NH2 . ARG C 1 549 ? -25.598 -33.774 39.225 1.00 33.83 ? 857 ARG C NH2 1 ATOM 9623 N N . VAL C 1 550 ? -27.772 -34.319 32.065 1.00 20.94 ? 858 VAL C N 1 ATOM 9624 C CA . VAL C 1 550 ? -28.716 -33.281 31.666 1.00 22.26 ? 858 VAL C CA 1 ATOM 9625 C C . VAL C 1 550 ? -29.284 -33.669 30.308 1.00 25.93 ? 858 VAL C C 1 ATOM 9626 O O . VAL C 1 550 ? -28.833 -33.170 29.278 1.00 24.41 ? 858 VAL C O 1 ATOM 9627 C CB . VAL C 1 550 ? -28.009 -31.905 31.564 1.00 20.66 ? 858 VAL C CB 1 ATOM 9628 C CG1 . VAL C 1 550 ? -29.020 -30.779 31.303 1.00 18.46 ? 858 VAL C CG1 1 ATOM 9629 C CG2 . VAL C 1 550 ? -27.198 -31.626 32.828 1.00 18.60 ? 858 VAL C CG2 1 ATOM 9630 N N . PRO C 1 551 ? -30.261 -34.588 30.300 1.00 31.12 ? 859 PRO C N 1 ATOM 9631 C CA . PRO C 1 551 ? -30.782 -35.180 29.061 1.00 34.30 ? 859 PRO C CA 1 ATOM 9632 C C . PRO C 1 551 ? -31.230 -34.143 28.038 1.00 33.17 ? 859 PRO C C 1 ATOM 9633 O O . PRO C 1 551 ? -30.994 -34.319 26.842 1.00 32.85 ? 859 PRO C O 1 ATOM 9634 C CB . PRO C 1 551 ? -31.975 -36.024 29.541 1.00 37.40 ? 859 PRO C CB 1 ATOM 9635 C CG . PRO C 1 551 ? -32.263 -35.560 30.936 1.00 36.87 ? 859 PRO C CG 1 ATOM 9636 C CD . PRO C 1 551 ? -30.943 -35.124 31.488 1.00 35.84 ? 859 PRO C CD 1 ATOM 9637 N N . ASN C 1 552 ? -31.849 -33.067 28.505 1.00 29.78 ? 860 ASN C N 1 ATOM 9638 C CA . ASN C 1 552 ? -32.300 -32.018 27.614 1.00 32.91 ? 860 ASN C CA 1 ATOM 9639 C C . ASN C 1 552 ? -31.193 -30.989 27.394 1.00 32.08 ? 860 ASN C C 1 ATOM 9640 O O . ASN C 1 552 ? -31.296 -29.852 27.876 1.00 30.20 ? 860 ASN C O 1 ATOM 9641 C CB . ASN C 1 552 ? -33.546 -31.346 28.184 1.00 41.76 ? 860 ASN C CB 1 ATOM 9642 C CG . ASN C 1 552 ? -34.396 -30.695 27.116 1.00 46.22 ? 860 ASN C CG 1 ATOM 9643 O OD1 . ASN C 1 552 ? -34.331 -31.071 25.946 1.00 49.84 ? 860 ASN C OD1 1 ATOM 9644 N ND2 . ASN C 1 552 ? -35.204 -29.717 27.513 1.00 46.16 ? 860 ASN C ND2 1 ATOM 9645 N N . SER C 1 553 ? -30.136 -31.394 26.684 1.00 25.28 ? 861 SER C N 1 ATOM 9646 C CA . SER C 1 553 ? -29.007 -30.497 26.422 1.00 19.45 ? 861 SER C CA 1 ATOM 9647 C C . SER C 1 553 ? -28.103 -30.938 25.273 1.00 19.23 ? 861 SER C C 1 ATOM 9648 O O . SER C 1 553 ? -28.022 -32.121 24.937 1.00 19.58 ? 861 SER C O 1 ATOM 9649 C CB . SER C 1 553 ? -28.147 -30.319 27.676 1.00 18.75 ? 861 SER C CB 1 ATOM 9650 O OG . SER C 1 553 ? -27.334 -31.457 27.909 1.00 18.89 ? 861 SER C OG 1 ATOM 9651 N N . VAL C 1 554 ? -27.400 -29.969 24.697 1.00 17.88 ? 862 VAL C N 1 ATOM 9652 C CA . VAL C 1 554 ? -26.447 -30.245 23.630 1.00 16.52 ? 862 VAL C CA 1 ATOM 9653 C C . VAL C 1 554 ? -25.133 -29.535 23.903 1.00 15.96 ? 862 VAL C C 1 ATOM 9654 O O . VAL C 1 554 ? -25.091 -28.559 24.657 1.00 15.78 ? 862 VAL C O 1 ATOM 9655 C CB . VAL C 1 554 ? -26.992 -29.819 22.249 1.00 18.52 ? 862 VAL C CB 1 ATOM 9656 C CG1 . VAL C 1 554 ? -28.253 -30.616 21.900 1.00 18.89 ? 862 VAL C CG1 1 ATOM 9657 C CG2 . VAL C 1 554 ? -27.266 -28.325 22.217 1.00 18.97 ? 862 VAL C CG2 1 ATOM 9658 N N . LEU C 1 555 ? -24.059 -30.035 23.297 1.00 16.18 ? 863 LEU C N 1 ATOM 9659 C CA . LEU C 1 555 ? -22.762 -29.389 23.391 1.00 17.05 ? 863 LEU C CA 1 ATOM 9660 C C . LEU C 1 555 ? -22.464 -28.745 22.045 1.00 19.35 ? 863 LEU C C 1 ATOM 9661 O O . LEU C 1 555 ? -22.578 -29.389 21.006 1.00 17.81 ? 863 LEU C O 1 ATOM 9662 C CB . LEU C 1 555 ? -21.677 -30.407 23.751 1.00 15.44 ? 863 LEU C CB 1 ATOM 9663 C CG . LEU C 1 555 ? -20.232 -29.895 23.739 1.00 18.50 ? 863 LEU C CG 1 ATOM 9664 C CD1 . LEU C 1 555 ? -20.005 -28.863 24.840 1.00 17.49 ? 863 LEU C CD1 1 ATOM 9665 C CD2 . LEU C 1 555 ? -19.250 -31.066 23.859 1.00 23.04 ? 863 LEU C CD2 1 ATOM 9666 N N . TRP C 1 556 ? -22.095 -27.469 22.068 1.00 14.91 ? 864 TRP C N 1 ATOM 9667 C CA . TRP C 1 556 ? -21.918 -26.701 20.840 1.00 12.88 ? 864 TRP C CA 1 ATOM 9668 C C . TRP C 1 556 ? -20.426 -26.438 20.655 1.00 14.15 ? 864 TRP C C 1 ATOM 9669 O O . TRP C 1 556 ? -19.819 -25.746 21.475 1.00 14.24 ? 864 TRP C O 1 ATOM 9670 C CB . TRP C 1 556 ? -22.710 -25.385 20.975 1.00 13.36 ? 864 TRP C CB 1 ATOM 9671 C CG . TRP C 1 556 ? -22.785 -24.494 19.750 1.00 14.09 ? 864 TRP C CG 1 ATOM 9672 C CD1 . TRP C 1 556 ? -22.463 -24.824 18.459 1.00 15.89 ? 864 TRP C CD1 1 ATOM 9673 C CD2 . TRP C 1 556 ? -23.222 -23.124 19.713 1.00 12.12 ? 864 TRP C CD2 1 ATOM 9674 N NE1 . TRP C 1 556 ? -22.681 -23.746 17.629 1.00 15.30 ? 864 TRP C NE1 1 ATOM 9675 C CE2 . TRP C 1 556 ? -23.137 -22.691 18.375 1.00 15.26 ? 864 TRP C CE2 1 ATOM 9676 C CE3 . TRP C 1 556 ? -23.678 -22.224 20.685 1.00 17.46 ? 864 TRP C CE3 1 ATOM 9677 C CZ2 . TRP C 1 556 ? -23.494 -21.396 17.981 1.00 13.85 ? 864 TRP C CZ2 1 ATOM 9678 C CZ3 . TRP C 1 556 ? -24.026 -20.936 20.293 1.00 17.32 ? 864 TRP C CZ3 1 ATOM 9679 C CH2 . TRP C 1 556 ? -23.933 -20.537 18.954 1.00 13.72 ? 864 TRP C CH2 1 ATOM 9680 N N . LEU C 1 557 ? -19.838 -27.024 19.607 1.00 14.75 ? 865 LEU C N 1 ATOM 9681 C CA . LEU C 1 557 ? -18.411 -26.878 19.309 1.00 16.32 ? 865 LEU C CA 1 ATOM 9682 C C . LEU C 1 557 ? -18.182 -26.350 17.888 1.00 16.11 ? 865 LEU C C 1 ATOM 9683 O O . LEU C 1 557 ? -19.098 -26.312 17.072 1.00 16.91 ? 865 LEU C O 1 ATOM 9684 C CB . LEU C 1 557 ? -17.685 -28.225 19.459 1.00 15.23 ? 865 LEU C CB 1 ATOM 9685 C CG . LEU C 1 557 ? -17.786 -28.939 20.808 1.00 18.45 ? 865 LEU C CG 1 ATOM 9686 C CD1 . LEU C 1 557 ? -17.108 -30.307 20.727 1.00 16.89 ? 865 LEU C CD1 1 ATOM 9687 C CD2 . LEU C 1 557 ? -17.163 -28.082 21.911 1.00 19.73 ? 865 LEU C CD2 1 ATOM 9688 N N . LEU C 1 558 ? -16.950 -25.952 17.596 1.00 12.95 ? 866 LEU C N 1 ATOM 9689 C CA . LEU C 1 558 ? -16.619 -25.387 16.288 1.00 10.93 ? 866 LEU C CA 1 ATOM 9690 C C . LEU C 1 558 ? -15.771 -26.334 15.446 1.00 14.40 ? 866 LEU C C 1 ATOM 9691 O O . LEU C 1 558 ? -15.008 -27.135 15.978 1.00 14.48 ? 866 LEU C O 1 ATOM 9692 C CB . LEU C 1 558 ? -15.876 -24.054 16.448 1.00 13.70 ? 866 LEU C CB 1 ATOM 9693 C CG . LEU C 1 558 ? -16.643 -23.001 17.251 1.00 16.02 ? 866 LEU C CG 1 ATOM 9694 C CD1 . LEU C 1 558 ? -15.907 -21.662 17.213 1.00 17.37 ? 866 LEU C CD1 1 ATOM 9695 C CD2 . LEU C 1 558 ? -18.065 -22.868 16.708 1.00 15.36 ? 866 LEU C CD2 1 ATOM 9696 N N . ARG C 1 559 ? -15.922 -26.246 14.129 1.00 14.26 ? 867 ARG C N 1 ATOM 9697 C CA . ARG C 1 559 ? -15.039 -26.969 13.220 1.00 15.20 ? 867 ARG C CA 1 ATOM 9698 C C . ARG C 1 559 ? -13.719 -26.210 13.168 1.00 13.29 ? 867 ARG C C 1 ATOM 9699 O O . ARG C 1 559 ? -13.487 -25.400 12.271 1.00 13.16 ? 867 ARG C O 1 ATOM 9700 C CB . ARG C 1 559 ? -15.672 -27.099 11.832 1.00 15.88 ? 867 ARG C CB 1 ATOM 9701 C CG . ARG C 1 559 ? -17.063 -27.738 11.855 1.00 19.54 ? 867 ARG C CG 1 ATOM 9702 C CD . ARG C 1 559 ? -17.526 -28.169 10.478 1.00 22.88 ? 867 ARG C CD 1 ATOM 9703 N NE . ARG C 1 559 ? -18.873 -28.729 10.525 1.00 25.06 ? 867 ARG C NE 1 ATOM 9704 C CZ . ARG C 1 559 ? -19.970 -28.059 10.177 1.00 28.33 ? 867 ARG C CZ 1 ATOM 9705 N NH1 . ARG C 1 559 ? -19.882 -26.813 9.731 1.00 26.46 ? 867 ARG C NH1 1 ATOM 9706 N NH2 . ARG C 1 559 ? -21.155 -28.642 10.255 1.00 31.69 ? 867 ARG C NH2 1 ATOM 9707 N N . PHE C 1 560 ? -12.851 -26.485 14.138 1.00 14.82 ? 868 PHE C N 1 ATOM 9708 C CA . PHE C 1 560 ? -11.689 -25.631 14.385 1.00 15.15 ? 868 PHE C CA 1 ATOM 9709 C C . PHE C 1 560 ? -10.469 -26.497 14.722 1.00 15.69 ? 868 PHE C C 1 ATOM 9710 O O . PHE C 1 560 ? -9.917 -26.381 15.813 1.00 13.00 ? 868 PHE C O 1 ATOM 9711 C CB . PHE C 1 560 ? -12.030 -24.709 15.568 1.00 12.52 ? 868 PHE C CB 1 ATOM 9712 C CG . PHE C 1 560 ? -11.345 -23.358 15.553 1.00 13.38 ? 868 PHE C CG 1 ATOM 9713 C CD1 . PHE C 1 560 ? -11.674 -22.411 16.522 1.00 16.88 ? 868 PHE C CD1 1 ATOM 9714 C CD2 . PHE C 1 560 ? -10.393 -23.029 14.599 1.00 17.08 ? 868 PHE C CD2 1 ATOM 9715 C CE1 . PHE C 1 560 ? -11.068 -21.165 16.545 1.00 17.39 ? 868 PHE C CE1 1 ATOM 9716 C CE2 . PHE C 1 560 ? -9.780 -21.777 14.611 1.00 17.68 ? 868 PHE C CE2 1 ATOM 9717 C CZ . PHE C 1 560 ? -10.115 -20.845 15.583 1.00 15.86 ? 868 PHE C CZ 1 ATOM 9718 N N . PRO C 1 561 ? -10.019 -27.351 13.780 1.00 16.34 ? 869 PRO C N 1 ATOM 9719 C CA . PRO C 1 561 ? -10.443 -27.469 12.380 1.00 17.75 ? 869 PRO C CA 1 ATOM 9720 C C . PRO C 1 561 ? -11.508 -28.541 12.154 1.00 18.29 ? 869 PRO C C 1 ATOM 9721 O O . PRO C 1 561 ? -11.714 -29.416 13.009 1.00 16.66 ? 869 PRO C O 1 ATOM 9722 C CB . PRO C 1 561 ? -9.147 -27.869 11.672 1.00 16.56 ? 869 PRO C CB 1 ATOM 9723 C CG . PRO C 1 561 ? -8.431 -28.735 12.711 1.00 16.71 ? 869 PRO C CG 1 ATOM 9724 C CD . PRO C 1 561 ? -8.896 -28.258 14.080 1.00 15.88 ? 869 PRO C CD 1 ATOM 9725 N N . ALA C 1 562 ? -12.166 -28.473 10.996 1.00 14.59 ? 870 ALA C N 1 ATOM 9726 C CA . ALA C 1 562 ? -13.213 -29.430 10.647 1.00 17.65 ? 870 ALA C CA 1 ATOM 9727 C C . ALA C 1 562 ? -12.759 -30.882 10.792 1.00 17.46 ? 870 ALA C C 1 ATOM 9728 O O . ALA C 1 562 ? -13.519 -31.727 11.245 1.00 17.88 ? 870 ALA C O 1 ATOM 9729 C CB . ALA C 1 562 ? -13.732 -29.169 9.229 1.00 17.38 ? 870 ALA C CB 1 ATOM 9730 N N . VAL C 1 563 ? -11.511 -31.170 10.436 1.00 19.55 ? 871 VAL C N 1 ATOM 9731 C CA . VAL C 1 563 ? -11.039 -32.556 10.488 1.00 20.88 ? 871 VAL C CA 1 ATOM 9732 C C . VAL C 1 563 ? -10.977 -33.127 11.912 1.00 21.14 ? 871 VAL C C 1 ATOM 9733 O O . VAL C 1 563 ? -10.800 -34.326 12.097 1.00 21.14 ? 871 VAL C O 1 ATOM 9734 C CB . VAL C 1 563 ? -9.701 -32.752 9.738 1.00 22.77 ? 871 VAL C CB 1 ATOM 9735 C CG1 . VAL C 1 563 ? -9.905 -32.497 8.262 1.00 17.41 ? 871 VAL C CG1 1 ATOM 9736 C CG2 . VAL C 1 563 ? -8.626 -31.819 10.294 1.00 24.37 ? 871 VAL C CG2 1 ATOM 9737 N N . GLY C 1 564 ? -11.154 -32.273 12.912 1.00 21.85 ? 872 GLY C N 1 ATOM 9738 C CA . GLY C 1 564 ? -11.249 -32.741 14.284 1.00 19.85 ? 872 GLY C CA 1 ATOM 9739 C C . GLY C 1 564 ? -12.654 -33.195 14.654 1.00 20.98 ? 872 GLY C C 1 ATOM 9740 O O . GLY C 1 564 ? -12.831 -33.955 15.613 1.00 20.73 ? 872 GLY C O 1 ATOM 9741 N N . GLU C 1 565 ? -13.654 -32.714 13.909 1.00 20.00 ? 873 GLU C N 1 ATOM 9742 C CA . GLU C 1 565 ? -15.054 -33.094 14.145 1.00 21.52 ? 873 GLU C CA 1 ATOM 9743 C C . GLU C 1 565 ? -15.309 -34.611 14.184 1.00 19.95 ? 873 GLU C C 1 ATOM 9744 O O . GLU C 1 565 ? -15.908 -35.101 15.142 1.00 22.73 ? 873 GLU C O 1 ATOM 9745 C CB . GLU C 1 565 ? -16.005 -32.401 13.148 1.00 23.50 ? 873 GLU C CB 1 ATOM 9746 C CG . GLU C 1 565 ? -17.421 -32.975 13.125 1.00 25.04 ? 873 GLU C CG 1 ATOM 9747 C CD . GLU C 1 565 ? -18.403 -32.137 12.304 1.00 24.72 ? 873 GLU C CD 1 ATOM 9748 O OE1 . GLU C 1 565 ? -17.968 -31.167 11.645 1.00 24.60 ? 873 GLU C OE1 1 ATOM 9749 O OE2 . GLU C 1 565 ? -19.612 -32.456 12.322 1.00 21.82 ? 873 GLU C OE2 1 ATOM 9750 N N . PRO C 1 566 ? -14.847 -35.363 13.166 1.00 23.85 ? 874 PRO C N 1 ATOM 9751 C CA . PRO C 1 566 ? -15.138 -36.801 13.215 1.00 23.00 ? 874 PRO C CA 1 ATOM 9752 C C . PRO C 1 566 ? -14.459 -37.537 14.378 1.00 23.45 ? 874 PRO C C 1 ATOM 9753 O O . PRO C 1 566 ? -15.007 -38.522 14.875 1.00 24.56 ? 874 PRO C O 1 ATOM 9754 C CB . PRO C 1 566 ? -14.610 -37.313 11.866 1.00 25.19 ? 874 PRO C CB 1 ATOM 9755 C CG . PRO C 1 566 ? -13.595 -36.341 11.464 1.00 28.80 ? 874 PRO C CG 1 ATOM 9756 C CD . PRO C 1 566 ? -14.088 -35.010 11.952 1.00 26.51 ? 874 PRO C CD 1 ATOM 9757 N N . ASN C 1 567 ? -13.291 -37.074 14.811 1.00 19.78 ? 875 ASN C N 1 ATOM 9758 C CA . ASN C 1 567 ? -12.638 -37.707 15.957 1.00 19.68 ? 875 ASN C CA 1 ATOM 9759 C C . ASN C 1 567 ? -13.401 -37.487 17.259 1.00 18.11 ? 875 ASN C C 1 ATOM 9760 O O . ASN C 1 567 ? -13.646 -38.435 18.003 1.00 19.03 ? 875 ASN C O 1 ATOM 9761 C CB . ASN C 1 567 ? -11.187 -37.251 16.084 1.00 17.84 ? 875 ASN C CB 1 ATOM 9762 C CG . ASN C 1 567 ? -10.307 -37.843 14.992 1.00 22.97 ? 875 ASN C CG 1 ATOM 9763 O OD1 . ASN C 1 567 ? -10.564 -38.946 14.514 1.00 26.21 ? 875 ASN C OD1 1 ATOM 9764 N ND2 . ASN C 1 567 ? -9.290 -37.105 14.579 1.00 18.93 ? 875 ASN C ND2 1 ATOM 9765 N N . ILE C 1 568 ? -13.769 -36.237 17.518 1.00 15.55 ? 876 ILE C N 1 ATOM 9766 C CA . ILE C 1 568 ? -14.618 -35.886 18.661 1.00 17.99 ? 876 ILE C CA 1 ATOM 9767 C C . ILE C 1 568 ? -15.919 -36.680 18.629 1.00 19.65 ? 876 ILE C C 1 ATOM 9768 O O . ILE C 1 568 ? -16.360 -37.207 19.650 1.00 20.34 ? 876 ILE C O 1 ATOM 9769 C CB . ILE C 1 568 ? -14.945 -34.381 18.682 1.00 18.09 ? 876 ILE C CB 1 ATOM 9770 C CG1 . ILE C 1 568 ? -13.672 -33.561 18.906 1.00 22.77 ? 876 ILE C CG1 1 ATOM 9771 C CG2 . ILE C 1 568 ? -15.991 -34.049 19.772 1.00 18.45 ? 876 ILE C CG2 1 ATOM 9772 C CD1 . ILE C 1 568 ? -13.071 -33.735 20.286 1.00 26.30 ? 876 ILE C CD1 1 ATOM 9773 N N . GLN C 1 569 ? -16.530 -36.789 17.454 1.00 19.69 ? 877 GLN C N 1 ATOM 9774 C CA . GLN C 1 569 ? -17.796 -37.514 17.369 1.00 22.18 ? 877 GLN C CA 1 ATOM 9775 C C . GLN C 1 569 ? -17.628 -39.003 17.651 1.00 23.79 ? 877 GLN C C 1 ATOM 9776 O O . GLN C 1 569 ? -18.475 -39.612 18.300 1.00 24.95 ? 877 GLN C O 1 ATOM 9777 C CB . GLN C 1 569 ? -18.496 -37.276 16.027 1.00 27.14 ? 877 GLN C CB 1 ATOM 9778 C CG . GLN C 1 569 ? -19.094 -35.879 15.861 1.00 31.75 ? 877 GLN C CG 1 ATOM 9779 C CD . GLN C 1 569 ? -20.385 -35.669 16.645 1.00 37.07 ? 877 GLN C CD 1 ATOM 9780 O OE1 . GLN C 1 569 ? -20.715 -36.439 17.549 1.00 42.44 ? 877 GLN C OE1 1 ATOM 9781 N NE2 . GLN C 1 569 ? -21.124 -34.623 16.294 1.00 36.19 ? 877 GLN C NE2 1 ATOM 9782 N N . GLN C 1 570 ? -16.533 -39.590 17.178 1.00 23.30 ? 878 GLN C N 1 ATOM 9783 C CA . GLN C 1 570 ? -16.283 -41.007 17.440 1.00 26.64 ? 878 GLN C CA 1 ATOM 9784 C C . GLN C 1 570 ? -16.055 -41.271 18.924 1.00 25.68 ? 878 GLN C C 1 ATOM 9785 O O . GLN C 1 570 ? -16.589 -42.230 19.485 1.00 26.15 ? 878 GLN C O 1 ATOM 9786 C CB . GLN C 1 570 ? -15.086 -41.520 16.642 1.00 29.45 ? 878 GLN C CB 1 ATOM 9787 C CG . GLN C 1 570 ? -14.853 -43.013 16.814 1.00 33.74 ? 878 GLN C CG 1 ATOM 9788 C CD . GLN C 1 570 ? -16.056 -43.841 16.391 1.00 40.10 ? 878 GLN C CD 1 ATOM 9789 O OE1 . GLN C 1 570 ? -16.454 -43.827 15.225 1.00 45.15 ? 878 GLN C OE1 1 ATOM 9790 N NE2 . GLN C 1 570 ? -16.647 -44.559 17.341 1.00 39.02 ? 878 GLN C NE2 1 ATOM 9791 N N . TYR C 1 571 ? -15.256 -40.421 19.559 1.00 23.37 ? 879 TYR C N 1 ATOM 9792 C CA . TYR C 1 571 ? -14.975 -40.571 20.982 1.00 23.01 ? 879 TYR C CA 1 ATOM 9793 C C . TYR C 1 571 ? -16.232 -40.362 21.823 1.00 22.91 ? 879 TYR C C 1 ATOM 9794 O O . TYR C 1 571 ? -16.436 -41.047 22.824 1.00 24.65 ? 879 TYR C O 1 ATOM 9795 C CB . TYR C 1 571 ? -13.864 -39.610 21.418 1.00 21.26 ? 879 TYR C CB 1 ATOM 9796 C CG . TYR C 1 571 ? -12.508 -39.965 20.850 1.00 23.96 ? 879 TYR C CG 1 ATOM 9797 C CD1 . TYR C 1 571 ? -12.032 -41.274 20.900 1.00 28.57 ? 879 TYR C CD1 1 ATOM 9798 C CD2 . TYR C 1 571 ? -11.704 -38.996 20.264 1.00 23.43 ? 879 TYR C CD2 1 ATOM 9799 C CE1 . TYR C 1 571 ? -10.790 -41.603 20.377 1.00 32.51 ? 879 TYR C CE1 1 ATOM 9800 C CE2 . TYR C 1 571 ? -10.464 -39.316 19.742 1.00 25.75 ? 879 TYR C CE2 1 ATOM 9801 C CZ . TYR C 1 571 ? -10.013 -40.617 19.798 1.00 29.65 ? 879 TYR C CZ 1 ATOM 9802 O OH . TYR C 1 571 ? -8.774 -40.928 19.282 1.00 31.92 ? 879 TYR C OH 1 ATOM 9803 N N . ALA C 1 572 ? -17.073 -39.418 21.408 1.00 22.18 ? 880 ALA C N 1 ATOM 9804 C CA . ALA C 1 572 ? -18.347 -39.187 22.083 1.00 25.67 ? 880 ALA C CA 1 ATOM 9805 C C . ALA C 1 572 ? -19.237 -40.416 21.966 1.00 27.28 ? 880 ALA C C 1 ATOM 9806 O O . ALA C 1 572 ? -19.905 -40.806 22.926 1.00 27.19 ? 880 ALA C O 1 ATOM 9807 C CB . ALA C 1 572 ? -19.054 -37.970 21.494 1.00 24.37 ? 880 ALA C CB 1 ATOM 9808 N N . GLN C 1 573 ? -19.245 -41.017 20.779 1.00 28.27 ? 881 GLN C N 1 ATOM 9809 C CA . GLN C 1 573 ? -20.057 -42.202 20.524 1.00 34.81 ? 881 GLN C CA 1 ATOM 9810 C C . GLN C 1 573 ? -19.558 -43.375 21.359 1.00 34.95 ? 881 GLN C C 1 ATOM 9811 O O . GLN C 1 573 ? -20.348 -44.163 21.873 1.00 36.47 ? 881 GLN C O 1 ATOM 9812 C CB . GLN C 1 573 ? -20.050 -42.548 19.034 1.00 40.37 ? 881 GLN C CB 1 ATOM 9813 C CG . GLN C 1 573 ? -20.880 -43.769 18.661 1.00 48.85 ? 881 GLN C CG 1 ATOM 9814 C CD . GLN C 1 573 ? -20.910 -44.011 17.160 1.00 55.48 ? 881 GLN C CD 1 ATOM 9815 O OE1 . GLN C 1 573 ? -20.417 -45.029 16.671 1.00 57.45 ? 881 GLN C OE1 1 ATOM 9816 N NE2 . GLN C 1 573 ? -21.488 -43.068 16.420 1.00 57.15 ? 881 GLN C NE2 1 ATOM 9817 N N . ASN C 1 574 ? -18.241 -43.479 21.497 1.00 33.63 ? 882 ASN C N 1 ATOM 9818 C CA . ASN C 1 574 ? -17.634 -44.494 22.348 1.00 35.36 ? 882 ASN C CA 1 ATOM 9819 C C . ASN C 1 574 ? -18.002 -44.277 23.812 1.00 35.13 ? 882 ASN C C 1 ATOM 9820 O O . ASN C 1 574 ? -18.034 -45.223 24.599 1.00 35.02 ? 882 ASN C O 1 ATOM 9821 C CB . ASN C 1 574 ? -16.112 -44.480 22.198 1.00 36.17 ? 882 ASN C CB 1 ATOM 9822 C CG . ASN C 1 574 ? -15.648 -44.976 20.839 1.00 37.46 ? 882 ASN C CG 1 ATOM 9823 O OD1 . ASN C 1 574 ? -16.452 -45.373 19.994 1.00 37.03 ? 882 ASN C OD1 1 ATOM 9824 N ND2 . ASN C 1 574 ? -14.339 -44.941 20.620 1.00 38.98 ? 882 ASN C ND2 1 ATOM 9825 N N . MET C 1 575 ? -18.271 -43.025 24.173 1.00 33.66 ? 883 MET C N 1 ATOM 9826 C CA . MET C 1 575 ? -18.644 -42.688 25.543 1.00 36.15 ? 883 MET C CA 1 ATOM 9827 C C . MET C 1 575 ? -20.143 -42.851 25.775 1.00 37.11 ? 883 MET C C 1 ATOM 9828 O O . MET C 1 575 ? -20.625 -42.642 26.881 1.00 37.55 ? 883 MET C O 1 ATOM 9829 C CB . MET C 1 575 ? -18.215 -41.259 25.894 1.00 36.55 ? 883 MET C CB 1 ATOM 9830 C CG . MET C 1 575 ? -16.718 -41.079 26.113 1.00 37.56 ? 883 MET C CG 1 ATOM 9831 S SD . MET C 1 575 ? -16.232 -39.338 26.156 1.00 41.54 ? 883 MET C SD 1 ATOM 9832 C CE . MET C 1 575 ? -14.446 -39.477 26.195 1.00 38.38 ? 883 MET C CE 1 ATOM 9833 N N . GLY C 1 576 ? -20.879 -43.216 24.730 1.00 38.78 ? 884 GLY C N 1 ATOM 9834 C CA . GLY C 1 576 ? -22.304 -43.468 24.866 1.00 40.79 ? 884 GLY C CA 1 ATOM 9835 C C . GLY C 1 576 ? -23.212 -42.314 24.464 1.00 40.79 ? 884 GLY C C 1 ATOM 9836 O O . GLY C 1 576 ? -24.420 -42.364 24.704 1.00 41.27 ? 884 GLY C O 1 ATOM 9837 N N . LEU C 1 577 ? -22.642 -41.279 23.851 1.00 35.74 ? 885 LEU C N 1 ATOM 9838 C CA . LEU C 1 577 ? -23.438 -40.150 23.372 1.00 35.53 ? 885 LEU C CA 1 ATOM 9839 C C . LEU C 1 577 ? -23.787 -40.292 21.900 1.00 37.58 ? 885 LEU C C 1 ATOM 9840 O O . LEU C 1 577 ? -22.902 -40.471 21.065 1.00 39.41 ? 885 LEU C O 1 ATOM 9841 C CB . LEU C 1 577 ? -22.690 -38.832 23.556 1.00 32.42 ? 885 LEU C CB 1 ATOM 9842 C CG . LEU C 1 577 ? -22.305 -38.320 24.941 1.00 33.05 ? 885 LEU C CG 1 ATOM 9843 C CD1 . LEU C 1 577 ? -21.323 -37.171 24.777 1.00 32.71 ? 885 LEU C CD1 1 ATOM 9844 C CD2 . LEU C 1 577 ? -23.532 -37.870 25.714 1.00 34.49 ? 885 LEU C CD2 1 ATOM 9845 N N . PRO C 1 578 ? -25.082 -40.205 21.573 1.00 40.14 ? 886 PRO C N 1 ATOM 9846 C CA . PRO C 1 578 ? -25.494 -40.188 20.167 1.00 41.70 ? 886 PRO C CA 1 ATOM 9847 C C . PRO C 1 578 ? -25.007 -38.928 19.458 1.00 40.52 ? 886 PRO C C 1 ATOM 9848 O O . PRO C 1 578 ? -24.692 -37.933 20.112 1.00 36.42 ? 886 PRO C O 1 ATOM 9849 C CB . PRO C 1 578 ? -27.026 -40.216 20.241 1.00 46.26 ? 886 PRO C CB 1 ATOM 9850 C CG . PRO C 1 578 ? -27.367 -39.834 21.652 1.00 46.90 ? 886 PRO C CG 1 ATOM 9851 C CD . PRO C 1 578 ? -26.229 -40.314 22.490 1.00 43.52 ? 886 PRO C CD 1 ATOM 9852 N N . GLN C 1 579 ? -24.951 -38.985 18.131 1.00 42.27 ? 887 GLN C N 1 ATOM 9853 C CA . GLN C 1 579 ? -24.397 -37.904 17.318 1.00 41.96 ? 887 GLN C CA 1 ATOM 9854 C C . GLN C 1 579 ? -25.092 -36.565 17.560 1.00 35.59 ? 887 GLN C C 1 ATOM 9855 O O . GLN C 1 579 ? -24.481 -35.500 17.428 1.00 35.58 ? 887 GLN C O 1 ATOM 9856 C CB . GLN C 1 579 ? -24.477 -38.278 15.834 1.00 49.42 ? 887 GLN C CB 1 ATOM 9857 C CG . GLN C 1 579 ? -23.818 -37.283 14.897 1.00 55.89 ? 887 GLN C CG 1 ATOM 9858 C CD . GLN C 1 579 ? -23.871 -37.730 13.450 1.00 63.07 ? 887 GLN C CD 1 ATOM 9859 O OE1 . GLN C 1 579 ? -24.381 -38.807 13.141 1.00 66.04 ? 887 GLN C OE1 1 ATOM 9860 N NE2 . GLN C 1 579 ? -23.343 -36.904 12.555 1.00 65.92 ? 887 GLN C NE2 1 ATOM 9861 N N . ASN C 1 580 ? -26.365 -36.627 17.936 1.00 32.83 ? 888 ASN C N 1 ATOM 9862 C CA . ASN C 1 580 ? -27.185 -35.427 18.094 1.00 35.18 ? 888 ASN C CA 1 ATOM 9863 C C . ASN C 1 580 ? -26.980 -34.647 19.398 1.00 29.80 ? 888 ASN C C 1 ATOM 9864 O O . ASN C 1 580 ? -27.628 -33.627 19.615 1.00 34.39 ? 888 ASN C O 1 ATOM 9865 C CB . ASN C 1 580 ? -28.668 -35.777 17.927 1.00 41.24 ? 888 ASN C CB 1 ATOM 9866 C CG . ASN C 1 580 ? -29.219 -36.574 19.096 1.00 45.76 ? 888 ASN C CG 1 ATOM 9867 O OD1 . ASN C 1 580 ? -28.474 -37.220 19.836 1.00 45.74 ? 888 ASN C OD1 1 ATOM 9868 N ND2 . ASN C 1 580 ? -30.535 -36.535 19.267 1.00 51.08 ? 888 ASN C ND2 1 ATOM 9869 N N . ARG C 1 581 ? -26.096 -35.123 20.270 1.00 25.58 ? 889 ARG C N 1 ATOM 9870 C CA . ARG C 1 581 ? -25.835 -34.410 21.520 1.00 23.92 ? 889 ARG C CA 1 ATOM 9871 C C . ARG C 1 581 ? -24.734 -33.377 21.321 1.00 22.06 ? 889 ARG C C 1 ATOM 9872 O O . ARG C 1 581 ? -24.513 -32.524 22.176 1.00 20.09 ? 889 ARG C O 1 ATOM 9873 C CB . ARG C 1 581 ? -25.447 -35.364 22.655 1.00 24.19 ? 889 ARG C CB 1 ATOM 9874 C CG . ARG C 1 581 ? -26.435 -36.490 22.960 1.00 25.97 ? 889 ARG C CG 1 ATOM 9875 C CD . ARG C 1 581 ? -27.801 -35.994 23.448 1.00 27.11 ? 889 ARG C CD 1 ATOM 9876 N NE . ARG C 1 581 ? -27.715 -35.032 24.544 1.00 24.63 ? 889 ARG C NE 1 ATOM 9877 C CZ . ARG C 1 581 ? -27.619 -35.352 25.832 1.00 27.95 ? 889 ARG C CZ 1 ATOM 9878 N NH1 . ARG C 1 581 ? -27.575 -36.627 26.212 1.00 27.23 ? 889 ARG C NH1 1 ATOM 9879 N NH2 . ARG C 1 581 ? -27.556 -34.389 26.746 1.00 28.15 ? 889 ARG C NH2 1 ATOM 9880 N N . ILE C 1 582 ? -24.032 -33.463 20.193 1.00 22.91 ? 890 ILE C N 1 ATOM 9881 C CA . ILE C 1 582 ? -22.968 -32.512 19.899 1.00 23.63 ? 890 ILE C CA 1 ATOM 9882 C C . ILE C 1 582 ? -23.215 -31.870 18.546 1.00 22.92 ? 890 ILE C C 1 ATOM 9883 O O . ILE C 1 582 ? -23.359 -32.563 17.542 1.00 23.95 ? 890 ILE C O 1 ATOM 9884 C CB . ILE C 1 582 ? -21.573 -33.178 19.900 1.00 23.45 ? 890 ILE C CB 1 ATOM 9885 C CG1 . ILE C 1 582 ? -21.330 -33.918 21.215 1.00 24.04 ? 890 ILE C CG1 1 ATOM 9886 C CG2 . ILE C 1 582 ? -20.489 -32.124 19.698 1.00 25.46 ? 890 ILE C CG2 1 ATOM 9887 C CD1 . ILE C 1 582 ? -19.932 -34.522 21.315 1.00 26.35 ? 890 ILE C CD1 1 ATOM 9888 N N . ILE C 1 583 ? -23.278 -30.545 18.531 1.00 18.64 ? 891 ILE C N 1 ATOM 9889 C CA . ILE C 1 583 ? -23.548 -29.794 17.309 1.00 18.86 ? 891 ILE C CA 1 ATOM 9890 C C . ILE C 1 583 ? -22.332 -28.953 16.913 1.00 17.87 ? 891 ILE C C 1 ATOM 9891 O O . ILE C 1 583 ? -21.792 -28.212 17.733 1.00 17.08 ? 891 ILE C O 1 ATOM 9892 C CB . ILE C 1 583 ? -24.766 -28.872 17.501 1.00 19.52 ? 891 ILE C CB 1 ATOM 9893 C CG1 . ILE C 1 583 ? -26.022 -29.718 17.752 1.00 22.98 ? 891 ILE C CG1 1 ATOM 9894 C CG2 . ILE C 1 583 ? -24.941 -27.945 16.298 1.00 18.39 ? 891 ILE C CG2 1 ATOM 9895 C CD1 . ILE C 1 583 ? -27.263 -28.918 18.039 1.00 25.65 ? 891 ILE C CD1 1 ATOM 9896 N N . PHE C 1 584 ? -21.895 -29.081 15.662 1.00 15.90 ? 892 PHE C N 1 ATOM 9897 C CA . PHE C 1 584 ? -20.756 -28.307 15.174 1.00 19.46 ? 892 PHE C CA 1 ATOM 9898 C C . PHE C 1 584 ? -21.175 -27.104 14.319 1.00 19.65 ? 892 PHE C C 1 ATOM 9899 O O . PHE C 1 584 ? -22.128 -27.175 13.542 1.00 20.21 ? 892 PHE C O 1 ATOM 9900 C CB . PHE C 1 584 ? -19.776 -29.209 14.405 1.00 16.88 ? 892 PHE C CB 1 ATOM 9901 C CG . PHE C 1 584 ? -18.853 -30.002 15.295 1.00 17.11 ? 892 PHE C CG 1 ATOM 9902 C CD1 . PHE C 1 584 ? -17.588 -29.524 15.604 1.00 15.93 ? 892 PHE C CD1 1 ATOM 9903 C CD2 . PHE C 1 584 ? -19.254 -31.220 15.833 1.00 19.74 ? 892 PHE C CD2 1 ATOM 9904 C CE1 . PHE C 1 584 ? -16.735 -30.249 16.433 1.00 18.62 ? 892 PHE C CE1 1 ATOM 9905 C CE2 . PHE C 1 584 ? -18.408 -31.945 16.667 1.00 18.98 ? 892 PHE C CE2 1 ATOM 9906 C CZ . PHE C 1 584 ? -17.149 -31.458 16.965 1.00 17.69 ? 892 PHE C CZ 1 ATOM 9907 N N . SER C 1 585 ? -20.465 -25.993 14.484 1.00 16.42 ? 893 SER C N 1 ATOM 9908 C CA . SER C 1 585 ? -20.651 -24.833 13.619 1.00 14.14 ? 893 SER C CA 1 ATOM 9909 C C . SER C 1 585 ? -19.321 -24.472 12.963 1.00 14.28 ? 893 SER C C 1 ATOM 9910 O O . SER C 1 585 ? -18.246 -24.806 13.489 1.00 14.49 ? 893 SER C O 1 ATOM 9911 C CB . SER C 1 585 ? -21.181 -23.633 14.415 1.00 13.52 ? 893 SER C CB 1 ATOM 9912 O OG . SER C 1 585 ? -22.532 -23.831 14.801 1.00 18.58 ? 893 SER C OG 1 ATOM 9913 N N . PRO C 1 586 ? -19.387 -23.795 11.811 1.00 15.83 ? 894 PRO C N 1 ATOM 9914 C CA . PRO C 1 586 ? -18.171 -23.267 11.199 1.00 15.65 ? 894 PRO C CA 1 ATOM 9915 C C . PRO C 1 586 ? -17.588 -22.169 12.068 1.00 16.19 ? 894 PRO C C 1 ATOM 9916 O O . PRO C 1 586 ? -18.315 -21.553 12.868 1.00 16.61 ? 894 PRO C O 1 ATOM 9917 C CB . PRO C 1 586 ? -18.667 -22.647 9.884 1.00 21.00 ? 894 PRO C CB 1 ATOM 9918 C CG . PRO C 1 586 ? -20.031 -23.175 9.662 1.00 19.08 ? 894 PRO C CG 1 ATOM 9919 C CD . PRO C 1 586 ? -20.591 -23.518 11.002 1.00 17.82 ? 894 PRO C CD 1 ATOM 9920 N N . VAL C 1 587 ? -16.281 -21.948 11.930 1.00 14.92 ? 895 VAL C N 1 ATOM 9921 C CA . VAL C 1 587 ? -15.641 -20.771 12.492 1.00 13.69 ? 895 VAL C CA 1 ATOM 9922 C C . VAL C 1 587 ? -16.295 -19.569 11.823 1.00 12.86 ? 895 VAL C C 1 ATOM 9923 O O . VAL C 1 587 ? -16.597 -19.603 10.629 1.00 13.85 ? 895 VAL C O 1 ATOM 9924 C CB . VAL C 1 587 ? -14.121 -20.788 12.231 1.00 11.91 ? 895 VAL C CB 1 ATOM 9925 C CG1 . VAL C 1 587 ? -13.470 -19.468 12.661 1.00 9.35 ? 895 VAL C CG1 1 ATOM 9926 C CG2 . VAL C 1 587 ? -13.485 -21.961 12.963 1.00 14.10 ? 895 VAL C CG2 1 ATOM 9927 N N . ALA C 1 588 ? -16.565 -18.527 12.602 1.00 14.08 ? 896 ALA C N 1 ATOM 9928 C CA . ALA C 1 588 ? -17.270 -17.358 12.090 1.00 14.97 ? 896 ALA C CA 1 ATOM 9929 C C . ALA C 1 588 ? -16.361 -16.135 12.091 1.00 14.35 ? 896 ALA C C 1 ATOM 9930 O O . ALA C 1 588 ? -15.396 -16.084 12.854 1.00 13.46 ? 896 ALA C O 1 ATOM 9931 C CB . ALA C 1 588 ? -18.500 -17.076 12.966 1.00 15.85 ? 896 ALA C CB 1 ATOM 9932 N N . PRO C 1 589 ? -16.697 -15.126 11.271 1.00 14.26 ? 897 PRO C N 1 ATOM 9933 C CA . PRO C 1 589 ? -16.066 -13.807 11.407 1.00 15.76 ? 897 PRO C CA 1 ATOM 9934 C C . PRO C 1 589 ? -16.168 -13.333 12.854 1.00 15.99 ? 897 PRO C C 1 ATOM 9935 O O . PRO C 1 589 ? -17.112 -13.729 13.550 1.00 13.85 ? 897 PRO C O 1 ATOM 9936 C CB . PRO C 1 589 ? -16.929 -12.908 10.514 1.00 16.74 ? 897 PRO C CB 1 ATOM 9937 C CG . PRO C 1 589 ? -17.570 -13.821 9.549 1.00 18.03 ? 897 PRO C CG 1 ATOM 9938 C CD . PRO C 1 589 ? -17.758 -15.133 10.249 1.00 14.31 ? 897 PRO C CD 1 ATOM 9939 N N . LYS C 1 590 ? -15.215 -12.508 13.283 1.00 13.33 ? 898 LYS C N 1 ATOM 9940 C CA . LYS C 1 590 ? -15.058 -12.112 14.685 1.00 13.81 ? 898 LYS C CA 1 ATOM 9941 C C . LYS C 1 590 ? -16.349 -11.618 15.366 1.00 14.99 ? 898 LYS C C 1 ATOM 9942 O O . LYS C 1 590 ? -16.739 -12.121 16.423 1.00 12.91 ? 898 LYS C O 1 ATOM 9943 C CB . LYS C 1 590 ? -13.964 -11.037 14.786 1.00 15.20 ? 898 LYS C CB 1 ATOM 9944 C CG . LYS C 1 590 ? -13.663 -10.556 16.198 1.00 16.75 ? 898 LYS C CG 1 ATOM 9945 C CD . LYS C 1 590 ? -12.668 -11.475 16.908 1.00 19.05 ? 898 LYS C CD 1 ATOM 9946 C CE . LYS C 1 590 ? -12.295 -10.937 18.295 1.00 18.55 ? 898 LYS C CE 1 ATOM 9947 N NZ . LYS C 1 590 ? -11.132 -11.675 18.887 1.00 14.99 ? 898 LYS C NZ 1 ATOM 9948 N N . GLU C 1 591 ? -17.014 -10.643 14.761 1.00 15.58 ? 899 GLU C N 1 ATOM 9949 C CA . GLU C 1 591 ? -18.242 -10.093 15.345 1.00 11.79 ? 899 GLU C CA 1 ATOM 9950 C C . GLU C 1 591 ? -19.338 -11.145 15.506 1.00 12.38 ? 899 GLU C C 1 ATOM 9951 O O . GLU C 1 591 ? -20.036 -11.158 16.523 1.00 13.22 ? 899 GLU C O 1 ATOM 9952 C CB . GLU C 1 591 ? -18.757 -8.906 14.518 1.00 15.80 ? 899 GLU C CB 1 ATOM 9953 C CG . GLU C 1 591 ? -19.901 -8.121 15.174 1.00 17.05 ? 899 GLU C CG 1 ATOM 9954 C CD . GLU C 1 591 ? -21.274 -8.706 14.878 1.00 19.36 ? 899 GLU C CD 1 ATOM 9955 O OE1 . GLU C 1 591 ? -21.397 -9.422 13.863 1.00 17.54 ? 899 GLU C OE1 1 ATOM 9956 O OE2 . GLU C 1 591 ? -22.221 -8.452 15.661 1.00 16.87 ? 899 GLU C OE2 1 ATOM 9957 N N . GLU C 1 592 ? -19.494 -12.019 14.509 1.00 10.51 ? 900 GLU C N 1 ATOM 9958 C CA . GLU C 1 592 ? -20.530 -13.058 14.571 1.00 12.37 ? 900 GLU C CA 1 ATOM 9959 C C . GLU C 1 592 ? -20.219 -14.083 15.663 1.00 15.94 ? 900 GLU C C 1 ATOM 9960 O O . GLU C 1 592 ? -21.115 -14.536 16.378 1.00 12.13 ? 900 GLU C O 1 ATOM 9961 C CB . GLU C 1 592 ? -20.709 -13.767 13.218 1.00 13.37 ? 900 GLU C CB 1 ATOM 9962 C CG . GLU C 1 592 ? -21.689 -14.961 13.254 1.00 14.41 ? 900 GLU C CG 1 ATOM 9963 C CD . GLU C 1 592 ? -21.622 -15.836 12.005 1.00 16.21 ? 900 GLU C CD 1 ATOM 9964 O OE1 . GLU C 1 592 ? -21.103 -15.362 10.963 1.00 13.55 ? 900 GLU C OE1 1 ATOM 9965 O OE2 . GLU C 1 592 ? -22.093 -17.002 12.067 1.00 15.47 ? 900 GLU C OE2 1 ATOM 9966 N N . HIS C 1 593 ? -18.942 -14.434 15.790 1.00 14.72 ? 901 HIS C N 1 ATOM 9967 C CA . HIS C 1 593 ? -18.471 -15.330 16.851 1.00 15.34 ? 901 HIS C CA 1 ATOM 9968 C C . HIS C 1 593 ? -18.809 -14.792 18.242 1.00 15.39 ? 901 HIS C C 1 ATOM 9969 O O . HIS C 1 593 ? -19.323 -15.521 19.098 1.00 12.09 ? 901 HIS C O 1 ATOM 9970 C CB . HIS C 1 593 ? -16.962 -15.556 16.678 1.00 15.00 ? 901 HIS C CB 1 ATOM 9971 C CG . HIS C 1 593 ? -16.227 -15.880 17.943 1.00 12.43 ? 901 HIS C CG 1 ATOM 9972 N ND1 . HIS C 1 593 ? -16.395 -17.066 18.628 1.00 11.30 ? 901 HIS C ND1 1 ATOM 9973 C CD2 . HIS C 1 593 ? -15.285 -15.183 18.625 1.00 13.67 ? 901 HIS C CD2 1 ATOM 9974 C CE1 . HIS C 1 593 ? -15.601 -17.077 19.685 1.00 11.99 ? 901 HIS C CE1 1 ATOM 9975 N NE2 . HIS C 1 593 ? -14.919 -15.945 19.708 1.00 12.72 ? 901 HIS C NE2 1 ATOM 9976 N N . VAL C 1 594 ? -18.542 -13.512 18.480 1.00 14.14 ? 902 VAL C N 1 ATOM 9977 C CA . VAL C 1 594 ? -18.843 -12.948 19.795 1.00 13.32 ? 902 VAL C CA 1 ATOM 9978 C C . VAL C 1 594 ? -20.357 -12.861 20.000 1.00 15.49 ? 902 VAL C C 1 ATOM 9979 O O . VAL C 1 594 ? -20.883 -13.288 21.035 1.00 16.26 ? 902 VAL C O 1 ATOM 9980 C CB . VAL C 1 594 ? -18.145 -11.588 20.010 1.00 13.19 ? 902 VAL C CB 1 ATOM 9981 C CG1 . VAL C 1 594 ? -18.494 -11.007 21.382 1.00 12.65 ? 902 VAL C CG1 1 ATOM 9982 C CG2 . VAL C 1 594 ? -16.629 -11.749 19.874 1.00 13.58 ? 902 VAL C CG2 1 ATOM 9983 N N . ARG C 1 595 ? -21.057 -12.352 18.990 1.00 14.40 ? 903 ARG C N 1 ATOM 9984 C CA . ARG C 1 595 ? -22.509 -12.182 19.063 1.00 14.69 ? 903 ARG C CA 1 ATOM 9985 C C . ARG C 1 595 ? -23.255 -13.504 19.279 1.00 13.94 ? 903 ARG C C 1 ATOM 9986 O O . ARG C 1 595 ? -24.186 -13.578 20.084 1.00 12.77 ? 903 ARG C O 1 ATOM 9987 C CB . ARG C 1 595 ? -23.013 -11.457 17.803 1.00 13.33 ? 903 ARG C CB 1 ATOM 9988 C CG . ARG C 1 595 ? -24.514 -11.269 17.718 1.00 16.15 ? 903 ARG C CG 1 ATOM 9989 C CD . ARG C 1 595 ? -24.883 -10.257 16.618 1.00 14.84 ? 903 ARG C CD 1 ATOM 9990 N NE . ARG C 1 595 ? -24.102 -10.440 15.398 1.00 12.14 ? 903 ARG C NE 1 ATOM 9991 C CZ . ARG C 1 595 ? -24.236 -11.461 14.551 1.00 13.29 ? 903 ARG C CZ 1 ATOM 9992 N NH1 . ARG C 1 595 ? -25.127 -12.411 14.786 1.00 14.67 ? 903 ARG C NH1 1 ATOM 9993 N NH2 . ARG C 1 595 ? -23.474 -11.532 13.463 1.00 12.44 ? 903 ARG C NH2 1 ATOM 9994 N N . ARG C 1 596 ? -22.832 -14.561 18.595 1.00 15.70 ? 904 ARG C N 1 ATOM 9995 C CA . ARG C 1 596 ? -23.559 -15.821 18.689 1.00 16.03 ? 904 ARG C CA 1 ATOM 9996 C C . ARG C 1 596 ? -23.375 -16.529 20.038 1.00 14.55 ? 904 ARG C C 1 ATOM 9997 O O . ARG C 1 596 ? -24.111 -17.441 20.356 1.00 13.12 ? 904 ARG C O 1 ATOM 9998 C CB . ARG C 1 596 ? -23.246 -16.758 17.511 1.00 16.70 ? 904 ARG C CB 1 ATOM 9999 C CG . ARG C 1 596 ? -21.902 -17.447 17.566 1.00 18.36 ? 904 ARG C CG 1 ATOM 10000 C CD . ARG C 1 596 ? -21.648 -18.230 16.272 1.00 17.06 ? 904 ARG C CD 1 ATOM 10001 N NE . ARG C 1 596 ? -20.287 -18.749 16.195 1.00 16.29 ? 904 ARG C NE 1 ATOM 10002 C CZ . ARG C 1 596 ? -19.811 -19.462 15.175 1.00 17.07 ? 904 ARG C CZ 1 ATOM 10003 N NH1 . ARG C 1 596 ? -20.585 -19.751 14.127 1.00 16.66 ? 904 ARG C NH1 1 ATOM 10004 N NH2 . ARG C 1 596 ? -18.555 -19.881 15.199 1.00 15.09 ? 904 ARG C NH2 1 ATOM 10005 N N . GLY C 1 597 ? -22.408 -16.103 20.837 1.00 14.96 ? 905 GLY C N 1 ATOM 10006 C CA . GLY C 1 597 ? -22.300 -16.631 22.188 1.00 12.97 ? 905 GLY C CA 1 ATOM 10007 C C . GLY C 1 597 ? -23.536 -16.337 23.026 1.00 13.32 ? 905 GLY C C 1 ATOM 10008 O O . GLY C 1 597 ? -23.810 -17.025 24.006 1.00 11.21 ? 905 GLY C O 1 ATOM 10009 N N . GLN C 1 598 ? -24.300 -15.315 22.645 1.00 14.04 ? 906 GLN C N 1 ATOM 10010 C CA . GLN C 1 598 ? -25.530 -14.987 23.372 1.00 14.40 ? 906 GLN C CA 1 ATOM 10011 C C . GLN C 1 598 ? -26.551 -16.123 23.336 1.00 16.35 ? 906 GLN C C 1 ATOM 10012 O O . GLN C 1 598 ? -27.466 -16.158 24.154 1.00 14.52 ? 906 GLN C O 1 ATOM 10013 C CB . GLN C 1 598 ? -26.183 -13.742 22.777 1.00 16.79 ? 906 GLN C CB 1 ATOM 10014 C CG . GLN C 1 598 ? -25.402 -12.467 23.013 1.00 12.45 ? 906 GLN C CG 1 ATOM 10015 C CD . GLN C 1 598 ? -26.065 -11.298 22.359 1.00 10.57 ? 906 GLN C CD 1 ATOM 10016 O OE1 . GLN C 1 598 ? -26.664 -10.448 23.028 1.00 15.54 ? 906 GLN C OE1 1 ATOM 10017 N NE2 . GLN C 1 598 ? -25.960 -11.233 21.036 1.00 11.91 ? 906 GLN C NE2 1 ATOM 10018 N N . LEU C 1 599 ? -26.401 -17.042 22.387 1.00 17.77 ? 907 LEU C N 1 ATOM 10019 C CA . LEU C 1 599 ? -27.393 -18.108 22.194 1.00 15.46 ? 907 LEU C CA 1 ATOM 10020 C C . LEU C 1 599 ? -27.178 -19.286 23.132 1.00 14.30 ? 907 LEU C C 1 ATOM 10021 O O . LEU C 1 599 ? -28.091 -20.089 23.367 1.00 15.88 ? 907 LEU C O 1 ATOM 10022 C CB . LEU C 1 599 ? -27.362 -18.610 20.758 1.00 15.24 ? 907 LEU C CB 1 ATOM 10023 C CG . LEU C 1 599 ? -27.636 -17.597 19.652 1.00 16.40 ? 907 LEU C CG 1 ATOM 10024 C CD1 . LEU C 1 599 ? -27.376 -18.246 18.304 1.00 18.04 ? 907 LEU C CD1 1 ATOM 10025 C CD2 . LEU C 1 599 ? -29.062 -17.060 19.739 1.00 13.77 ? 907 LEU C CD2 1 ATOM 10026 N N . ALA C 1 600 ? -25.963 -19.416 23.644 1.00 12.05 ? 908 ALA C N 1 ATOM 10027 C CA . ALA C 1 600 ? -25.666 -20.504 24.571 1.00 13.29 ? 908 ALA C CA 1 ATOM 10028 C C . ALA C 1 600 ? -26.227 -20.211 25.966 1.00 17.68 ? 908 ALA C C 1 ATOM 10029 O O . ALA C 1 600 ? -26.485 -19.054 26.300 1.00 18.81 ? 908 ALA C O 1 ATOM 10030 C CB . ALA C 1 600 ? -24.160 -20.743 24.636 1.00 13.04 ? 908 ALA C CB 1 ATOM 10031 N N . ASP C 1 601 ? -26.426 -21.259 26.770 1.00 15.44 ? 909 ASP C N 1 ATOM 10032 C CA . ASP C 1 601 ? -26.775 -21.084 28.181 1.00 13.46 ? 909 ASP C CA 1 ATOM 10033 C C . ASP C 1 601 ? -25.526 -20.966 29.051 1.00 15.85 ? 909 ASP C C 1 ATOM 10034 O O . ASP C 1 601 ? -25.458 -20.131 29.953 1.00 15.37 ? 909 ASP C O 1 ATOM 10035 C CB . ASP C 1 601 ? -27.642 -22.245 28.697 1.00 13.32 ? 909 ASP C CB 1 ATOM 10036 C CG . ASP C 1 601 ? -29.005 -22.290 28.037 1.00 18.99 ? 909 ASP C CG 1 ATOM 10037 O OD1 . ASP C 1 601 ? -29.217 -23.148 27.149 1.00 19.89 ? 909 ASP C OD1 1 ATOM 10038 O OD2 . ASP C 1 601 ? -29.851 -21.441 28.384 1.00 21.97 ? 909 ASP C OD2 1 ATOM 10039 N N . VAL C 1 602 ? -24.544 -21.820 28.770 1.00 16.62 ? 910 VAL C N 1 ATOM 10040 C CA . VAL C 1 602 ? -23.365 -21.986 29.617 1.00 17.29 ? 910 VAL C CA 1 ATOM 10041 C C . VAL C 1 602 ? -22.172 -22.355 28.744 1.00 16.73 ? 910 VAL C C 1 ATOM 10042 O O . VAL C 1 602 ? -22.304 -23.180 27.846 1.00 19.34 ? 910 VAL C O 1 ATOM 10043 C CB . VAL C 1 602 ? -23.561 -23.147 30.624 1.00 16.12 ? 910 VAL C CB 1 ATOM 10044 C CG1 . VAL C 1 602 ? -22.310 -23.345 31.464 1.00 12.14 ? 910 VAL C CG1 1 ATOM 10045 C CG2 . VAL C 1 602 ? -24.774 -22.911 31.533 1.00 17.24 ? 910 VAL C CG2 1 ATOM 10046 N N . CYS C 1 603 ? -21.014 -21.747 29.006 1.00 14.11 ? 911 CYS C N 1 ATOM 10047 C CA . CYS C 1 603 ? -19.763 -22.160 28.369 1.00 14.49 ? 911 CYS C CA 1 ATOM 10048 C C . CYS C 1 603 ? -19.004 -23.139 29.260 1.00 13.94 ? 911 CYS C C 1 ATOM 10049 O O . CYS C 1 603 ? -18.864 -22.919 30.459 1.00 17.56 ? 911 CYS C O 1 ATOM 10050 C CB . CYS C 1 603 ? -18.874 -20.944 28.082 1.00 20.36 ? 911 CYS C CB 1 ATOM 10051 S SG . CYS C 1 603 ? -17.226 -21.353 27.419 1.00 23.97 ? 911 CYS C SG 1 ATOM 10052 N N . LEU C 1 604 ? -18.529 -24.233 28.678 1.00 15.16 ? 912 LEU C N 1 ATOM 10053 C CA . LEU C 1 604 ? -17.715 -25.180 29.428 1.00 13.85 ? 912 LEU C CA 1 ATOM 10054 C C . LEU C 1 604 ? -16.243 -25.008 29.034 1.00 16.43 ? 912 LEU C C 1 ATOM 10055 O O . LEU C 1 604 ? -15.828 -25.433 27.961 1.00 17.49 ? 912 LEU C O 1 ATOM 10056 C CB . LEU C 1 604 ? -18.177 -26.617 29.165 1.00 15.98 ? 912 LEU C CB 1 ATOM 10057 C CG . LEU C 1 604 ? -19.637 -26.950 29.470 1.00 17.97 ? 912 LEU C CG 1 ATOM 10058 C CD1 . LEU C 1 604 ? -19.972 -28.394 29.085 1.00 20.19 ? 912 LEU C CD1 1 ATOM 10059 C CD2 . LEU C 1 604 ? -19.970 -26.697 30.941 1.00 14.33 ? 912 LEU C CD2 1 ATOM 10060 N N . ASP C 1 605 ? -15.465 -24.377 29.909 1.00 17.26 ? 913 ASP C N 1 ATOM 10061 C CA . ASP C 1 605 ? -14.072 -24.053 29.606 1.00 17.80 ? 913 ASP C CA 1 ATOM 10062 C C . ASP C 1 605 ? -13.184 -25.297 29.592 1.00 15.20 ? 913 ASP C C 1 ATOM 10063 O O . ASP C 1 605 ? -13.411 -26.247 30.343 1.00 18.31 ? 913 ASP C O 1 ATOM 10064 C CB . ASP C 1 605 ? -13.536 -23.032 30.619 1.00 18.87 ? 913 ASP C CB 1 ATOM 10065 C CG . ASP C 1 605 ? -12.111 -22.594 30.315 1.00 22.47 ? 913 ASP C CG 1 ATOM 10066 O OD1 . ASP C 1 605 ? -11.825 -22.271 29.139 1.00 18.17 ? 913 ASP C OD1 1 ATOM 10067 O OD2 . ASP C 1 605 ? -11.279 -22.585 31.254 1.00 21.95 ? 913 ASP C OD2 1 ATOM 10068 N N . THR C 1 606 ? -12.174 -25.285 28.727 1.00 16.07 ? 914 THR C N 1 ATOM 10069 C CA . THR C 1 606 ? -11.194 -26.370 28.643 1.00 15.73 ? 914 THR C CA 1 ATOM 10070 C C . THR C 1 606 ? -10.114 -26.273 29.727 1.00 15.76 ? 914 THR C C 1 ATOM 10071 O O . THR C 1 606 ? -9.337 -25.325 29.740 1.00 18.35 ? 914 THR C O 1 ATOM 10072 C CB . THR C 1 606 ? -10.498 -26.364 27.251 1.00 16.18 ? 914 THR C CB 1 ATOM 10073 O OG1 . THR C 1 606 ? -10.223 -25.010 26.867 1.00 16.27 ? 914 THR C OG1 1 ATOM 10074 C CG2 . THR C 1 606 ? -11.399 -26.988 26.215 1.00 13.04 ? 914 THR C CG2 1 ATOM 10075 N N . PRO C 1 607 ? -10.041 -27.275 30.625 1.00 14.22 ? 915 PRO C N 1 ATOM 10076 C CA . PRO C 1 607 ? -9.061 -27.248 31.721 1.00 17.92 ? 915 PRO C CA 1 ATOM 10077 C C . PRO C 1 607 ? -7.601 -27.353 31.279 1.00 18.82 ? 915 PRO C C 1 ATOM 10078 O O . PRO C 1 607 ? -6.733 -26.793 31.955 1.00 17.74 ? 915 PRO C O 1 ATOM 10079 C CB . PRO C 1 607 ? -9.426 -28.486 32.552 1.00 20.36 ? 915 PRO C CB 1 ATOM 10080 C CG . PRO C 1 607 ? -10.853 -28.758 32.223 1.00 20.76 ? 915 PRO C CG 1 ATOM 10081 C CD . PRO C 1 607 ? -10.999 -28.383 30.778 1.00 17.56 ? 915 PRO C CD 1 ATOM 10082 N N . LEU C 1 608 ? -7.327 -28.065 30.187 1.00 18.89 ? 916 LEU C N 1 ATOM 10083 C CA . LEU C 1 608 ? -5.945 -28.265 29.751 1.00 18.26 ? 916 LEU C CA 1 ATOM 10084 C C . LEU C 1 608 ? -5.278 -26.930 29.420 1.00 18.70 ? 916 LEU C C 1 ATOM 10085 O O . LEU C 1 608 ? -4.188 -26.631 29.889 1.00 18.17 ? 916 LEU C O 1 ATOM 10086 C CB . LEU C 1 608 ? -5.891 -29.203 28.542 1.00 15.20 ? 916 LEU C CB 1 ATOM 10087 C CG . LEU C 1 608 ? -4.485 -29.513 28.020 1.00 18.88 ? 916 LEU C CG 1 ATOM 10088 C CD1 . LEU C 1 608 ? -3.678 -30.313 29.047 1.00 17.98 ? 916 LEU C CD1 1 ATOM 10089 C CD2 . LEU C 1 608 ? -4.542 -30.236 26.679 1.00 17.68 ? 916 LEU C CD2 1 ATOM 10090 N N . CYS C 1 609 ? -5.944 -26.145 28.586 1.00 17.54 ? 917 CYS C N 1 ATOM 10091 C CA . CYS C 1 609 ? -5.542 -24.780 28.294 1.00 14.69 ? 917 CYS C CA 1 ATOM 10092 C C . CYS C 1 609 ? -6.856 -24.060 28.136 1.00 14.15 ? 917 CYS C C 1 ATOM 10093 O O . CYS C 1 609 ? -7.678 -24.478 27.326 1.00 14.70 ? 917 CYS C O 1 ATOM 10094 C CB . CYS C 1 609 ? -4.734 -24.703 26.992 1.00 14.53 ? 917 CYS C CB 1 ATOM 10095 S SG . CYS C 1 609 ? -4.374 -23.011 26.455 1.00 20.83 ? 917 CYS C SG 1 ATOM 10096 N N . ASN C 1 610 ? -7.085 -23.019 28.935 1.00 13.90 ? 918 ASN C N 1 ATOM 10097 C CA . ASN C 1 610 ? -8.374 -22.336 28.931 1.00 14.83 ? 918 ASN C CA 1 ATOM 10098 C C . ASN C 1 610 ? -8.592 -21.513 27.675 1.00 16.16 ? 918 ASN C C 1 ATOM 10099 O O . ASN C 1 610 ? -7.654 -21.239 26.913 1.00 15.36 ? 918 ASN C O 1 ATOM 10100 C CB . ASN C 1 610 ? -8.508 -21.359 30.111 1.00 16.08 ? 918 ASN C CB 1 ATOM 10101 C CG . ASN C 1 610 ? -8.267 -21.998 31.475 1.00 19.09 ? 918 ASN C CG 1 ATOM 10102 O OD1 . ASN C 1 610 ? -7.982 -21.283 32.437 1.00 20.21 ? 918 ASN C OD1 1 ATOM 10103 N ND2 . ASN C 1 610 ? -8.397 -23.325 31.576 1.00 16.13 ? 918 ASN C ND2 1 ATOM 10104 N N . GLY C 1 611 ? -9.831 -21.076 27.487 1.00 16.06 ? 919 GLY C N 1 ATOM 10105 C CA . GLY C 1 611 ? -10.080 -19.964 26.594 1.00 15.94 ? 919 GLY C CA 1 ATOM 10106 C C . GLY C 1 611 ? -9.414 -18.736 27.203 1.00 15.70 ? 919 GLY C C 1 ATOM 10107 O O . GLY C 1 611 ? -9.517 -18.493 28.411 1.00 14.07 ? 919 GLY C O 1 ATOM 10108 N N . HIS C 1 612 ? -8.705 -17.973 26.382 1.00 14.52 ? 920 HIS C N 1 ATOM 10109 C CA . HIS C 1 612 ? -8.086 -16.743 26.867 1.00 11.54 ? 920 HIS C CA 1 ATOM 10110 C C . HIS C 1 612 ? -8.837 -15.597 26.220 1.00 15.26 ? 920 HIS C C 1 ATOM 10111 O O . HIS C 1 612 ? -9.754 -15.050 26.827 1.00 14.80 ? 920 HIS C O 1 ATOM 10112 C CB . HIS C 1 612 ? -6.583 -16.716 26.574 1.00 13.17 ? 920 HIS C CB 1 ATOM 10113 C CG . HIS C 1 612 ? -5.822 -17.808 27.263 1.00 15.94 ? 920 HIS C CG 1 ATOM 10114 N ND1 . HIS C 1 612 ? -4.506 -18.100 26.974 1.00 17.94 ? 920 HIS C ND1 1 ATOM 10115 C CD2 . HIS C 1 612 ? -6.200 -18.687 28.222 1.00 15.04 ? 920 HIS C CD2 1 ATOM 10116 C CE1 . HIS C 1 612 ? -4.108 -19.116 27.719 1.00 18.95 ? 920 HIS C CE1 1 ATOM 10117 N NE2 . HIS C 1 612 ? -5.116 -19.489 28.489 1.00 15.45 ? 920 HIS C NE2 1 ATOM 10118 N N . THR C 1 613 ? -8.479 -15.258 24.984 1.00 16.94 ? 921 THR C N 1 ATOM 10119 C CA . THR C 1 613 ? -9.280 -14.320 24.204 1.00 15.02 ? 921 THR C CA 1 ATOM 10120 C C . THR C 1 613 ? -10.712 -14.872 24.162 1.00 15.26 ? 921 THR C C 1 ATOM 10121 O O . THR C 1 613 ? -11.703 -14.146 24.320 1.00 12.91 ? 921 THR C O 1 ATOM 10122 C CB . THR C 1 613 ? -8.730 -14.194 22.759 1.00 14.53 ? 921 THR C CB 1 ATOM 10123 O OG1 . THR C 1 613 ? -7.337 -13.850 22.795 1.00 16.28 ? 921 THR C OG1 1 ATOM 10124 C CG2 . THR C 1 613 ? -9.486 -13.136 21.968 1.00 14.26 ? 921 THR C CG2 1 ATOM 10125 N N . THR C 1 614 ? -10.798 -16.179 23.973 1.00 10.94 ? 922 THR C N 1 ATOM 10126 C CA . THR C 1 614 ? -12.070 -16.877 23.814 1.00 13.40 ? 922 THR C CA 1 ATOM 10127 C C . THR C 1 614 ? -12.953 -16.773 25.069 1.00 17.48 ? 922 THR C C 1 ATOM 10128 O O . THR C 1 614 ? -14.175 -16.657 24.973 1.00 19.72 ? 922 THR C O 1 ATOM 10129 C CB . THR C 1 614 ? -11.818 -18.357 23.408 1.00 15.37 ? 922 THR C CB 1 ATOM 10130 O OG1 . THR C 1 614 ? -10.924 -18.386 22.283 1.00 13.73 ? 922 THR C OG1 1 ATOM 10131 C CG2 . THR C 1 614 ? -13.125 -19.070 23.028 1.00 15.79 ? 922 THR C CG2 1 ATOM 10132 N N . GLY C 1 615 ? -12.323 -16.791 26.238 1.00 12.37 ? 923 GLY C N 1 ATOM 10133 C CA . GLY C 1 615 ? -13.037 -16.613 27.489 1.00 14.77 ? 923 GLY C CA 1 ATOM 10134 C C . GLY C 1 615 ? -13.639 -15.221 27.560 1.00 14.82 ? 923 GLY C C 1 ATOM 10135 O O . GLY C 1 615 ? -14.813 -15.077 27.906 1.00 13.03 ? 923 GLY C O 1 ATOM 10136 N N . MET C 1 616 ? -12.847 -14.201 27.214 1.00 14.39 ? 924 MET C N 1 ATOM 10137 C CA . MET C 1 616 ? -13.344 -12.820 27.189 1.00 13.63 ? 924 MET C CA 1 ATOM 10138 C C . MET C 1 616 ? -14.527 -12.690 26.225 1.00 13.46 ? 924 MET C C 1 ATOM 10139 O O . MET C 1 616 ? -15.503 -11.991 26.518 1.00 14.16 ? 924 MET C O 1 ATOM 10140 C CB . MET C 1 616 ? -12.234 -11.822 26.803 1.00 14.80 ? 924 MET C CB 1 ATOM 10141 C CG . MET C 1 616 ? -11.017 -11.828 27.741 1.00 12.37 ? 924 MET C CG 1 ATOM 10142 S SD . MET C 1 616 ? -11.374 -11.253 29.428 1.00 17.35 ? 924 MET C SD 1 ATOM 10143 C CE . MET C 1 616 ? -11.508 -9.470 29.181 1.00 11.75 ? 924 MET C CE 1 ATOM 10144 N N . ASP C 1 617 ? -14.440 -13.375 25.089 1.00 11.24 ? 925 ASP C N 1 ATOM 10145 C CA . ASP C 1 617 ? -15.473 -13.301 24.051 1.00 11.36 ? 925 ASP C CA 1 ATOM 10146 C C . ASP C 1 617 ? -16.813 -13.807 24.582 1.00 11.39 ? 925 ASP C C 1 ATOM 10147 O O . ASP C 1 617 ? -17.879 -13.218 24.332 1.00 12.49 ? 925 ASP C O 1 ATOM 10148 C CB . ASP C 1 617 ? -15.075 -14.132 22.832 1.00 12.84 ? 925 ASP C CB 1 ATOM 10149 C CG . ASP C 1 617 ? -13.853 -13.584 22.102 1.00 16.29 ? 925 ASP C CG 1 ATOM 10150 O OD1 . ASP C 1 617 ? -13.537 -12.374 22.201 1.00 14.30 ? 925 ASP C OD1 1 ATOM 10151 O OD2 . ASP C 1 617 ? -13.215 -14.389 21.399 1.00 14.17 ? 925 ASP C OD2 1 ATOM 10152 N N . VAL C 1 618 ? -16.744 -14.913 25.309 1.00 10.89 ? 926 VAL C N 1 ATOM 10153 C CA . VAL C 1 618 ? -17.934 -15.592 25.815 1.00 13.36 ? 926 VAL C CA 1 ATOM 10154 C C . VAL C 1 618 ? -18.566 -14.809 26.971 1.00 16.41 ? 926 VAL C C 1 ATOM 10155 O O . VAL C 1 618 ? -19.792 -14.724 27.079 1.00 14.20 ? 926 VAL C O 1 ATOM 10156 C CB . VAL C 1 618 ? -17.595 -17.058 26.222 1.00 26.26 ? 926 VAL C CB 1 ATOM 10157 C CG1 . VAL C 1 618 ? -17.729 -17.274 27.718 1.00 27.52 ? 926 VAL C CG1 1 ATOM 10158 C CG2 . VAL C 1 618 ? -18.457 -18.049 25.442 1.00 27.87 ? 926 VAL C CG2 1 ATOM 10159 N N . LEU C 1 619 ? -17.737 -14.194 27.806 1.00 12.89 ? 927 LEU C N 1 ATOM 10160 C CA . LEU C 1 619 ? -18.260 -13.408 28.915 1.00 15.38 ? 927 LEU C CA 1 ATOM 10161 C C . LEU C 1 619 ? -18.887 -12.117 28.425 1.00 16.29 ? 927 LEU C C 1 ATOM 10162 O O . LEU C 1 619 ? -19.809 -11.600 29.050 1.00 16.49 ? 927 LEU C O 1 ATOM 10163 C CB . LEU C 1 619 ? -17.157 -13.102 29.926 1.00 14.24 ? 927 LEU C CB 1 ATOM 10164 C CG . LEU C 1 619 ? -16.618 -14.342 30.642 1.00 16.25 ? 927 LEU C CG 1 ATOM 10165 C CD1 . LEU C 1 619 ? -15.405 -13.984 31.468 1.00 16.15 ? 927 LEU C CD1 1 ATOM 10166 C CD2 . LEU C 1 619 ? -17.703 -14.969 31.519 1.00 16.87 ? 927 LEU C CD2 1 ATOM 10167 N N . TRP C 1 620 ? -18.374 -11.576 27.321 1.00 11.86 ? 928 TRP C N 1 ATOM 10168 C CA . TRP C 1 620 ? -18.932 -10.333 26.802 1.00 13.63 ? 928 TRP C CA 1 ATOM 10169 C C . TRP C 1 620 ? -20.356 -10.566 26.301 1.00 13.25 ? 928 TRP C C 1 ATOM 10170 O O . TRP C 1 620 ? -21.205 -9.665 26.340 1.00 17.08 ? 928 TRP C O 1 ATOM 10171 C CB . TRP C 1 620 ? -18.062 -9.722 25.695 1.00 14.05 ? 928 TRP C CB 1 ATOM 10172 C CG . TRP C 1 620 ? -18.571 -8.373 25.271 1.00 13.92 ? 928 TRP C CG 1 ATOM 10173 C CD1 . TRP C 1 620 ? -19.117 -8.037 24.066 1.00 12.99 ? 928 TRP C CD1 1 ATOM 10174 C CD2 . TRP C 1 620 ? -18.622 -7.192 26.080 1.00 12.30 ? 928 TRP C CD2 1 ATOM 10175 N NE1 . TRP C 1 620 ? -19.488 -6.710 24.069 1.00 13.93 ? 928 TRP C NE1 1 ATOM 10176 C CE2 . TRP C 1 620 ? -19.199 -6.170 25.296 1.00 13.62 ? 928 TRP C CE2 1 ATOM 10177 C CE3 . TRP C 1 620 ? -18.226 -6.898 27.388 1.00 13.36 ? 928 TRP C CE3 1 ATOM 10178 C CZ2 . TRP C 1 620 ? -19.394 -4.871 25.780 1.00 13.65 ? 928 TRP C CZ2 1 ATOM 10179 C CZ3 . TRP C 1 620 ? -18.415 -5.605 27.869 1.00 13.47 ? 928 TRP C CZ3 1 ATOM 10180 C CH2 . TRP C 1 620 ? -19.000 -4.609 27.063 1.00 15.42 ? 928 TRP C CH2 1 ATOM 10181 N N . ALA C 1 621 ? -20.621 -11.784 25.845 1.00 14.16 ? 929 ALA C N 1 ATOM 10182 C CA . ALA C 1 621 ? -21.966 -12.140 25.404 1.00 15.63 ? 929 ALA C CA 1 ATOM 10183 C C . ALA C 1 621 ? -22.890 -12.433 26.592 1.00 18.03 ? 929 ALA C C 1 ATOM 10184 O O . ALA C 1 621 ? -24.080 -12.669 26.409 1.00 14.96 ? 929 ALA C O 1 ATOM 10185 C CB . ALA C 1 621 ? -21.912 -13.314 24.461 1.00 17.09 ? 929 ALA C CB 1 ATOM 10186 N N . GLY C 1 622 ? -22.333 -12.427 27.803 1.00 17.10 ? 930 GLY C N 1 ATOM 10187 C CA . GLY C 1 622 ? -23.125 -12.605 29.013 1.00 15.40 ? 930 GLY C CA 1 ATOM 10188 C C . GLY C 1 622 ? -23.307 -14.064 29.396 1.00 15.74 ? 930 GLY C C 1 ATOM 10189 O O . GLY C 1 622 ? -24.200 -14.403 30.167 1.00 16.91 ? 930 GLY C O 1 ATOM 10190 N N . THR C 1 623 ? -22.443 -14.925 28.867 1.00 14.54 ? 931 THR C N 1 ATOM 10191 C CA . THR C 1 623 ? -22.565 -16.368 29.068 1.00 15.18 ? 931 THR C CA 1 ATOM 10192 C C . THR C 1 623 ? -21.698 -16.817 30.236 1.00 16.29 ? 931 THR C C 1 ATOM 10193 O O . THR C 1 623 ? -20.488 -16.617 30.214 1.00 17.51 ? 931 THR C O 1 ATOM 10194 C CB . THR C 1 623 ? -22.041 -17.115 27.831 1.00 19.08 ? 931 THR C CB 1 ATOM 10195 O OG1 . THR C 1 623 ? -22.623 -16.559 26.653 1.00 25.72 ? 931 THR C OG1 1 ATOM 10196 C CG2 . THR C 1 623 ? -22.360 -18.612 27.911 1.00 19.44 ? 931 THR C CG2 1 ATOM 10197 N N . PRO C 1 624 ? -22.307 -17.444 31.249 1.00 15.20 ? 932 PRO C N 1 ATOM 10198 C CA . PRO C 1 624 ? -21.502 -18.002 32.341 1.00 17.91 ? 932 PRO C CA 1 ATOM 10199 C C . PRO C 1 624 ? -20.527 -19.052 31.817 1.00 19.70 ? 932 PRO C C 1 ATOM 10200 O O . PRO C 1 624 ? -20.892 -19.856 30.956 1.00 18.97 ? 932 PRO C O 1 ATOM 10201 C CB . PRO C 1 624 ? -22.551 -18.671 33.242 1.00 14.82 ? 932 PRO C CB 1 ATOM 10202 C CG . PRO C 1 624 ? -23.836 -17.945 32.931 1.00 18.01 ? 932 PRO C CG 1 ATOM 10203 C CD . PRO C 1 624 ? -23.748 -17.672 31.452 1.00 15.84 ? 932 PRO C CD 1 ATOM 10204 N N . MET C 1 625 ? -19.308 -19.047 32.343 1.00 17.06 ? 933 MET C N 1 ATOM 10205 C CA . MET C 1 625 ? -18.287 -19.996 31.930 1.00 18.09 ? 933 MET C CA 1 ATOM 10206 C C . MET C 1 625 ? -17.864 -20.839 33.129 1.00 19.31 ? 933 MET C C 1 ATOM 10207 O O . MET C 1 625 ? -17.500 -20.293 34.164 1.00 19.26 ? 933 MET C O 1 ATOM 10208 C CB . MET C 1 625 ? -17.086 -19.224 31.374 1.00 17.78 ? 933 MET C CB 1 ATOM 10209 C CG . MET C 1 625 ? -15.864 -20.060 31.084 1.00 16.71 ? 933 MET C CG 1 ATOM 10210 S SD . MET C 1 625 ? -14.688 -19.159 30.043 1.00 24.24 ? 933 MET C SD 1 ATOM 10211 C CE . MET C 1 625 ? -14.377 -17.693 31.026 1.00 23.26 ? 933 MET C CE 1 ATOM 10212 N N . VAL C 1 626 ? -17.937 -22.163 33.010 1.00 17.63 ? 934 VAL C N 1 ATOM 10213 C CA . VAL C 1 626 ? -17.479 -23.026 34.096 1.00 17.76 ? 934 VAL C CA 1 ATOM 10214 C C . VAL C 1 626 ? -16.025 -23.400 33.828 1.00 16.15 ? 934 VAL C C 1 ATOM 10215 O O . VAL C 1 626 ? -15.700 -23.829 32.732 1.00 14.61 ? 934 VAL C O 1 ATOM 10216 C CB . VAL C 1 626 ? -18.337 -24.307 34.214 1.00 17.84 ? 934 VAL C CB 1 ATOM 10217 C CG1 . VAL C 1 626 ? -17.870 -25.158 35.388 1.00 20.21 ? 934 VAL C CG1 1 ATOM 10218 C CG2 . VAL C 1 626 ? -19.794 -23.948 34.378 1.00 15.35 ? 934 VAL C CG2 1 ATOM 10219 N N . THR C 1 627 ? -15.150 -23.232 34.814 1.00 16.04 ? 935 THR C N 1 ATOM 10220 C CA . THR C 1 627 ? -13.738 -23.538 34.593 1.00 16.81 ? 935 THR C CA 1 ATOM 10221 C C . THR C 1 627 ? -13.136 -24.326 35.753 1.00 17.38 ? 935 THR C C 1 ATOM 10222 O O . THR C 1 627 ? -13.664 -24.313 36.860 1.00 17.95 ? 935 THR C O 1 ATOM 10223 C CB . THR C 1 627 ? -12.918 -22.246 34.363 1.00 19.82 ? 935 THR C CB 1 ATOM 10224 O OG1 . THR C 1 627 ? -11.588 -22.577 33.933 1.00 19.24 ? 935 THR C OG1 1 ATOM 10225 C CG2 . THR C 1 627 ? -12.875 -21.414 35.648 1.00 21.17 ? 935 THR C CG2 1 ATOM 10226 N N . MET C 1 628 ? -12.045 -25.035 35.483 1.00 19.74 ? 936 MET C N 1 ATOM 10227 C CA . MET C 1 628 ? -11.305 -25.747 36.524 1.00 21.87 ? 936 MET C CA 1 ATOM 10228 C C . MET C 1 628 ? -9.840 -25.356 36.395 1.00 22.94 ? 936 MET C C 1 ATOM 10229 O O . MET C 1 628 ? -9.127 -25.888 35.540 1.00 20.99 ? 936 MET C O 1 ATOM 10230 C CB . MET C 1 628 ? -11.446 -27.260 36.360 1.00 24.06 ? 936 MET C CB 1 ATOM 10231 C CG . MET C 1 628 ? -10.802 -28.066 37.493 1.00 23.32 ? 936 MET C CG 1 ATOM 10232 S SD . MET C 1 628 ? -10.932 -29.858 37.282 1.00 25.94 ? 936 MET C SD 1 ATOM 10233 C CE . MET C 1 628 ? -9.822 -30.123 35.895 1.00 24.68 ? 936 MET C CE 1 ATOM 10234 N N . PRO C 1 629 ? -9.388 -24.403 37.220 1.00 22.33 ? 937 PRO C N 1 ATOM 10235 C CA . PRO C 1 629 ? -8.005 -23.941 37.066 1.00 21.22 ? 937 PRO C CA 1 ATOM 10236 C C . PRO C 1 629 ? -6.987 -25.016 37.442 1.00 22.02 ? 937 PRO C C 1 ATOM 10237 O O . PRO C 1 629 ? -7.182 -25.756 38.409 1.00 21.41 ? 937 PRO C O 1 ATOM 10238 C CB . PRO C 1 629 ? -7.919 -22.743 38.017 1.00 21.36 ? 937 PRO C CB 1 ATOM 10239 C CG . PRO C 1 629 ? -9.033 -22.943 38.996 1.00 21.52 ? 937 PRO C CG 1 ATOM 10240 C CD . PRO C 1 629 ? -10.124 -23.643 38.247 1.00 21.10 ? 937 PRO C CD 1 ATOM 10241 N N . GLY C 1 630 ? -5.916 -25.106 36.664 1.00 17.88 ? 938 GLY C N 1 ATOM 10242 C CA . GLY C 1 630 ? -4.893 -26.110 36.889 1.00 19.04 ? 938 GLY C CA 1 ATOM 10243 C C . GLY C 1 630 ? -3.660 -25.495 37.513 1.00 22.49 ? 938 GLY C C 1 ATOM 10244 O O . GLY C 1 630 ? -3.766 -24.648 38.395 1.00 25.91 ? 938 GLY C O 1 ATOM 10245 N N . GLU C 1 631 ? -2.484 -25.917 37.065 1.00 24.30 ? 939 GLU C N 1 ATOM 10246 C CA . GLU C 1 631 ? -1.256 -25.376 37.631 1.00 31.05 ? 939 GLU C CA 1 ATOM 10247 C C . GLU C 1 631 ? -0.523 -24.426 36.678 1.00 32.78 ? 939 GLU C C 1 ATOM 10248 O O . GLU C 1 631 ? 0.065 -23.434 37.116 1.00 38.67 ? 939 GLU C O 1 ATOM 10249 C CB . GLU C 1 631 ? -0.351 -26.501 38.126 1.00 35.78 ? 939 GLU C CB 1 ATOM 10250 C CG . GLU C 1 631 ? -1.024 -27.376 39.176 1.00 39.70 ? 939 GLU C CG 1 ATOM 10251 C CD . GLU C 1 631 ? -0.097 -28.421 39.760 1.00 44.51 ? 939 GLU C CD 1 ATOM 10252 O OE1 . GLU C 1 631 ? 1.130 -28.188 39.788 1.00 44.46 ? 939 GLU C OE1 1 ATOM 10253 O OE2 . GLU C 1 631 ? -0.602 -29.479 40.190 1.00 47.97 ? 939 GLU C OE2 1 ATOM 10254 N N . THR C 1 632 ? -0.578 -24.706 35.381 1.00 25.90 ? 940 THR C N 1 ATOM 10255 C CA . THR C 1 632 ? 0.071 -23.828 34.411 1.00 22.16 ? 940 THR C CA 1 ATOM 10256 C C . THR C 1 632 ? -0.696 -22.521 34.272 1.00 22.04 ? 940 THR C C 1 ATOM 10257 O O . THR C 1 632 ? -1.911 -22.483 34.473 1.00 20.66 ? 940 THR C O 1 ATOM 10258 C CB . THR C 1 632 ? 0.136 -24.459 33.020 1.00 22.00 ? 940 THR C CB 1 ATOM 10259 O OG1 . THR C 1 632 ? -1.195 -24.601 32.507 1.00 20.39 ? 940 THR C OG1 1 ATOM 10260 C CG2 . THR C 1 632 ? 0.831 -25.818 33.067 1.00 24.85 ? 940 THR C CG2 1 ATOM 10261 N N . LEU C 1 633 ? 0.015 -21.460 33.898 1.00 19.60 ? 941 LEU C N 1 ATOM 10262 C CA . LEU C 1 633 ? -0.615 -20.170 33.634 1.00 17.91 ? 941 LEU C CA 1 ATOM 10263 C C . LEU C 1 633 ? -1.808 -20.333 32.690 1.00 16.59 ? 941 LEU C C 1 ATOM 10264 O O . LEU C 1 633 ? -2.892 -19.801 32.945 1.00 14.98 ? 941 LEU C O 1 ATOM 10265 C CB . LEU C 1 633 ? 0.421 -19.204 33.032 1.00 20.02 ? 941 LEU C CB 1 ATOM 10266 C CG . LEU C 1 633 ? 0.153 -17.695 32.961 1.00 20.14 ? 941 LEU C CG 1 ATOM 10267 C CD1 . LEU C 1 633 ? 1.454 -16.936 32.657 1.00 20.25 ? 941 LEU C CD1 1 ATOM 10268 C CD2 . LEU C 1 633 ? -0.911 -17.338 31.935 1.00 19.09 ? 941 LEU C CD2 1 ATOM 10269 N N . ALA C 1 634 ? -1.607 -21.080 31.606 1.00 16.10 ? 942 ALA C N 1 ATOM 10270 C CA . ALA C 1 634 ? -2.612 -21.184 30.544 1.00 18.26 ? 942 ALA C CA 1 ATOM 10271 C C . ALA C 1 634 ? -3.898 -21.863 31.025 1.00 18.56 ? 942 ALA C C 1 ATOM 10272 O O . ALA C 1 634 ? -4.976 -21.659 30.465 1.00 15.30 ? 942 ALA C O 1 ATOM 10273 C CB . ALA C 1 634 ? -2.028 -21.927 29.335 1.00 17.75 ? 942 ALA C CB 1 ATOM 10274 N N . SER C 1 635 ? -3.770 -22.669 32.070 1.00 16.54 ? 943 SER C N 1 ATOM 10275 C CA . SER C 1 635 ? -4.897 -23.404 32.624 1.00 14.98 ? 943 SER C CA 1 ATOM 10276 C C . SER C 1 635 ? -5.611 -22.621 33.727 1.00 18.21 ? 943 SER C C 1 ATOM 10277 O O . SER C 1 635 ? -6.558 -23.132 34.338 1.00 20.62 ? 943 SER C O 1 ATOM 10278 C CB . SER C 1 635 ? -4.416 -24.741 33.195 1.00 17.01 ? 943 SER C CB 1 ATOM 10279 O OG . SER C 1 635 ? -3.642 -24.542 34.374 1.00 18.47 ? 943 SER C OG 1 ATOM 10280 N N . ARG C 1 636 ? -5.167 -21.391 33.988 1.00 15.75 ? 944 ARG C N 1 ATOM 10281 C CA . ARG C 1 636 ? -5.700 -20.616 35.121 1.00 14.83 ? 944 ARG C CA 1 ATOM 10282 C C . ARG C 1 636 ? -6.304 -19.274 34.720 1.00 16.16 ? 944 ARG C C 1 ATOM 10283 O O . ARG C 1 636 ? -6.866 -18.560 35.560 1.00 15.91 ? 944 ARG C O 1 ATOM 10284 C CB . ARG C 1 636 ? -4.612 -20.381 36.174 1.00 16.86 ? 944 ARG C CB 1 ATOM 10285 C CG . ARG C 1 636 ? -4.151 -21.647 36.898 1.00 18.54 ? 944 ARG C CG 1 ATOM 10286 C CD . ARG C 1 636 ? -3.120 -21.342 37.979 1.00 20.86 ? 944 ARG C CD 1 ATOM 10287 N NE . ARG C 1 636 ? -3.696 -20.595 39.095 1.00 19.69 ? 944 ARG C NE 1 ATOM 10288 C CZ . ARG C 1 636 ? -4.373 -21.153 40.093 1.00 23.01 ? 944 ARG C CZ 1 ATOM 10289 N NH1 . ARG C 1 636 ? -4.562 -22.468 40.115 1.00 23.96 ? 944 ARG C NH1 1 ATOM 10290 N NH2 . ARG C 1 636 ? -4.863 -20.398 41.068 1.00 25.46 ? 944 ARG C NH2 1 ATOM 10291 N N . VAL C 1 637 ? -6.173 -18.924 33.446 1.00 18.10 ? 945 VAL C N 1 ATOM 10292 C CA . VAL C 1 637 ? -6.613 -17.614 32.956 1.00 18.22 ? 945 VAL C CA 1 ATOM 10293 C C . VAL C 1 637 ? -8.118 -17.402 33.125 1.00 17.58 ? 945 VAL C C 1 ATOM 10294 O O . VAL C 1 637 ? -8.562 -16.352 33.604 1.00 12.91 ? 945 VAL C O 1 ATOM 10295 C CB . VAL C 1 637 ? -6.196 -17.401 31.481 1.00 15.90 ? 945 VAL C CB 1 ATOM 10296 C CG1 . VAL C 1 637 ? -6.902 -16.183 30.871 1.00 14.05 ? 945 VAL C CG1 1 ATOM 10297 C CG2 . VAL C 1 637 ? -4.679 -17.245 31.384 1.00 17.06 ? 945 VAL C CG2 1 ATOM 10298 N N . ALA C 1 638 ? -8.903 -18.406 32.747 1.00 16.87 ? 946 ALA C N 1 ATOM 10299 C CA . ALA C 1 638 ? -10.355 -18.303 32.855 1.00 17.16 ? 946 ALA C CA 1 ATOM 10300 C C . ALA C 1 638 ? -10.814 -18.060 34.304 1.00 18.45 ? 946 ALA C C 1 ATOM 10301 O O . ALA C 1 638 ? -11.704 -17.242 34.553 1.00 14.66 ? 946 ALA C O 1 ATOM 10302 C CB . ALA C 1 638 ? -11.021 -19.543 32.275 1.00 17.23 ? 946 ALA C CB 1 ATOM 10303 N N . ALA C 1 639 ? -10.199 -18.753 35.257 1.00 18.60 ? 947 ALA C N 1 ATOM 10304 C CA . ALA C 1 639 ? -10.535 -18.546 36.666 1.00 20.03 ? 947 ALA C CA 1 ATOM 10305 C C . ALA C 1 639 ? -10.213 -17.115 37.086 1.00 18.68 ? 947 ALA C C 1 ATOM 10306 O O . ALA C 1 639 ? -10.927 -16.512 37.888 1.00 17.32 ? 947 ALA C O 1 ATOM 10307 C CB . ALA C 1 639 ? -9.787 -19.542 37.555 1.00 18.70 ? 947 ALA C CB 1 ATOM 10308 N N . SER C 1 640 ? -9.125 -16.577 36.548 1.00 17.44 ? 948 SER C N 1 ATOM 10309 C CA . SER C 1 640 ? -8.733 -15.203 36.846 1.00 18.65 ? 948 SER C CA 1 ATOM 10310 C C . SER C 1 640 ? -9.758 -14.208 36.295 1.00 16.50 ? 948 SER C C 1 ATOM 10311 O O . SER C 1 640 ? -10.131 -13.242 36.973 1.00 16.84 ? 948 SER C O 1 ATOM 10312 C CB . SER C 1 640 ? -7.343 -14.913 36.279 1.00 19.86 ? 948 SER C CB 1 ATOM 10313 O OG . SER C 1 640 ? -6.914 -13.609 36.625 1.00 19.79 ? 948 SER C OG 1 ATOM 10314 N N . GLN C 1 641 ? -10.211 -14.448 35.067 1.00 14.79 ? 949 GLN C N 1 ATOM 10315 C CA . GLN C 1 641 ? -11.252 -13.627 34.461 1.00 14.78 ? 949 GLN C CA 1 ATOM 10316 C C . GLN C 1 641 ? -12.529 -13.670 35.300 1.00 15.14 ? 949 GLN C C 1 ATOM 10317 O O . GLN C 1 641 ? -13.151 -12.641 35.554 1.00 14.47 ? 949 GLN C O 1 ATOM 10318 C CB . GLN C 1 641 ? -11.550 -14.105 33.038 1.00 18.68 ? 949 GLN C CB 1 ATOM 10319 C CG . GLN C 1 641 ? -10.364 -14.017 32.085 1.00 18.82 ? 949 GLN C CG 1 ATOM 10320 C CD . GLN C 1 641 ? -10.620 -14.751 30.784 1.00 18.72 ? 949 GLN C CD 1 ATOM 10321 O OE1 . GLN C 1 641 ? -11.519 -15.592 30.701 1.00 13.77 ? 949 GLN C OE1 1 ATOM 10322 N NE2 . GLN C 1 641 ? -9.819 -14.450 29.763 1.00 17.01 ? 949 GLN C NE2 1 ATOM 10323 N N . LEU C 1 642 ? -12.914 -14.868 35.735 1.00 14.06 ? 950 LEU C N 1 ATOM 10324 C CA . LEU C 1 642 ? -14.132 -15.045 36.516 1.00 14.88 ? 950 LEU C CA 1 ATOM 10325 C C . LEU C 1 642 ? -14.038 -14.424 37.901 1.00 17.39 ? 950 LEU C C 1 ATOM 10326 O O . LEU C 1 642 ? -15.029 -13.930 38.443 1.00 18.05 ? 950 LEU C O 1 ATOM 10327 C CB . LEU C 1 642 ? -14.476 -16.536 36.624 1.00 16.72 ? 950 LEU C CB 1 ATOM 10328 C CG . LEU C 1 642 ? -14.965 -17.103 35.294 1.00 15.54 ? 950 LEU C CG 1 ATOM 10329 C CD1 . LEU C 1 642 ? -15.077 -18.617 35.349 1.00 16.07 ? 950 LEU C CD1 1 ATOM 10330 C CD2 . LEU C 1 642 ? -16.305 -16.488 34.970 1.00 18.32 ? 950 LEU C CD2 1 ATOM 10331 N N . THR C 1 643 ? -12.846 -14.459 38.479 1.00 16.87 ? 951 THR C N 1 ATOM 10332 C CA . THR C 1 643 ? -12.642 -13.849 39.785 1.00 18.54 ? 951 THR C CA 1 ATOM 10333 C C . THR C 1 643 ? -12.799 -12.329 39.702 1.00 20.47 ? 951 THR C C 1 ATOM 10334 O O . THR C 1 643 ? -13.445 -11.707 40.556 1.00 21.69 ? 951 THR C O 1 ATOM 10335 C CB . THR C 1 643 ? -11.274 -14.222 40.362 1.00 19.81 ? 951 THR C CB 1 ATOM 10336 O OG1 . THR C 1 643 ? -11.211 -15.644 40.543 1.00 19.21 ? 951 THR C OG1 1 ATOM 10337 C CG2 . THR C 1 643 ? -11.061 -13.539 41.708 1.00 22.69 ? 951 THR C CG2 1 ATOM 10338 N N . CYS C 1 644 ? -12.216 -11.739 38.665 1.00 19.60 ? 952 CYS C N 1 ATOM 10339 C CA . CYS C 1 644 ? -12.327 -10.300 38.430 1.00 19.20 ? 952 CYS C CA 1 ATOM 10340 C C . CYS C 1 644 ? -13.773 -9.921 38.150 1.00 19.87 ? 952 CYS C C 1 ATOM 10341 O O . CYS C 1 644 ? -14.277 -8.915 38.663 1.00 20.47 ? 952 CYS C O 1 ATOM 10342 C CB . CYS C 1 644 ? -11.443 -9.894 37.250 1.00 19.86 ? 952 CYS C CB 1 ATOM 10343 S SG . CYS C 1 644 ? -11.644 -8.166 36.747 1.00 19.45 ? 952 CYS C SG 1 ATOM 10344 N N . LEU C 1 645 ? -14.440 -10.744 37.344 1.00 15.81 ? 953 LEU C N 1 ATOM 10345 C CA . LEU C 1 645 ? -15.854 -10.560 37.035 1.00 19.26 ? 953 LEU C CA 1 ATOM 10346 C C . LEU C 1 645 ? -16.726 -10.607 38.289 1.00 23.16 ? 953 LEU C C 1 ATOM 10347 O O . LEU C 1 645 ? -17.735 -9.903 38.385 1.00 24.47 ? 953 LEU C O 1 ATOM 10348 C CB . LEU C 1 645 ? -16.321 -11.643 36.054 1.00 17.97 ? 953 LEU C CB 1 ATOM 10349 C CG . LEU C 1 645 ? -17.704 -11.472 35.412 1.00 18.99 ? 953 LEU C CG 1 ATOM 10350 C CD1 . LEU C 1 645 ? -17.693 -10.266 34.491 1.00 15.72 ? 953 LEU C CD1 1 ATOM 10351 C CD2 . LEU C 1 645 ? -18.098 -12.734 34.631 1.00 14.66 ? 953 LEU C CD2 1 ATOM 10352 N N . GLY C 1 646 ? -16.342 -11.456 39.240 1.00 22.78 ? 954 GLY C N 1 ATOM 10353 C CA . GLY C 1 646 ? -17.063 -11.584 40.494 1.00 23.70 ? 954 GLY C CA 1 ATOM 10354 C C . GLY C 1 646 ? -17.924 -12.829 40.546 1.00 26.19 ? 954 GLY C C 1 ATOM 10355 O O . GLY C 1 646 ? -18.920 -12.864 41.260 1.00 31.85 ? 954 GLY C O 1 ATOM 10356 N N . CYS C 1 647 ? -17.534 -13.860 39.801 1.00 23.65 ? 955 CYS C N 1 ATOM 10357 C CA . CYS C 1 647 ? -18.302 -15.099 39.750 1.00 25.17 ? 955 CYS C CA 1 ATOM 10358 C C . CYS C 1 647 ? -17.492 -16.288 40.261 1.00 25.83 ? 955 CYS C C 1 ATOM 10359 O O . CYS C 1 647 ? -17.146 -17.187 39.491 1.00 25.39 ? 955 CYS C O 1 ATOM 10360 C CB . CYS C 1 647 ? -18.768 -15.383 38.318 1.00 25.60 ? 955 CYS C CB 1 ATOM 10361 S SG . CYS C 1 647 ? -20.047 -14.282 37.706 1.00 30.53 ? 955 CYS C SG 1 ATOM 10362 N N . LEU C 1 648 ? -17.199 -16.292 41.557 1.00 23.37 ? 956 LEU C N 1 ATOM 10363 C CA . LEU C 1 648 ? -16.397 -17.357 42.153 1.00 25.58 ? 956 LEU C CA 1 ATOM 10364 C C . LEU C 1 648 ? -17.101 -18.709 42.097 1.00 26.27 ? 956 LEU C C 1 ATOM 10365 O O . LEU C 1 648 ? -16.450 -19.754 42.126 1.00 25.85 ? 956 LEU C O 1 ATOM 10366 C CB . LEU C 1 648 ? -16.056 -17.026 43.611 1.00 28.02 ? 956 LEU C CB 1 ATOM 10367 C CG . LEU C 1 648 ? -15.248 -15.751 43.876 1.00 31.69 ? 956 LEU C CG 1 ATOM 10368 C CD1 . LEU C 1 648 ? -15.039 -15.553 45.372 1.00 34.70 ? 956 LEU C CD1 1 ATOM 10369 C CD2 . LEU C 1 648 ? -13.914 -15.811 43.156 1.00 32.88 ? 956 LEU C CD2 1 ATOM 10370 N N . GLU C 1 649 ? -18.430 -18.687 42.027 1.00 24.68 ? 957 GLU C N 1 ATOM 10371 C CA . GLU C 1 649 ? -19.222 -19.920 42.056 1.00 26.66 ? 957 GLU C CA 1 ATOM 10372 C C . GLU C 1 649 ? -19.053 -20.772 40.796 1.00 22.78 ? 957 GLU C C 1 ATOM 10373 O O . GLU C 1 649 ? -19.543 -21.900 40.731 1.00 23.16 ? 957 GLU C O 1 ATOM 10374 C CB . GLU C 1 649 ? -20.705 -19.599 42.250 1.00 32.09 ? 957 GLU C CB 1 ATOM 10375 C CG . GLU C 1 649 ? -21.311 -18.777 41.114 1.00 36.20 ? 957 GLU C CG 1 ATOM 10376 C CD . GLU C 1 649 ? -21.233 -17.284 41.367 1.00 40.88 ? 957 GLU C CD 1 ATOM 10377 O OE1 . GLU C 1 649 ? -20.138 -16.790 41.717 1.00 39.27 ? 957 GLU C OE1 1 ATOM 10378 O OE2 . GLU C 1 649 ? -22.278 -16.608 41.236 1.00 43.62 ? 957 GLU C OE2 1 ATOM 10379 N N . LEU C 1 650 ? -18.362 -20.228 39.801 1.00 19.20 ? 958 LEU C N 1 ATOM 10380 C CA . LEU C 1 650 ? -18.181 -20.907 38.523 1.00 17.29 ? 958 LEU C CA 1 ATOM 10381 C C . LEU C 1 650 ? -16.814 -21.553 38.417 1.00 20.42 ? 958 LEU C C 1 ATOM 10382 O O . LEU C 1 650 ? -16.474 -22.122 37.385 1.00 18.75 ? 958 LEU C O 1 ATOM 10383 C CB . LEU C 1 650 ? -18.379 -19.920 37.367 1.00 16.52 ? 958 LEU C CB 1 ATOM 10384 C CG . LEU C 1 650 ? -19.830 -19.476 37.176 1.00 20.59 ? 958 LEU C CG 1 ATOM 10385 C CD1 . LEU C 1 650 ? -19.937 -18.304 36.228 1.00 15.04 ? 958 LEU C CD1 1 ATOM 10386 C CD2 . LEU C 1 650 ? -20.658 -20.651 36.699 1.00 19.46 ? 958 LEU C CD2 1 ATOM 10387 N N . ILE C 1 651 ? -16.036 -21.469 39.493 1.00 21.25 ? 959 ILE C N 1 ATOM 10388 C CA . ILE C 1 651 ? -14.663 -21.971 39.501 1.00 18.40 ? 959 ILE C CA 1 ATOM 10389 C C . ILE C 1 651 ? -14.609 -23.280 40.279 1.00 21.12 ? 959 ILE C C 1 ATOM 10390 O O . ILE C 1 651 ? -14.897 -23.308 41.477 1.00 22.49 ? 959 ILE C O 1 ATOM 10391 C CB . ILE C 1 651 ? -13.710 -20.943 40.162 1.00 18.07 ? 959 ILE C CB 1 ATOM 10392 C CG1 . ILE C 1 651 ? -13.828 -19.585 39.468 1.00 15.69 ? 959 ILE C CG1 1 ATOM 10393 C CG2 . ILE C 1 651 ? -12.258 -21.436 40.128 1.00 19.84 ? 959 ILE C CG2 1 ATOM 10394 C CD1 . ILE C 1 651 ? -13.056 -18.462 40.160 1.00 16.72 ? 959 ILE C CD1 1 ATOM 10395 N N . ALA C 1 652 ? -14.255 -24.368 39.596 1.00 18.05 ? 960 ALA C N 1 ATOM 10396 C CA . ALA C 1 652 ? -14.284 -25.691 40.210 1.00 17.88 ? 960 ALA C CA 1 ATOM 10397 C C . ALA C 1 652 ? -12.914 -26.080 40.758 1.00 18.89 ? 960 ALA C C 1 ATOM 10398 O O . ALA C 1 652 ? -11.892 -25.822 40.123 1.00 21.35 ? 960 ALA C O 1 ATOM 10399 C CB . ALA C 1 652 ? -14.742 -26.719 39.199 1.00 18.03 ? 960 ALA C CB 1 ATOM 10400 N N . LYS C 1 653 ? -12.895 -26.738 41.914 1.00 19.23 ? 961 LYS C N 1 ATOM 10401 C CA . LYS C 1 653 ? -11.632 -27.141 42.527 1.00 24.18 ? 961 LYS C CA 1 ATOM 10402 C C . LYS C 1 653 ? -11.167 -28.510 42.050 1.00 23.66 ? 961 LYS C C 1 ATOM 10403 O O . LYS C 1 653 ? -10.013 -28.884 42.255 1.00 25.35 ? 961 LYS C O 1 ATOM 10404 C CB . LYS C 1 653 ? -11.734 -27.127 44.058 1.00 30.60 ? 961 LYS C CB 1 ATOM 10405 C CG . LYS C 1 653 ? -11.898 -25.733 44.655 1.00 38.74 ? 961 LYS C CG 1 ATOM 10406 C CD . LYS C 1 653 ? -11.932 -25.778 46.176 1.00 46.55 ? 961 LYS C CD 1 ATOM 10407 C CE . LYS C 1 653 ? -12.370 -24.440 46.766 1.00 50.61 ? 961 LYS C CE 1 ATOM 10408 N NZ . LYS C 1 653 ? -13.780 -24.101 46.410 1.00 50.95 ? 961 LYS C NZ 1 ATOM 10409 N N . ASN C 1 654 ? -12.073 -29.258 41.430 1.00 23.71 ? 962 ASN C N 1 ATOM 10410 C CA . ASN C 1 654 ? -11.759 -30.577 40.879 1.00 23.91 ? 962 ASN C CA 1 ATOM 10411 C C . ASN C 1 654 ? -12.810 -30.981 39.846 1.00 22.69 ? 962 ASN C C 1 ATOM 10412 O O . ASN C 1 654 ? -13.786 -30.262 39.647 1.00 23.13 ? 962 ASN C O 1 ATOM 10413 C CB . ASN C 1 654 ? -11.626 -31.634 41.984 1.00 25.59 ? 962 ASN C CB 1 ATOM 10414 C CG . ASN C 1 654 ? -12.882 -31.761 42.832 1.00 28.84 ? 962 ASN C CG 1 ATOM 10415 O OD1 . ASN C 1 654 ? -14.001 -31.803 42.317 1.00 27.62 ? 962 ASN C OD1 1 ATOM 10416 N ND2 . ASN C 1 654 ? -12.698 -31.818 44.144 1.00 34.20 ? 962 ASN C ND2 1 ATOM 10417 N N . ARG C 1 655 ? -12.611 -32.121 39.190 1.00 20.80 ? 963 ARG C N 1 ATOM 10418 C CA . ARG C 1 655 ? -13.487 -32.528 38.087 1.00 22.08 ? 963 ARG C CA 1 ATOM 10419 C C . ARG C 1 655 ? -14.936 -32.780 38.503 1.00 21.91 ? 963 ARG C C 1 ATOM 10420 O O . ARG C 1 655 ? -15.872 -32.377 37.805 1.00 21.51 ? 963 ARG C O 1 ATOM 10421 C CB . ARG C 1 655 ? -12.906 -33.748 37.365 1.00 26.13 ? 963 ARG C CB 1 ATOM 10422 C CG . ARG C 1 655 ? -11.642 -33.413 36.574 1.00 29.88 ? 963 ARG C CG 1 ATOM 10423 C CD . ARG C 1 655 ? -11.047 -34.641 35.907 1.00 37.79 ? 963 ARG C CD 1 ATOM 10424 N NE . ARG C 1 655 ? -10.915 -35.749 36.847 1.00 46.97 ? 963 ARG C NE 1 ATOM 10425 C CZ . ARG C 1 655 ? -9.902 -35.894 37.698 1.00 54.85 ? 963 ARG C CZ 1 ATOM 10426 N NH1 . ARG C 1 655 ? -8.925 -34.996 37.735 1.00 56.51 ? 963 ARG C NH1 1 ATOM 10427 N NH2 . ARG C 1 655 ? -9.870 -36.937 38.518 1.00 58.00 ? 963 ARG C NH2 1 ATOM 10428 N N . GLN C 1 656 ? -15.119 -33.450 39.633 1.00 22.64 ? 964 GLN C N 1 ATOM 10429 C CA . GLN C 1 656 ? -16.463 -33.664 40.155 1.00 25.26 ? 964 GLN C CA 1 ATOM 10430 C C . GLN C 1 656 ? -17.198 -32.344 40.381 1.00 23.04 ? 964 GLN C C 1 ATOM 10431 O O . GLN C 1 656 ? -18.362 -32.220 40.027 1.00 21.56 ? 964 GLN C O 1 ATOM 10432 C CB . GLN C 1 656 ? -16.437 -34.484 41.448 1.00 28.34 ? 964 GLN C CB 1 ATOM 10433 C CG . GLN C 1 656 ? -17.828 -34.831 41.956 1.00 33.66 ? 964 GLN C CG 1 ATOM 10434 C CD . GLN C 1 656 ? -18.636 -35.608 40.929 1.00 37.83 ? 964 GLN C CD 1 ATOM 10435 O OE1 . GLN C 1 656 ? -18.313 -36.750 40.606 1.00 38.68 ? 964 GLN C OE1 1 ATOM 10436 N NE2 . GLN C 1 656 ? -19.686 -34.983 40.401 1.00 38.63 ? 964 GLN C NE2 1 ATOM 10437 N N . GLU C 1 657 ? -16.515 -31.355 40.954 1.00 24.32 ? 965 GLU C N 1 ATOM 10438 C CA . GLU C 1 657 ? -17.138 -30.053 41.165 1.00 24.88 ? 965 GLU C CA 1 ATOM 10439 C C . GLU C 1 657 ? -17.503 -29.364 39.847 1.00 20.89 ? 965 GLU C C 1 ATOM 10440 O O . GLU C 1 657 ? -18.542 -28.704 39.750 1.00 16.66 ? 965 GLU C O 1 ATOM 10441 C CB . GLU C 1 657 ? -16.257 -29.137 42.016 1.00 30.85 ? 965 GLU C CB 1 ATOM 10442 C CG . GLU C 1 657 ? -16.923 -27.804 42.318 1.00 35.84 ? 965 GLU C CG 1 ATOM 10443 C CD . GLU C 1 657 ? -16.308 -27.068 43.492 1.00 37.92 ? 965 GLU C CD 1 ATOM 10444 O OE1 . GLU C 1 657 ? -15.106 -26.744 43.430 1.00 30.95 ? 965 GLU C OE1 1 ATOM 10445 O OE2 . GLU C 1 657 ? -17.040 -26.806 44.474 1.00 43.82 ? 965 GLU C OE2 1 ATOM 10446 N N . TYR C 1 658 ? -16.640 -29.518 38.842 1.00 18.11 ? 966 TYR C N 1 ATOM 10447 C CA . TYR C 1 658 ? -16.877 -28.958 37.510 1.00 17.00 ? 966 TYR C CA 1 ATOM 10448 C C . TYR C 1 658 ? -18.140 -29.559 36.919 1.00 15.92 ? 966 TYR C C 1 ATOM 10449 O O . TYR C 1 658 ? -18.978 -28.842 36.385 1.00 16.74 ? 966 TYR C O 1 ATOM 10450 C CB . TYR C 1 658 ? -15.666 -29.242 36.621 1.00 17.32 ? 966 TYR C CB 1 ATOM 10451 C CG . TYR C 1 658 ? -15.691 -28.721 35.196 1.00 15.88 ? 966 TYR C CG 1 ATOM 10452 C CD1 . TYR C 1 658 ? -14.895 -27.642 34.817 1.00 15.04 ? 966 TYR C CD1 1 ATOM 10453 C CD2 . TYR C 1 658 ? -16.452 -29.345 34.217 1.00 17.57 ? 966 TYR C CD2 1 ATOM 10454 C CE1 . TYR C 1 658 ? -14.875 -27.191 33.497 1.00 16.19 ? 966 TYR C CE1 1 ATOM 10455 C CE2 . TYR C 1 658 ? -16.439 -28.901 32.902 1.00 16.92 ? 966 TYR C CE2 1 ATOM 10456 C CZ . TYR C 1 658 ? -15.651 -27.829 32.548 1.00 17.23 ? 966 TYR C CZ 1 ATOM 10457 O OH . TYR C 1 658 ? -15.646 -27.394 31.244 1.00 14.66 ? 966 TYR C OH 1 ATOM 10458 N N . GLU C 1 659 ? -18.281 -30.874 37.017 1.00 16.13 ? 967 GLU C N 1 ATOM 10459 C CA . GLU C 1 659 ? -19.494 -31.527 36.532 1.00 19.00 ? 967 GLU C CA 1 ATOM 10460 C C . GLU C 1 659 ? -20.724 -31.047 37.306 1.00 18.82 ? 967 GLU C C 1 ATOM 10461 O O . GLU C 1 659 ? -21.753 -30.712 36.712 1.00 20.32 ? 967 GLU C O 1 ATOM 10462 C CB . GLU C 1 659 ? -19.364 -33.053 36.623 1.00 22.63 ? 967 GLU C CB 1 ATOM 10463 C CG . GLU C 1 659 ? -18.319 -33.627 35.667 1.00 26.82 ? 967 GLU C CG 1 ATOM 10464 C CD . GLU C 1 659 ? -18.054 -35.111 35.888 1.00 29.38 ? 967 GLU C CD 1 ATOM 10465 O OE1 . GLU C 1 659 ? -18.868 -35.770 36.587 1.00 24.63 ? 967 GLU C OE1 1 ATOM 10466 O OE2 . GLU C 1 659 ? -17.032 -35.609 35.352 1.00 28.82 ? 967 GLU C OE2 1 ATOM 10467 N N . ASP C 1 660 ? -20.611 -31.008 38.628 1.00 19.23 ? 968 ASP C N 1 ATOM 10468 C CA . ASP C 1 660 ? -21.734 -30.613 39.478 1.00 20.66 ? 968 ASP C CA 1 ATOM 10469 C C . ASP C 1 660 ? -22.195 -29.180 39.200 1.00 22.23 ? 968 ASP C C 1 ATOM 10470 O O . ASP C 1 660 ? -23.400 -28.914 39.138 1.00 20.42 ? 968 ASP C O 1 ATOM 10471 C CB . ASP C 1 660 ? -21.387 -30.782 40.956 1.00 22.25 ? 968 ASP C CB 1 ATOM 10472 C CG . ASP C 1 660 ? -21.341 -32.242 41.385 1.00 28.69 ? 968 ASP C CG 1 ATOM 10473 O OD1 . ASP C 1 660 ? -21.909 -33.100 40.669 1.00 29.76 ? 968 ASP C OD1 1 ATOM 10474 O OD2 . ASP C 1 660 ? -20.740 -32.529 42.441 1.00 26.78 ? 968 ASP C OD2 1 ATOM 10475 N N . ILE C 1 661 ? -21.242 -28.263 39.031 1.00 21.27 ? 969 ILE C N 1 ATOM 10476 C CA . ILE C 1 661 ? -21.577 -26.877 38.707 1.00 21.31 ? 969 ILE C CA 1 ATOM 10477 C C . ILE C 1 661 ? -22.284 -26.794 37.362 1.00 19.53 ? 969 ILE C C 1 ATOM 10478 O O . ILE C 1 661 ? -23.364 -26.220 37.249 1.00 17.11 ? 969 ILE C O 1 ATOM 10479 C CB . ILE C 1 661 ? -20.333 -25.971 38.660 1.00 20.88 ? 969 ILE C CB 1 ATOM 10480 C CG1 . ILE C 1 661 ? -19.755 -25.778 40.067 1.00 24.15 ? 969 ILE C CG1 1 ATOM 10481 C CG2 . ILE C 1 661 ? -20.695 -24.614 38.048 1.00 20.96 ? 969 ILE C CG2 1 ATOM 10482 C CD1 . ILE C 1 661 ? -18.364 -25.168 40.084 1.00 22.61 ? 969 ILE C CD1 1 ATOM 10483 N N . ALA C 1 662 ? -21.673 -27.391 36.343 1.00 16.65 ? 970 ALA C N 1 ATOM 10484 C CA . ALA C 1 662 ? -22.265 -27.405 35.011 1.00 18.57 ? 970 ALA C CA 1 ATOM 10485 C C . ALA C 1 662 ? -23.659 -28.048 34.986 1.00 16.52 ? 970 ALA C C 1 ATOM 10486 O O . ALA C 1 662 ? -24.550 -27.582 34.275 1.00 19.19 ? 970 ALA C O 1 ATOM 10487 C CB . ALA C 1 662 ? -21.334 -28.113 34.019 1.00 14.14 ? 970 ALA C CB 1 ATOM 10488 N N . VAL C 1 663 ? -23.843 -29.115 35.749 1.00 15.89 ? 971 VAL C N 1 ATOM 10489 C CA . VAL C 1 663 ? -25.144 -29.792 35.796 1.00 16.71 ? 971 VAL C CA 1 ATOM 10490 C C . VAL C 1 663 ? -26.178 -28.938 36.535 1.00 18.00 ? 971 VAL C C 1 ATOM 10491 O O . VAL C 1 663 ? -27.335 -28.852 36.115 1.00 18.58 ? 971 VAL C O 1 ATOM 10492 C CB . VAL C 1 663 ? -25.050 -31.214 36.424 1.00 22.23 ? 971 VAL C CB 1 ATOM 10493 C CG1 . VAL C 1 663 ? -26.428 -31.790 36.663 1.00 20.62 ? 971 VAL C CG1 1 ATOM 10494 C CG2 . VAL C 1 663 ? -24.274 -32.148 35.504 1.00 19.35 ? 971 VAL C CG2 1 ATOM 10495 N N . LYS C 1 664 ? -25.756 -28.301 37.625 1.00 20.87 ? 972 LYS C N 1 ATOM 10496 C CA . LYS C 1 664 ? -26.632 -27.389 38.363 1.00 19.91 ? 972 LYS C CA 1 ATOM 10497 C C . LYS C 1 664 ? -27.126 -26.270 37.448 1.00 20.70 ? 972 LYS C C 1 ATOM 10498 O O . LYS C 1 664 ? -28.307 -25.929 37.450 1.00 20.17 ? 972 LYS C O 1 ATOM 10499 C CB . LYS C 1 664 ? -25.911 -26.777 39.570 1.00 19.40 ? 972 LYS C CB 1 ATOM 10500 C CG . LYS C 1 664 ? -26.800 -25.848 40.413 1.00 20.23 ? 972 LYS C CG 1 ATOM 10501 C CD . LYS C 1 664 ? -26.113 -25.416 41.704 1.00 21.42 ? 972 LYS C CD 1 ATOM 10502 C CE . LYS C 1 664 ? -27.017 -24.515 42.539 1.00 26.43 ? 972 LYS C CE 1 ATOM 10503 N NZ . LYS C 1 664 ? -26.322 -23.959 43.740 1.00 26.02 ? 972 LYS C NZ 1 ATOM 10504 N N . LEU C 1 665 ? -26.216 -25.708 36.658 1.00 18.03 ? 973 LEU C N 1 ATOM 10505 C CA . LEU C 1 665 ? -26.588 -24.627 35.747 1.00 17.87 ? 973 LEU C CA 1 ATOM 10506 C C . LEU C 1 665 ? -27.568 -25.103 34.681 1.00 20.51 ? 973 LEU C C 1 ATOM 10507 O O . LEU C 1 665 ? -28.453 -24.364 34.261 1.00 22.47 ? 973 LEU C O 1 ATOM 10508 C CB . LEU C 1 665 ? -25.346 -24.018 35.100 1.00 15.20 ? 973 LEU C CB 1 ATOM 10509 C CG . LEU C 1 665 ? -24.502 -23.187 36.067 1.00 19.31 ? 973 LEU C CG 1 ATOM 10510 C CD1 . LEU C 1 665 ? -23.119 -22.926 35.477 1.00 15.81 ? 973 LEU C CD1 1 ATOM 10511 C CD2 . LEU C 1 665 ? -25.220 -21.868 36.375 1.00 21.21 ? 973 LEU C CD2 1 ATOM 10512 N N . GLY C 1 666 ? -27.423 -26.347 34.256 1.00 15.27 ? 974 GLY C N 1 ATOM 10513 C CA . GLY C 1 666 ? -28.305 -26.866 33.229 1.00 17.31 ? 974 GLY C CA 1 ATOM 10514 C C . GLY C 1 666 ? -29.638 -27.421 33.707 1.00 19.83 ? 974 GLY C C 1 ATOM 10515 O O . GLY C 1 666 ? -30.474 -27.793 32.886 1.00 20.36 ? 974 GLY C O 1 ATOM 10516 N N . THR C 1 667 ? -29.854 -27.481 35.018 1.00 18.07 ? 975 THR C N 1 ATOM 10517 C CA . THR C 1 667 ? -31.074 -28.100 35.536 1.00 19.39 ? 975 THR C CA 1 ATOM 10518 C C . THR C 1 667 ? -31.830 -27.211 36.520 1.00 23.38 ? 975 THR C C 1 ATOM 10519 O O . THR C 1 667 ? -33.046 -27.260 36.587 1.00 20.23 ? 975 THR C O 1 ATOM 10520 C CB . THR C 1 667 ? -30.790 -29.455 36.227 1.00 20.83 ? 975 THR C CB 1 ATOM 10521 O OG1 . THR C 1 667 ? -29.855 -29.260 37.292 1.00 20.29 ? 975 THR C OG1 1 ATOM 10522 C CG2 . THR C 1 667 ? -30.226 -30.480 35.232 1.00 21.04 ? 975 THR C CG2 1 ATOM 10523 N N . ASP C 1 668 ? -31.104 -26.418 37.299 1.00 21.68 ? 976 ASP C N 1 ATOM 10524 C CA . ASP C 1 668 ? -31.741 -25.488 38.225 1.00 18.87 ? 976 ASP C CA 1 ATOM 10525 C C . ASP C 1 668 ? -31.943 -24.194 37.441 1.00 21.88 ? 976 ASP C C 1 ATOM 10526 O O . ASP C 1 668 ? -31.068 -23.329 37.429 1.00 20.04 ? 976 ASP C O 1 ATOM 10527 C CB . ASP C 1 668 ? -30.816 -25.274 39.420 1.00 23.32 ? 976 ASP C CB 1 ATOM 10528 C CG . ASP C 1 668 ? -31.431 -24.412 40.515 1.00 23.60 ? 976 ASP C CG 1 ATOM 10529 O OD1 . ASP C 1 668 ? -32.407 -23.672 40.264 1.00 24.22 ? 976 ASP C OD1 1 ATOM 10530 O OD2 . ASP C 1 668 ? -30.903 -24.467 41.638 1.00 21.06 ? 976 ASP C OD2 1 ATOM 10531 N N . LEU C 1 669 ? -33.083 -24.067 36.770 1.00 18.80 ? 977 LEU C N 1 ATOM 10532 C CA . LEU C 1 669 ? -33.265 -22.954 35.836 1.00 20.40 ? 977 LEU C CA 1 ATOM 10533 C C . LEU C 1 669 ? -33.327 -21.573 36.508 1.00 17.48 ? 977 LEU C C 1 ATOM 10534 O O . LEU C 1 669 ? -32.947 -20.567 35.901 1.00 17.78 ? 977 LEU C O 1 ATOM 10535 C CB . LEU C 1 669 ? -34.473 -23.194 34.925 1.00 24.12 ? 977 LEU C CB 1 ATOM 10536 C CG . LEU C 1 669 ? -34.415 -24.478 34.086 1.00 26.60 ? 977 LEU C CG 1 ATOM 10537 C CD1 . LEU C 1 669 ? -35.619 -24.574 33.156 1.00 27.50 ? 977 LEU C CD1 1 ATOM 10538 C CD2 . LEU C 1 669 ? -33.116 -24.576 33.294 1.00 27.29 ? 977 LEU C CD2 1 ATOM 10539 N N . GLU C 1 670 ? -33.804 -21.512 37.747 1.00 18.36 ? 978 GLU C N 1 ATOM 10540 C CA . GLU C 1 670 ? -33.784 -20.246 38.470 1.00 20.79 ? 978 GLU C CA 1 ATOM 10541 C C . GLU C 1 670 ? -32.344 -19.845 38.790 1.00 20.90 ? 978 GLU C C 1 ATOM 10542 O O . GLU C 1 670 ? -31.992 -18.672 38.738 1.00 20.08 ? 978 GLU C O 1 ATOM 10543 C CB . GLU C 1 670 ? -34.627 -20.309 39.739 1.00 24.74 ? 978 GLU C CB 1 ATOM 10544 C CG . GLU C 1 670 ? -36.114 -20.418 39.460 1.00 28.93 ? 978 GLU C CG 1 ATOM 10545 C CD . GLU C 1 670 ? -36.641 -19.253 38.644 1.00 34.30 ? 978 GLU C CD 1 ATOM 10546 O OE1 . GLU C 1 670 ? -36.634 -18.121 39.162 1.00 37.70 ? 978 GLU C OE1 1 ATOM 10547 O OE2 . GLU C 1 670 ? -37.048 -19.465 37.480 1.00 34.65 ? 978 GLU C OE2 1 ATOM 10548 N N . TYR C 1 671 ? -31.518 -20.831 39.117 1.00 17.63 ? 979 TYR C N 1 ATOM 10549 C CA . TYR C 1 671 ? -30.112 -20.583 39.374 1.00 18.58 ? 979 TYR C CA 1 ATOM 10550 C C . TYR C 1 671 ? -29.452 -20.059 38.111 1.00 17.57 ? 979 TYR C C 1 ATOM 10551 O O . TYR C 1 671 ? -28.723 -19.059 38.157 1.00 18.59 ? 979 TYR C O 1 ATOM 10552 C CB . TYR C 1 671 ? -29.411 -21.857 39.862 1.00 19.57 ? 979 TYR C CB 1 ATOM 10553 C CG . TYR C 1 671 ? -27.965 -21.633 40.264 1.00 21.27 ? 979 TYR C CG 1 ATOM 10554 C CD1 . TYR C 1 671 ? -27.647 -20.849 41.373 1.00 24.62 ? 979 TYR C CD1 1 ATOM 10555 C CD2 . TYR C 1 671 ? -26.924 -22.185 39.530 1.00 22.82 ? 979 TYR C CD2 1 ATOM 10556 C CE1 . TYR C 1 671 ? -26.330 -20.626 41.747 1.00 24.68 ? 979 TYR C CE1 1 ATOM 10557 C CE2 . TYR C 1 671 ? -25.592 -21.966 39.897 1.00 24.16 ? 979 TYR C CE2 1 ATOM 10558 C CZ . TYR C 1 671 ? -25.304 -21.190 41.008 1.00 25.84 ? 979 TYR C CZ 1 ATOM 10559 O OH . TYR C 1 671 ? -23.994 -20.966 41.385 1.00 24.48 ? 979 TYR C OH 1 ATOM 10560 N N . LEU C 1 672 ? -29.737 -20.714 36.984 1.00 16.83 ? 980 LEU C N 1 ATOM 10561 C CA . LEU C 1 672 ? -29.190 -20.308 35.685 1.00 16.59 ? 980 LEU C CA 1 ATOM 10562 C C . LEU C 1 672 ? -29.509 -18.841 35.404 1.00 14.20 ? 980 LEU C C 1 ATOM 10563 O O . LEU C 1 672 ? -28.643 -18.078 34.982 1.00 16.70 ? 980 LEU C O 1 ATOM 10564 C CB . LEU C 1 672 ? -29.736 -21.198 34.553 1.00 16.60 ? 980 LEU C CB 1 ATOM 10565 C CG . LEU C 1 672 ? -29.248 -20.869 33.137 1.00 20.16 ? 980 LEU C CG 1 ATOM 10566 C CD1 . LEU C 1 672 ? -27.727 -20.967 33.038 1.00 16.66 ? 980 LEU C CD1 1 ATOM 10567 C CD2 . LEU C 1 672 ? -29.904 -21.756 32.092 1.00 20.24 ? 980 LEU C CD2 1 ATOM 10568 N N . LYS C 1 673 ? -30.746 -18.444 35.659 1.00 16.01 ? 981 LYS C N 1 ATOM 10569 C CA . LYS C 1 673 ? -31.142 -17.061 35.418 1.00 18.66 ? 981 LYS C CA 1 ATOM 10570 C C . LYS C 1 673 ? -30.354 -16.078 36.280 1.00 18.50 ? 981 LYS C C 1 ATOM 10571 O O . LYS C 1 673 ? -29.902 -15.035 35.790 1.00 17.93 ? 981 LYS C O 1 ATOM 10572 C CB . LYS C 1 673 ? -32.640 -16.875 35.640 1.00 24.32 ? 981 LYS C CB 1 ATOM 10573 C CG . LYS C 1 673 ? -33.088 -15.435 35.492 1.00 31.06 ? 981 LYS C CG 1 ATOM 10574 C CD . LYS C 1 673 ? -34.597 -15.304 35.633 1.00 40.59 ? 981 LYS C CD 1 ATOM 10575 C CE . LYS C 1 673 ? -35.324 -16.199 34.637 1.00 45.47 ? 981 LYS C CE 1 ATOM 10576 N NZ . LYS C 1 673 ? -36.794 -15.964 34.681 1.00 52.06 ? 981 LYS C NZ 1 ATOM 10577 N N . LYS C 1 674 ? -30.196 -16.413 37.559 1.00 18.44 ? 982 LYS C N 1 ATOM 10578 C CA . LYS C 1 674 ? -29.435 -15.582 38.485 1.00 20.94 ? 982 LYS C CA 1 ATOM 10579 C C . LYS C 1 674 ? -27.999 -15.375 38.006 1.00 20.65 ? 982 LYS C C 1 ATOM 10580 O O . LYS C 1 674 ? -27.518 -14.242 37.933 1.00 18.44 ? 982 LYS C O 1 ATOM 10581 C CB . LYS C 1 674 ? -29.431 -16.200 39.880 1.00 24.27 ? 982 LYS C CB 1 ATOM 10582 C CG . LYS C 1 674 ? -28.540 -15.473 40.879 1.00 30.89 ? 982 LYS C CG 1 ATOM 10583 C CD . LYS C 1 674 ? -28.504 -16.201 42.218 1.00 37.72 ? 982 LYS C CD 1 ATOM 10584 C CE . LYS C 1 674 ? -27.537 -15.534 43.184 1.00 44.70 ? 982 LYS C CE 1 ATOM 10585 N NZ . LYS C 1 674 ? -27.438 -16.270 44.474 1.00 50.27 ? 982 LYS C NZ 1 ATOM 10586 N N . VAL C 1 675 ? -27.319 -16.471 37.679 1.00 19.05 ? 983 VAL C N 1 ATOM 10587 C CA . VAL C 1 675 ? -25.936 -16.400 37.201 1.00 20.48 ? 983 VAL C CA 1 ATOM 10588 C C . VAL C 1 675 ? -25.791 -15.694 35.841 1.00 20.52 ? 983 VAL C C 1 ATOM 10589 O O . VAL C 1 675 ? -24.886 -14.868 35.650 1.00 18.43 ? 983 VAL C O 1 ATOM 10590 C CB . VAL C 1 675 ? -25.280 -17.800 37.168 1.00 22.29 ? 983 VAL C CB 1 ATOM 10591 C CG1 . VAL C 1 675 ? -23.852 -17.716 36.657 1.00 22.47 ? 983 VAL C CG1 1 ATOM 10592 C CG2 . VAL C 1 675 ? -25.320 -18.431 38.555 1.00 26.15 ? 983 VAL C CG2 1 ATOM 10593 N N . ARG C 1 676 ? -26.669 -16.006 34.891 1.00 17.87 ? 984 ARG C N 1 ATOM 10594 C CA . ARG C 1 676 ? -26.630 -15.293 33.616 1.00 16.80 ? 984 ARG C CA 1 ATOM 10595 C C . ARG C 1 676 ? -26.870 -13.805 33.827 1.00 20.94 ? 984 ARG C C 1 ATOM 10596 O O . ARG C 1 676 ? -26.260 -12.979 33.152 1.00 20.72 ? 984 ARG C O 1 ATOM 10597 C CB . ARG C 1 676 ? -27.634 -15.854 32.619 1.00 18.41 ? 984 ARG C CB 1 ATOM 10598 C CG . ARG C 1 676 ? -27.279 -17.248 32.127 1.00 16.95 ? 984 ARG C CG 1 ATOM 10599 C CD . ARG C 1 676 ? -28.296 -17.735 31.123 1.00 16.90 ? 984 ARG C CD 1 ATOM 10600 N NE . ARG C 1 676 ? -28.417 -16.828 29.981 1.00 15.78 ? 984 ARG C NE 1 ATOM 10601 C CZ . ARG C 1 676 ? -27.557 -16.763 28.976 1.00 14.30 ? 984 ARG C CZ 1 ATOM 10602 N NH1 . ARG C 1 676 ? -26.475 -17.527 28.969 1.00 16.05 ? 984 ARG C NH1 1 ATOM 10603 N NH2 . ARG C 1 676 ? -27.774 -15.914 27.980 1.00 17.55 ? 984 ARG C NH2 1 ATOM 10604 N N . GLY C 1 677 ? -27.750 -13.469 34.767 1.00 22.09 ? 985 GLY C N 1 ATOM 10605 C CA . GLY C 1 677 ? -28.012 -12.079 35.096 1.00 22.89 ? 985 GLY C CA 1 ATOM 10606 C C . GLY C 1 677 ? -26.768 -11.442 35.703 1.00 21.70 ? 985 GLY C C 1 ATOM 10607 O O . GLY C 1 677 ? -26.422 -10.307 35.400 1.00 19.06 ? 985 GLY C O 1 ATOM 10608 N N . LYS C 1 678 ? -26.094 -12.197 36.559 1.00 17.06 ? 986 LYS C N 1 ATOM 10609 C CA . LYS C 1 678 ? -24.872 -11.746 37.205 1.00 22.30 ? 986 LYS C CA 1 ATOM 10610 C C . LYS C 1 678 ? -23.774 -11.453 36.181 1.00 20.96 ? 986 LYS C C 1 ATOM 10611 O O . LYS C 1 678 ? -23.151 -10.392 36.207 1.00 18.84 ? 986 LYS C O 1 ATOM 10612 C CB . LYS C 1 678 ? -24.411 -12.795 38.227 1.00 26.77 ? 986 LYS C CB 1 ATOM 10613 C CG . LYS C 1 678 ? -23.295 -12.348 39.137 1.00 31.24 ? 986 LYS C CG 1 ATOM 10614 C CD . LYS C 1 678 ? -23.075 -13.342 40.280 1.00 35.39 ? 986 LYS C CD 1 ATOM 10615 C CE . LYS C 1 678 ? -22.027 -12.835 41.258 1.00 39.75 ? 986 LYS C CE 1 ATOM 10616 N NZ . LYS C 1 678 ? -21.695 -13.822 42.335 1.00 43.45 ? 986 LYS C NZ 1 ATOM 10617 N N . VAL C 1 679 ? -23.549 -12.386 35.266 1.00 17.22 ? 987 VAL C N 1 ATOM 10618 C CA . VAL C 1 679 ? -22.554 -12.183 34.223 1.00 13.92 ? 987 VAL C CA 1 ATOM 10619 C C . VAL C 1 679 ? -22.909 -10.981 33.354 1.00 16.24 ? 987 VAL C C 1 ATOM 10620 O O . VAL C 1 679 ? -22.063 -10.122 33.103 1.00 18.47 ? 987 VAL C O 1 ATOM 10621 C CB . VAL C 1 679 ? -22.378 -13.455 33.366 1.00 15.44 ? 987 VAL C CB 1 ATOM 10622 C CG1 . VAL C 1 679 ? -21.449 -13.196 32.193 1.00 19.33 ? 987 VAL C CG1 1 ATOM 10623 C CG2 . VAL C 1 679 ? -21.854 -14.587 34.247 1.00 17.59 ? 987 VAL C CG2 1 ATOM 10624 N N . TRP C 1 680 ? -24.167 -10.908 32.926 1.00 17.79 ? 988 TRP C N 1 ATOM 10625 C CA . TRP C 1 680 ? -24.641 -9.819 32.072 1.00 16.50 ? 988 TRP C CA 1 ATOM 10626 C C . TRP C 1 680 ? -24.381 -8.436 32.689 1.00 17.12 ? 988 TRP C C 1 ATOM 10627 O O . TRP C 1 680 ? -23.919 -7.519 32.010 1.00 18.99 ? 988 TRP C O 1 ATOM 10628 C CB . TRP C 1 680 ? -26.139 -10.000 31.794 1.00 19.89 ? 988 TRP C CB 1 ATOM 10629 C CG . TRP C 1 680 ? -26.731 -8.991 30.829 1.00 21.75 ? 988 TRP C CG 1 ATOM 10630 C CD1 . TRP C 1 680 ? -27.552 -7.937 31.137 1.00 26.54 ? 988 TRP C CD1 1 ATOM 10631 C CD2 . TRP C 1 680 ? -26.565 -8.966 29.405 1.00 21.23 ? 988 TRP C CD2 1 ATOM 10632 N NE1 . TRP C 1 680 ? -27.894 -7.255 29.989 1.00 27.33 ? 988 TRP C NE1 1 ATOM 10633 C CE2 . TRP C 1 680 ? -27.303 -7.870 28.914 1.00 25.16 ? 988 TRP C CE2 1 ATOM 10634 C CE3 . TRP C 1 680 ? -25.862 -9.767 28.497 1.00 23.30 ? 988 TRP C CE3 1 ATOM 10635 C CZ2 . TRP C 1 680 ? -27.354 -7.550 27.555 1.00 24.76 ? 988 TRP C CZ2 1 ATOM 10636 C CZ3 . TRP C 1 680 ? -25.911 -9.446 27.143 1.00 21.80 ? 988 TRP C CZ3 1 ATOM 10637 C CH2 . TRP C 1 680 ? -26.654 -8.346 26.687 1.00 21.02 ? 988 TRP C CH2 1 ATOM 10638 N N . LYS C 1 681 ? -24.686 -8.288 33.975 1.00 18.76 ? 989 LYS C N 1 ATOM 10639 C CA . LYS C 1 681 ? -24.466 -7.015 34.657 1.00 19.74 ? 989 LYS C CA 1 ATOM 10640 C C . LYS C 1 681 ? -22.989 -6.757 34.923 1.00 19.88 ? 989 LYS C C 1 ATOM 10641 O O . LYS C 1 681 ? -22.475 -5.665 34.655 1.00 19.84 ? 989 LYS C O 1 ATOM 10642 C CB . LYS C 1 681 ? -25.230 -6.979 35.989 1.00 25.37 ? 989 LYS C CB 1 ATOM 10643 C CG . LYS C 1 681 ? -24.977 -5.704 36.789 1.00 32.28 ? 989 LYS C CG 1 ATOM 10644 C CD . LYS C 1 681 ? -25.537 -5.787 38.198 1.00 41.89 ? 989 LYS C CD 1 ATOM 10645 C CE . LYS C 1 681 ? -25.133 -4.559 39.004 1.00 46.58 ? 989 LYS C CE 1 ATOM 10646 N NZ . LYS C 1 681 ? -23.654 -4.359 38.957 1.00 47.02 ? 989 LYS C NZ 1 ATOM 10647 N N . GLN C 1 682 ? -22.296 -7.771 35.435 1.00 15.36 ? 990 GLN C N 1 ATOM 10648 C CA A GLN C 1 682 ? -20.902 -7.634 35.883 0.46 16.63 ? 990 GLN C CA 1 ATOM 10649 C CA B GLN C 1 682 ? -20.927 -7.558 35.889 0.54 16.43 ? 990 GLN C CA 1 ATOM 10650 C C . GLN C 1 682 ? -19.889 -7.395 34.769 1.00 17.15 ? 990 GLN C C 1 ATOM 10651 O O . GLN C 1 682 ? -18.797 -6.887 35.004 1.00 17.88 ? 990 GLN C O 1 ATOM 10652 C CB A GLN C 1 682 ? -20.469 -8.861 36.693 0.46 17.50 ? 990 GLN C CB 1 ATOM 10653 C CB B GLN C 1 682 ? -20.540 -8.608 36.942 0.54 18.17 ? 990 GLN C CB 1 ATOM 10654 C CG A GLN C 1 682 ? -21.086 -8.946 38.072 0.46 20.02 ? 990 GLN C CG 1 ATOM 10655 C CG B GLN C 1 682 ? -21.310 -8.381 38.247 0.54 20.78 ? 990 GLN C CG 1 ATOM 10656 C CD A GLN C 1 682 ? -20.686 -7.785 38.954 0.46 22.94 ? 990 GLN C CD 1 ATOM 10657 C CD B GLN C 1 682 ? -21.286 -9.555 39.212 0.54 23.14 ? 990 GLN C CD 1 ATOM 10658 O OE1 A GLN C 1 682 ? -21.466 -6.861 39.167 0.46 26.48 ? 990 GLN C OE1 1 ATOM 10659 O OE1 B GLN C 1 682 ? -22.127 -9.643 40.114 0.54 29.05 ? 990 GLN C OE1 1 ATOM 10660 N NE2 A GLN C 1 682 ? -19.463 -7.828 39.474 0.46 22.68 ? 990 GLN C NE2 1 ATOM 10661 N NE2 B GLN C 1 682 ? -20.328 -10.454 39.040 0.54 21.05 ? 990 GLN C NE2 1 ATOM 10662 N N . ARG C 1 683 ? -20.226 -7.777 33.545 1.00 13.99 ? 991 ARG C N 1 ATOM 10663 C CA . ARG C 1 683 ? -19.288 -7.509 32.458 1.00 20.81 ? 991 ARG C CA 1 ATOM 10664 C C . ARG C 1 683 ? -19.135 -5.994 32.280 1.00 19.73 ? 991 ARG C C 1 ATOM 10665 O O . ARG C 1 683 ? -18.128 -5.516 31.751 1.00 22.11 ? 991 ARG C O 1 ATOM 10666 C CB . ARG C 1 683 ? -19.732 -8.190 31.164 1.00 27.54 ? 991 ARG C CB 1 ATOM 10667 C CG . ARG C 1 683 ? -20.877 -7.492 30.505 1.00 25.14 ? 991 ARG C CG 1 ATOM 10668 C CD . ARG C 1 683 ? -21.767 -8.424 29.710 1.00 23.88 ? 991 ARG C CD 1 ATOM 10669 N NE . ARG C 1 683 ? -23.020 -7.716 29.500 1.00 22.97 ? 991 ARG C NE 1 ATOM 10670 C CZ . ARG C 1 683 ? -23.432 -7.237 28.335 1.00 24.51 ? 991 ARG C CZ 1 ATOM 10671 N NH1 . ARG C 1 683 ? -22.737 -7.448 27.225 1.00 22.30 ? 991 ARG C NH1 1 ATOM 10672 N NH2 . ARG C 1 683 ? -24.570 -6.572 28.281 1.00 26.87 ? 991 ARG C NH2 1 ATOM 10673 N N . ILE C 1 684 ? -20.124 -5.241 32.764 1.00 18.59 ? 992 ILE C N 1 ATOM 10674 C CA . ILE C 1 684 ? -20.083 -3.780 32.719 1.00 18.96 ? 992 ILE C CA 1 ATOM 10675 C C . ILE C 1 684 ? -19.537 -3.178 34.014 1.00 18.84 ? 992 ILE C C 1 ATOM 10676 O O . ILE C 1 684 ? -18.673 -2.300 33.983 1.00 20.47 ? 992 ILE C O 1 ATOM 10677 C CB . ILE C 1 684 ? -21.473 -3.176 32.434 1.00 20.96 ? 992 ILE C CB 1 ATOM 10678 C CG1 . ILE C 1 684 ? -22.043 -3.742 31.135 1.00 24.55 ? 992 ILE C CG1 1 ATOM 10679 C CG2 . ILE C 1 684 ? -21.390 -1.647 32.355 1.00 25.36 ? 992 ILE C CG2 1 ATOM 10680 C CD1 . ILE C 1 684 ? -21.133 -3.555 29.941 1.00 23.59 ? 992 ILE C CD1 1 ATOM 10681 N N . SER C 1 685 ? -20.033 -3.658 35.151 1.00 17.69 ? 993 SER C N 1 ATOM 10682 C CA . SER C 1 685 ? -19.738 -3.030 36.436 1.00 21.23 ? 993 SER C CA 1 ATOM 10683 C C . SER C 1 685 ? -18.421 -3.484 37.073 1.00 20.33 ? 993 SER C C 1 ATOM 10684 O O . SER C 1 685 ? -17.889 -2.799 37.944 1.00 19.12 ? 993 SER C O 1 ATOM 10685 C CB . SER C 1 685 ? -20.896 -3.252 37.415 1.00 23.82 ? 993 SER C CB 1 ATOM 10686 O OG . SER C 1 685 ? -21.025 -4.625 37.729 1.00 25.26 ? 993 SER C OG 1 ATOM 10687 N N . SER C 1 686 ? -17.911 -4.642 36.657 1.00 18.59 ? 994 SER C N 1 ATOM 10688 C CA . SER C 1 686 ? -16.625 -5.140 37.157 1.00 15.76 ? 994 SER C CA 1 ATOM 10689 C C . SER C 1 686 ? -15.475 -4.477 36.383 1.00 16.65 ? 994 SER C C 1 ATOM 10690 O O . SER C 1 686 ? -15.714 -3.770 35.394 1.00 17.13 ? 994 SER C O 1 ATOM 10691 C CB . SER C 1 686 ? -16.559 -6.663 37.007 1.00 15.45 ? 994 SER C CB 1 ATOM 10692 O OG . SER C 1 686 ? -16.168 -7.013 35.683 1.00 18.49 ? 994 SER C OG 1 ATOM 10693 N N . PRO C 1 687 ? -14.222 -4.688 36.825 1.00 15.84 ? 995 PRO C N 1 ATOM 10694 C CA . PRO C 1 687 ? -13.115 -4.136 36.036 1.00 15.44 ? 995 PRO C CA 1 ATOM 10695 C C . PRO C 1 687 ? -12.773 -4.923 34.764 1.00 17.84 ? 995 PRO C C 1 ATOM 10696 O O . PRO C 1 687 ? -11.918 -4.444 34.021 1.00 15.73 ? 995 PRO C O 1 ATOM 10697 C CB . PRO C 1 687 ? -11.911 -4.220 36.996 1.00 17.37 ? 995 PRO C CB 1 ATOM 10698 C CG . PRO C 1 687 ? -12.486 -4.470 38.369 1.00 19.59 ? 995 PRO C CG 1 ATOM 10699 C CD . PRO C 1 687 ? -13.764 -5.219 38.126 1.00 19.85 ? 995 PRO C CD 1 ATOM 10700 N N . LEU C 1 688 ? -13.398 -6.076 34.508 1.00 16.51 ? 996 LEU C N 1 ATOM 10701 C CA . LEU C 1 688 ? -12.900 -6.993 33.458 1.00 15.28 ? 996 LEU C CA 1 ATOM 10702 C C . LEU C 1 688 ? -12.702 -6.366 32.079 1.00 16.12 ? 996 LEU C C 1 ATOM 10703 O O . LEU C 1 688 ? -11.680 -6.600 31.427 1.00 17.15 ? 996 LEU C O 1 ATOM 10704 C CB . LEU C 1 688 ? -13.788 -8.239 33.326 1.00 14.54 ? 996 LEU C CB 1 ATOM 10705 C CG . LEU C 1 688 ? -13.229 -9.370 32.458 1.00 14.24 ? 996 LEU C CG 1 ATOM 10706 C CD1 . LEU C 1 688 ? -11.847 -9.797 32.990 1.00 14.56 ? 996 LEU C CD1 1 ATOM 10707 C CD2 . LEU C 1 688 ? -14.168 -10.556 32.447 1.00 10.90 ? 996 LEU C CD2 1 ATOM 10708 N N . PHE C 1 689 ? -13.683 -5.587 31.632 1.00 12.92 ? 997 PHE C N 1 ATOM 10709 C CA . PHE C 1 689 ? -13.630 -4.992 30.304 1.00 14.45 ? 997 PHE C CA 1 ATOM 10710 C C . PHE C 1 689 ? -13.357 -3.493 30.363 1.00 15.42 ? 997 PHE C C 1 ATOM 10711 O O . PHE C 1 689 ? -13.562 -2.788 29.376 1.00 18.97 ? 997 PHE C O 1 ATOM 10712 C CB . PHE C 1 689 ? -14.943 -5.263 29.560 1.00 15.88 ? 997 PHE C CB 1 ATOM 10713 C CG . PHE C 1 689 ? -15.170 -6.716 29.249 1.00 15.22 ? 997 PHE C CG 1 ATOM 10714 C CD1 . PHE C 1 689 ? -14.667 -7.275 28.076 1.00 14.49 ? 997 PHE C CD1 1 ATOM 10715 C CD2 . PHE C 1 689 ? -15.864 -7.531 30.136 1.00 14.48 ? 997 PHE C CD2 1 ATOM 10716 C CE1 . PHE C 1 689 ? -14.874 -8.631 27.787 1.00 14.92 ? 997 PHE C CE1 1 ATOM 10717 C CE2 . PHE C 1 689 ? -16.078 -8.879 29.855 1.00 15.67 ? 997 PHE C CE2 1 ATOM 10718 C CZ . PHE C 1 689 ? -15.573 -9.429 28.681 1.00 14.51 ? 997 PHE C CZ 1 ATOM 10719 N N . ASN C 1 690 ? -12.899 -3.009 31.517 1.00 14.86 ? 998 ASN C N 1 ATOM 10720 C CA . ASN C 1 690 ? -12.690 -1.566 31.711 1.00 17.53 ? 998 ASN C CA 1 ATOM 10721 C C . ASN C 1 690 ? -11.265 -1.183 31.323 1.00 15.99 ? 998 ASN C C 1 ATOM 10722 O O . ASN C 1 690 ? -10.344 -1.235 32.133 1.00 13.76 ? 998 ASN C O 1 ATOM 10723 C CB . ASN C 1 690 ? -13.005 -1.155 33.160 1.00 16.48 ? 998 ASN C CB 1 ATOM 10724 C CG . ASN C 1 690 ? -13.223 0.351 33.323 1.00 21.98 ? 998 ASN C CG 1 ATOM 10725 O OD1 . ASN C 1 690 ? -12.413 1.164 32.890 1.00 20.06 ? 998 ASN C OD1 1 ATOM 10726 N ND2 . ASN C 1 690 ? -14.329 0.719 33.955 1.00 27.45 ? 998 ASN C ND2 1 ATOM 10727 N N . THR C 1 691 ? -11.086 -0.827 30.059 1.00 17.25 ? 999 THR C N 1 ATOM 10728 C CA . THR C 1 691 ? -9.750 -0.604 29.529 1.00 17.80 ? 999 THR C CA 1 ATOM 10729 C C . THR C 1 691 ? -9.060 0.614 30.147 1.00 16.25 ? 999 THR C C 1 ATOM 10730 O O . THR C 1 691 ? -7.837 0.627 30.287 1.00 18.89 ? 999 THR C O 1 ATOM 10731 C CB . THR C 1 691 ? -9.771 -0.524 27.993 1.00 19.62 ? 999 THR C CB 1 ATOM 10732 O OG1 . THR C 1 691 ? -10.814 0.363 27.575 1.00 21.85 ? 999 THR C OG1 1 ATOM 10733 C CG2 . THR C 1 691 ? -10.040 -1.903 27.405 1.00 19.51 ? 999 THR C CG2 1 ATOM 10734 N N . LYS C 1 692 ? -9.834 1.629 30.529 1.00 13.12 ? 1000 LYS C N 1 ATOM 10735 C CA . LYS C 1 692 ? -9.255 2.794 31.192 1.00 16.88 ? 1000 LYS C CA 1 ATOM 10736 C C . LYS C 1 692 ? -8.746 2.424 32.582 1.00 16.37 ? 1000 LYS C C 1 ATOM 10737 O O . LYS C 1 692 ? -7.629 2.777 32.956 1.00 15.19 ? 1000 LYS C O 1 ATOM 10738 C CB . LYS C 1 692 ? -10.266 3.940 31.298 1.00 19.58 ? 1000 LYS C CB 1 ATOM 10739 C CG . LYS C 1 692 ? -9.678 5.236 31.876 1.00 21.77 ? 1000 LYS C CG 1 ATOM 10740 C CD . LYS C 1 692 ? -8.512 5.744 31.026 1.00 22.85 ? 1000 LYS C CD 1 ATOM 10741 C CE . LYS C 1 692 ? -7.955 7.070 31.542 1.00 26.16 ? 1000 LYS C CE 1 ATOM 10742 N NZ . LYS C 1 692 ? -6.870 7.584 30.643 1.00 26.74 ? 1000 LYS C NZ 1 ATOM 10743 N N . GLN C 1 693 ? -9.560 1.706 33.352 1.00 14.22 ? 1001 GLN C N 1 ATOM 10744 C CA . GLN C 1 693 ? -9.098 1.240 34.655 1.00 17.79 ? 1001 GLN C CA 1 ATOM 10745 C C . GLN C 1 693 ? -7.838 0.387 34.520 1.00 17.28 ? 1001 GLN C C 1 ATOM 10746 O O . GLN C 1 693 ? -6.879 0.538 35.284 1.00 18.62 ? 1001 GLN C O 1 ATOM 10747 C CB . GLN C 1 693 ? -10.192 0.457 35.377 1.00 20.28 ? 1001 GLN C CB 1 ATOM 10748 C CG . GLN C 1 693 ? -9.811 0.040 36.790 1.00 25.28 ? 1001 GLN C CG 1 ATOM 10749 C CD . GLN C 1 693 ? -10.973 -0.573 37.550 1.00 30.50 ? 1001 GLN C CD 1 ATOM 10750 O OE1 . GLN C 1 693 ? -12.099 -0.624 37.050 1.00 33.02 ? 1001 GLN C OE1 1 ATOM 10751 N NE2 . GLN C 1 693 ? -10.707 -1.036 38.766 1.00 33.45 ? 1001 GLN C NE2 1 ATOM 10752 N N . TYR C 1 694 ? -7.844 -0.505 33.540 1.00 15.07 ? 1002 TYR C N 1 ATOM 10753 C CA . TYR C 1 694 ? -6.726 -1.417 33.331 1.00 15.59 ? 1002 TYR C CA 1 ATOM 10754 C C . TYR C 1 694 ? -5.440 -0.646 33.047 1.00 16.87 ? 1002 TYR C C 1 ATOM 10755 O O . TYR C 1 694 ? -4.397 -0.915 33.649 1.00 18.63 ? 1002 TYR C O 1 ATOM 10756 C CB . TYR C 1 694 ? -7.018 -2.386 32.175 1.00 11.91 ? 1002 TYR C CB 1 ATOM 10757 C CG . TYR C 1 694 ? -5.961 -3.471 32.035 1.00 14.77 ? 1002 TYR C CG 1 ATOM 10758 C CD1 . TYR C 1 694 ? -6.128 -4.716 32.637 1.00 16.09 ? 1002 TYR C CD1 1 ATOM 10759 C CD2 . TYR C 1 694 ? -4.793 -3.242 31.323 1.00 16.08 ? 1002 TYR C CD2 1 ATOM 10760 C CE1 . TYR C 1 694 ? -5.150 -5.706 32.522 1.00 16.05 ? 1002 TYR C CE1 1 ATOM 10761 C CE2 . TYR C 1 694 ? -3.816 -4.218 31.205 1.00 18.15 ? 1002 TYR C CE2 1 ATOM 10762 C CZ . TYR C 1 694 ? -4.000 -5.448 31.806 1.00 18.29 ? 1002 TYR C CZ 1 ATOM 10763 O OH . TYR C 1 694 ? -3.020 -6.415 31.685 1.00 20.65 ? 1002 TYR C OH 1 ATOM 10764 N N . THR C 1 695 ? -5.519 0.306 32.121 1.00 15.64 ? 1003 THR C N 1 ATOM 10765 C CA . THR C 1 695 ? -4.352 1.102 31.749 1.00 18.05 ? 1003 THR C CA 1 ATOM 10766 C C . THR C 1 695 ? -3.808 1.836 32.969 1.00 17.87 ? 1003 THR C C 1 ATOM 10767 O O . THR C 1 695 ? -2.595 1.890 33.191 1.00 18.76 ? 1003 THR C O 1 ATOM 10768 C CB . THR C 1 695 ? -4.697 2.110 30.641 1.00 16.93 ? 1003 THR C CB 1 ATOM 10769 O OG1 . THR C 1 695 ? -5.196 1.398 29.503 1.00 18.30 ? 1003 THR C OG1 1 ATOM 10770 C CG2 . THR C 1 695 ? -3.457 2.916 30.230 1.00 17.57 ? 1003 THR C CG2 1 ATOM 10771 N N . MET C 1 696 ? -4.705 2.379 33.781 1.00 14.58 ? 1004 MET C N 1 ATOM 10772 C CA . MET C 1 696 ? -4.263 3.097 34.976 1.00 19.36 ? 1004 MET C CA 1 ATOM 10773 C C . MET C 1 696 ? -3.585 2.188 35.999 1.00 20.50 ? 1004 MET C C 1 ATOM 10774 O O . MET C 1 696 ? -2.630 2.593 36.669 1.00 19.67 ? 1004 MET C O 1 ATOM 10775 C CB . MET C 1 696 ? -5.424 3.871 35.602 1.00 19.77 ? 1004 MET C CB 1 ATOM 10776 C CG . MET C 1 696 ? -5.933 4.988 34.697 1.00 20.92 ? 1004 MET C CG 1 ATOM 10777 S SD . MET C 1 696 ? -7.363 5.852 35.372 1.00 23.71 ? 1004 MET C SD 1 ATOM 10778 C CE . MET C 1 696 ? -6.682 6.470 36.904 1.00 22.24 ? 1004 MET C CE 1 ATOM 10779 N N . GLU C 1 697 ? -4.072 0.958 36.121 1.00 22.38 ? 1005 GLU C N 1 ATOM 10780 C CA . GLU C 1 697 ? -3.428 0.003 37.019 1.00 24.07 ? 1005 GLU C CA 1 ATOM 10781 C C . GLU C 1 697 ? -2.094 -0.487 36.457 1.00 22.70 ? 1005 GLU C C 1 ATOM 10782 O O . GLU C 1 697 ? -1.132 -0.709 37.206 1.00 18.53 ? 1005 GLU C O 1 ATOM 10783 C CB . GLU C 1 697 ? -4.364 -1.168 37.333 1.00 26.69 ? 1005 GLU C CB 1 ATOM 10784 C CG . GLU C 1 697 ? -5.557 -0.779 38.207 1.00 31.55 ? 1005 GLU C CG 1 ATOM 10785 C CD . GLU C 1 697 ? -5.133 -0.238 39.559 1.00 36.82 ? 1005 GLU C CD 1 ATOM 10786 O OE1 . GLU C 1 697 ? -3.978 -0.478 39.969 1.00 38.06 ? 1005 GLU C OE1 1 ATOM 10787 O OE2 . GLU C 1 697 ? -5.955 0.431 40.216 1.00 43.95 ? 1005 GLU C OE2 1 ATOM 10788 N N . LEU C 1 698 ? -2.043 -0.648 35.137 1.00 21.01 ? 1006 LEU C N 1 ATOM 10789 C CA . LEU C 1 698 ? -0.796 -0.954 34.439 1.00 22.77 ? 1006 LEU C CA 1 ATOM 10790 C C . LEU C 1 698 ? 0.236 0.144 34.702 1.00 18.74 ? 1006 LEU C C 1 ATOM 10791 O O . LEU C 1 698 ? 1.404 -0.132 34.998 1.00 19.16 ? 1006 LEU C O 1 ATOM 10792 C CB . LEU C 1 698 ? -1.068 -1.090 32.939 1.00 23.11 ? 1006 LEU C CB 1 ATOM 10793 C CG . LEU C 1 698 ? 0.007 -1.683 32.033 1.00 24.22 ? 1006 LEU C CG 1 ATOM 10794 C CD1 . LEU C 1 698 ? 0.510 -3.011 32.590 1.00 23.30 ? 1006 LEU C CD1 1 ATOM 10795 C CD2 . LEU C 1 698 ? -0.574 -1.876 30.643 1.00 22.68 ? 1006 LEU C CD2 1 ATOM 10796 N N . GLU C 1 699 ? -0.202 1.397 34.606 1.00 16.26 ? 1007 GLU C N 1 ATOM 10797 C CA . GLU C 1 699 ? 0.667 2.538 34.886 1.00 15.65 ? 1007 GLU C CA 1 ATOM 10798 C C . GLU C 1 699 ? 1.203 2.551 36.321 1.00 20.42 ? 1007 GLU C C 1 ATOM 10799 O O . GLU C 1 699 ? 2.385 2.844 36.547 1.00 18.03 ? 1007 GLU C O 1 ATOM 10800 C CB . GLU C 1 699 ? -0.057 3.852 34.548 1.00 19.34 ? 1007 GLU C CB 1 ATOM 10801 C CG . GLU C 1 699 ? -0.285 4.005 33.049 1.00 20.90 ? 1007 GLU C CG 1 ATOM 10802 C CD . GLU C 1 699 ? -1.144 5.199 32.678 1.00 23.59 ? 1007 GLU C CD 1 ATOM 10803 O OE1 . GLU C 1 699 ? -2.104 5.508 33.415 1.00 23.28 ? 1007 GLU C OE1 1 ATOM 10804 O OE2 . GLU C 1 699 ? -0.846 5.827 31.640 1.00 22.79 ? 1007 GLU C OE2 1 ATOM 10805 N N . ARG C 1 700 ? 0.345 2.231 37.286 1.00 22.99 ? 1008 ARG C N 1 ATOM 10806 C CA . ARG C 1 700 ? 0.778 2.150 38.683 1.00 25.94 ? 1008 ARG C CA 1 ATOM 10807 C C . ARG C 1 700 ? 1.874 1.097 38.831 1.00 22.29 ? 1008 ARG C C 1 ATOM 10808 O O . ARG C 1 700 ? 2.850 1.292 39.555 1.00 21.98 ? 1008 ARG C O 1 ATOM 10809 C CB . ARG C 1 700 ? -0.398 1.799 39.597 1.00 30.47 ? 1008 ARG C CB 1 ATOM 10810 C CG . ARG C 1 700 ? -0.062 1.857 41.083 1.00 38.60 ? 1008 ARG C CG 1 ATOM 10811 C CD . ARG C 1 700 ? -1.138 1.196 41.932 1.00 46.23 ? 1008 ARG C CD 1 ATOM 10812 N NE . ARG C 1 700 ? -2.481 1.578 41.508 1.00 52.96 ? 1008 ARG C NE 1 ATOM 10813 C CZ . ARG C 1 700 ? -3.137 2.643 41.958 1.00 58.03 ? 1008 ARG C CZ 1 ATOM 10814 N NH1 . ARG C 1 700 ? -2.574 3.443 42.855 1.00 60.03 ? 1008 ARG C NH1 1 ATOM 10815 N NH2 . ARG C 1 700 ? -4.359 2.908 41.508 1.00 58.79 ? 1008 ARG C NH2 1 ATOM 10816 N N . LEU C 1 701 ? 1.713 -0.014 38.123 1.00 21.36 ? 1009 LEU C N 1 ATOM 10817 C CA . LEU C 1 701 ? 2.679 -1.108 38.186 1.00 23.39 ? 1009 LEU C CA 1 ATOM 10818 C C . LEU C 1 701 ? 4.033 -0.716 37.583 1.00 23.00 ? 1009 LEU C C 1 ATOM 10819 O O . LEU C 1 701 ? 5.079 -0.994 38.170 1.00 23.98 ? 1009 LEU C O 1 ATOM 10820 C CB . LEU C 1 701 ? 2.107 -2.343 37.484 1.00 22.89 ? 1009 LEU C CB 1 ATOM 10821 C CG . LEU C 1 701 ? 2.881 -3.658 37.553 1.00 22.53 ? 1009 LEU C CG 1 ATOM 10822 C CD1 . LEU C 1 701 ? 3.204 -4.035 38.990 1.00 22.80 ? 1009 LEU C CD1 1 ATOM 10823 C CD2 . LEU C 1 701 ? 2.065 -4.756 36.880 1.00 22.01 ? 1009 LEU C CD2 1 ATOM 10824 N N . TYR C 1 702 ? 4.000 -0.082 36.411 1.00 19.88 ? 1010 TYR C N 1 ATOM 10825 C CA . TYR C 1 702 ? 5.196 0.420 35.736 1.00 20.97 ? 1010 TYR C CA 1 ATOM 10826 C C . TYR C 1 702 ? 6.008 1.319 36.655 1.00 23.48 ? 1010 TYR C C 1 ATOM 10827 O O . TYR C 1 702 ? 7.229 1.207 36.729 1.00 23.62 ? 1010 TYR C O 1 ATOM 10828 C CB . TYR C 1 702 ? 4.820 1.225 34.484 1.00 21.29 ? 1010 TYR C CB 1 ATOM 10829 C CG . TYR C 1 702 ? 4.334 0.405 33.305 1.00 20.33 ? 1010 TYR C CG 1 ATOM 10830 C CD1 . TYR C 1 702 ? 4.664 -0.938 33.176 1.00 19.82 ? 1010 TYR C CD1 1 ATOM 10831 C CD2 . TYR C 1 702 ? 3.550 0.987 32.316 1.00 21.05 ? 1010 TYR C CD2 1 ATOM 10832 C CE1 . TYR C 1 702 ? 4.211 -1.684 32.088 1.00 19.30 ? 1010 TYR C CE1 1 ATOM 10833 C CE2 . TYR C 1 702 ? 3.099 0.259 31.235 1.00 19.49 ? 1010 TYR C CE2 1 ATOM 10834 C CZ . TYR C 1 702 ? 3.429 -1.074 31.126 1.00 19.96 ? 1010 TYR C CZ 1 ATOM 10835 O OH . TYR C 1 702 ? 2.974 -1.786 30.043 1.00 19.95 ? 1010 TYR C OH 1 ATOM 10836 N N . LEU C 1 703 ? 5.319 2.223 37.342 1.00 24.29 ? 1011 LEU C N 1 ATOM 10837 C CA . LEU C 1 703 ? 5.981 3.154 38.248 1.00 24.86 ? 1011 LEU C CA 1 ATOM 10838 C C . LEU C 1 703 ? 6.581 2.448 39.457 1.00 26.85 ? 1011 LEU C C 1 ATOM 10839 O O . LEU C 1 703 ? 7.611 2.870 39.971 1.00 27.42 ? 1011 LEU C O 1 ATOM 10840 C CB . LEU C 1 703 ? 5.018 4.258 38.690 1.00 27.54 ? 1011 LEU C CB 1 ATOM 10841 C CG . LEU C 1 703 ? 4.617 5.245 37.590 1.00 30.73 ? 1011 LEU C CG 1 ATOM 10842 C CD1 . LEU C 1 703 ? 3.532 6.184 38.086 1.00 32.85 ? 1011 LEU C CD1 1 ATOM 10843 C CD2 . LEU C 1 703 ? 5.831 6.038 37.111 1.00 33.37 ? 1011 LEU C CD2 1 ATOM 10844 N N . GLN C 1 704 ? 5.945 1.372 39.910 1.00 29.70 ? 1012 GLN C N 1 ATOM 10845 C CA . GLN C 1 704 ? 6.523 0.571 40.986 1.00 32.84 ? 1012 GLN C CA 1 ATOM 10846 C C . GLN C 1 704 ? 7.817 -0.088 40.517 1.00 29.43 ? 1012 GLN C C 1 ATOM 10847 O O . GLN C 1 704 ? 8.812 -0.115 41.245 1.00 28.69 ? 1012 GLN C O 1 ATOM 10848 C CB . GLN C 1 704 ? 5.539 -0.495 41.477 1.00 38.48 ? 1012 GLN C CB 1 ATOM 10849 C CG . GLN C 1 704 ? 4.340 0.061 42.225 1.00 45.53 ? 1012 GLN C CG 1 ATOM 10850 C CD . GLN C 1 704 ? 3.390 -1.025 42.701 1.00 51.72 ? 1012 GLN C CD 1 ATOM 10851 O OE1 . GLN C 1 704 ? 3.754 -2.202 42.770 1.00 54.09 ? 1012 GLN C OE1 1 ATOM 10852 N NE2 . GLN C 1 704 ? 2.162 -0.633 43.032 1.00 52.56 ? 1012 GLN C NE2 1 ATOM 10853 N N . MET C 1 705 ? 7.794 -0.618 39.297 1.00 27.25 ? 1013 MET C N 1 ATOM 10854 C CA . MET C 1 705 ? 8.981 -1.218 38.697 1.00 27.65 ? 1013 MET C CA 1 ATOM 10855 C C . MET C 1 705 ? 10.089 -0.188 38.580 1.00 28.58 ? 1013 MET C C 1 ATOM 10856 O O . MET C 1 705 ? 11.248 -0.457 38.920 1.00 28.45 ? 1013 MET C O 1 ATOM 10857 C CB . MET C 1 705 ? 8.670 -1.744 37.296 1.00 26.69 ? 1013 MET C CB 1 ATOM 10858 C CG . MET C 1 705 ? 7.645 -2.853 37.226 1.00 27.57 ? 1013 MET C CG 1 ATOM 10859 S SD . MET C 1 705 ? 7.362 -3.311 35.508 1.00 25.53 ? 1013 MET C SD 1 ATOM 10860 C CE . MET C 1 705 ? 6.361 -4.790 35.702 1.00 22.91 ? 1013 MET C CE 1 ATOM 10861 N N . TRP C 1 706 ? 9.734 0.996 38.086 1.00 28.03 ? 1014 TRP C N 1 ATOM 10862 C CA . TRP C 1 706 ? 10.733 2.033 37.867 1.00 27.78 ? 1014 TRP C CA 1 ATOM 10863 C C . TRP C 1 706 ? 11.356 2.550 39.161 1.00 32.02 ? 1014 TRP C C 1 ATOM 10864 O O . TRP C 1 706 ? 12.580 2.666 39.259 1.00 32.94 ? 1014 TRP C O 1 ATOM 10865 C CB . TRP C 1 706 ? 10.179 3.211 37.061 1.00 27.14 ? 1014 TRP C CB 1 ATOM 10866 C CG . TRP C 1 706 ? 11.212 4.289 36.962 1.00 29.87 ? 1014 TRP C CG 1 ATOM 10867 C CD1 . TRP C 1 706 ? 11.226 5.481 37.627 1.00 31.45 ? 1014 TRP C CD1 1 ATOM 10868 C CD2 . TRP C 1 706 ? 12.420 4.241 36.195 1.00 28.89 ? 1014 TRP C CD2 1 ATOM 10869 N NE1 . TRP C 1 706 ? 12.360 6.188 37.302 1.00 33.35 ? 1014 TRP C NE1 1 ATOM 10870 C CE2 . TRP C 1 706 ? 13.109 5.448 36.425 1.00 30.88 ? 1014 TRP C CE2 1 ATOM 10871 C CE3 . TRP C 1 706 ? 12.980 3.299 35.324 1.00 29.05 ? 1014 TRP C CE3 1 ATOM 10872 C CZ2 . TRP C 1 706 ? 14.326 5.740 35.815 1.00 30.17 ? 1014 TRP C CZ2 1 ATOM 10873 C CZ3 . TRP C 1 706 ? 14.191 3.590 34.722 1.00 29.79 ? 1014 TRP C CZ3 1 ATOM 10874 C CH2 . TRP C 1 706 ? 14.851 4.800 34.971 1.00 28.43 ? 1014 TRP C CH2 1 ATOM 10875 N N . GLU C 1 707 ? 10.518 2.876 40.141 1.00 33.39 ? 1015 GLU C N 1 ATOM 10876 C CA . GLU C 1 707 ? 11.006 3.383 41.422 1.00 36.08 ? 1015 GLU C CA 1 ATOM 10877 C C . GLU C 1 707 ? 11.914 2.362 42.097 1.00 33.44 ? 1015 GLU C C 1 ATOM 10878 O O . GLU C 1 707 ? 12.871 2.719 42.785 1.00 33.73 ? 1015 GLU C O 1 ATOM 10879 C CB . GLU C 1 707 ? 9.842 3.749 42.343 1.00 41.12 ? 1015 GLU C CB 1 ATOM 10880 C CG . GLU C 1 707 ? 9.061 4.974 41.890 1.00 48.25 ? 1015 GLU C CG 1 ATOM 10881 C CD . GLU C 1 707 ? 7.754 5.146 42.645 1.00 55.78 ? 1015 GLU C CD 1 ATOM 10882 O OE1 . GLU C 1 707 ? 7.496 4.357 43.580 1.00 58.65 ? 1015 GLU C OE1 1 ATOM 10883 O OE2 . GLU C 1 707 ? 6.982 6.067 42.298 1.00 58.64 ? 1015 GLU C OE2 1 ATOM 10884 N N . HIS C 1 708 ? 11.610 1.087 41.886 1.00 31.01 ? 1016 HIS C N 1 ATOM 10885 C CA . HIS C 1 708 ? 12.426 0.001 42.421 1.00 32.59 ? 1016 HIS C CA 1 ATOM 10886 C C . HIS C 1 708 ? 13.805 -0.019 41.763 1.00 32.04 ? 1016 HIS C C 1 ATOM 10887 O O . HIS C 1 708 ? 14.821 -0.183 42.436 1.00 34.76 ? 1016 HIS C O 1 ATOM 10888 C CB . HIS C 1 708 ? 11.716 -1.335 42.199 1.00 31.07 ? 1016 HIS C CB 1 ATOM 10889 C CG . HIS C 1 708 ? 12.380 -2.494 42.873 1.00 33.50 ? 1016 HIS C CG 1 ATOM 10890 N ND1 . HIS C 1 708 ? 12.378 -2.660 44.242 1.00 35.80 ? 1016 HIS C ND1 1 ATOM 10891 C CD2 . HIS C 1 708 ? 13.060 -3.550 42.367 1.00 35.13 ? 1016 HIS C CD2 1 ATOM 10892 C CE1 . HIS C 1 708 ? 13.029 -3.768 44.549 1.00 37.69 ? 1016 HIS C CE1 1 ATOM 10893 N NE2 . HIS C 1 708 ? 13.454 -4.326 43.430 1.00 35.97 ? 1016 HIS C NE2 1 ATOM 10894 N N . TYR C 1 709 ? 13.833 0.149 40.444 1.00 30.21 ? 1017 TYR C N 1 ATOM 10895 C CA . TYR C 1 709 ? 15.089 0.193 39.700 1.00 31.83 ? 1017 TYR C CA 1 ATOM 10896 C C . TYR C 1 709 ? 15.867 1.473 39.981 1.00 30.92 ? 1017 TYR C C 1 ATOM 10897 O O . TYR C 1 709 ? 17.076 1.438 40.217 1.00 31.54 ? 1017 TYR C O 1 ATOM 10898 C CB . TYR C 1 709 ? 14.833 0.077 38.197 1.00 30.79 ? 1017 TYR C CB 1 ATOM 10899 C CG . TYR C 1 709 ? 16.065 0.335 37.358 1.00 33.85 ? 1017 TYR C CG 1 ATOM 10900 C CD1 . TYR C 1 709 ? 17.021 -0.657 37.169 1.00 35.09 ? 1017 TYR C CD1 1 ATOM 10901 C CD2 . TYR C 1 709 ? 16.275 1.572 36.754 1.00 33.75 ? 1017 TYR C CD2 1 ATOM 10902 C CE1 . TYR C 1 709 ? 18.150 -0.425 36.406 1.00 36.50 ? 1017 TYR C CE1 1 ATOM 10903 C CE2 . TYR C 1 709 ? 17.404 1.813 35.992 1.00 35.35 ? 1017 TYR C CE2 1 ATOM 10904 C CZ . TYR C 1 709 ? 18.336 0.812 35.820 1.00 36.54 ? 1017 TYR C CZ 1 ATOM 10905 O OH . TYR C 1 709 ? 19.455 1.044 35.056 1.00 38.56 ? 1017 TYR C OH 1 ATOM 10906 N N . ALA C 1 710 ? 15.166 2.602 39.935 1.00 29.36 ? 1018 ALA C N 1 ATOM 10907 C CA . ALA C 1 710 ? 15.780 3.901 40.176 1.00 33.34 ? 1018 ALA C CA 1 ATOM 10908 C C . ALA C 1 710 ? 16.462 3.955 41.540 1.00 35.91 ? 1018 ALA C C 1 ATOM 10909 O O . ALA C 1 710 ? 17.451 4.667 41.720 1.00 37.92 ? 1018 ALA C O 1 ATOM 10910 C CB . ALA C 1 710 ? 14.743 5.011 40.050 1.00 34.86 ? 1018 ALA C CB 1 ATOM 10911 N N . ALA C 1 711 ? 15.935 3.189 42.492 1.00 36.06 ? 1019 ALA C N 1 ATOM 10912 C CA . ALA C 1 711 ? 16.518 3.113 43.829 1.00 39.14 ? 1019 ALA C CA 1 ATOM 10913 C C . ALA C 1 711 ? 17.747 2.205 43.871 1.00 41.24 ? 1019 ALA C C 1 ATOM 10914 O O . ALA C 1 711 ? 18.392 2.074 44.910 1.00 45.66 ? 1019 ALA C O 1 ATOM 10915 C CB . ALA C 1 711 ? 15.482 2.651 44.837 1.00 37.94 ? 1019 ALA C CB 1 ATOM 10916 N N . GLY C 1 712 ? 18.063 1.578 42.741 1.00 39.19 ? 1020 GLY C N 1 ATOM 10917 C CA . GLY C 1 712 ? 19.276 0.789 42.619 1.00 40.22 ? 1020 GLY C CA 1 ATOM 10918 C C . GLY C 1 712 ? 19.102 -0.692 42.900 1.00 39.95 ? 1020 GLY C C 1 ATOM 10919 O O . GLY C 1 712 ? 20.080 -1.408 43.106 1.00 41.72 ? 1020 GLY C O 1 ATOM 10920 N N . ASN C 1 713 ? 17.858 -1.158 42.907 1.00 35.91 ? 1021 ASN C N 1 ATOM 10921 C CA . ASN C 1 713 ? 17.579 -2.560 43.193 1.00 35.62 ? 1021 ASN C CA 1 ATOM 10922 C C . ASN C 1 713 ? 17.401 -3.388 41.928 1.00 35.83 ? 1021 ASN C C 1 ATOM 10923 O O . ASN C 1 713 ? 16.883 -2.900 40.923 1.00 35.56 ? 1021 ASN C O 1 ATOM 10924 C CB . ASN C 1 713 ? 16.323 -2.700 44.057 1.00 36.15 ? 1021 ASN C CB 1 ATOM 10925 C CG . ASN C 1 713 ? 16.418 -1.936 45.360 1.00 40.95 ? 1021 ASN C CG 1 ATOM 10926 O OD1 . ASN C 1 713 ? 17.154 -2.323 46.268 1.00 43.26 ? 1021 ASN C OD1 1 ATOM 10927 N ND2 . ASN C 1 713 ? 15.658 -0.850 45.466 1.00 41.50 ? 1021 ASN C ND2 1 ATOM 10928 N N . LYS C 1 714 ? 17.833 -4.643 41.986 1.00 36.07 ? 1022 LYS C N 1 ATOM 10929 C CA . LYS C 1 714 ? 17.522 -5.614 40.944 1.00 37.73 ? 1022 LYS C CA 1 ATOM 10930 C C . LYS C 1 714 ? 16.053 -6.006 41.098 1.00 33.41 ? 1022 LYS C C 1 ATOM 10931 O O . LYS C 1 714 ? 15.481 -5.827 42.172 1.00 32.29 ? 1022 LYS C O 1 ATOM 10932 C CB . LYS C 1 714 ? 18.434 -6.840 41.070 1.00 42.79 ? 1022 LYS C CB 1 ATOM 10933 C CG . LYS C 1 714 ? 19.914 -6.533 40.877 1.00 47.05 ? 1022 LYS C CG 1 ATOM 10934 C CD . LYS C 1 714 ? 20.757 -7.797 40.943 1.00 51.35 ? 1022 LYS C CD 1 ATOM 10935 C CE . LYS C 1 714 ? 22.238 -7.484 40.781 1.00 55.82 ? 1022 LYS C CE 1 ATOM 10936 N NZ . LYS C 1 714 ? 23.074 -8.714 40.838 1.00 58.79 ? 1022 LYS C NZ 1 ATOM 10937 N N . PRO C 1 715 ? 15.431 -6.525 40.026 1.00 33.51 ? 1023 PRO C N 1 ATOM 10938 C CA . PRO C 1 715 ? 14.000 -6.859 40.088 1.00 31.25 ? 1023 PRO C CA 1 ATOM 10939 C C . PRO C 1 715 ? 13.623 -7.772 41.256 1.00 32.24 ? 1023 PRO C C 1 ATOM 10940 O O . PRO C 1 715 ? 14.398 -8.644 41.648 1.00 32.12 ? 1023 PRO C O 1 ATOM 10941 C CB . PRO C 1 715 ? 13.760 -7.580 38.759 1.00 30.45 ? 1023 PRO C CB 1 ATOM 10942 C CG . PRO C 1 715 ? 14.742 -6.955 37.832 1.00 30.84 ? 1023 PRO C CG 1 ATOM 10943 C CD . PRO C 1 715 ? 15.972 -6.687 38.664 1.00 32.04 ? 1023 PRO C CD 1 ATOM 10944 N N . ASP C 1 716 ? 12.438 -7.552 41.812 1.00 32.17 ? 1024 ASP C N 1 ATOM 10945 C CA . ASP C 1 716 ? 11.894 -8.425 42.845 1.00 34.14 ? 1024 ASP C CA 1 ATOM 10946 C C . ASP C 1 716 ? 10.396 -8.506 42.611 1.00 29.46 ? 1024 ASP C C 1 ATOM 10947 O O . ASP C 1 716 ? 9.844 -7.679 41.882 1.00 28.86 ? 1024 ASP C O 1 ATOM 10948 C CB . ASP C 1 716 ? 12.178 -7.862 44.236 1.00 38.56 ? 1024 ASP C CB 1 ATOM 10949 C CG . ASP C 1 716 ? 12.239 -8.941 45.303 1.00 43.96 ? 1024 ASP C CG 1 ATOM 10950 O OD1 . ASP C 1 716 ? 11.751 -10.068 45.058 1.00 42.16 ? 1024 ASP C OD1 1 ATOM 10951 O OD2 . ASP C 1 716 ? 12.779 -8.660 46.393 1.00 48.05 ? 1024 ASP C OD2 1 ATOM 10952 N N . HIS C 1 717 ? 9.739 -9.491 43.219 1.00 25.70 ? 1025 HIS C N 1 ATOM 10953 C CA . HIS C 1 717 ? 8.300 -9.664 43.027 1.00 28.72 ? 1025 HIS C CA 1 ATOM 10954 C C . HIS C 1 717 ? 7.539 -8.405 43.435 1.00 29.85 ? 1025 HIS C C 1 ATOM 10955 O O . HIS C 1 717 ? 7.824 -7.805 44.470 1.00 31.85 ? 1025 HIS C O 1 ATOM 10956 C CB . HIS C 1 717 ? 7.767 -10.860 43.824 1.00 28.17 ? 1025 HIS C CB 1 ATOM 10957 C CG . HIS C 1 717 ? 8.473 -12.149 43.538 1.00 28.38 ? 1025 HIS C CG 1 ATOM 10958 N ND1 . HIS C 1 717 ? 8.355 -12.815 42.336 1.00 27.96 ? 1025 HIS C ND1 1 ATOM 10959 C CD2 . HIS C 1 717 ? 9.287 -12.909 44.311 1.00 29.79 ? 1025 HIS C CD2 1 ATOM 10960 C CE1 . HIS C 1 717 ? 9.075 -13.922 42.376 1.00 28.83 ? 1025 HIS C CE1 1 ATOM 10961 N NE2 . HIS C 1 717 ? 9.654 -14.001 43.562 1.00 29.44 ? 1025 HIS C NE2 1 ATOM 10962 N N . MET C 1 718 ? 6.587 -8.004 42.600 1.00 31.35 ? 1026 MET C N 1 ATOM 10963 C CA . MET C 1 718 ? 5.700 -6.890 42.905 1.00 33.76 ? 1026 MET C CA 1 ATOM 10964 C C . MET C 1 718 ? 4.308 -7.453 43.159 1.00 36.64 ? 1026 MET C C 1 ATOM 10965 O O . MET C 1 718 ? 3.444 -7.411 42.282 1.00 33.20 ? 1026 MET C O 1 ATOM 10966 C CB . MET C 1 718 ? 5.655 -5.909 41.733 1.00 31.93 ? 1026 MET C CB 1 ATOM 10967 C CG . MET C 1 718 ? 7.000 -5.309 41.357 1.00 35.84 ? 1026 MET C CG 1 ATOM 10968 S SD . MET C 1 718 ? 7.598 -4.096 42.558 1.00 51.37 ? 1026 MET C SD 1 ATOM 10969 C CE . MET C 1 718 ? 9.273 -3.862 41.977 1.00 49.75 ? 1026 MET C CE 1 ATOM 10970 N N . ILE C 1 719 ? 4.098 -7.988 44.357 1.00 40.63 ? 1027 ILE C N 1 ATOM 10971 C CA . ILE C 1 719 ? 2.888 -8.749 44.647 1.00 45.72 ? 1027 ILE C CA 1 ATOM 10972 C C . ILE C 1 719 ? 1.988 -8.097 45.696 1.00 53.46 ? 1027 ILE C C 1 ATOM 10973 O O . ILE C 1 719 ? 1.197 -8.777 46.351 1.00 54.21 ? 1027 ILE C O 1 ATOM 10974 C CB . ILE C 1 719 ? 3.228 -10.190 45.085 1.00 44.69 ? 1027 ILE C CB 1 ATOM 10975 C CG1 . ILE C 1 719 ? 4.199 -10.177 46.266 1.00 44.50 ? 1027 ILE C CG1 1 ATOM 10976 C CG2 . ILE C 1 719 ? 3.828 -10.972 43.926 1.00 42.89 ? 1027 ILE C CG2 1 ATOM 10977 C CD1 . ILE C 1 719 ? 4.593 -11.560 46.743 1.00 45.87 ? 1027 ILE C CD1 1 ATOM 10978 N N . LYS C 1 720 ? 2.109 -6.782 45.847 1.00 60.17 ? 1028 LYS C N 1 ATOM 10979 C CA . LYS C 1 720 ? 1.249 -6.034 46.760 1.00 65.87 ? 1028 LYS C CA 1 ATOM 10980 C C . LYS C 1 720 ? 0.791 -4.719 46.141 1.00 67.44 ? 1028 LYS C C 1 ATOM 10981 O O . LYS C 1 720 ? -0.405 -4.436 46.079 1.00 68.32 ? 1028 LYS C O 1 ATOM 10982 C CB . LYS C 1 720 ? 1.959 -5.771 48.089 1.00 70.30 ? 1028 LYS C CB 1 ATOM 10983 C CG . LYS C 1 720 ? 2.066 -6.991 48.988 1.00 74.03 ? 1028 LYS C CG 1 ATOM 10984 C CD . LYS C 1 720 ? 2.841 -6.673 50.253 1.00 78.81 ? 1028 LYS C CD 1 ATOM 10985 C CE . LYS C 1 720 ? 2.202 -5.524 51.014 1.00 81.96 ? 1028 LYS C CE 1 ATOM 10986 N NZ . LYS C 1 720 ? 2.983 -5.161 52.229 1.00 85.01 ? 1028 LYS C NZ 1 ATOM 10987 N N . TYR D 2 1 ? -12.029 -17.979 9.276 1.00 19.22 ? 13 TYR D N 1 ATOM 10988 C CA . TYR D 2 1 ? -13.350 -18.462 8.883 1.00 21.64 ? 13 TYR D CA 1 ATOM 10989 C C . TYR D 2 1 ? -13.373 -18.748 7.383 1.00 22.32 ? 13 TYR D C 1 ATOM 10990 O O . TYR D 2 1 ? -12.590 -18.169 6.628 1.00 24.55 ? 13 TYR D O 1 ATOM 10991 C CB . TYR D 2 1 ? -14.433 -17.442 9.261 1.00 18.18 ? 13 TYR D CB 1 ATOM 10992 C CG . TYR D 2 1 ? -14.313 -16.102 8.565 1.00 18.59 ? 13 TYR D CG 1 ATOM 10993 C CD1 . TYR D 2 1 ? -15.023 -15.836 7.399 1.00 18.15 ? 13 TYR D CD1 1 ATOM 10994 C CD2 . TYR D 2 1 ? -13.511 -15.096 9.087 1.00 19.37 ? 13 TYR D CD2 1 ATOM 10995 C CE1 . TYR D 2 1 ? -14.926 -14.607 6.764 1.00 24.28 ? 13 TYR D CE1 1 ATOM 10996 C CE2 . TYR D 2 1 ? -13.404 -13.865 8.455 1.00 21.39 ? 13 TYR D CE2 1 ATOM 10997 C CZ . TYR D 2 1 ? -14.117 -13.627 7.297 1.00 22.89 ? 13 TYR D CZ 1 ATOM 10998 O OH . TYR D 2 1 ? -14.017 -12.401 6.671 1.00 23.86 ? 13 TYR D OH 1 ATOM 10999 N N . PRO D 2 2 ? -14.258 -19.657 6.947 1.00 21.86 ? 14 PRO D N 1 ATOM 11000 C CA . PRO D 2 2 ? -14.287 -20.036 5.528 1.00 25.15 ? 14 PRO D CA 1 ATOM 11001 C C . PRO D 2 2 ? -14.553 -18.835 4.623 1.00 26.90 ? 14 PRO D C 1 ATOM 11002 O O . PRO D 2 2 ? -15.556 -18.149 4.795 1.00 29.25 ? 14 PRO D O 1 ATOM 11003 C CB . PRO D 2 2 ? -15.458 -21.021 5.454 1.00 25.41 ? 14 PRO D CB 1 ATOM 11004 C CG . PRO D 2 2 ? -15.573 -21.572 6.849 1.00 25.14 ? 14 PRO D CG 1 ATOM 11005 C CD . PRO D 2 2 ? -15.242 -20.415 7.742 1.00 23.56 ? 14 PRO D CD 1 ATOM 11006 N N . GLY D 2 3 ? -13.656 -18.587 3.678 1.00 28.75 ? 15 GLY D N 1 ATOM 11007 C CA . GLY D 2 3 ? -13.782 -17.443 2.794 1.00 29.42 ? 15 GLY D CA 1 ATOM 11008 C C . GLY D 2 3 ? -13.027 -16.235 3.318 1.00 29.10 ? 15 GLY D C 1 ATOM 11009 O O . GLY D 2 3 ? -12.988 -15.184 2.675 1.00 32.85 ? 15 GLY D O 1 ATOM 11010 N N . GLY D 2 4 ? -12.424 -16.388 4.491 1.00 22.13 ? 16 GLY D N 1 ATOM 11011 C CA . GLY D 2 4 ? -11.704 -15.306 5.128 1.00 21.61 ? 16 GLY D CA 1 ATOM 11012 C C . GLY D 2 4 ? -10.528 -15.838 5.915 1.00 26.44 ? 16 GLY D C 1 ATOM 11013 O O . GLY D 2 4 ? -9.870 -16.794 5.496 1.00 27.77 ? 16 GLY D O 1 ATOM 11014 N N . SER D 2 5 ? -10.263 -15.223 7.061 1.00 25.15 ? 17 SER D N 1 ATOM 11015 C CA . SER D 2 5 ? -9.189 -15.679 7.927 1.00 26.55 ? 17 SER D CA 1 ATOM 11016 C C . SER D 2 5 ? -9.504 -15.393 9.386 1.00 25.27 ? 17 SER D C 1 ATOM 11017 O O . SER D 2 5 ? -10.146 -14.398 9.726 1.00 24.09 ? 17 SER D O 1 ATOM 11018 C CB . SER D 2 5 ? -7.851 -15.048 7.533 1.00 34.75 ? 17 SER D CB 1 ATOM 11019 O OG . SER D 2 5 ? -7.894 -13.637 7.631 1.00 38.73 ? 17 SER D OG 1 ATOM 11020 N N . THR D 2 6 ? -9.063 -16.297 10.245 1.00 18.83 ? 18 THR D N 1 ATOM 11021 C CA . THR D 2 6 ? -9.211 -16.119 11.670 1.00 18.19 ? 18 THR D CA 1 ATOM 11022 C C . THR D 2 6 ? -7.830 -16.336 12.273 1.00 19.88 ? 18 THR D C 1 ATOM 11023 O O . THR D 2 6 ? -7.366 -17.476 12.392 1.00 16.61 ? 18 THR D O 1 ATOM 11024 C CB . THR D 2 6 ? -10.253 -17.103 12.243 1.00 19.04 ? 18 THR D CB 1 ATOM 11025 O OG1 . THR D 2 6 ? -11.547 -16.789 11.704 1.00 16.60 ? 18 THR D OG1 1 ATOM 11026 C CG2 . THR D 2 6 ? -10.307 -17.014 13.758 1.00 14.92 ? 18 THR D CG2 1 ATOM 11027 N N . PRO D 2 7 ? -7.139 -15.232 12.586 1.00 20.07 ? 19 PRO D N 1 ATOM 11028 C CA . PRO D 2 7 ? -5.821 -15.288 13.226 1.00 17.89 ? 19 PRO D CA 1 ATOM 11029 C C . PRO D 2 7 ? -5.929 -15.850 14.630 1.00 15.33 ? 19 PRO D C 1 ATOM 11030 O O . PRO D 2 7 ? -6.904 -15.570 15.337 1.00 15.81 ? 19 PRO D O 1 ATOM 11031 C CB . PRO D 2 7 ? -5.396 -13.820 13.289 1.00 19.31 ? 19 PRO D CB 1 ATOM 11032 C CG . PRO D 2 7 ? -6.676 -13.035 13.132 1.00 23.05 ? 19 PRO D CG 1 ATOM 11033 C CD . PRO D 2 7 ? -7.527 -13.854 12.235 1.00 18.03 ? 19 PRO D CD 1 ATOM 11034 N N . VAL D 2 8 ? -4.933 -16.632 15.032 1.00 15.02 ? 20 VAL D N 1 ATOM 11035 C CA . VAL D 2 8 ? -4.930 -17.247 16.349 1.00 15.48 ? 20 VAL D CA 1 ATOM 11036 C C . VAL D 2 8 ? -3.547 -17.087 16.962 1.00 14.25 ? 20 VAL D C 1 ATOM 11037 O O . VAL D 2 8 ? -2.600 -16.694 16.275 1.00 15.65 ? 20 VAL D O 1 ATOM 11038 C CB . VAL D 2 8 ? -5.281 -18.740 16.254 1.00 15.88 ? 20 VAL D CB 1 ATOM 11039 C CG1 . VAL D 2 8 ? -6.714 -18.904 15.763 1.00 18.06 ? 20 VAL D CG1 1 ATOM 11040 C CG2 . VAL D 2 8 ? -4.305 -19.450 15.310 1.00 15.72 ? 20 VAL D CG2 1 ATOM 11041 N N . SER D 2 9 ? -3.433 -17.375 18.254 1.00 16.04 ? 21 SER D N 1 ATOM 11042 C CA . SER D 2 9 ? -2.128 -17.383 18.907 1.00 15.16 ? 21 SER D CA 1 ATOM 11043 C C . SER D 2 9 ? -1.369 -18.611 18.423 1.00 18.09 ? 21 SER D C 1 ATOM 11044 O O . SER D 2 9 ? -1.917 -19.705 18.417 1.00 19.91 ? 21 SER D O 1 ATOM 11045 C CB . SER D 2 9 ? -2.275 -17.412 20.433 1.00 18.40 ? 21 SER D CB 1 ATOM 11046 O OG . SER D 2 9 ? -2.597 -16.119 20.946 1.00 21.18 ? 21 SER D OG 1 ATOM 11047 N N . SER D 2 10 ? -0.123 -18.442 17.989 1.00 18.75 ? 22 SER D N 1 ATOM 11048 C CA . SER D 2 10 ? 0.623 -19.587 17.468 1.00 22.48 ? 22 SER D CA 1 ATOM 11049 C C . SER D 2 10 ? 2.126 -19.512 17.703 1.00 22.09 ? 22 SER D C 1 ATOM 11050 O O . SER D 2 10 ? 2.690 -18.434 17.873 1.00 21.02 ? 22 SER D O 1 ATOM 11051 C CB . SER D 2 10 ? 0.315 -19.822 15.987 1.00 29.32 ? 22 SER D CB 1 ATOM 11052 O OG . SER D 2 10 ? 0.367 -18.620 15.247 1.00 31.89 ? 22 SER D OG 1 ATOM 11053 N N . ALA D 2 11 ? 2.768 -20.675 17.695 1.00 20.54 ? 23 ALA D N 1 ATOM 11054 C CA . ALA D 2 11 ? 4.180 -20.778 18.052 1.00 23.10 ? 23 ALA D CA 1 ATOM 11055 C C . ALA D 2 11 ? 5.065 -20.183 16.972 1.00 22.71 ? 23 ALA D C 1 ATOM 11056 O O . ALA D 2 11 ? 4.710 -20.205 15.796 1.00 25.17 ? 23 ALA D O 1 ATOM 11057 C CB . ALA D 2 11 ? 4.555 -22.240 18.279 1.00 24.01 ? 23 ALA D CB 1 ATOM 11058 N N . ASN D 2 12 ? 6.222 -19.662 17.368 1.00 22.13 ? 24 ASN D N 1 ATOM 11059 C CA . ASN D 2 12 ? 7.224 -19.260 16.385 1.00 25.93 ? 24 ASN D CA 1 ATOM 11060 C C . ASN D 2 12 ? 8.021 -20.466 15.887 1.00 28.75 ? 24 ASN D C 1 ATOM 11061 O O . ASN D 2 12 ? 8.109 -21.485 16.572 1.00 26.32 ? 24 ASN D O 1 ATOM 11062 C CB . ASN D 2 12 ? 8.146 -18.163 16.932 1.00 26.96 ? 24 ASN D CB 1 ATOM 11063 C CG . ASN D 2 12 ? 9.005 -18.630 18.092 1.00 28.73 ? 24 ASN D CG 1 ATOM 11064 O OD1 . ASN D 2 12 ? 8.690 -19.606 18.770 1.00 27.64 ? 24 ASN D OD1 1 ATOM 11065 N ND2 . ASN D 2 12 ? 10.103 -17.920 18.327 1.00 30.66 ? 24 ASN D ND2 1 ATOM 11066 N N . MET D 2 13 ? 8.584 -20.357 14.688 1.00 31.98 ? 25 MET D N 1 ATOM 11067 C CA . MET D 2 13 ? 9.325 -21.464 14.097 1.00 40.67 ? 25 MET D CA 1 ATOM 11068 C C . MET D 2 13 ? 10.607 -21.726 14.883 1.00 45.42 ? 25 MET D C 1 ATOM 11069 O O . MET D 2 13 ? 11.174 -20.807 15.473 1.00 45.09 ? 25 MET D O 1 ATOM 11070 C CB . MET D 2 13 ? 9.657 -21.166 12.633 1.00 46.21 ? 25 MET D CB 1 ATOM 11071 C CG . MET D 2 13 ? 9.499 -22.366 11.701 1.00 51.34 ? 25 MET D CG 1 ATOM 11072 S SD . MET D 2 13 ? 7.925 -22.348 10.815 1.00 96.20 ? 25 MET D SD 1 ATOM 11073 C CE . MET D 2 13 ? 8.243 -21.079 9.589 1.00 79.54 ? 25 MET D CE 1 ATOM 11074 N N . MET D 2 14 ? 11.055 -22.980 14.898 1.00 49.63 ? 26 MET D N 1 ATOM 11075 C CA . MET D 2 14 ? 12.306 -23.333 15.570 1.00 53.19 ? 26 MET D CA 1 ATOM 11076 C C . MET D 2 14 ? 13.102 -24.373 14.783 1.00 59.11 ? 26 MET D C 1 ATOM 11077 O O . MET D 2 14 ? 12.604 -24.955 13.819 1.00 60.01 ? 26 MET D O 1 ATOM 11078 C CB . MET D 2 14 ? 12.045 -23.832 16.996 1.00 53.12 ? 26 MET D CB 1 ATOM 11079 C CG . MET D 2 14 ? 11.338 -25.180 17.078 1.00 55.61 ? 26 MET D CG 1 ATOM 11080 S SD . MET D 2 14 ? 11.312 -25.851 18.758 1.00 53.17 ? 26 MET D SD 1 ATOM 11081 C CE . MET D 2 14 ? 10.248 -27.276 18.546 1.00 45.35 ? 26 MET D CE 1 HETATM 11082 N N1 . UDP E 3 . ? -15.268 27.693 14.453 1.00 13.79 ? 1101 UDP A N1 1 HETATM 11083 C C2 . UDP E 3 . ? -14.135 27.222 15.072 1.00 14.57 ? 1101 UDP A C2 1 HETATM 11084 N N3 . UDP E 3 . ? -13.557 27.967 16.073 1.00 12.87 ? 1101 UDP A N3 1 HETATM 11085 C C4 . UDP E 3 . ? -14.105 29.184 16.443 1.00 12.45 ? 1101 UDP A C4 1 HETATM 11086 C C5 . UDP E 3 . ? -15.241 29.669 15.801 1.00 12.51 ? 1101 UDP A C5 1 HETATM 11087 C C6 . UDP E 3 . ? -15.838 28.886 14.817 1.00 10.39 ? 1101 UDP A C6 1 HETATM 11088 O O2 . UDP E 3 . ? -13.656 26.133 14.733 1.00 13.84 ? 1101 UDP A O2 1 HETATM 11089 O O4 . UDP E 3 . ? -13.577 29.844 17.334 1.00 10.10 ? 1101 UDP A O4 1 HETATM 11090 C "C1'" . UDP E 3 . ? -15.835 26.912 13.349 1.00 14.09 ? 1101 UDP A "C1'" 1 HETATM 11091 C "C2'" . UDP E 3 . ? -17.305 26.568 13.462 1.00 13.92 ? 1101 UDP A "C2'" 1 HETATM 11092 O "O2'" . UDP E 3 . ? -17.528 25.374 14.188 1.00 11.90 ? 1101 UDP A "O2'" 1 HETATM 11093 C "C3'" . UDP E 3 . ? -17.657 26.432 11.990 1.00 13.98 ? 1101 UDP A "C3'" 1 HETATM 11094 C "C4'" . UDP E 3 . ? -16.767 27.457 11.306 1.00 13.96 ? 1101 UDP A "C4'" 1 HETATM 11095 O "O4'" . UDP E 3 . ? -15.719 27.737 12.199 1.00 14.88 ? 1101 UDP A "O4'" 1 HETATM 11096 O "O3'" . UDP E 3 . ? -17.312 25.156 11.504 1.00 14.91 ? 1101 UDP A "O3'" 1 HETATM 11097 C "C5'" . UDP E 3 . ? -17.529 28.739 10.997 1.00 16.56 ? 1101 UDP A "C5'" 1 HETATM 11098 O "O5'" . UDP E 3 . ? -18.012 28.669 9.680 1.00 16.54 ? 1101 UDP A "O5'" 1 HETATM 11099 P PA . UDP E 3 . ? -19.228 29.603 9.183 1.00 16.34 ? 1101 UDP A PA 1 HETATM 11100 O O1A . UDP E 3 . ? -19.410 29.429 7.730 1.00 14.50 ? 1101 UDP A O1A 1 HETATM 11101 O O2A . UDP E 3 . ? -19.006 31.003 9.591 1.00 17.40 ? 1101 UDP A O2A 1 HETATM 11102 O O3A . UDP E 3 . ? -20.411 28.926 10.048 1.00 14.87 ? 1101 UDP A O3A 1 HETATM 11103 P PB . UDP E 3 . ? -21.995 29.024 9.784 1.00 14.78 ? 1101 UDP A PB 1 HETATM 11104 O O1B . UDP E 3 . ? -22.373 30.109 8.840 1.00 14.44 ? 1101 UDP A O1B 1 HETATM 11105 O O2B . UDP E 3 . ? -22.453 27.735 9.239 1.00 13.93 ? 1101 UDP A O2B 1 HETATM 11106 O O3B . UDP E 3 . ? -22.595 29.279 11.111 1.00 17.21 ? 1101 UDP A O3B 1 HETATM 11107 S S . SO4 F 4 . ? -5.659 23.253 -18.735 1.00 66.16 ? 1102 SO4 A S 1 HETATM 11108 O O1 . SO4 F 4 . ? -5.066 23.371 -20.068 1.00 66.40 ? 1102 SO4 A O1 1 HETATM 11109 O O2 . SO4 F 4 . ? -6.866 22.434 -18.814 1.00 67.22 ? 1102 SO4 A O2 1 HETATM 11110 O O3 . SO4 F 4 . ? -4.708 22.634 -17.816 1.00 66.99 ? 1102 SO4 A O3 1 HETATM 11111 O O4 . SO4 F 4 . ? -6.006 24.574 -18.229 1.00 66.76 ? 1102 SO4 A O4 1 HETATM 11112 C C1 . 0YT G 5 . ? -21.524 27.165 6.038 1.00 17.65 ? 101 0YT B C1 1 HETATM 11113 C C2 . 0YT G 5 . ? -22.882 27.781 5.693 1.00 16.94 ? 101 0YT B C2 1 HETATM 11114 N N2 . 0YT G 5 . ? -22.966 29.175 6.100 1.00 20.37 ? 101 0YT B N2 1 HETATM 11115 C C7 . 0YT G 5 . ? -23.201 30.214 5.216 1.00 21.59 ? 101 0YT B C7 1 HETATM 11116 O O7 . 0YT G 5 . ? -23.315 30.030 4.050 1.00 20.86 ? 101 0YT B O7 1 HETATM 11117 C C8 . 0YT G 5 . ? -23.287 31.628 5.807 1.00 20.84 ? 101 0YT B C8 1 HETATM 11118 C C3 . 0YT G 5 . ? -24.070 26.944 6.230 1.00 15.07 ? 101 0YT B C3 1 HETATM 11119 O O3 . 0YT G 5 . ? -25.295 27.520 5.768 1.00 14.55 ? 101 0YT B O3 1 HETATM 11120 C C4 . 0YT G 5 . ? -24.009 25.421 5.924 1.00 19.24 ? 101 0YT B C4 1 HETATM 11121 O O4 . 0YT G 5 . ? -25.162 24.841 6.397 1.00 19.98 ? 101 0YT B O4 1 HETATM 11122 C C5 . 0YT G 5 . ? -22.816 24.728 6.563 1.00 22.65 ? 101 0YT B C5 1 HETATM 11123 C C6 . 0YT G 5 . ? -22.793 23.218 6.341 1.00 26.72 ? 101 0YT B C6 1 HETATM 11124 O O6 . 0YT G 5 . ? -23.147 22.770 5.091 1.00 31.01 ? 101 0YT B O6 1 HETATM 11125 S S5 . 0YT G 5 . ? -21.368 25.378 5.804 1.00 29.14 ? 101 0YT B S5 1 HETATM 11126 S S . SO4 H 4 . ? -13.950 28.183 -6.860 1.00 42.44 ? 102 SO4 B S 1 HETATM 11127 O O1 . SO4 H 4 . ? -13.789 28.731 -8.204 1.00 45.46 ? 102 SO4 B O1 1 HETATM 11128 O O2 . SO4 H 4 . ? -14.895 27.073 -6.913 1.00 42.81 ? 102 SO4 B O2 1 HETATM 11129 O O3 . SO4 H 4 . ? -12.661 27.706 -6.361 1.00 45.69 ? 102 SO4 B O3 1 HETATM 11130 O O4 . SO4 H 4 . ? -14.445 29.213 -5.960 1.00 41.75 ? 102 SO4 B O4 1 HETATM 11131 N N1 . UDP I 3 . ? -12.671 -16.582 16.751 1.00 13.30 ? 1101 UDP C N1 1 HETATM 11132 C C2 . UDP I 3 . ? -13.412 -16.114 15.696 1.00 13.44 ? 1101 UDP C C2 1 HETATM 11133 N N3 . UDP I 3 . ? -14.483 -16.842 15.230 1.00 13.38 ? 1101 UDP C N3 1 HETATM 11134 C C4 . UDP I 3 . ? -14.788 -18.059 15.820 1.00 11.41 ? 1101 UDP C C4 1 HETATM 11135 C C5 . UDP I 3 . ? -14.024 -18.543 16.874 1.00 14.38 ? 1101 UDP C C5 1 HETATM 11136 C C6 . UDP I 3 . ? -12.966 -17.777 17.343 1.00 10.70 ? 1101 UDP C C6 1 HETATM 11137 O O2 . UDP I 3 . ? -13.117 -15.034 15.188 1.00 12.46 ? 1101 UDP C O2 1 HETATM 11138 O O4 . UDP I 3 . ? -15.741 -18.712 15.421 1.00 11.36 ? 1101 UDP C O4 1 HETATM 11139 C "C1'" . UDP I 3 . ? -11.498 -15.807 17.192 1.00 16.07 ? 1101 UDP C "C1'" 1 HETATM 11140 C "C2'" . UDP I 3 . ? -11.427 -15.447 18.668 1.00 16.33 ? 1101 UDP C "C2'" 1 HETATM 11141 O "O2'" . UDP I 3 . ? -12.099 -14.243 18.989 1.00 13.19 ? 1101 UDP C "O2'" 1 HETATM 11142 C "C3'" . UDP I 3 . ? -9.924 -15.319 18.856 1.00 14.72 ? 1101 UDP C "C3'" 1 HETATM 11143 C "C4'" . UDP I 3 . ? -9.357 -16.345 17.881 1.00 14.09 ? 1101 UDP C "C4'" 1 HETATM 11144 O "O4'" . UDP I 3 . ? -10.370 -16.630 16.949 1.00 16.21 ? 1101 UDP C "O4'" 1 HETATM 11145 O "O3'" . UDP I 3 . ? -9.473 -14.036 18.476 1.00 15.83 ? 1101 UDP C "O3'" 1 HETATM 11146 C "C5'" . UDP I 3 . ? -8.965 -17.632 18.592 1.00 14.82 ? 1101 UDP C "C5'" 1 HETATM 11147 O "O5'" . UDP I 3 . ? -7.591 -17.551 18.882 1.00 14.22 ? 1101 UDP C "O5'" 1 HETATM 11148 P PA . UDP I 3 . ? -6.941 -18.448 20.043 1.00 16.97 ? 1101 UDP C PA 1 HETATM 11149 O O1A . UDP I 3 . ? -7.370 -19.849 19.856 1.00 18.49 ? 1101 UDP C O1A 1 HETATM 11150 O O2A . UDP I 3 . ? -5.474 -18.269 20.057 1.00 16.23 ? 1101 UDP C O2A 1 HETATM 11151 O O3A . UDP I 3 . ? -7.648 -17.758 21.320 1.00 16.63 ? 1101 UDP C O3A 1 HETATM 11152 P PB . UDP I 3 . ? -7.226 -17.871 22.868 1.00 15.93 ? 1101 UDP C PB 1 HETATM 11153 O O1B . UDP I 3 . ? -6.224 -18.948 23.099 1.00 13.93 ? 1101 UDP C O1B 1 HETATM 11154 O O2B . UDP I 3 . ? -6.678 -16.558 23.268 1.00 13.61 ? 1101 UDP C O2B 1 HETATM 11155 O O3B . UDP I 3 . ? -8.460 -18.165 23.627 1.00 18.54 ? 1101 UDP C O3B 1 HETATM 11156 C C1 . 0YT J 5 . ? -3.570 -16.063 21.963 1.00 16.48 ? 101 0YT D C1 1 HETATM 11157 C C2 . 0YT J 5 . ? -3.029 -16.651 23.264 1.00 15.55 ? 101 0YT D C2 1 HETATM 11158 N N2 . 0YT J 5 . ? -3.403 -18.036 23.440 1.00 18.58 ? 101 0YT D N2 1 HETATM 11159 C C7 . 0YT J 5 . ? -2.499 -19.083 23.588 1.00 20.46 ? 101 0YT D C7 1 HETATM 11160 O O7 . 0YT J 5 . ? -1.322 -18.929 23.538 1.00 19.47 ? 101 0YT D O7 1 HETATM 11161 C C8 . 0YT J 5 . ? -3.099 -20.474 23.797 1.00 19.44 ? 101 0YT D C8 1 HETATM 11162 C C3 . 0YT J 5 . ? -3.421 -15.782 24.488 1.00 14.74 ? 101 0YT D C3 1 HETATM 11163 O O3 . 0YT J 5 . ? -2.824 -16.340 25.653 1.00 14.74 ? 101 0YT D O3 1 HETATM 11164 C C4 . 0YT J 5 . ? -3.079 -14.274 24.369 1.00 17.78 ? 101 0YT D C4 1 HETATM 11165 O O4 . 0YT J 5 . ? -3.357 -13.671 25.590 1.00 19.07 ? 101 0YT D O4 1 HETATM 11166 C C5 . 0YT J 5 . ? -3.862 -13.578 23.272 1.00 24.32 ? 101 0YT D C5 1 HETATM 11167 C C6 . 0YT J 5 . ? -3.592 -12.077 23.173 1.00 27.92 ? 101 0YT D C6 1 HETATM 11168 O O6 . 0YT J 5 . ? -2.376 -11.626 23.635 1.00 31.32 ? 101 0YT D O6 1 HETATM 11169 S S5 . 0YT J 5 . ? -3.349 -14.281 21.744 1.00 28.06 ? 101 0YT D S5 1 HETATM 11170 S S . SO4 K 4 . ? 8.373 -17.127 12.892 1.00 43.34 ? 102 SO4 D S 1 HETATM 11171 O O1 . SO4 K 4 . ? 9.708 -17.604 12.550 1.00 47.34 ? 102 SO4 D O1 1 HETATM 11172 O O2 . SO4 K 4 . ? 7.713 -16.607 11.697 1.00 45.33 ? 102 SO4 D O2 1 HETATM 11173 O O3 . SO4 K 4 . ? 7.579 -18.229 13.412 1.00 45.07 ? 102 SO4 D O3 1 HETATM 11174 O O4 . SO4 K 4 . ? 8.496 -16.080 13.896 1.00 41.58 ? 102 SO4 D O4 1 HETATM 11175 O O . HOH L 6 . ? -30.447 40.989 37.704 1.00 20.44 ? 1201 HOH A O 1 HETATM 11176 O O . HOH L 6 . ? -23.735 16.565 33.401 1.00 18.66 ? 1202 HOH A O 1 HETATM 11177 O O . HOH L 6 . ? -7.260 15.396 25.096 1.00 24.04 ? 1203 HOH A O 1 HETATM 11178 O O . HOH L 6 . ? -20.095 32.462 11.537 1.00 16.64 ? 1204 HOH A O 1 HETATM 11179 O O . HOH L 6 . ? -10.465 26.008 27.123 1.00 13.40 ? 1205 HOH A O 1 HETATM 11180 O O . HOH L 6 . ? -17.976 36.755 16.972 1.00 16.59 ? 1206 HOH A O 1 HETATM 11181 O O . HOH L 6 . ? -22.247 25.440 31.305 1.00 20.09 ? 1207 HOH A O 1 HETATM 11182 O O . HOH L 6 . ? -24.983 14.573 16.404 1.00 13.61 ? 1208 HOH A O 1 HETATM 11183 O O . HOH L 6 . ? -8.649 30.519 22.264 1.00 19.91 ? 1209 HOH A O 1 HETATM 11184 O O . HOH L 6 . ? -19.428 27.490 20.094 1.00 25.30 ? 1210 HOH A O 1 HETATM 11185 O O . HOH L 6 . ? -13.993 21.388 30.088 1.00 17.32 ? 1211 HOH A O 1 HETATM 11186 O O . HOH L 6 . ? -8.558 35.018 15.626 1.00 12.08 ? 1212 HOH A O 1 HETATM 11187 O O . HOH L 6 . ? -6.371 12.803 23.582 1.00 16.28 ? 1213 HOH A O 1 HETATM 11188 O O . HOH L 6 . ? -14.693 24.790 10.649 1.00 14.84 ? 1214 HOH A O 1 HETATM 11189 O O . HOH L 6 . ? -11.803 21.203 12.432 1.00 16.62 ? 1215 HOH A O 1 HETATM 11190 O O . HOH L 6 . ? -28.000 8.917 15.951 1.00 22.30 ? 1216 HOH A O 1 HETATM 11191 O O . HOH L 6 . ? 2.041 44.942 -6.030 1.00 29.80 ? 1217 HOH A O 1 HETATM 11192 O O . HOH L 6 . ? -38.558 38.136 34.656 1.00 22.77 ? 1218 HOH A O 1 HETATM 11193 O O . HOH L 6 . ? -35.202 4.198 6.576 1.00 29.20 ? 1219 HOH A O 1 HETATM 11194 O O . HOH L 6 . ? -29.020 32.493 -3.508 1.00 21.38 ? 1220 HOH A O 1 HETATM 11195 O O . HOH L 6 . ? -16.671 33.843 5.146 1.00 36.98 ? 1221 HOH A O 1 HETATM 11196 O O . HOH L 6 . ? -12.196 5.795 40.024 1.00 33.66 ? 1222 HOH A O 1 HETATM 11197 O O . HOH L 6 . ? -15.007 16.805 -1.357 1.00 18.96 ? 1223 HOH A O 1 HETATM 11198 O O . HOH L 6 . ? -22.427 6.688 10.042 1.00 20.21 ? 1224 HOH A O 1 HETATM 11199 O O . HOH L 6 . ? -14.601 13.123 13.689 1.00 17.18 ? 1225 HOH A O 1 HETATM 11200 O O . HOH L 6 . ? -31.836 17.716 13.016 1.00 17.37 ? 1226 HOH A O 1 HETATM 11201 O O . HOH L 6 . ? -22.451 31.755 18.881 1.00 31.69 ? 1227 HOH A O 1 HETATM 11202 O O . HOH L 6 . ? -25.593 32.174 16.512 1.00 41.06 ? 1228 HOH A O 1 HETATM 11203 O O . HOH L 6 . ? -7.178 30.340 19.784 1.00 21.81 ? 1229 HOH A O 1 HETATM 11204 O O . HOH L 6 . ? -20.564 43.871 8.860 1.00 20.10 ? 1230 HOH A O 1 HETATM 11205 O O . HOH L 6 . ? -10.046 9.108 20.659 1.00 20.84 ? 1231 HOH A O 1 HETATM 11206 O O . HOH L 6 . ? 7.472 42.622 -17.606 1.00 27.49 ? 1232 HOH A O 1 HETATM 11207 O O . HOH L 6 . ? -4.777 28.404 23.111 1.00 22.89 ? 1233 HOH A O 1 HETATM 11208 O O . HOH L 6 . ? -13.028 20.998 2.284 1.00 33.95 ? 1234 HOH A O 1 HETATM 11209 O O . HOH L 6 . ? -23.387 13.521 10.803 1.00 14.95 ? 1235 HOH A O 1 HETATM 11210 O O . HOH L 6 . ? -5.105 8.839 32.935 1.00 22.17 ? 1236 HOH A O 1 HETATM 11211 O O . HOH L 6 . ? -30.722 33.160 2.315 1.00 22.00 ? 1237 HOH A O 1 HETATM 11212 O O . HOH L 6 . ? -30.731 22.811 2.305 1.00 17.85 ? 1238 HOH A O 1 HETATM 11213 O O . HOH L 6 . ? -20.912 8.107 7.084 1.00 18.06 ? 1239 HOH A O 1 HETATM 11214 O O . HOH L 6 . ? -19.824 18.943 14.537 1.00 20.34 ? 1240 HOH A O 1 HETATM 11215 O O . HOH L 6 . ? -15.982 38.769 9.094 1.00 14.51 ? 1241 HOH A O 1 HETATM 11216 O O . HOH L 6 . ? -26.847 23.009 -0.879 1.00 26.53 ? 1242 HOH A O 1 HETATM 11217 O O . HOH L 6 . ? -21.192 14.564 34.920 1.00 25.80 ? 1243 HOH A O 1 HETATM 11218 O O . HOH L 6 . ? -4.294 11.459 24.870 1.00 28.07 ? 1244 HOH A O 1 HETATM 11219 O O . HOH L 6 . ? -24.315 14.892 46.577 1.00 36.35 ? 1245 HOH A O 1 HETATM 11220 O O . HOH L 6 . ? -37.208 41.793 29.664 1.00 23.20 ? 1246 HOH A O 1 HETATM 11221 O O . HOH L 6 . ? -18.463 30.518 13.793 1.00 19.72 ? 1247 HOH A O 1 HETATM 11222 O O . HOH L 6 . ? -11.536 5.362 4.236 1.00 22.29 ? 1248 HOH A O 1 HETATM 11223 O O . HOH L 6 . ? -41.308 20.931 8.436 1.00 18.96 ? 1249 HOH A O 1 HETATM 11224 O O . HOH L 6 . ? -21.167 46.247 3.463 1.00 23.60 ? 1250 HOH A O 1 HETATM 11225 O O . HOH L 6 . ? -20.665 40.157 -3.693 1.00 21.19 ? 1251 HOH A O 1 HETATM 11226 O O . HOH L 6 . ? -11.581 35.809 34.802 1.00 42.22 ? 1252 HOH A O 1 HETATM 11227 O O . HOH L 6 . ? -19.925 21.730 13.896 1.00 18.69 ? 1253 HOH A O 1 HETATM 11228 O O . HOH L 6 . ? -14.187 11.795 11.380 1.00 17.56 ? 1254 HOH A O 1 HETATM 11229 O O . HOH L 6 . ? -37.388 29.669 11.331 1.00 27.99 ? 1255 HOH A O 1 HETATM 11230 O O . HOH L 6 . ? -10.047 22.971 13.988 1.00 18.35 ? 1256 HOH A O 1 HETATM 11231 O O . HOH L 6 . ? -27.059 40.252 12.431 1.00 14.49 ? 1257 HOH A O 1 HETATM 11232 O O . HOH L 6 . ? -27.700 26.750 35.335 1.00 29.43 ? 1258 HOH A O 1 HETATM 11233 O O . HOH L 6 . ? -10.753 16.142 1.504 1.00 21.16 ? 1259 HOH A O 1 HETATM 11234 O O . HOH L 6 . ? -6.935 9.519 13.889 1.00 26.51 ? 1260 HOH A O 1 HETATM 11235 O O . HOH L 6 . ? -20.377 25.967 22.064 1.00 19.80 ? 1261 HOH A O 1 HETATM 11236 O O . HOH L 6 . ? -41.447 28.279 15.661 1.00 33.50 ? 1262 HOH A O 1 HETATM 11237 O O . HOH L 6 . ? -31.532 48.031 16.310 1.00 24.14 ? 1263 HOH A O 1 HETATM 11238 O O . HOH L 6 . ? -40.748 14.666 -10.224 1.00 33.37 ? 1264 HOH A O 1 HETATM 11239 O O . HOH L 6 . ? 1.097 27.244 -21.081 1.00 25.70 ? 1265 HOH A O 1 HETATM 11240 O O . HOH L 6 . ? -29.744 25.364 3.085 1.00 30.52 ? 1266 HOH A O 1 HETATM 11241 O O . HOH L 6 . ? -33.674 32.672 13.199 1.00 16.77 ? 1267 HOH A O 1 HETATM 11242 O O . HOH L 6 . ? -9.457 22.104 20.836 1.00 27.87 ? 1268 HOH A O 1 HETATM 11243 O O . HOH L 6 . ? -15.861 6.935 33.558 1.00 20.67 ? 1269 HOH A O 1 HETATM 11244 O O . HOH L 6 . ? -15.779 30.117 20.317 1.00 16.52 ? 1270 HOH A O 1 HETATM 11245 O O . HOH L 6 . ? -30.714 15.391 19.709 1.00 21.15 ? 1271 HOH A O 1 HETATM 11246 O O . HOH L 6 . ? -37.876 23.208 13.139 1.00 23.32 ? 1272 HOH A O 1 HETATM 11247 O O . HOH L 6 . ? -34.609 17.896 12.938 1.00 27.00 ? 1273 HOH A O 1 HETATM 11248 O O . HOH L 6 . ? -29.307 24.169 -0.134 1.00 25.62 ? 1274 HOH A O 1 HETATM 11249 O O . HOH L 6 . ? -21.220 54.976 -1.394 1.00 42.82 ? 1275 HOH A O 1 HETATM 11250 O O . HOH L 6 . ? 2.925 29.090 -21.540 1.00 30.20 ? 1276 HOH A O 1 HETATM 11251 O O . HOH L 6 . ? -38.918 37.399 13.630 1.00 24.59 ? 1277 HOH A O 1 HETATM 11252 O O . HOH L 6 . ? -36.187 16.902 10.447 1.00 19.76 ? 1278 HOH A O 1 HETATM 11253 O O . HOH L 6 . ? -21.680 20.118 -5.006 1.00 22.05 ? 1279 HOH A O 1 HETATM 11254 O O . HOH L 6 . ? -31.545 4.621 7.819 1.00 21.70 ? 1280 HOH A O 1 HETATM 11255 O O . HOH L 6 . ? -20.941 42.477 -2.454 1.00 21.81 ? 1281 HOH A O 1 HETATM 11256 O O . HOH L 6 . ? -14.157 13.637 17.341 1.00 18.38 ? 1282 HOH A O 1 HETATM 11257 O O . HOH L 6 . ? -12.651 23.962 12.065 1.00 21.05 ? 1283 HOH A O 1 HETATM 11258 O O . HOH L 6 . ? -18.806 49.951 -1.397 1.00 33.06 ? 1284 HOH A O 1 HETATM 11259 O O . HOH L 6 . ? -26.959 24.352 29.946 1.00 18.29 ? 1285 HOH A O 1 HETATM 11260 O O . HOH L 6 . ? -30.049 50.612 32.485 1.00 30.46 ? 1286 HOH A O 1 HETATM 11261 O O . HOH L 6 . ? -31.029 36.317 15.384 1.00 23.48 ? 1287 HOH A O 1 HETATM 11262 O O . HOH L 6 . ? -14.027 21.820 -7.196 1.00 26.31 ? 1288 HOH A O 1 HETATM 11263 O O . HOH L 6 . ? -17.962 14.630 30.470 1.00 19.94 ? 1289 HOH A O 1 HETATM 11264 O O . HOH L 6 . ? -24.471 -0.374 7.113 1.00 30.77 ? 1290 HOH A O 1 HETATM 11265 O O . HOH L 6 . ? -14.930 36.675 7.560 1.00 19.97 ? 1291 HOH A O 1 HETATM 11266 O O . HOH L 6 . ? -16.768 25.273 0.047 1.00 21.02 ? 1292 HOH A O 1 HETATM 11267 O O . HOH L 6 . ? -6.308 36.792 23.337 1.00 22.62 ? 1293 HOH A O 1 HETATM 11268 O O . HOH L 6 . ? -39.943 21.558 14.256 1.00 31.92 ? 1294 HOH A O 1 HETATM 11269 O O . HOH L 6 . ? 9.373 47.393 -10.897 1.00 32.37 ? 1295 HOH A O 1 HETATM 11270 O O . HOH L 6 . ? -23.858 12.079 15.115 1.00 33.99 ? 1296 HOH A O 1 HETATM 11271 O O . HOH L 6 . ? -17.948 46.214 -13.219 1.00 30.08 ? 1297 HOH A O 1 HETATM 11272 O O . HOH L 6 . ? -34.209 36.081 -0.539 1.00 36.57 ? 1298 HOH A O 1 HETATM 11273 O O . HOH L 6 . ? -13.308 18.966 -8.807 1.00 28.66 ? 1299 HOH A O 1 HETATM 11274 O O . HOH L 6 . ? -12.717 16.453 19.343 1.00 23.13 ? 1300 HOH A O 1 HETATM 11275 O O . HOH L 6 . ? -4.750 24.342 21.659 1.00 21.55 ? 1301 HOH A O 1 HETATM 11276 O O . HOH L 6 . ? 0.103 13.985 24.391 1.00 33.58 ? 1302 HOH A O 1 HETATM 11277 O O . HOH L 6 . ? -21.577 21.700 -7.269 1.00 24.87 ? 1303 HOH A O 1 HETATM 11278 O O . HOH L 6 . ? -11.785 11.609 29.640 1.00 25.68 ? 1304 HOH A O 1 HETATM 11279 O O . HOH L 6 . ? -35.181 34.915 39.431 1.00 21.93 ? 1305 HOH A O 1 HETATM 11280 O O . HOH L 6 . ? -18.674 26.681 37.566 1.00 21.70 ? 1306 HOH A O 1 HETATM 11281 O O . HOH L 6 . ? -7.298 24.332 22.943 1.00 22.35 ? 1307 HOH A O 1 HETATM 11282 O O . HOH L 6 . ? -11.776 9.249 18.334 1.00 27.07 ? 1308 HOH A O 1 HETATM 11283 O O . HOH L 6 . ? -29.110 35.134 -4.471 1.00 35.29 ? 1309 HOH A O 1 HETATM 11284 O O . HOH L 6 . ? -2.494 6.868 35.711 1.00 30.10 ? 1310 HOH A O 1 HETATM 11285 O O . HOH L 6 . ? -6.425 28.023 21.288 1.00 19.24 ? 1311 HOH A O 1 HETATM 11286 O O . HOH L 6 . ? -40.787 22.080 10.968 1.00 26.78 ? 1312 HOH A O 1 HETATM 11287 O O . HOH L 6 . ? -12.308 12.823 27.270 1.00 18.65 ? 1313 HOH A O 1 HETATM 11288 O O . HOH L 6 . ? -43.405 26.392 16.174 1.00 43.97 ? 1314 HOH A O 1 HETATM 11289 O O . HOH L 6 . ? -21.208 56.944 8.783 1.00 30.15 ? 1315 HOH A O 1 HETATM 11290 O O . HOH L 6 . ? -35.538 2.731 4.441 1.00 32.59 ? 1316 HOH A O 1 HETATM 11291 O O . HOH L 6 . ? -27.489 25.928 4.865 1.00 24.38 ? 1317 HOH A O 1 HETATM 11292 O O . HOH L 6 . ? -25.604 30.015 34.295 1.00 21.26 ? 1318 HOH A O 1 HETATM 11293 O O . HOH L 6 . ? 0.620 16.601 38.264 1.00 41.00 ? 1319 HOH A O 1 HETATM 11294 O O . HOH L 6 . ? -0.568 16.039 18.696 1.00 29.55 ? 1320 HOH A O 1 HETATM 11295 O O . HOH L 6 . ? -7.736 33.418 13.381 1.00 26.53 ? 1321 HOH A O 1 HETATM 11296 O O . HOH L 6 . ? 6.356 44.941 -20.591 1.00 37.08 ? 1322 HOH A O 1 HETATM 11297 O O . HOH L 6 . ? -10.286 10.472 -2.473 1.00 28.88 ? 1323 HOH A O 1 HETATM 11298 O O . HOH L 6 . ? -38.216 33.340 37.733 1.00 20.28 ? 1324 HOH A O 1 HETATM 11299 O O . HOH L 6 . ? -18.140 9.144 19.420 1.00 33.69 ? 1325 HOH A O 1 HETATM 11300 O O . HOH L 6 . ? -23.805 23.939 30.051 1.00 29.65 ? 1326 HOH A O 1 HETATM 11301 O O . HOH L 6 . ? -8.244 11.202 4.520 1.00 23.19 ? 1327 HOH A O 1 HETATM 11302 O O . HOH L 6 . ? -25.007 44.326 5.623 1.00 26.26 ? 1328 HOH A O 1 HETATM 11303 O O . HOH L 6 . ? -20.784 20.885 0.550 1.00 24.56 ? 1329 HOH A O 1 HETATM 11304 O O . HOH L 6 . ? -26.228 1.715 7.683 1.00 17.47 ? 1330 HOH A O 1 HETATM 11305 O O . HOH L 6 . ? -41.745 8.108 2.046 1.00 29.76 ? 1331 HOH A O 1 HETATM 11306 O O . HOH L 6 . ? -19.768 12.899 28.527 1.00 29.52 ? 1332 HOH A O 1 HETATM 11307 O O . HOH L 6 . ? -9.426 10.146 30.422 1.00 23.90 ? 1333 HOH A O 1 HETATM 11308 O O . HOH L 6 . ? -3.788 28.633 30.980 1.00 32.19 ? 1334 HOH A O 1 HETATM 11309 O O . HOH L 6 . ? -19.951 25.929 -10.717 1.00 25.85 ? 1335 HOH A O 1 HETATM 11310 O O . HOH L 6 . ? -40.086 14.138 -7.626 1.00 31.54 ? 1336 HOH A O 1 HETATM 11311 O O . HOH L 6 . ? -29.648 24.941 34.617 1.00 27.41 ? 1337 HOH A O 1 HETATM 11312 O O . HOH L 6 . ? -28.116 29.494 35.238 1.00 21.75 ? 1338 HOH A O 1 HETATM 11313 O O . HOH L 6 . ? -23.817 1.624 -10.078 1.00 32.02 ? 1339 HOH A O 1 HETATM 11314 O O . HOH L 6 . ? -42.182 33.754 17.856 1.00 47.31 ? 1340 HOH A O 1 HETATM 11315 O O . HOH L 6 . ? -5.455 33.981 11.974 1.00 37.71 ? 1341 HOH A O 1 HETATM 11316 O O . HOH L 6 . ? 6.428 49.532 -16.328 1.00 27.17 ? 1342 HOH A O 1 HETATM 11317 O O . HOH L 6 . ? -16.210 3.839 9.877 1.00 37.65 ? 1343 HOH A O 1 HETATM 11318 O O . HOH L 6 . ? -30.549 43.272 10.586 1.00 37.12 ? 1344 HOH A O 1 HETATM 11319 O O . HOH L 6 . ? -4.156 10.465 18.835 1.00 24.06 ? 1345 HOH A O 1 HETATM 11320 O O . HOH L 6 . ? -13.013 4.821 28.774 1.00 25.92 ? 1346 HOH A O 1 HETATM 11321 O O . HOH L 6 . ? 2.199 24.995 -22.563 1.00 34.33 ? 1347 HOH A O 1 HETATM 11322 O O . HOH L 6 . ? -41.141 30.052 -7.783 1.00 47.80 ? 1348 HOH A O 1 HETATM 11323 O O . HOH L 6 . ? -16.497 9.058 13.613 1.00 32.68 ? 1349 HOH A O 1 HETATM 11324 O O . HOH L 6 . ? -13.029 30.877 36.016 1.00 25.39 ? 1350 HOH A O 1 HETATM 11325 O O . HOH L 6 . ? -7.819 37.475 12.426 1.00 20.97 ? 1351 HOH A O 1 HETATM 11326 O O . HOH L 6 . ? -33.287 12.049 20.212 1.00 24.88 ? 1352 HOH A O 1 HETATM 11327 O O . HOH L 6 . ? -29.995 2.930 -11.560 1.00 34.42 ? 1353 HOH A O 1 HETATM 11328 O O . HOH L 6 . ? -33.241 14.516 13.496 1.00 30.80 ? 1354 HOH A O 1 HETATM 11329 O O . HOH L 6 . ? -7.040 32.186 23.572 1.00 33.15 ? 1355 HOH A O 1 HETATM 11330 O O . HOH L 6 . ? -12.351 55.531 -3.876 1.00 27.17 ? 1356 HOH A O 1 HETATM 11331 O O . HOH L 6 . ? -27.305 16.699 -20.720 1.00 43.24 ? 1357 HOH A O 1 HETATM 11332 O O . HOH L 6 . ? -26.749 11.093 16.905 1.00 37.86 ? 1358 HOH A O 1 HETATM 11333 O O . HOH L 6 . ? -39.281 12.856 6.190 1.00 30.06 ? 1359 HOH A O 1 HETATM 11334 O O . HOH L 6 . ? -14.896 11.317 15.947 1.00 31.48 ? 1360 HOH A O 1 HETATM 11335 O O . HOH L 6 . ? -0.319 44.692 3.764 1.00 26.82 ? 1361 HOH A O 1 HETATM 11336 O O . HOH L 6 . ? -39.322 36.236 -5.886 1.00 44.10 ? 1362 HOH A O 1 HETATM 11337 O O . HOH L 6 . ? -7.674 12.604 -3.868 1.00 32.06 ? 1363 HOH A O 1 HETATM 11338 O O . HOH L 6 . ? -20.884 25.541 2.198 1.00 29.33 ? 1364 HOH A O 1 HETATM 11339 O O . HOH L 6 . ? -29.382 8.737 -13.881 1.00 34.55 ? 1365 HOH A O 1 HETATM 11340 O O . HOH L 6 . ? -16.916 3.994 -0.169 1.00 32.97 ? 1366 HOH A O 1 HETATM 11341 O O . HOH L 6 . ? -30.579 15.215 -18.887 1.00 29.00 ? 1367 HOH A O 1 HETATM 11342 O O . HOH L 6 . ? -39.219 -0.271 -9.016 1.00 43.20 ? 1368 HOH A O 1 HETATM 11343 O O . HOH L 6 . ? -3.345 15.606 29.515 1.00 28.65 ? 1369 HOH A O 1 HETATM 11344 O O . HOH L 6 . ? -21.379 8.108 13.515 1.00 29.12 ? 1370 HOH A O 1 HETATM 11345 O O . HOH L 6 . ? -6.380 53.769 -1.686 1.00 32.71 ? 1371 HOH A O 1 HETATM 11346 O O . HOH L 6 . ? -31.402 45.067 35.047 1.00 24.05 ? 1372 HOH A O 1 HETATM 11347 O O . HOH L 6 . ? -8.394 42.894 -17.089 1.00 29.41 ? 1373 HOH A O 1 HETATM 11348 O O . HOH L 6 . ? -2.957 13.432 16.978 1.00 30.56 ? 1374 HOH A O 1 HETATM 11349 O O . HOH L 6 . ? -17.853 52.451 -0.228 1.00 37.30 ? 1375 HOH A O 1 HETATM 11350 O O . HOH L 6 . ? -3.637 49.379 -5.889 1.00 30.70 ? 1376 HOH A O 1 HETATM 11351 O O . HOH L 6 . ? -38.336 2.324 4.137 1.00 36.69 ? 1377 HOH A O 1 HETATM 11352 O O . HOH L 6 . ? -28.192 47.811 10.157 1.00 24.84 ? 1378 HOH A O 1 HETATM 11353 O O . HOH L 6 . ? -39.514 29.787 13.235 1.00 36.47 ? 1379 HOH A O 1 HETATM 11354 O O . HOH L 6 . ? -8.799 41.953 22.401 1.00 29.77 ? 1380 HOH A O 1 HETATM 11355 O O . HOH L 6 . ? -13.870 9.343 12.160 1.00 42.57 ? 1381 HOH A O 1 HETATM 11356 O O . HOH L 6 . ? -13.919 5.507 32.468 1.00 23.75 ? 1382 HOH A O 1 HETATM 11357 O O . HOH L 6 . ? -7.949 9.321 -1.317 1.00 36.77 ? 1383 HOH A O 1 HETATM 11358 O O . HOH L 6 . ? -19.801 31.838 6.285 1.00 24.51 ? 1384 HOH A O 1 HETATM 11359 O O . HOH L 6 . ? -9.863 34.836 -12.732 1.00 37.64 ? 1385 HOH A O 1 HETATM 11360 O O . HOH L 6 . ? -28.944 31.160 36.958 1.00 25.52 ? 1386 HOH A O 1 HETATM 11361 O O . HOH L 6 . ? -18.901 52.546 2.226 1.00 32.78 ? 1387 HOH A O 1 HETATM 11362 O O . HOH L 6 . ? -25.422 56.516 4.835 1.00 24.42 ? 1388 HOH A O 1 HETATM 11363 O O . HOH L 6 . ? -28.305 6.657 -15.135 1.00 33.18 ? 1389 HOH A O 1 HETATM 11364 O O . HOH L 6 . ? -12.267 9.144 24.608 1.00 39.00 ? 1390 HOH A O 1 HETATM 11365 O O . HOH L 6 . ? -27.257 43.310 35.851 1.00 24.88 ? 1391 HOH A O 1 HETATM 11366 O O . HOH L 6 . ? -1.436 22.183 39.872 1.00 31.96 ? 1392 HOH A O 1 HETATM 11367 O O . HOH L 6 . ? -16.561 56.105 -14.166 1.00 35.07 ? 1393 HOH A O 1 HETATM 11368 O O . HOH L 6 . ? -32.065 52.032 20.251 1.00 33.40 ? 1394 HOH A O 1 HETATM 11369 O O . HOH L 6 . ? -9.061 6.557 3.287 1.00 39.04 ? 1395 HOH A O 1 HETATM 11370 O O . HOH L 6 . ? -3.726 10.765 15.779 1.00 32.89 ? 1396 HOH A O 1 HETATM 11371 O O . HOH L 6 . ? -17.592 27.106 -8.802 1.00 36.32 ? 1397 HOH A O 1 HETATM 11372 O O . HOH L 6 . ? 2.103 33.252 -33.629 1.00 40.26 ? 1398 HOH A O 1 HETATM 11373 O O . HOH L 6 . ? -21.843 27.843 -10.012 1.00 26.13 ? 1399 HOH A O 1 HETATM 11374 O O . HOH L 6 . ? -24.522 29.487 37.243 1.00 25.32 ? 1400 HOH A O 1 HETATM 11375 O O . HOH L 6 . ? -10.355 36.116 25.575 1.00 21.83 ? 1401 HOH A O 1 HETATM 11376 O O . HOH L 6 . ? -40.980 5.681 3.348 1.00 45.70 ? 1402 HOH A O 1 HETATM 11377 O O . HOH L 6 . ? -11.163 6.857 25.541 1.00 39.53 ? 1403 HOH A O 1 HETATM 11378 O O . HOH L 6 . ? -10.940 40.457 29.935 1.00 31.57 ? 1404 HOH A O 1 HETATM 11379 O O . HOH L 6 . ? -8.721 19.172 -0.366 1.00 33.40 ? 1405 HOH A O 1 HETATM 11380 O O . HOH L 6 . ? -12.389 9.734 14.590 1.00 38.30 ? 1406 HOH A O 1 HETATM 11381 O O . HOH L 6 . ? -22.317 5.851 12.602 1.00 37.15 ? 1407 HOH A O 1 HETATM 11382 O O . HOH L 6 . ? -17.281 9.962 -20.812 1.00 41.49 ? 1408 HOH A O 1 HETATM 11383 O O . HOH L 6 . ? -15.786 21.254 -18.331 1.00 48.03 ? 1409 HOH A O 1 HETATM 11384 O O . HOH L 6 . ? -28.855 45.597 7.677 1.00 38.12 ? 1410 HOH A O 1 HETATM 11385 O O . HOH L 6 . ? -10.493 25.287 -28.380 1.00 47.88 ? 1411 HOH A O 1 HETATM 11386 O O . HOH L 6 . ? -20.069 12.157 34.942 1.00 42.73 ? 1412 HOH A O 1 HETATM 11387 O O . HOH L 6 . ? -1.697 10.518 40.687 1.00 32.72 ? 1413 HOH A O 1 HETATM 11388 O O . HOH L 6 . ? -30.584 51.393 -10.604 1.00 38.70 ? 1414 HOH A O 1 HETATM 11389 O O . HOH L 6 . ? -42.060 31.420 19.042 1.00 41.74 ? 1415 HOH A O 1 HETATM 11390 O O . HOH L 6 . ? -28.027 23.093 32.853 1.00 30.48 ? 1416 HOH A O 1 HETATM 11391 O O . HOH L 6 . ? -37.850 15.210 -11.523 1.00 39.78 ? 1417 HOH A O 1 HETATM 11392 O O . HOH L 6 . ? -5.727 23.061 -24.448 1.00 35.43 ? 1418 HOH A O 1 HETATM 11393 O O . HOH L 6 . ? -11.571 49.098 8.805 1.00 33.91 ? 1419 HOH A O 1 HETATM 11394 O O . HOH L 6 . ? -20.612 4.105 13.730 1.00 38.53 ? 1420 HOH A O 1 HETATM 11395 O O . HOH L 6 . ? 3.578 31.952 -26.580 1.00 30.81 ? 1421 HOH A O 1 HETATM 11396 O O . HOH L 6 . ? -3.015 12.790 42.920 1.00 38.12 ? 1422 HOH A O 1 HETATM 11397 O O . HOH L 6 . ? -37.267 31.174 3.725 1.00 30.56 ? 1423 HOH A O 1 HETATM 11398 O O . HOH L 6 . ? -24.830 19.825 -23.526 1.00 39.49 ? 1424 HOH A O 1 HETATM 11399 O O . HOH L 6 . ? -18.731 35.547 41.467 1.00 33.81 ? 1425 HOH A O 1 HETATM 11400 O O . HOH L 6 . ? -24.271 14.342 35.279 1.00 31.81 ? 1426 HOH A O 1 HETATM 11401 O O . HOH L 6 . ? 7.050 48.521 -18.499 1.00 37.03 ? 1427 HOH A O 1 HETATM 11402 O O . HOH L 6 . ? -27.554 3.290 11.088 1.00 33.85 ? 1428 HOH A O 1 HETATM 11403 O O . HOH L 6 . ? -35.868 1.679 -2.097 1.00 34.05 ? 1429 HOH A O 1 HETATM 11404 O O . HOH L 6 . ? 4.549 30.704 -24.668 1.00 26.57 ? 1430 HOH A O 1 HETATM 11405 O O . HOH L 6 . ? -40.490 2.447 -8.294 1.00 44.09 ? 1431 HOH A O 1 HETATM 11406 O O . HOH L 6 . ? -25.783 23.544 33.058 1.00 33.03 ? 1432 HOH A O 1 HETATM 11407 O O . HOH L 6 . ? -34.868 46.883 25.445 1.00 36.57 ? 1433 HOH A O 1 HETATM 11408 O O . HOH L 6 . ? -8.582 12.037 46.113 1.00 36.26 ? 1434 HOH A O 1 HETATM 11409 O O . HOH L 6 . ? -7.826 39.028 -9.211 1.00 30.63 ? 1435 HOH A O 1 HETATM 11410 O O . HOH L 6 . ? -32.494 7.395 16.336 1.00 25.54 ? 1436 HOH A O 1 HETATM 11411 O O . HOH L 6 . ? -17.998 9.828 32.269 1.00 33.75 ? 1437 HOH A O 1 HETATM 11412 O O . HOH L 6 . ? -30.637 37.754 5.360 1.00 42.57 ? 1438 HOH A O 1 HETATM 11413 O O . HOH L 6 . ? -37.025 36.826 -9.453 1.00 38.46 ? 1439 HOH A O 1 HETATM 11414 O O . HOH L 6 . ? -32.260 1.613 -10.854 1.00 38.62 ? 1440 HOH A O 1 HETATM 11415 O O . HOH L 6 . ? 0.913 15.753 26.351 1.00 31.13 ? 1441 HOH A O 1 HETATM 11416 O O . HOH L 6 . ? -6.217 10.786 9.200 1.00 36.99 ? 1442 HOH A O 1 HETATM 11417 O O . HOH L 6 . ? -31.209 49.731 26.611 1.00 32.76 ? 1443 HOH A O 1 HETATM 11418 O O . HOH L 6 . ? -45.875 27.150 6.143 1.00 32.24 ? 1444 HOH A O 1 HETATM 11419 O O . HOH L 6 . ? -8.699 20.487 4.452 1.00 40.06 ? 1445 HOH A O 1 HETATM 11420 O O . HOH L 6 . ? -34.844 -7.241 1.307 1.00 37.72 ? 1446 HOH A O 1 HETATM 11421 O O . HOH L 6 . ? -47.114 18.044 0.302 1.00 40.74 ? 1447 HOH A O 1 HETATM 11422 O O . HOH L 6 . ? 4.234 35.428 -32.442 1.00 38.37 ? 1448 HOH A O 1 HETATM 11423 O O . HOH L 6 . ? -21.857 30.065 -11.514 1.00 47.39 ? 1449 HOH A O 1 HETATM 11424 O O . HOH L 6 . ? -7.898 5.651 14.667 1.00 35.49 ? 1450 HOH A O 1 HETATM 11425 O O . HOH L 6 . ? -2.675 22.720 15.537 1.00 26.97 ? 1451 HOH A O 1 HETATM 11426 O O . HOH L 6 . ? -2.658 9.481 23.250 1.00 34.70 ? 1452 HOH A O 1 HETATM 11427 O O . HOH L 6 . ? -24.920 0.228 -12.488 1.00 46.56 ? 1453 HOH A O 1 HETATM 11428 O O . HOH L 6 . ? -26.261 21.818 -26.286 1.00 50.42 ? 1454 HOH A O 1 HETATM 11429 O O . HOH L 6 . ? -35.437 27.667 38.125 1.00 31.51 ? 1455 HOH A O 1 HETATM 11430 O O . HOH L 6 . ? -11.230 7.030 21.876 1.00 49.78 ? 1456 HOH A O 1 HETATM 11431 O O . HOH L 6 . ? -31.470 51.918 -4.078 1.00 36.51 ? 1457 HOH A O 1 HETATM 11432 O O . HOH L 6 . ? -15.372 0.349 5.286 1.00 32.76 ? 1458 HOH A O 1 HETATM 11433 O O . HOH L 6 . ? -33.694 0.527 -12.970 1.00 43.37 ? 1459 HOH A O 1 HETATM 11434 O O . HOH L 6 . ? -29.466 12.502 20.359 1.00 27.41 ? 1460 HOH A O 1 HETATM 11435 O O . HOH L 6 . ? -33.796 38.421 10.879 1.00 26.75 ? 1461 HOH A O 1 HETATM 11436 O O . HOH L 6 . ? 3.404 43.590 -33.929 1.00 53.91 ? 1462 HOH A O 1 HETATM 11437 O O . HOH L 6 . ? -37.857 21.331 -11.849 1.00 37.86 ? 1463 HOH A O 1 HETATM 11438 O O . HOH L 6 . ? -41.683 34.276 15.464 1.00 46.80 ? 1464 HOH A O 1 HETATM 11439 O O . HOH L 6 . ? -4.148 26.866 43.469 1.00 37.38 ? 1465 HOH A O 1 HETATM 11440 O O . HOH L 6 . ? -30.852 43.589 13.636 1.00 39.63 ? 1466 HOH A O 1 HETATM 11441 O O . HOH L 6 . ? -38.593 22.631 -9.781 1.00 48.28 ? 1467 HOH A O 1 HETATM 11442 O O . HOH L 6 . ? 8.256 43.476 -28.904 1.00 38.67 ? 1468 HOH A O 1 HETATM 11443 O O . HOH L 6 . ? -32.976 50.809 -1.850 1.00 42.22 ? 1469 HOH A O 1 HETATM 11444 O O . HOH L 6 . ? -7.971 7.532 10.420 1.00 41.75 ? 1470 HOH A O 1 HETATM 11445 O O . HOH L 6 . ? -35.240 34.912 -3.300 1.00 37.31 ? 1471 HOH A O 1 HETATM 11446 O O . HOH L 6 . ? -12.971 5.076 25.951 1.00 46.33 ? 1472 HOH A O 1 HETATM 11447 O O . HOH L 6 . ? -39.421 12.748 17.328 1.00 46.35 ? 1473 HOH A O 1 HETATM 11448 O O . HOH L 6 . ? -40.959 27.159 -5.066 1.00 36.14 ? 1474 HOH A O 1 HETATM 11449 O O . HOH L 6 . ? -17.132 47.916 -15.237 1.00 39.49 ? 1475 HOH A O 1 HETATM 11450 O O . HOH L 6 . ? -44.796 11.023 -3.495 1.00 47.49 ? 1476 HOH A O 1 HETATM 11451 O O . HOH L 6 . ? -21.749 20.928 27.098 1.00 38.11 ? 1477 HOH A O 1 HETATM 11452 O O . HOH L 6 . ? -8.432 9.430 -6.031 1.00 48.35 ? 1478 HOH A O 1 HETATM 11453 O O . HOH L 6 . ? -34.527 25.214 37.438 1.00 39.18 ? 1479 HOH A O 1 HETATM 11454 O O . HOH L 6 . ? -24.641 33.391 35.432 1.00 32.09 ? 1480 HOH A O 1 HETATM 11455 O O . HOH L 6 . ? -28.606 50.909 9.881 1.00 46.26 ? 1481 HOH A O 1 HETATM 11456 O O . HOH L 6 . ? -35.309 15.135 12.159 1.00 24.32 ? 1482 HOH A O 1 HETATM 11457 O O . HOH L 6 . ? -4.812 26.542 19.593 1.00 28.12 ? 1483 HOH A O 1 HETATM 11458 O O . HOH L 6 . ? -9.866 47.907 7.410 1.00 48.20 ? 1484 HOH A O 1 HETATM 11459 O O . HOH L 6 . ? -40.980 31.791 13.856 1.00 36.10 ? 1485 HOH A O 1 HETATM 11460 O O . HOH L 6 . ? -32.557 51.141 -12.591 1.00 46.46 ? 1486 HOH A O 1 HETATM 11461 O O . HOH L 6 . ? -13.641 5.445 9.356 1.00 34.92 ? 1487 HOH A O 1 HETATM 11462 O O . HOH L 6 . ? -33.454 49.884 25.432 1.00 39.28 ? 1488 HOH A O 1 HETATM 11463 O O . HOH L 6 . ? -0.719 48.741 -5.772 1.00 42.95 ? 1489 HOH A O 1 HETATM 11464 O O . HOH L 6 . ? -8.192 52.763 2.581 1.00 39.15 ? 1490 HOH A O 1 HETATM 11465 O O . HOH L 6 . ? -30.890 51.547 28.924 1.00 38.95 ? 1491 HOH A O 1 HETATM 11466 O O . HOH L 6 . ? -19.589 36.690 3.555 1.00 34.30 ? 1492 HOH A O 1 HETATM 11467 O O . HOH L 6 . ? -21.977 40.667 -17.815 1.00 51.59 ? 1493 HOH A O 1 HETATM 11468 O O . HOH L 6 . ? -6.292 17.826 25.594 1.00 35.55 ? 1494 HOH A O 1 HETATM 11469 O O . HOH L 6 . ? -16.342 54.745 0.034 1.00 48.35 ? 1495 HOH A O 1 HETATM 11470 O O . HOH L 6 . ? -9.559 37.584 -18.152 1.00 30.69 ? 1496 HOH A O 1 HETATM 11471 O O . HOH L 6 . ? -19.302 23.404 47.224 1.00 34.75 ? 1497 HOH A O 1 HETATM 11472 O O . HOH L 6 . ? -24.851 19.505 33.930 1.00 40.57 ? 1498 HOH A O 1 HETATM 11473 O O . HOH L 6 . ? -28.226 40.152 36.073 1.00 23.90 ? 1499 HOH A O 1 HETATM 11474 O O . HOH L 6 . ? -37.185 6.085 6.774 1.00 28.41 ? 1500 HOH A O 1 HETATM 11475 O O . HOH L 6 . ? -18.260 22.747 -18.472 1.00 37.40 ? 1501 HOH A O 1 HETATM 11476 O O . HOH L 6 . ? 3.838 21.700 24.535 1.00 49.43 ? 1502 HOH A O 1 HETATM 11477 O O . HOH L 6 . ? 2.950 27.268 29.353 1.00 41.35 ? 1503 HOH A O 1 HETATM 11478 O O . HOH L 6 . ? -7.179 7.128 12.656 1.00 37.72 ? 1504 HOH A O 1 HETATM 11479 O O . HOH L 6 . ? -10.317 6.977 27.874 1.00 34.84 ? 1505 HOH A O 1 HETATM 11480 O O . HOH L 6 . ? -8.000 35.242 24.920 1.00 27.44 ? 1506 HOH A O 1 HETATM 11481 O O . HOH L 6 . ? 9.870 48.295 -19.989 1.00 38.37 ? 1507 HOH A O 1 HETATM 11482 O O . HOH L 6 . ? -21.024 55.567 15.225 1.00 41.34 ? 1508 HOH A O 1 HETATM 11483 O O . HOH L 6 . ? 4.510 38.730 -38.485 1.00 40.42 ? 1509 HOH A O 1 HETATM 11484 O O . HOH L 6 . ? -42.818 23.130 12.764 1.00 42.55 ? 1510 HOH A O 1 HETATM 11485 O O . HOH L 6 . ? 3.590 35.808 -13.475 1.00 36.84 ? 1511 HOH A O 1 HETATM 11486 O O . HOH L 6 . ? -16.335 4.973 38.559 1.00 35.27 ? 1512 HOH A O 1 HETATM 11487 O O . HOH L 6 . ? -26.124 39.285 37.824 1.00 34.22 ? 1513 HOH A O 1 HETATM 11488 O O . HOH L 6 . ? 2.095 26.291 -18.772 1.00 46.50 ? 1514 HOH A O 1 HETATM 11489 O O . HOH L 6 . ? -7.885 10.570 32.486 1.00 35.76 ? 1515 HOH A O 1 HETATM 11490 O O . HOH L 6 . ? -28.171 8.464 -21.914 1.00 42.28 ? 1516 HOH A O 1 HETATM 11491 O O . HOH L 6 . ? 6.690 37.286 -38.056 1.00 35.63 ? 1517 HOH A O 1 HETATM 11492 O O . HOH L 6 . ? -30.617 21.615 -17.957 1.00 44.94 ? 1518 HOH A O 1 HETATM 11493 O O . HOH L 6 . ? -41.154 20.762 16.699 1.00 42.66 ? 1519 HOH A O 1 HETATM 11494 O O . HOH L 6 . ? -33.064 36.445 39.827 1.00 23.21 ? 1520 HOH A O 1 HETATM 11495 O O . HOH L 6 . ? -33.626 18.051 -12.762 1.00 37.72 ? 1521 HOH A O 1 HETATM 11496 O O . HOH L 6 . ? -42.221 20.254 13.019 1.00 37.80 ? 1522 HOH A O 1 HETATM 11497 O O . HOH L 6 . ? -26.902 55.795 -1.828 1.00 45.02 ? 1523 HOH A O 1 HETATM 11498 O O . HOH L 6 . ? -11.146 41.917 24.599 1.00 34.30 ? 1524 HOH A O 1 HETATM 11499 O O . HOH L 6 . ? -39.741 37.584 10.009 1.00 42.05 ? 1525 HOH A O 1 HETATM 11500 O O . HOH L 6 . ? -17.816 27.329 39.970 1.00 36.21 ? 1526 HOH A O 1 HETATM 11501 O O . HOH L 6 . ? -33.244 48.171 18.354 1.00 30.85 ? 1527 HOH A O 1 HETATM 11502 O O . HOH L 6 . ? -13.937 38.312 37.763 1.00 36.55 ? 1528 HOH A O 1 HETATM 11503 O O . HOH L 6 . ? -27.103 53.253 22.336 1.00 49.11 ? 1529 HOH A O 1 HETATM 11504 O O . HOH L 6 . ? -23.675 -0.151 -8.124 1.00 41.64 ? 1530 HOH A O 1 HETATM 11505 O O . HOH L 6 . ? -32.264 32.710 -1.753 1.00 49.16 ? 1531 HOH A O 1 HETATM 11506 O O . HOH L 6 . ? -15.864 3.429 -3.879 1.00 45.18 ? 1532 HOH A O 1 HETATM 11507 O O . HOH L 6 . ? -36.228 14.768 -14.619 1.00 46.76 ? 1533 HOH A O 1 HETATM 11508 O O . HOH L 6 . ? -28.861 44.344 4.994 1.00 31.08 ? 1534 HOH A O 1 HETATM 11509 O O . HOH L 6 . ? -26.596 14.561 29.097 1.00 41.06 ? 1535 HOH A O 1 HETATM 11510 O O . HOH L 6 . ? -26.359 34.632 -16.808 1.00 33.59 ? 1536 HOH A O 1 HETATM 11511 O O . HOH L 6 . ? -34.482 30.609 -15.689 1.00 46.44 ? 1537 HOH A O 1 HETATM 11512 O O . HOH L 6 . ? -18.569 4.547 -9.918 1.00 53.16 ? 1538 HOH A O 1 HETATM 11513 O O . HOH L 6 . ? -0.068 43.921 -32.829 1.00 44.68 ? 1539 HOH A O 1 HETATM 11514 O O . HOH L 6 . ? -35.874 12.469 -16.510 1.00 38.81 ? 1540 HOH A O 1 HETATM 11515 O O . HOH L 6 . ? -36.154 12.112 18.764 1.00 39.22 ? 1541 HOH A O 1 HETATM 11516 O O . HOH L 6 . ? -25.159 3.277 4.695 1.00 38.92 ? 1542 HOH A O 1 HETATM 11517 O O . HOH L 6 . ? -8.273 24.784 -30.054 1.00 41.70 ? 1543 HOH A O 1 HETATM 11518 O O . HOH L 6 . ? -17.428 10.871 44.548 1.00 41.02 ? 1544 HOH A O 1 HETATM 11519 O O . HOH L 6 . ? -41.449 41.941 24.362 1.00 41.75 ? 1545 HOH A O 1 HETATM 11520 O O . HOH L 6 . ? -3.485 47.895 -22.768 1.00 31.70 ? 1546 HOH A O 1 HETATM 11521 O O . HOH L 6 . ? -8.907 9.097 2.981 1.00 57.69 ? 1547 HOH A O 1 HETATM 11522 O O . HOH L 6 . ? -44.013 20.474 8.185 1.00 42.79 ? 1548 HOH A O 1 HETATM 11523 O O . HOH L 6 . ? -41.245 23.266 19.061 1.00 45.52 ? 1549 HOH A O 1 HETATM 11524 O O . HOH L 6 . ? -18.505 40.217 -5.414 1.00 48.20 ? 1550 HOH A O 1 HETATM 11525 O O . HOH L 6 . ? -14.888 57.611 -6.839 1.00 39.79 ? 1551 HOH A O 1 HETATM 11526 O O . HOH L 6 . ? -7.432 28.109 -39.069 1.00 43.60 ? 1552 HOH A O 1 HETATM 11527 O O . HOH L 6 . ? -8.187 30.451 37.013 1.00 43.57 ? 1553 HOH A O 1 HETATM 11528 O O . HOH L 6 . ? -5.049 22.850 -29.359 1.00 37.55 ? 1554 HOH A O 1 HETATM 11529 O O . HOH L 6 . ? -32.045 39.324 7.117 1.00 39.38 ? 1555 HOH A O 1 HETATM 11530 O O . HOH L 6 . ? -7.379 23.473 -28.179 1.00 36.73 ? 1556 HOH A O 1 HETATM 11531 O O . HOH L 6 . ? -10.996 45.148 22.306 1.00 46.75 ? 1557 HOH A O 1 HETATM 11532 O O . HOH L 6 . ? -11.206 51.332 18.077 1.00 31.77 ? 1558 HOH A O 1 HETATM 11533 O O . HOH L 6 . ? -1.496 17.122 41.068 1.00 48.08 ? 1559 HOH A O 1 HETATM 11534 O O . HOH L 6 . ? 0.411 18.950 39.799 1.00 50.85 ? 1560 HOH A O 1 HETATM 11535 O O . HOH L 6 . ? -25.982 1.884 2.255 1.00 37.99 ? 1561 HOH A O 1 HETATM 11536 O O . HOH L 6 . ? -34.341 39.015 6.470 1.00 43.84 ? 1562 HOH A O 1 HETATM 11537 O O . HOH L 6 . ? -30.465 51.802 3.262 1.00 36.73 ? 1563 HOH A O 1 HETATM 11538 O O . HOH L 6 . ? -46.597 16.717 -13.814 1.00 44.02 ? 1564 HOH A O 1 HETATM 11539 O O . HOH L 6 . ? -35.802 23.251 32.896 1.00 35.46 ? 1565 HOH A O 1 HETATM 11540 O O . HOH L 6 . ? -27.113 -0.570 -12.995 1.00 50.61 ? 1566 HOH A O 1 HETATM 11541 O O . HOH L 6 . ? -7.434 6.327 40.818 1.00 39.47 ? 1567 HOH A O 1 HETATM 11542 O O . HOH L 6 . ? -31.127 40.542 4.416 1.00 44.48 ? 1568 HOH A O 1 HETATM 11543 O O . HOH L 6 . ? -11.609 22.772 3.956 1.00 40.46 ? 1569 HOH A O 1 HETATM 11544 O O . HOH L 6 . ? -33.883 44.936 -3.882 1.00 40.35 ? 1570 HOH A O 1 HETATM 11545 O O . HOH L 6 . ? -36.739 11.440 23.325 1.00 44.88 ? 1571 HOH A O 1 HETATM 11546 O O . HOH L 6 . ? -22.091 47.769 33.766 1.00 36.33 ? 1572 HOH A O 1 HETATM 11547 O O . HOH L 6 . ? -20.922 7.895 17.867 1.00 37.81 ? 1573 HOH A O 1 HETATM 11548 O O . HOH L 6 . ? -4.436 24.364 -15.657 1.00 46.07 ? 1574 HOH A O 1 HETATM 11549 O O . HOH L 6 . ? -27.992 57.738 -0.692 1.00 47.53 ? 1575 HOH A O 1 HETATM 11550 O O . HOH L 6 . ? -30.365 52.293 25.333 1.00 54.91 ? 1576 HOH A O 1 HETATM 11551 O O . HOH L 6 . ? -8.900 46.323 20.800 1.00 48.57 ? 1577 HOH A O 1 HETATM 11552 O O . HOH L 6 . ? -31.576 43.023 4.823 1.00 39.94 ? 1578 HOH A O 1 HETATM 11553 O O . HOH L 6 . ? -5.180 15.042 9.743 1.00 43.25 ? 1579 HOH A O 1 HETATM 11554 O O . HOH L 6 . ? -40.659 34.207 24.223 1.00 48.04 ? 1580 HOH A O 1 HETATM 11555 O O . HOH L 6 . ? -4.346 16.310 7.130 1.00 44.09 ? 1581 HOH A O 1 HETATM 11556 O O . HOH L 6 . ? -12.307 29.292 -17.525 1.00 45.10 ? 1582 HOH A O 1 HETATM 11557 O O . HOH L 6 . ? -48.483 22.171 -4.150 1.00 51.47 ? 1583 HOH A O 1 HETATM 11558 O O . HOH L 6 . ? -9.500 18.584 22.262 1.00 29.05 ? 1584 HOH A O 1 HETATM 11559 O O . HOH L 6 . ? -20.978 2.026 -10.332 1.00 42.80 ? 1585 HOH A O 1 HETATM 11560 O O . HOH L 6 . ? -6.991 16.035 -7.541 1.00 38.22 ? 1586 HOH A O 1 HETATM 11561 O O . HOH L 6 . ? -33.191 16.150 -14.400 1.00 49.53 ? 1587 HOH A O 1 HETATM 11562 O O . HOH L 6 . ? -13.442 57.928 -4.796 1.00 40.04 ? 1588 HOH A O 1 HETATM 11563 O O . HOH L 6 . ? -4.691 14.392 -1.859 1.00 40.05 ? 1589 HOH A O 1 HETATM 11564 O O . HOH L 6 . ? -39.339 18.813 17.846 1.00 52.47 ? 1590 HOH A O 1 HETATM 11565 O O . HOH L 6 . ? -44.883 5.741 -7.967 1.00 43.51 ? 1591 HOH A O 1 HETATM 11566 O O . HOH L 6 . ? -18.460 41.858 -8.002 1.00 36.36 ? 1592 HOH A O 1 HETATM 11567 O O . HOH L 6 . ? -43.623 28.495 9.116 1.00 42.95 ? 1593 HOH A O 1 HETATM 11568 O O . HOH L 6 . ? -19.528 11.074 27.038 1.00 53.05 ? 1594 HOH A O 1 HETATM 11569 O O . HOH L 6 . ? -18.285 48.998 32.466 1.00 42.78 ? 1595 HOH A O 1 HETATM 11570 O O . HOH L 6 . ? 3.448 47.756 -26.842 1.00 46.42 ? 1596 HOH A O 1 HETATM 11571 O O . HOH L 6 . ? -39.807 -3.387 2.681 1.00 50.84 ? 1597 HOH A O 1 HETATM 11572 O O . HOH L 6 . ? -39.367 19.010 20.346 1.00 47.21 ? 1598 HOH A O 1 HETATM 11573 O O . HOH L 6 . ? -45.217 32.355 -2.485 1.00 44.63 ? 1599 HOH A O 1 HETATM 11574 O O . HOH L 6 . ? -22.074 10.440 28.178 1.00 48.44 ? 1600 HOH A O 1 HETATM 11575 O O . HOH L 6 . ? -14.043 23.382 -1.025 1.00 41.75 ? 1601 HOH A O 1 HETATM 11576 O O . HOH L 6 . ? -43.284 23.723 17.297 1.00 47.85 ? 1602 HOH A O 1 HETATM 11577 O O . HOH L 6 . ? -10.080 4.931 39.866 1.00 37.49 ? 1603 HOH A O 1 HETATM 11578 O O . HOH L 6 . ? -48.174 20.573 -1.878 1.00 46.04 ? 1604 HOH A O 1 HETATM 11579 O O . HOH L 6 . ? -40.126 16.182 18.318 1.00 42.75 ? 1605 HOH A O 1 HETATM 11580 O O . HOH L 6 . ? -49.385 19.457 0.000 0.50 38.82 ? 1606 HOH A O 1 HETATM 11581 O O . HOH L 6 . ? -4.950 7.595 11.337 1.00 46.33 ? 1607 HOH A O 1 HETATM 11582 O O . HOH L 6 . ? -42.055 30.490 16.217 1.00 44.97 ? 1608 HOH A O 1 HETATM 11583 O O . HOH L 6 . ? -7.312 40.146 11.243 1.00 23.78 ? 1609 HOH A O 1 HETATM 11584 O O . HOH L 6 . ? -42.429 16.464 3.338 1.00 37.53 ? 1610 HOH A O 1 HETATM 11585 O O . HOH L 6 . ? 4.491 32.096 -11.040 1.00 30.81 ? 1611 HOH A O 1 HETATM 11586 O O . HOH L 6 . ? -12.728 16.461 46.476 1.00 42.81 ? 1612 HOH A O 1 HETATM 11587 O O . HOH L 6 . ? -9.518 32.043 11.483 1.00 34.09 ? 1613 HOH A O 1 HETATM 11588 O O . HOH L 6 . ? -5.870 40.767 -23.112 1.00 47.80 ? 1614 HOH A O 1 HETATM 11589 O O . HOH L 6 . ? -12.237 21.811 -4.713 1.00 47.84 ? 1615 HOH A O 1 HETATM 11590 O O . HOH L 6 . ? -2.769 10.330 13.533 1.00 43.62 ? 1616 HOH A O 1 HETATM 11591 O O . HOH L 6 . ? -13.131 0.667 4.037 1.00 46.38 ? 1617 HOH A O 1 HETATM 11592 O O . HOH L 6 . ? -12.308 18.982 1.259 1.00 35.56 ? 1618 HOH A O 1 HETATM 11593 O O . HOH L 6 . ? -27.726 10.772 19.521 1.00 43.31 ? 1619 HOH A O 1 HETATM 11594 O O . HOH M 6 . ? -11.141 25.429 13.737 1.00 16.07 ? 201 HOH B O 1 HETATM 11595 O O . HOH M 6 . ? -8.697 22.765 11.503 1.00 18.58 ? 202 HOH B O 1 HETATM 11596 O O . HOH M 6 . ? -11.109 31.320 8.810 1.00 24.67 ? 203 HOH B O 1 HETATM 11597 O O . HOH M 6 . ? -18.333 26.660 1.803 1.00 27.59 ? 204 HOH B O 1 HETATM 11598 O O . HOH M 6 . ? -5.463 22.718 11.800 1.00 39.26 ? 205 HOH B O 1 HETATM 11599 O O . HOH M 6 . ? -12.206 33.585 7.411 1.00 32.25 ? 206 HOH B O 1 HETATM 11600 O O . HOH M 6 . ? -14.917 27.057 1.722 1.00 24.92 ? 207 HOH B O 1 HETATM 11601 O O . HOH M 6 . ? -3.967 23.520 9.976 1.00 48.79 ? 208 HOH B O 1 HETATM 11602 O O . HOH N 6 . ? -25.864 -14.886 13.544 1.00 15.79 ? 1201 HOH C O 1 HETATM 11603 O O . HOH N 6 . ? -9.180 -21.390 21.275 1.00 17.35 ? 1202 HOH C O 1 HETATM 11604 O O . HOH N 6 . ? -28.579 -14.264 25.661 1.00 16.97 ? 1203 HOH C O 1 HETATM 11605 O O . HOH N 6 . ? -22.801 -1.678 9.026 1.00 16.08 ? 1204 HOH C O 1 HETATM 11606 O O . HOH N 6 . ? -14.671 -23.902 10.273 1.00 14.55 ? 1205 HOH C O 1 HETATM 11607 O O . HOH N 6 . ? -28.320 -10.234 17.345 1.00 16.60 ? 1206 HOH C O 1 HETATM 11608 O O . HOH N 6 . ? -7.221 -27.499 16.911 1.00 14.72 ? 1207 HOH C O 1 HETATM 11609 O O . HOH N 6 . ? -17.747 -16.374 21.643 1.00 28.41 ? 1208 HOH C O 1 HETATM 11610 O O . HOH N 6 . ? 18.994 -19.196 -9.401 1.00 19.61 ? 1209 HOH C O 1 HETATM 11611 O O . HOH N 6 . ? -14.876 -25.622 19.734 1.00 14.88 ? 1210 HOH C O 1 HETATM 11612 O O . HOH N 6 . ? 15.453 -38.348 -8.362 1.00 30.32 ? 1211 HOH C O 1 HETATM 11613 O O . HOH N 6 . ? -21.235 -19.435 11.039 1.00 20.79 ? 1212 HOH C O 1 HETATM 11614 O O . HOH N 6 . ? -8.971 -13.717 15.787 1.00 15.54 ? 1213 HOH C O 1 HETATM 11615 O O . HOH N 6 . ? -11.038 -10.072 13.082 1.00 15.77 ? 1214 HOH C O 1 HETATM 11616 O O . HOH N 6 . ? -38.500 5.341 16.848 1.00 35.97 ? 1215 HOH C O 1 HETATM 11617 O O . HOH N 6 . ? -8.039 -2.410 24.376 1.00 15.19 ? 1216 HOH C O 1 HETATM 11618 O O . HOH N 6 . ? -19.609 2.017 12.345 1.00 20.45 ? 1217 HOH C O 1 HETATM 11619 O O . HOH N 6 . ? -29.878 -26.958 42.349 1.00 22.06 ? 1218 HOH C O 1 HETATM 11620 O O . HOH N 6 . ? -0.808 -10.122 13.193 1.00 34.82 ? 1219 HOH C O 1 HETATM 11621 O O . HOH N 6 . ? -13.501 -3.433 26.648 1.00 14.28 ? 1220 HOH C O 1 HETATM 11622 O O . HOH N 6 . ? 4.752 -31.409 20.425 1.00 22.12 ? 1221 HOH C O 1 HETATM 11623 O O . HOH N 6 . ? 6.934 -21.318 28.269 1.00 22.16 ? 1222 HOH C O 1 HETATM 11624 O O . HOH N 6 . ? -3.231 -22.381 17.138 1.00 35.98 ? 1223 HOH C O 1 HETATM 11625 O O . HOH N 6 . ? -11.983 -2.065 15.987 1.00 19.69 ? 1224 HOH C O 1 HETATM 11626 O O . HOH N 6 . ? -12.570 2.089 29.547 1.00 20.94 ? 1225 HOH C O 1 HETATM 11627 O O . HOH N 6 . ? -6.490 -32.856 21.339 1.00 18.25 ? 1226 HOH C O 1 HETATM 11628 O O . HOH N 6 . ? 5.916 -28.941 19.885 1.00 19.88 ? 1227 HOH C O 1 HETATM 11629 O O . HOH N 6 . ? -18.395 -18.988 17.980 1.00 19.09 ? 1228 HOH C O 1 HETATM 11630 O O . HOH N 6 . ? -9.221 -29.027 28.370 1.00 12.15 ? 1229 HOH C O 1 HETATM 11631 O O . HOH N 6 . ? 1.246 -21.972 30.709 1.00 21.08 ? 1230 HOH C O 1 HETATM 11632 O O . HOH N 6 . ? -30.503 -5.665 27.434 1.00 19.80 ? 1231 HOH C O 1 HETATM 11633 O O . HOH N 6 . ? -28.227 -3.473 21.386 1.00 19.55 ? 1232 HOH C O 1 HETATM 11634 O O . HOH N 6 . ? -4.719 3.088 21.455 1.00 15.89 ? 1233 HOH C O 1 HETATM 11635 O O . HOH N 6 . ? 1.321 -11.734 30.711 1.00 18.86 ? 1234 HOH C O 1 HETATM 11636 O O . HOH N 6 . ? 5.245 -44.382 11.792 1.00 26.85 ? 1235 HOH C O 1 HETATM 11637 O O . HOH N 6 . ? -3.612 -9.875 41.913 1.00 20.31 ? 1236 HOH C O 1 HETATM 11638 O O . HOH N 6 . ? -22.599 -17.254 7.448 1.00 26.64 ? 1237 HOH C O 1 HETATM 11639 O O . HOH N 6 . ? -11.668 -19.279 19.839 1.00 20.67 ? 1238 HOH C O 1 HETATM 11640 O O . HOH N 6 . ? -17.731 -5.323 14.890 1.00 22.83 ? 1239 HOH C O 1 HETATM 11641 O O . HOH N 6 . ? 3.409 -13.006 29.003 1.00 24.39 ? 1240 HOH C O 1 HETATM 11642 O O . HOH N 6 . ? -8.635 -12.033 38.979 1.00 26.01 ? 1241 HOH C O 1 HETATM 11643 O O . HOH N 6 . ? -16.031 -20.679 24.415 1.00 31.58 ? 1242 HOH C O 1 HETATM 11644 O O . HOH N 6 . ? -7.475 4.444 23.272 1.00 19.86 ? 1243 HOH C O 1 HETATM 11645 O O . HOH N 6 . ? -25.022 -30.729 40.393 1.00 24.64 ? 1244 HOH C O 1 HETATM 11646 O O . HOH N 6 . ? -12.107 -7.811 21.285 1.00 19.90 ? 1245 HOH C O 1 HETATM 11647 O O . HOH N 6 . ? -29.107 -4.625 6.759 1.00 29.20 ? 1246 HOH C O 1 HETATM 11648 O O . HOH N 6 . ? -30.792 -8.357 28.566 1.00 49.79 ? 1247 HOH C O 1 HETATM 11649 O O . HOH N 6 . ? 5.693 -33.774 -2.898 1.00 29.13 ? 1248 HOH C O 1 HETATM 11650 O O . HOH N 6 . ? -12.526 -36.888 33.203 1.00 25.03 ? 1249 HOH C O 1 HETATM 11651 O O . HOH N 6 . ? 0.452 -14.123 29.812 1.00 34.38 ? 1250 HOH C O 1 HETATM 11652 O O . HOH N 6 . ? -2.340 5.009 37.664 1.00 28.78 ? 1251 HOH C O 1 HETATM 11653 O O . HOH N 6 . ? -4.160 6.515 32.076 1.00 20.86 ? 1252 HOH C O 1 HETATM 11654 O O . HOH N 6 . ? -9.747 -0.695 15.336 1.00 18.00 ? 1253 HOH C O 1 HETATM 11655 O O . HOH N 6 . ? 5.852 -20.121 -1.641 1.00 47.36 ? 1254 HOH C O 1 HETATM 11656 O O . HOH N 6 . ? -11.525 -10.629 21.378 1.00 18.66 ? 1255 HOH C O 1 HETATM 11657 O O . HOH N 6 . ? -9.187 -21.495 35.003 1.00 16.43 ? 1256 HOH C O 1 HETATM 11658 O O . HOH N 6 . ? -11.718 -25.249 32.385 1.00 28.54 ? 1257 HOH C O 1 HETATM 11659 O O . HOH N 6 . ? -34.085 -18.273 28.783 1.00 25.37 ? 1258 HOH C O 1 HETATM 11660 O O . HOH N 6 . ? -9.266 -6.603 33.027 1.00 20.63 ? 1259 HOH C O 1 HETATM 11661 O O . HOH N 6 . ? -26.623 -13.239 30.284 1.00 17.45 ? 1260 HOH C O 1 HETATM 11662 O O . HOH N 6 . ? -13.153 1.745 8.443 1.00 26.92 ? 1261 HOH C O 1 HETATM 11663 O O . HOH N 6 . ? -15.560 -2.399 16.098 1.00 17.37 ? 1262 HOH C O 1 HETATM 11664 O O . HOH N 6 . ? -25.740 -1.718 15.271 1.00 19.60 ? 1263 HOH C O 1 HETATM 11665 O O . HOH N 6 . ? 7.436 -9.030 20.701 1.00 22.80 ? 1264 HOH C O 1 HETATM 11666 O O . HOH N 6 . ? 3.019 -5.607 14.656 1.00 16.71 ? 1265 HOH C O 1 HETATM 11667 O O . HOH N 6 . ? -1.079 -35.151 21.362 1.00 19.25 ? 1266 HOH C O 1 HETATM 11668 O O . HOH N 6 . ? -7.656 -12.107 43.596 1.00 43.78 ? 1267 HOH C O 1 HETATM 11669 O O . HOH N 6 . ? 9.740 -10.584 20.300 1.00 22.47 ? 1268 HOH C O 1 HETATM 11670 O O . HOH N 6 . ? 4.053 -11.914 26.250 1.00 28.05 ? 1269 HOH C O 1 HETATM 11671 O O . HOH N 6 . ? -10.705 -17.045 42.911 1.00 30.06 ? 1270 HOH C O 1 HETATM 11672 O O . HOH N 6 . ? -9.077 -26.282 40.200 1.00 24.27 ? 1271 HOH C O 1 HETATM 11673 O O . HOH N 6 . ? 4.075 -43.691 20.931 1.00 46.00 ? 1272 HOH C O 1 HETATM 11674 O O . HOH N 6 . ? -33.300 -20.051 33.085 1.00 21.76 ? 1273 HOH C O 1 HETATM 11675 O O . HOH N 6 . ? -12.892 -11.873 11.487 1.00 19.45 ? 1274 HOH C O 1 HETATM 11676 O O . HOH N 6 . ? -6.254 -5.760 37.081 1.00 20.49 ? 1275 HOH C O 1 HETATM 11677 O O . HOH N 6 . ? -12.458 -1.083 25.250 1.00 27.73 ? 1276 HOH C O 1 HETATM 11678 O O . HOH N 6 . ? -0.336 -5.032 10.727 1.00 22.17 ? 1277 HOH C O 1 HETATM 11679 O O . HOH N 6 . ? -5.579 9.762 29.482 1.00 31.99 ? 1278 HOH C O 1 HETATM 11680 O O . HOH N 6 . ? -28.240 -0.432 15.154 1.00 24.45 ? 1279 HOH C O 1 HETATM 11681 O O . HOH N 6 . ? -13.469 -20.976 27.428 1.00 35.26 ? 1280 HOH C O 1 HETATM 11682 O O . HOH N 6 . ? 3.550 -38.781 18.433 1.00 29.62 ? 1281 HOH C O 1 HETATM 11683 O O . HOH N 6 . ? 20.939 -16.151 -3.482 1.00 31.06 ? 1282 HOH C O 1 HETATM 11684 O O . HOH N 6 . ? -4.670 9.437 26.895 1.00 22.14 ? 1283 HOH C O 1 HETATM 11685 O O . HOH N 6 . ? -11.817 2.190 17.885 1.00 32.08 ? 1284 HOH C O 1 HETATM 11686 O O . HOH N 6 . ? -32.965 -22.204 42.252 1.00 21.13 ? 1285 HOH C O 1 HETATM 11687 O O . HOH N 6 . ? -20.497 -16.875 8.759 1.00 25.50 ? 1286 HOH C O 1 HETATM 11688 O O . HOH N 6 . ? -22.013 -13.139 9.811 1.00 22.79 ? 1287 HOH C O 1 HETATM 11689 O O . HOH N 6 . ? -8.846 -6.661 35.882 1.00 25.23 ? 1288 HOH C O 1 HETATM 11690 O O . HOH N 6 . ? -16.025 -4.209 32.700 1.00 19.87 ? 1289 HOH C O 1 HETATM 11691 O O . HOH N 6 . ? 7.820 -24.098 28.146 1.00 30.79 ? 1290 HOH C O 1 HETATM 11692 O O . HOH N 6 . ? -12.821 -35.005 40.987 1.00 27.18 ? 1291 HOH C O 1 HETATM 11693 O O . HOH N 6 . ? -32.338 -3.369 25.035 1.00 26.97 ? 1292 HOH C O 1 HETATM 11694 O O . HOH N 6 . ? -3.028 5.734 11.925 1.00 23.49 ? 1293 HOH C O 1 HETATM 11695 O O . HOH N 6 . ? -10.994 -15.231 45.128 1.00 39.16 ? 1294 HOH C O 1 HETATM 11696 O O . HOH N 6 . ? -16.676 -31.513 9.438 1.00 29.19 ? 1295 HOH C O 1 HETATM 11697 O O . HOH N 6 . ? -5.946 -11.034 41.659 1.00 23.80 ? 1296 HOH C O 1 HETATM 11698 O O . HOH N 6 . ? 0.127 -7.856 12.307 1.00 32.31 ? 1297 HOH C O 1 HETATM 11699 O O . HOH N 6 . ? -35.141 -15.524 23.022 1.00 19.30 ? 1298 HOH C O 1 HETATM 11700 O O . HOH N 6 . ? -6.714 -36.626 29.171 1.00 20.96 ? 1299 HOH C O 1 HETATM 11701 O O . HOH N 6 . ? -16.951 1.933 13.913 1.00 27.30 ? 1300 HOH C O 1 HETATM 11702 O O . HOH N 6 . ? -27.175 -12.732 27.118 1.00 28.18 ? 1301 HOH C O 1 HETATM 11703 O O . HOH N 6 . ? 12.931 9.518 22.503 1.00 27.86 ? 1302 HOH C O 1 HETATM 11704 O O . HOH N 6 . ? -31.549 4.117 19.713 1.00 22.48 ? 1303 HOH C O 1 HETATM 11705 O O . HOH N 6 . ? -18.539 -4.941 2.742 1.00 34.07 ? 1304 HOH C O 1 HETATM 11706 O O . HOH N 6 . ? -6.243 -39.670 29.663 1.00 44.90 ? 1305 HOH C O 1 HETATM 11707 O O . HOH N 6 . ? -0.404 8.485 35.713 1.00 33.76 ? 1306 HOH C O 1 HETATM 11708 O O . HOH N 6 . ? 0.691 -19.952 37.274 1.00 26.60 ? 1307 HOH C O 1 HETATM 11709 O O . HOH N 6 . ? -21.389 -31.071 11.354 1.00 32.39 ? 1308 HOH C O 1 HETATM 11710 O O . HOH N 6 . ? -19.694 -10.975 11.773 1.00 26.47 ? 1309 HOH C O 1 HETATM 11711 O O . HOH N 6 . ? -43.615 -3.622 29.479 1.00 39.67 ? 1310 HOH C O 1 HETATM 11712 O O . HOH N 6 . ? -3.729 -0.172 8.594 1.00 23.95 ? 1311 HOH C O 1 HETATM 11713 O O . HOH N 6 . ? 3.017 3.106 41.502 1.00 29.82 ? 1312 HOH C O 1 HETATM 11714 O O . HOH N 6 . ? 1.862 -14.124 16.555 1.00 22.85 ? 1313 HOH C O 1 HETATM 11715 O O . HOH N 6 . ? -10.960 3.048 22.635 1.00 30.84 ? 1314 HOH C O 1 HETATM 11716 O O . HOH N 6 . ? 4.761 -40.542 2.980 1.00 33.38 ? 1315 HOH C O 1 HETATM 11717 O O . HOH N 6 . ? 7.775 -40.706 30.680 1.00 33.43 ? 1316 HOH C O 1 HETATM 11718 O O . HOH N 6 . ? -32.305 2.317 8.879 1.00 22.81 ? 1317 HOH C O 1 HETATM 11719 O O . HOH N 6 . ? 10.309 -7.851 12.255 1.00 27.16 ? 1318 HOH C O 1 HETATM 11720 O O . HOH N 6 . ? -14.252 -0.289 16.600 1.00 30.77 ? 1319 HOH C O 1 HETATM 11721 O O . HOH N 6 . ? 5.787 -23.577 6.297 1.00 40.59 ? 1320 HOH C O 1 HETATM 11722 O O . HOH N 6 . ? 1.856 -9.689 20.611 1.00 24.26 ? 1321 HOH C O 1 HETATM 11723 O O . HOH N 6 . ? -1.748 -14.726 27.810 1.00 23.70 ? 1322 HOH C O 1 HETATM 11724 O O . HOH N 6 . ? -18.306 0.697 6.214 1.00 22.21 ? 1323 HOH C O 1 HETATM 11725 O O . HOH N 6 . ? -2.412 14.541 32.131 1.00 42.00 ? 1324 HOH C O 1 HETATM 11726 O O . HOH N 6 . ? 14.967 8.229 28.245 1.00 29.40 ? 1325 HOH C O 1 HETATM 11727 O O . HOH N 6 . ? -22.546 -25.737 8.975 1.00 26.41 ? 1326 HOH C O 1 HETATM 11728 O O . HOH N 6 . ? -24.328 -2.788 2.589 1.00 31.82 ? 1327 HOH C O 1 HETATM 11729 O O . HOH N 6 . ? 6.169 -38.228 2.867 1.00 26.34 ? 1328 HOH C O 1 HETATM 11730 O O . HOH N 6 . ? -1.907 -45.323 25.788 1.00 21.57 ? 1329 HOH C O 1 HETATM 11731 O O . HOH N 6 . ? -32.517 -1.070 24.030 1.00 38.92 ? 1330 HOH C O 1 HETATM 11732 O O . HOH N 6 . ? 12.371 -3.123 38.793 1.00 29.05 ? 1331 HOH C O 1 HETATM 11733 O O . HOH N 6 . ? -30.434 -17.575 7.328 1.00 35.11 ? 1332 HOH C O 1 HETATM 11734 O O . HOH N 6 . ? -29.221 0.986 12.898 1.00 27.01 ? 1333 HOH C O 1 HETATM 11735 O O . HOH N 6 . ? -16.077 -0.979 35.322 1.00 25.15 ? 1334 HOH C O 1 HETATM 11736 O O . HOH N 6 . ? -1.611 -1.676 39.607 1.00 29.98 ? 1335 HOH C O 1 HETATM 11737 O O . HOH N 6 . ? -21.192 -13.296 7.082 1.00 21.82 ? 1336 HOH C O 1 HETATM 11738 O O . HOH N 6 . ? 0.446 8.732 38.550 1.00 31.21 ? 1337 HOH C O 1 HETATM 11739 O O . HOH N 6 . ? -16.815 -1.430 31.718 1.00 29.85 ? 1338 HOH C O 1 HETATM 11740 O O . HOH N 6 . ? -31.661 -18.314 31.985 1.00 22.07 ? 1339 HOH C O 1 HETATM 11741 O O . HOH N 6 . ? 12.903 -14.678 18.451 1.00 27.96 ? 1340 HOH C O 1 HETATM 11742 O O . HOH N 6 . ? -28.562 -39.479 33.777 1.00 32.31 ? 1341 HOH C O 1 HETATM 11743 O O . HOH N 6 . ? -6.891 -18.541 38.364 1.00 30.09 ? 1342 HOH C O 1 HETATM 11744 O O . HOH N 6 . ? -31.638 -15.706 31.750 1.00 26.44 ? 1343 HOH C O 1 HETATM 11745 O O . HOH N 6 . ? -35.935 -26.891 18.179 1.00 33.24 ? 1344 HOH C O 1 HETATM 11746 O O . HOH N 6 . ? 15.010 -3.527 38.765 1.00 33.78 ? 1345 HOH C O 1 HETATM 11747 O O . HOH N 6 . ? -31.009 -13.731 33.555 1.00 28.87 ? 1346 HOH C O 1 HETATM 11748 O O . HOH N 6 . ? -34.060 -21.441 30.643 1.00 43.83 ? 1347 HOH C O 1 HETATM 11749 O O . HOH N 6 . ? 18.277 4.424 26.178 1.00 32.75 ? 1348 HOH C O 1 HETATM 11750 O O . HOH N 6 . ? -27.158 6.279 16.231 1.00 25.79 ? 1349 HOH C O 1 HETATM 11751 O O . HOH N 6 . ? -11.454 -26.411 9.172 1.00 19.72 ? 1350 HOH C O 1 HETATM 11752 O O . HOH N 6 . ? 26.132 -20.892 -6.529 1.00 35.96 ? 1351 HOH C O 1 HETATM 11753 O O . HOH N 6 . ? -19.330 -30.928 43.939 1.00 37.97 ? 1352 HOH C O 1 HETATM 11754 O O . HOH N 6 . ? -2.741 -33.079 25.393 1.00 21.58 ? 1353 HOH C O 1 HETATM 11755 O O . HOH N 6 . ? 19.638 -33.437 -8.819 1.00 47.06 ? 1354 HOH C O 1 HETATM 11756 O O . HOH N 6 . ? -9.450 -10.390 41.069 1.00 30.48 ? 1355 HOH C O 1 HETATM 11757 O O . HOH N 6 . ? 6.202 9.331 35.010 1.00 34.07 ? 1356 HOH C O 1 HETATM 11758 O O . HOH N 6 . ? 20.458 8.501 33.267 1.00 50.68 ? 1357 HOH C O 1 HETATM 11759 O O . HOH N 6 . ? -9.890 5.284 23.595 1.00 34.05 ? 1358 HOH C O 1 HETATM 11760 O O . HOH N 6 . ? 3.590 0.629 9.849 1.00 26.37 ? 1359 HOH C O 1 HETATM 11761 O O . HOH N 6 . ? 11.576 -22.899 -6.764 1.00 31.00 ? 1360 HOH C O 1 HETATM 11762 O O . HOH N 6 . ? 15.139 -35.015 16.116 1.00 25.28 ? 1361 HOH C O 1 HETATM 11763 O O . HOH N 6 . ? -12.378 3.697 34.071 1.00 24.77 ? 1362 HOH C O 1 HETATM 11764 O O . HOH N 6 . ? 21.318 -18.094 -5.278 1.00 31.05 ? 1363 HOH C O 1 HETATM 11765 O O . HOH N 6 . ? 1.296 -8.097 8.259 1.00 30.87 ? 1364 HOH C O 1 HETATM 11766 O O . HOH N 6 . ? -19.674 -14.874 22.761 1.00 21.81 ? 1365 HOH C O 1 HETATM 11767 O O . HOH N 6 . ? -8.147 7.774 28.278 1.00 33.18 ? 1366 HOH C O 1 HETATM 11768 O O . HOH N 6 . ? 4.624 -24.822 33.733 1.00 35.94 ? 1367 HOH C O 1 HETATM 11769 O O . HOH N 6 . ? 18.019 -31.786 6.215 1.00 29.96 ? 1368 HOH C O 1 HETATM 11770 O O . HOH N 6 . ? -9.776 -32.287 32.187 1.00 40.16 ? 1369 HOH C O 1 HETATM 11771 O O . HOH N 6 . ? -8.009 7.253 17.162 1.00 35.76 ? 1370 HOH C O 1 HETATM 11772 O O . HOH N 6 . ? 2.083 7.114 16.692 1.00 33.23 ? 1371 HOH C O 1 HETATM 11773 O O . HOH N 6 . ? -6.988 -31.917 31.673 1.00 33.40 ? 1372 HOH C O 1 HETATM 11774 O O . HOH N 6 . ? -12.638 -22.335 9.117 1.00 29.83 ? 1373 HOH C O 1 HETATM 11775 O O . HOH N 6 . ? 13.747 11.578 37.653 1.00 44.08 ? 1374 HOH C O 1 HETATM 11776 O O . HOH N 6 . ? -16.602 -2.253 4.936 1.00 30.38 ? 1375 HOH C O 1 HETATM 11777 O O . HOH N 6 . ? -33.241 6.384 20.999 1.00 35.70 ? 1376 HOH C O 1 HETATM 11778 O O . HOH N 6 . ? -13.178 1.364 13.930 1.00 38.44 ? 1377 HOH C O 1 HETATM 11779 O O . HOH N 6 . ? 8.703 0.305 43.897 1.00 38.25 ? 1378 HOH C O 1 HETATM 11780 O O . HOH N 6 . ? -40.328 0.631 6.446 1.00 31.88 ? 1379 HOH C O 1 HETATM 11781 O O . HOH N 6 . ? -30.049 1.084 21.545 1.00 34.33 ? 1380 HOH C O 1 HETATM 11782 O O . HOH N 6 . ? 8.643 -10.613 12.942 1.00 31.08 ? 1381 HOH C O 1 HETATM 11783 O O . HOH N 6 . ? -22.827 -21.140 9.758 1.00 41.04 ? 1382 HOH C O 1 HETATM 11784 O O . HOH N 6 . ? -17.232 2.062 20.190 1.00 28.62 ? 1383 HOH C O 1 HETATM 11785 O O . HOH N 6 . ? 9.853 -16.263 39.865 1.00 34.74 ? 1384 HOH C O 1 HETATM 11786 O O . HOH N 6 . ? -23.989 -23.923 10.733 1.00 30.41 ? 1385 HOH C O 1 HETATM 11787 O O . HOH N 6 . ? -29.778 -12.441 29.444 1.00 32.54 ? 1386 HOH C O 1 HETATM 11788 O O . HOH N 6 . ? 5.874 -37.555 0.012 1.00 36.32 ? 1387 HOH C O 1 HETATM 11789 O O . HOH N 6 . ? 16.263 -9.932 36.077 1.00 45.76 ? 1388 HOH C O 1 HETATM 11790 O O . HOH N 6 . ? 4.461 -1.510 6.822 1.00 29.21 ? 1389 HOH C O 1 HETATM 11791 O O . HOH N 6 . ? -24.107 -19.606 7.305 1.00 28.16 ? 1390 HOH C O 1 HETATM 11792 O O . HOH N 6 . ? -3.971 -20.668 20.258 1.00 28.38 ? 1391 HOH C O 1 HETATM 11793 O O . HOH N 6 . ? 22.617 1.074 14.488 1.00 45.07 ? 1392 HOH C O 1 HETATM 11794 O O . HOH N 6 . ? 11.176 -40.793 18.513 1.00 36.67 ? 1393 HOH C O 1 HETATM 11795 O O . HOH N 6 . ? -9.582 -3.236 34.605 1.00 30.26 ? 1394 HOH C O 1 HETATM 11796 O O . HOH N 6 . ? -6.164 -45.848 22.042 1.00 33.55 ? 1395 HOH C O 1 HETATM 11797 O O . HOH N 6 . ? 13.328 8.696 38.718 1.00 39.52 ? 1396 HOH C O 1 HETATM 11798 O O . HOH N 6 . ? -5.837 -25.543 15.659 1.00 21.70 ? 1397 HOH C O 1 HETATM 11799 O O . HOH N 6 . ? -3.843 -9.368 8.823 1.00 39.92 ? 1398 HOH C O 1 HETATM 11800 O O . HOH N 6 . ? -28.745 1.293 8.753 1.00 30.01 ? 1399 HOH C O 1 HETATM 11801 O O . HOH N 6 . ? -31.113 -18.844 29.414 1.00 24.26 ? 1400 HOH C O 1 HETATM 11802 O O . HOH N 6 . ? -8.546 -18.799 40.684 1.00 30.53 ? 1401 HOH C O 1 HETATM 11803 O O . HOH N 6 . ? 0.478 -40.592 30.436 1.00 32.55 ? 1402 HOH C O 1 HETATM 11804 O O . HOH N 6 . ? -17.116 4.830 35.416 1.00 35.31 ? 1403 HOH C O 1 HETATM 11805 O O . HOH N 6 . ? 4.178 -23.055 28.823 1.00 51.81 ? 1404 HOH C O 1 HETATM 11806 O O . HOH N 6 . ? -13.656 -0.087 28.310 1.00 39.72 ? 1405 HOH C O 1 HETATM 11807 O O . HOH N 6 . ? 24.990 2.685 25.377 1.00 36.23 ? 1406 HOH C O 1 HETATM 11808 O O . HOH N 6 . ? 1.084 5.568 41.456 1.00 48.51 ? 1407 HOH C O 1 HETATM 11809 O O . HOH N 6 . ? -14.190 -20.439 44.129 1.00 43.20 ? 1408 HOH C O 1 HETATM 11810 O O . HOH N 6 . ? 13.328 -14.639 33.220 1.00 33.46 ? 1409 HOH C O 1 HETATM 11811 O O . HOH N 6 . ? -22.847 -38.602 34.071 1.00 35.40 ? 1410 HOH C O 1 HETATM 11812 O O . HOH N 6 . ? 12.533 -16.604 20.515 1.00 30.30 ? 1411 HOH C O 1 HETATM 11813 O O . HOH N 6 . ? -21.321 -35.644 37.535 1.00 34.29 ? 1412 HOH C O 1 HETATM 11814 O O . HOH N 6 . ? 22.450 -3.992 27.868 1.00 35.30 ? 1413 HOH C O 1 HETATM 11815 O O . HOH N 6 . ? -13.270 -22.795 43.684 1.00 49.23 ? 1414 HOH C O 1 HETATM 11816 O O . HOH N 6 . ? 19.834 -23.527 23.726 1.00 39.69 ? 1415 HOH C O 1 HETATM 11817 O O . HOH N 6 . ? -6.951 -27.244 34.735 1.00 24.53 ? 1416 HOH C O 1 HETATM 11818 O O . HOH N 6 . ? 0.963 -28.369 1.407 1.00 51.83 ? 1417 HOH C O 1 HETATM 11819 O O . HOH N 6 . ? 7.397 -23.748 34.392 1.00 35.10 ? 1418 HOH C O 1 HETATM 11820 O O . HOH N 6 . ? 13.814 -23.746 8.097 1.00 38.83 ? 1419 HOH C O 1 HETATM 11821 O O . HOH N 6 . ? 10.303 -39.662 31.457 1.00 38.23 ? 1420 HOH C O 1 HETATM 11822 O O . HOH N 6 . ? 16.081 -4.007 36.145 1.00 46.22 ? 1421 HOH C O 1 HETATM 11823 O O . HOH N 6 . ? -44.954 -0.805 14.173 1.00 39.79 ? 1422 HOH C O 1 HETATM 11824 O O . HOH N 6 . ? 2.346 -37.264 2.892 1.00 39.40 ? 1423 HOH C O 1 HETATM 11825 O O . HOH N 6 . ? -23.094 -30.926 13.827 1.00 35.27 ? 1424 HOH C O 1 HETATM 11826 O O . HOH N 6 . ? -6.181 -27.635 9.583 1.00 31.97 ? 1425 HOH C O 1 HETATM 11827 O O . HOH N 6 . ? -2.415 4.687 9.207 1.00 39.48 ? 1426 HOH C O 1 HETATM 11828 O O . HOH N 6 . ? 16.683 10.625 31.700 1.00 40.59 ? 1427 HOH C O 1 HETATM 11829 O O . HOH N 6 . ? 18.622 -3.755 9.424 1.00 36.72 ? 1428 HOH C O 1 HETATM 11830 O O . HOH N 6 . ? 23.713 -5.555 24.495 1.00 36.20 ? 1429 HOH C O 1 HETATM 11831 O O . HOH N 6 . ? -26.482 -4.649 2.142 1.00 34.13 ? 1430 HOH C O 1 HETATM 11832 O O . HOH N 6 . ? 15.810 -44.888 14.632 1.00 36.44 ? 1431 HOH C O 1 HETATM 11833 O O . HOH N 6 . ? 17.349 -6.377 35.400 1.00 46.23 ? 1432 HOH C O 1 HETATM 11834 O O . HOH N 6 . ? 6.780 1.665 7.651 1.00 39.29 ? 1433 HOH C O 1 HETATM 11835 O O . HOH N 6 . ? 2.094 1.915 7.500 1.00 35.44 ? 1434 HOH C O 1 HETATM 11836 O O . HOH N 6 . ? -39.512 -11.086 6.074 1.00 35.13 ? 1435 HOH C O 1 HETATM 11837 O O . HOH N 6 . ? -12.323 -12.581 44.926 1.00 41.64 ? 1436 HOH C O 1 HETATM 11838 O O . HOH N 6 . ? 10.074 -27.920 6.769 1.00 30.95 ? 1437 HOH C O 1 HETATM 11839 O O . HOH N 6 . ? 0.210 -14.443 20.967 1.00 29.63 ? 1438 HOH C O 1 HETATM 11840 O O . HOH N 6 . ? -25.119 -40.342 34.143 1.00 34.31 ? 1439 HOH C O 1 HETATM 11841 O O . HOH N 6 . ? -38.143 -5.385 3.971 1.00 36.82 ? 1440 HOH C O 1 HETATM 11842 O O . HOH N 6 . ? -23.011 1.715 5.400 1.00 35.12 ? 1441 HOH C O 1 HETATM 11843 O O . HOH N 6 . ? -10.648 1.722 15.024 1.00 43.87 ? 1442 HOH C O 1 HETATM 11844 O O . HOH N 6 . ? -25.937 -2.011 23.007 1.00 32.30 ? 1443 HOH C O 1 HETATM 11845 O O . HOH N 6 . ? -12.047 -10.004 43.099 1.00 44.83 ? 1444 HOH C O 1 HETATM 11846 O O . HOH N 6 . ? -0.720 7.415 11.889 1.00 46.48 ? 1445 HOH C O 1 HETATM 11847 O O . HOH N 6 . ? 0.135 -41.437 19.207 1.00 34.57 ? 1446 HOH C O 1 HETATM 11848 O O . HOH N 6 . ? -22.817 1.938 15.101 1.00 38.69 ? 1447 HOH C O 1 HETATM 11849 O O . HOH N 6 . ? -33.750 -16.558 39.492 1.00 30.01 ? 1448 HOH C O 1 HETATM 11850 O O . HOH N 6 . ? -1.817 7.937 25.376 1.00 33.26 ? 1449 HOH C O 1 HETATM 11851 O O . HOH N 6 . ? -2.876 -39.074 7.609 1.00 37.87 ? 1450 HOH C O 1 HETATM 11852 O O . HOH N 6 . ? -39.223 -16.399 24.568 1.00 44.94 ? 1451 HOH C O 1 HETATM 11853 O O . HOH N 6 . ? -1.848 -26.698 31.061 1.00 38.53 ? 1452 HOH C O 1 HETATM 11854 O O . HOH N 6 . ? 26.240 -8.808 21.534 1.00 36.44 ? 1453 HOH C O 1 HETATM 11855 O O . HOH N 6 . ? -31.379 0.602 11.542 1.00 37.49 ? 1454 HOH C O 1 HETATM 11856 O O . HOH N 6 . ? 2.264 -42.683 6.019 1.00 31.12 ? 1455 HOH C O 1 HETATM 11857 O O . HOH N 6 . ? 17.115 2.403 27.294 1.00 31.46 ? 1456 HOH C O 1 HETATM 11858 O O . HOH N 6 . ? -14.121 -12.239 43.182 1.00 34.43 ? 1457 HOH C O 1 HETATM 11859 O O . HOH N 6 . ? 2.937 9.796 39.437 1.00 55.86 ? 1458 HOH C O 1 HETATM 11860 O O . HOH N 6 . ? -30.609 5.562 17.594 1.00 25.66 ? 1459 HOH C O 1 HETATM 11861 O O . HOH N 6 . ? -9.452 3.627 9.084 1.00 39.89 ? 1460 HOH C O 1 HETATM 11862 O O . HOH N 6 . ? -4.184 -11.564 10.659 1.00 34.37 ? 1461 HOH C O 1 HETATM 11863 O O . HOH N 6 . ? 10.521 -16.002 16.121 1.00 37.57 ? 1462 HOH C O 1 HETATM 11864 O O . HOH N 6 . ? 14.077 -40.344 28.989 1.00 36.64 ? 1463 HOH C O 1 HETATM 11865 O O . HOH N 6 . ? -16.167 -40.571 34.113 1.00 34.83 ? 1464 HOH C O 1 HETATM 11866 O O . HOH N 6 . ? -29.607 -11.731 31.575 1.00 34.23 ? 1465 HOH C O 1 HETATM 11867 O O . HOH N 6 . ? -0.659 -16.027 46.119 1.00 36.26 ? 1466 HOH C O 1 HETATM 11868 O O . HOH N 6 . ? -10.261 -23.168 43.053 1.00 47.75 ? 1467 HOH C O 1 HETATM 11869 O O . HOH N 6 . ? 16.962 -37.117 15.107 1.00 43.30 ? 1468 HOH C O 1 HETATM 11870 O O . HOH N 6 . ? 10.075 -24.892 38.130 1.00 44.24 ? 1469 HOH C O 1 HETATM 11871 O O . HOH N 6 . ? -22.150 -13.905 4.655 1.00 37.95 ? 1470 HOH C O 1 HETATM 11872 O O . HOH N 6 . ? -31.619 -19.569 42.559 1.00 30.13 ? 1471 HOH C O 1 HETATM 11873 O O . HOH N 6 . ? -7.468 -38.063 12.542 1.00 32.88 ? 1472 HOH C O 1 HETATM 11874 O O . HOH N 6 . ? -31.153 -36.646 25.807 1.00 33.22 ? 1473 HOH C O 1 HETATM 11875 O O . HOH N 6 . ? 6.309 9.438 37.873 1.00 42.41 ? 1474 HOH C O 1 HETATM 11876 O O . HOH N 6 . ? -32.170 -3.108 28.217 1.00 34.15 ? 1475 HOH C O 1 HETATM 11877 O O . HOH N 6 . ? 15.468 10.696 23.014 1.00 39.67 ? 1476 HOH C O 1 HETATM 11878 O O . HOH N 6 . ? -1.517 -33.301 29.120 1.00 32.78 ? 1477 HOH C O 1 HETATM 11879 O O . HOH N 6 . ? -28.846 -37.662 28.429 1.00 53.71 ? 1478 HOH C O 1 HETATM 11880 O O . HOH N 6 . ? -2.075 -27.779 34.696 1.00 45.06 ? 1479 HOH C O 1 HETATM 11881 O O . HOH N 6 . ? -28.999 -1.109 22.364 1.00 48.87 ? 1480 HOH C O 1 HETATM 11882 O O . HOH N 6 . ? -24.192 -24.925 13.168 1.00 21.95 ? 1481 HOH C O 1 HETATM 11883 O O . HOH N 6 . ? -24.701 -10.659 -0.993 1.00 45.64 ? 1482 HOH C O 1 HETATM 11884 O O . HOH N 6 . ? -1.708 -38.644 30.332 1.00 30.01 ? 1483 HOH C O 1 HETATM 11885 O O . HOH N 6 . ? -16.990 -23.365 43.688 1.00 40.97 ? 1484 HOH C O 1 HETATM 11886 O O . HOH N 6 . ? -25.719 -3.403 29.695 1.00 42.68 ? 1485 HOH C O 1 HETATM 11887 O O . HOH N 6 . ? 2.780 18.561 34.566 1.00 42.99 ? 1486 HOH C O 1 HETATM 11888 O O . HOH N 6 . ? -30.093 -28.795 40.051 1.00 24.66 ? 1487 HOH C O 1 HETATM 11889 O O . HOH N 6 . ? -7.973 -3.973 36.419 1.00 20.79 ? 1488 HOH C O 1 HETATM 11890 O O . HOH N 6 . ? -8.895 -20.560 42.191 1.00 29.73 ? 1489 HOH C O 1 HETATM 11891 O O . HOH N 6 . ? -21.354 -38.749 36.181 1.00 36.65 ? 1490 HOH C O 1 HETATM 11892 O O . HOH N 6 . ? 2.438 -41.553 17.514 1.00 30.82 ? 1491 HOH C O 1 HETATM 11893 O O . HOH N 6 . ? -24.246 4.220 13.910 1.00 38.36 ? 1492 HOH C O 1 HETATM 11894 O O . HOH N 6 . ? 16.057 -39.969 30.529 1.00 45.85 ? 1493 HOH C O 1 HETATM 11895 O O . HOH N 6 . ? 9.539 -36.342 -10.814 1.00 35.83 ? 1494 HOH C O 1 HETATM 11896 O O . HOH N 6 . ? -34.365 -19.749 16.966 1.00 30.58 ? 1495 HOH C O 1 HETATM 11897 O O . HOH N 6 . ? -31.738 -3.475 6.195 1.00 41.06 ? 1496 HOH C O 1 HETATM 11898 O O . HOH N 6 . ? -42.045 0.346 22.442 1.00 39.57 ? 1497 HOH C O 1 HETATM 11899 O O . HOH N 6 . ? -2.141 -24.458 17.823 1.00 35.90 ? 1498 HOH C O 1 HETATM 11900 O O . HOH N 6 . ? -20.317 -21.872 45.140 1.00 43.47 ? 1499 HOH C O 1 HETATM 11901 O O . HOH N 6 . ? 7.558 -33.821 33.285 1.00 46.73 ? 1500 HOH C O 1 HETATM 11902 O O . HOH N 6 . ? -14.501 -36.866 35.272 1.00 29.28 ? 1501 HOH C O 1 HETATM 11903 O O . HOH N 6 . ? -0.443 -3.213 41.272 1.00 45.02 ? 1502 HOH C O 1 HETATM 11904 O O . HOH N 6 . ? 19.057 -5.576 44.582 1.00 47.13 ? 1503 HOH C O 1 HETATM 11905 O O . HOH N 6 . ? -1.302 -25.588 19.711 1.00 30.52 ? 1504 HOH C O 1 HETATM 11906 O O . HOH N 6 . ? -33.954 -29.784 34.670 1.00 18.17 ? 1505 HOH C O 1 HETATM 11907 O O . HOH N 6 . ? -35.702 -25.316 37.515 1.00 20.54 ? 1506 HOH C O 1 HETATM 11908 O O . HOH N 6 . ? -1.680 -41.544 8.501 1.00 38.09 ? 1507 HOH C O 1 HETATM 11909 O O . HOH N 6 . ? -28.642 -29.448 14.333 1.00 34.85 ? 1508 HOH C O 1 HETATM 11910 O O . HOH N 6 . ? -26.487 4.144 13.366 1.00 34.61 ? 1509 HOH C O 1 HETATM 11911 O O . HOH N 6 . ? -19.077 -15.431 6.977 1.00 27.29 ? 1510 HOH C O 1 HETATM 11912 O O . HOH N 6 . ? -2.559 -11.879 12.039 1.00 39.51 ? 1511 HOH C O 1 HETATM 11913 O O . HOH N 6 . ? -32.602 -28.996 32.260 1.00 21.74 ? 1512 HOH C O 1 HETATM 11914 O O . HOH N 6 . ? 14.471 9.602 30.497 1.00 32.20 ? 1513 HOH C O 1 HETATM 11915 O O . HOH N 6 . ? 13.599 -25.699 35.303 1.00 37.98 ? 1514 HOH C O 1 HETATM 11916 O O . HOH N 6 . ? -36.251 6.150 20.714 1.00 38.09 ? 1515 HOH C O 1 HETATM 11917 O O . HOH N 6 . ? -25.341 -16.324 26.641 1.00 37.81 ? 1516 HOH C O 1 HETATM 11918 O O . HOH N 6 . ? 4.392 -43.827 13.839 1.00 48.59 ? 1517 HOH C O 1 HETATM 11919 O O . HOH N 6 . ? -24.082 -4.243 9.969 1.00 22.90 ? 1518 HOH C O 1 HETATM 11920 O O . HOH N 6 . ? -32.328 -22.292 28.620 1.00 29.37 ? 1519 HOH C O 1 HETATM 11921 O O . HOH N 6 . ? 5.357 -44.240 26.477 1.00 40.01 ? 1520 HOH C O 1 HETATM 11922 O O . HOH N 6 . ? 16.650 -6.884 31.654 1.00 34.56 ? 1521 HOH C O 1 HETATM 11923 O O . HOH N 6 . ? -32.368 -32.304 31.352 1.00 27.94 ? 1522 HOH C O 1 HETATM 11924 O O . HOH N 6 . ? -4.444 -34.552 29.598 1.00 36.23 ? 1523 HOH C O 1 HETATM 11925 O O . HOH N 6 . ? 20.726 -1.334 33.748 1.00 37.77 ? 1524 HOH C O 1 HETATM 11926 O O . HOH N 6 . ? -12.781 -44.414 22.626 1.00 44.14 ? 1525 HOH C O 1 HETATM 11927 O O . HOH N 6 . ? -8.229 0.395 7.213 1.00 36.36 ? 1526 HOH C O 1 HETATM 11928 O O . HOH N 6 . ? -35.583 -9.954 2.179 1.00 35.75 ? 1527 HOH C O 1 HETATM 11929 O O . HOH N 6 . ? 19.161 -26.549 7.324 1.00 36.54 ? 1528 HOH C O 1 HETATM 11930 O O . HOH N 6 . ? -8.342 -43.945 19.804 1.00 50.01 ? 1529 HOH C O 1 HETATM 11931 O O . HOH N 6 . ? 17.960 -5.187 31.268 1.00 57.21 ? 1530 HOH C O 1 HETATM 11932 O O . HOH N 6 . ? 10.908 11.376 22.546 1.00 40.81 ? 1531 HOH C O 1 HETATM 11933 O O . HOH N 6 . ? 0.873 -25.944 13.488 1.00 39.29 ? 1532 HOH C O 1 HETATM 11934 O O . HOH N 6 . ? 12.153 -26.548 22.464 1.00 33.46 ? 1533 HOH C O 1 HETATM 11935 O O . HOH N 6 . ? -34.654 -33.328 32.430 1.00 33.24 ? 1534 HOH C O 1 HETATM 11936 O O . HOH N 6 . ? 8.391 -46.685 13.827 1.00 47.26 ? 1535 HOH C O 1 HETATM 11937 O O . HOH N 6 . ? -3.462 -28.267 32.484 1.00 41.50 ? 1536 HOH C O 1 HETATM 11938 O O . HOH N 6 . ? 9.001 -29.914 38.802 1.00 38.71 ? 1537 HOH C O 1 HETATM 11939 O O . HOH N 6 . ? 18.925 -3.563 34.065 1.00 47.81 ? 1538 HOH C O 1 HETATM 11940 O O . HOH N 6 . ? 1.620 -5.249 42.259 1.00 37.16 ? 1539 HOH C O 1 HETATM 11941 O O . HOH N 6 . ? -37.683 -16.243 22.411 1.00 33.58 ? 1540 HOH C O 1 HETATM 11942 O O . HOH N 6 . ? -39.394 4.886 12.588 1.00 41.11 ? 1541 HOH C O 1 HETATM 11943 O O . HOH N 6 . ? -7.986 -9.098 43.065 1.00 44.20 ? 1542 HOH C O 1 HETATM 11944 O O . HOH N 6 . ? -17.899 2.116 23.608 1.00 41.75 ? 1543 HOH C O 1 HETATM 11945 O O . HOH N 6 . ? 8.107 -4.864 6.005 1.00 39.42 ? 1544 HOH C O 1 HETATM 11946 O O . HOH N 6 . ? 13.076 5.115 43.378 1.00 39.78 ? 1545 HOH C O 1 HETATM 11947 O O . HOH N 6 . ? 5.471 7.688 15.152 1.00 49.04 ? 1546 HOH C O 1 HETATM 11948 O O . HOH N 6 . ? -21.038 -34.136 13.429 1.00 47.16 ? 1547 HOH C O 1 HETATM 11949 O O . HOH N 6 . ? 17.439 -25.502 30.102 1.00 43.11 ? 1548 HOH C O 1 HETATM 11950 O O . HOH N 6 . ? 12.825 9.124 19.444 1.00 50.16 ? 1549 HOH C O 1 HETATM 11951 O O . HOH N 6 . ? -15.446 3.187 22.476 1.00 47.66 ? 1550 HOH C O 1 HETATM 11952 O O . HOH N 6 . ? 3.308 15.302 27.669 1.00 37.73 ? 1551 HOH C O 1 HETATM 11953 O O . HOH N 6 . ? -0.834 -29.575 31.265 1.00 45.31 ? 1552 HOH C O 1 HETATM 11954 O O . HOH N 6 . ? -6.620 -5.062 5.144 1.00 43.90 ? 1553 HOH C O 1 HETATM 11955 O O . HOH N 6 . ? -6.102 -23.316 42.782 1.00 50.66 ? 1554 HOH C O 1 HETATM 11956 O O . HOH N 6 . ? 7.356 -28.998 17.558 1.00 44.31 ? 1555 HOH C O 1 HETATM 11957 O O . HOH N 6 . ? -16.932 -40.101 13.203 1.00 34.85 ? 1556 HOH C O 1 HETATM 11958 O O . HOH N 6 . ? 14.915 -9.964 11.944 1.00 44.11 ? 1557 HOH C O 1 HETATM 11959 O O . HOH N 6 . ? 11.249 1.581 10.121 1.00 38.42 ? 1558 HOH C O 1 HETATM 11960 O O . HOH N 6 . ? -19.001 -14.603 43.611 1.00 47.99 ? 1559 HOH C O 1 HETATM 11961 O O . HOH N 6 . ? -1.245 -31.939 31.838 1.00 36.92 ? 1560 HOH C O 1 HETATM 11962 O O . HOH N 6 . ? -14.305 -0.910 38.082 1.00 32.97 ? 1561 HOH C O 1 HETATM 11963 O O . HOH N 6 . ? 21.495 3.091 20.355 1.00 46.48 ? 1562 HOH C O 1 HETATM 11964 O O . HOH N 6 . ? 17.212 -31.549 19.315 1.00 40.61 ? 1563 HOH C O 1 HETATM 11965 O O . HOH N 6 . ? -15.382 2.980 35.655 1.00 35.28 ? 1564 HOH C O 1 HETATM 11966 O O . HOH N 6 . ? -13.277 3.152 24.460 1.00 40.57 ? 1565 HOH C O 1 HETATM 11967 O O . HOH N 6 . ? -28.494 -12.345 39.992 1.00 46.81 ? 1566 HOH C O 1 HETATM 11968 O O . HOH N 6 . ? 13.081 -24.403 -5.109 1.00 31.99 ? 1567 HOH C O 1 HETATM 11969 O O . HOH N 6 . ? 7.432 9.869 16.230 1.00 42.67 ? 1568 HOH C O 1 HETATM 11970 O O . HOH N 6 . ? -13.948 1.081 25.724 1.00 43.20 ? 1569 HOH C O 1 HETATM 11971 O O . HOH N 6 . ? -28.162 -4.167 -0.075 1.00 36.44 ? 1570 HOH C O 1 HETATM 11972 O O . HOH N 6 . ? -25.328 -41.774 16.760 1.00 49.38 ? 1571 HOH C O 1 HETATM 11973 O O . HOH N 6 . ? 14.078 -11.302 37.168 1.00 46.88 ? 1572 HOH C O 1 HETATM 11974 O O . HOH N 6 . ? 12.656 -40.915 20.378 1.00 44.44 ? 1573 HOH C O 1 HETATM 11975 O O . HOH N 6 . ? 2.358 -3.334 4.420 1.00 36.79 ? 1574 HOH C O 1 HETATM 11976 O O . HOH N 6 . ? -8.441 -24.593 42.935 1.00 53.55 ? 1575 HOH C O 1 HETATM 11977 O O . HOH N 6 . ? -12.359 -45.532 18.488 1.00 47.22 ? 1576 HOH C O 1 HETATM 11978 O O . HOH N 6 . ? -3.826 -42.253 14.795 1.00 35.56 ? 1577 HOH C O 1 HETATM 11979 O O . HOH N 6 . ? 0.558 9.231 25.940 1.00 38.09 ? 1578 HOH C O 1 HETATM 11980 O O . HOH N 6 . ? -43.559 3.185 14.222 1.00 46.71 ? 1579 HOH C O 1 HETATM 11981 O O . HOH N 6 . ? -4.705 -30.901 32.826 1.00 44.94 ? 1580 HOH C O 1 HETATM 11982 O O . HOH N 6 . ? 16.446 -10.302 40.546 1.00 49.08 ? 1581 HOH C O 1 HETATM 11983 O O . HOH N 6 . ? -8.725 -4.411 5.588 1.00 50.60 ? 1582 HOH C O 1 HETATM 11984 O O . HOH N 6 . ? 21.415 -10.300 28.222 1.00 54.40 ? 1583 HOH C O 1 HETATM 11985 O O . HOH N 6 . ? -6.195 -29.698 35.147 1.00 51.80 ? 1584 HOH C O 1 HETATM 11986 O O . HOH N 6 . ? -24.417 5.995 15.999 1.00 43.11 ? 1585 HOH C O 1 HETATM 11987 O O . HOH N 6 . ? 13.316 -26.259 -6.723 1.00 55.46 ? 1586 HOH C O 1 HETATM 11988 O O . HOH N 6 . ? -11.939 3.927 8.489 1.00 40.35 ? 1587 HOH C O 1 HETATM 11989 O O . HOH N 6 . ? -4.677 1.591 6.670 1.00 45.42 ? 1588 HOH C O 1 HETATM 11990 O O . HOH N 6 . ? 20.257 -29.415 19.456 1.00 47.79 ? 1589 HOH C O 1 HETATM 11991 O O . HOH N 6 . ? 10.576 -20.811 -5.811 1.00 32.22 ? 1590 HOH C O 1 HETATM 11992 O O . HOH N 6 . ? -11.293 -19.175 43.709 1.00 41.78 ? 1591 HOH C O 1 HETATM 11993 O O . HOH N 6 . ? 2.829 -39.914 2.679 1.00 37.16 ? 1592 HOH C O 1 HETATM 11994 O O . HOH N 6 . ? -10.370 -29.053 8.587 1.00 24.85 ? 1593 HOH C O 1 HETATM 11995 O O . HOH N 6 . ? 18.709 -15.235 -4.215 1.00 46.21 ? 1594 HOH C O 1 HETATM 11996 O O . HOH N 6 . ? -25.370 -22.381 10.227 1.00 40.28 ? 1595 HOH C O 1 HETATM 11997 O O . HOH N 6 . ? 5.500 -21.829 30.952 1.00 43.71 ? 1596 HOH C O 1 HETATM 11998 O O . HOH N 6 . ? -3.743 -33.477 0.824 1.00 27.55 ? 1597 HOH C O 1 HETATM 11999 O O . HOH O 6 . ? -10.647 -12.907 13.819 1.00 21.11 ? 201 HOH D O 1 HETATM 12000 O O . HOH O 6 . ? -12.505 -14.380 12.586 1.00 17.56 ? 202 HOH D O 1 HETATM 12001 O O . HOH O 6 . ? 0.293 -15.552 18.310 1.00 24.53 ? 203 HOH D O 1 HETATM 12002 O O . HOH O 6 . ? -10.509 -11.644 9.860 1.00 18.83 ? 204 HOH D O 1 HETATM 12003 O O . HOH O 6 . ? -0.075 -15.839 14.854 1.00 24.56 ? 205 HOH D O 1 HETATM 12004 O O . HOH O 6 . ? -8.120 -18.627 9.132 1.00 43.99 ? 206 HOH D O 1 HETATM 12005 O O . HOH O 6 . ? -7.518 -20.092 12.028 1.00 26.09 ? 207 HOH D O 1 HETATM 12006 O O . HOH O 6 . ? -2.688 -16.902 12.799 1.00 22.39 ? 208 HOH D O 1 HETATM 12007 O O . HOH O 6 . ? -15.191 -11.695 4.632 1.00 31.32 ? 209 HOH D O 1 HETATM 12008 O O . HOH O 6 . ? -11.114 -11.463 6.880 1.00 41.82 ? 210 HOH D O 1 HETATM 12009 O O . HOH O 6 . ? -9.310 -16.793 2.599 1.00 42.74 ? 211 HOH D O 1 HETATM 12010 O O . HOH O 6 . ? 2.973 -21.176 13.809 1.00 34.42 ? 212 HOH D O 1 # loop_ _atom_site_anisotrop.id _atom_site_anisotrop.type_symbol _atom_site_anisotrop.pdbx_label_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_label_comp_id _atom_site_anisotrop.pdbx_label_asym_id _atom_site_anisotrop.pdbx_label_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_atom_id 1 N N . PRO A 6 ? 1.0458 1.2388 1.1830 -0.0946 -0.1463 0.4636 314 PRO A N 2 C CA . PRO A 6 ? 1.0376 1.1939 1.2069 -0.1102 -0.1676 0.4647 314 PRO A CA 3 C C . PRO A 6 ? 1.0089 1.1225 1.1507 -0.0984 -0.1804 0.4463 314 PRO A C 4 O O . PRO A 6 ? 0.9890 1.0820 1.1324 -0.0908 -0.1951 0.4208 314 PRO A O 5 C CB . PRO A 6 ? 1.0922 1.2585 1.2909 -0.1312 -0.1608 0.5022 314 PRO A CB 6 C CG . PRO A 6 ? 1.0916 1.3150 1.2945 -0.1305 -0.1351 0.5203 314 PRO A CG 7 C CD . PRO A 6 ? 1.0771 1.3106 1.2256 -0.1026 -0.1246 0.4975 314 PRO A CD 8 N N . THR A 7 ? 0.9997 1.1027 1.1159 -0.0949 -0.1737 0.4598 315 THR A N 9 C CA . THR A 7 ? 0.9728 1.0383 1.0622 -0.0821 -0.1856 0.4447 315 THR A CA 10 C C . THR A 7 ? 0.8992 0.9702 0.9583 -0.0609 -0.1837 0.4163 315 THR A C 11 O O . THR A 7 ? 0.8796 0.9301 0.9350 -0.0512 -0.1962 0.3951 315 THR A O 12 C CB . THR A 7 ? 1.0322 1.0837 1.0977 -0.0820 -0.1795 0.4676 315 THR A CB 13 O OG1 . THR A 7 ? 1.0679 1.1171 1.1671 -0.1048 -0.1807 0.4970 315 THR A OG1 14 C CG2 . THR A 7 ? 1.0432 1.0544 1.0850 -0.0688 -0.1951 0.4527 315 THR A CG2 15 N N . HIS A 8 ? 0.8558 0.9554 0.8947 -0.0531 -0.1688 0.4167 316 HIS A N 16 C CA . HIS A 8 ? 0.8010 0.9031 0.8136 -0.0349 -0.1705 0.3902 316 HIS A CA 17 C C . HIS A 8 ? 0.6910 0.7991 0.7291 -0.0370 -0.1775 0.3677 316 HIS A C 18 O O . HIS A 8 ? 0.6488 0.7480 0.6799 -0.0267 -0.1847 0.3453 316 HIS A O 19 C CB . HIS A 8 ? 0.8280 0.9548 0.8101 -0.0236 -0.1565 0.3955 316 HIS A CB 20 C CG . HIS A 8 ? 0.8313 0.9533 0.7855 -0.0052 -0.1636 0.3679 316 HIS A CG 21 N ND1 . HIS A 8 ? 0.8325 0.9308 0.7855 0.0009 -0.1786 0.3465 316 HIS A ND1 22 C CD2 . HIS A 8 ? 0.8338 0.9710 0.7625 0.0087 -0.1598 0.3589 316 HIS A CD2 23 C CE1 . HIS A 8 ? 0.8223 0.9199 0.7543 0.0147 -0.1847 0.3270 316 HIS A CE1 24 N NE2 . HIS A 8 ? 0.8324 0.9489 0.7460 0.0208 -0.1753 0.3322 316 HIS A NE2 25 N N . ALA A 9 ? 0.6416 0.7656 0.7107 -0.0501 -0.1754 0.3756 317 ALA A N 26 C CA . ALA A 9 ? 0.5946 0.7218 0.6842 -0.0503 -0.1820 0.3556 317 ALA A CA 27 C C . ALA A 9 ? 0.5852 0.6847 0.6856 -0.0475 -0.1955 0.3436 317 ALA A C 28 O O . ALA A 9 ? 0.5748 0.6742 0.6773 -0.0388 -0.1983 0.3227 317 ALA A O 29 C CB . ALA A 9 ? 0.5950 0.7423 0.7144 -0.0633 -0.1804 0.3680 317 ALA A CB 30 N N . ASP A 10 ? 0.6056 0.6823 0.7115 -0.0534 -0.2035 0.3581 318 ASP A N 31 C CA . ASP A 10 ? 0.6497 0.6979 0.7599 -0.0459 -0.2180 0.3472 318 ASP A CA 32 C C . ASP A 10 ? 0.6395 0.6871 0.7302 -0.0290 -0.2169 0.3301 318 ASP A C 33 O O . ASP A 10 ? 0.5957 0.6424 0.6928 -0.0178 -0.2214 0.3135 318 ASP A O 34 C CB . ASP A 10 ? 0.7221 0.7413 0.8362 -0.0544 -0.2285 0.3664 318 ASP A CB 35 C CG . ASP A 10 ? 0.7762 0.7793 0.9213 -0.0676 -0.2434 0.3742 318 ASP A CG 36 O OD1 . ASP A 10 ? 0.7905 0.7933 0.9476 -0.0611 -0.2509 0.3565 318 ASP A OD1 37 O OD2 . ASP A 10 ? 0.8096 0.7986 0.9672 -0.0839 -0.2488 0.3980 318 ASP A OD2 38 N N A SER A 11 ? 0.6631 0.7124 0.7305 -0.0259 -0.2116 0.3356 319 SER A N 39 N N B SER A 11 ? 0.6632 0.7124 0.7306 -0.0259 -0.2115 0.3357 319 SER A N 40 C CA A SER A 11 ? 0.6654 0.7128 0.7185 -0.0117 -0.2146 0.3220 319 SER A CA 41 C CA B SER A 11 ? 0.6654 0.7129 0.7183 -0.0118 -0.2145 0.3221 319 SER A CA 42 C C A SER A 11 ? 0.6266 0.6956 0.6852 -0.0076 -0.2101 0.3046 319 SER A C 43 C C B SER A 11 ? 0.6266 0.6956 0.6855 -0.0076 -0.2101 0.3047 319 SER A C 44 O O A SER A 11 ? 0.6200 0.6924 0.6852 0.0011 -0.2142 0.2932 319 SER A O 45 O O B SER A 11 ? 0.6195 0.6918 0.6852 0.0011 -0.2142 0.2932 319 SER A O 46 C CB A SER A 11 ? 0.7030 0.7419 0.7257 -0.0071 -0.2137 0.3313 319 SER A CB 47 C CB B SER A 11 ? 0.7024 0.7421 0.7247 -0.0073 -0.2132 0.3313 319 SER A CB 48 O OG A SER A 11 ? 0.7050 0.7592 0.7117 -0.0095 -0.2032 0.3372 319 SER A OG 49 O OG B SER A 11 ? 0.7448 0.7631 0.7604 -0.0115 -0.2165 0.3498 319 SER A OG 50 N N . LEU A 12 ? 0.5984 0.6832 0.6560 -0.0139 -0.2019 0.3047 320 LEU A N 51 C CA . LEU A 12 ? 0.5840 0.6844 0.6457 -0.0113 -0.1989 0.2891 320 LEU A CA 52 C C . LEU A 12 ? 0.5398 0.6453 0.6247 -0.0100 -0.1993 0.2803 320 LEU A C 53 O O . LEU A 12 ? 0.5161 0.6298 0.6078 -0.0046 -0.1995 0.2703 320 LEU A O 54 C CB . LEU A 12 ? 0.6010 0.7153 0.6540 -0.0155 -0.1916 0.2910 320 LEU A CB 55 C CG . LEU A 12 ? 0.6402 0.7526 0.6608 -0.0083 -0.1908 0.2952 320 LEU A CG 56 C CD1 . LEU A 12 ? 0.6265 0.7577 0.6391 -0.0097 -0.1820 0.3016 320 LEU A CD1 57 C CD2 . LEU A 12 ? 0.6602 0.7652 0.6676 0.0020 -0.1998 0.2787 320 LEU A CD2 58 N N . ASN A 13 ? 0.5387 0.6387 0.6355 -0.0141 -0.2008 0.2856 321 ASN A N 59 C CA . ASN A 13 ? 0.5338 0.6336 0.6447 -0.0067 -0.2035 0.2762 321 ASN A CA 60 C C . ASN A 13 ? 0.5609 0.6539 0.6727 0.0073 -0.2092 0.2726 321 ASN A C 61 O O . ASN A 13 ? 0.5582 0.6628 0.6766 0.0193 -0.2072 0.2639 321 ASN A O 62 C CB . ASN A 13 ? 0.5281 0.6158 0.6502 -0.0125 -0.2106 0.2819 321 ASN A CB 63 C CG . ASN A 13 ? 0.4976 0.5791 0.6263 0.0015 -0.2171 0.2691 321 ASN A CG 64 O OD1 . ASN A 13 ? 0.4779 0.5740 0.6073 0.0068 -0.2112 0.2584 321 ASN A OD1 65 N ND2 . ASN A 13 ? 0.5250 0.5822 0.6548 0.0102 -0.2306 0.2695 321 ASN A ND2 66 N N . ASN A 14 ? 0.5585 0.6350 0.6628 0.0076 -0.2158 0.2810 322 ASN A N 67 C CA . ASN A 14 ? 0.6159 0.6874 0.7203 0.0226 -0.2225 0.2781 322 ASN A CA 68 C C . ASN A 14 ? 0.5852 0.6794 0.6947 0.0274 -0.2182 0.2727 322 ASN A C 69 O O . ASN A 14 ? 0.5899 0.6982 0.7113 0.0410 -0.2187 0.2683 322 ASN A O 70 C CB . ASN A 14 ? 0.6930 0.7397 0.7852 0.0211 -0.2314 0.2887 322 ASN A CB 71 C CG . ASN A 14 ? 0.7661 0.8079 0.8574 0.0388 -0.2399 0.2850 322 ASN A CG 72 O OD1 . ASN A 14 ? 0.7751 0.8277 0.8764 0.0550 -0.2414 0.2763 322 ASN A OD1 73 N ND2 . ASN A 14 ? 0.8175 0.8455 0.8954 0.0387 -0.2455 0.2920 322 ASN A ND2 74 N N . LEU A 15 ? 0.5629 0.6611 0.6644 0.0175 -0.2157 0.2742 323 LEU A N 75 C CA . LEU A 15 ? 0.5704 0.6847 0.6799 0.0185 -0.2167 0.2702 323 LEU A CA 76 C C . LEU A 15 ? 0.5320 0.6688 0.6599 0.0179 -0.2094 0.2658 323 LEU A C 77 O O . LEU A 15 ? 0.4778 0.6333 0.6247 0.0216 -0.2104 0.2672 323 LEU A O 78 C CB . LEU A 15 ? 0.6095 0.7170 0.7005 0.0115 -0.2191 0.2698 323 LEU A CB 79 C CG . LEU A 15 ? 0.6699 0.7580 0.7380 0.0157 -0.2271 0.2752 323 LEU A CG 80 C CD1 . LEU A 15 ? 0.6947 0.7787 0.7409 0.0156 -0.2306 0.2714 323 LEU A CD1 81 C CD2 . LEU A 15 ? 0.6763 0.7637 0.7545 0.0252 -0.2372 0.2756 323 LEU A CD2 82 N N . ALA A 16 ? 0.4994 0.6360 0.6231 0.0128 -0.2023 0.2627 324 ALA A N 83 C CA . ALA A 16 ? 0.4594 0.6139 0.5950 0.0133 -0.1951 0.2589 324 ALA A CA 84 C C . ALA A 16 ? 0.4517 0.6196 0.6005 0.0292 -0.1932 0.2600 324 ALA A C 85 O O . ALA A 16 ? 0.4429 0.6345 0.6082 0.0325 -0.1885 0.2637 324 ALA A O 86 C CB . ALA A 16 ? 0.4402 0.5894 0.5666 0.0075 -0.1903 0.2544 324 ALA A CB 87 N N . ASN A 17 ? 0.5019 0.6546 0.6430 0.0405 -0.1981 0.2583 325 ASN A N 88 C CA . ASN A 17 ? 0.5156 0.6770 0.6617 0.0634 -0.1995 0.2566 325 ASN A CA 89 C C . ASN A 17 ? 0.5290 0.7130 0.6925 0.0707 -0.2000 0.2631 325 ASN A C 90 O O . ASN A 17 ? 0.5093 0.7212 0.6871 0.0856 -0.1944 0.2663 325 ASN A O 91 C CB . ASN A 17 ? 0.5427 0.6746 0.6750 0.0748 -0.2111 0.2529 325 ASN A CB 92 C CG . ASN A 17 ? 0.5477 0.6603 0.6717 0.0683 -0.2138 0.2485 325 ASN A CG 93 O OD1 . ASN A 17 ? 0.5283 0.6525 0.6535 0.0651 -0.2066 0.2444 325 ASN A OD1 94 N ND2 . ASN A 17 ? 0.5667 0.6488 0.6849 0.0652 -0.2262 0.2507 325 ASN A ND2 95 N N . ILE A 18 ? 0.5627 0.7372 0.7259 0.0611 -0.2070 0.2666 326 ILE A N 96 C CA . ILE A 18 ? 0.5943 0.7886 0.7770 0.0663 -0.2113 0.2728 326 ILE A CA 97 C C . ILE A 18 ? 0.6135 0.8406 0.8232 0.0559 -0.2045 0.2811 326 ILE A C 98 O O . ILE A 18 ? 0.6038 0.8650 0.8395 0.0663 -0.2001 0.2900 326 ILE A O 99 C CB . ILE A 18 ? 0.5913 0.7638 0.7632 0.0584 -0.2226 0.2735 326 ILE A CB 100 C CG1 . ILE A 18 ? 0.6252 0.7660 0.7740 0.0676 -0.2299 0.2709 326 ILE A CG1 101 C CG2 . ILE A 18 ? 0.5699 0.7636 0.7654 0.0627 -0.2300 0.2793 326 ILE A CG2 102 C CD1 . ILE A 18 ? 0.5567 0.6736 0.6883 0.0601 -0.2389 0.2740 326 ILE A CD1 103 N N . LYS A 19 ? 0.6404 0.8580 0.8446 0.0363 -0.2043 0.2800 327 LYS A N 104 C CA . LYS A 19 ? 0.6543 0.8942 0.8822 0.0235 -0.2019 0.2887 327 LYS A CA 105 C C . LYS A 19 ? 0.6263 0.8942 0.8674 0.0307 -0.1877 0.2956 327 LYS A C 106 O O . LYS A 19 ? 0.6108 0.9105 0.8822 0.0259 -0.1836 0.3112 327 LYS A O 107 C CB . LYS A 19 ? 0.6867 0.9032 0.8971 0.0066 -0.2069 0.2819 327 LYS A CB 108 C CG . LYS A 19 ? 0.7391 0.9512 0.9603 -0.0042 -0.2221 0.2851 327 LYS A CG 109 C CD . LYS A 19 ? 0.7871 0.9888 1.0031 0.0034 -0.2332 0.2835 327 LYS A CD 110 C CE . LYS A 19 ? 0.8395 1.0359 1.0670 -0.0050 -0.2518 0.2855 327 LYS A CE 111 N NZ . LYS A 19 ? 0.8495 1.0773 1.1237 -0.0140 -0.2541 0.3014 327 LYS A NZ 112 N N . ARG A 20 ? 0.6210 0.8769 0.8394 0.0427 -0.1815 0.2859 328 ARG A N 113 C CA . ARG A 20 ? 0.6237 0.9019 0.8455 0.0564 -0.1694 0.2896 328 ARG A CA 114 C C . ARG A 20 ? 0.6355 0.9504 0.8792 0.0774 -0.1637 0.3012 328 ARG A C 115 O O . ARG A 20 ? 0.6249 0.9789 0.8905 0.0813 -0.1512 0.3175 328 ARG A O 116 C CB . ARG A 20 ? 0.6347 0.8854 0.8256 0.0680 -0.1701 0.2739 328 ARG A CB 117 C CG . ARG A 20 ? 0.6527 0.9196 0.8381 0.0887 -0.1610 0.2737 328 ARG A CG 118 C CD . ARG A 20 ? 0.7024 0.9355 0.8587 0.0988 -0.1683 0.2566 328 ARG A CD 119 N NE . ARG A 20 ? 0.7597 1.0026 0.9044 0.1223 -0.1628 0.2533 328 ARG A NE 120 C CZ . ARG A 20 ? 0.7913 1.0077 0.9128 0.1318 -0.1708 0.2388 328 ARG A CZ 121 N NH1 . ARG A 20 ? 0.7873 0.9720 0.9011 0.1171 -0.1822 0.2297 328 ARG A NH1 122 N NH2 . ARG A 20 ? 0.8181 1.0423 0.9256 0.1564 -0.1670 0.2353 328 ARG A NH2 123 N N . GLU A 21 ? 0.6709 0.9756 0.9092 0.0922 -0.1723 0.2948 329 GLU A N 124 C CA . GLU A 21 ? 0.7204 1.0597 0.9777 0.1168 -0.1683 0.3030 329 GLU A CA 125 C C . GLU A 21 ? 0.7134 1.0957 1.0149 0.1043 -0.1645 0.3247 329 GLU A C 126 O O . GLU A 21 ? 0.7252 1.1563 1.0533 0.1200 -0.1518 0.3409 329 GLU A O 127 C CB . GLU A 21 ? 0.7751 1.0861 1.0146 0.1346 -0.1833 0.2895 329 GLU A CB 128 C CG . GLU A 21 ? 0.8188 1.0870 1.0203 0.1482 -0.1912 0.2715 329 GLU A CG 129 C CD . GLU A 21 ? 0.8592 1.1418 1.0516 0.1736 -0.1825 0.2682 329 GLU A CD 130 O OE1 . GLU A 21 ? 0.8768 1.2001 1.0853 0.1963 -0.1724 0.2765 329 GLU A OE1 131 O OE2 . GLU A 21 ? 0.8637 1.1193 1.0328 0.1721 -0.1850 0.2578 329 GLU A OE2 132 N N . GLN A 22 ? 0.7070 1.0717 1.0162 0.0774 -0.1759 0.3259 330 GLN A N 133 C CA . GLN A 22 ? 0.7140 1.1100 1.0665 0.0617 -0.1791 0.3458 330 GLN A CA 134 C C . GLN A 22 ? 0.7156 1.1447 1.0939 0.0487 -0.1662 0.3673 330 GLN A C 135 O O . GLN A 22 ? 0.7260 1.1922 1.1488 0.0379 -0.1657 0.3916 330 GLN A O 136 C CB . GLN A 22 ? 0.7264 1.0854 1.0718 0.0398 -0.1988 0.3377 330 GLN A CB 137 C CG . GLN A 22 ? 0.7599 1.0871 1.0795 0.0509 -0.2115 0.3213 330 GLN A CG 138 C CD . GLN A 22 ? 0.7956 1.0862 1.0991 0.0335 -0.2283 0.3132 330 GLN A CD 139 O OE1 . GLN A 22 ? 0.8069 1.0962 1.1229 0.0145 -0.2344 0.3185 330 GLN A OE1 140 N NE2 . GLN A 22 ? 0.8166 1.0753 1.0896 0.0418 -0.2370 0.3009 330 GLN A NE2 141 N N . GLY A 23 ? 0.7054 1.1203 1.0571 0.0492 -0.1573 0.3601 331 GLY A N 142 C CA . GLY A 23 ? 0.6826 1.1245 1.0524 0.0389 -0.1455 0.3803 331 GLY A CA 143 C C . GLY A 23 ? 0.6603 1.0674 1.0223 0.0102 -0.1582 0.3753 331 GLY A C 144 O O . GLY A 23 ? 0.6571 1.0763 1.0295 -0.0007 -0.1528 0.3896 331 GLY A O 145 N N . ASN A 24 ? 0.6475 1.0117 0.9891 0.0006 -0.1754 0.3553 332 ASN A N 146 C CA . ASN A 24 ? 0.6399 0.9680 0.9658 -0.0198 -0.1882 0.3457 332 ASN A CA 147 C C . ASN A 24 ? 0.6444 0.9486 0.9309 -0.0141 -0.1805 0.3273 332 ASN A C 148 O O . ASN A 24 ? 0.6504 0.9219 0.9046 -0.0110 -0.1850 0.3069 332 ASN A O 149 C CB . ASN A 24 ? 0.6404 0.9354 0.9541 -0.0263 -0.2075 0.3318 332 ASN A CB 150 C CG . ASN A 24 ? 0.6409 0.9097 0.9529 -0.0455 -0.2253 0.3293 332 ASN A CG 151 O OD1 . ASN A 24 ? 0.6232 0.8845 0.9277 -0.0532 -0.2235 0.3288 332 ASN A OD1 152 N ND2 . ASN A 24 ? 0.6644 0.9165 0.9806 -0.0508 -0.2450 0.3262 332 ASN A ND2 153 N N . ILE A 25 ? 0.6424 0.9656 0.9339 -0.0123 -0.1687 0.3372 333 ILE A N 154 C CA . ILE A 25 ? 0.6279 0.9325 0.8852 -0.0040 -0.1616 0.3209 333 ILE A CA 155 C C . ILE A 25 ? 0.6053 0.8709 0.8378 -0.0175 -0.1731 0.3030 333 ILE A C 156 O O . ILE A 25 ? 0.6195 0.8624 0.8222 -0.0109 -0.1719 0.2843 333 ILE A O 157 C CB . ILE A 25 ? 0.6549 0.9890 0.9214 0.0024 -0.1478 0.3372 333 ILE A CB 158 C CG1 . ILE A 25 ? 0.6812 1.0609 0.9689 0.0226 -0.1329 0.3560 333 ILE A CG1 159 C CG2 . ILE A 25 ? 0.6565 0.9678 0.8857 0.0132 -0.1435 0.3178 333 ILE A CG2 160 C CD1 . ILE A 25 ? 0.7012 1.0698 0.9639 0.0479 -0.1306 0.3371 333 ILE A CD1 161 N N . GLU A 26 ? 0.5909 0.8494 0.8368 -0.0352 -0.1858 0.3098 334 GLU A N 162 C CA . GLU A 26 ? 0.6032 0.8260 0.8224 -0.0425 -0.1976 0.2920 334 GLU A CA 163 C C . GLU A 26 ? 0.5843 0.7829 0.7801 -0.0385 -0.2051 0.2752 334 GLU A C 164 O O . GLU A 26 ? 0.5373 0.7150 0.7030 -0.0344 -0.2057 0.2587 334 GLU A O 165 C CB . GLU A 26 ? 0.6574 0.8732 0.8944 -0.0597 -0.2136 0.3026 334 GLU A CB 166 C CG . GLU A 26 ? 0.6919 0.9290 0.9487 -0.0655 -0.2071 0.3220 334 GLU A CG 167 C CD . GLU A 26 ? 0.7172 0.9410 0.9413 -0.0562 -0.1990 0.3064 334 GLU A CD 168 O OE1 . GLU A 26 ? 0.7188 0.9165 0.9090 -0.0486 -0.2008 0.2817 334 GLU A OE1 169 O OE2 . GLU A 26 ? 0.7259 0.9682 0.9595 -0.0557 -0.1907 0.3210 334 GLU A OE2 170 N N . GLU A 27 ? 0.5864 0.7910 0.7969 -0.0383 -0.2105 0.2815 335 GLU A N 171 C CA . GLU A 27 ? 0.6028 0.7872 0.7900 -0.0322 -0.2165 0.2690 335 GLU A CA 172 C C . GLU A 27 ? 0.5487 0.7316 0.7169 -0.0211 -0.2034 0.2617 335 GLU A C 173 O O . GLU A 27 ? 0.5343 0.6991 0.6767 -0.0181 -0.2049 0.2519 335 GLU A O 174 C CB . GLU A 27 ? 0.6687 0.8600 0.8762 -0.0326 -0.2263 0.2777 335 GLU A CB 175 C CG . GLU A 27 ? 0.7525 0.9248 0.9604 -0.0405 -0.2482 0.2755 335 GLU A CG 176 C CD . GLU A 27 ? 0.8108 0.9524 0.9749 -0.0323 -0.2554 0.2572 335 GLU A CD 177 O OE1 . GLU A 27 ? 0.8207 0.9560 0.9670 -0.0226 -0.2542 0.2532 335 GLU A OE1 178 O OE2 . GLU A 27 ? 0.8330 0.9581 0.9795 -0.0337 -0.2623 0.2483 335 GLU A OE2 179 N N . ALA A 28 ? 0.5064 0.7093 0.6881 -0.0139 -0.1920 0.2683 336 ALA A N 180 C CA . ALA A 28 ? 0.4863 0.6838 0.6525 -0.0030 -0.1841 0.2613 336 ALA A CA 181 C C . ALA A 28 ? 0.4332 0.6176 0.5794 -0.0058 -0.1813 0.2508 336 ALA A C 182 O O . ALA A 28 ? 0.4161 0.5873 0.5471 -0.0047 -0.1815 0.2451 336 ALA A O 183 C CB . ALA A 28 ? 0.4945 0.7139 0.6743 0.0108 -0.1755 0.2680 336 ALA A CB 184 N N . VAL A 29 ? 0.4228 0.6125 0.5716 -0.0099 -0.1794 0.2508 337 VAL A N 185 C CA . VAL A 29 ? 0.4050 0.5836 0.5356 -0.0108 -0.1783 0.2399 337 VAL A CA 186 C C . VAL A 29 ? 0.4380 0.6001 0.5502 -0.0150 -0.1854 0.2321 337 VAL A C 187 O O . VAL A 29 ? 0.4504 0.6079 0.5499 -0.0129 -0.1830 0.2268 337 VAL A O 188 C CB . VAL A 29 ? 0.4084 0.5921 0.5432 -0.0142 -0.1780 0.2421 337 VAL A CB 189 C CG1 . VAL A 29 ? 0.3909 0.5602 0.5047 -0.0140 -0.1803 0.2285 337 VAL A CG1 190 C CG2 . VAL A 29 ? 0.4121 0.6157 0.5582 -0.0049 -0.1684 0.2509 337 VAL A CG2 191 N N . ARG A 30 ? 0.4540 0.6090 0.5657 -0.0194 -0.1953 0.2332 338 ARG A N 192 C CA . ARG A 30 ? 0.4655 0.6049 0.5530 -0.0167 -0.2035 0.2252 338 ARG A CA 193 C C . ARG A 30 ? 0.4751 0.6136 0.5523 -0.0126 -0.1996 0.2281 338 ARG A C 194 O O . ARG A 30 ? 0.4872 0.6223 0.5442 -0.0085 -0.1989 0.2251 338 ARG A O 195 C CB . ARG A 30 ? 0.4932 0.6219 0.5814 -0.0189 -0.2191 0.2254 338 ARG A CB 196 C CG . ARG A 30 ? 0.5411 0.6525 0.5963 -0.0089 -0.2297 0.2150 338 ARG A CG 197 C CD . ARG A 30 ? 0.5921 0.6895 0.6472 -0.0088 -0.2491 0.2140 338 ARG A CD 198 N NE . ARG A 30 ? 0.6168 0.7187 0.6874 -0.0113 -0.2511 0.2231 338 ARG A NE 199 C CZ . ARG A 30 ? 0.6737 0.7697 0.7234 -0.0013 -0.2521 0.2225 338 ARG A CZ 200 N NH1 . ARG A 30 ? 0.7174 0.8061 0.7307 0.0118 -0.2497 0.2161 338 ARG A NH1 201 N NH2 . ARG A 30 ? 0.6570 0.7559 0.7216 -0.0029 -0.2554 0.2302 338 ARG A NH2 202 N N . LEU A 31 ? 0.4336 0.5768 0.5255 -0.0131 -0.1975 0.2363 339 LEU A N 203 C CA . LEU A 31 ? 0.4623 0.6011 0.5465 -0.0107 -0.1958 0.2421 339 LEU A CA 204 C C . LEU A 31 ? 0.4558 0.5988 0.5427 -0.0122 -0.1880 0.2447 339 LEU A C 205 O O . LEU A 31 ? 0.4451 0.5856 0.5227 -0.0138 -0.1871 0.2516 339 LEU A O 206 C CB . LEU A 31 ? 0.4744 0.6137 0.5722 -0.0083 -0.1991 0.2486 339 LEU A CB 207 C CG . LEU A 31 ? 0.5276 0.6605 0.6224 -0.0070 -0.2109 0.2485 339 LEU A CG 208 C CD1 . LEU A 31 ? 0.5381 0.6765 0.6512 -0.0036 -0.2143 0.2553 339 LEU A CD1 209 C CD2 . LEU A 31 ? 0.5623 0.6794 0.6255 -0.0019 -0.2162 0.2470 339 LEU A CD2 210 N N . TYR A 32 ? 0.4978 0.7293 0.3329 0.0229 -0.1873 -0.0209 340 TYR A N 211 C CA . TYR A 32 ? 0.4791 0.7026 0.3179 0.0291 -0.1593 -0.0160 340 TYR A CA 212 C C . TYR A 32 ? 0.4910 0.6959 0.2947 0.0228 -0.1380 -0.0305 340 TYR A C 213 O O . TYR A 32 ? 0.4958 0.6878 0.2724 0.0238 -0.1202 -0.0261 340 TYR A O 214 C CB . TYR A 32 ? 0.4521 0.6948 0.3493 0.0335 -0.1486 -0.0157 340 TYR A CB 215 C CG . TYR A 32 ? 0.4753 0.7370 0.4093 0.0436 -0.1602 -0.0008 340 TYR A CG 216 C CD1 . TYR A 32 ? 0.5260 0.7773 0.4422 0.0535 -0.1642 0.0153 340 TYR A CD1 217 C CD2 . TYR A 32 ? 0.4794 0.7682 0.4648 0.0432 -0.1664 -0.0033 340 TYR A CD2 218 C CE1 . TYR A 32 ? 0.5302 0.7970 0.4806 0.0662 -0.1751 0.0273 340 TYR A CE1 219 C CE2 . TYR A 32 ? 0.5085 0.8136 0.5306 0.0534 -0.1731 0.0082 340 TYR A CE2 220 C CZ . TYR A 32 ? 0.5309 0.8238 0.5365 0.0661 -0.1775 0.0227 340 TYR A CZ 221 O OH . TYR A 32 ? 0.5380 0.8393 0.5800 0.0773 -0.1822 0.0321 340 TYR A OH 222 N N . ARG A 33 ? 0.4800 0.6837 0.2849 0.0162 -0.1397 -0.0485 341 ARG A N 223 C CA . ARG A 33 ? 0.5185 0.7060 0.2941 0.0132 -0.1206 -0.0656 341 ARG A CA 224 C C . ARG A 33 ? 0.5802 0.7491 0.2928 0.0089 -0.1200 -0.0671 341 ARG A C 225 O O . ARG A 33 ? 0.6102 0.7702 0.2976 0.0089 -0.0966 -0.0748 341 ARG A O 226 C CB . ARG A 33 ? 0.5403 0.7235 0.3257 0.0079 -0.1268 -0.0847 341 ARG A CB 227 C CG . ARG A 33 ? 0.4972 0.6922 0.3366 0.0098 -0.1226 -0.0849 341 ARG A CG 228 C CD . ARG A 33 ? 0.5265 0.7063 0.3645 0.0045 -0.1242 -0.1048 341 ARG A CD 229 N NE . ARG A 33 ? 0.5022 0.6895 0.3857 0.0024 -0.1253 -0.1030 341 ARG A NE 230 C CZ . ARG A 33 ? 0.4893 0.6757 0.3966 0.0093 -0.1079 -0.1028 341 ARG A CZ 231 N NH1 . ARG A 33 ? 0.4924 0.6754 0.3887 0.0189 -0.0884 -0.1049 341 ARG A NH1 232 N NH2 . ARG A 33 ? 0.4742 0.6636 0.4157 0.0051 -0.1103 -0.1004 341 ARG A NH2 233 N N . LYS A 34 ? 0.6094 0.7737 0.2967 0.0048 -0.1461 -0.0600 342 LYS A N 234 C CA . LYS A 34 ? 0.6846 0.8269 0.3046 -0.0007 -0.1488 -0.0592 342 LYS A CA 235 C C . LYS A 34 ? 0.6685 0.8041 0.2698 0.0022 -0.1338 -0.0414 342 LYS A C 236 O O . LYS A 34 ? 0.6869 0.8044 0.2397 -0.0036 -0.1158 -0.0444 342 LYS A O 237 C CB . LYS A 34 ? 0.7525 0.8827 0.3578 -0.0064 -0.1824 -0.0523 342 LYS A CB 238 C CG . LYS A 34 ? 0.8713 0.9651 0.4049 -0.0135 -0.1867 -0.0505 342 LYS A CG 239 C CD . LYS A 34 ? 0.9479 1.0207 0.4425 -0.0202 -0.1698 -0.0735 342 LYS A CD 240 C CE . LYS A 34 ? 1.0657 1.1035 0.4888 -0.0200 -0.1724 -0.0738 342 LYS A CE 241 N NZ . LYS A 34 ? 1.1372 1.1569 0.5250 -0.0222 -0.1545 -0.0976 342 LYS A NZ 242 N N . ALA A 35 ? 0.6515 0.7991 0.2916 0.0101 -0.1396 -0.0234 343 ALA A N 243 C CA . ALA A 35 ? 0.6573 0.7942 0.2823 0.0123 -0.1268 -0.0057 343 ALA A CA 244 C C . ALA A 35 ? 0.6404 0.7792 0.2697 0.0093 -0.0909 -0.0139 343 ALA A C 245 O O . ALA A 35 ? 0.6216 0.7459 0.2134 0.0032 -0.0742 -0.0069 343 ALA A O 246 C CB . ALA A 35 ? 0.6053 0.7539 0.2761 0.0236 -0.1398 0.0117 343 ALA A CB 247 N N . LEU A 36 ? 0.5764 0.7332 0.2514 0.0129 -0.0798 -0.0284 344 LEU A N 248 C CA . LEU A 36 ? 0.5694 0.7330 0.2567 0.0123 -0.0491 -0.0382 344 LEU A CA 249 C C . LEU A 36 ? 0.6272 0.7825 0.2694 0.0054 -0.0332 -0.0556 344 LEU A C 250 O O . LEU A 36 ? 0.6661 0.8252 0.2989 0.0018 -0.0067 -0.0595 344 LEU A O 251 C CB . LEU A 36 ? 0.4969 0.6777 0.2421 0.0193 -0.0459 -0.0483 344 LEU A CB 252 C CG . LEU A 36 ? 0.4664 0.6571 0.2578 0.0257 -0.0540 -0.0333 344 LEU A CG 253 C CD1 . LEU A 36 ? 0.3998 0.6028 0.2388 0.0300 -0.0519 -0.0440 344 LEU A CD1 254 C CD2 . LEU A 36 ? 0.4619 0.6495 0.2529 0.0258 -0.0386 -0.0189 344 LEU A CD2 255 N N . GLU A 37 ? 0.6495 0.7949 0.2642 0.0030 -0.0492 -0.0670 345 GLU A N 256 C CA . GLU A 37 ? 0.7108 0.8446 0.2768 -0.0027 -0.0355 -0.0856 345 GLU A CA 257 C C . GLU A 37 ? 0.7932 0.9033 0.3056 -0.0122 -0.0260 -0.0725 345 GLU A C 258 O O . GLU A 37 ? 0.8454 0.9455 0.3320 -0.0164 -0.0012 -0.0826 345 GLU A O 259 C CB . GLU A 37 ? 0.7458 0.8638 0.2957 -0.0044 -0.0586 -0.0981 345 GLU A CB 260 C CG . GLU A 37 ? 0.8185 0.9107 0.3224 -0.0089 -0.0453 -0.1163 345 GLU A CG 261 C CD . GLU A 37 ? 0.8849 0.9574 0.3712 -0.0122 -0.0702 -0.1281 345 GLU A CD 262 O OE1 . GLU A 37 ? 0.9474 0.9910 0.3836 -0.0165 -0.0663 -0.1394 345 GLU A OE1 263 O OE2 . GLU A 37 ? 0.8682 0.9530 0.3908 -0.0110 -0.0933 -0.1260 345 GLU A OE2 264 N N . VAL A 38 ? 0.7976 0.8974 0.2949 -0.0141 -0.0464 -0.0498 346 VAL A N 265 C CA . VAL A 38 ? 0.8659 0.9358 0.3085 -0.0217 -0.0422 -0.0346 346 VAL A CA 266 C C . VAL A 38 ? 0.8552 0.9309 0.3081 -0.0256 -0.0173 -0.0224 346 VAL A C 267 O O . VAL A 38 ? 0.8712 0.9316 0.2901 -0.0333 0.0043 -0.0206 346 VAL A O 268 C CB . VAL A 38 ? 0.9177 0.9686 0.3394 -0.0188 -0.0784 -0.0155 346 VAL A CB 269 C CG1 . VAL A 38 ? 0.9991 1.0224 0.3685 -0.0221 -0.0744 0.0010 346 VAL A CG1 270 C CG2 . VAL A 38 ? 0.9503 0.9947 0.3610 -0.0171 -0.1037 -0.0280 346 VAL A CG2 271 N N . PHE A 39 ? 0.8397 0.9391 0.3417 -0.0196 -0.0202 -0.0142 347 PHE A N 272 C CA . PHE A 39 ? 0.8568 0.9604 0.3721 -0.0239 0.0003 -0.0021 347 PHE A CA 273 C C . PHE A 39 ? 0.7476 0.8812 0.3340 -0.0144 0.0086 -0.0098 347 PHE A C 274 O O . PHE A 39 ? 0.6916 0.8275 0.3156 -0.0051 -0.0076 0.0012 347 PHE A O 275 C CB . PHE A 39 ? 0.9525 1.0310 0.4465 -0.0240 -0.0190 0.0252 347 PHE A CB 276 C CG . PHE A 39 ? 1.0175 1.0904 0.5174 -0.0307 -0.0002 0.0391 347 PHE A CG 277 C CD1 . PHE A 39 ? 1.0489 1.1263 0.5473 -0.0422 0.0330 0.0306 347 PHE A CD1 278 C CD2 . PHE A 39 ? 1.0289 1.0885 0.5440 -0.0234 -0.0164 0.0594 347 PHE A CD2 279 C CE1 . PHE A 39 ? 1.0531 1.1250 0.5596 -0.0504 0.0486 0.0430 347 PHE A CE1 280 C CE2 . PHE A 39 ? 1.0375 1.0864 0.5543 -0.0310 -0.0004 0.0717 347 PHE A CE2 281 C CZ . PHE A 39 ? 1.0460 1.1019 0.5565 -0.0466 0.0318 0.0638 347 PHE A CZ 282 N N . PRO A 40 ? 0.7495 0.9041 0.3554 -0.0154 0.0336 -0.0294 348 PRO A N 283 C CA . PRO A 40 ? 0.6923 0.8714 0.3626 -0.0058 0.0408 -0.0394 348 PRO A CA 284 C C . PRO A 40 ? 0.6433 0.8256 0.3479 -0.0051 0.0434 -0.0230 348 PRO A C 285 O O . PRO A 40 ? 0.5620 0.7555 0.3153 0.0046 0.0368 -0.0249 348 PRO A O 286 C CB . PRO A 40 ? 0.7131 0.9108 0.3834 -0.0089 0.0696 -0.0606 348 PRO A CB 287 C CG . PRO A 40 ? 0.7747 0.9493 0.3925 -0.0151 0.0703 -0.0666 348 PRO A CG 288 C CD . PRO A 40 ? 0.8048 0.9525 0.3764 -0.0236 0.0548 -0.0434 348 PRO A CD 289 N N . GLU A 41 ? 0.7006 0.8694 0.3759 -0.0165 0.0527 -0.0072 349 GLU A N 290 C CA . GLU A 41 ? 0.6954 0.8620 0.3967 -0.0178 0.0561 0.0075 349 GLU A CA 291 C C . GLU A 41 ? 0.6732 0.8155 0.3693 -0.0106 0.0309 0.0279 349 GLU A C 292 O O . GLU A 41 ? 0.6721 0.7915 0.3457 -0.0170 0.0311 0.0459 349 GLU A O 293 C CB . GLU A 41 ? 0.7570 0.9202 0.4314 -0.0361 0.0806 0.0134 349 GLU A CB 294 C CG . GLU A 41 ? 0.7800 0.9718 0.4745 -0.0409 0.1068 -0.0073 349 GLU A CG 295 C CD . GLU A 41 ? 0.7594 0.9815 0.5159 -0.0324 0.1120 -0.0177 349 GLU A CD 296 O OE1 . GLU A 41 ? 0.7776 1.0011 0.5535 -0.0391 0.1182 -0.0079 349 GLU A OE1 297 O OE2 . GLU A 41 ? 0.7403 0.9797 0.5246 -0.0191 0.1081 -0.0354 349 GLU A OE2 298 N N . PHE A 42 ? 0.6198 0.7673 0.3381 0.0027 0.0094 0.0244 350 PHE A N 299 C CA . PHE A 42 ? 0.5901 0.7225 0.3106 0.0125 -0.0156 0.0406 350 PHE A CA 300 C C . PHE A 42 ? 0.5357 0.6827 0.3142 0.0240 -0.0190 0.0396 350 PHE A C 301 O O . PHE A 42 ? 0.5056 0.6703 0.3156 0.0314 -0.0283 0.0292 350 PHE A O 302 C CB . PHE A 42 ? 0.5969 0.7279 0.2981 0.0168 -0.0386 0.0373 350 PHE A CB 303 C CG . PHE A 42 ? 0.5957 0.7089 0.2836 0.0252 -0.0655 0.0556 350 PHE A CG 304 C CD1 . PHE A 42 ? 0.5865 0.6870 0.2885 0.0326 -0.0686 0.0716 350 PHE A CD1 305 C CD2 . PHE A 42 ? 0.6169 0.7254 0.2783 0.0269 -0.0893 0.0559 350 PHE A CD2 306 C CE1 . PHE A 42 ? 0.6113 0.6958 0.3039 0.0440 -0.0945 0.0871 350 PHE A CE1 307 C CE2 . PHE A 42 ? 0.6280 0.7233 0.2813 0.0369 -0.1169 0.0722 350 PHE A CE2 308 C CZ . PHE A 42 ? 0.6308 0.7146 0.3010 0.0468 -0.1193 0.0876 350 PHE A CZ 309 N N . ALA A 43 ? 0.4960 0.6326 0.2845 0.0238 -0.0113 0.0505 351 ALA A N 310 C CA . ALA A 43 ? 0.4916 0.6380 0.3284 0.0329 -0.0112 0.0495 351 ALA A CA 311 C C . ALA A 43 ? 0.4654 0.6178 0.3267 0.0475 -0.0327 0.0524 351 ALA A C 312 O O . ALA A 43 ? 0.4398 0.6115 0.3406 0.0527 -0.0333 0.0431 351 ALA A O 313 C CB . ALA A 43 ? 0.5100 0.6367 0.3428 0.0292 -0.0018 0.0618 351 ALA A CB 314 N N . ALA A 44 ? 0.4918 0.6281 0.3294 0.0534 -0.0505 0.0655 352 ALA A N 315 C CA . ALA A 44 ? 0.4897 0.6370 0.3540 0.0680 -0.0719 0.0685 352 ALA A CA 316 C C . ALA A 44 ? 0.4691 0.6430 0.3509 0.0667 -0.0813 0.0545 352 ALA A C 317 O O . ALA A 44 ? 0.4741 0.6693 0.3973 0.0738 -0.0887 0.0500 352 ALA A O 318 C CB . ALA A 44 ? 0.5729 0.6967 0.4052 0.0757 -0.0920 0.0851 352 ALA A CB 319 N N . ALA A 45 ? 0.4772 0.6481 0.3254 0.0562 -0.0799 0.0471 353 ALA A N 320 C CA . ALA A 45 ? 0.4708 0.6599 0.3280 0.0532 -0.0894 0.0328 353 ALA A CA 321 C C . ALA A 45 ? 0.4242 0.6307 0.3207 0.0513 -0.0759 0.0183 353 ALA A C 322 O O . ALA A 45 ? 0.3935 0.6166 0.3185 0.0524 -0.0862 0.0109 353 ALA A O 323 C CB . ALA A 45 ? 0.5011 0.6780 0.3074 0.0429 -0.0887 0.0267 353 ALA A CB 324 N N . HIS A 46 ? 0.4103 0.6121 0.3075 0.0476 -0.0539 0.0146 354 HIS A N 325 C CA . HIS A 46 ? 0.3698 0.5833 0.3009 0.0473 -0.0428 0.0024 354 HIS A CA 326 C C . HIS A 46 ? 0.3717 0.5938 0.3431 0.0541 -0.0472 0.0078 354 HIS A C 327 O O . HIS A 46 ? 0.3574 0.5904 0.3553 0.0534 -0.0495 -0.0009 354 HIS A O 328 C CB . HIS A 46 ? 0.3550 0.5645 0.2813 0.0430 -0.0208 -0.0012 354 HIS A CB 329 C CG . HIS A 46 ? 0.3527 0.5633 0.2541 0.0369 -0.0112 -0.0148 354 HIS A CG 330 N ND1 . HIS A 46 ? 0.3460 0.5631 0.2565 0.0378 -0.0121 -0.0321 354 HIS A ND1 331 C CD2 . HIS A 46 ? 0.3935 0.5984 0.2600 0.0298 0.0009 -0.0145 354 HIS A CD2 332 C CE1 . HIS A 46 ? 0.3814 0.5980 0.2654 0.0339 -0.0008 -0.0432 354 HIS A CE1 333 N NE2 . HIS A 46 ? 0.4031 0.6146 0.2606 0.0281 0.0084 -0.0328 354 HIS A NE2 334 N N . SER A 47 ? 0.3811 0.5955 0.3541 0.0603 -0.0476 0.0218 355 SER A N 335 C CA . SER A 47 ? 0.3619 0.5837 0.3705 0.0682 -0.0489 0.0262 355 SER A CA 336 C C . SER A 47 ? 0.3355 0.5773 0.3669 0.0726 -0.0665 0.0252 355 SER A C 337 O O . SER A 47 ? 0.2949 0.5516 0.3606 0.0737 -0.0648 0.0213 355 SER A O 338 C CB . SER A 47 ? 0.3962 0.6004 0.3966 0.0753 -0.0459 0.0402 355 SER A CB 339 O OG . SER A 47 ? 0.4262 0.6371 0.4592 0.0846 -0.0459 0.0426 355 SER A OG 340 N N . ASN A 48 ? 0.3638 0.6065 0.3752 0.0736 -0.0835 0.0289 356 ASN A N 341 C CA . ASN A 48 ? 0.3558 0.6214 0.3901 0.0765 -0.1033 0.0277 356 ASN A CA 342 C C . ASN A 48 ? 0.3323 0.6120 0.3798 0.0648 -0.1047 0.0131 356 ASN A C 343 O O . ASN A 48 ? 0.3207 0.6228 0.4047 0.0633 -0.1097 0.0096 356 ASN A O 344 C CB . ASN A 48 ? 0.3995 0.6590 0.4037 0.0801 -0.1244 0.0356 356 ASN A CB 345 C CG . ASN A 48 ? 0.4405 0.6862 0.4377 0.0944 -0.1300 0.0516 356 ASN A CG 346 O OD1 . ASN A 48 ? 0.4093 0.6585 0.4353 0.1043 -0.1221 0.0554 356 ASN A OD1 347 N ND2 . ASN A 48 ? 0.4764 0.7021 0.4310 0.0958 -0.1441 0.0608 356 ASN A ND2 348 N N . LEU A 49 ? 0.3247 0.5902 0.3414 0.0559 -0.0996 0.0041 357 LEU A N 349 C CA . LEU A 49 ? 0.3179 0.5875 0.3404 0.0455 -0.1009 -0.0107 357 LEU A CA 350 C C . LEU A 49 ? 0.2743 0.5470 0.3284 0.0438 -0.0870 -0.0150 357 LEU A C 351 O O . LEU A 49 ? 0.2771 0.5599 0.3528 0.0363 -0.0923 -0.0214 357 LEU A O 352 C CB . LEU A 49 ? 0.3387 0.5896 0.3209 0.0400 -0.0948 -0.0210 357 LEU A CB 353 C CG . LEU A 49 ? 0.3533 0.5995 0.3348 0.0314 -0.0956 -0.0381 357 LEU A CG 354 C CD1 . LEU A 49 ? 0.3303 0.5883 0.3214 0.0237 -0.1176 -0.0414 357 LEU A CD1 355 C CD2 . LEU A 49 ? 0.3917 0.6204 0.3332 0.0298 -0.0872 -0.0495 357 LEU A CD2 356 N N . ALA A 50 ? 0.2342 0.4965 0.2883 0.0489 -0.0702 -0.0108 358 ALA A N 357 C CA . ALA A 50 ? 0.2356 0.4962 0.3132 0.0475 -0.0579 -0.0138 358 ALA A CA 358 C C . ALA A 50 ? 0.2548 0.5334 0.3667 0.0481 -0.0614 -0.0091 358 ALA A C 359 O O . ALA A 50 ? 0.2328 0.5145 0.3620 0.0402 -0.0592 -0.0149 358 ALA A O 360 C CB . ALA A 50 ? 0.2603 0.5078 0.3311 0.0526 -0.0422 -0.0089 358 ALA A CB 361 N N . SER A 51 ? 0.2612 0.5507 0.3819 0.0575 -0.0666 0.0012 359 SER A N 362 C CA . SER A 51 ? 0.2711 0.5807 0.4271 0.0603 -0.0681 0.0046 359 SER A CA 363 C C . SER A 51 ? 0.2695 0.5959 0.4425 0.0485 -0.0798 -0.0020 359 SER A C 364 O O . SER A 51 ? 0.2542 0.5888 0.4530 0.0413 -0.0737 -0.0043 359 SER A O 365 C CB . SER A 51 ? 0.3110 0.6198 0.4686 0.0741 -0.0733 0.0154 359 SER A CB 366 O OG . SER A 51 ? 0.3593 0.6815 0.5495 0.0752 -0.0755 0.0157 359 SER A OG 367 N N . VAL A 52 ? 0.2287 0.5595 0.3844 0.0452 -0.0967 -0.0051 360 VAL A N 368 C CA . VAL A 52 ? 0.2563 0.6003 0.4242 0.0320 -0.1104 -0.0118 360 VAL A CA 369 C C . VAL A 52 ? 0.2606 0.6000 0.4283 0.0173 -0.1052 -0.0233 360 VAL A C 370 O O . VAL A 52 ? 0.2602 0.6103 0.4511 0.0044 -0.1067 -0.0265 360 VAL A O 371 C CB . VAL A 52 ? 0.3439 0.6867 0.4852 0.0313 -0.1311 -0.0129 360 VAL A CB 372 C CG1 . VAL A 52 ? 0.3871 0.7355 0.5312 0.0142 -0.1446 -0.0230 360 VAL A CG1 373 C CG2 . VAL A 52 ? 0.3609 0.7104 0.5102 0.0432 -0.1423 -0.0014 360 VAL A CG2 374 N N . LEU A 53 ? 0.2350 0.5451 0.3721 0.0181 -0.0962 -0.0283 361 LEU A N 375 C CA . LEU A 53 ? 0.2690 0.5588 0.3992 0.0070 -0.0905 -0.0383 361 LEU A CA 376 C C . LEU A 53 ? 0.2573 0.5498 0.4129 0.0032 -0.0776 -0.0349 361 LEU A C 377 O O . LEU A 53 ? 0.2669 0.5549 0.4299 -0.0113 -0.0785 -0.0400 361 LEU A O 378 C CB . LEU A 53 ? 0.2728 0.5342 0.3707 0.0131 -0.0822 -0.0444 361 LEU A CB 379 C CG . LEU A 53 ? 0.2784 0.5322 0.3442 0.0134 -0.0922 -0.0514 361 LEU A CG 380 C CD1 . LEU A 53 ? 0.2520 0.4863 0.2917 0.0214 -0.0795 -0.0571 361 LEU A CD1 381 C CD2 . LEU A 53 ? 0.2939 0.5409 0.3531 -0.0003 -0.1064 -0.0630 361 LEU A CD2 382 N N . GLN A 54 ? 0.2610 0.5576 0.4258 0.0149 -0.0656 -0.0262 362 GLN A N 383 C CA . GLN A 54 ? 0.2752 0.5730 0.4592 0.0125 -0.0519 -0.0227 362 GLN A CA 384 C C . GLN A 54 ? 0.2733 0.6017 0.4904 0.0023 -0.0549 -0.0221 362 GLN A C 385 O O . GLN A 54 ? 0.2588 0.5845 0.4855 -0.0100 -0.0462 -0.0236 362 GLN A O 386 C CB . GLN A 54 ? 0.3234 0.6195 0.5086 0.0276 -0.0405 -0.0142 362 GLN A CB 387 C CG . GLN A 54 ? 0.3760 0.6725 0.5773 0.0262 -0.0257 -0.0112 362 GLN A CG 388 C CD . GLN A 54 ? 0.4470 0.7314 0.6439 0.0402 -0.0158 -0.0035 362 GLN A CD 389 O OE1 . GLN A 54 ? 0.4861 0.7662 0.6715 0.0503 -0.0208 0.0007 362 GLN A OE1 390 N NE2 . GLN A 54 ? 0.4402 0.7177 0.6431 0.0394 -0.0022 -0.0022 362 GLN A NE2 391 N N . GLN A 55 ? 0.2972 0.6451 0.5267 0.0065 -0.0661 -0.0188 363 GLN A N 392 C CA . GLN A 55 ? 0.3467 0.7183 0.6079 -0.0025 -0.0689 -0.0180 363 GLN A CA 393 C C . GLN A 55 ? 0.3477 0.7245 0.6111 -0.0254 -0.0778 -0.0265 363 GLN A C 394 O O . GLN A 55 ? 0.3469 0.7384 0.6344 -0.0398 -0.0725 -0.0272 363 GLN A O 395 C CB . GLN A 55 ? 0.4181 0.8047 0.6906 0.0085 -0.0824 -0.0129 363 GLN A CB 396 C CG . GLN A 55 ? 0.4908 0.8750 0.7707 0.0280 -0.0739 -0.0050 363 GLN A CG 397 C CD . GLN A 55 ? 0.5684 0.9726 0.8705 0.0371 -0.0883 -0.0009 363 GLN A CD 398 O OE1 . GLN A 55 ? 0.6011 1.0106 0.8953 0.0353 -0.1082 -0.0010 363 GLN A OE1 399 N NE2 . GLN A 55 ? 0.5867 1.0015 0.9163 0.0473 -0.0792 0.0022 363 GLN A NE2 400 N N . GLN A 56 ? 0.3181 0.6805 0.5542 -0.0299 -0.0909 -0.0339 364 GLN A N 401 C CA . GLN A 56 ? 0.3409 0.6949 0.5697 -0.0521 -0.1011 -0.0434 364 GLN A CA 402 C C . GLN A 56 ? 0.3431 0.6613 0.5559 -0.0625 -0.0877 -0.0460 364 GLN A C 403 O O . GLN A 56 ? 0.3903 0.6911 0.5938 -0.0822 -0.0938 -0.0524 364 GLN A O 404 C CB . GLN A 56 ? 0.3988 0.7320 0.5929 -0.0505 -0.1175 -0.0508 364 GLN A CB 405 C CG . GLN A 56 ? 0.4544 0.8105 0.6552 -0.0474 -0.1357 -0.0484 364 GLN A CG 406 C CD . GLN A 56 ? 0.4974 0.8333 0.6581 -0.0481 -0.1513 -0.0577 364 GLN A CD 407 O OE1 . GLN A 56 ? 0.4994 0.8065 0.6275 -0.0375 -0.1432 -0.0608 364 GLN A OE1 408 N NE2 . GLN A 56 ? 0.5328 0.8721 0.6919 -0.0597 -0.1701 -0.0606 364 GLN A NE2 409 N N . GLY A 57 ? 0.2665 0.5702 0.4731 -0.0496 -0.0716 -0.0409 365 GLY A N 410 C CA . GLY A 57 ? 0.2977 0.5655 0.4867 -0.0571 -0.0611 -0.0420 365 GLY A CA 411 C C . GLY A 57 ? 0.2984 0.5250 0.4514 -0.0494 -0.0657 -0.0488 365 GLY A C 412 O O . GLY A 57 ? 0.3289 0.5205 0.4638 -0.0541 -0.0622 -0.0510 365 GLY A O 413 N N . LYS A 58 ? 0.2727 0.5034 0.4146 -0.0372 -0.0737 -0.0524 366 LYS A N 414 C CA . LYS A 58 ? 0.2941 0.4935 0.4058 -0.0275 -0.0754 -0.0606 366 LYS A CA 415 C C . LYS A 58 ? 0.2954 0.4929 0.4056 -0.0102 -0.0625 -0.0553 366 LYS A C 416 O O . LYS A 58 ? 0.3174 0.5248 0.4214 0.0018 -0.0614 -0.0545 366 LYS A O 417 C CB . LYS A 58 ? 0.2780 0.4820 0.3741 -0.0252 -0.0880 -0.0682 366 LYS A CB 418 C CG . LYS A 58 ? 0.3140 0.5182 0.4095 -0.0440 -0.1035 -0.0746 366 LYS A CG 419 C CD . LYS A 58 ? 0.3486 0.5520 0.4213 -0.0419 -0.1170 -0.0832 366 LYS A CD 420 C CE . LYS A 58 ? 0.3841 0.5881 0.4568 -0.0628 -0.1346 -0.0896 366 LYS A CE 421 N NZ . LYS A 58 ? 0.4247 0.6259 0.4707 -0.0619 -0.1497 -0.0984 366 LYS A NZ 422 N N . LEU A 59 ? 0.3093 0.4922 0.4225 -0.0112 -0.0533 -0.0513 367 LEU A N 423 C CA . LEU A 59 ? 0.2796 0.4631 0.3951 0.0017 -0.0417 -0.0449 367 LEU A CA 424 C C . LEU A 59 ? 0.2913 0.4597 0.3904 0.0143 -0.0409 -0.0514 367 LEU A C 425 O O . LEU A 59 ? 0.2655 0.4454 0.3659 0.0245 -0.0344 -0.0475 367 LEU A O 426 C CB . LEU A 59 ? 0.2639 0.4342 0.3834 -0.0047 -0.0335 -0.0393 367 LEU A CB 427 C CG . LEU A 59 ? 0.2569 0.4456 0.3950 -0.0189 -0.0302 -0.0343 367 LEU A CG 428 C CD1 . LEU A 59 ? 0.2365 0.4066 0.3701 -0.0268 -0.0200 -0.0296 367 LEU A CD1 429 C CD2 . LEU A 59 ? 0.2271 0.4534 0.3883 -0.0110 -0.0267 -0.0284 367 LEU A CD2 430 N N . GLN A 60 ? 0.2975 0.4400 0.3818 0.0136 -0.0473 -0.0616 368 GLN A N 431 C CA . GLN A 60 ? 0.2837 0.4172 0.3576 0.0271 -0.0460 -0.0704 368 GLN A CA 432 C C . GLN A 60 ? 0.2816 0.4353 0.3497 0.0328 -0.0446 -0.0741 368 GLN A C 433 O O . GLN A 60 ? 0.2606 0.4240 0.3282 0.0424 -0.0364 -0.0746 368 GLN A O 434 C CB . GLN A 60 ? 0.3181 0.4187 0.3773 0.0278 -0.0550 -0.0825 368 GLN A CB 435 C CG . GLN A 60 ? 0.3382 0.4117 0.3960 0.0256 -0.0569 -0.0786 368 GLN A CG 436 C CD . GLN A 60 ? 0.4430 0.4773 0.4829 0.0276 -0.0686 -0.0897 368 GLN A CD 437 O OE1 . GLN A 60 ? 0.5066 0.5237 0.5439 0.0405 -0.0715 -0.0945 368 GLN A OE1 438 N NE2 . GLN A 60 ? 0.4447 0.4635 0.4724 0.0148 -0.0770 -0.0941 368 GLN A NE2 439 N N . GLU A 61 ? 0.2812 0.4411 0.3434 0.0250 -0.0529 -0.0762 369 GLU A N 440 C CA . GLU A 61 ? 0.2853 0.4596 0.3347 0.0287 -0.0536 -0.0791 369 GLU A CA 441 C C . GLU A 61 ? 0.2725 0.4700 0.3308 0.0322 -0.0471 -0.0654 369 GLU A C 442 O O . GLU A 61 ? 0.2862 0.4903 0.3318 0.0382 -0.0415 -0.0652 369 GLU A O 443 C CB . GLU A 61 ? 0.3155 0.4881 0.3538 0.0185 -0.0676 -0.0850 369 GLU A CB 444 C CG . GLU A 61 ? 0.3195 0.4911 0.3308 0.0227 -0.0696 -0.0950 369 GLU A CG 445 C CD . GLU A 61 ? 0.3728 0.5402 0.3697 0.0114 -0.0860 -0.1013 369 GLU A CD 446 O OE1 . GLU A 61 ? 0.3761 0.5396 0.3856 -0.0008 -0.0956 -0.1002 369 GLU A OE1 447 O OE2 . GLU A 61 ? 0.3738 0.5414 0.3448 0.0131 -0.0891 -0.1075 369 GLU A OE2 448 N N . ALA A 62 ? 0.2516 0.4592 0.3299 0.0282 -0.0472 -0.0543 370 ALA A N 449 C CA . ALA A 62 ? 0.2556 0.4793 0.3426 0.0337 -0.0417 -0.0416 370 ALA A CA 450 C C . ALA A 62 ? 0.2518 0.4688 0.3350 0.0412 -0.0290 -0.0392 370 ALA A C 451 O O . ALA A 62 ? 0.2720 0.4949 0.3474 0.0458 -0.0245 -0.0328 370 ALA A O 452 C CB . ALA A 62 ? 0.2664 0.5014 0.3777 0.0297 -0.0418 -0.0332 370 ALA A CB 453 N N . LEU A 63 ? 0.2165 0.4196 0.3041 0.0414 -0.0249 -0.0440 371 LEU A N 454 C CA . LEU A 63 ? 0.2274 0.4264 0.3158 0.0471 -0.0153 -0.0429 371 LEU A CA 455 C C . LEU A 63 ? 0.2824 0.4880 0.3580 0.0515 -0.0101 -0.0489 371 LEU A C 456 O O . LEU A 63 ? 0.2685 0.4800 0.3435 0.0532 -0.0014 -0.0436 371 LEU A O 457 C CB . LEU A 63 ? 0.2549 0.4363 0.3481 0.0472 -0.0166 -0.0487 371 LEU A CB 458 C CG . LEU A 63 ? 0.2824 0.4582 0.3823 0.0497 -0.0104 -0.0433 371 LEU A CG 459 C CD1 . LEU A 63 ? 0.3365 0.5155 0.4419 0.0463 -0.0059 -0.0310 371 LEU A CD1 460 C CD2 . LEU A 63 ? 0.2395 0.3939 0.3394 0.0502 -0.0161 -0.0489 371 LEU A CD2 461 N N . MET A 64 ? 0.2870 0.4907 0.3505 0.0519 -0.0146 -0.0607 372 MET A N 462 C CA . MET A 64 ? 0.2838 0.4950 0.3320 0.0552 -0.0076 -0.0685 372 MET A CA 463 C C . MET A 64 ? 0.3091 0.5304 0.3443 0.0521 -0.0031 -0.0572 372 MET A C 464 O O . MET A 64 ? 0.3176 0.5459 0.3473 0.0522 0.0084 -0.0557 372 MET A O 465 C CB . MET A 64 ? 0.3062 0.5102 0.3374 0.0552 -0.0144 -0.0826 372 MET A CB 466 C CG . MET A 64 ? 0.3335 0.5256 0.3680 0.0623 -0.0145 -0.0989 372 MET A CG 467 S SD . MET A 64 ? 0.4157 0.5949 0.4227 0.0629 -0.0211 -0.1171 372 MET A SD 468 C CE . MET A 64 ? 0.6726 0.8712 0.6587 0.0646 -0.0056 -0.1208 372 MET A CE 469 N N . HIS A 65 ? 0.2721 0.4938 0.3024 0.0490 -0.0132 -0.0490 373 HIS A N 470 C CA . HIS A 65 ? 0.2488 0.4745 0.2619 0.0477 -0.0136 -0.0378 373 HIS A CA 471 C C . HIS A 65 ? 0.2494 0.4741 0.2717 0.0492 -0.0074 -0.0235 373 HIS A C 472 O O . HIS A 65 ? 0.2385 0.4605 0.2425 0.0478 -0.0025 -0.0154 373 HIS A O 473 C CB . HIS A 65 ? 0.2552 0.4833 0.2618 0.0457 -0.0300 -0.0349 373 HIS A CB 474 C CG . HIS A 65 ? 0.2985 0.5228 0.2857 0.0423 -0.0365 -0.0490 373 HIS A CG 475 N ND1 . HIS A 65 ? 0.3340 0.5548 0.2875 0.0409 -0.0331 -0.0535 373 HIS A ND1 476 C CD2 . HIS A 65 ? 0.2926 0.5122 0.2856 0.0391 -0.0453 -0.0602 373 HIS A CD2 477 C CE1 . HIS A 65 ? 0.3375 0.5519 0.2768 0.0385 -0.0398 -0.0680 373 HIS A CE1 478 N NE2 . HIS A 65 ? 0.3271 0.5395 0.2903 0.0372 -0.0481 -0.0721 373 HIS A NE2 479 N N . TYR A 66 ? 0.2293 0.4524 0.2757 0.0511 -0.0072 -0.0207 374 TYR A N 480 C CA . TYR A 66 ? 0.2469 0.4647 0.2995 0.0526 -0.0003 -0.0098 374 TYR A CA 481 C C . TYR A 66 ? 0.2330 0.4494 0.2796 0.0496 0.0119 -0.0124 374 TYR A C 482 O O . TYR A 66 ? 0.2217 0.4323 0.2586 0.0473 0.0177 -0.0031 374 TYR A O 483 C CB . TYR A 66 ? 0.2537 0.4683 0.3290 0.0541 -0.0009 -0.0086 374 TYR A CB 484 C CG . TYR A 66 ? 0.2130 0.4340 0.2996 0.0568 -0.0088 -0.0025 374 TYR A CG 485 C CD1 . TYR A 66 ? 0.2333 0.4561 0.3143 0.0621 -0.0127 0.0077 374 TYR A CD1 486 C CD2 . TYR A 66 ? 0.1824 0.4082 0.2861 0.0537 -0.0125 -0.0072 374 TYR A CD2 487 C CE1 . TYR A 66 ? 0.2448 0.4794 0.3427 0.0669 -0.0206 0.0119 374 TYR A CE1 488 C CE2 . TYR A 66 ? 0.2042 0.4433 0.3241 0.0550 -0.0179 -0.0029 374 TYR A CE2 489 C CZ . TYR A 66 ? 0.2342 0.4804 0.3542 0.0629 -0.0221 0.0059 374 TYR A CZ 490 O OH . TYR A 66 ? 0.2435 0.5086 0.3861 0.0664 -0.0282 0.0088 374 TYR A OH 491 N N . LYS A 67 ? 0.1864 0.4080 0.2396 0.0496 0.0151 -0.0255 375 LYS A N 492 C CA . LYS A 67 ? 0.1961 0.4245 0.2516 0.0473 0.0264 -0.0301 375 LYS A CA 493 C C . LYS A 67 ? 0.2529 0.4878 0.2850 0.0418 0.0350 -0.0289 375 LYS A C 494 O O . LYS A 67 ? 0.2373 0.4762 0.2669 0.0354 0.0457 -0.0251 375 LYS A O 495 C CB . LYS A 67 ? 0.2199 0.4539 0.2909 0.0521 0.0260 -0.0456 375 LYS A CB 496 C CG . LYS A 67 ? 0.2460 0.4687 0.3349 0.0550 0.0189 -0.0451 375 LYS A CG 497 C CD . LYS A 67 ? 0.2741 0.4955 0.3739 0.0617 0.0145 -0.0596 375 LYS A CD 498 C CE . LYS A 67 ? 0.2776 0.4809 0.3865 0.0626 0.0056 -0.0567 375 LYS A CE 499 N NZ . LYS A 67 ? 0.2718 0.4658 0.3874 0.0702 -0.0022 -0.0693 375 LYS A NZ 500 N N . GLU A 68 ? 0.2721 0.5065 0.2845 0.0424 0.0300 -0.0317 376 GLU A N 501 C CA . GLU A 68 ? 0.3758 0.6112 0.3572 0.0359 0.0370 -0.0293 376 GLU A CA 502 C C . GLU A 68 ? 0.3651 0.5867 0.3299 0.0312 0.0358 -0.0105 376 GLU A C 503 O O . GLU A 68 ? 0.3659 0.5854 0.3122 0.0222 0.0472 -0.0051 376 GLU A O 504 C CB . GLU A 68 ? 0.4522 0.6852 0.4116 0.0375 0.0283 -0.0360 376 GLU A CB 505 C CG . GLU A 68 ? 0.5353 0.7768 0.4978 0.0410 0.0329 -0.0564 376 GLU A CG 506 C CD . GLU A 68 ? 0.6235 0.8801 0.5839 0.0379 0.0530 -0.0651 376 GLU A CD 507 O OE1 . GLU A 68 ? 0.6559 0.9129 0.5893 0.0287 0.0631 -0.0583 376 GLU A OE1 508 O OE2 . GLU A 68 ? 0.6488 0.9170 0.6349 0.0444 0.0585 -0.0787 376 GLU A OE2 509 N N . ALA A 69 ? 0.3198 0.5315 0.2912 0.0372 0.0223 -0.0010 377 ALA A N 510 C CA . ALA A 69 ? 0.3512 0.5460 0.3071 0.0371 0.0181 0.0162 377 ALA A CA 511 C C . ALA A 69 ? 0.3647 0.5510 0.3237 0.0310 0.0299 0.0224 377 ALA A C 512 O O . ALA A 69 ? 0.3937 0.5643 0.3261 0.0239 0.0339 0.0335 377 ALA A O 513 C CB . ALA A 69 ? 0.3287 0.5209 0.3017 0.0474 0.0032 0.0220 377 ALA A CB 514 N N . ILE A 70 ? 0.3459 0.5400 0.3340 0.0322 0.0343 0.0156 378 ILE A N 515 C CA . ILE A 70 ? 0.3380 0.5235 0.3311 0.0258 0.0426 0.0207 378 ILE A CA 516 C C . ILE A 70 ? 0.3639 0.5607 0.3501 0.0126 0.0570 0.0165 378 ILE A C 517 O O . ILE A 70 ? 0.3852 0.5723 0.3661 0.0025 0.0637 0.0237 378 ILE A O 518 C CB . ILE A 70 ? 0.4082 0.5954 0.4309 0.0307 0.0405 0.0155 378 ILE A CB 519 C CG1 . ILE A 70 ? 0.4014 0.6093 0.4445 0.0319 0.0425 0.0000 378 ILE A CG1 520 C CG2 . ILE A 70 ? 0.3775 0.5559 0.4078 0.0414 0.0301 0.0198 378 ILE A CG2 521 C CD1 . ILE A 70 ? 0.3808 0.5862 0.4467 0.0344 0.0399 -0.0040 378 ILE A CD1 522 N N . ARG A 71 ? 0.3205 0.5384 0.3076 0.0120 0.0625 0.0040 379 ARG A N 523 C CA . ARG A 71 ? 0.3942 0.6291 0.3765 -0.0004 0.0791 -0.0016 379 ARG A CA 524 C C . ARG A 71 ? 0.4547 0.6740 0.3945 -0.0121 0.0848 0.0104 379 ARG A C 525 O O . ARG A 71 ? 0.4554 0.6718 0.3842 -0.0275 0.0965 0.0169 379 ARG A O 526 C CB . ARG A 71 ? 0.3728 0.6342 0.3678 0.0051 0.0847 -0.0208 379 ARG A CB 527 C CG . ARG A 71 ? 0.4351 0.7198 0.4265 -0.0071 0.1048 -0.0282 379 ARG A CG 528 C CD . ARG A 71 ? 0.4495 0.7491 0.4478 0.0010 0.1085 -0.0472 379 ARG A CD 529 N NE . ARG A 71 ? 0.4566 0.7489 0.4242 0.0068 0.1032 -0.0497 379 ARG A NE 530 C CZ . ARG A 71 ? 0.5032 0.7848 0.4279 -0.0025 0.1084 -0.0433 379 ARG A CZ 531 N NH1 . ARG A 71 ? 0.5500 0.8283 0.4563 -0.0189 0.1220 -0.0339 379 ARG A NH1 532 N NH2 . ARG A 71 ? 0.5518 0.8196 0.4505 0.0032 0.0974 -0.0453 379 ARG A NH2 533 N N . ILE A 72 ? 0.4747 0.6823 0.3891 -0.0061 0.0751 0.0137 380 ILE A N 534 C CA . ILE A 72 ? 0.4902 0.6770 0.3574 -0.0155 0.0761 0.0263 380 ILE A CA 535 C C . ILE A 72 ? 0.5139 0.6695 0.3663 -0.0203 0.0715 0.0455 380 ILE A C 536 O O . ILE A 72 ? 0.5512 0.6899 0.3700 -0.0358 0.0803 0.0559 380 ILE A O 537 C CB . ILE A 72 ? 0.4763 0.6547 0.3225 -0.0055 0.0601 0.0269 380 ILE A CB 538 C CG1 . ILE A 72 ? 0.4643 0.6669 0.3182 -0.0019 0.0647 0.0069 380 ILE A CG1 539 C CG2 . ILE A 72 ? 0.5022 0.6534 0.2949 -0.0142 0.0571 0.0420 380 ILE A CG2 540 C CD1 . ILE A 72 ? 0.4984 0.6938 0.3358 0.0066 0.0466 0.0052 380 ILE A CD1 541 N N . SER A 73 ? 0.4793 0.6251 0.3547 -0.0074 0.0586 0.0496 381 SER A N 542 C CA A SER A 73 ? 0.4983 0.6111 0.3611 -0.0078 0.0530 0.0656 381 SER A CA 543 C CA B SER A 73 ? 0.4977 0.6105 0.3606 -0.0078 0.0530 0.0656 381 SER A CA 544 C C . SER A 73 ? 0.5031 0.6185 0.4003 -0.0055 0.0551 0.0619 381 SER A C 545 O O . SER A 73 ? 0.4890 0.6082 0.4114 0.0091 0.0460 0.0581 381 SER A O 546 C CB A SER A 73 ? 0.4877 0.5805 0.3383 0.0083 0.0334 0.0755 381 SER A CB 547 C CB B SER A 73 ? 0.4886 0.5816 0.3395 0.0084 0.0334 0.0754 381 SER A CB 548 O OG A SER A 73 ? 0.4878 0.5452 0.3242 0.0109 0.0277 0.0900 381 SER A OG 549 O OG B SER A 73 ? 0.5212 0.6092 0.3369 0.0062 0.0279 0.0793 381 SER A OG 550 N N . PRO A 74 ? 0.5237 0.6369 0.4204 -0.0218 0.0674 0.0629 382 PRO A N 551 C CA . PRO A 74 ? 0.4826 0.5967 0.4076 -0.0221 0.0683 0.0589 382 PRO A CA 552 C C . PRO A 74 ? 0.5200 0.5969 0.4363 -0.0136 0.0585 0.0697 382 PRO A C 553 O O . PRO A 74 ? 0.5072 0.5823 0.4445 -0.0104 0.0572 0.0653 382 PRO A O 554 C CB . PRO A 74 ? 0.4831 0.6048 0.4048 -0.0452 0.0830 0.0584 382 PRO A CB 555 C CG . PRO A 74 ? 0.5256 0.6642 0.4278 -0.0546 0.0936 0.0564 382 PRO A CG 556 C CD . PRO A 74 ? 0.5590 0.6733 0.4296 -0.0431 0.0819 0.0662 382 PRO A CD 557 N N . THR A 75 ? 0.5706 0.6168 0.4549 -0.0090 0.0511 0.0830 383 THR A N 558 C CA . THR A 75 ? 0.5883 0.5989 0.4654 0.0034 0.0416 0.0917 383 THR A CA 559 C C . THR A 75 ? 0.5550 0.5745 0.4488 0.0270 0.0293 0.0897 383 THR A C 560 O O . THR A 75 ? 0.6011 0.5962 0.4914 0.0416 0.0210 0.0959 383 THR A O 561 C CB . THR A 75 ? 0.6477 0.6119 0.4792 -0.0039 0.0388 0.1085 383 THR A CB 562 O OG1 . THR A 75 ? 0.6757 0.6370 0.4820 0.0004 0.0314 0.1158 383 THR A OG1 563 C CG2 . THR A 75 ? 0.6557 0.6116 0.4708 -0.0317 0.0522 0.1110 383 THR A CG2 564 N N . PHE A 76 ? 0.4886 0.5436 0.4015 0.0306 0.0283 0.0801 384 PHE A N 565 C CA . PHE A 76 ? 0.4539 0.5229 0.3844 0.0488 0.0165 0.0775 384 PHE A CA 566 C C . PHE A 76 ? 0.3918 0.4688 0.3552 0.0584 0.0175 0.0700 384 PHE A C 567 O O . PHE A 76 ? 0.3627 0.4664 0.3512 0.0586 0.0192 0.0590 384 PHE A O 568 C CB . PHE A 76 ? 0.4090 0.5089 0.3452 0.0461 0.0153 0.0687 384 PHE A CB 569 C CG . PHE A 76 ? 0.4082 0.5168 0.3476 0.0596 0.0000 0.0702 384 PHE A CG 570 C CD1 . PHE A 76 ? 0.3842 0.5137 0.3209 0.0567 -0.0038 0.0631 384 PHE A CD1 571 C CD2 . PHE A 76 ? 0.4191 0.5162 0.3654 0.0753 -0.0110 0.0776 384 PHE A CD2 572 C CE1 . PHE A 76 ? 0.4036 0.5426 0.3440 0.0669 -0.0200 0.0641 384 PHE A CE1 573 C CE2 . PHE A 76 ? 0.4043 0.5157 0.3595 0.0873 -0.0266 0.0784 384 PHE A CE2 574 C CZ . PHE A 76 ? 0.4066 0.5390 0.3587 0.0819 -0.0320 0.0720 384 PHE A CZ 575 N N . ALA A 77 ? 0.3602 0.4103 0.3196 0.0660 0.0166 0.0758 385 ALA A N 576 C CA . ALA A 77 ? 0.3146 0.3675 0.2983 0.0735 0.0202 0.0688 385 ALA A CA 577 C C . ALA A 77 ? 0.2890 0.3707 0.3016 0.0864 0.0150 0.0626 385 ALA A C 578 O O . ALA A 77 ? 0.2449 0.3423 0.2789 0.0849 0.0199 0.0535 385 ALA A O 579 C CB . ALA A 77 ? 0.3854 0.4006 0.3547 0.0810 0.0207 0.0752 385 ALA A CB 580 N N . ASP A 78 ? 0.2768 0.3645 0.2885 0.0975 0.0039 0.0680 386 ASP A N 581 C CA . ASP A 78 ? 0.2877 0.4062 0.3291 0.1077 -0.0026 0.0626 386 ASP A CA 582 C C . ASP A 78 ? 0.2755 0.4217 0.3309 0.0962 -0.0004 0.0524 386 ASP A C 583 O O . ASP A 78 ? 0.2166 0.3835 0.2981 0.0979 0.0007 0.0451 386 ASP A O 584 C CB . ASP A 78 ? 0.3782 0.4993 0.4136 0.1195 -0.0186 0.0705 386 ASP A CB 585 C CG . ASP A 78 ? 0.4714 0.6268 0.5430 0.1310 -0.0266 0.0654 386 ASP A CG 586 O OD1 . ASP A 78 ? 0.5008 0.6612 0.5959 0.1429 -0.0221 0.0627 386 ASP A OD1 587 O OD2 . ASP A 78 ? 0.4958 0.6737 0.5718 0.1274 -0.0371 0.0633 386 ASP A OD2 588 N N . ALA A 79 ? 0.2939 0.4386 0.3305 0.0842 0.0011 0.0516 387 ALA A N 589 C CA . ALA A 79 ? 0.2628 0.4286 0.3092 0.0754 0.0027 0.0409 387 ALA A CA 590 C C . ALA A 79 ? 0.2165 0.3822 0.2772 0.0699 0.0121 0.0331 387 ALA A C 591 O O . ALA A 79 ? 0.2128 0.3927 0.2902 0.0684 0.0111 0.0249 387 ALA A O 592 C CB . ALA A 79 ? 0.2779 0.4434 0.3005 0.0660 0.0038 0.0404 387 ALA A CB 593 N N . TYR A 80 ? 0.1806 0.3274 0.2319 0.0659 0.0197 0.0360 388 TYR A N 594 C CA . TYR A 80 ? 0.2093 0.3525 0.2714 0.0616 0.0256 0.0297 388 TYR A CA 595 C C . TYR A 80 ? 0.1877 0.3327 0.2657 0.0688 0.0258 0.0279 388 TYR A C 596 O O . TYR A 80 ? 0.1483 0.2986 0.2369 0.0650 0.0271 0.0211 388 TYR A O 597 C CB . TYR A 80 ? 0.2478 0.3684 0.2962 0.0557 0.0315 0.0338 388 TYR A CB 598 C CG . TYR A 80 ? 0.2516 0.3784 0.2947 0.0437 0.0349 0.0309 388 TYR A CG 599 C CD1 . TYR A 80 ? 0.2510 0.3904 0.3085 0.0389 0.0356 0.0213 388 TYR A CD1 600 C CD2 . TYR A 80 ? 0.2821 0.4025 0.3059 0.0370 0.0375 0.0377 388 TYR A CD2 601 C CE1 . TYR A 80 ? 0.2512 0.4031 0.3106 0.0297 0.0394 0.0169 388 TYR A CE1 602 C CE2 . TYR A 80 ? 0.2981 0.4300 0.3204 0.0246 0.0436 0.0340 388 TYR A CE2 603 C CZ . TYR A 80 ? 0.2970 0.4477 0.3404 0.0218 0.0448 0.0228 388 TYR A CZ 604 O OH . TYR A 80 ? 0.3545 0.5232 0.4029 0.0112 0.0514 0.0175 388 TYR A OH 605 N N . SER A 81 ? 0.2365 0.3764 0.3152 0.0792 0.0247 0.0340 389 SER A N 606 C CA . SER A 81 ? 0.2394 0.3856 0.3358 0.0866 0.0280 0.0315 389 SER A CA 607 C C . SER A 81 ? 0.2458 0.4202 0.3626 0.0840 0.0237 0.0258 389 SER A C 608 O O . SER A 81 ? 0.2202 0.3988 0.3471 0.0788 0.0288 0.0203 389 SER A O 609 C CB . SER A 81 ? 0.2771 0.4170 0.3746 0.1017 0.0263 0.0379 389 SER A CB 610 O OG . SER A 81 ? 0.2679 0.4203 0.3871 0.1097 0.0320 0.0337 389 SER A OG 611 N N . ASN A 82 ? 0.2055 0.3958 0.3245 0.0858 0.0136 0.0274 390 ASN A N 612 C CA . ASN A 82 ? 0.2072 0.4213 0.3432 0.0813 0.0074 0.0216 390 ASN A CA 613 C C . ASN A 82 ? 0.1790 0.3916 0.3111 0.0695 0.0085 0.0139 390 ASN A C 614 O O . ASN A 82 ? 0.1682 0.3884 0.3115 0.0625 0.0073 0.0083 390 ASN A O 615 C CB . ASN A 82 ? 0.2311 0.4609 0.3669 0.0863 -0.0061 0.0251 390 ASN A CB 616 C CG . ASN A 82 ? 0.2581 0.4923 0.4062 0.0982 -0.0111 0.0302 390 ASN A CG 617 O OD1 . ASN A 82 ? 0.2729 0.5076 0.4384 0.0989 -0.0045 0.0266 390 ASN A OD1 618 N ND2 . ASN A 82 ? 0.2872 0.5236 0.4248 0.1081 -0.0232 0.0382 390 ASN A ND2 619 N N . MET A 83 ? 0.1657 0.3641 0.2802 0.0661 0.0106 0.0132 391 MET A N 620 C CA . MET A 83 ? 0.1481 0.3427 0.2602 0.0583 0.0109 0.0049 391 MET A CA 621 C C . MET A 83 ? 0.1498 0.3326 0.2666 0.0549 0.0163 0.0032 391 MET A C 622 O O . MET A 83 ? 0.1999 0.3800 0.3190 0.0491 0.0138 -0.0027 391 MET A O 623 C CB . MET A 83 ? 0.1542 0.3423 0.2524 0.0565 0.0133 0.0037 391 MET A CB 624 C CG . MET A 83 ? 0.1386 0.3264 0.2382 0.0525 0.0119 -0.0065 391 MET A CG 625 S SD . MET A 83 ? 0.2536 0.4439 0.3456 0.0506 0.0174 -0.0094 391 MET A SD 626 C CE . MET A 83 ? 0.3206 0.5084 0.4229 0.0510 0.0138 -0.0214 391 MET A CE 627 N N . GLY A 84 ? 0.1466 0.3178 0.2605 0.0583 0.0234 0.0084 392 GLY A N 628 C CA . GLY A 84 ? 0.1271 0.2842 0.2396 0.0547 0.0295 0.0072 392 GLY A CA 629 C C . GLY A 84 ? 0.1372 0.3067 0.2634 0.0516 0.0314 0.0052 392 GLY A C 630 O O . GLY A 84 ? 0.1732 0.3327 0.2953 0.0432 0.0330 0.0021 392 GLY A O 631 N N . ASN A 85 ? 0.1048 0.2961 0.2469 0.0576 0.0304 0.0074 393 ASN A N 632 C CA . ASN A 85 ? 0.1434 0.3550 0.3049 0.0530 0.0320 0.0050 393 ASN A CA 633 C C . ASN A 85 ? 0.1545 0.3672 0.3147 0.0405 0.0244 -0.0002 393 ASN A C 634 O O . ASN A 85 ? 0.1815 0.3926 0.3446 0.0295 0.0284 -0.0026 393 ASN A O 635 C CB . ASN A 85 ? 0.1756 0.4023 0.3517 0.0595 0.0265 0.0067 393 ASN A CB 636 C CG . ASN A 85 ? 0.2663 0.4861 0.4445 0.0705 0.0341 0.0091 393 ASN A CG 637 O OD1 . ASN A 85 ? 0.2665 0.4708 0.4353 0.0714 0.0454 0.0088 393 ASN A OD1 638 N ND2 . ASN A 85 ? 0.2771 0.5081 0.4668 0.0802 0.0270 0.0113 393 ASN A ND2 639 N N . THR A 86 ? 0.1475 0.3598 0.3002 0.0416 0.0141 -0.0023 394 THR A N 640 C CA . THR A 86 ? 0.1218 0.3292 0.2693 0.0323 0.0059 -0.0090 394 THR A CA 641 C C . THR A 86 ? 0.1365 0.3159 0.2689 0.0262 0.0079 -0.0117 394 THR A C 642 O O . THR A 86 ? 0.1763 0.3463 0.3059 0.0155 0.0054 -0.0148 394 THR A O 643 C CB . THR A 86 ? 0.1697 0.3808 0.3087 0.0367 -0.0032 -0.0123 394 THR A CB 644 O OG1 . THR A 86 ? 0.1841 0.4174 0.3325 0.0413 -0.0082 -0.0088 394 THR A OG1 645 C CG2 . THR A 86 ? 0.1911 0.3932 0.3225 0.0291 -0.0117 -0.0213 394 THR A CG2 646 N N . LEU A 87 ? 0.1298 0.2942 0.2514 0.0319 0.0111 -0.0102 395 LEU A N 647 C CA . LEU A 87 ? 0.1478 0.2854 0.2551 0.0278 0.0098 -0.0122 395 LEU A CA 648 C C . LEU A 87 ? 0.1483 0.2731 0.2501 0.0187 0.0170 -0.0090 395 LEU A C 649 O O . LEU A 87 ? 0.1869 0.2892 0.2751 0.0102 0.0128 -0.0107 395 LEU A O 650 C CB . LEU A 87 ? 0.1465 0.2755 0.2470 0.0345 0.0107 -0.0111 395 LEU A CB 651 C CG . LEU A 87 ? 0.1783 0.3180 0.2817 0.0407 0.0057 -0.0157 395 LEU A CG 652 C CD1 . LEU A 87 ? 0.1786 0.3136 0.2789 0.0437 0.0078 -0.0144 395 LEU A CD1 653 C CD2 . LEU A 87 ? 0.1805 0.3136 0.2818 0.0403 -0.0038 -0.0245 395 LEU A CD2 654 N N . LYS A 88 ? 0.1367 0.2737 0.2467 0.0208 0.0281 -0.0047 396 LYS A N 655 C CA . LYS A 88 ? 0.1915 0.3226 0.2981 0.0119 0.0393 -0.0028 396 LYS A CA 656 C C . LYS A 88 ? 0.2157 0.3528 0.3279 -0.0021 0.0372 -0.0050 396 LYS A C 657 O O . LYS A 88 ? 0.2324 0.3471 0.3275 -0.0151 0.0401 -0.0044 396 LYS A O 658 C CB . LYS A 88 ? 0.2034 0.3549 0.3253 0.0200 0.0517 -0.0003 396 LYS A CB 659 C CG . LYS A 88 ? 0.2513 0.4014 0.3714 0.0126 0.0677 -0.0002 396 LYS A CG 660 C CD . LYS A 88 ? 0.2983 0.4708 0.4378 0.0258 0.0789 0.0002 396 LYS A CD 661 C CE . LYS A 88 ? 0.3677 0.5524 0.5156 0.0194 0.0976 -0.0022 396 LYS A CE 662 N NZ . LYS A 88 ? 0.4153 0.5653 0.5305 0.0145 0.1097 -0.0026 396 LYS A NZ 663 N N . GLU A 89 ? 0.1865 0.3507 0.3191 -0.0010 0.0310 -0.0071 397 GLU A N 664 C CA . GLU A 89 ? 0.2416 0.4129 0.3811 -0.0165 0.0275 -0.0097 397 GLU A CA 665 C C . GLU A 89 ? 0.2594 0.3964 0.3750 -0.0244 0.0155 -0.0131 397 GLU A C 666 O O . GLU A 89 ? 0.2748 0.3986 0.3824 -0.0413 0.0146 -0.0137 397 GLU A O 667 C CB . GLU A 89 ? 0.2624 0.4706 0.4284 -0.0133 0.0208 -0.0116 397 GLU A CB 668 C CG . GLU A 89 ? 0.3552 0.5756 0.5321 -0.0315 0.0168 -0.0146 397 GLU A CG 669 C CD . GLU A 89 ? 0.4012 0.6635 0.6083 -0.0285 0.0099 -0.0159 397 GLU A CD 670 O OE1 . GLU A 89 ? 0.4077 0.6874 0.6254 -0.0109 0.0092 -0.0134 397 GLU A OE1 671 O OE2 . GLU A 89 ? 0.4198 0.6957 0.6383 -0.0444 0.0038 -0.0191 397 GLU A OE2 672 N N . MET A 90 ? 0.2235 0.3455 0.3279 -0.0123 0.0065 -0.0157 398 MET A N 673 C CA . MET A 90 ? 0.2791 0.3674 0.3625 -0.0144 -0.0056 -0.0202 398 MET A CA 674 C C . MET A 90 ? 0.2809 0.3340 0.3408 -0.0184 -0.0042 -0.0163 398 MET A C 675 O O . MET A 90 ? 0.3068 0.3278 0.3478 -0.0173 -0.0161 -0.0191 398 MET A O 676 C CB . MET A 90 ? 0.2825 0.3742 0.3673 0.0012 -0.0142 -0.0261 398 MET A CB 677 C CG . MET A 90 ? 0.2855 0.4058 0.3848 0.0048 -0.0170 -0.0300 398 MET A CG 678 S SD . MET A 90 ? 0.3134 0.4395 0.4109 0.0211 -0.0215 -0.0368 398 MET A SD 679 C CE . MET A 90 ? 0.3675 0.4585 0.4484 0.0229 -0.0333 -0.0466 398 MET A CE 680 N N . GLN A 91 ? 0.2829 0.3405 0.3422 -0.0217 0.0094 -0.0104 399 GLN A N 681 C CA . GLN A 91 ? 0.3490 0.3728 0.3812 -0.0267 0.0120 -0.0061 399 GLN A CA 682 C C . GLN A 91 ? 0.3464 0.3538 0.3686 -0.0132 0.0027 -0.0069 399 GLN A C 683 O O . GLN A 91 ? 0.3537 0.3272 0.3499 -0.0164 -0.0024 -0.0043 399 GLN A O 684 C CB . GLN A 91 ? 0.4315 0.4204 0.4384 -0.0443 0.0072 -0.0045 399 GLN A CB 685 C CG . GLN A 91 ? 0.5000 0.5067 0.5165 -0.0629 0.0203 -0.0028 399 GLN A CG 686 C CD . GLN A 91 ? 0.6416 0.6088 0.6271 -0.0848 0.0178 0.0005 399 GLN A CD 687 O OE1 . GLN A 91 ? 0.6946 0.6174 0.6507 -0.0838 0.0025 0.0012 399 GLN A OE1 688 N NE2 . GLN A 91 ? 0.6782 0.6615 0.6708 -0.1049 0.0324 0.0026 399 GLN A NE2 689 N N . ASP A 92 ? 0.2936 0.3256 0.3356 0.0006 0.0002 -0.0103 400 ASP A N 690 C CA . ASP A 92 ? 0.2817 0.3076 0.3209 0.0112 -0.0057 -0.0112 400 ASP A CA 691 C C . ASP A 92 ? 0.2792 0.3140 0.3196 0.0126 0.0070 -0.0065 400 ASP A C 692 O O . ASP A 92 ? 0.2385 0.2983 0.2959 0.0198 0.0124 -0.0064 400 ASP A O 693 C CB . ASP A 92 ? 0.2641 0.3107 0.3214 0.0228 -0.0130 -0.0178 400 ASP A CB 694 C CG . ASP A 92 ? 0.3032 0.3518 0.3638 0.0315 -0.0172 -0.0192 400 ASP A CG 695 O OD1 . ASP A 92 ? 0.3181 0.3483 0.3653 0.0289 -0.0181 -0.0153 400 ASP A OD1 696 O OD2 . ASP A 92 ? 0.2850 0.3544 0.3611 0.0397 -0.0193 -0.0247 400 ASP A OD2 697 N N . VAL A 93 ? 0.2876 0.2972 0.3055 0.0057 0.0113 -0.0027 401 VAL A N 698 C CA . VAL A 93 ? 0.3475 0.3587 0.3611 0.0066 0.0246 0.0003 401 VAL A CA 699 C C . VAL A 93 ? 0.3234 0.3335 0.3376 0.0146 0.0195 -0.0001 401 VAL A C 700 O O . VAL A 93 ? 0.3400 0.3628 0.3623 0.0197 0.0283 0.0012 401 VAL A O 701 C CB . VAL A 93 ? 0.4169 0.3985 0.4005 -0.0046 0.0324 0.0032 401 VAL A CB 702 C CG1 . VAL A 93 ? 0.4613 0.4391 0.4362 -0.0016 0.0454 0.0041 401 VAL A CG1 703 C CG2 . VAL A 93 ? 0.4437 0.4329 0.4303 -0.0156 0.0426 0.0039 401 VAL A CG2 704 N N . GLN A 94 ? 0.2980 0.2925 0.3040 0.0154 0.0044 -0.0018 402 GLN A N 705 C CA . GLN A 94 ? 0.3268 0.3250 0.3374 0.0200 -0.0011 -0.0028 402 GLN A CA 706 C C . GLN A 94 ? 0.2994 0.3308 0.3367 0.0269 0.0026 -0.0045 402 GLN A C 707 O O . GLN A 94 ? 0.3234 0.3612 0.3636 0.0281 0.0079 -0.0026 402 GLN A O 708 C CB . GLN A 94 ? 0.4097 0.3938 0.4153 0.0211 -0.0200 -0.0057 402 GLN A CB 709 C CG . GLN A 94 ? 0.5485 0.4939 0.5204 0.0138 -0.0268 -0.0026 402 GLN A CG 710 C CD . GLN A 94 ? 0.6525 0.5872 0.6231 0.0172 -0.0490 -0.0052 402 GLN A CD 711 O OE1 . GLN A 94 ? 0.6539 0.6119 0.6482 0.0225 -0.0548 -0.0091 402 GLN A OE1 712 N NE2 . GLN A 94 ? 0.7302 0.6299 0.6733 0.0138 -0.0619 -0.0030 402 GLN A NE2 713 N N . GLY A 95 ? 0.2901 0.3383 0.3422 0.0303 -0.0005 -0.0080 403 GLY A N 714 C CA . GLY A 95 ? 0.2592 0.3362 0.3307 0.0358 0.0025 -0.0099 403 GLY A CA 715 C C . GLY A 95 ? 0.2251 0.3124 0.2989 0.0366 0.0147 -0.0046 403 GLY A C 716 O O . GLY A 95 ? 0.1927 0.2903 0.2709 0.0392 0.0180 -0.0025 403 GLY A O 717 N N . ALA A 96 ? 0.2205 0.3047 0.2916 0.0343 0.0209 -0.0024 404 ALA A N 718 C CA . ALA A 96 ? 0.2295 0.3256 0.3071 0.0382 0.0311 0.0017 404 ALA A CA 719 C C . ALA A 96 ? 0.2474 0.3289 0.3139 0.0406 0.0371 0.0052 404 ALA A C 720 O O . ALA A 96 ? 0.2167 0.3053 0.2872 0.0465 0.0403 0.0085 404 ALA A O 721 C CB . ALA A 96 ? 0.1969 0.2959 0.2774 0.0343 0.0382 0.0019 404 ALA A CB 722 N N . LEU A 97 ? 0.2327 0.2893 0.2811 0.0353 0.0371 0.0046 405 LEU A N 723 C CA . LEU A 97 ? 0.3009 0.3376 0.3338 0.0358 0.0415 0.0066 405 LEU A CA 724 C C . LEU A 97 ? 0.2760 0.3176 0.3131 0.0359 0.0357 0.0079 405 LEU A C 725 O O . LEU A 97 ? 0.2873 0.3206 0.3179 0.0383 0.0406 0.0112 405 LEU A O 726 C CB . LEU A 97 ? 0.3743 0.3812 0.3826 0.0282 0.0396 0.0051 405 LEU A CB 727 C CG . LEU A 97 ? 0.4486 0.4292 0.4344 0.0280 0.0480 0.0057 405 LEU A CG 728 C CD1 . LEU A 97 ? 0.5056 0.4592 0.4643 0.0207 0.0508 0.0039 405 LEU A CD1 729 C CD2 . LEU A 97 ? 0.4813 0.4506 0.4603 0.0250 0.0398 0.0064 405 LEU A CD2 730 N N . GLN A 98 ? 0.2830 0.3371 0.3301 0.0332 0.0260 0.0048 406 GLN A N 731 C CA . GLN A 98 ? 0.2895 0.3549 0.3439 0.0310 0.0229 0.0050 406 GLN A CA 732 C C . GLN A 98 ? 0.2371 0.3162 0.2966 0.0353 0.0294 0.0093 406 GLN A C 733 O O . GLN A 98 ? 0.2562 0.3287 0.3084 0.0322 0.0321 0.0134 406 GLN A O 734 C CB . GLN A 98 ? 0.3316 0.4151 0.4014 0.0303 0.0135 -0.0013 406 GLN A CB 735 C CG . GLN A 98 ? 0.4103 0.4790 0.4750 0.0276 0.0025 -0.0051 406 GLN A CG 736 C CD . GLN A 98 ? 0.4745 0.5200 0.5222 0.0205 0.0010 -0.0024 406 GLN A CD 737 O OE1 . GLN A 98 ? 0.4616 0.5115 0.5119 0.0152 0.0025 -0.0010 406 GLN A OE1 738 N NE2 . GLN A 98 ? 0.4964 0.5142 0.5230 0.0184 -0.0019 -0.0017 406 GLN A NE2 739 N N . CYS A 99 ? 0.1816 0.2771 0.2509 0.0411 0.0302 0.0087 407 CYS A N 740 C CA . CYS A 99 ? 0.1940 0.3011 0.2658 0.0462 0.0332 0.0132 407 CYS A CA 741 C C . CYS A 99 ? 0.1954 0.2859 0.2572 0.0518 0.0388 0.0197 407 CYS A C 742 O O . CYS A 99 ? 0.2294 0.3154 0.2835 0.0535 0.0394 0.0255 407 CYS A O 743 C CB . CYS A 99 ? 0.2182 0.3447 0.3023 0.0504 0.0305 0.0105 407 CYS A CB 744 S SG . CYS A 99 ? 0.2583 0.4024 0.3508 0.0476 0.0237 0.0019 407 CYS A SG 745 N N . TYR A 100 ? 0.2018 0.2821 0.2624 0.0551 0.0433 0.0185 408 TYR A N 746 C CA . TYR A 100 ? 0.2239 0.2878 0.2765 0.0634 0.0498 0.0221 408 TYR A CA 747 C C . TYR A 100 ? 0.2308 0.2655 0.2623 0.0587 0.0504 0.0248 408 TYR A C 748 O O . TYR A 100 ? 0.2099 0.2286 0.2312 0.0650 0.0521 0.0299 408 TYR A O 749 C CB . TYR A 100 ? 0.2495 0.3088 0.3033 0.0659 0.0578 0.0180 408 TYR A CB 750 C CG . TYR A 100 ? 0.2055 0.2929 0.2806 0.0676 0.0587 0.0155 408 TYR A CG 751 C CD1 . TYR A 100 ? 0.1944 0.3072 0.2876 0.0743 0.0538 0.0178 408 TYR A CD1 752 C CD2 . TYR A 100 ? 0.1554 0.2416 0.2296 0.0605 0.0635 0.0112 408 TYR A CD2 753 C CE1 . TYR A 100 ? 0.1917 0.3310 0.3052 0.0733 0.0532 0.0150 408 TYR A CE1 754 C CE2 . TYR A 100 ? 0.1735 0.2841 0.2664 0.0584 0.0646 0.0091 408 TYR A CE2 755 C CZ . TYR A 100 ? 0.2049 0.3433 0.3192 0.0645 0.0592 0.0105 408 TYR A CZ 756 O OH . TYR A 100 ? 0.2079 0.3710 0.3414 0.0599 0.0591 0.0080 408 TYR A OH 757 N N . THR A 101 ? 0.2126 0.2388 0.2371 0.0474 0.0472 0.0215 409 THR A N 758 C CA . THR A 101 ? 0.2075 0.2086 0.2139 0.0389 0.0458 0.0232 409 THR A CA 759 C C . THR A 101 ? 0.2384 0.2450 0.2442 0.0341 0.0438 0.0288 409 THR A C 760 O O . THR A 101 ? 0.2849 0.2660 0.2726 0.0319 0.0454 0.0338 409 THR A O 761 C CB . THR A 101 ? 0.2056 0.2031 0.2097 0.0276 0.0392 0.0180 409 THR A CB 762 O OG1 . THR A 101 ? 0.3570 0.3432 0.3536 0.0302 0.0414 0.0142 409 THR A OG1 763 C CG2 . THR A 101 ? 0.2469 0.2196 0.2334 0.0165 0.0363 0.0191 409 THR A CG2 764 N N . ARG A 102 ? 0.2326 0.2693 0.2547 0.0317 0.0409 0.0277 410 ARG A N 765 C CA . ARG A 102 ? 0.2466 0.2902 0.2650 0.0258 0.0416 0.0328 410 ARG A CA 766 C C . ARG A 102 ? 0.2618 0.2919 0.2675 0.0357 0.0431 0.0411 410 ARG A C 767 O O . ARG A 102 ? 0.2836 0.2944 0.2706 0.0302 0.0438 0.0485 410 ARG A O 768 C CB . ARG A 102 ? 0.2334 0.3122 0.2698 0.0235 0.0401 0.0279 410 ARG A CB 769 C CG . ARG A 102 ? 0.2524 0.3457 0.3029 0.0148 0.0371 0.0200 410 ARG A CG 770 C CD . ARG A 102 ? 0.2701 0.3583 0.3148 -0.0004 0.0391 0.0223 410 ARG A CD 771 N NE . ARG A 102 ? 0.2501 0.3506 0.2900 -0.0069 0.0455 0.0265 410 ARG A NE 772 C CZ . ARG A 102 ? 0.2857 0.3637 0.3028 -0.0152 0.0496 0.0361 410 ARG A CZ 773 N NH1 . ARG A 102 ? 0.2823 0.3240 0.2811 -0.0166 0.0477 0.0413 410 ARG A NH1 774 N NH2 . ARG A 102 ? 0.3128 0.4010 0.3216 -0.0227 0.0557 0.0403 410 ARG A NH2 775 N N . ALA A 103 ? 0.2532 0.2636 0.2221 0.0703 0.0870 0.0779 411 ALA A N 776 C CA . ALA A 103 ? 0.2922 0.2906 0.2613 0.0619 0.0840 0.0778 411 ALA A CA 777 C C . ALA A 103 ? 0.2883 0.2917 0.2705 0.0552 0.0828 0.0763 411 ALA A C 778 O O . ALA A 103 ? 0.3020 0.3011 0.2875 0.0510 0.0855 0.0792 411 ALA A O 779 C CB . ALA A 103 ? 0.2794 0.2636 0.2383 0.0611 0.0823 0.0769 411 ALA A CB 780 N N . ILE A 104 ? 0.2960 0.3070 0.2842 0.0541 0.0815 0.0720 412 ILE A N 781 C CA . ILE A 104 ? 0.2975 0.3095 0.2951 0.0449 0.0843 0.0674 412 ILE A CA 782 C C . ILE A 104 ? 0.3464 0.3715 0.3496 0.0359 0.0907 0.0633 412 ILE A C 783 O O . ILE A 104 ? 0.3522 0.3660 0.3588 0.0265 0.0988 0.0606 412 ILE A O 784 C CB . ILE A 104 ? 0.4063 0.4265 0.4067 0.0439 0.0815 0.0622 412 ILE A CB 785 C CG1 . ILE A 104 ? 0.3576 0.3605 0.3532 0.0490 0.0775 0.0651 412 ILE A CG1 786 C CG2 . ILE A 104 ? 0.4602 0.4850 0.4681 0.0304 0.0878 0.0538 412 ILE A CG2 787 C CD1 . ILE A 104 ? 0.3284 0.3380 0.3238 0.0509 0.0741 0.0615 412 ILE A CD1 788 N N . GLN A 105 ? 0.3257 0.3736 0.3285 0.0391 0.0894 0.0635 413 GLN A N 789 C CA . GLN A 105 ? 0.3236 0.3902 0.3312 0.0291 0.0952 0.0591 413 GLN A CA 790 C C . GLN A 105 ? 0.3602 0.4069 0.3651 0.0275 0.1003 0.0633 413 GLN A C 791 O O . GLN A 105 ? 0.3936 0.4366 0.4012 0.0151 0.1093 0.0589 413 GLN A O 792 C CB . GLN A 105 ? 0.2941 0.3972 0.3029 0.0363 0.0928 0.0613 413 GLN A CB 793 C CG . GLN A 105 ? 0.3323 0.4691 0.3452 0.0370 0.0897 0.0588 413 GLN A CG 794 C CD . GLN A 105 ? 0.3563 0.5361 0.3711 0.0488 0.0896 0.0659 413 GLN A CD 795 O OE1 . GLN A 105 ? 0.3540 0.5254 0.3638 0.0629 0.0916 0.0746 413 GLN A OE1 796 N NE2 . GLN A 105 ? 0.3347 0.5639 0.3561 0.0432 0.0886 0.0630 413 GLN A NE2 797 N N . ILE A 106 ? 0.3402 0.3741 0.3381 0.0387 0.0963 0.0714 414 ILE A N 798 C CA . ILE A 106 ? 0.3551 0.3751 0.3494 0.0385 0.1000 0.0773 414 ILE A CA 799 C C . ILE A 106 ? 0.3908 0.3896 0.3867 0.0356 0.1055 0.0813 414 ILE A C 800 O O . ILE A 106 ? 0.3707 0.3599 0.3672 0.0315 0.1147 0.0845 414 ILE A O 801 C CB . ILE A 106 ? 0.3549 0.3699 0.3388 0.0478 0.0955 0.0830 414 ILE A CB 802 C CG1 . ILE A 106 ? 0.2872 0.3168 0.2680 0.0540 0.0959 0.0816 414 ILE A CG1 803 C CG2 . ILE A 106 ? 0.3685 0.3755 0.3481 0.0467 0.0985 0.0898 414 ILE A CG2 804 C CD1 . ILE A 106 ? 0.3409 0.3582 0.3078 0.0611 0.0965 0.0842 414 ILE A CD1 805 N N . ASN A 107 ? 0.3703 0.3614 0.3663 0.0392 0.1018 0.0824 415 ASN A N 806 C CA . ASN A 107 ? 0.4089 0.3822 0.4071 0.0404 0.1087 0.0888 415 ASN A CA 807 C C . ASN A 107 ? 0.4097 0.3780 0.4120 0.0381 0.1088 0.0828 415 ASN A C 808 O O . ASN A 107 ? 0.4026 0.3737 0.4032 0.0440 0.1004 0.0847 415 ASN A O 809 C CB . ASN A 107 ? 0.4276 0.4017 0.4205 0.0501 0.1042 0.1016 415 ASN A CB 810 C CG . ASN A 107 ? 0.4278 0.3910 0.4239 0.0567 0.1122 0.1131 415 ASN A CG 811 O OD1 . ASN A 107 ? 0.4255 0.3707 0.4262 0.0541 0.1245 0.1112 415 ASN A OD1 812 N ND2 . ASN A 107 ? 0.4279 0.4045 0.4210 0.0648 0.1064 0.1241 415 ASN A ND2 813 N N . PRO A 108 ? 0.4311 0.3917 0.4372 0.0270 0.1202 0.0743 416 PRO A N 814 C CA . PRO A 108 ? 0.4505 0.4071 0.4595 0.0215 0.1224 0.0661 416 PRO A CA 815 C C . PRO A 108 ? 0.4325 0.3704 0.4420 0.0317 0.1253 0.0759 416 PRO A C 816 O O . PRO A 108 ? 0.4521 0.3896 0.4635 0.0307 0.1228 0.0711 416 PRO A O 817 C CB . PRO A 108 ? 0.5049 0.4525 0.5143 0.0036 0.1399 0.0546 416 PRO A CB 818 C CG . PRO A 108 ? 0.4933 0.4543 0.5016 -0.0013 0.1405 0.0535 416 PRO A CG 819 C CD . PRO A 108 ? 0.4681 0.4244 0.4742 0.0156 0.1332 0.0694 416 PRO A CD 820 N N . ALA A 109 ? 0.4201 0.3480 0.4283 0.0423 0.1306 0.0909 417 ALA A N 821 C CA . ALA A 109 ? 0.4094 0.3282 0.4192 0.0550 0.1350 0.1043 417 ALA A CA 822 C C . ALA A 109 ? 0.3833 0.3257 0.3913 0.0639 0.1176 0.1118 417 ALA A C 823 O O . ALA A 109 ? 0.4127 0.3629 0.4234 0.0745 0.1168 0.1220 417 ALA A O 824 C CB . ALA A 109 ? 0.3983 0.3038 0.4093 0.0636 0.1480 0.1135 417 ALA A CB 825 N N . PHE A 110 ? 0.2993 0.2569 0.3031 0.0586 0.1038 0.1029 418 PHE A N 826 C CA . PHE A 110 ? 0.3131 0.2883 0.3109 0.0618 0.0912 0.1059 418 PHE A CA 827 C C . PHE A 110 ? 0.2815 0.2575 0.2802 0.0615 0.0859 0.1008 418 PHE A C 828 O O . PHE A 110 ? 0.3081 0.2830 0.3047 0.0567 0.0809 0.0897 418 PHE A O 829 C CB . PHE A 110 ? 0.3273 0.3095 0.3174 0.0571 0.0846 0.0985 418 PHE A CB 830 C CG . PHE A 110 ? 0.3694 0.3641 0.3485 0.0562 0.0773 0.0997 418 PHE A CG 831 C CD1 . PHE A 110 ? 0.3855 0.3943 0.3630 0.0580 0.0748 0.1076 418 PHE A CD1 832 C CD2 . PHE A 110 ? 0.3866 0.3804 0.3555 0.0525 0.0754 0.0925 418 PHE A CD2 833 C CE1 . PHE A 110 ? 0.4289 0.4531 0.3938 0.0513 0.0699 0.1053 418 PHE A CE1 834 C CE2 . PHE A 110 ? 0.4390 0.4386 0.3939 0.0474 0.0733 0.0903 418 PHE A CE2 835 C CZ . PHE A 110 ? 0.4365 0.4525 0.3888 0.0444 0.0702 0.0951 418 PHE A CZ 836 N N . ALA A 111 ? 0.2958 0.2766 0.2978 0.0683 0.0879 0.1108 419 ALA A N 837 C CA . ALA A 111 ? 0.3511 0.3332 0.3550 0.0683 0.0843 0.1073 419 ALA A CA 838 C C . ALA A 111 ? 0.3578 0.3492 0.3523 0.0617 0.0730 0.0979 419 ALA A C 839 O O . ALA A 111 ? 0.3281 0.3119 0.3223 0.0585 0.0705 0.0885 419 ALA A O 840 C CB . ALA A 111 ? 0.4027 0.3966 0.4115 0.0791 0.0888 0.1231 419 ALA A CB 841 N N . ASP A 112 ? 0.3275 0.3341 0.3126 0.0588 0.0685 0.1003 420 ASP A N 842 C CA . ASP A 112 ? 0.3570 0.3658 0.3289 0.0503 0.0634 0.0905 420 ASP A CA 843 C C . ASP A 112 ? 0.3507 0.3401 0.3182 0.0491 0.0646 0.0802 420 ASP A C 844 O O . ASP A 112 ? 0.3325 0.3141 0.2925 0.0465 0.0641 0.0731 420 ASP A O 845 C CB . ASP A 112 ? 0.4426 0.4689 0.4022 0.0433 0.0622 0.0921 420 ASP A CB 846 C CG . ASP A 112 ? 0.5214 0.5813 0.4833 0.0436 0.0598 0.1034 420 ASP A CG 847 O OD1 . ASP A 112 ? 0.5259 0.5930 0.4969 0.0495 0.0592 0.1089 420 ASP A OD1 848 O OD2 . ASP A 112 ? 0.5578 0.6411 0.5120 0.0384 0.0591 0.1075 420 ASP A OD2 849 N N . ALA A 113 ? 0.3251 0.3097 0.2970 0.0519 0.0674 0.0807 421 ALA A N 850 C CA . ALA A 113 ? 0.2936 0.2706 0.2626 0.0534 0.0690 0.0743 421 ALA A CA 851 C C . ALA A 113 ? 0.2650 0.2409 0.2414 0.0549 0.0682 0.0702 421 ALA A C 852 O O . ALA A 113 ? 0.2785 0.2529 0.2496 0.0579 0.0686 0.0668 421 ALA A O 853 C CB . ALA A 113 ? 0.2586 0.2387 0.2311 0.0547 0.0721 0.0761 421 ALA A CB 854 N N . HIS A 114 ? 0.2711 0.2475 0.2586 0.0534 0.0693 0.0712 422 HIS A N 855 C CA . HIS A 114 ? 0.3053 0.2818 0.2986 0.0516 0.0695 0.0655 422 HIS A CA 856 C C . HIS A 114 ? 0.2874 0.2611 0.2752 0.0529 0.0655 0.0640 422 HIS A C 857 O O . HIS A 114 ? 0.2691 0.2450 0.2553 0.0536 0.0643 0.0596 422 HIS A O 858 C CB . HIS A 114 ? 0.3267 0.2971 0.3299 0.0482 0.0766 0.0657 422 HIS A CB 859 C CG . HIS A 114 ? 0.2982 0.2693 0.3054 0.0423 0.0838 0.0625 422 HIS A CG 860 N ND1 . HIS A 114 ? 0.2686 0.2536 0.2776 0.0347 0.0845 0.0532 422 HIS A ND1 861 C CD2 . HIS A 114 ? 0.3108 0.2739 0.3199 0.0418 0.0918 0.0674 422 HIS A CD2 862 C CE1 . HIS A 114 ? 0.2967 0.2824 0.3081 0.0271 0.0926 0.0504 422 HIS A CE1 863 N NE2 . HIS A 114 ? 0.2831 0.2516 0.2943 0.0317 0.0978 0.0589 422 HIS A NE2 864 N N . SER A 115 ? 0.3142 0.2872 0.2985 0.0527 0.0638 0.0683 423 SER A N 865 C CA . SER A 115 ? 0.2783 0.2502 0.2558 0.0508 0.0610 0.0657 423 SER A CA 866 C C . SER A 115 ? 0.2821 0.2455 0.2445 0.0502 0.0626 0.0611 423 SER A C 867 O O . SER A 115 ? 0.2701 0.2268 0.2273 0.0510 0.0635 0.0575 423 SER A O 868 C CB . SER A 115 ? 0.3025 0.2863 0.2787 0.0486 0.0594 0.0715 423 SER A CB 869 O OG . SER A 115 ? 0.3411 0.3278 0.3124 0.0446 0.0573 0.0680 423 SER A OG 870 N N . ASN A 116 ? 0.2475 0.2085 0.2017 0.0498 0.0655 0.0620 424 ASN A N 871 C CA . ASN A 116 ? 0.2804 0.2264 0.2180 0.0511 0.0726 0.0589 424 ASN A CA 872 C C . ASN A 116 ? 0.2957 0.2409 0.2366 0.0618 0.0750 0.0605 424 ASN A C 873 O O . ASN A 116 ? 0.3266 0.2590 0.2561 0.0666 0.0817 0.0603 424 ASN A O 874 C CB . ASN A 116 ? 0.3561 0.2992 0.2846 0.0487 0.0772 0.0595 424 ASN A CB 875 C CG . ASN A 116 ? 0.3952 0.3449 0.3144 0.0358 0.0768 0.0569 424 ASN A CG 876 O OD1 . ASN A 116 ? 0.4058 0.3600 0.3209 0.0280 0.0752 0.0536 424 ASN A OD1 877 N ND2 . ASN A 116 ? 0.3802 0.3357 0.2955 0.0324 0.0783 0.0584 424 ASN A ND2 878 N N . LEU A 117 ? 0.2651 0.2266 0.2206 0.0648 0.0712 0.0627 425 LEU A N 879 C CA . LEU A 117 ? 0.3176 0.2931 0.2780 0.0725 0.0720 0.0644 425 LEU A CA 880 C C . LEU A 117 ? 0.3038 0.2812 0.2662 0.0719 0.0695 0.0620 425 LEU A C 881 O O . LEU A 117 ? 0.2688 0.2514 0.2265 0.0807 0.0728 0.0654 425 LEU A O 882 C CB . LEU A 117 ? 0.2783 0.2759 0.2528 0.0694 0.0695 0.0637 425 LEU A CB 883 C CG . LEU A 117 ? 0.2790 0.3058 0.2597 0.0730 0.0694 0.0643 425 LEU A CG 884 C CD1 . LEU A 117 ? 0.3281 0.3607 0.2993 0.0892 0.0752 0.0734 425 LEU A CD1 885 C CD2 . LEU A 117 ? 0.2182 0.2676 0.2101 0.0638 0.0691 0.0603 425 LEU A CD2 886 N N . ALA A 118 ? 0.2724 0.2468 0.2417 0.0634 0.0650 0.0579 426 ALA A N 887 C CA . ALA A 118 ? 0.2823 0.2572 0.2534 0.0618 0.0630 0.0549 426 ALA A CA 888 C C . ALA A 118 ? 0.3090 0.2683 0.2649 0.0659 0.0669 0.0559 426 ALA A C 889 O O . ALA A 118 ? 0.3164 0.2789 0.2700 0.0706 0.0681 0.0566 426 ALA A O 890 C CB . ALA A 118 ? 0.2711 0.2427 0.2507 0.0545 0.0605 0.0524 426 ALA A CB 891 N N . SER A 119 ? 0.3113 0.2540 0.2551 0.0626 0.0708 0.0554 427 SER A N 892 C CA . SER A 119 ? 0.3635 0.2847 0.2885 0.0621 0.0793 0.0536 427 SER A CA 893 C C . SER A 119 ? 0.3848 0.2960 0.2988 0.0763 0.0904 0.0599 427 SER A C 894 O O . SER A 119 ? 0.4076 0.3027 0.3093 0.0805 0.0989 0.0610 427 SER A O 895 C CB . SER A 119 ? 0.4485 0.3583 0.3606 0.0505 0.0834 0.0490 427 SER A CB 896 O OG . SER A 119 ? 0.4814 0.4096 0.4049 0.0416 0.0737 0.0478 427 SER A OG 897 N N . ILE A 120 ? 0.3592 0.2810 0.2775 0.0853 0.0919 0.0657 428 ILE A N 898 C CA . ILE A 120 ? 0.3620 0.2840 0.2730 0.1035 0.1030 0.0760 428 ILE A CA 899 C C . ILE A 120 ? 0.3936 0.3423 0.3144 0.1115 0.0978 0.0810 428 ILE A C 900 O O . ILE A 120 ? 0.4108 0.3533 0.3213 0.1254 0.1081 0.0895 428 ILE A O 901 C CB . ILE A 120 ? 0.3569 0.2938 0.2729 0.1114 0.1046 0.0818 428 ILE A CB 902 C CG1 . ILE A 120 ? 0.4323 0.3404 0.3342 0.1051 0.1134 0.0777 428 ILE A CG1 903 C CG2 . ILE A 120 ? 0.3932 0.3433 0.3080 0.1335 0.1138 0.0948 428 ILE A CG2 904 C CD1 . ILE A 120 ? 0.4968 0.3674 0.3792 0.1103 0.1305 0.0763 428 ILE A CD1 905 N N . HIS A 121 ? 0.3517 0.3289 0.2909 0.1019 0.0841 0.0756 429 HIS A N 906 C CA . HIS A 121 ? 0.3461 0.3529 0.2940 0.1040 0.0791 0.0770 429 HIS A CA 907 C C . HIS A 121 ? 0.3810 0.3685 0.3208 0.1025 0.0808 0.0748 429 HIS A C 908 O O . HIS A 121 ? 0.3943 0.3942 0.3304 0.1129 0.0843 0.0819 429 HIS A O 909 C CB . HIS A 121 ? 0.3394 0.3716 0.3049 0.0887 0.0686 0.0676 429 HIS A CB 910 C CG . HIS A 121 ? 0.3723 0.4322 0.3459 0.0886 0.0678 0.0692 429 HIS A CG 911 N ND1 . HIS A 121 ? 0.4202 0.5059 0.3913 0.1040 0.0726 0.0807 429 HIS A ND1 912 C CD2 . HIS A 121 ? 0.3743 0.4408 0.3579 0.0755 0.0647 0.0617 429 HIS A CD2 913 C CE1 . HIS A 121 ? 0.3776 0.4885 0.3576 0.0984 0.0705 0.0787 429 HIS A CE1 914 N NE2 . HIS A 121 ? 0.3356 0.4326 0.3225 0.0802 0.0663 0.0664 429 HIS A NE2 915 N N . LYS A 122 ? 0.3750 0.3366 0.3118 0.0900 0.0788 0.0661 430 LYS A N 916 C CA . LYS A 122 ? 0.3918 0.3361 0.3210 0.0856 0.0804 0.0624 430 LYS A CA 917 C C . LYS A 122 ? 0.4628 0.3809 0.3707 0.0969 0.0959 0.0693 430 LYS A C 918 O O . LYS A 122 ? 0.4526 0.3692 0.3552 0.1025 0.0997 0.0727 430 LYS A O 919 C CB . LYS A 122 ? 0.3993 0.3296 0.3292 0.0703 0.0761 0.0535 430 LYS A CB 920 C CG . LYS A 122 ? 0.4407 0.3598 0.3649 0.0631 0.0766 0.0484 430 LYS A CG 921 C CD . LYS A 122 ? 0.4807 0.3976 0.4059 0.0494 0.0729 0.0422 430 LYS A CD 922 C CE . LYS A 122 ? 0.5262 0.4455 0.4533 0.0417 0.0699 0.0375 430 LYS A CE 923 N NZ . LYS A 122 ? 0.5599 0.4582 0.4683 0.0403 0.0797 0.0353 430 LYS A NZ 924 N N . ASP A 123 ? 0.4852 0.3798 0.3794 0.1001 0.1076 0.0714 431 ASP A N 925 C CA . ASP A 123 ? 0.5777 0.4418 0.4547 0.1093 0.1252 0.0731 431 ASP A CA 926 C C . ASP A 123 ? 0.6013 0.4877 0.4852 0.1316 0.1296 0.0851 431 ASP A C 927 O O . ASP A 123 ? 0.6431 0.5146 0.5181 0.1376 0.1397 0.0879 431 ASP A O 928 C CB . ASP A 123 ? 0.6460 0.4814 0.5106 0.1044 0.1357 0.0680 431 ASP A CB 929 C CG . ASP A 123 ? 0.7371 0.5616 0.5941 0.0799 0.1322 0.0559 431 ASP A CG 930 O OD1 . ASP A 123 ? 0.7709 0.5993 0.6279 0.0685 0.1267 0.0509 431 ASP A OD1 931 O OD2 . ASP A 123 ? 0.7654 0.5825 0.6171 0.0724 0.1352 0.0517 431 ASP A OD2 932 N N . SER A 124 ? 0.5488 0.4760 0.4485 0.1391 0.1200 0.0927 432 SER A N 933 C CA . SER A 124 ? 0.5612 0.5233 0.4689 0.1548 0.1196 0.1050 432 SER A CA 934 C C . SER A 124 ? 0.5765 0.5689 0.4920 0.1589 0.1124 0.1095 432 SER A C 935 O O . SER A 124 ? 0.6120 0.6391 0.5342 0.1712 0.1115 0.1200 432 SER A O 936 C CB . SER A 124 ? 0.5259 0.5235 0.4461 0.1586 0.1121 0.1107 432 SER A CB 937 O OG . SER A 124 ? 0.5152 0.4865 0.4280 0.1569 0.1197 0.1080 432 SER A OG 938 N N . GLY A 125 ? 0.5352 0.5170 0.4484 0.1445 0.1059 0.1010 433 GLY A N 939 C CA . GLY A 125 ? 0.5265 0.5352 0.4443 0.1427 0.0987 0.1024 433 GLY A CA 940 C C . GLY A 125 ? 0.5119 0.5692 0.4463 0.1302 0.0845 0.0964 433 GLY A C 941 O O . GLY A 125 ? 0.5695 0.6518 0.5097 0.1236 0.0781 0.0925 433 GLY A O 942 N N . ASN A 126 ? 0.4277 0.4960 0.3714 0.1238 0.0797 0.0920 434 ASN A N 943 C CA . ASN A 126 ? 0.3688 0.4764 0.3292 0.1073 0.0687 0.0816 434 ASN A CA 944 C C . ASN A 126 ? 0.3433 0.4242 0.3104 0.0863 0.0627 0.0648 434 ASN A C 945 O O . ASN A 126 ? 0.3075 0.3796 0.2807 0.0776 0.0608 0.0587 434 ASN A O 946 C CB . ASN A 126 ? 0.3756 0.5096 0.3422 0.1105 0.0688 0.0856 434 ASN A CB 947 C CG . ASN A 126 ? 0.3717 0.5586 0.3517 0.0942 0.0617 0.0768 434 ASN A CG 948 O OD1 . ASN A 126 ? 0.3905 0.5789 0.3758 0.0749 0.0575 0.0625 434 ASN A OD1 949 N ND2 . ASN A 126 ? 0.3619 0.5931 0.3461 0.1005 0.0626 0.0845 434 ASN A ND2 950 N N . ILE A 127 ? 0.3495 0.4190 0.3152 0.0803 0.0611 0.0593 435 ILE A N 951 C CA . ILE A 127 ? 0.2621 0.3080 0.2338 0.0648 0.0578 0.0469 435 ILE A CA 952 C C . ILE A 127 ? 0.2238 0.2851 0.2082 0.0488 0.0560 0.0360 435 ILE A C 953 O O . ILE A 127 ? 0.2823 0.3215 0.2714 0.0426 0.0570 0.0316 435 ILE A O 954 C CB . ILE A 127 ? 0.3349 0.3695 0.3029 0.0623 0.0575 0.0438 435 ILE A CB 955 C CG1 . ILE A 127 ? 0.3832 0.3961 0.3354 0.0757 0.0634 0.0532 435 ILE A CG1 956 C CG2 . ILE A 127 ? 0.2949 0.3070 0.2692 0.0506 0.0560 0.0346 435 ILE A CG2 957 C CD1 . ILE A 127 ? 0.4282 0.4065 0.3723 0.0755 0.0674 0.0531 435 ILE A CD1 958 N N . PRO A 128 ? 0.3011 0.4018 0.2897 0.0412 0.0556 0.0317 436 PRO A N 959 C CA . PRO A 128 ? 0.3266 0.4353 0.3234 0.0217 0.0588 0.0184 436 PRO A CA 960 C C . PRO A 128 ? 0.3219 0.4231 0.3220 0.0216 0.0607 0.0197 436 PRO A C 961 O O . PRO A 128 ? 0.3242 0.4044 0.3287 0.0104 0.0664 0.0118 436 PRO A O 962 C CB . PRO A 128 ? 0.3602 0.5228 0.3577 0.0120 0.0584 0.0137 436 PRO A CB 963 C CG . PRO A 128 ? 0.3821 0.5556 0.3736 0.0246 0.0548 0.0225 436 PRO A CG 964 C CD . PRO A 128 ? 0.3435 0.4831 0.3284 0.0467 0.0543 0.0371 436 PRO A CD 965 N N . GLU A 129 ? 0.2871 0.4034 0.2843 0.0353 0.0582 0.0309 437 GLU A N 966 C CA . GLU A 129 ? 0.2841 0.3938 0.2836 0.0365 0.0598 0.0331 437 GLU A CA 967 C C . GLU A 129 ? 0.3150 0.3795 0.3118 0.0426 0.0601 0.0366 437 GLU A C 968 O O . GLU A 129 ? 0.3371 0.3879 0.3376 0.0376 0.0626 0.0346 437 GLU A O 969 C CB . GLU A 129 ? 0.3643 0.5045 0.3608 0.0515 0.0588 0.0453 437 GLU A CB 970 C CG . GLU A 129 ? 0.4791 0.6373 0.4808 0.0459 0.0605 0.0437 437 GLU A CG 971 C CD . GLU A 129 ? 0.5689 0.7607 0.5774 0.0221 0.0627 0.0291 437 GLU A CD 972 O OE1 . GLU A 129 ? 0.6032 0.8498 0.6130 0.0190 0.0612 0.0296 437 GLU A OE1 973 O OE2 . GLU A 129 ? 0.5971 0.7617 0.6081 0.0059 0.0681 0.0175 437 GLU A OE2 974 N N . ALA A 130 ? 0.2767 0.3215 0.2659 0.0523 0.0587 0.0420 438 ALA A N 975 C CA . ALA A 130 ? 0.2526 0.2642 0.2383 0.0538 0.0588 0.0435 438 ALA A CA 976 C C . ALA A 130 ? 0.2795 0.2795 0.2740 0.0435 0.0601 0.0372 438 ALA A C 977 O O . ALA A 130 ? 0.2806 0.2681 0.2777 0.0430 0.0617 0.0395 438 ALA A O 978 C CB . ALA A 130 ? 0.2624 0.2589 0.2370 0.0607 0.0593 0.0471 438 ALA A CB 979 N N . ILE A 131 ? 0.2517 0.2563 0.2499 0.0367 0.0614 0.0306 439 ILE A N 980 C CA . ILE A 131 ? 0.2633 0.2535 0.2686 0.0290 0.0675 0.0257 439 ILE A CA 981 C C . ILE A 131 ? 0.2817 0.2688 0.2922 0.0216 0.0757 0.0226 439 ILE A C 982 O O . ILE A 131 ? 0.2461 0.2135 0.2603 0.0236 0.0824 0.0265 439 ILE A O 983 C CB . ILE A 131 ? 0.2591 0.2543 0.2658 0.0208 0.0703 0.0171 439 ILE A CB 984 C CG1 . ILE A 131 ? 0.2266 0.2156 0.2289 0.0278 0.0649 0.0208 439 ILE A CG1 985 C CG2 . ILE A 131 ? 0.2747 0.2520 0.2872 0.0118 0.0829 0.0107 439 ILE A CG2 986 C CD1 . ILE A 131 ? 0.2406 0.2418 0.2416 0.0215 0.0652 0.0136 439 ILE A CD1 987 N N . ALA A 132 ? 0.2711 0.2806 0.2814 0.0138 0.0765 0.0168 440 ALA A N 988 C CA . ALA A 132 ? 0.3086 0.3162 0.3219 0.0034 0.0859 0.0117 440 ALA A CA 989 C C . ALA A 132 ? 0.3400 0.3326 0.3538 0.0134 0.0851 0.0220 440 ALA A C 990 O O . ALA A 132 ? 0.3857 0.3578 0.4020 0.0109 0.0957 0.0229 440 ALA A O 991 C CB . ALA A 132 ? 0.3166 0.3624 0.3292 -0.0077 0.0850 0.0041 440 ALA A CB 992 N N . SER A 133 ? 0.2769 0.2784 0.2869 0.0251 0.0750 0.0302 441 SER A N 993 C CA . SER A 133 ? 0.2966 0.2877 0.3050 0.0328 0.0738 0.0388 441 SER A CA 994 C C . SER A 133 ? 0.2772 0.2485 0.2860 0.0388 0.0745 0.0460 441 SER A C 995 O O . SER A 133 ? 0.2721 0.2355 0.2827 0.0414 0.0786 0.0522 441 SER A O 996 C CB . SER A 133 ? 0.2930 0.2957 0.2944 0.0419 0.0670 0.0441 441 SER A CB 997 O OG . SER A 133 ? 0.3112 0.3383 0.3145 0.0393 0.0679 0.0419 441 SER A OG 998 N N . TYR A 134 ? 0.2783 0.2467 0.2855 0.0414 0.0710 0.0463 442 TYR A N 999 C CA . TYR A 134 ? 0.3039 0.2645 0.3128 0.0467 0.0719 0.0539 442 TYR A CA 1000 C C . TYR A 134 ? 0.2940 0.2422 0.3111 0.0471 0.0843 0.0569 442 TYR A C 1001 O O . TYR A 134 ? 0.2813 0.2279 0.3010 0.0551 0.0881 0.0683 442 TYR A O 1002 C CB . TYR A 134 ? 0.3158 0.2783 0.3215 0.0475 0.0669 0.0525 442 TYR A CB 1003 C CG . TYR A 134 ? 0.3099 0.2760 0.3040 0.0484 0.0600 0.0529 442 TYR A CG 1004 C CD1 . TYR A 134 ? 0.3166 0.2856 0.3048 0.0491 0.0586 0.0578 442 TYR A CD1 1005 C CD2 . TYR A 134 ? 0.3107 0.2754 0.2976 0.0476 0.0577 0.0480 442 TYR A CD2 1006 C CE1 . TYR A 134 ? 0.3630 0.3291 0.3368 0.0465 0.0571 0.0555 442 TYR A CE1 1007 C CE2 . TYR A 134 ? 0.3464 0.3057 0.3193 0.0481 0.0572 0.0481 442 TYR A CE2 1008 C CZ . TYR A 134 ? 0.3807 0.3385 0.3463 0.0463 0.0580 0.0505 442 TYR A CZ 1009 O OH . TYR A 134 ? 0.4096 0.3561 0.3578 0.0435 0.0621 0.0480 442 TYR A OH 1010 N N . ARG A 135 ? 0.3136 0.2539 0.3332 0.0386 0.0930 0.0473 443 ARG A N 1011 C CA . ARG A 135 ? 0.3546 0.2735 0.3785 0.0376 0.1114 0.0484 443 ARG A CA 1012 C C . ARG A 135 ? 0.3687 0.2784 0.3925 0.0378 0.1207 0.0529 443 ARG A C 1013 O O . ARG A 135 ? 0.3502 0.2419 0.3763 0.0462 0.1353 0.0637 443 ARG A O 1014 C CB . ARG A 135 ? 0.4122 0.3241 0.4351 0.0231 0.1211 0.0329 443 ARG A CB 1015 C CG . ARG A 135 ? 0.4216 0.3364 0.4453 0.0251 0.1164 0.0311 443 ARG A CG 1016 C CD . ARG A 135 ? 0.4576 0.3703 0.4789 0.0087 0.1250 0.0146 443 ARG A CD 1017 N NE . ARG A 135 ? 0.4466 0.3541 0.4694 0.0132 0.1253 0.0154 443 ARG A NE 1018 C CZ . ARG A 135 ? 0.4516 0.3637 0.4718 0.0013 0.1274 0.0026 443 ARG A CZ 1019 N NH1 . ARG A 135 ? 0.5020 0.4297 0.5177 -0.0171 0.1290 -0.0123 443 ARG A NH1 1020 N NH2 . ARG A 135 ? 0.3975 0.3039 0.4195 0.0071 0.1277 0.0049 443 ARG A NH2 1021 N N . THR A 136 ? 0.3561 0.2793 0.3770 0.0302 0.1137 0.0465 444 THR A N 1022 C CA . THR A 136 ? 0.3548 0.2722 0.3752 0.0302 0.1205 0.0508 444 THR A CA 1023 C C . THR A 136 ? 0.3138 0.2332 0.3349 0.0462 0.1156 0.0684 444 THR A C 1024 O O . THR A 136 ? 0.3767 0.2824 0.3991 0.0525 0.1283 0.0786 444 THR A O 1025 C CB . THR A 136 ? 0.3598 0.2979 0.3779 0.0202 0.1129 0.0417 444 THR A CB 1026 O OG1 . THR A 136 ? 0.3884 0.3328 0.4057 0.0027 0.1202 0.0258 444 THR A OG1 1027 C CG2 . THR A 136 ? 0.3547 0.2876 0.3720 0.0206 0.1189 0.0467 444 THR A CG2 1028 N N . ALA A 137 ? 0.3051 0.2426 0.3239 0.0517 0.0995 0.0719 445 ALA A N 1029 C CA . ALA A 137 ? 0.3194 0.2681 0.3368 0.0620 0.0942 0.0859 445 ALA A CA 1030 C C . ALA A 137 ? 0.3261 0.2723 0.3491 0.0737 0.1039 0.1004 445 ALA A C 1031 O O . ALA A 137 ? 0.3312 0.2855 0.3552 0.0835 0.1078 0.1155 445 ALA A O 1032 C CB . ALA A 137 ? 0.3022 0.2675 0.3128 0.0605 0.0794 0.0829 445 ALA A CB 1033 N N . LEU A 138 ? 0.2889 0.2272 0.3154 0.0743 0.1087 0.0974 446 LEU A N 1034 C CA . LEU A 138 ? 0.3065 0.2443 0.3390 0.0876 0.1200 0.1114 446 LEU A CA 1035 C C . LEU A 138 ? 0.3774 0.2925 0.4126 0.0903 0.1417 0.1120 446 LEU A C 1036 O O . LEU A 138 ? 0.4046 0.3277 0.4441 0.1032 0.1521 0.1242 446 LEU A O 1037 C CB . LEU A 138 ? 0.3369 0.2735 0.3715 0.0866 0.1184 0.1064 446 LEU A CB 1038 C CG . LEU A 138 ? 0.3400 0.3055 0.3711 0.0833 0.0988 0.1039 446 LEU A CG 1039 C CD1 . LEU A 138 ? 0.3438 0.3038 0.3747 0.0765 0.0956 0.0918 446 LEU A CD1 1040 C CD2 . LEU A 138 ? 0.3294 0.3264 0.3635 0.0955 0.0966 0.1225 446 LEU A CD2 1041 N N . LYS A 139 ? 0.4223 0.3103 0.4536 0.0775 0.1509 0.0993 447 LYS A N 1042 C CA . LYS A 139 ? 0.4929 0.3549 0.5230 0.0763 0.1738 0.0960 447 LYS A CA 1043 C C . LYS A 139 ? 0.5030 0.3751 0.5336 0.0852 0.1737 0.1070 447 LYS A C 1044 O O . LYS A 139 ? 0.5025 0.3657 0.5344 0.0955 0.1913 0.1145 447 LYS A O 1045 C CB . LYS A 139 ? 0.5474 0.3851 0.5714 0.0537 0.1827 0.0764 447 LYS A CB 1046 C CG . LYS A 139 ? 0.6918 0.4988 0.7106 0.0470 0.2079 0.0668 447 LYS A CG 1047 C CD . LYS A 139 ? 0.7731 0.5711 0.7848 0.0178 0.2131 0.0433 447 LYS A CD 1048 C CE . LYS A 139 ? 0.8755 0.6390 0.8779 0.0071 0.2396 0.0285 447 LYS A CE 1049 N NZ . LYS A 139 ? 0.8984 0.6645 0.8927 -0.0255 0.2428 0.0018 447 LYS A NZ 1050 N N . LEU A 140 ? 0.4834 0.3744 0.5121 0.0817 0.1553 0.1085 448 LEU A N 1051 C CA . LEU A 140 ? 0.4562 0.3606 0.4847 0.0885 0.1524 0.1181 448 LEU A CA 1052 C C . LEU A 140 ? 0.4722 0.4095 0.5057 0.1044 0.1460 0.1349 448 LEU A C 1053 O O . LEU A 140 ? 0.4518 0.3981 0.4877 0.1146 0.1528 0.1460 448 LEU A O 1054 C CB . LEU A 140 ? 0.3789 0.2929 0.4019 0.0781 0.1372 0.1131 448 LEU A CB 1055 C CG . LEU A 140 ? 0.3774 0.2707 0.3962 0.0620 0.1463 0.1005 448 LEU A CG 1056 C CD1 . LEU A 140 ? 0.3511 0.2682 0.3673 0.0535 0.1264 0.0901 448 LEU A CD1 1057 C CD2 . LEU A 140 ? 0.3178 0.1978 0.3359 0.0638 0.1597 0.1028 448 LEU A CD2 1058 N N . LYS A 141 ? 0.4221 0.3801 0.4568 0.1055 0.1336 0.1367 449 LYS A N 1059 C CA . LYS A 141 ? 0.3940 0.3907 0.4330 0.1171 0.1272 0.1518 449 LYS A CA 1060 C C . LYS A 141 ? 0.3934 0.3982 0.4363 0.1211 0.1279 0.1539 449 LYS A C 1061 O O . LYS A 141 ? 0.3248 0.3404 0.3643 0.1140 0.1135 0.1486 449 LYS A O 1062 C CB . LYS A 141 ? 0.3960 0.4208 0.4284 0.1103 0.1077 0.1521 449 LYS A CB 1063 C CG . LYS A 141 ? 0.4395 0.5126 0.4753 0.1185 0.1011 0.1667 449 LYS A CG 1064 C CD . LYS A 141 ? 0.4480 0.5465 0.4744 0.1093 0.0874 0.1662 449 LYS A CD 1065 C CE . LYS A 141 ? 0.4477 0.5424 0.4596 0.0926 0.0757 0.1531 449 LYS A CE 1066 N NZ . LYS A 141 ? 0.4816 0.5939 0.4802 0.0807 0.0679 0.1493 449 LYS A NZ 1067 N N . PRO A 142 ? 0.4293 0.4267 0.4778 0.1327 0.1470 0.1621 450 PRO A N 1068 C CA . PRO A 142 ? 0.4397 0.4420 0.4914 0.1376 0.1519 0.1657 450 PRO A CA 1069 C C . PRO A 142 ? 0.4021 0.4523 0.4566 0.1409 0.1352 0.1747 450 PRO A C 1070 O O . PRO A 142 ? 0.4073 0.4592 0.4615 0.1372 0.1294 0.1702 450 PRO A O 1071 C CB . PRO A 142 ? 0.4893 0.4842 0.5446 0.1533 0.1782 0.1795 450 PRO A CB 1072 C CG . PRO A 142 ? 0.5269 0.4903 0.5787 0.1502 0.1903 0.1732 450 PRO A CG 1073 C CD . PRO A 142 ? 0.4712 0.4498 0.5210 0.1413 0.1686 0.1681 450 PRO A CD 1074 N N . ASP A 143 ? 0.4053 0.4964 0.4625 0.1466 0.1281 0.1865 451 ASP A N 1075 C CA . ASP A 143 ? 0.3982 0.5432 0.4571 0.1457 0.1124 0.1934 451 ASP A CA 1076 C C . ASP A 143 ? 0.3206 0.4701 0.3679 0.1281 0.0921 0.1813 451 ASP A C 1077 O O . ASP A 143 ? 0.3130 0.4802 0.3567 0.1247 0.0863 0.1834 451 ASP A O 1078 C CB . ASP A 143 ? 0.4765 0.6736 0.5446 0.1603 0.1183 0.2137 451 ASP A CB 1079 C CG . ASP A 143 ? 0.4976 0.7582 0.5685 0.1568 0.1032 0.2194 451 ASP A CG 1080 O OD1 . ASP A 143 ? 0.5044 0.7674 0.5723 0.1474 0.0939 0.2106 451 ASP A OD1 1081 O OD2 . ASP A 143 ? 0.5355 0.8439 0.6100 0.1615 0.0999 0.2313 451 ASP A OD2 1082 N N . PHE A 144 ? 0.3063 0.4376 0.3449 0.1161 0.0841 0.1689 452 PHE A N 1083 C CA . PHE A 144 ? 0.2889 0.4117 0.3106 0.0970 0.0723 0.1546 452 PHE A CA 1084 C C . PHE A 144 ? 0.2546 0.3826 0.2717 0.0841 0.0643 0.1401 452 PHE A C 1085 O O . PHE A 144 ? 0.2302 0.3229 0.2465 0.0791 0.0647 0.1260 452 PHE A O 1086 C CB . PHE A 144 ? 0.2850 0.3579 0.3054 0.0934 0.0769 0.1421 452 PHE A CB 1087 C CG . PHE A 144 ? 0.2728 0.3382 0.2808 0.0775 0.0678 0.1261 452 PHE A CG 1088 C CD1 . PHE A 144 ? 0.2739 0.3629 0.2697 0.0640 0.0587 0.1187 452 PHE A CD1 1089 C CD2 . PHE A 144 ? 0.2885 0.3229 0.2957 0.0754 0.0712 0.1183 452 PHE A CD2 1090 C CE1 . PHE A 144 ? 0.3216 0.3962 0.3040 0.0513 0.0554 0.1049 452 PHE A CE1 1091 C CE2 . PHE A 144 ? 0.3310 0.3589 0.3274 0.0646 0.0652 0.1063 452 PHE A CE2 1092 C CZ . PHE A 144 ? 0.3034 0.3479 0.2870 0.0539 0.0585 0.1002 452 PHE A CZ 1093 N N . PRO A 145 ? 0.2798 0.4561 0.2930 0.0778 0.0578 0.1440 453 PRO A N 1094 C CA . PRO A 145 ? 0.3070 0.4925 0.3154 0.0652 0.0525 0.1320 453 PRO A CA 1095 C C . PRO A 145 ? 0.3046 0.4503 0.2990 0.0475 0.0490 0.1082 453 PRO A C 1096 O O . PRO A 145 ? 0.2620 0.3861 0.2576 0.0463 0.0495 0.0998 453 PRO A O 1097 C CB . PRO A 145 ? 0.3091 0.5586 0.3110 0.0545 0.0466 0.1372 453 PRO A CB 1098 C CG . PRO A 145 ? 0.3236 0.6032 0.3381 0.0728 0.0490 0.1588 453 PRO A CG 1099 C CD . PRO A 145 ? 0.3184 0.5490 0.3324 0.0810 0.0555 0.1596 453 PRO A CD 1100 N N . ASP A 146 ? 0.2746 0.4111 0.2555 0.0359 0.0473 0.0991 454 ASP A N 1101 C CA . ASP A 146 ? 0.3306 0.4287 0.2972 0.0236 0.0478 0.0803 454 ASP A CA 1102 C C . ASP A 146 ? 0.3020 0.3615 0.2777 0.0345 0.0501 0.0779 454 ASP A C 1103 O O . ASP A 146 ? 0.3394 0.3793 0.3099 0.0302 0.0505 0.0680 454 ASP A O 1104 C CB . ASP A 146 ? 0.3413 0.4297 0.2937 0.0146 0.0495 0.0739 454 ASP A CB 1105 C CG . ASP A 146 ? 0.4154 0.5350 0.3505 -0.0058 0.0497 0.0674 454 ASP A CG 1106 O OD1 . ASP A 146 ? 0.4307 0.5785 0.3629 -0.0159 0.0483 0.0650 454 ASP A OD1 1107 O OD2 . ASP A 146 ? 0.4986 0.6163 0.4220 -0.0138 0.0524 0.0634 454 ASP A OD2 1108 N N . ALA A 147 ? 0.2656 0.3162 0.2534 0.0472 0.0532 0.0868 455 ALA A N 1109 C CA . ALA A 147 ? 0.2513 0.2711 0.2458 0.0526 0.0567 0.0821 455 ALA A CA 1110 C C . ALA A 147 ? 0.2490 0.2656 0.2526 0.0571 0.0594 0.0827 455 ALA A C 1111 O O . ALA A 147 ? 0.2300 0.2277 0.2333 0.0545 0.0599 0.0732 455 ALA A O 1112 C CB . ALA A 147 ? 0.2597 0.2697 0.2618 0.0602 0.0623 0.0886 455 ALA A CB 1113 N N . TYR A 148 ? 0.2290 0.2677 0.2407 0.0648 0.0620 0.0950 456 TYR A N 1114 C CA . TYR A 148 ? 0.2405 0.2757 0.2607 0.0704 0.0667 0.0967 456 TYR A CA 1115 C C . TYR A 148 ? 0.2523 0.2908 0.2645 0.0593 0.0596 0.0849 456 TYR A C 1116 O O . TYR A 148 ? 0.2312 0.2514 0.2452 0.0582 0.0615 0.0772 456 TYR A O 1117 C CB . TYR A 148 ? 0.2703 0.3329 0.3011 0.0851 0.0731 0.1163 456 TYR A CB 1118 C CG . TYR A 148 ? 0.2906 0.3445 0.3306 0.0938 0.0821 0.1196 456 TYR A CG 1119 C CD1 . TYR A 148 ? 0.3350 0.3569 0.3821 0.1039 0.0984 0.1234 456 TYR A CD1 1120 C CD2 . TYR A 148 ? 0.2959 0.3716 0.3359 0.0901 0.0766 0.1175 456 TYR A CD2 1121 C CE1 . TYR A 148 ? 0.3499 0.3595 0.4034 0.1109 0.1099 0.1253 456 TYR A CE1 1122 C CE2 . TYR A 148 ? 0.3248 0.3923 0.3731 0.0985 0.0857 0.1206 456 TYR A CE2 1123 C CZ . TYR A 148 ? 0.3260 0.3595 0.3808 0.1094 0.1027 0.1246 456 TYR A CZ 1124 O OH . TYR A 148 ? 0.3464 0.3678 0.4076 0.1168 0.1147 0.1265 456 TYR A OH 1125 N N . CYS A 149 ? 0.2581 0.3196 0.2597 0.0490 0.0533 0.0825 457 CYS A N 1126 C CA . CYS A 149 ? 0.2766 0.3384 0.2674 0.0364 0.0500 0.0708 457 CYS A CA 1127 C C . CYS A 149 ? 0.2784 0.3045 0.2581 0.0307 0.0505 0.0577 457 CYS A C 1128 O O . CYS A 149 ? 0.2582 0.2724 0.2343 0.0275 0.0509 0.0506 457 CYS A O 1129 C CB . CYS A 149 ? 0.2837 0.3788 0.2625 0.0222 0.0470 0.0690 457 CYS A CB 1130 S SG . CYS A 149 ? 0.3145 0.4697 0.3070 0.0300 0.0457 0.0874 457 CYS A SG 1131 N N . ASN A 150 ? 0.2789 0.2913 0.2532 0.0311 0.0512 0.0564 458 ASN A N 1132 C CA . ASN A 150 ? 0.2601 0.2450 0.2257 0.0307 0.0532 0.0485 458 ASN A CA 1133 C C . ASN A 150 ? 0.2732 0.2486 0.2504 0.0381 0.0536 0.0481 458 ASN A C 1134 O O . ASN A 150 ? 0.3001 0.2642 0.2719 0.0377 0.0544 0.0427 458 ASN A O 1135 C CB . ASN A 150 ? 0.2677 0.2448 0.2276 0.0319 0.0548 0.0493 458 ASN A CB 1136 C CG . ASN A 150 ? 0.3682 0.3468 0.3100 0.0206 0.0578 0.0451 458 ASN A CG 1137 O OD1 . ASN A 150 ? 0.4361 0.4217 0.3680 0.0094 0.0593 0.0399 458 ASN A OD1 1138 N ND2 . ASN A 150 ? 0.4465 0.4190 0.3829 0.0213 0.0603 0.0459 458 ASN A ND2 1139 N N . LEU A 151 ? 0.2146 0.1948 0.2063 0.0442 0.0554 0.0540 459 LEU A N 1140 C CA . LEU A 151 ? 0.2507 0.2214 0.2513 0.0464 0.0593 0.0507 459 LEU A CA 1141 C C . LEU A 151 ? 0.2395 0.2111 0.2417 0.0448 0.0595 0.0474 459 LEU A C 1142 O O . LEU A 151 ? 0.2411 0.2060 0.2426 0.0422 0.0602 0.0404 459 LEU A O 1143 C CB . LEU A 151 ? 0.2441 0.2119 0.2563 0.0517 0.0672 0.0571 459 LEU A CB 1144 C CG . LEU A 151 ? 0.2760 0.2306 0.2950 0.0497 0.0765 0.0513 459 LEU A CG 1145 C CD1 . LEU A 151 ? 0.2873 0.2409 0.3018 0.0412 0.0743 0.0399 459 LEU A CD1 1146 C CD2 . LEU A 151 ? 0.3305 0.2735 0.3570 0.0550 0.0902 0.0582 459 LEU A CD2 1147 N N . ALA A 152 ? 0.2356 0.2207 0.2397 0.0461 0.0587 0.0531 460 ALA A N 1148 C CA . ALA A 152 ? 0.2507 0.2397 0.2566 0.0447 0.0591 0.0508 460 ALA A CA 1149 C C . ALA A 152 ? 0.2692 0.2497 0.2622 0.0370 0.0553 0.0411 460 ALA A C 1150 O O . ALA A 152 ? 0.2606 0.2357 0.2548 0.0359 0.0564 0.0363 460 ALA A O 1151 C CB . ALA A 152 ? 0.2293 0.2450 0.2387 0.0468 0.0582 0.0598 460 ALA A CB 1152 N N . HIS A 153 ? 0.2757 0.2528 0.2550 0.0322 0.0534 0.0388 461 HIS A N 1153 C CA . HIS A 153 ? 0.2674 0.2303 0.2316 0.0276 0.0548 0.0323 461 HIS A CA 1154 C C . HIS A 153 ? 0.2566 0.2094 0.2210 0.0337 0.0557 0.0311 461 HIS A C 1155 O O . HIS A 153 ? 0.2449 0.1925 0.2038 0.0340 0.0571 0.0284 461 HIS A O 1156 C CB . HIS A 153 ? 0.2926 0.2483 0.2385 0.0201 0.0582 0.0298 461 HIS A CB 1157 C CG . HIS A 153 ? 0.3245 0.2594 0.2518 0.0159 0.0653 0.0243 461 HIS A CG 1158 N ND1 . HIS A 153 ? 0.3532 0.2655 0.2663 0.0210 0.0732 0.0251 461 HIS A ND1 1159 C CD2 . HIS A 153 ? 0.3481 0.2797 0.2682 0.0088 0.0681 0.0194 461 HIS A CD2 1160 C CE1 . HIS A 153 ? 0.3633 0.2561 0.2600 0.0184 0.0823 0.0219 461 HIS A CE1 1161 N NE2 . HIS A 153 ? 0.3563 0.2600 0.2568 0.0095 0.0788 0.0174 461 HIS A NE2 1162 N N . CYS A 154 ? 0.2806 0.2357 0.2511 0.0381 0.0553 0.0336 462 CYS A N 1163 C CA . CYS A 154 ? 0.2534 0.2122 0.2266 0.0416 0.0556 0.0323 462 CYS A CA 1164 C C . CYS A 154 ? 0.2285 0.1934 0.2103 0.0381 0.0559 0.0274 462 CYS A C 1165 O O . CYS A 154 ? 0.2104 0.1818 0.1885 0.0383 0.0559 0.0251 462 CYS A O 1166 C CB . CYS A 154 ? 0.2653 0.2301 0.2457 0.0431 0.0558 0.0340 462 CYS A CB 1167 S SG . CYS A 154 ? 0.3299 0.2887 0.2997 0.0479 0.0568 0.0393 462 CYS A SG 1168 N N . LEU A 155 ? 0.2392 0.2029 0.2315 0.0358 0.0582 0.0268 463 LEU A N 1169 C CA . LEU A 155 ? 0.2400 0.2039 0.2395 0.0318 0.0624 0.0212 463 LEU A CA 1170 C C . LEU A 155 ? 0.2291 0.1934 0.2229 0.0305 0.0601 0.0190 463 LEU A C 1171 O O . LEU A 155 ? 0.2617 0.2298 0.2556 0.0264 0.0617 0.0131 463 LEU A O 1172 C CB . LEU A 155 ? 0.2360 0.1932 0.2463 0.0338 0.0701 0.0246 463 LEU A CB 1173 C CG . LEU A 155 ? 0.2661 0.2183 0.2810 0.0342 0.0759 0.0263 463 LEU A CG 1174 C CD1 . LEU A 155 ? 0.2691 0.2112 0.2930 0.0407 0.0873 0.0339 463 LEU A CD1 1175 C CD2 . LEU A 155 ? 0.3047 0.2589 0.3187 0.0239 0.0804 0.0155 463 LEU A CD2 1176 N N . GLN A 156 ? 0.2050 0.1672 0.1924 0.0319 0.0574 0.0227 464 GLN A N 1177 C CA . GLN A 156 ? 0.2120 0.1724 0.1915 0.0290 0.0567 0.0201 464 GLN A CA 1178 C C . GLN A 156 ? 0.2184 0.1755 0.1864 0.0307 0.0569 0.0189 464 GLN A C 1179 O O . GLN A 156 ? 0.2250 0.1845 0.1910 0.0292 0.0576 0.0159 464 GLN A O 1180 C CB . GLN A 156 ? 0.2439 0.2045 0.2151 0.0255 0.0560 0.0222 464 GLN A CB 1181 C CG . GLN A 156 ? 0.3008 0.2596 0.2632 0.0193 0.0573 0.0181 464 GLN A CG 1182 C CD . GLN A 156 ? 0.3243 0.2982 0.2992 0.0183 0.0569 0.0186 464 GLN A CD 1183 O OE1 . GLN A 156 ? 0.3263 0.3127 0.3144 0.0230 0.0570 0.0244 464 GLN A OE1 1184 N NE2 . GLN A 156 ? 0.3021 0.2748 0.2727 0.0139 0.0581 0.0142 464 GLN A NE2 1185 N N . ILE A 157 ? 0.2367 0.1904 0.1969 0.0355 0.0576 0.0230 465 ILE A N 1186 C CA . ILE A 157 ? 0.2086 0.1622 0.1574 0.0426 0.0605 0.0271 465 ILE A CA 1187 C C . ILE A 157 ? 0.2490 0.2248 0.2046 0.0429 0.0584 0.0254 465 ILE A C 1188 O O . ILE A 157 ? 0.2640 0.2456 0.2114 0.0476 0.0605 0.0287 465 ILE A O 1189 C CB . ILE A 157 ? 0.2211 0.1714 0.1639 0.0502 0.0631 0.0335 465 ILE A CB 1190 C CG1 . ILE A 157 ? 0.2534 0.1792 0.1815 0.0481 0.0694 0.0340 465 ILE A CG1 1191 C CG2 . ILE A 157 ? 0.2404 0.2036 0.1773 0.0619 0.0664 0.0414 465 ILE A CG2 1192 C CD1 . ILE A 157 ? 0.2736 0.1935 0.1970 0.0532 0.0729 0.0384 465 ILE A CD1 1193 N N . VAL A 158 ? 0.1943 0.1831 0.1631 0.0366 0.0563 0.0201 466 VAL A N 1194 C CA . VAL A 158 ? 0.2624 0.2768 0.2357 0.0310 0.0561 0.0149 466 VAL A CA 1195 C C . VAL A 158 ? 0.2401 0.2522 0.2201 0.0198 0.0587 0.0046 466 VAL A C 1196 O O . VAL A 158 ? 0.2400 0.2715 0.2229 0.0097 0.0611 -0.0035 466 VAL A O 1197 C CB . VAL A 158 ? 0.2465 0.2790 0.2261 0.0272 0.0563 0.0130 466 VAL A CB 1198 C CG1 . VAL A 158 ? 0.2474 0.2851 0.2205 0.0401 0.0550 0.0243 466 VAL A CG1 1199 C CG2 . VAL A 158 ? 0.2158 0.2300 0.2050 0.0201 0.0600 0.0074 466 VAL A CG2 1200 N N . CYS A 159 ? 0.2362 0.2275 0.2178 0.0205 0.0597 0.0047 467 CYS A N 1201 C CA . CYS A 159 ? 0.2413 0.2271 0.2293 0.0134 0.0643 -0.0027 467 CYS A CA 1202 C C . CYS A 159 ? 0.2559 0.2383 0.2532 0.0053 0.0731 -0.0101 467 CYS A C 1203 O O . CYS A 159 ? 0.2562 0.2406 0.2547 -0.0050 0.0803 -0.0201 467 CYS A O 1204 C CB . CYS A 159 ? 0.2749 0.2723 0.2568 0.0095 0.0637 -0.0068 467 CYS A CB 1205 S SG . CYS A 159 ? 0.2836 0.2741 0.2517 0.0188 0.0597 0.0019 467 CYS A SG 1206 N N . ASP A 160 ? 0.2547 0.2292 0.2564 0.0088 0.0748 -0.0058 468 ASP A N 1207 C CA . ASP A 160 ? 0.2470 0.2085 0.2558 0.0033 0.0875 -0.0105 468 ASP A CA 1208 C C . ASP A 160 ? 0.2544 0.1989 0.2701 0.0131 0.0932 -0.0025 468 ASP A C 1209 O O . ASP A 160 ? 0.2601 0.2053 0.2778 0.0231 0.0878 0.0084 468 ASP A O 1210 C CB . ASP A 160 ? 0.2357 0.1993 0.2453 0.0036 0.0873 -0.0081 468 ASP A CB 1211 C CG . ASP A 160 ? 0.3043 0.2506 0.3180 -0.0042 0.1042 -0.0141 468 ASP A CG 1212 O OD1 . ASP A 160 ? 0.3456 0.2701 0.3634 -0.0015 0.1174 -0.0132 468 ASP A OD1 1213 O OD2 . ASP A 160 ? 0.3701 0.3239 0.3821 -0.0128 0.1066 -0.0193 468 ASP A OD2 1214 N N . TRP A 161 ? 0.2510 0.1844 0.2696 0.0100 0.1049 -0.0075 469 TRP A N 1215 C CA . TRP A 161 ? 0.2608 0.1850 0.2870 0.0222 0.1118 0.0027 469 TRP A CA 1216 C C . TRP A 161 ? 0.2941 0.1940 0.3258 0.0262 0.1341 0.0053 469 TRP A C 1217 O O . TRP A 161 ? 0.2759 0.1648 0.3130 0.0351 0.1475 0.0113 469 TRP A O 1218 C CB . TRP A 161 ? 0.2741 0.2023 0.2994 0.0203 0.1109 -0.0013 469 TRP A CB 1219 C CG . TRP A 161 ? 0.2433 0.1895 0.2609 0.0177 0.0933 -0.0022 469 TRP A CG 1220 C CD1 . TRP A 161 ? 0.2291 0.1846 0.2421 0.0219 0.0811 0.0045 469 TRP A CD1 1221 C CD2 . TRP A 161 ? 0.2269 0.1794 0.2381 0.0104 0.0897 -0.0102 469 TRP A CD2 1222 N NE1 . TRP A 161 ? 0.2408 0.2032 0.2440 0.0185 0.0727 0.0017 469 TRP A NE1 1223 C CE2 . TRP A 161 ? 0.2558 0.2183 0.2583 0.0124 0.0768 -0.0063 469 TRP A CE2 1224 C CE3 . TRP A 161 ? 0.2344 0.1835 0.2449 0.0020 0.0981 -0.0203 469 TRP A CE3 1225 C CZ2 . TRP A 161 ? 0.2326 0.2014 0.2263 0.0087 0.0725 -0.0099 469 TRP A CZ2 1226 C CZ3 . TRP A 161 ? 0.2469 0.2076 0.2498 -0.0029 0.0910 -0.0247 469 TRP A CZ3 1227 C CH2 . TRP A 161 ? 0.2286 0.1988 0.2234 0.0016 0.0784 -0.0185 469 TRP A CH2 1228 N N . THR A 162 ? 0.3542 0.2445 0.3839 0.0206 0.1404 0.0020 470 THR A N 1229 C CA . THR A 162 ? 0.4216 0.2820 0.4537 0.0246 0.1657 0.0052 470 THR A CA 1230 C C . THR A 162 ? 0.3757 0.2381 0.4169 0.0487 0.1680 0.0283 470 THR A C 1231 O O . THR A 162 ? 0.3459 0.2310 0.3892 0.0558 0.1504 0.0381 470 THR A O 1232 C CB . THR A 162 ? 0.4869 0.3389 0.5139 0.0125 0.1716 -0.0029 470 THR A CB 1233 O OG1 . THR A 162 ? 0.4740 0.3401 0.4931 -0.0102 0.1661 -0.0226 470 THR A OG1 1234 C CG2 . THR A 162 ? 0.5480 0.3605 0.5736 0.0134 0.2032 -0.0016 470 THR A CG2 1235 N N . ASP A 163 ? 0.4054 0.2519 0.4483 0.0566 0.1848 0.0385 471 ASP A N 1236 C CA . ASP A 163 ? 0.4604 0.3210 0.5092 0.0774 0.1850 0.0636 471 ASP A CA 1237 C C . ASP A 163 ? 0.4300 0.3304 0.4861 0.0878 0.1637 0.0716 471 ASP A C 1238 O O . ASP A 163 ? 0.3956 0.3209 0.4557 0.1001 0.1564 0.0882 471 ASP A O 1239 C CB . ASP A 163 ? 0.4849 0.3406 0.5323 0.0825 0.1909 0.0744 471 ASP A CB 1240 C CG . ASP A 163 ? 0.5875 0.4053 0.6269 0.0716 0.2169 0.0675 471 ASP A CG 1241 O OD1 . ASP A 163 ? 0.6358 0.4315 0.6712 0.0665 0.2352 0.0640 471 ASP A OD1 1242 O OD2 . ASP A 163 ? 0.6406 0.4507 0.6771 0.0668 0.2208 0.0649 471 ASP A OD2 1243 N N . TYR A 164 ? 0.4085 0.3172 0.4651 0.0810 0.1558 0.0592 472 TYR A N 1244 C CA . TYR A 164 ? 0.3724 0.3175 0.4294 0.0803 0.1334 0.0618 472 TYR A CA 1245 C C . TYR A 164 ? 0.3477 0.3259 0.4144 0.0983 0.1336 0.0827 472 TYR A C 1246 O O . TYR A 164 ? 0.2806 0.2900 0.3469 0.0993 0.1196 0.0903 472 TYR A O 1247 C CB . TYR A 164 ? 0.3776 0.3226 0.4289 0.0666 0.1257 0.0461 472 TYR A CB 1248 C CG . TYR A 164 ? 0.3309 0.3057 0.3786 0.0624 0.1063 0.0465 472 TYR A CG 1249 C CD1 . TYR A 164 ? 0.3224 0.3024 0.3601 0.0523 0.0911 0.0401 472 TYR A CD1 1250 C CD2 . TYR A 164 ? 0.3417 0.3382 0.3943 0.0677 0.1060 0.0530 472 TYR A CD2 1251 C CE1 . TYR A 164 ? 0.3036 0.3027 0.3341 0.0461 0.0789 0.0388 472 TYR A CE1 1252 C CE2 . TYR A 164 ? 0.3197 0.3415 0.3663 0.0595 0.0913 0.0507 472 TYR A CE2 1253 C CZ . TYR A 164 ? 0.2932 0.3128 0.3275 0.0479 0.0791 0.0429 472 TYR A CZ 1254 O OH . TYR A 164 ? 0.3216 0.3591 0.3463 0.0375 0.0698 0.0391 472 TYR A OH 1255 N N . ASP A 165 ? 0.3009 0.2745 0.3716 0.1080 0.1467 0.0913 473 ASP A N 1256 C CA . ASP A 165 ? 0.3623 0.3732 0.4389 0.1232 0.1447 0.1124 473 ASP A CA 1257 C C . ASP A 165 ? 0.3439 0.3712 0.4203 0.1344 0.1445 0.1316 473 ASP A C 1258 O O . ASP A 165 ? 0.3497 0.4254 0.4296 0.1406 0.1334 0.1445 473 ASP A O 1259 C CB . ASP A 165 ? 0.4602 0.4549 0.5368 0.1314 0.1605 0.1199 473 ASP A CB 1260 C CG . ASP A 165 ? 0.5154 0.5043 0.5928 0.1213 0.1590 0.1032 473 ASP A CG 1261 O OD1 . ASP A 165 ? 0.4676 0.4815 0.5468 0.1121 0.1443 0.0926 473 ASP A OD1 1262 O OD2 . ASP A 165 ? 0.6064 0.5653 0.6809 0.1215 0.1747 0.1010 473 ASP A OD2 1263 N N . GLU A 166 ? 0.3304 0.3209 0.4012 0.1344 0.1577 0.1325 474 GLU A N 1264 C CA . GLU A 166 ? 0.3687 0.3711 0.4378 0.1443 0.1607 0.1502 474 GLU A CA 1265 C C . GLU A 166 ? 0.3021 0.3301 0.3727 0.1376 0.1415 0.1444 474 GLU A C 1266 O O . GLU A 166 ? 0.3185 0.3846 0.3901 0.1450 0.1345 0.1596 474 GLU A O 1267 C CB . GLU A 166 ? 0.4993 0.4545 0.5616 0.1426 0.1831 0.1494 474 GLU A CB 1268 C CG . GLU A 166 ? 0.6456 0.6099 0.7056 0.1524 0.1900 0.1665 474 GLU A CG 1269 C CD . GLU A 166 ? 0.7689 0.6867 0.8223 0.1483 0.2153 0.1628 474 GLU A CD 1270 O OE1 . GLU A 166 ? 0.7995 0.7185 0.8513 0.1508 0.2194 0.1681 474 GLU A OE1 1271 O OE2 . GLU A 166 ? 0.8315 0.7130 0.8809 0.1413 0.2325 0.1535 474 GLU A OE2 1272 N N . ARG A 167 ? 0.3607 0.2098 0.3502 0.1149 0.0026 -0.0020 475 ARG A N 1273 C CA . ARG A 167 ? 0.3387 0.1916 0.3101 0.1059 0.0081 0.0120 475 ARG A CA 1274 C C . ARG A 167 ? 0.3820 0.2541 0.3432 0.1077 0.0135 0.0169 475 ARG A C 1275 O O . ARG A 167 ? 0.3681 0.2407 0.3224 0.1027 0.0133 0.0308 475 ARG A O 1276 C CB . ARG A 167 ? 0.3629 0.2163 0.3235 0.1002 0.0109 0.0047 475 ARG A CB 1277 C CG . ARG A 167 ? 0.3673 0.2271 0.3194 0.0899 0.0155 0.0160 475 ARG A CG 1278 C CD . ARG A 167 ? 0.4189 0.2834 0.3642 0.0848 0.0148 0.0083 475 ARG A CD 1279 N NE . ARG A 167 ? 0.4194 0.2690 0.3721 0.0844 0.0069 -0.0009 475 ARG A NE 1280 C CZ . ARG A 167 ? 0.4419 0.2917 0.3860 0.0812 0.0016 -0.0100 475 ARG A CZ 1281 N NH1 . ARG A 167 ? 0.4326 0.2967 0.3614 0.0774 0.0036 -0.0089 475 ARG A NH1 1282 N NH2 . ARG A 167 ? 0.4306 0.2643 0.3810 0.0807 -0.0084 -0.0193 475 ARG A NH2 1283 N N . MET A 168 ? 0.3631 0.2530 0.3235 0.1132 0.0182 0.0052 476 MET A N 1284 C CA . MET A 168 ? 0.3316 0.2426 0.2892 0.1128 0.0217 0.0103 476 MET A CA 1285 C C . MET A 168 ? 0.3214 0.2306 0.2928 0.1180 0.0146 0.0198 476 MET A C 1286 O O . MET A 168 ? 0.3552 0.2711 0.3200 0.1134 0.0122 0.0304 476 MET A O 1287 C CB . MET A 168 ? 0.3298 0.2636 0.2887 0.1169 0.0296 -0.0023 476 MET A CB 1288 C CG . MET A 168 ? 0.3340 0.2714 0.2732 0.1094 0.0340 -0.0084 476 MET A CG 1289 S SD . MET A 168 ? 0.3574 0.2954 0.2823 0.0953 0.0314 0.0065 476 MET A SD 1290 C CE . MET A 168 ? 0.4162 0.3287 0.3386 0.0912 0.0259 0.0064 476 MET A CE 1291 N N . LYS A 169 ? 0.2909 0.1890 0.2823 0.1276 0.0085 0.0154 477 LYS A N 1292 C CA . LYS A 169 ? 0.3520 0.2472 0.3607 0.1298 -0.0029 0.0259 477 LYS A CA 1293 C C . LYS A 169 ? 0.3863 0.2661 0.3776 0.1184 -0.0099 0.0454 477 LYS A C 1294 O O . LYS A 169 ? 0.3832 0.2654 0.3704 0.1162 -0.0175 0.0574 477 LYS A O 1295 C CB . LYS A 169 ? 0.4207 0.3073 0.4614 0.1376 -0.0106 0.0168 477 LYS A CB 1296 C CG . LYS A 169 ? 0.4843 0.3925 0.5470 0.1501 -0.0027 -0.0033 477 LYS A CG 1297 C CD . LYS A 169 ? 0.5463 0.4443 0.6414 0.1582 -0.0079 -0.0106 477 LYS A CD 1298 C CE . LYS A 169 ? 0.5837 0.5062 0.6989 0.1706 0.0036 -0.0320 477 LYS A CE 1299 N NZ . LYS A 169 ? 0.6484 0.5582 0.7860 0.1803 -0.0018 -0.0408 477 LYS A NZ 1300 N N . LYS A 170 ? 0.3916 0.2572 0.3724 0.1106 -0.0071 0.0480 478 LYS A N 1301 C CA . LYS A 170 ? 0.4205 0.2757 0.3835 0.0995 -0.0090 0.0656 478 LYS A CA 1302 C C . LYS A 170 ? 0.3883 0.2547 0.3248 0.0946 -0.0014 0.0689 478 LYS A C 1303 O O . LYS A 170 ? 0.4188 0.2834 0.3384 0.0887 -0.0053 0.0810 478 LYS A O 1304 C CB . LYS A 170 ? 0.4591 0.2998 0.4243 0.0927 -0.0064 0.0682 478 LYS A CB 1305 C CG . LYS A 170 ? 0.5036 0.3361 0.4525 0.0809 -0.0058 0.0884 478 LYS A CG 1306 C CD . LYS A 170 ? 0.5381 0.3551 0.5001 0.0738 -0.0074 0.0953 478 LYS A CD 1307 C CE . LYS A 170 ? 0.5972 0.4112 0.5407 0.0602 -0.0032 0.1177 478 LYS A CE 1308 N NZ . LYS A 170 ? 0.6050 0.4052 0.5643 0.0507 -0.0049 0.1275 478 LYS A NZ 1309 N N . LEU A 171 ? 0.3679 0.2451 0.3003 0.0964 0.0074 0.0577 479 LEU A N 1310 C CA . LEU A 171 ? 0.3809 0.2690 0.2957 0.0907 0.0116 0.0575 479 LEU A CA 1311 C C . LEU A 171 ? 0.3611 0.2567 0.2728 0.0927 0.0030 0.0622 479 LEU A C 1312 O O . LEU A 171 ? 0.3618 0.2559 0.2538 0.0876 0.0004 0.0676 479 LEU A O 1313 C CB . LEU A 171 ? 0.3685 0.2679 0.2867 0.0900 0.0176 0.0458 479 LEU A CB 1314 C CG . LEU A 171 ? 0.3703 0.2633 0.2906 0.0863 0.0230 0.0408 479 LEU A CG 1315 C CD1 . LEU A 171 ? 0.3552 0.2585 0.2766 0.0851 0.0243 0.0318 479 LEU A CD1 1316 C CD2 . LEU A 171 ? 0.3929 0.2821 0.3042 0.0796 0.0279 0.0457 479 LEU A CD2 1317 N N . VAL A 172 ? 0.3641 0.2692 0.2968 0.1003 -0.0015 0.0587 480 VAL A N 1318 C CA . VAL A 172 ? 0.3937 0.3082 0.3328 0.1023 -0.0119 0.0638 480 VAL A CA 1319 C C . VAL A 172 ? 0.3648 0.2644 0.2945 0.0998 -0.0245 0.0772 480 VAL A C 1320 O O . VAL A 172 ? 0.4153 0.3159 0.3308 0.0948 -0.0338 0.0834 480 VAL A O 1321 C CB . VAL A 172 ? 0.4008 0.3323 0.3728 0.1120 -0.0123 0.0569 480 VAL A CB 1322 C CG1 . VAL A 172 ? 0.3805 0.3230 0.3670 0.1137 -0.0252 0.0641 480 VAL A CG1 1323 C CG2 . VAL A 172 ? 0.3825 0.3322 0.3576 0.1107 0.0009 0.0454 480 VAL A CG2 1324 N N . SER A 173 ? 0.3196 0.2061 0.2581 0.1000 -0.0266 0.0812 481 SER A N 1325 C CA A SER A 173 ? 0.3603 0.2337 0.2923 0.0934 -0.0396 0.0969 481 SER A CA 1326 C CA B SER A 173 ? 0.3617 0.2353 0.2936 0.0935 -0.0398 0.0969 481 SER A CA 1327 C C . SER A 173 ? 0.4164 0.2854 0.3088 0.0814 -0.0353 0.1047 481 SER A C 1328 O O . SER A 173 ? 0.4200 0.2869 0.2955 0.0749 -0.0462 0.1160 481 SER A O 1329 C CB A SER A 173 ? 0.3749 0.2337 0.3270 0.0946 -0.0428 0.1007 481 SER A CB 1330 C CB B SER A 173 ? 0.3736 0.2327 0.3269 0.0949 -0.0442 0.1013 481 SER A CB 1331 O OG A SER A 173 ? 0.3889 0.2373 0.3378 0.0871 -0.0554 0.1211 481 SER A OG 1332 O OG B SER A 173 ? 0.3717 0.2363 0.3639 0.1076 -0.0494 0.0919 481 SER A OG 1333 N N . ILE A 174 ? 0.4219 0.2911 0.3008 0.0790 -0.0190 0.0978 482 ILE A N 1334 C CA . ILE A 174 ? 0.4736 0.3419 0.3182 0.0702 -0.0103 0.1011 482 ILE A CA 1335 C C . ILE A 174 ? 0.4808 0.3564 0.3059 0.0700 -0.0147 0.0948 482 ILE A C 1336 O O . ILE A 174 ? 0.5058 0.3794 0.3019 0.0630 -0.0185 0.0999 482 ILE A O 1337 C CB . ILE A 174 ? 0.4812 0.3500 0.3249 0.0701 0.0079 0.0939 482 ILE A CB 1338 C CG1 . ILE A 174 ? 0.5132 0.3721 0.3718 0.0666 0.0106 0.1029 482 ILE A CG1 1339 C CG2 . ILE A 174 ? 0.4779 0.3514 0.2909 0.0645 0.0193 0.0907 482 ILE A CG2 1340 C CD1 . ILE A 174 ? 0.4988 0.3595 0.3723 0.0672 0.0232 0.0939 482 ILE A CD1 1341 N N . VAL A 175 ? 0.4727 0.3568 0.3133 0.0767 -0.0152 0.0839 483 VAL A N 1342 C CA . VAL A 175 ? 0.4811 0.3700 0.3092 0.0763 -0.0227 0.0782 483 VAL A CA 1343 C C . VAL A 175 ? 0.4947 0.3831 0.3206 0.0737 -0.0419 0.0868 483 VAL A C 1344 O O . VAL A 175 ? 0.5176 0.4025 0.3160 0.0688 -0.0494 0.0858 483 VAL A O 1345 C CB . VAL A 175 ? 0.4468 0.3489 0.3009 0.0797 -0.0208 0.0679 483 VAL A CB 1346 C CG1 . VAL A 175 ? 0.4128 0.3198 0.2642 0.0772 -0.0336 0.0646 483 VAL A CG1 1347 C CG2 . VAL A 175 ? 0.4209 0.3243 0.2763 0.0780 -0.0058 0.0583 483 VAL A CG2 1348 N N . ALA A 176 ? 0.4764 0.3677 0.3321 0.0779 -0.0508 0.0942 484 ALA A N 1349 C CA . ALA A 176 ? 0.5075 0.3999 0.3699 0.0764 -0.0707 0.1045 484 ALA A CA 1350 C C . ALA A 176 ? 0.5299 0.4126 0.3577 0.0669 -0.0760 0.1157 484 ALA A C 1351 O O . ALA A 176 ? 0.5258 0.4092 0.3388 0.0633 -0.0901 0.1193 484 ALA A O 1352 C CB . ALA A 176 ? 0.5141 0.4110 0.4192 0.0851 -0.0769 0.1099 484 ALA A CB 1353 N N . ASP A 177 ? 0.5450 0.4199 0.3598 0.0625 -0.0645 0.1212 485 ASP A N 1354 C CA . ASP A 177 ? 0.6122 0.4824 0.3950 0.0525 -0.0662 0.1350 485 ASP A CA 1355 C C . ASP A 177 ? 0.6294 0.5011 0.3673 0.0459 -0.0587 0.1251 485 ASP A C 1356 O O . ASP A 177 ? 0.6739 0.5460 0.3814 0.0395 -0.0668 0.1311 485 ASP A O 1357 C CB . ASP A 177 ? 0.6692 0.5331 0.4574 0.0485 -0.0555 0.1454 485 ASP A CB 1358 C CG . ASP A 177 ? 0.7880 0.6516 0.5447 0.0380 -0.0543 0.1631 485 ASP A CG 1359 O OD1 . ASP A 177 ? 0.8569 0.7186 0.6006 0.0387 -0.0682 0.1726 485 ASP A OD1 1360 O OD2 . ASP A 177 ? 0.7969 0.6610 0.5402 0.0296 -0.0388 0.1667 485 ASP A OD2 1361 N N . GLN A 178 ? 0.5825 0.4552 0.3168 0.0496 -0.0427 0.1085 486 GLN A N 1362 C CA . GLN A 178 ? 0.5910 0.4649 0.2878 0.0468 -0.0337 0.0947 486 GLN A CA 1363 C C . GLN A 178 ? 0.6271 0.4993 0.3136 0.0484 -0.0519 0.0857 486 GLN A C 1364 O O . GLN A 178 ? 0.7197 0.5905 0.3691 0.0434 -0.0540 0.0788 486 GLN A O 1365 C CB . GLN A 178 ? 0.5308 0.4069 0.2342 0.0527 -0.0130 0.0799 486 GLN A CB 1366 C CG . GLN A 178 ? 0.5152 0.3935 0.2267 0.0495 0.0051 0.0879 486 GLN A CG 1367 C CD . GLN A 178 ? 0.4990 0.3810 0.2232 0.0559 0.0236 0.0746 486 GLN A CD 1368 O OE1 . GLN A 178 ? 0.4723 0.3567 0.2239 0.0623 0.0193 0.0646 486 GLN A OE1 1369 N NE2 . GLN A 178 ? 0.5340 0.4228 0.2493 0.0512 0.0436 0.0737 486 GLN A NE2 1370 N N . LEU A 179 ? 0.6015 0.4755 0.3224 0.0547 -0.0649 0.0852 487 LEU A N 1371 C CA . LEU A 179 ? 0.6302 0.5036 0.3504 0.0547 -0.0854 0.0796 487 LEU A CA 1372 C C . LEU A 179 ? 0.7141 0.5860 0.4196 0.0483 -0.1031 0.0916 487 LEU A C 1373 O O . LEU A 179 ? 0.7450 0.6125 0.4272 0.0448 -0.1171 0.0846 487 LEU A O 1374 C CB . LEU A 179 ? 0.5684 0.4507 0.3362 0.0610 -0.0933 0.0799 487 LEU A CB 1375 C CG . LEU A 179 ? 0.5445 0.4295 0.3255 0.0664 -0.0821 0.0681 487 LEU A CG 1376 C CD1 . LEU A 179 ? 0.4984 0.3979 0.3257 0.0696 -0.0903 0.0713 487 LEU A CD1 1377 C CD2 . LEU A 179 ? 0.5469 0.4239 0.3003 0.0639 -0.0833 0.0514 487 LEU A CD2 1378 N N . GLU A 180 ? 0.7780 0.6522 0.4979 0.0476 -0.1041 0.1091 488 GLU A N 1379 C CA . GLU A 180 ? 0.8997 0.7712 0.6067 0.0431 -0.1211 0.1231 488 GLU A CA 1380 C C . GLU A 180 ? 0.9702 0.8384 0.6214 0.0339 -0.1153 0.1239 488 GLU A C 1381 O O . GLU A 180 ? 1.0190 0.8836 0.6429 0.0294 -0.1310 0.1251 488 GLU A O 1382 C CB . GLU A 180 ? 0.9466 0.8178 0.6845 0.0469 -0.1232 0.1408 488 GLU A CB 1383 C CG . GLU A 180 ? 0.9713 0.8483 0.7630 0.0566 -0.1339 0.1406 488 GLU A CG 1384 C CD . GLU A 180 ? 1.0243 0.8958 0.8423 0.0613 -0.1392 0.1544 488 GLU A CD 1385 O OE1 . GLU A 180 ? 1.0577 0.9187 0.8504 0.0556 -0.1380 0.1671 488 GLU A OE1 1386 O OE2 . GLU A 180 ? 1.0245 0.9020 0.8887 0.0707 -0.1445 0.1519 488 GLU A OE2 1387 N N . LYS A 181 ? 0.9719 0.8431 0.6073 0.0308 -0.0921 0.1229 489 LYS A N 1388 C CA . LYS A 181 ? 1.0361 0.9116 0.6227 0.0221 -0.0811 0.1247 489 LYS A CA 1389 C C . LYS A 181 ? 1.0669 0.9439 0.6201 0.0212 -0.0719 0.0991 489 LYS A C 1390 O O . LYS A 181 ? 1.1046 0.9908 0.6206 0.0153 -0.0558 0.0941 489 LYS A O 1391 C CB . LYS A 181 ? 1.0344 0.9159 0.6254 0.0182 -0.0600 0.1374 489 LYS A CB 1392 C CG . LYS A 181 ? 1.0328 0.9081 0.6517 0.0200 -0.0700 0.1621 489 LYS A CG 1393 C CD . LYS A 181 ? 1.0429 0.9212 0.6682 0.0160 -0.0508 0.1749 489 LYS A CD 1394 C CE . LYS A 181 ? 1.0705 0.9331 0.7144 0.0189 -0.0624 0.1977 489 LYS A CE 1395 N NZ . LYS A 181 ? 1.0791 0.9374 0.7334 0.0160 -0.0456 0.2095 489 LYS A NZ 1396 N N . ASN A 182 ? 1.0584 0.9280 0.6284 0.0281 -0.0820 0.0825 490 ASN A N 1397 C CA . ASN A 182 ? 1.0911 0.9571 0.6360 0.0301 -0.0788 0.0559 490 ASN A CA 1398 C C . ASN A 182 ? 1.0785 0.9516 0.6125 0.0319 -0.0487 0.0405 490 ASN A C 1399 O O . ASN A 182 ? 1.1217 1.0012 0.6207 0.0289 -0.0378 0.0245 490 ASN A O 1400 C CB . ASN A 182 ? 1.1730 1.0376 0.6756 0.0238 -0.0937 0.0513 490 ASN A CB 1401 C CG . ASN A 182 ? 1.2158 1.0725 0.7015 0.0273 -0.0984 0.0215 490 ASN A CG 1402 O OD1 . ASN A 182 ? 1.1993 1.0450 0.7102 0.0320 -0.1177 0.0144 490 ASN A OD1 1403 N ND2 . ASN A 182 ? 1.2600 1.1246 0.7071 0.0248 -0.0811 0.0034 490 ASN A ND2 1404 N N . ARG A 183 ? 1.0096 0.8840 0.5768 0.0373 -0.0349 0.0442 491 ARG A N 1405 C CA . ARG A 183 ? 0.9835 0.8655 0.5519 0.0407 -0.0074 0.0295 491 ARG A CA 1406 C C . ARG A 183 ? 0.8683 0.7439 0.4704 0.0526 -0.0065 0.0177 491 ARG A C 1407 O O . ARG A 183 ? 0.8163 0.6858 0.4452 0.0562 -0.0214 0.0281 491 ARG A O 1408 C CB . ARG A 183 ? 1.0332 0.9266 0.6069 0.0337 0.0116 0.0476 491 ARG A CB 1409 C CG . ARG A 183 ? 1.1465 1.0505 0.6852 0.0206 0.0116 0.0623 491 ARG A CG 1410 C CD . ARG A 183 ? 1.2026 1.1237 0.7406 0.0127 0.0372 0.0714 491 ARG A CD 1411 N NE . ARG A 183 ? 1.2409 1.1758 0.7760 0.0163 0.0622 0.0458 491 ARG A NE 1412 C CZ . ARG A 183 ? 1.2690 1.2245 0.8063 0.0098 0.0877 0.0477 491 ARG A CZ 1413 N NH1 . ARG A 183 ? 1.2798 1.2421 0.8183 -0.0019 0.0906 0.0760 491 ARG A NH1 1414 N NH2 . ARG A 183 ? 1.2767 1.2474 0.8201 0.0152 0.1091 0.0215 491 ARG A NH2 1415 N N . LEU A 184 ? 0.8163 0.6962 0.4201 0.0584 0.0106 -0.0041 492 LEU A N 1416 C CA . LEU A 184 ? 0.7448 0.6237 0.3902 0.0668 0.0108 -0.0149 492 LEU A CA 1417 C C . LEU A 184 ? 0.6819 0.5672 0.3646 0.0661 0.0184 0.0034 492 LEU A C 1418 O O . LEU A 184 ? 0.7001 0.5932 0.3825 0.0638 0.0379 0.0099 492 LEU A O 1419 C CB . LEU A 184 ? 0.7519 0.6372 0.4017 0.0725 0.0281 -0.0413 492 LEU A CB 1420 C CG . LEU A 184 ? 0.7328 0.6174 0.4338 0.0785 0.0233 -0.0527 492 LEU A CG 1421 C CD1 . LEU A 184 ? 0.7468 0.6175 0.4537 0.0796 -0.0036 -0.0615 492 LEU A CD1 1422 C CD2 . LEU A 184 ? 0.7684 0.6621 0.4831 0.0850 0.0433 -0.0749 492 LEU A CD2 1423 N N . PRO A 185 ? 0.5993 0.4823 0.3143 0.0675 0.0032 0.0114 493 PRO A N 1424 C CA . PRO A 185 ? 0.5587 0.4465 0.3055 0.0679 0.0083 0.0255 493 PRO A CA 1425 C C . PRO A 185 ? 0.5375 0.4323 0.3067 0.0695 0.0264 0.0185 493 PRO A C 1426 O O . PRO A 185 ? 0.5482 0.4447 0.3276 0.0723 0.0292 0.0019 493 PRO A O 1427 C CB . PRO A 185 ? 0.5230 0.4118 0.2982 0.0696 -0.0085 0.0273 493 PRO A CB 1428 C CG . PRO A 185 ? 0.5485 0.4308 0.3030 0.0681 -0.0270 0.0244 493 PRO A CG 1429 C CD . PRO A 185 ? 0.5856 0.4629 0.3080 0.0681 -0.0198 0.0075 493 PRO A CD 1430 N N . SER A 186 ? 0.4912 0.3883 0.2713 0.0676 0.0358 0.0309 494 SER A N 1431 C CA . SER A 186 ? 0.4485 0.3521 0.2528 0.0679 0.0504 0.0265 494 SER A CA 1432 C C . SER A 186 ? 0.4443 0.3483 0.2815 0.0710 0.0431 0.0214 494 SER A C 1433 O O . SER A 186 ? 0.4458 0.3537 0.3052 0.0715 0.0501 0.0157 494 SER A O 1434 C CB . SER A 186 ? 0.4580 0.3613 0.2652 0.0635 0.0591 0.0424 494 SER A CB 1435 O OG . SER A 186 ? 0.5019 0.4074 0.2781 0.0578 0.0690 0.0493 494 SER A OG 1436 N N . VAL A 187 ? 0.3861 0.2877 0.2273 0.0720 0.0287 0.0250 495 VAL A N 1437 C CA . VAL A 187 ? 0.3992 0.3034 0.2649 0.0725 0.0219 0.0226 495 VAL A CA 1438 C C . VAL A 187 ? 0.3903 0.2927 0.2591 0.0725 0.0131 0.0119 495 VAL A C 1439 O O . VAL A 187 ? 0.3756 0.2750 0.2302 0.0723 0.0040 0.0098 495 VAL A O 1440 C CB . VAL A 187 ? 0.3800 0.2875 0.2522 0.0729 0.0138 0.0319 495 VAL A CB 1441 C CG1 . VAL A 187 ? 0.2934 0.2070 0.1840 0.0709 0.0080 0.0309 495 VAL A CG1 1442 C CG2 . VAL A 187 ? 0.3636 0.2694 0.2388 0.0746 0.0199 0.0393 495 VAL A CG2 1443 N N . HIS A 188 ? 0.3598 0.2620 0.2492 0.0724 0.0129 0.0054 496 HIS A N 1444 C CA . HIS A 188 ? 0.3575 0.2545 0.2574 0.0725 0.0013 -0.0044 496 HIS A CA 1445 C C . HIS A 188 ? 0.3374 0.2352 0.2441 0.0674 -0.0143 0.0052 496 HIS A C 1446 O O . HIS A 188 ? 0.3387 0.2439 0.2517 0.0642 -0.0135 0.0168 496 HIS A O 1447 C CB . HIS A 188 ? 0.3191 0.2149 0.2456 0.0734 0.0019 -0.0104 496 HIS A CB 1448 C CG . HIS A 188 ? 0.3171 0.2046 0.2588 0.0758 -0.0094 -0.0241 496 HIS A CG 1449 N ND1 . HIS A 188 ? 0.3195 0.1996 0.2744 0.0710 -0.0292 -0.0194 496 HIS A ND1 1450 C CD2 . HIS A 188 ? 0.3185 0.2039 0.2676 0.0828 -0.0039 -0.0433 496 HIS A CD2 1451 C CE1 . HIS A 188 ? 0.3451 0.2149 0.3160 0.0752 -0.0385 -0.0349 496 HIS A CE1 1452 N NE2 . HIS A 188 ? 0.3239 0.1974 0.2918 0.0836 -0.0227 -0.0517 496 HIS A NE2 1453 N N . PRO A 189 ? 0.3262 0.2176 0.2326 0.0661 -0.0281 -0.0003 497 PRO A N 1454 C CA . PRO A 189 ? 0.3342 0.2291 0.2522 0.0592 -0.0432 0.0110 497 PRO A CA 1455 C C . PRO A 189 ? 0.3253 0.2246 0.2651 0.0525 -0.0473 0.0215 497 PRO A C 1456 O O . PRO A 189 ? 0.3266 0.2382 0.2718 0.0462 -0.0492 0.0355 497 PRO A O 1457 C CB . PRO A 189 ? 0.3698 0.2520 0.2885 0.0588 -0.0598 -0.0002 497 PRO A CB 1458 C CG . PRO A 189 ? 0.4076 0.2800 0.3190 0.0668 -0.0523 -0.0204 497 PRO A CG 1459 C CD . PRO A 189 ? 0.3544 0.2359 0.2497 0.0709 -0.0305 -0.0184 497 PRO A CD 1460 N N . HIS A 190 ? 0.2902 0.1812 0.2424 0.0537 -0.0485 0.0153 498 HIS A N 1461 C CA . HIS A 190 ? 0.3221 0.2151 0.2900 0.0461 -0.0550 0.0275 498 HIS A CA 1462 C C . HIS A 190 ? 0.3719 0.2780 0.3287 0.0450 -0.0414 0.0364 498 HIS A C 1463 O O . HIS A 190 ? 0.4274 0.3422 0.3852 0.0368 -0.0444 0.0495 498 HIS A O 1464 C CB . HIS A 190 ? 0.3707 0.2508 0.3584 0.0487 -0.0619 0.0188 498 HIS A CB 1465 C CG . HIS A 190 ? 0.4080 0.2854 0.4118 0.0387 -0.0763 0.0336 498 HIS A CG 1466 N ND1 . HIS A 190 ? 0.4341 0.3121 0.4418 0.0379 -0.0742 0.0374 498 HIS A ND1 1467 C CD2 . HIS A 190 ? 0.4373 0.3109 0.4528 0.0274 -0.0949 0.0480 498 HIS A CD2 1468 C CE1 . HIS A 190 ? 0.4633 0.3373 0.4802 0.0266 -0.0912 0.0533 498 HIS A CE1 1469 N NE2 . HIS A 190 ? 0.4618 0.3348 0.4839 0.0192 -0.1024 0.0606 498 HIS A NE2 1470 N N . HIS A 191 ? 0.3473 0.2545 0.2927 0.0528 -0.0266 0.0290 499 HIS A N 1471 C CA . HIS A 191 ? 0.3439 0.2591 0.2812 0.0531 -0.0161 0.0340 499 HIS A CA 1472 C C . HIS A 191 ? 0.3342 0.2618 0.2622 0.0537 -0.0110 0.0399 499 HIS A C 1473 O O . HIS A 191 ? 0.3307 0.2663 0.2545 0.0543 -0.0040 0.0425 499 HIS A O 1474 C CB . HIS A 191 ? 0.3423 0.2527 0.2770 0.0597 -0.0045 0.0261 499 HIS A CB 1475 C CG . HIS A 191 ? 0.3675 0.2706 0.3188 0.0607 -0.0069 0.0188 499 HIS A CG 1476 N ND1 . HIS A 191 ? 0.3466 0.2491 0.3019 0.0657 0.0046 0.0110 499 HIS A ND1 1477 C CD2 . HIS A 191 ? 0.3638 0.2612 0.3334 0.0573 -0.0200 0.0189 499 HIS A CD2 1478 C CE1 . HIS A 191 ? 0.3581 0.2574 0.3365 0.0667 0.0003 0.0044 499 HIS A CE1 1479 N NE2 . HIS A 191 ? 0.3493 0.2435 0.3372 0.0622 -0.0163 0.0089 499 HIS A NE2 1480 N N . SER A 192 ? 0.3444 0.2735 0.2715 0.0544 -0.0158 0.0402 500 SER A N 1481 C CA . SER A 192 ? 0.3104 0.2516 0.2357 0.0566 -0.0127 0.0451 500 SER A CA 1482 C C . SER A 192 ? 0.3091 0.2695 0.2439 0.0512 -0.0110 0.0539 500 SER A C 1483 O O . SER A 192 ? 0.2898 0.2640 0.2283 0.0553 -0.0042 0.0553 500 SER A O 1484 C CB . SER A 192 ? 0.3104 0.2482 0.2338 0.0571 -0.0225 0.0443 500 SER A CB 1485 O OG . SER A 192 ? 0.3475 0.2874 0.2842 0.0492 -0.0358 0.0486 500 SER A OG 1486 N N . MET A 193 ? 0.3137 0.2757 0.2535 0.0419 -0.0169 0.0601 501 MET A N 1487 C CA . MET A 193 ? 0.3289 0.3114 0.2718 0.0339 -0.0129 0.0701 501 MET A CA 1488 C C . MET A 193 ? 0.2927 0.2820 0.2227 0.0385 0.0007 0.0648 501 MET A C 1489 O O . MET A 193 ? 0.3041 0.3150 0.2329 0.0354 0.0094 0.0685 501 MET A O 1490 C CB . MET A 193 ? 0.3131 0.2918 0.2608 0.0206 -0.0255 0.0813 501 MET A CB 1491 C CG . MET A 193 ? 0.2854 0.2430 0.2279 0.0212 -0.0317 0.0764 501 MET A CG 1492 S SD . MET A 193 ? 0.5188 0.4683 0.4719 0.0054 -0.0520 0.0923 501 MET A SD 1493 C CE . MET A 193 ? 0.4613 0.3922 0.4101 0.0093 -0.0559 0.0849 501 MET A CE 1494 N N . LEU A 194 ? 0.2603 0.2322 0.1819 0.0454 0.0028 0.0553 502 LEU A N 1495 C CA . LEU A 194 ? 0.2608 0.2333 0.1709 0.0488 0.0110 0.0487 502 LEU A CA 1496 C C . LEU A 194 ? 0.3102 0.2875 0.2223 0.0603 0.0213 0.0398 502 LEU A C 1497 O O . LEU A 194 ? 0.3139 0.2931 0.2186 0.0642 0.0277 0.0317 502 LEU A O 1498 C CB . LEU A 194 ? 0.2636 0.2154 0.1708 0.0493 0.0058 0.0439 502 LEU A CB 1499 C CG . LEU A 194 ? 0.2966 0.2398 0.2085 0.0401 -0.0073 0.0509 502 LEU A CG 1500 C CD1 . LEU A 194 ? 0.3271 0.2533 0.2457 0.0432 -0.0112 0.0443 502 LEU A CD1 1501 C CD2 . LEU A 194 ? 0.3249 0.2783 0.2255 0.0289 -0.0117 0.0609 502 LEU A CD2 1502 N N . TYR A 195 ? 0.3141 0.2912 0.2365 0.0657 0.0201 0.0408 503 TYR A N 1503 C CA . TYR A 195 ? 0.3245 0.3000 0.2530 0.0767 0.0247 0.0348 503 TYR A CA 1504 C C . TYR A 195 ? 0.3405 0.3371 0.2859 0.0799 0.0261 0.0377 503 TYR A C 1505 O O . TYR A 195 ? 0.3285 0.3347 0.2806 0.0731 0.0205 0.0461 503 TYR A O 1506 C CB . TYR A 195 ? 0.2949 0.2500 0.2201 0.0795 0.0198 0.0360 503 TYR A CB 1507 C CG . TYR A 195 ? 0.3316 0.2709 0.2483 0.0758 0.0194 0.0339 503 TYR A CG 1508 C CD1 . TYR A 195 ? 0.3612 0.2967 0.2754 0.0748 0.0218 0.0286 503 TYR A CD1 1509 C CD2 . TYR A 195 ? 0.3740 0.3036 0.2867 0.0735 0.0164 0.0356 503 TYR A CD2 1510 C CE1 . TYR A 195 ? 0.3685 0.2917 0.2825 0.0713 0.0197 0.0274 503 TYR A CE1 1511 C CE2 . TYR A 195 ? 0.3452 0.2650 0.2578 0.0711 0.0178 0.0324 503 TYR A CE2 1512 C CZ . TYR A 195 ? 0.3483 0.2652 0.2646 0.0698 0.0187 0.0295 503 TYR A CZ 1513 O OH . TYR A 195 ? 0.3234 0.2327 0.2470 0.0674 0.0184 0.0271 503 TYR A OH 1514 N N . PRO A 196 ? 0.3656 0.3689 0.3230 0.0905 0.0318 0.0303 504 PRO A N 1515 C CA . PRO A 196 ? 0.3425 0.3711 0.3247 0.0950 0.0342 0.0313 504 PRO A CA 1516 C C . PRO A 196 ? 0.3473 0.3703 0.3426 0.0968 0.0211 0.0400 504 PRO A C 1517 O O . PRO A 196 ? 0.3396 0.3688 0.3577 0.1065 0.0183 0.0384 504 PRO A O 1518 C CB . PRO A 196 ? 0.3615 0.3942 0.3548 0.1083 0.0428 0.0167 504 PRO A CB 1519 C CG . PRO A 196 ? 0.3542 0.3546 0.3330 0.1113 0.0373 0.0130 504 PRO A CG 1520 C CD . PRO A 196 ? 0.3774 0.3659 0.3317 0.0991 0.0350 0.0193 504 PRO A CD 1521 N N . LEU A 197 ? 0.3668 0.3769 0.3479 0.0879 0.0115 0.0480 505 LEU A N 1522 C CA . LEU A 197 ? 0.3747 0.3781 0.3595 0.0873 -0.0030 0.0553 505 LEU A CA 1523 C C . LEU A 197 ? 0.3955 0.4248 0.4070 0.0832 -0.0077 0.0616 505 LEU A C 1524 O O . LEU A 197 ? 0.4201 0.4688 0.4389 0.0760 -0.0002 0.0636 505 LEU A O 1525 C CB . LEU A 197 ? 0.3471 0.3295 0.3065 0.0799 -0.0101 0.0569 505 LEU A CB 1526 C CG . LEU A 197 ? 0.3983 0.3585 0.3352 0.0820 -0.0051 0.0525 505 LEU A CG 1527 C CD1 . LEU A 197 ? 0.4215 0.3698 0.3415 0.0753 -0.0072 0.0501 505 LEU A CD1 1528 C CD2 . LEU A 197 ? 0.4019 0.3490 0.3325 0.0874 -0.0109 0.0565 505 LEU A CD2 1529 N N . SER A 198 ? 0.4149 0.4451 0.4419 0.0864 -0.0214 0.0667 506 SER A N 1530 C CA . SER A 198 ? 0.3964 0.4517 0.4549 0.0816 -0.0287 0.0740 506 SER A CA 1531 C C . SER A 198 ? 0.3998 0.4480 0.4467 0.0680 -0.0392 0.0795 506 SER A C 1532 O O . SER A 198 ? 0.3742 0.3957 0.3898 0.0655 -0.0443 0.0761 506 SER A O 1533 C CB . SER A 198 ? 0.3975 0.4521 0.4767 0.0882 -0.0459 0.0786 506 SER A CB 1534 O OG . SER A 198 ? 0.3889 0.4132 0.4366 0.0852 -0.0631 0.0816 506 SER A OG 1535 N N . HIS A 199 ? 0.4099 0.4831 0.4859 0.0592 -0.0424 0.0877 507 HIS A N 1536 C CA . HIS A 199 ? 0.4170 0.4815 0.4893 0.0456 -0.0565 0.0937 507 HIS A CA 1537 C C . HIS A 199 ? 0.3685 0.4058 0.4251 0.0465 -0.0794 0.0909 507 HIS A C 1538 O O . HIS A 199 ? 0.3360 0.3511 0.3721 0.0406 -0.0898 0.0872 507 HIS A O 1539 C CB . HIS A 199 ? 0.4701 0.5683 0.5829 0.0344 -0.0576 0.1063 507 HIS A CB 1540 C CG . HIS A 199 ? 0.5371 0.6657 0.6590 0.0319 -0.0329 0.1091 507 HIS A CG 1541 N ND1 . HIS A 199 ? 0.5739 0.6932 0.6673 0.0269 -0.0222 0.1079 507 HIS A ND1 1542 C CD2 . HIS A 199 ? 0.5627 0.7319 0.7173 0.0338 -0.0168 0.1119 507 HIS A CD2 1543 C CE1 . HIS A 199 ? 0.5907 0.7418 0.6924 0.0248 -0.0013 0.1104 507 HIS A CE1 1544 N NE2 . HIS A 199 ? 0.5934 0.7768 0.7323 0.0293 0.0044 0.1117 507 HIS A NE2 1545 N N . GLY A 200 ? 0.3777 0.4164 0.4432 0.0545 -0.0881 0.0919 508 GLY A N 1546 C CA . GLY A 200 ? 0.3923 0.4054 0.4351 0.0551 -0.1102 0.0900 508 GLY A CA 1547 C C . GLY A 200 ? 0.3813 0.3644 0.3748 0.0586 -0.1042 0.0804 508 GLY A C 1548 O O . GLY A 200 ? 0.3903 0.3519 0.3562 0.0547 -0.1166 0.0743 508 GLY A O 1549 N N . PHE A 201 ? 0.3463 0.3290 0.3308 0.0660 -0.0849 0.0779 509 PHE A N 1550 C CA . PHE A 201 ? 0.3856 0.3448 0.3303 0.0685 -0.0766 0.0708 509 PHE A CA 1551 C C . PHE A 201 ? 0.3993 0.3511 0.3320 0.0628 -0.0705 0.0627 509 PHE A C 1552 O O . PHE A 201 ? 0.4295 0.3623 0.3329 0.0624 -0.0720 0.0545 509 PHE A O 1553 C CB . PHE A 201 ? 0.3712 0.3315 0.3165 0.0765 -0.0600 0.0709 509 PHE A CB 1554 C CG . PHE A 201 ? 0.4002 0.3546 0.3465 0.0829 -0.0690 0.0779 509 PHE A CG 1555 C CD1 . PHE A 201 ? 0.3868 0.3396 0.3366 0.0813 -0.0908 0.0849 509 PHE A CD1 1556 C CD2 . PHE A 201 ? 0.4411 0.3887 0.3860 0.0896 -0.0590 0.0786 509 PHE A CD2 1557 C CE1 . PHE A 201 ? 0.4470 0.3924 0.3991 0.0862 -0.1025 0.0938 509 PHE A CE1 1558 C CE2 . PHE A 201 ? 0.4290 0.3678 0.3779 0.0946 -0.0706 0.0874 509 PHE A CE2 1559 C CZ . PHE A 201 ? 0.4696 0.4082 0.4226 0.0924 -0.0919 0.0956 509 PHE A CZ 1560 N N . ARG A 202 ? 0.3693 0.3371 0.3255 0.0585 -0.0637 0.0653 510 ARG A N 1561 C CA . ARG A 202 ? 0.3725 0.3322 0.3232 0.0526 -0.0617 0.0605 510 ARG A CA 1562 C C . ARG A 202 ? 0.3538 0.2993 0.3010 0.0469 -0.0813 0.0560 510 ARG A C 1563 O O . ARG A 202 ? 0.3492 0.2767 0.2805 0.0473 -0.0825 0.0451 510 ARG A O 1564 C CB . ARG A 202 ? 0.3914 0.3714 0.3650 0.0463 -0.0536 0.0684 510 ARG A CB 1565 C CG . ARG A 202 ? 0.4053 0.3957 0.3765 0.0522 -0.0342 0.0676 510 ARG A CG 1566 C CD . ARG A 202 ? 0.4216 0.4235 0.3985 0.0441 -0.0268 0.0724 510 ARG A CD 1567 N NE . ARG A 202 ? 0.4125 0.4287 0.3878 0.0490 -0.0097 0.0703 510 ARG A NE 1568 C CZ . ARG A 202 ? 0.3954 0.4398 0.3884 0.0493 -0.0007 0.0739 510 ARG A CZ 1569 N NH1 . ARG A 202 ? 0.3564 0.4198 0.3744 0.0439 -0.0072 0.0828 510 ARG A NH1 1570 N NH2 . ARG A 202 ? 0.4248 0.4796 0.4127 0.0553 0.0149 0.0672 510 ARG A NH2 1571 N N . LYS A 203 ? 0.3617 0.3154 0.3274 0.0423 -0.0977 0.0628 511 LYS A N 1572 C CA . LYS A 203 ? 0.3861 0.3236 0.3492 0.0369 -0.1205 0.0569 511 LYS A CA 1573 C C . LYS A 203 ? 0.3935 0.3081 0.3157 0.0436 -0.1253 0.0429 511 LYS A C 1574 O O . LYS A 203 ? 0.3792 0.2742 0.2842 0.0433 -0.1335 0.0283 511 LYS A O 1575 C CB . LYS A 203 ? 0.3986 0.3517 0.3948 0.0294 -0.1388 0.0686 511 LYS A CB 1576 C CG . LYS A 203 ? 0.4385 0.3733 0.4373 0.0220 -0.1665 0.0626 511 LYS A CG 1577 C CD . LYS A 203 ? 0.4561 0.4106 0.5005 0.0108 -0.1839 0.0781 511 LYS A CD 1578 C CE . LYS A 203 ? 0.4930 0.4567 0.5439 0.0140 -0.1947 0.0823 511 LYS A CE 1579 N NZ . LYS A 203 ? 0.4943 0.4740 0.5907 0.0013 -0.2109 0.0925 511 LYS A NZ 1580 N N . ALA A 204 ? 0.4000 0.3176 0.3069 0.0495 -0.1202 0.0474 512 ALA A N 1581 C CA . ALA A 204 ? 0.4076 0.3066 0.2705 0.0535 -0.1232 0.0388 512 ALA A CA 1582 C C . ALA A 204 ? 0.4062 0.2943 0.2420 0.0575 -0.1040 0.0256 512 ALA A C 1583 O O . ALA A 204 ? 0.4434 0.3163 0.2453 0.0586 -0.1069 0.0115 512 ALA A O 1584 C CB . ALA A 204 ? 0.4120 0.3162 0.2691 0.0574 -0.1228 0.0512 512 ALA A CB 1585 N N . ILE A 205 ? 0.3828 0.2801 0.2337 0.0597 -0.0845 0.0290 513 ILE A N 1586 C CA . ILE A 205 ? 0.3921 0.2824 0.2288 0.0629 -0.0675 0.0175 513 ILE A CA 1587 C C . ILE A 205 ? 0.4059 0.2852 0.2468 0.0617 -0.0760 0.0015 513 ILE A C 1588 O O . ILE A 205 ? 0.4028 0.2718 0.2211 0.0656 -0.0708 -0.0151 513 ILE A O 1589 C CB . ILE A 205 ? 0.3593 0.2604 0.2170 0.0642 -0.0506 0.0243 513 ILE A CB 1590 C CG1 . ILE A 205 ? 0.3645 0.2713 0.2170 0.0675 -0.0414 0.0351 513 ILE A CG1 1591 C CG2 . ILE A 205 ? 0.3610 0.2561 0.2156 0.0664 -0.0380 0.0125 513 ILE A CG2 1592 C CD1 . ILE A 205 ? 0.3519 0.2688 0.2255 0.0689 -0.0287 0.0402 513 ILE A CD1 1593 N N . ALA A 206 ? 0.3869 0.2695 0.2592 0.0561 -0.0891 0.0068 514 ALA A N 1594 C CA . ALA A 206 ? 0.3845 0.2534 0.2687 0.0541 -0.1026 -0.0061 514 ALA A CA 1595 C C . ALA A 206 ? 0.4389 0.2911 0.2994 0.0557 -0.1193 -0.0227 514 ALA A C 1596 O O . ALA A 206 ? 0.4855 0.3227 0.3389 0.0601 -0.1220 -0.0439 514 ALA A O 1597 C CB . ALA A 206 ? 0.3618 0.2382 0.2843 0.0444 -0.1158 0.0086 514 ALA A CB 1598 N N . GLU A 207 ? 0.4454 0.3002 0.2950 0.0526 -0.1317 -0.0145 515 GLU A N 1599 C CA . GLU A 207 ? 0.5066 0.3445 0.3287 0.0526 -0.1515 -0.0292 515 GLU A CA 1600 C C . GLU A 207 ? 0.5350 0.3637 0.3084 0.0604 -0.1365 -0.0486 515 GLU A C 1601 O O . GLU A 207 ? 0.5356 0.3478 0.2856 0.0631 -0.1467 -0.0720 515 GLU A O 1602 C CB . GLU A 207 ? 0.5567 0.4012 0.3778 0.0477 -0.1681 -0.0132 515 GLU A CB 1603 C CG . GLU A 207 ? 0.6811 0.5072 0.4770 0.0453 -0.1959 -0.0259 515 GLU A CG 1604 C CD . GLU A 207 ? 0.8139 0.6307 0.5489 0.0497 -0.1901 -0.0354 515 GLU A CD 1605 O OE1 . GLU A 207 ? 0.8172 0.6434 0.5352 0.0536 -0.1652 -0.0278 515 GLU A OE1 1606 O OE2 . GLU A 207 ? 0.9031 0.7027 0.6058 0.0482 -0.2115 -0.0497 515 GLU A OE2 1607 N N . ARG A 208 ? 0.5133 0.3465 0.2986 0.0838 -0.0682 0.0888 516 ARG A N 1608 C CA . ARG A 208 ? 0.5535 0.3725 0.3171 0.0827 -0.0597 0.0940 516 ARG A CA 1609 C C . ARG A 208 ? 0.5651 0.3833 0.3204 0.0787 -0.0500 0.0892 516 ARG A C 1610 O O . ARG A 208 ? 0.5830 0.3935 0.3170 0.0782 -0.0459 0.0903 516 ARG A O 1611 C CB . ARG A 208 ? 0.6020 0.4124 0.3712 0.0829 -0.0529 0.1013 516 ARG A CB 1612 C CG . ARG A 208 ? 0.6908 0.4989 0.4652 0.0878 -0.0611 0.1074 516 ARG A CG 1613 C CD . ARG A 208 ? 0.7928 0.5926 0.5444 0.0903 -0.0659 0.1131 516 ARG A CD 1614 N NE . ARG A 208 ? 0.8661 0.6621 0.6220 0.0953 -0.0726 0.1205 516 ARG A NE 1615 C CZ . ARG A 208 ? 0.9521 0.7381 0.6893 0.0980 -0.0759 0.1279 516 ARG A CZ 1616 N NH1 . ARG A 208 ? 0.9926 0.7713 0.7051 0.0960 -0.0726 0.1286 516 ARG A NH1 1617 N NH2 . ARG A 208 ? 0.9765 0.7596 0.7195 0.1031 -0.0822 0.1348 516 ARG A NH2 1618 N N . HIS A 209 ? 0.5341 0.3604 0.3062 0.0762 -0.0461 0.0840 517 HIS A N 1619 C CA . HIS A 209 ? 0.5675 0.3945 0.3344 0.0730 -0.0372 0.0795 517 HIS A CA 1620 C C . HIS A 209 ? 0.5891 0.4195 0.3453 0.0733 -0.0430 0.0728 517 HIS A C 1621 O O . HIS A 209 ? 0.6277 0.4533 0.3683 0.0724 -0.0363 0.0710 517 HIS A O 1622 C CB . HIS A 209 ? 0.5378 0.3723 0.3254 0.0705 -0.0322 0.0762 517 HIS A CB 1623 C CG . HIS A 209 ? 0.5547 0.3828 0.3484 0.0685 -0.0230 0.0820 517 HIS A CG 1624 N ND1 . HIS A 209 ? 0.5774 0.4042 0.3714 0.0646 -0.0110 0.0825 517 HIS A ND1 1625 C CD2 . HIS A 209 ? 0.5447 0.3668 0.3444 0.0695 -0.0240 0.0878 517 HIS A CD2 1626 C CE1 . HIS A 209 ? 0.5819 0.4022 0.3823 0.0624 -0.0054 0.0882 517 HIS A CE1 1627 N NE2 . HIS A 209 ? 0.5768 0.3932 0.3799 0.0654 -0.0131 0.0913 517 HIS A NE2 1628 N N . GLY A 210 ? 0.5640 0.4025 0.3291 0.0745 -0.0553 0.0692 518 GLY A N 1629 C CA . GLY A 210 ? 0.5833 0.4236 0.3385 0.0741 -0.0626 0.0631 518 GLY A CA 1630 C C . GLY A 210 ? 0.6164 0.4449 0.3450 0.0757 -0.0632 0.0659 518 GLY A C 1631 O O . GLY A 210 ? 0.6210 0.4447 0.3337 0.0749 -0.0612 0.0613 518 GLY A O 1632 N N . ASN A 211 ? 0.6343 0.4572 0.3574 0.0782 -0.0657 0.0734 519 ASN A N 1633 C CA . ASN A 211 ? 0.6590 0.4702 0.3559 0.0801 -0.0667 0.0769 519 ASN A CA 1634 C C . ASN A 211 ? 0.6346 0.4354 0.3137 0.0793 -0.0522 0.0790 519 ASN A C 1635 O O . ASN A 211 ? 0.6676 0.4594 0.3232 0.0803 -0.0513 0.0785 519 ASN A O 1636 C CB . ASN A 211 ? 0.7514 0.5597 0.4477 0.0833 -0.0737 0.0851 519 ASN A CB 1637 C CG . ASN A 211 ? 0.8085 0.6228 0.5059 0.0851 -0.0896 0.0832 519 ASN A CG 1638 O OD1 . ASN A 211 ? 0.8011 0.6284 0.5203 0.0847 -0.0971 0.0799 519 ASN A OD1 1639 N ND2 . ASN A 211 ? 0.8298 0.6351 0.5038 0.0868 -0.0948 0.0855 519 ASN A ND2 1640 N N . LEU A 212 ? 0.6154 0.4176 0.3061 0.0774 -0.0409 0.0814 520 LEU A N 1641 C CA . LEU A 212 ? 0.6517 0.4478 0.3309 0.0760 -0.0260 0.0828 520 LEU A CA 1642 C C . LEU A 212 ? 0.6449 0.4421 0.3150 0.0758 -0.0237 0.0745 520 LEU A C 1643 O O . LEU A 212 ? 0.6480 0.4369 0.2974 0.0770 -0.0171 0.0747 520 LEU A O 1644 C CB . LEU A 212 ? 0.6689 0.4695 0.3671 0.0730 -0.0157 0.0854 520 LEU A CB 1645 C CG . LEU A 212 ? 0.7623 0.5559 0.4616 0.0719 -0.0090 0.0951 520 LEU A CG 1646 C CD1 . LEU A 212 ? 0.7596 0.5582 0.4777 0.0678 0.0012 0.0958 520 LEU A CD1 1647 C CD2 . LEU A 212 ? 0.8123 0.5950 0.4875 0.0725 -0.0014 0.1006 520 LEU A CD2 1648 N N . CYS A 213 ? 0.6064 0.4131 0.2919 0.0746 -0.0288 0.0672 521 CYS A N 1649 C CA . CYS A 213 ? 0.6036 0.4108 0.2824 0.0744 -0.0278 0.0589 521 CYS A CA 1650 C C . CYS A 213 ? 0.6287 0.4272 0.2848 0.0763 -0.0355 0.0561 521 CYS A C 1651 O O . CYS A 213 ? 0.6602 0.4515 0.2994 0.0774 -0.0294 0.0526 521 CYS A O 1652 C CB . CYS A 213 ? 0.5676 0.3862 0.2673 0.0724 -0.0342 0.0524 521 CYS A CB 1653 S SG . CYS A 213 ? 0.6576 0.4858 0.3823 0.0702 -0.0252 0.0545 521 CYS A SG 1654 N N . LEU A 214 ? 0.6202 0.4193 0.2766 0.0768 -0.0490 0.0576 522 LEU A N 1655 C CA . LEU A 214 ? 0.6814 0.4720 0.3161 0.0783 -0.0580 0.0556 522 LEU A CA 1656 C C . LEU A 214 ? 0.7360 0.5131 0.3446 0.0809 -0.0494 0.0606 522 LEU A C 1657 O O . LEU A 214 ? 0.7722 0.5399 0.3590 0.0821 -0.0490 0.0567 522 LEU A O 1658 C CB . LEU A 214 ? 0.7184 0.5141 0.3608 0.0786 -0.0736 0.0579 522 LEU A CB 1659 C CG . LEU A 214 ? 0.7160 0.5250 0.3812 0.0761 -0.0843 0.0520 522 LEU A CG 1660 C CD1 . LEU A 214 ? 0.7198 0.5363 0.3967 0.0771 -0.0974 0.0564 522 LEU A CD1 1661 C CD2 . LEU A 214 ? 0.7314 0.5371 0.3863 0.0741 -0.0895 0.0432 522 LEU A CD2 1662 N N . ASP A 215 ? 0.7248 0.5003 0.3353 0.0815 -0.0422 0.0694 523 ASP A N 1663 C CA . ASP A 215 ? 0.7938 0.5572 0.3811 0.0834 -0.0328 0.0755 523 ASP A CA 1664 C C . ASP A 215 ? 0.8049 0.5647 0.3823 0.0836 -0.0184 0.0719 523 ASP A C 1665 O O . ASP A 215 ? 0.8093 0.5584 0.3623 0.0859 -0.0134 0.0726 523 ASP A O 1666 C CB . ASP A 215 ? 0.8084 0.5713 0.4033 0.0830 -0.0267 0.0858 523 ASP A CB 1667 C CG . ASP A 215 ? 0.8428 0.6058 0.4417 0.0844 -0.0400 0.0910 523 ASP A CG 1668 O OD1 . ASP A 215 ? 0.8656 0.6292 0.4761 0.0839 -0.0371 0.0984 523 ASP A OD1 1669 O OD2 . ASP A 215 ? 0.8547 0.6173 0.4458 0.0860 -0.0534 0.0878 523 ASP A OD2 1670 N N . LYS A 216 ? 0.7796 0.5488 0.3764 0.0817 -0.0115 0.0681 524 LYS A N 1671 C CA . LYS A 216 ? 0.8223 0.5906 0.4142 0.0823 0.0028 0.0652 524 LYS A CA 1672 C C . LYS A 216 ? 0.8297 0.5926 0.4073 0.0843 -0.0010 0.0559 524 LYS A C 1673 O O . LYS A 216 ? 0.8873 0.6439 0.4501 0.0867 0.0096 0.0544 524 LYS A O 1674 C CB . LYS A 216 ? 0.8249 0.6054 0.4426 0.0797 0.0110 0.0648 524 LYS A CB 1675 C CG . LYS A 216 ? 0.8690 0.6527 0.4993 0.0773 0.0178 0.0741 524 LYS A CG 1676 C CD . LYS A 216 ? 0.8800 0.6754 0.5352 0.0743 0.0251 0.0732 524 LYS A CD 1677 C CE . LYS A 216 ? 0.9087 0.7059 0.5768 0.0710 0.0309 0.0822 524 LYS A CE 1678 N NZ . LYS A 216 ? 0.8983 0.7065 0.5903 0.0677 0.0376 0.0814 524 LYS A NZ 1679 N N . ILE A 217 ? 0.7491 0.5144 0.3318 0.0832 -0.0159 0.0498 525 ILE A N 1680 C CA . ILE A 217 ? 0.7451 0.5039 0.3148 0.0842 -0.0207 0.0408 525 ILE A CA 1681 C C . ILE A 217 ? 0.8098 0.5556 0.3526 0.0860 -0.0298 0.0404 525 ILE A C 1682 O O . ILE A 217 ? 0.8279 0.5641 0.3532 0.0875 -0.0309 0.0340 525 ILE A O 1683 C CB . ILE A 217 ? 0.7178 0.4857 0.3072 0.0812 -0.0308 0.0336 525 ILE A CB 1684 C CG1 . ILE A 217 ? 0.7105 0.4855 0.3128 0.0788 -0.0460 0.0357 525 ILE A CG1 1685 C CG2 . ILE A 217 ? 0.6702 0.4486 0.2812 0.0801 -0.0206 0.0329 525 ILE A CG2 1686 C CD1 . ILE A 217 ? 0.7300 0.5003 0.3222 0.0777 -0.0616 0.0306 525 ILE A CD1 1687 N N . ASN A 218 ? 0.8429 0.5877 0.3820 0.0861 -0.0365 0.0473 526 ASN A N 1688 C CA . ASN A 218 ? 0.9066 0.6394 0.4196 0.0880 -0.0455 0.0479 526 ASN A CA 1689 C C . ASN A 218 ? 0.9223 0.6411 0.4070 0.0916 -0.0331 0.0492 526 ASN A C 1690 O O . ASN A 218 ? 0.9591 0.6657 0.4187 0.0934 -0.0386 0.0458 526 ASN A O 1691 C CB . ASN A 218 ? 0.9572 0.6925 0.4733 0.0879 -0.0548 0.0561 526 ASN A CB 1692 C CG . ASN A 218 ? 0.9756 0.7235 0.5157 0.0852 -0.0700 0.0540 526 ASN A CG 1693 O OD1 . ASN A 218 ? 0.9771 0.7286 0.5237 0.0830 -0.0778 0.0459 526 ASN A OD1 1694 N ND2 . ASN A 218 ? 0.9762 0.7309 0.5302 0.0854 -0.0737 0.0616 526 ASN A ND2 1695 N N . VAL A 219 ? 0.9038 0.6249 0.3930 0.0924 -0.0162 0.0541 527 VAL A N 1696 C CA . VAL A 219 ? 0.9540 0.6641 0.4194 0.0959 -0.0022 0.0562 527 VAL A CA 1697 C C . VAL A 219 ? 0.9503 0.6550 0.4062 0.0982 0.0027 0.0469 527 VAL A C 1698 O O . VAL A 219 ? 0.9818 0.6756 0.4146 0.1019 0.0124 0.0469 527 VAL A O 1699 C CB . VAL A 219 ? 0.9778 0.6939 0.4539 0.0955 0.0149 0.0646 527 VAL A CB 1700 C CG1 . VAL A 219 ? 1.0010 0.7219 0.4892 0.0930 0.0100 0.0736 527 VAL A CG1 1701 C CG2 . VAL A 219 ? 0.9311 0.6591 0.4311 0.0942 0.0245 0.0607 527 VAL A CG2 1702 N N . LEU A 220 ? 0.8910 0.6027 0.3644 0.0961 -0.0037 0.0392 528 LEU A N 1703 C CA . LEU A 220 ? 0.8947 0.6003 0.3602 0.0981 -0.0011 0.0301 528 LEU A CA 1704 C C . LEU A 220 ? 0.9280 0.6196 0.3694 0.0986 -0.0151 0.0243 528 LEU A C 1705 O O . LEU A 220 ? 0.9425 0.6231 0.3674 0.1012 -0.0127 0.0175 528 LEU A O 1706 C CB . LEU A 220 ? 0.8662 0.5838 0.3594 0.0953 -0.0032 0.0247 528 LEU A CB 1707 C CG . LEU A 220 ? 0.8601 0.5917 0.3777 0.0948 0.0105 0.0289 528 LEU A CG 1708 C CD1 . LEU A 220 ? 0.8269 0.5704 0.3712 0.0914 0.0044 0.0243 528 LEU A CD1 1709 C CD2 . LEU A 220 ? 0.8925 0.6209 0.4019 0.0991 0.0282 0.0287 528 LEU A CD2 1710 N N . HIS A 221 ? 0.9566 0.6488 0.3967 0.0962 -0.0298 0.0271 529 HIS A N 1711 C CA . HIS A 221 ? 1.0060 0.6865 0.4247 0.0959 -0.0450 0.0227 529 HIS A CA 1712 C C . HIS A 221 ? 0.9880 0.6654 0.4089 0.0940 -0.0529 0.0121 529 HIS A C 1713 O O . HIS A 221 ? 1.0335 0.6964 0.4303 0.0949 -0.0597 0.0066 529 HIS A O 1714 C CB . HIS A 221 ? 1.0749 0.7385 0.4579 0.1005 -0.0392 0.0252 529 HIS A CB 1715 C CG . HIS A 221 ? 1.1270 0.7920 0.5055 0.1018 -0.0341 0.0362 529 HIS A CG 1716 N ND1 . HIS A 221 ? 1.1509 0.8159 0.5268 0.1044 -0.0154 0.0423 529 HIS A ND1 1717 C CD2 . HIS A 221 ? 1.1451 0.8116 0.5222 0.1006 -0.0454 0.0427 529 HIS A CD2 1718 C CE1 . HIS A 221 ? 1.1678 0.8331 0.5400 0.1044 -0.0152 0.0521 529 HIS A CE1 1719 N NE2 . HIS A 221 ? 1.1682 0.8341 0.5407 0.1025 -0.0333 0.0526 529 HIS A NE2 1720 N N . LYS A 222 ? 0.9259 0.6160 0.3750 0.0911 -0.0521 0.0093 530 LYS A N 1721 C CA . LYS A 222 ? 0.9015 0.5900 0.3564 0.0884 -0.0598 0.0001 530 LYS A CA 1722 C C . LYS A 222 ? 0.9074 0.5994 0.3682 0.0833 -0.0802 -0.0018 530 LYS A C 1723 O O . LYS A 222 ? 0.8972 0.6012 0.3737 0.0813 -0.0868 0.0039 530 LYS A O 1724 C CB . LYS A 222 ? 0.8616 0.5632 0.3450 0.0870 -0.0521 -0.0014 530 LYS A CB 1725 C CG . LYS A 222 ? 0.8681 0.5696 0.3504 0.0917 -0.0321 0.0011 530 LYS A CG 1726 C CD . LYS A 222 ? 0.8178 0.5338 0.3295 0.0901 -0.0260 0.0003 530 LYS A CD 1727 C CE . LYS A 222 ? 0.8098 0.5226 0.3262 0.0883 -0.0319 -0.0085 530 LYS A CE 1728 N NZ . LYS A 222 ? 0.8315 0.5305 0.3285 0.0933 -0.0223 -0.0131 530 LYS A NZ 1729 N N . PRO A 223 ? 0.9329 0.6144 0.3814 0.0814 -0.0902 -0.0097 531 PRO A N 1730 C CA . PRO A 223 ? 0.9599 0.6455 0.4154 0.0758 -0.1099 -0.0121 531 PRO A CA 1731 C C . PRO A 223 ? 0.9371 0.6404 0.4279 0.0707 -0.1142 -0.0133 531 PRO A C 1732 O O . PRO A 223 ? 0.9152 0.6238 0.4204 0.0715 -0.1027 -0.0140 531 PRO A O 1733 C CB . PRO A 223 ? 1.0194 0.6869 0.4511 0.0752 -0.1157 -0.0207 531 PRO A CB 1734 C CG . PRO A 223 ? 1.0150 0.6752 0.4424 0.0790 -0.0995 -0.0244 531 PRO A CG 1735 C CD . PRO A 223 ? 0.9723 0.6377 0.4010 0.0842 -0.0830 -0.0168 531 PRO A CD 1736 N N . PRO A 224 ? 0.9254 0.6385 0.4304 0.0656 -0.1306 -0.0131 532 PRO A N 1737 C CA . PRO A 224 ? 0.8793 0.6082 0.4165 0.0604 -0.1350 -0.0150 532 PRO A CA 1738 C C . PRO A 224 ? 0.8222 0.5427 0.3577 0.0576 -0.1345 -0.0236 532 PRO A C 1739 O O . PRO A 224 ? 0.8329 0.5375 0.3457 0.0572 -0.1400 -0.0290 532 PRO A O 1740 C CB . PRO A 224 ? 0.8954 0.6346 0.4436 0.0560 -0.1531 -0.0132 532 PRO A CB 1741 C CG . PRO A 224 ? 0.9424 0.6666 0.4597 0.0579 -0.1605 -0.0135 532 PRO A CG 1742 C CD . PRO A 224 ? 0.9550 0.6668 0.4491 0.0647 -0.1451 -0.0104 532 PRO A CD 1743 N N . TYR A 225 ? 0.7380 0.4684 0.2966 0.0560 -0.1280 -0.0247 533 TYR A N 1744 C CA . TYR A 225 ? 0.7393 0.4625 0.2987 0.0537 -0.1266 -0.0319 533 TYR A CA 1745 C C . TYR A 225 ? 0.7624 0.4876 0.3305 0.0460 -0.1431 -0.0364 533 TYR A C 1746 O O . TYR A 225 ? 0.7566 0.4972 0.3444 0.0417 -0.1535 -0.0333 533 TYR A O 1747 C CB . TYR A 225 ? 0.6984 0.4330 0.2813 0.0540 -0.1156 -0.0309 533 TYR A CB 1748 C CG . TYR A 225 ? 0.7096 0.4414 0.2851 0.0610 -0.0979 -0.0279 533 TYR A CG 1749 C CD1 . TYR A 225 ? 0.7342 0.4518 0.2931 0.0652 -0.0877 -0.0320 533 TYR A CD1 1750 C CD2 . TYR A 225 ? 0.6826 0.4263 0.2691 0.0634 -0.0911 -0.0207 533 TYR A CD2 1751 C CE1 . TYR A 225 ? 0.7405 0.4578 0.2952 0.0714 -0.0711 -0.0288 533 TYR A CE1 1752 C CE2 . TYR A 225 ? 0.6919 0.4341 0.2734 0.0689 -0.0749 -0.0176 533 TYR A CE2 1753 C CZ . TYR A 225 ? 0.7291 0.4591 0.2955 0.0729 -0.0648 -0.0216 533 TYR A CZ 1754 O OH . TYR A 225 ? 0.7391 0.4697 0.3028 0.0784 -0.0482 -0.0180 533 TYR A OH 1755 N N . GLU A 226 ? 0.7672 0.4770 0.3212 0.0442 -0.1454 -0.0435 534 GLU A N 1756 C CA . GLU A 226 ? 0.7938 0.5054 0.3587 0.0360 -0.1594 -0.0481 534 GLU A CA 1757 C C . GLU A 226 ? 0.7544 0.4791 0.3484 0.0325 -0.1553 -0.0482 534 GLU A C 1758 O O . GLU A 226 ? 0.7886 0.5082 0.3817 0.0359 -0.1429 -0.0497 534 GLU A O 1759 C CB . GLU A 226 ? 0.8684 0.5570 0.4068 0.0353 -0.1630 -0.0557 534 GLU A CB 1760 C CG . GLU A 226 ? 0.9739 0.6481 0.4814 0.0380 -0.1690 -0.0564 534 GLU A CG 1761 C CD . GLU A 226 ? 1.0627 0.7133 0.5438 0.0369 -0.1733 -0.0646 534 GLU A CD 1762 O OE1 . GLU A 226 ? 1.0621 0.7054 0.5458 0.0362 -0.1677 -0.0692 534 GLU A OE1 1763 O OE2 . GLU A 226 ? 1.1222 0.7610 0.5794 0.0369 -0.1824 -0.0664 534 GLU A OE2 1764 N N . HIS A 227 ? 0.6917 0.4340 0.3117 0.0260 -0.1655 -0.0462 535 HIS A N 1765 C CA . HIS A 227 ? 0.6639 0.4199 0.3123 0.0222 -0.1622 -0.0457 535 HIS A CA 1766 C C . HIS A 227 ? 0.6960 0.4478 0.3504 0.0141 -0.1714 -0.0512 535 HIS A C 1767 O O . HIS A 227 ? 0.7147 0.4596 0.3591 0.0098 -0.1838 -0.0541 535 HIS A O 1768 C CB . HIS A 227 ? 0.6169 0.3967 0.2926 0.0207 -0.1655 -0.0393 535 HIS A CB 1769 C CG . HIS A 227 ? 0.6098 0.3942 0.2824 0.0281 -0.1559 -0.0335 535 HIS A CG 1770 N ND1 . HIS A 227 ? 0.6318 0.4291 0.3134 0.0290 -0.1613 -0.0275 535 HIS A ND1 1771 C CD2 . HIS A 227 ? 0.6225 0.4004 0.2848 0.0347 -0.1412 -0.0323 535 HIS A CD2 1772 C CE1 . HIS A 227 ? 0.6367 0.4339 0.3126 0.0356 -0.1504 -0.0230 535 HIS A CE1 1773 N NE2 . HIS A 227 ? 0.6315 0.4177 0.2962 0.0388 -0.1381 -0.0258 535 HIS A NE2 1774 N N . PRO A 228 ? 0.6847 0.4400 0.3548 0.0119 -0.1654 -0.0524 536 PRO A N 1775 C CA . PRO A 228 ? 0.7056 0.4587 0.3849 0.0033 -0.1739 -0.0566 536 PRO A CA 1776 C C . PRO A 228 ? 0.7048 0.4776 0.4090 -0.0046 -0.1868 -0.0538 536 PRO A C 1777 O O . PRO A 228 ? 0.6414 0.4335 0.3650 -0.0032 -0.1853 -0.0483 536 PRO A O 1778 C CB . PRO A 228 ? 0.6858 0.4412 0.3782 0.0039 -0.1628 -0.0567 536 PRO A CB 1779 C CG . PRO A 228 ? 0.6648 0.4322 0.3650 0.0108 -0.1518 -0.0515 536 PRO A CG 1780 C CD . PRO A 228 ? 0.6721 0.4318 0.3500 0.0172 -0.1505 -0.0502 536 PRO A CD 1781 N N . LYS A 229 ? 0.7356 0.5035 0.4394 -0.0125 -0.1991 -0.0576 537 LYS A N 1782 C CA . LYS A 229 ? 0.7479 0.5352 0.4763 -0.0205 -0.2117 -0.0551 537 LYS A CA 1783 C C . LYS A 229 ? 0.7063 0.5018 0.4589 -0.0289 -0.2127 -0.0559 537 LYS A C 1784 O O . LYS A 229 ? 0.6993 0.5127 0.4761 -0.0361 -0.2216 -0.0536 537 LYS A O 1785 C CB . LYS A 229 ? 0.8295 0.6084 0.5427 -0.0245 -0.2266 -0.0582 537 LYS A CB 1786 C CG . LYS A 229 ? 0.8757 0.6561 0.5752 -0.0184 -0.2301 -0.0551 537 LYS A CG 1787 C CD . LYS A 229 ? 0.9393 0.7135 0.6266 -0.0235 -0.2467 -0.0581 537 LYS A CD 1788 C CE . LYS A 229 ? 0.9621 0.7404 0.6385 -0.0179 -0.2516 -0.0540 537 LYS A CE 1789 N NZ . LYS A 229 ? 1.0042 0.7765 0.6680 -0.0229 -0.2687 -0.0569 537 LYS A NZ 1790 N N . ASP A 230 ? 0.6834 0.4662 0.4297 -0.0278 -0.2032 -0.0588 538 ASP A N 1791 C CA . ASP A 230 ? 0.6513 0.4389 0.4176 -0.0355 -0.2030 -0.0595 538 ASP A CA 1792 C C . ASP A 230 ? 0.5979 0.3768 0.3600 -0.0305 -0.1889 -0.0602 538 ASP A C 1793 O O . ASP A 230 ? 0.5991 0.3708 0.3457 -0.0212 -0.1790 -0.0599 538 ASP A O 1794 C CB . ASP A 230 ? 0.7284 0.5026 0.4870 -0.0443 -0.2144 -0.0647 538 ASP A CB 1795 C CG . ASP A 230 ? 0.8075 0.5535 0.5302 -0.0398 -0.2140 -0.0707 538 ASP A CG 1796 O OD1 . ASP A 230 ? 0.8940 0.6333 0.6016 -0.0410 -0.2244 -0.0730 538 ASP A OD1 1797 O OD2 . ASP A 230 ? 0.8009 0.5315 0.5100 -0.0346 -0.2032 -0.0731 538 ASP A OD2 1798 N N . LEU A 231 ? 0.5950 0.3748 0.3713 -0.0368 -0.1877 -0.0608 539 LEU A N 1799 C CA . LEU A 231 ? 0.6125 0.3851 0.3868 -0.0325 -0.1751 -0.0612 539 LEU A CA 1800 C C . LEU A 231 ? 0.6452 0.3935 0.4013 -0.0343 -0.1751 -0.0668 539 LEU A C 1801 O O . LEU A 231 ? 0.6490 0.3919 0.4078 -0.0334 -0.1672 -0.0671 539 LEU A O 1802 C CB . LEU A 231 ? 0.5918 0.3842 0.3964 -0.0372 -0.1720 -0.0568 539 LEU A CB 1803 C CG . LEU A 231 ? 0.5807 0.3986 0.4072 -0.0368 -0.1733 -0.0511 539 LEU A CG 1804 C CD1 . LEU A 231 ? 0.5432 0.3787 0.3981 -0.0416 -0.1697 -0.0473 539 LEU A CD1 1805 C CD2 . LEU A 231 ? 0.5604 0.3788 0.3754 -0.0260 -0.1652 -0.0494 539 LEU A CD2 1806 N N . LYS A 232 ? 0.6849 0.4181 0.4219 -0.0364 -0.1840 -0.0714 540 LYS A N 1807 C CA . LYS A 232 ? 0.7362 0.4451 0.4552 -0.0387 -0.1853 -0.0772 540 LYS A CA 1808 C C . LYS A 232 ? 0.7525 0.4434 0.4493 -0.0279 -0.1724 -0.0796 540 LYS A C 1809 O O . LYS A 232 ? 0.7690 0.4474 0.4627 -0.0281 -0.1677 -0.0819 540 LYS A O 1810 C CB . LYS A 232 ? 0.7842 0.4810 0.4868 -0.0436 -0.1987 -0.0818 540 LYS A CB 1811 C CG . LYS A 232 ? 0.8147 0.5271 0.5399 -0.0557 -0.2124 -0.0803 540 LYS A CG 1812 C CD . LYS A 232 ? 0.9050 0.6033 0.6124 -0.0609 -0.2262 -0.0855 540 LYS A CD 1813 C CE . LYS A 232 ? 0.9445 0.6594 0.6766 -0.0736 -0.2399 -0.0840 540 LYS A CE 1814 N NZ . LYS A 232 ? 0.9311 0.6757 0.6881 -0.0731 -0.2413 -0.0772 540 LYS A NZ 1815 N N . LEU A 233 ? 0.7497 0.4397 0.4318 -0.0184 -0.1665 -0.0788 541 LEU A N 1816 C CA . LEU A 233 ? 0.7672 0.4421 0.4291 -0.0076 -0.1537 -0.0806 541 LEU A CA 1817 C C . LEU A 233 ? 0.7226 0.4078 0.4004 -0.0032 -0.1413 -0.0769 541 LEU A C 1818 O O . LEU A 233 ? 0.7345 0.4080 0.4005 0.0043 -0.1308 -0.0784 541 LEU A O 1819 C CB . LEU A 233 ? 0.8014 0.4736 0.4440 0.0008 -0.1505 -0.0802 541 LEU A CB 1820 C CG . LEU A 233 ? 0.8723 0.5305 0.4932 -0.0017 -0.1617 -0.0845 541 LEU A CG 1821 C CD1 . LEU A 233 ? 0.9074 0.5597 0.5059 0.0078 -0.1558 -0.0840 541 LEU A CD1 1822 C CD2 . LEU A 233 ? 0.9066 0.5409 0.5106 -0.0047 -0.1655 -0.0912 541 LEU A CD2 1823 N N . SER A 234 ? 0.6705 0.3776 0.3748 -0.0078 -0.1426 -0.0720 542 SER A N 1824 C CA . SER A 234 ? 0.6553 0.3729 0.3755 -0.0046 -0.1322 -0.0685 542 SER A CA 1825 C C . SER A 234 ? 0.6529 0.3722 0.3901 -0.0131 -0.1351 -0.0683 542 SER A C 1826 O O . SER A 234 ? 0.6069 0.3382 0.3618 -0.0131 -0.1293 -0.0648 542 SER A O 1827 C CB . SER A 234 ? 0.6584 0.3986 0.3953 -0.0027 -0.1296 -0.0630 542 SER A CB 1828 O OG . SER A 234 ? 0.6675 0.4215 0.4193 -0.0107 -0.1410 -0.0612 542 SER A OG 1829 N N . ASP A 235 ? 0.7186 0.4250 0.4497 -0.0205 -0.1443 -0.0722 543 ASP A N 1830 C CA . ASP A 235 ? 0.7311 0.4360 0.4761 -0.0295 -0.1477 -0.0722 543 ASP A CA 1831 C C . ASP A 235 ? 0.6545 0.3839 0.4300 -0.0372 -0.1507 -0.0668 543 ASP A C 1832 O O . ASP A 235 ? 0.6507 0.3845 0.4409 -0.0403 -0.1464 -0.0644 543 ASP A O 1833 C CB . ASP A 235 ? 0.8106 0.5023 0.5491 -0.0240 -0.1373 -0.0731 543 ASP A CB 1834 C CG . ASP A 235 ? 0.9223 0.5880 0.6322 -0.0183 -0.1356 -0.0790 543 ASP A CG 1835 O OD1 . ASP A 235 ? 0.9550 0.6091 0.6520 -0.0227 -0.1451 -0.0831 543 ASP A OD1 1836 O OD2 . ASP A 235 ? 0.9574 0.6146 0.6582 -0.0091 -0.1248 -0.0794 543 ASP A OD2 1837 N N . GLY A 236 ? 0.5862 0.3314 0.3710 -0.0400 -0.1577 -0.0648 544 GLY A N 1838 C CA . GLY A 236 ? 0.5441 0.3136 0.3583 -0.0472 -0.1612 -0.0598 544 GLY A CA 1839 C C . GLY A 236 ? 0.5161 0.3030 0.3431 -0.0410 -0.1523 -0.0552 544 GLY A C 1840 O O . GLY A 236 ? 0.5078 0.3158 0.3590 -0.0455 -0.1539 -0.0508 544 GLY A O 1841 N N . ARG A 237 ? 0.4804 0.2587 0.2917 -0.0306 -0.1425 -0.0560 545 ARG A N 1842 C CA . ARG A 237 ? 0.4664 0.2591 0.2880 -0.0244 -0.1337 -0.0520 545 ARG A CA 1843 C C . ARG A 237 ? 0.4678 0.2699 0.2859 -0.0189 -0.1342 -0.0504 545 ARG A C 1844 O O . ARG A 237 ? 0.5088 0.2996 0.3070 -0.0151 -0.1364 -0.0529 545 ARG A O 1845 C CB . ARG A 237 ? 0.5130 0.2933 0.3221 -0.0163 -0.1221 -0.0533 545 ARG A CB 1846 C CG . ARG A 237 ? 0.5502 0.3178 0.3591 -0.0204 -0.1211 -0.0549 545 ARG A CG 1847 C CD . ARG A 237 ? 0.5860 0.3389 0.3788 -0.0108 -0.1107 -0.0567 545 ARG A CD 1848 N NE . ARG A 237 ? 0.5658 0.3306 0.3682 -0.0047 -0.1011 -0.0532 545 ARG A NE 1849 C CZ . ARG A 237 ? 0.5621 0.3202 0.3547 0.0049 -0.0910 -0.0536 545 ARG A CZ 1850 N NH1 . ARG A 237 ? 0.5660 0.3057 0.3390 0.0098 -0.0885 -0.0572 545 ARG A NH1 1851 N NH2 . ARG A 237 ? 0.5311 0.3013 0.3340 0.0096 -0.0833 -0.0504 545 ARG A NH2 1852 N N . LEU A 238 ? 0.4264 0.2486 0.2635 -0.0184 -0.1321 -0.0460 546 LEU A N 1853 C CA . LEU A 238 ? 0.4391 0.2705 0.2742 -0.0125 -0.1312 -0.0436 546 LEU A CA 1854 C C . LEU A 238 ? 0.4357 0.2608 0.2578 -0.0026 -0.1194 -0.0435 546 LEU A C 1855 O O . LEU A 238 ? 0.4306 0.2590 0.2604 -0.0008 -0.1118 -0.0425 546 LEU A O 1856 C CB . LEU A 238 ? 0.4296 0.2852 0.2913 -0.0157 -0.1337 -0.0388 546 LEU A CB 1857 C CG . LEU A 238 ? 0.4536 0.3203 0.3169 -0.0116 -0.1364 -0.0357 546 LEU A CG 1858 C CD1 . LEU A 238 ? 0.4397 0.3019 0.2944 -0.0147 -0.1472 -0.0372 546 LEU A CD1 1859 C CD2 . LEU A 238 ? 0.4311 0.3215 0.3219 -0.0135 -0.1365 -0.0309 546 LEU A CD2 1860 N N . ARG A 239 ? 0.4379 0.2541 0.2404 0.0037 -0.1176 -0.0445 547 ARG A N 1861 C CA . ARG A 239 ? 0.4328 0.2436 0.2231 0.0130 -0.1058 -0.0441 547 ARG A CA 1862 C C . ARG A 239 ? 0.4177 0.2442 0.2176 0.0165 -0.1027 -0.0395 547 ARG A C 1863 O O . ARG A 239 ? 0.4319 0.2621 0.2286 0.0171 -0.1074 -0.0377 547 ARG A O 1864 C CB . ARG A 239 ? 0.4507 0.2428 0.2140 0.0182 -0.1040 -0.0472 547 ARG A CB 1865 C CG . ARG A 239 ? 0.4554 0.2299 0.2074 0.0165 -0.1047 -0.0520 547 ARG A CG 1866 C CD . ARG A 239 ? 0.5073 0.2631 0.2318 0.0226 -0.1017 -0.0552 547 ARG A CD 1867 N NE . ARG A 239 ? 0.5618 0.3008 0.2757 0.0235 -0.0990 -0.0593 547 ARG A NE 1868 C CZ . ARG A 239 ? 0.5885 0.3085 0.2806 0.0244 -0.1020 -0.0638 547 ARG A CZ 1869 N NH1 . ARG A 239 ? 0.5952 0.3106 0.2735 0.0241 -0.1082 -0.0648 547 ARG A NH1 1870 N NH2 . ARG A 239 ? 0.5853 0.2902 0.2689 0.0256 -0.0990 -0.0673 547 ARG A NH2 1871 N N . VAL A 240 ? 0.3959 0.2313 0.2075 0.0188 -0.0950 -0.0375 548 VAL A N 1872 C CA . VAL A 240 ? 0.3871 0.2375 0.2093 0.0217 -0.0920 -0.0331 548 VAL A CA 1873 C C . VAL A 240 ? 0.4121 0.2583 0.2232 0.0300 -0.0799 -0.0322 548 VAL A C 1874 O O . VAL A 240 ? 0.4250 0.2665 0.2342 0.0326 -0.0725 -0.0338 548 VAL A O 1875 C CB . VAL A 240 ? 0.3782 0.2447 0.2249 0.0172 -0.0934 -0.0311 548 VAL A CB 1876 C CG1 . VAL A 240 ? 0.3615 0.2426 0.2186 0.0207 -0.0904 -0.0266 548 VAL A CG1 1877 C CG2 . VAL A 240 ? 0.3843 0.2567 0.2443 0.0086 -0.1043 -0.0314 548 VAL A CG2 1878 N N . GLY A 241 ? 0.3910 0.2392 0.1952 0.0342 -0.0776 -0.0292 549 GLY A N 1879 C CA . GLY A 241 ? 0.4002 0.2462 0.1952 0.0415 -0.0658 -0.0274 549 GLY A CA 1880 C C . GLY A 241 ? 0.3688 0.2291 0.1771 0.0430 -0.0622 -0.0225 549 GLY A C 1881 O O . GLY A 241 ? 0.3755 0.2424 0.1884 0.0421 -0.0671 -0.0192 549 GLY A O 1882 N N . TYR A 242 ? 0.3235 0.1886 0.1384 0.0455 -0.0537 -0.0221 550 TYR A N 1883 C CA . TYR A 242 ? 0.3276 0.2067 0.1577 0.0466 -0.0479 -0.0170 550 TYR A CA 1884 C C . TYR A 242 ? 0.3810 0.2567 0.1998 0.0526 -0.0369 -0.0140 550 TYR A C 1885 O O . TYR A 242 ? 0.3526 0.2238 0.1655 0.0562 -0.0281 -0.0156 550 TYR A O 1886 C CB . TYR A 242 ? 0.3253 0.2159 0.1775 0.0441 -0.0436 -0.0170 550 TYR A CB 1887 C CG . TYR A 242 ? 0.3129 0.2100 0.1799 0.0378 -0.0525 -0.0184 550 TYR A CG 1888 C CD1 . TYR A 242 ? 0.3047 0.2140 0.1872 0.0351 -0.0571 -0.0153 550 TYR A CD1 1889 C CD2 . TYR A 242 ? 0.3069 0.1976 0.1729 0.0348 -0.0554 -0.0223 550 TYR A CD2 1890 C CE1 . TYR A 242 ? 0.2738 0.1908 0.1714 0.0295 -0.0639 -0.0160 550 TYR A CE1 1891 C CE2 . TYR A 242 ? 0.3070 0.2042 0.1875 0.0283 -0.0627 -0.0228 550 TYR A CE2 1892 C CZ . TYR A 242 ? 0.3081 0.2196 0.2050 0.0257 -0.0665 -0.0195 550 TYR A CZ 1893 O OH . TYR A 242 ? 0.3017 0.2214 0.2144 0.0194 -0.0724 -0.0195 550 TYR A OH 1894 N N . VAL A 243 ? 0.3539 0.2318 0.1703 0.0537 -0.0370 -0.0093 551 VAL A N 1895 C CA . VAL A 243 ? 0.3395 0.2139 0.1448 0.0584 -0.0265 -0.0054 551 VAL A CA 1896 C C . VAL A 243 ? 0.3391 0.2273 0.1655 0.0572 -0.0198 -0.0001 551 VAL A C 1897 O O . VAL A 243 ? 0.3118 0.2059 0.1482 0.0550 -0.0248 0.0029 551 VAL A O 1898 C CB . VAL A 243 ? 0.3610 0.2264 0.1492 0.0596 -0.0305 -0.0032 551 VAL A CB 1899 C CG1 . VAL A 243 ? 0.3819 0.2432 0.1587 0.0639 -0.0185 0.0011 551 VAL A CG1 1900 C CG2 . VAL A 243 ? 0.3404 0.1953 0.1167 0.0582 -0.0381 -0.0086 551 VAL A CG2 1901 N N . SER A 244 ? 0.3415 0.2348 0.1750 0.0587 -0.0087 0.0008 552 SER A N 1902 C CA . SER A 244 ? 0.3308 0.2366 0.1844 0.0565 -0.0030 0.0051 552 SER A CA 1903 C C . SER A 244 ? 0.3357 0.2442 0.1896 0.0590 0.0098 0.0083 552 SER A C 1904 O O . SER A 244 ? 0.3118 0.2183 0.1604 0.0623 0.0155 0.0059 552 SER A O 1905 C CB . SER A 244 ? 0.3308 0.2477 0.2058 0.0528 -0.0061 0.0025 552 SER A CB 1906 O OG . SER A 244 ? 0.3160 0.2435 0.2085 0.0504 -0.0015 0.0057 552 SER A OG 1907 N N . SER A 245 ? 0.3215 0.2347 0.1828 0.0573 0.0145 0.0138 553 SER A N 1908 C CA . SER A 245 ? 0.3194 0.2388 0.1873 0.0579 0.0265 0.0175 553 SER A CA 1909 C C . SER A 245 ? 0.3113 0.2450 0.2039 0.0544 0.0276 0.0165 553 SER A C 1910 O O . SER A 245 ? 0.2947 0.2368 0.1979 0.0539 0.0361 0.0194 553 SER A O 1911 C CB . SER A 245 ? 0.3341 0.2507 0.1985 0.0566 0.0310 0.0244 553 SER A CB 1912 O OG . SER A 245 ? 0.3509 0.2716 0.2296 0.0521 0.0254 0.0258 553 SER A OG 1913 N N . ASP A 246 ? 0.2826 0.2194 0.1842 0.0519 0.0190 0.0126 554 ASP A N 1914 C CA . ASP A 246 ? 0.2714 0.2203 0.1941 0.0482 0.0188 0.0118 554 ASP A CA 1915 C C . ASP A 246 ? 0.2708 0.2230 0.1983 0.0490 0.0156 0.0071 554 ASP A C 1916 O O . ASP A 246 ? 0.2619 0.2205 0.2019 0.0458 0.0112 0.0055 554 ASP A O 1917 C CB . ASP A 246 ? 0.2757 0.2265 0.2073 0.0440 0.0131 0.0125 554 ASP A CB 1918 C CG . ASP A 246 ? 0.3217 0.2688 0.2509 0.0429 0.0168 0.0178 554 ASP A CG 1919 O OD1 . ASP A 246 ? 0.3208 0.2718 0.2544 0.0420 0.0248 0.0212 554 ASP A OD1 1920 O OD2 . ASP A 246 ? 0.3783 0.3189 0.3018 0.0430 0.0117 0.0189 554 ASP A OD2 1921 N N . PHE A 247 ? 0.2458 0.1921 0.1618 0.0536 0.0182 0.0052 555 PHE A N 1922 C CA . PHE A 247 ? 0.2291 0.1774 0.1496 0.0551 0.0168 0.0016 555 PHE A CA 1923 C C . PHE A 247 ? 0.2529 0.2129 0.1876 0.0563 0.0242 0.0040 555 PHE A C 1924 O O . PHE A 247 ? 0.2603 0.2198 0.1904 0.0613 0.0320 0.0052 555 PHE A O 1925 C CB . PHE A 247 ? 0.2433 0.1783 0.1449 0.0599 0.0165 -0.0018 555 PHE A CB 1926 C CG . PHE A 247 ? 0.2989 0.2232 0.1880 0.0579 0.0072 -0.0047 555 PHE A CG 1927 C CD1 . PHE A 247 ? 0.3203 0.2489 0.2197 0.0528 -0.0010 -0.0058 555 PHE A CD1 1928 C CD2 . PHE A 247 ? 0.2888 0.1993 0.1560 0.0611 0.0066 -0.0063 555 PHE A CD2 1929 C CE1 . PHE A 247 ? 0.3273 0.2485 0.2183 0.0507 -0.0098 -0.0080 555 PHE A CE1 1930 C CE2 . PHE A 247 ? 0.3170 0.2188 0.1739 0.0588 -0.0034 -0.0088 555 PHE A CE2 1931 C CZ . PHE A 247 ? 0.3109 0.2190 0.1811 0.0534 -0.0117 -0.0095 555 PHE A CZ 1932 N N . GLY A 248 ? 0.2635 0.2341 0.2153 0.0520 0.0216 0.0047 556 GLY A N 1933 C CA . GLY A 248 ? 0.1918 0.1754 0.1595 0.0518 0.0266 0.0073 556 GLY A CA 1934 C C . GLY A 248 ? 0.2079 0.1994 0.1893 0.0453 0.0223 0.0080 556 GLY A C 1935 O O . GLY A 248 ? 0.1930 0.1805 0.1723 0.0425 0.0158 0.0056 556 GLY A O 1936 N N . ASN A 249 ? 0.2113 0.2137 0.2068 0.0427 0.0259 0.0110 557 ASN A N 1937 C CA . ASN A 249 ? 0.1968 0.2050 0.2038 0.0362 0.0214 0.0109 557 ASN A CA 1938 C C . ASN A 249 ? 0.2039 0.2047 0.2059 0.0326 0.0207 0.0119 557 ASN A C 1939 O O . ASN A 249 ? 0.2038 0.2057 0.2090 0.0303 0.0254 0.0156 557 ASN A O 1940 C CB . ASN A 249 ? 0.2233 0.2453 0.2475 0.0337 0.0242 0.0137 557 ASN A CB 1941 C CG . ASN A 249 ? 0.2247 0.2512 0.2589 0.0269 0.0182 0.0124 557 ASN A CG 1942 O OD1 . ASN A 249 ? 0.1876 0.2084 0.2167 0.0256 0.0123 0.0089 557 ASN A OD1 1943 N ND2 . ASN A 249 ? 0.2210 0.2577 0.2696 0.0225 0.0197 0.0151 557 ASN A ND2 1944 N N . HIS A 250 ? 0.1899 0.1835 0.1851 0.0322 0.0149 0.0089 558 HIS A N 1945 C CA . HIS A 250 ? 0.2077 0.1937 0.1981 0.0302 0.0133 0.0097 558 HIS A CA 1946 C C . HIS A 250 ? 0.1975 0.1806 0.1862 0.0299 0.0066 0.0060 558 HIS A C 1947 O O . HIS A 250 ? 0.1886 0.1719 0.1743 0.0320 0.0040 0.0036 558 HIS A O 1948 C CB . HIS A 250 ? 0.2469 0.2244 0.2235 0.0338 0.0164 0.0122 558 HIS A CB 1949 C CG . HIS A 250 ? 0.2254 0.1947 0.1964 0.0328 0.0147 0.0142 558 HIS A CG 1950 N ND1 . HIS A 250 ? 0.2022 0.1661 0.1680 0.0340 0.0082 0.0120 558 HIS A ND1 1951 C CD2 . HIS A 250 ? 0.2170 0.1823 0.1872 0.0309 0.0185 0.0186 558 HIS A CD2 1952 C CE1 . HIS A 250 ? 0.2321 0.1893 0.1943 0.0337 0.0079 0.0149 558 HIS A CE1 1953 N NE2 . HIS A 250 ? 0.2194 0.1761 0.1831 0.0318 0.0141 0.0190 558 HIS A NE2 1954 N N . PRO A 251 ? 0.2003 0.1804 0.1912 0.0275 0.0042 0.0057 559 PRO A N 1955 C CA . PRO A 251 ? 0.2133 0.1922 0.2045 0.0277 -0.0008 0.0025 559 PRO A CA 1956 C C . PRO A 251 ? 0.1877 0.1639 0.1713 0.0308 -0.0040 0.0015 559 PRO A C 1957 O O . PRO A 251 ? 0.1830 0.1618 0.1689 0.0305 -0.0072 -0.0011 559 PRO A O 1958 C CB . PRO A 251 ? 0.2272 0.2004 0.2187 0.0269 -0.0013 0.0036 559 PRO A CB 1959 C CG . PRO A 251 ? 0.2150 0.1872 0.2094 0.0241 0.0029 0.0065 559 PRO A CG 1960 C CD . PRO A 251 ? 0.1648 0.1424 0.1593 0.0245 0.0069 0.0084 559 PRO A CD 1961 N N . THR A 252 ? 0.2250 0.1954 0.1989 0.0334 -0.0032 0.0035 560 THR A N 1962 C CA . THR A 252 ? 0.2674 0.2337 0.2328 0.0356 -0.0074 0.0022 560 THR A CA 1963 C C . THR A 252 ? 0.2538 0.2226 0.2196 0.0357 -0.0083 -0.0006 560 THR A C 1964 O O . THR A 252 ? 0.2296 0.1984 0.1960 0.0348 -0.0129 -0.0026 560 THR A O 1965 C CB . THR A 252 ? 0.3349 0.2931 0.2866 0.0386 -0.0063 0.0045 560 THR A CB 1966 O OG1 . THR A 252 ? 0.3438 0.2983 0.2941 0.0388 -0.0070 0.0076 560 THR A OG1 1967 C CG2 . THR A 252 ? 0.3478 0.3009 0.2897 0.0402 -0.0119 0.0023 560 THR A CG2 1968 N N . SER A 253 ? 0.2297 0.2005 0.1960 0.0366 -0.0036 -0.0001 561 SER A N 1969 C CA . SER A 253 ? 0.2292 0.2013 0.1960 0.0374 -0.0042 -0.0022 561 SER A CA 1970 C C . SER A 253 ? 0.2252 0.2041 0.2025 0.0344 -0.0064 -0.0034 561 SER A C 1971 O O . SER A 253 ? 0.2245 0.2025 0.2012 0.0341 -0.0090 -0.0049 561 SER A O 1972 C CB . SER A 253 ? 0.2306 0.2038 0.1962 0.0406 0.0015 -0.0009 561 SER A CB 1973 O OG . SER A 253 ? 0.2069 0.1720 0.1593 0.0442 0.0041 -0.0004 561 SER A OG 1974 N N . HIS A 254 ? 0.2072 0.1913 0.1925 0.0320 -0.0053 -0.0026 562 HIS A N 1975 C CA . HIS A 254 ? 0.1996 0.1886 0.1918 0.0293 -0.0072 -0.0041 562 HIS A CA 1976 C C . HIS A 254 ? 0.2271 0.2145 0.2186 0.0284 -0.0107 -0.0057 562 HIS A C 1977 O O . HIS A 254 ? 0.2374 0.2279 0.2321 0.0267 -0.0118 -0.0068 562 HIS A O 1978 C CB . HIS A 254 ? 0.1678 0.1600 0.1664 0.0267 -0.0060 -0.0038 562 HIS A CB 1979 C CG . HIS A 254 ? 0.1889 0.1848 0.1916 0.0262 -0.0026 -0.0017 562 HIS A CG 1980 N ND1 . HIS A 254 ? 0.1815 0.1784 0.1894 0.0232 -0.0013 -0.0007 562 HIS A ND1 1981 C CD2 . HIS A 254 ? 0.2099 0.2092 0.2134 0.0285 -0.0001 -0.0001 562 HIS A CD2 1982 C CE1 . HIS A 254 ? 0.1560 0.1582 0.1690 0.0228 0.0019 0.0017 562 HIS A CE1 1983 N NE2 . HIS A 254 ? 0.1808 0.1850 0.1915 0.0266 0.0030 0.0022 562 HIS A NE2 1984 N N . LEU A 255 ? 0.2024 0.1857 0.1900 0.0294 -0.0123 -0.0053 563 LEU A N 1985 C CA . LEU A 255 ? 0.1881 0.1722 0.1778 0.0286 -0.0159 -0.0062 563 LEU A CA 1986 C C . LEU A 255 ? 0.2157 0.1964 0.2004 0.0284 -0.0191 -0.0069 563 LEU A C 1987 O O . LEU A 255 ? 0.1955 0.1788 0.1841 0.0262 -0.0210 -0.0076 563 LEU A O 1988 C CB . LEU A 255 ? 0.2214 0.2040 0.2116 0.0299 -0.0173 -0.0052 563 LEU A CB 1989 C CG . LEU A 255 ? 0.2356 0.2188 0.2302 0.0299 -0.0146 -0.0048 563 LEU A CG 1990 C CD1 . LEU A 255 ? 0.2746 0.2552 0.2696 0.0322 -0.0165 -0.0034 563 LEU A CD1 1991 C CD2 . LEU A 255 ? 0.2278 0.2157 0.2286 0.0281 -0.0132 -0.0070 563 LEU A CD2 1992 N N . MET A 256 ? 0.2038 0.1780 0.1793 0.0305 -0.0194 -0.0067 564 MET A N 1993 C CA . MET A 256 ? 0.2000 0.1682 0.1687 0.0300 -0.0236 -0.0080 564 MET A CA 1994 C C . MET A 256 ? 0.2071 0.1686 0.1680 0.0316 -0.0221 -0.0091 564 MET A C 1995 O O . MET A 256 ? 0.2141 0.1676 0.1668 0.0314 -0.0257 -0.0107 564 MET A O 1996 C CB . MET A 256 ? 0.1922 0.1555 0.1539 0.0310 -0.0279 -0.0078 564 MET A CB 1997 C CG . MET A 256 ? 0.1921 0.1502 0.1441 0.0346 -0.0247 -0.0062 564 MET A CG 1998 S SD . MET A 256 ? 0.2794 0.2306 0.2204 0.0379 -0.0192 -0.0070 564 MET A SD 1999 C CE . MET A 256 ? 0.3060 0.2451 0.2327 0.0380 -0.0254 -0.0103 564 MET A CE 2000 N N . GLN A 257 ? 0.1970 0.1615 0.1606 0.0333 -0.0173 -0.0083 565 GLN A N 2001 C CA . GLN A 257 ? 0.2359 0.1941 0.1925 0.0365 -0.0153 -0.0090 565 GLN A CA 2002 C C . GLN A 257 ? 0.2585 0.2100 0.2119 0.0349 -0.0189 -0.0106 565 GLN A C 2003 O O . GLN A 257 ? 0.2459 0.1877 0.1900 0.0378 -0.0185 -0.0120 565 GLN A O 2004 C CB . GLN A 257 ? 0.2350 0.1999 0.1980 0.0388 -0.0102 -0.0074 565 GLN A CB 2005 C CG . GLN A 257 ? 0.2278 0.1998 0.2002 0.0361 -0.0114 -0.0067 565 GLN A CG 2006 C CD . GLN A 257 ? 0.2454 0.2236 0.2235 0.0386 -0.0083 -0.0051 565 GLN A CD 2007 O OE1 . GLN A 257 ? 0.2180 0.1951 0.1940 0.0430 -0.0048 -0.0044 565 GLN A OE1 2008 N NE2 . GLN A 257 ? 0.2117 0.1970 0.1972 0.0360 -0.0095 -0.0044 565 GLN A NE2 2009 N N . SER A 258 ? 0.2357 0.1914 0.1964 0.0303 -0.0219 -0.0103 566 SER A N 2010 C CA . SER A 258 ? 0.2289 0.1781 0.1875 0.0277 -0.0248 -0.0109 566 SER A CA 2011 C C . SER A 258 ? 0.2404 0.1822 0.1936 0.0246 -0.0306 -0.0128 566 SER A C 2012 O O . SER A 258 ? 0.2457 0.1788 0.1949 0.0221 -0.0335 -0.0137 566 SER A O 2013 C CB . SER A 258 ? 0.2006 0.1575 0.1688 0.0240 -0.0245 -0.0090 566 SER A CB 2014 O OG . SER A 258 ? 0.2152 0.1764 0.1860 0.0265 -0.0209 -0.0075 566 SER A OG 2015 N N . ILE A 259 ? 0.2053 0.1501 0.1586 0.0243 -0.0328 -0.0131 567 ILE A N 2016 C CA . ILE A 259 ? 0.2375 0.1781 0.1880 0.0207 -0.0399 -0.0146 567 ILE A CA 2017 C C . ILE A 259 ? 0.2732 0.1975 0.2078 0.0214 -0.0434 -0.0177 567 ILE A C 2018 O O . ILE A 259 ? 0.3009 0.2192 0.2346 0.0165 -0.0491 -0.0191 567 ILE A O 2019 C CB . ILE A 259 ? 0.2688 0.2166 0.2232 0.0210 -0.0424 -0.0136 567 ILE A CB 2020 C CG1 . ILE A 259 ? 0.2908 0.2527 0.2618 0.0188 -0.0407 -0.0113 567 ILE A CG1 2021 C CG2 . ILE A 259 ? 0.3219 0.2641 0.2708 0.0182 -0.0510 -0.0152 567 ILE A CG2 2022 C CD1 . ILE A 259 ? 0.3044 0.2730 0.2802 0.0205 -0.0421 -0.0100 567 ILE A CD1 2023 N N . PRO A 260 ? 0.2939 0.2105 0.2157 0.0274 -0.0398 -0.0190 568 PRO A N 2024 C CA . PRO A 260 ? 0.3156 0.2147 0.2198 0.0289 -0.0425 -0.0227 568 PRO A CA 2025 C C . PRO A 260 ? 0.2980 0.1876 0.2009 0.0268 -0.0434 -0.0241 568 PRO A C 2026 O O . PRO A 260 ? 0.3477 0.2242 0.2414 0.0234 -0.0496 -0.0272 568 PRO A O 2027 C CB . PRO A 260 ? 0.3315 0.2270 0.2253 0.0367 -0.0351 -0.0229 568 PRO A CB 2028 C CG . PRO A 260 ? 0.2803 0.1897 0.1835 0.0373 -0.0322 -0.0194 568 PRO A CG 2029 C CD . PRO A 260 ? 0.2914 0.2139 0.2132 0.0326 -0.0332 -0.0171 568 PRO A CD 2030 N N . GLY A 261 ? 0.2727 0.1681 0.1844 0.0285 -0.0379 -0.0216 569 GLY A N 2031 C CA . GLY A 261 ? 0.3039 0.1898 0.2143 0.0273 -0.0382 -0.0218 569 GLY A CA 2032 C C . GLY A 261 ? 0.3235 0.2113 0.2427 0.0184 -0.0438 -0.0207 569 GLY A C 2033 O O . GLY A 261 ? 0.3391 0.2156 0.2551 0.0157 -0.0455 -0.0209 569 GLY A O 2034 N N . MET A 262 ? 0.2933 0.1953 0.2242 0.0140 -0.0460 -0.0190 570 MET A N 2035 C CA . MET A 262 ? 0.2901 0.1975 0.2325 0.0056 -0.0501 -0.0172 570 MET A CA 2036 C C . MET A 262 ? 0.2933 0.1954 0.2333 -0.0004 -0.0590 -0.0197 570 MET A C 2037 O O . MET A 262 ? 0.2785 0.1847 0.2290 -0.0082 -0.0629 -0.0182 570 MET A O 2038 C CB . MET A 262 ? 0.3098 0.2366 0.2681 0.0046 -0.0467 -0.0138 570 MET A CB 2039 C CG . MET A 262 ? 0.3212 0.2526 0.2829 0.0076 -0.0399 -0.0112 570 MET A CG 2040 S SD . MET A 262 ? 0.3231 0.2741 0.3000 0.0067 -0.0360 -0.0083 570 MET A SD 2041 C CE . MET A 262 ? 0.3245 0.2757 0.3005 0.0088 -0.0302 -0.0057 570 MET A CE 2042 N N . HIS A 263 ? 0.2808 0.1740 0.2070 0.0030 -0.0623 -0.0233 571 HIS A N 2043 C CA . HIS A 263 ? 0.3245 0.2104 0.2455 -0.0025 -0.0724 -0.0262 571 HIS A CA 2044 C C . HIS A 263 ? 0.3608 0.2300 0.2757 -0.0084 -0.0767 -0.0284 571 HIS A C 2045 O O . HIS A 263 ? 0.3744 0.2304 0.2798 -0.0048 -0.0721 -0.0293 571 HIS A O 2046 C CB . HIS A 263 ? 0.3444 0.2214 0.2475 0.0030 -0.0748 -0.0297 571 HIS A CB 2047 C CG . HIS A 263 ? 0.3438 0.2358 0.2538 0.0052 -0.0754 -0.0274 571 HIS A CG 2048 N ND1 . HIS A 263 ? 0.3471 0.2502 0.2694 -0.0004 -0.0833 -0.0260 571 HIS A ND1 2049 C CD2 . HIS A 263 ? 0.3390 0.2361 0.2459 0.0123 -0.0693 -0.0259 571 HIS A CD2 2050 C CE1 . HIS A 263 ? 0.3336 0.2469 0.2589 0.0040 -0.0820 -0.0238 571 HIS A CE1 2051 N NE2 . HIS A 263 ? 0.3324 0.2415 0.2480 0.0112 -0.0735 -0.0237 571 HIS A NE2 2052 N N . ASN A 264 ? 0.3275 0.1974 0.2487 -0.0175 -0.0859 -0.0290 572 ASN A N 2053 C CA . ASN A 264 ? 0.3556 0.2092 0.2723 -0.0252 -0.0915 -0.0309 572 ASN A CA 2054 C C . ASN A 264 ? 0.3852 0.2201 0.2801 -0.0214 -0.0936 -0.0355 572 ASN A C 2055 O O . ASN A 264 ? 0.3799 0.2164 0.2705 -0.0221 -0.0995 -0.0371 572 ASN A O 2056 C CB . ASN A 264 ? 0.3747 0.2412 0.3103 -0.0364 -0.0993 -0.0286 572 ASN A CB 2057 C CG . ASN A 264 ? 0.3796 0.2341 0.3137 -0.0445 -0.1031 -0.0289 572 ASN A CG 2058 O OD1 . ASN A 264 ? 0.4104 0.2463 0.3307 -0.0423 -0.0998 -0.0306 572 ASN A OD1 2059 N ND2 . ASN A 264 ? 0.3303 0.1962 0.2796 -0.0534 -0.1099 -0.0272 572 ASN A ND2 2060 N N . PRO A 265 ? 0.3840 0.2021 0.2658 -0.0168 -0.0882 -0.0369 573 PRO A N 2061 C CA . PRO A 265 ? 0.4115 0.2125 0.2724 -0.0117 -0.0883 -0.0410 573 PRO A CA 2062 C C . PRO A 265 ? 0.4127 0.2051 0.2700 -0.0199 -0.0974 -0.0432 573 PRO A C 2063 O O . PRO A 265 ? 0.4333 0.2135 0.2733 -0.0165 -0.0993 -0.0469 573 PRO A O 2064 C CB . PRO A 265 ? 0.4383 0.2264 0.2916 -0.0058 -0.0804 -0.0410 573 PRO A CB 2065 C CG . PRO A 265 ? 0.4478 0.2418 0.3173 -0.0117 -0.0794 -0.0368 573 PRO A CG 2066 C CD . PRO A 265 ? 0.3759 0.1903 0.2617 -0.0154 -0.0816 -0.0344 573 PRO A CD 2067 N N . ASP A 266 ? 0.3743 0.1728 0.2476 -0.0306 -0.1026 -0.0409 574 ASP A N 2068 C CA . ASP A 266 ? 0.4103 0.2026 0.2829 -0.0393 -0.1116 -0.0427 574 ASP A CA 2069 C C . ASP A 266 ? 0.4256 0.2284 0.3000 -0.0409 -0.1194 -0.0437 574 ASP A C 2070 O O . ASP A 266 ? 0.4245 0.2190 0.2912 -0.0451 -0.1271 -0.0466 574 ASP A O 2071 C CB . ASP A 266 ? 0.4448 0.2432 0.3367 -0.0507 -0.1138 -0.0390 574 ASP A CB 2072 C CG . ASP A 266 ? 0.4951 0.2868 0.3875 -0.0604 -0.1229 -0.0408 574 ASP A CG 2073 O OD1 . ASP A 266 ? 0.4740 0.2457 0.3468 -0.0583 -0.1253 -0.0455 574 ASP A OD1 2074 O OD2 . ASP A 266 ? 0.4923 0.2993 0.4053 -0.0702 -0.1275 -0.0376 574 ASP A OD2 2075 N N . LYS A 267 ? 0.3969 0.2174 0.2809 -0.0373 -0.1176 -0.0412 575 LYS A N 2076 C CA . LYS A 267 ? 0.4321 0.2650 0.3208 -0.0386 -0.1248 -0.0408 575 LYS A CA 2077 C C . LYS A 267 ? 0.4261 0.2606 0.3029 -0.0283 -0.1210 -0.0414 575 LYS A C 2078 O O . LYS A 267 ? 0.4340 0.2740 0.3089 -0.0277 -0.1265 -0.0414 575 LYS A O 2079 C CB . LYS A 267 ? 0.4179 0.2748 0.3348 -0.0457 -0.1276 -0.0361 575 LYS A CB 2080 C CG . LYS A 267 ? 0.4467 0.3054 0.3783 -0.0571 -0.1315 -0.0345 575 LYS A CG 2081 C CD . LYS A 267 ? 0.4977 0.3487 0.4232 -0.0630 -0.1415 -0.0375 575 LYS A CD 2082 C CE . LYS A 267 ? 0.5310 0.3863 0.4740 -0.0751 -0.1453 -0.0354 575 LYS A CE 2083 N NZ . LYS A 267 ? 0.5771 0.4220 0.5125 -0.0814 -0.1554 -0.0390 575 LYS A NZ 2084 N N . PHE A 268 ? 0.3796 0.2096 0.2491 -0.0204 -0.1114 -0.0415 576 PHE A N 2085 C CA . PHE A 268 ? 0.4032 0.2362 0.2635 -0.0110 -0.1063 -0.0412 576 PHE A CA 2086 C C . PHE A 268 ? 0.4400 0.2568 0.2802 -0.0021 -0.0976 -0.0437 576 PHE A C 2087 O O . PHE A 268 ? 0.4392 0.2480 0.2784 -0.0012 -0.0926 -0.0443 576 PHE A O 2088 C CB . PHE A 268 ? 0.3737 0.2261 0.2519 -0.0098 -0.1026 -0.0374 576 PHE A CB 2089 C CG . PHE A 268 ? 0.3439 0.2147 0.2425 -0.0165 -0.1101 -0.0343 576 PHE A CG 2090 C CD1 . PHE A 268 ? 0.3496 0.2291 0.2485 -0.0139 -0.1140 -0.0330 576 PHE A CD1 2091 C CD2 . PHE A 268 ? 0.3449 0.2244 0.2629 -0.0252 -0.1128 -0.0323 576 PHE A CD2 2092 C CE1 . PHE A 268 ? 0.3549 0.2525 0.2740 -0.0191 -0.1205 -0.0298 576 PHE A CE1 2093 C CE2 . PHE A 268 ? 0.3501 0.2485 0.2889 -0.0309 -0.1187 -0.0291 576 PHE A CE2 2094 C CZ . PHE A 268 ? 0.3326 0.2405 0.2724 -0.0273 -0.1226 -0.0280 576 PHE A CZ 2095 N N . GLU A 269 ? 0.4034 0.2156 0.2281 0.0046 -0.0956 -0.0448 577 GLU A N 2096 C CA . GLU A 269 ? 0.4417 0.2427 0.2499 0.0141 -0.0858 -0.0462 577 GLU A CA 2097 C C . GLU A 269 ? 0.4379 0.2499 0.2468 0.0208 -0.0795 -0.0434 577 GLU A C 2098 O O . GLU A 269 ? 0.4049 0.2208 0.2100 0.0211 -0.0832 -0.0425 577 GLU A O 2099 C CB . GLU A 269 ? 0.4951 0.2778 0.2813 0.0161 -0.0879 -0.0500 577 GLU A CB 2100 C CG . GLU A 269 ? 0.5149 0.2858 0.2857 0.0256 -0.0772 -0.0514 577 GLU A CG 2101 C CD . GLU A 269 ? 0.5581 0.3097 0.3065 0.0275 -0.0792 -0.0556 577 GLU A CD 2102 O OE1 . GLU A 269 ? 0.5772 0.3247 0.3202 0.0219 -0.0892 -0.0573 577 GLU A OE1 2103 O OE2 . GLU A 269 ? 0.5579 0.2987 0.2944 0.0347 -0.0710 -0.0571 577 GLU A OE2 2104 N N . VAL A 270 ? 0.4077 0.2248 0.2220 0.0260 -0.0701 -0.0419 578 VAL A N 2105 C CA . VAL A 270 ? 0.3961 0.2258 0.2153 0.0308 -0.0643 -0.0389 578 VAL A CA 2106 C C . VAL A 270 ? 0.3844 0.2082 0.1890 0.0400 -0.0543 -0.0387 578 VAL A C 2107 O O . VAL A 270 ? 0.3780 0.1955 0.1786 0.0447 -0.0469 -0.0395 578 VAL A O 2108 C CB . VAL A 270 ? 0.4144 0.2559 0.2510 0.0302 -0.0605 -0.0370 578 VAL A CB 2109 C CG1 . VAL A 270 ? 0.4105 0.2661 0.2539 0.0347 -0.0542 -0.0334 578 VAL A CG1 2110 C CG2 . VAL A 270 ? 0.3866 0.2351 0.2388 0.0210 -0.0694 -0.0366 578 VAL A CG2 2111 N N . PHE A 271 ? 0.3762 0.2029 0.1740 0.0424 -0.0538 -0.0369 579 PHE A N 2112 C CA . PHE A 271 ? 0.3794 0.2024 0.1647 0.0504 -0.0436 -0.0357 579 PHE A CA 2113 C C . PHE A 271 ? 0.3831 0.2206 0.1781 0.0527 -0.0382 -0.0315 579 PHE A C 2114 O O . PHE A 271 ? 0.4329 0.2777 0.2329 0.0494 -0.0443 -0.0294 579 PHE A O 2115 C CB . PHE A 271 ? 0.3888 0.2011 0.1555 0.0512 -0.0472 -0.0366 579 PHE A CB 2116 C CG . PHE A 271 ? 0.4151 0.2114 0.1693 0.0490 -0.0530 -0.0412 579 PHE A CG 2117 C CD1 . PHE A 271 ? 0.4355 0.2179 0.1712 0.0549 -0.0468 -0.0432 579 PHE A CD1 2118 C CD2 . PHE A 271 ? 0.4268 0.2220 0.1880 0.0408 -0.0644 -0.0433 579 PHE A CD2 2119 C CE1 . PHE A 271 ? 0.4716 0.2379 0.1942 0.0529 -0.0524 -0.0477 579 PHE A CE1 2120 C CE2 . PHE A 271 ? 0.4412 0.2210 0.1904 0.0382 -0.0699 -0.0474 579 PHE A CE2 2121 C CZ . PHE A 271 ? 0.4666 0.2312 0.1957 0.0444 -0.0641 -0.0499 579 PHE A CZ 2122 N N . CYS A 272 ? 0.3423 0.1846 0.1410 0.0583 -0.0270 -0.0298 580 CYS A N 2123 C CA . CYS A 272 ? 0.3342 0.1890 0.1404 0.0606 -0.0209 -0.0256 580 CYS A CA 2124 C C . CYS A 272 ? 0.3834 0.2349 0.1773 0.0664 -0.0113 -0.0229 580 CYS A C 2125 O O . CYS A 272 ? 0.4069 0.2536 0.1957 0.0712 -0.0036 -0.0236 580 CYS A O 2126 C CB . CYS A 272 ? 0.3384 0.2072 0.1669 0.0604 -0.0150 -0.0234 580 CYS A CB 2127 S SG . CYS A 272 ? 0.3716 0.2503 0.2216 0.0520 -0.0243 -0.0234 580 CYS A SG 2128 N N . TYR A 273 ? 0.3900 0.2442 0.1796 0.0660 -0.0120 -0.0194 581 TYR A N 2129 C CA . TYR A 273 ? 0.3993 0.2503 0.1771 0.0707 -0.0030 -0.0160 581 TYR A CA 2130 C C . TYR A 273 ? 0.4025 0.2666 0.1915 0.0721 0.0062 -0.0105 581 TYR A C 2131 O O . TYR A 273 ? 0.3950 0.2659 0.1916 0.0686 0.0022 -0.0067 581 TYR A O 2132 C CB . TYR A 273 ? 0.4004 0.2429 0.1636 0.0690 -0.0103 -0.0154 581 TYR A CB 2133 C CG . TYR A 273 ? 0.4256 0.2546 0.1764 0.0675 -0.0186 -0.0208 581 TYR A CG 2134 C CD1 . TYR A 273 ? 0.4595 0.2764 0.1938 0.0720 -0.0130 -0.0228 581 TYR A CD1 2135 C CD2 . TYR A 273 ? 0.4104 0.2392 0.1669 0.0614 -0.0317 -0.0236 581 TYR A CD2 2136 C CE1 . TYR A 273 ? 0.4793 0.2824 0.2010 0.0704 -0.0207 -0.0278 581 TYR A CE1 2137 C CE2 . TYR A 273 ? 0.4332 0.2497 0.1791 0.0592 -0.0393 -0.0282 581 TYR A CE2 2138 C CZ . TYR A 273 ? 0.4590 0.2619 0.1865 0.0637 -0.0339 -0.0304 581 TYR A CZ 2139 O OH . TYR A 273 ? 0.4893 0.2786 0.2049 0.0615 -0.0416 -0.0352 581 TYR A OH 2140 N N . ALA A 274 ? 0.3986 0.2682 0.1939 0.0763 0.0180 -0.0092 582 ALA A N 2141 C CA . ALA A 274 ? 0.3784 0.2636 0.1921 0.0757 0.0266 -0.0033 582 ALA A CA 2142 C C . ALA A 274 ? 0.3989 0.2812 0.1999 0.0781 0.0347 0.0019 582 ALA A C 2143 O O . ALA A 274 ? 0.4063 0.2809 0.1945 0.0820 0.0402 0.0017 582 ALA A O 2144 C CB . ALA A 274 ? 0.3521 0.2465 0.1805 0.0789 0.0350 -0.0037 582 ALA A CB 2145 N N . LEU A 275 ? 0.3459 0.2363 0.1582 0.0737 0.0341 0.0075 583 LEU A N 2146 C CA . LEU A 275 ? 0.3556 0.2431 0.1573 0.0751 0.0424 0.0137 583 LEU A CA 2147 C C . LEU A 275 ? 0.3869 0.2886 0.2072 0.0749 0.0553 0.0188 583 LEU A C 2148 O O . LEU A 275 ? 0.4695 0.3708 0.2844 0.0755 0.0644 0.0249 583 LEU A O 2149 C CB . LEU A 275 ? 0.3546 0.2400 0.1556 0.0708 0.0344 0.0175 583 LEU A CB 2150 C CG . LEU A 275 ? 0.4016 0.2756 0.1872 0.0706 0.0205 0.0135 583 LEU A CG 2151 C CD1 . LEU A 275 ? 0.4039 0.2764 0.1891 0.0680 0.0138 0.0184 583 LEU A CD1 2152 C CD2 . LEU A 275 ? 0.4172 0.2783 0.1821 0.0741 0.0205 0.0097 583 LEU A CD2 2153 N N . SER A 276 ? 0.3147 0.2292 0.1570 0.0738 0.0558 0.0167 584 SER A N 2154 C CA . SER A 276 ? 0.3495 0.2797 0.2128 0.0729 0.0661 0.0212 584 SER A CA 2155 C C . SER A 276 ? 0.3571 0.2920 0.2249 0.0789 0.0722 0.0180 584 SER A C 2156 O O . SER A 276 ? 0.3513 0.2792 0.2127 0.0815 0.0657 0.0119 584 SER A O 2157 C CB . SER A 276 ? 0.3555 0.2986 0.2443 0.0654 0.0600 0.0224 584 SER A CB 2158 O OG . SER A 276 ? 0.3935 0.3394 0.2910 0.0647 0.0516 0.0169 584 SER A OG 2159 N N . PRO A 277 ? 0.3938 0.3405 0.2731 0.0812 0.0846 0.0225 585 PRO A N 2160 C CA . PRO A 277 ? 0.3990 0.3531 0.2886 0.0865 0.0889 0.0203 585 PRO A CA 2161 C C . PRO A 277 ? 0.3425 0.3084 0.2541 0.0841 0.0821 0.0181 585 PRO A C 2162 O O . PRO A 277 ? 0.3099 0.2818 0.2343 0.0762 0.0747 0.0194 585 PRO A O 2163 C CB . PRO A 277 ? 0.4497 0.4172 0.3529 0.0865 0.1011 0.0269 585 PRO A CB 2164 C CG . PRO A 277 ? 0.4694 0.4422 0.3790 0.0798 0.1031 0.0328 585 PRO A CG 2165 C CD . PRO A 277 ? 0.4298 0.3845 0.3168 0.0778 0.0938 0.0303 585 PRO A CD 2166 N N . ASP A 278 ? 0.3395 0.3073 0.2559 0.0892 0.0822 0.0150 586 ASP A N 2167 C CA . ASP A 278 ? 0.3394 0.3173 0.2746 0.0884 0.0763 0.0133 586 ASP A CA 2168 C C . ASP A 278 ? 0.3062 0.3057 0.2692 0.0831 0.0786 0.0188 586 ASP A C 2169 O O . ASP A 278 ? 0.2961 0.3072 0.2699 0.0855 0.0885 0.0232 586 ASP A O 2170 C CB . ASP A 278 ? 0.3822 0.3576 0.3172 0.0941 0.0765 0.0107 586 ASP A CB 2171 C CG . ASP A 278 ? 0.3912 0.3731 0.3410 0.0936 0.0690 0.0088 586 ASP A CG 2172 O OD1 . ASP A 278 ? 0.3449 0.3380 0.3103 0.0891 0.0650 0.0104 586 ASP A OD1 2173 O OD2 . ASP A 278 ? 0.4235 0.3985 0.3686 0.0977 0.0671 0.0060 586 ASP A OD2 2174 N N . ASP A 279 ? 0.2805 0.2850 0.2553 0.0750 0.0688 0.0185 587 ASP A N 2175 C CA . ASP A 279 ? 0.2654 0.2884 0.2651 0.0688 0.0692 0.0229 587 ASP A CA 2176 C C . ASP A 279 ? 0.2744 0.3115 0.2936 0.0705 0.0660 0.0226 587 ASP A C 2177 O O . ASP A 279 ? 0.2699 0.3225 0.3099 0.0649 0.0641 0.0256 587 ASP A O 2178 C CB . ASP A 279 ? 0.2547 0.2755 0.2562 0.0591 0.0616 0.0232 587 ASP A CB 2179 C CG . ASP A 279 ? 0.2755 0.2903 0.2743 0.0566 0.0497 0.0182 587 ASP A CG 2180 O OD1 . ASP A 279 ? 0.2627 0.2756 0.2594 0.0612 0.0468 0.0150 587 ASP A OD1 2181 O OD2 . ASP A 279 ? 0.2506 0.2625 0.2497 0.0501 0.0439 0.0178 587 ASP A OD2 2182 N N . GLY A 280 ? 0.2594 0.2897 0.2709 0.0780 0.0648 0.0191 588 GLY A N 2183 C CA . GLY A 280 ? 0.2719 0.3133 0.2991 0.0814 0.0619 0.0193 588 GLY A CA 2184 C C . GLY A 280 ? 0.2620 0.3030 0.2935 0.0757 0.0495 0.0169 588 GLY A C 2185 O O . GLY A 280 ? 0.2557 0.3055 0.2994 0.0780 0.0458 0.0176 588 GLY A O 2186 N N . THR A 281 ? 0.2335 0.2647 0.2549 0.0689 0.0432 0.0145 589 THR A N 2187 C CA . THR A 281 ? 0.2298 0.2612 0.2550 0.0635 0.0330 0.0125 589 THR A CA 2188 C C . THR A 281 ? 0.2362 0.2536 0.2474 0.0665 0.0278 0.0086 589 THR A C 2189 O O . THR A 281 ? 0.2379 0.2422 0.2337 0.0714 0.0307 0.0064 589 THR A O 2190 C CB . THR A 281 ? 0.2205 0.2497 0.2444 0.0547 0.0290 0.0121 589 THR A CB 2191 O OG1 . THR A 281 ? 0.2190 0.2331 0.2246 0.0552 0.0292 0.0098 589 THR A OG1 2192 C CG2 . THR A 281 ? 0.2207 0.2616 0.2579 0.0504 0.0337 0.0161 589 THR A CG2 2193 N N . ASN A 282 ? 0.2272 0.2463 0.2429 0.0632 0.0201 0.0077 590 ASN A N 2194 C CA . ASN A 282 ? 0.2218 0.2283 0.2260 0.0647 0.0151 0.0048 590 ASN A CA 2195 C C . ASN A 282 ? 0.2199 0.2130 0.2096 0.0610 0.0126 0.0017 590 ASN A C 2196 O O . ASN A 282 ? 0.2452 0.2256 0.2232 0.0627 0.0103 -0.0008 590 ASN A O 2197 C CB . ASN A 282 ? 0.2074 0.2193 0.2192 0.0618 0.0082 0.0055 590 ASN A CB 2198 C CG . ASN A 282 ? 0.2485 0.2706 0.2720 0.0674 0.0088 0.0084 590 ASN A CG 2199 O OD1 . ASN A 282 ? 0.2714 0.2958 0.2976 0.0744 0.0150 0.0098 590 ASN A OD1 2200 N ND2 . ASN A 282 ? 0.2239 0.2519 0.2539 0.0650 0.0023 0.0097 590 ASN A ND2 2201 N N . PHE A 283 ? 0.2005 0.1965 0.1915 0.0558 0.0127 0.0021 591 PHE A N 2202 C CA . PHE A 283 ? 0.2088 0.1941 0.1879 0.0528 0.0100 -0.0003 591 PHE A CA 2203 C C . PHE A 283 ? 0.2454 0.2188 0.2093 0.0578 0.0133 -0.0017 591 PHE A C 2204 O O . PHE A 283 ? 0.2353 0.1969 0.1874 0.0573 0.0092 -0.0046 591 PHE A O 2205 C CB . PHE A 283 ? 0.2039 0.1940 0.1875 0.0477 0.0101 0.0011 591 PHE A CB 2206 C CG . PHE A 283 ? 0.2078 0.2080 0.2046 0.0429 0.0072 0.0018 591 PHE A CG 2207 C CD1 . PHE A 283 ? 0.2089 0.2079 0.2059 0.0399 0.0015 -0.0001 591 PHE A CD1 2208 C CD2 . PHE A 283 ? 0.2076 0.2180 0.2158 0.0412 0.0102 0.0045 591 PHE A CD2 2209 C CE1 . PHE A 283 ? 0.1950 0.2015 0.2010 0.0359 -0.0011 0.0001 591 PHE A CE1 2210 C CE2 . PHE A 283 ? 0.2060 0.2241 0.2245 0.0363 0.0065 0.0045 591 PHE A CE2 2211 C CZ . PHE A 283 ? 0.1793 0.1947 0.1954 0.0341 0.0008 0.0020 591 PHE A CZ 2212 N N . ARG A 284 ? 0.2299 0.2064 0.1940 0.0622 0.0209 0.0003 592 ARG A N 2213 C CA . ARG A 284 ? 0.2561 0.2205 0.2035 0.0679 0.0253 -0.0013 592 ARG A CA 2214 C C . ARG A 284 ? 0.2519 0.2071 0.1926 0.0734 0.0244 -0.0042 592 ARG A C 2215 O O . ARG A 284 ? 0.2784 0.2179 0.2020 0.0752 0.0225 -0.0078 592 ARG A O 2216 C CB . ARG A 284 ? 0.2851 0.2565 0.2354 0.0717 0.0354 0.0021 592 ARG A CB 2217 C CG . ARG A 284 ? 0.2897 0.2487 0.2214 0.0790 0.0421 0.0006 592 ARG A CG 2218 C CD . ARG A 284 ? 0.3087 0.2540 0.2207 0.0768 0.0392 -0.0011 592 ARG A CD 2219 N NE . ARG A 284 ? 0.3209 0.2569 0.2152 0.0833 0.0476 -0.0012 592 ARG A NE 2220 C CZ . ARG A 284 ? 0.3253 0.2594 0.2108 0.0825 0.0519 0.0017 592 ARG A CZ 2221 N NH1 . ARG A 284 ? 0.3170 0.2574 0.2107 0.0755 0.0482 0.0049 592 ARG A NH1 2222 N NH2 . ARG A 284 ? 0.3273 0.2522 0.1951 0.0884 0.0597 0.0017 592 ARG A NH2 2223 N N . VAL A 285 ? 0.2242 0.1885 0.1782 0.0758 0.0251 -0.0026 593 VAL A N 2224 C CA . VAL A 285 ? 0.2543 0.2093 0.2030 0.0815 0.0242 -0.0046 593 VAL A CA 2225 C C . VAL A 285 ? 0.2584 0.1990 0.1961 0.0770 0.0159 -0.0080 593 VAL A C 2226 O O . VAL A 285 ? 0.2646 0.1886 0.1874 0.0805 0.0153 -0.0115 593 VAL A O 2227 C CB . VAL A 285 ? 0.2690 0.2369 0.2351 0.0838 0.0239 -0.0014 593 VAL A CB 2228 C CG1 . VAL A 285 ? 0.3179 0.2746 0.2779 0.0872 0.0212 -0.0029 593 VAL A CG1 2229 C CG2 . VAL A 285 ? 0.2803 0.2635 0.2595 0.0880 0.0319 0.0023 593 VAL A CG2 2230 N N . LYS A 286 ? 0.2391 0.1859 0.1843 0.0692 0.0098 -0.0072 594 LYS A N 2231 C CA . LYS A 286 ? 0.2366 0.1736 0.1757 0.0642 0.0026 -0.0095 594 LYS A CA 2232 C C . LYS A 286 ? 0.2379 0.1613 0.1613 0.0626 0.0001 -0.0130 594 LYS A C 2233 O O . LYS A 286 ? 0.2784 0.1876 0.1914 0.0622 -0.0037 -0.0159 594 LYS A O 2234 C CB . LYS A 286 ? 0.2490 0.1969 0.1996 0.0569 -0.0018 -0.0078 594 LYS A CB 2235 C CG . LYS A 286 ? 0.2589 0.1996 0.2064 0.0516 -0.0081 -0.0091 594 LYS A CG 2236 C CD . LYS A 286 ? 0.2847 0.2364 0.2424 0.0453 -0.0108 -0.0076 594 LYS A CD 2237 C CE . LYS A 286 ? 0.3085 0.2549 0.2648 0.0401 -0.0156 -0.0081 594 LYS A CE 2238 N NZ . LYS A 286 ? 0.3164 0.2579 0.2719 0.0416 -0.0162 -0.0066 594 LYS A NZ 2239 N N . VAL A 287 ? 0.2249 0.1520 0.1462 0.0612 0.0016 -0.0126 595 VAL A N 2240 C CA . VAL A 287 ? 0.2543 0.1692 0.1600 0.0598 -0.0020 -0.0156 595 VAL A CA 2241 C C . VAL A 287 ? 0.2975 0.1962 0.1850 0.0663 0.0011 -0.0189 595 VAL A C 2242 O O . VAL A 287 ? 0.3230 0.2066 0.1966 0.0649 -0.0044 -0.0228 595 VAL A O 2243 C CB . VAL A 287 ? 0.2990 0.2203 0.2051 0.0578 -0.0009 -0.0136 595 VAL A CB 2244 C CG1 . VAL A 287 ? 0.3388 0.2469 0.2270 0.0573 -0.0053 -0.0163 595 VAL A CG1 2245 C CG2 . VAL A 287 ? 0.3264 0.2602 0.2482 0.0516 -0.0046 -0.0113 595 VAL A CG2 2246 N N . MET A 288 ? 0.3263 0.2281 0.2143 0.0736 0.0100 -0.0175 596 MET A N 2247 C CA . MET A 288 ? 0.3362 0.2253 0.2094 0.0794 0.0140 -0.0198 596 MET A CA 2248 C C . MET A 288 ? 0.3480 0.2268 0.2189 0.0790 0.0096 -0.0220 596 MET A C 2249 O O . MET A 288 ? 0.3733 0.2371 0.2290 0.0799 0.0081 -0.0250 596 MET A O 2250 C CB . MET A 288 ? 0.3568 0.2566 0.2371 0.0856 0.0246 -0.0162 596 MET A CB 2251 C CG . MET A 288 ? 0.3652 0.2726 0.2452 0.0860 0.0302 -0.0136 596 MET A CG 2252 S SD . MET A 288 ? 0.3940 0.3147 0.2839 0.0922 0.0432 -0.0089 596 MET A SD 2253 C CE . MET A 288 ? 0.5744 0.4778 0.4444 0.0978 0.0459 -0.0120 596 MET A CE 2254 N N . ALA A 289 ? 0.3288 0.2148 0.2141 0.0775 0.0074 -0.0202 597 ALA A N 2255 C CA . ALA A 289 ? 0.3459 0.2220 0.2295 0.0772 0.0039 -0.0212 597 ALA A CA 2256 C C . ALA A 289 ? 0.3506 0.2137 0.2264 0.0700 -0.0053 -0.0243 597 ALA A C 2257 O O . ALA A 289 ? 0.3696 0.2189 0.2377 0.0690 -0.0083 -0.0262 597 ALA A O 2258 C CB . ALA A 289 ? 0.3472 0.2355 0.2480 0.0788 0.0050 -0.0172 597 ALA A CB 2259 N N . GLU A 290 ? 0.3051 0.1727 0.1840 0.0646 -0.0099 -0.0247 598 GLU A N 2260 C CA . GLU A 290 ? 0.3140 0.1760 0.1927 0.0557 -0.0188 -0.0259 598 GLU A CA 2261 C C . GLU A 290 ? 0.3653 0.2177 0.2306 0.0518 -0.0246 -0.0298 598 GLU A C 2262 O O . GLU A 290 ? 0.3647 0.2076 0.2263 0.0453 -0.0323 -0.0320 598 GLU A O 2263 C CB . GLU A 290 ? 0.3020 0.1821 0.1996 0.0494 -0.0206 -0.0217 598 GLU A CB 2264 C CG . GLU A 290 ? 0.3222 0.2097 0.2306 0.0525 -0.0169 -0.0181 598 GLU A CG 2265 C CD . GLU A 290 ? 0.3281 0.2299 0.2513 0.0461 -0.0191 -0.0147 598 GLU A CD 2266 O OE1 . GLU A 290 ? 0.3069 0.2145 0.2340 0.0400 -0.0224 -0.0149 598 GLU A OE1 2267 O OE2 . GLU A 290 ? 0.3191 0.2259 0.2494 0.0477 -0.0175 -0.0117 598 GLU A OE2 2268 N N . ALA A 291 ? 0.3382 0.1928 0.1962 0.0554 -0.0213 -0.0302 599 ALA A N 2269 C CA . ALA A 291 ? 0.3765 0.2208 0.2190 0.0528 -0.0272 -0.0334 599 ALA A CA 2270 C C . ALA A 291 ? 0.4007 0.2289 0.2292 0.0542 -0.0278 -0.0360 599 ALA A C 2271 O O . ALA A 291 ? 0.4040 0.2295 0.2315 0.0600 -0.0209 -0.0354 599 ALA A O 2272 C CB . ALA A 291 ? 0.3729 0.2228 0.2097 0.0568 -0.0226 -0.0321 599 ALA A CB 2273 N N . ASN A 292 ? 0.4091 0.2270 0.2275 0.0488 -0.0362 -0.0388 600 ASN A N 2274 C CA . ASN A 292 ? 0.4289 0.2297 0.2320 0.0500 -0.0372 -0.0418 600 ASN A CA 2275 C C . ASN A 292 ? 0.4484 0.2453 0.2378 0.0584 -0.0291 -0.0419 600 ASN A C 2276 O O . ASN A 292 ? 0.4567 0.2432 0.2369 0.0634 -0.0245 -0.0434 600 ASN A O 2277 C CB . ASN A 292 ? 0.4830 0.2748 0.2796 0.0417 -0.0487 -0.0446 600 ASN A CB 2278 C CG . ASN A 292 ? 0.5070 0.3035 0.3187 0.0326 -0.0562 -0.0439 600 ASN A CG 2279 O OD1 . ASN A 292 ? 0.4784 0.2841 0.2985 0.0265 -0.0630 -0.0431 600 ASN A OD1 2280 N ND2 . ASN A 292 ? 0.5494 0.3402 0.3654 0.0318 -0.0546 -0.0438 600 ASN A ND2 2281 N N . HIS A 293 ? 0.4284 0.2335 0.2166 0.0599 -0.0272 -0.0401 601 HIS A N 2282 C CA . HIS A 293 ? 0.4756 0.2786 0.2519 0.0673 -0.0185 -0.0392 601 HIS A CA 2283 C C . HIS A 293 ? 0.4516 0.2706 0.2375 0.0698 -0.0122 -0.0350 601 HIS A C 2284 O O . HIS A 293 ? 0.4215 0.2487 0.2149 0.0651 -0.0175 -0.0338 601 HIS A O 2285 C CB . HIS A 293 ? 0.5080 0.2974 0.2646 0.0661 -0.0240 -0.0419 601 HIS A CB 2286 C CG . HIS A 293 ? 0.5315 0.3048 0.2787 0.0622 -0.0318 -0.0464 601 HIS A CG 2287 N ND1 . HIS A 293 ? 0.5621 0.3221 0.2983 0.0670 -0.0273 -0.0489 601 HIS A ND1 2288 C CD2 . HIS A 293 ? 0.5534 0.3222 0.3015 0.0537 -0.0438 -0.0485 601 HIS A CD2 2289 C CE1 . HIS A 293 ? 0.5970 0.3435 0.3264 0.0615 -0.0363 -0.0527 601 HIS A CE1 2290 N NE2 . HIS A 293 ? 0.5858 0.3380 0.3230 0.0530 -0.0463 -0.0524 601 HIS A NE2 2291 N N . PHE A 294 ? 0.4451 0.2689 0.2315 0.0769 -0.0008 -0.0326 602 PHE A N 2292 C CA . PHE A 294 ? 0.4330 0.2714 0.2281 0.0791 0.0062 -0.0282 602 PHE A CA 2293 C C . PHE A 294 ? 0.4426 0.2773 0.2245 0.0847 0.0149 -0.0265 602 PHE A C 2294 O O . PHE A 294 ? 0.4493 0.2804 0.2275 0.0905 0.0223 -0.0268 602 PHE A O 2295 C CB . PHE A 294 ? 0.4075 0.2610 0.2234 0.0811 0.0125 -0.0254 602 PHE A CB 2296 C CG . PHE A 294 ? 0.3775 0.2467 0.2054 0.0811 0.0175 -0.0211 602 PHE A CG 2297 C CD1 . PHE A 294 ? 0.3916 0.2688 0.2311 0.0763 0.0120 -0.0208 602 PHE A CD1 2298 C CD2 . PHE A 294 ? 0.4150 0.2904 0.2426 0.0857 0.0280 -0.0174 602 PHE A CD2 2299 C CE1 . PHE A 294 ? 0.3737 0.2667 0.2274 0.0744 0.0157 -0.0157 602 PHE A CE1 2300 C CE2 . PHE A 294 ? 0.3896 0.2789 0.2285 0.0849 0.0328 -0.0131 602 PHE A CE2 2301 C CZ . PHE A 294 ? 0.3824 0.2801 0.2344 0.0790 0.0262 -0.0123 602 PHE A CZ 2302 N N . ILE A 295 ? 0.4375 0.2731 0.2126 0.0833 0.0140 -0.0245 603 ILE A N 2303 C CA . ILE A 295 ? 0.4445 0.2747 0.2047 0.0877 0.0213 -0.0227 603 ILE A CA 2304 C C . ILE A 295 ? 0.4493 0.2937 0.2190 0.0889 0.0299 -0.0167 603 ILE A C 2305 O O . ILE A 295 ? 0.4102 0.2609 0.1856 0.0847 0.0255 -0.0147 603 ILE A O 2306 C CB . ILE A 295 ? 0.4720 0.2881 0.2123 0.0849 0.0123 -0.0250 603 ILE A CB 2307 C CG1 . ILE A 295 ? 0.4828 0.2844 0.2139 0.0826 0.0030 -0.0308 603 ILE A CG1 2308 C CG2 . ILE A 295 ? 0.4812 0.2912 0.2050 0.0898 0.0204 -0.0229 603 ILE A CG2 2309 C CD1 . ILE A 295 ? 0.4969 0.3017 0.2392 0.0750 -0.0093 -0.0327 603 ILE A CD1 2310 N N . ASP A 296 ? 0.4920 0.3417 0.2644 0.0943 0.0423 -0.0137 604 ASP A N 2311 C CA . ASP A 296 ? 0.4772 0.3409 0.2603 0.0947 0.0516 -0.0075 604 ASP A CA 2312 C C . ASP A 296 ? 0.4822 0.3377 0.2471 0.0955 0.0545 -0.0049 604 ASP A C 2313 O O . ASP A 296 ? 0.5186 0.3693 0.2735 0.1003 0.0628 -0.0041 604 ASP A O 2314 C CB . ASP A 296 ? 0.4943 0.3707 0.2935 0.0993 0.0632 -0.0048 604 ASP A CB 2315 C CG . ASP A 296 ? 0.5340 0.4270 0.3484 0.0983 0.0726 0.0021 604 ASP A CG 2316 O OD1 . ASP A 296 ? 0.4832 0.3764 0.2942 0.0944 0.0707 0.0049 604 ASP A OD1 2317 O OD2 . ASP A 296 ? 0.5667 0.4728 0.3974 0.1012 0.0816 0.0049 604 ASP A OD2 2318 N N . LEU A 297 ? 0.4570 0.3110 0.2176 0.0909 0.0475 -0.0033 605 LEU A N 2319 C CA . LEU A 297 ? 0.4600 0.3058 0.2032 0.0912 0.0486 -0.0005 605 LEU A CA 2320 C C . LEU A 297 ? 0.4749 0.3312 0.2256 0.0920 0.0611 0.0070 605 LEU A C 2321 O O . LEU A 297 ? 0.5061 0.3562 0.2430 0.0927 0.0646 0.0103 605 LEU A O 2322 C CB . LEU A 297 ? 0.4759 0.3161 0.2125 0.0861 0.0352 -0.0013 605 LEU A CB 2323 C CG . LEU A 297 ? 0.4729 0.3008 0.1989 0.0844 0.0222 -0.0081 605 LEU A CG 2324 C CD1 . LEU A 297 ? 0.4718 0.2974 0.1942 0.0794 0.0095 -0.0076 605 LEU A CD1 2325 C CD2 . LEU A 297 ? 0.4881 0.3015 0.1939 0.0887 0.0251 -0.0112 605 LEU A CD2 2326 N N . SER A 298 ? 0.4633 0.3358 0.2366 0.0913 0.0678 0.0099 606 SER A N 2327 C CA . SER A 298 ? 0.5031 0.3872 0.2871 0.0911 0.0800 0.0173 606 SER A CA 2328 C C . SER A 298 ? 0.5357 0.4173 0.3119 0.0966 0.0910 0.0182 606 SER A C 2329 O O . SER A 298 ? 0.5228 0.4092 0.3005 0.0964 0.1009 0.0243 606 SER A O 2330 C CB . SER A 298 ? 0.4801 0.3832 0.2920 0.0887 0.0840 0.0198 606 SER A CB 2331 O OG . SER A 298 ? 0.5102 0.4203 0.3335 0.0927 0.0880 0.0170 606 SER A OG 2332 N N . GLN A 299 ? 0.5392 0.4124 0.3068 0.1012 0.0894 0.0124 607 GLN A N 2333 C CA . GLN A 299 ? 0.5932 0.4615 0.3502 0.1074 0.0992 0.0123 607 GLN A CA 2334 C C . GLN A 299 ? 0.6007 0.4502 0.3285 0.1088 0.0968 0.0109 607 GLN A C 2335 O O . GLN A 299 ? 0.5889 0.4314 0.3034 0.1142 0.1046 0.0105 607 GLN A O 2336 C CB . GLN A 299 ? 0.6063 0.4724 0.3661 0.1121 0.0986 0.0068 607 GLN A CB 2337 C CG . GLN A 299 ? 0.6254 0.5093 0.4133 0.1111 0.0995 0.0077 607 GLN A CG 2338 C CD . GLN A 299 ? 0.6724 0.5765 0.4821 0.1101 0.1107 0.0150 607 GLN A CD 2339 O OE1 . GLN A 299 ? 0.6917 0.6093 0.5206 0.1050 0.1089 0.0179 607 GLN A OE1 2340 N NE2 . GLN A 299 ? 0.6730 0.5793 0.4803 0.1146 0.1225 0.0179 607 GLN A NE2 2341 N N . ILE A 300 ? 0.5841 0.4256 0.3020 0.1043 0.0856 0.0101 608 ILE A N 2342 C CA . ILE A 300 ? 0.6295 0.4538 0.3204 0.1050 0.0810 0.0088 608 ILE A CA 2343 C C . ILE A 300 ? 0.6358 0.4621 0.3252 0.1006 0.0792 0.0149 608 ILE A C 2344 O O . ILE A 300 ? 0.6124 0.4354 0.3001 0.0963 0.0669 0.0137 608 ILE A O 2345 C CB . ILE A 300 ? 0.6142 0.4244 0.2922 0.1038 0.0661 0.0011 608 ILE A CB 2346 C CG1 . ILE A 300 ? 0.6443 0.4525 0.3263 0.1073 0.0670 -0.0044 608 ILE A CG1 2347 C CG2 . ILE A 300 ? 0.5942 0.3866 0.2439 0.1049 0.0614 -0.0006 608 ILE A CG2 2348 C CD1 . ILE A 300 ? 0.6558 0.4500 0.3265 0.1052 0.0530 -0.0117 608 ILE A CD1 2349 N N . PRO A 301 ? 0.6953 0.5273 0.3862 0.1014 0.0916 0.0218 609 PRO A N 2350 C CA . PRO A 301 ? 0.7140 0.5484 0.4054 0.0971 0.0920 0.0289 609 PRO A CA 2351 C C . PRO A 301 ? 0.7482 0.5668 0.4159 0.0961 0.0810 0.0279 609 PRO A C 2352 O O . PRO A 301 ? 0.7579 0.5775 0.4289 0.0917 0.0738 0.0313 609 PRO A O 2353 C CB . PRO A 301 ? 0.7688 0.6086 0.4612 0.0992 0.1084 0.0353 609 PRO A CB 2354 C CG . PRO A 301 ? 0.7753 0.6241 0.4806 0.1034 0.1167 0.0325 609 PRO A CG 2355 C CD . PRO A 301 ? 0.7536 0.5911 0.4480 0.1064 0.1065 0.0235 609 PRO A CD 2356 N N . CYS A 302 ? 0.7396 0.5437 0.3841 0.1003 0.0796 0.0234 610 CYS A N 2357 C CA . CYS A 302 ? 0.7495 0.5389 0.3709 0.0996 0.0690 0.0224 610 CYS A CA 2358 C C . CYS A 302 ? 0.7276 0.5148 0.3524 0.0957 0.0515 0.0174 610 CYS A C 2359 O O . CYS A 302 ? 0.7160 0.5010 0.3432 0.0962 0.0459 0.0105 610 CYS A O 2360 C CB . CYS A 302 ? 0.7754 0.5494 0.3704 0.1050 0.0721 0.0186 610 CYS A CB 2361 S SG . CYS A 302 ? 0.8151 0.5710 0.3810 0.1040 0.0577 0.0167 610 CYS A SG 2362 N N . ASN A 303 ? 0.7025 0.4905 0.3281 0.0919 0.0429 0.0212 611 ASN A N 2363 C CA . ASN A 303 ? 0.6460 0.4340 0.2771 0.0880 0.0263 0.0173 611 ASN A CA 2364 C C . ASN A 303 ? 0.6414 0.4155 0.2528 0.0887 0.0151 0.0105 611 ASN A C 2365 O O . ASN A 303 ? 0.6307 0.4054 0.2489 0.0857 0.0030 0.0053 611 ASN A O 2366 C CB . ASN A 303 ? 0.6337 0.4264 0.2713 0.0845 0.0204 0.0237 611 ASN A CB 2367 C CG . ASN A 303 ? 0.6198 0.4263 0.2805 0.0824 0.0281 0.0291 611 ASN A CG 2368 O OD1 . ASN A 303 ? 0.6420 0.4575 0.3196 0.0816 0.0301 0.0262 611 ASN A OD1 2369 N ND2 . ASN A 303 ? 0.6252 0.4329 0.2863 0.0812 0.0323 0.0371 611 ASN A ND2 2370 N N . GLY A 304 ? 0.6414 0.4028 0.2284 0.0923 0.0192 0.0108 612 GLY A N 2371 C CA . GLY A 304 ? 0.6888 0.4353 0.2547 0.0933 0.0098 0.0043 612 GLY A CA 2372 C C . GLY A 304 ? 0.6778 0.4206 0.2451 0.0950 0.0116 -0.0032 612 GLY A C 2373 O O . GLY A 304 ? 0.6771 0.4143 0.2426 0.0924 -0.0005 -0.0094 612 GLY A O 2374 N N . LYS A 305 ? 0.6844 0.4306 0.2558 0.0993 0.0268 -0.0021 613 LYS A N 2375 C CA . LYS A 305 ? 0.6983 0.4419 0.2728 0.1019 0.0298 -0.0082 613 LYS A CA 2376 C C . LYS A 305 ? 0.6370 0.3915 0.2362 0.0975 0.0226 -0.0107 613 LYS A C 2377 O O . LYS A 305 ? 0.6466 0.3950 0.2452 0.0967 0.0160 -0.0171 613 LYS A O 2378 C CB . LYS A 305 ? 0.7581 0.5056 0.3344 0.1078 0.0481 -0.0055 613 LYS A CB 2379 C CG . LYS A 305 ? 0.8473 0.5834 0.3981 0.1126 0.0565 -0.0034 613 LYS A CG 2380 C CD . LYS A 305 ? 0.8896 0.6315 0.4447 0.1185 0.0750 -0.0006 613 LYS A CD 2381 C CE . LYS A 305 ? 0.9707 0.7015 0.5001 0.1231 0.0840 0.0020 613 LYS A CE 2382 N NZ . LYS A 305 ? 1.0019 0.7394 0.5366 0.1290 0.1024 0.0047 613 LYS A NZ 2383 N N . ALA A 306 ? 0.5759 0.3457 0.1958 0.0946 0.0241 -0.0056 614 ALA A N 2384 C CA . ALA A 306 ? 0.5365 0.3172 0.1792 0.0905 0.0177 -0.0075 614 ALA A CA 2385 C C . ALA A 306 ? 0.5572 0.3331 0.1980 0.0852 0.0002 -0.0116 614 ALA A C 2386 O O . ALA A 306 ? 0.5737 0.3500 0.2232 0.0827 -0.0064 -0.0165 614 ALA A O 2387 C CB . ALA A 306 ? 0.5116 0.3085 0.1747 0.0886 0.0232 -0.0009 614 ALA A CB 2388 N N . ALA A 307 ? 0.5995 0.3716 0.2300 0.0834 -0.0073 -0.0092 615 ALA A N 2389 C CA . ALA A 307 ? 0.6111 0.3800 0.2405 0.0784 -0.0241 -0.0126 615 ALA A CA 2390 C C . ALA A 307 ? 0.6279 0.3820 0.2412 0.0786 -0.0298 -0.0198 615 ALA A C 2391 O O . ALA A 307 ? 0.6105 0.3644 0.2307 0.0738 -0.0415 -0.0242 615 ALA A O 2392 C CB . ALA A 307 ? 0.6336 0.4016 0.2546 0.0774 -0.0305 -0.0080 615 ALA A CB 2393 N N . ASP A 308 ? 0.6480 0.3894 0.2399 0.0840 -0.0214 -0.0210 616 ASP A N 2394 C CA . ASP A 308 ? 0.6514 0.3768 0.2263 0.0848 -0.0254 -0.0280 616 ASP A CA 2395 C C . ASP A 308 ? 0.6227 0.3511 0.2130 0.0836 -0.0249 -0.0322 616 ASP A C 2396 O O . ASP A 308 ? 0.6485 0.3687 0.2357 0.0801 -0.0350 -0.0378 616 ASP A O 2397 C CB . ASP A 308 ? 0.6953 0.4075 0.2457 0.0919 -0.0139 -0.0282 616 ASP A CB 2398 C CG . ASP A 308 ? 0.7520 0.4561 0.2808 0.0926 -0.0172 -0.0256 616 ASP A CG 2399 O OD1 . ASP A 308 ? 0.7683 0.4640 0.2783 0.0984 -0.0063 -0.0240 616 ASP A OD1 2400 O OD2 . ASP A 308 ? 0.7720 0.4785 0.3029 0.0876 -0.0305 -0.0247 616 ASP A OD2 2401 N N . ARG A 309 ? 0.6005 0.3407 0.2076 0.0863 -0.0134 -0.0291 617 ARG A N 2402 C CA . ARG A 309 ? 0.6334 0.3776 0.2557 0.0859 -0.0116 -0.0322 617 ARG A CA 2403 C C . ARG A 309 ? 0.6169 0.3682 0.2565 0.0783 -0.0249 -0.0339 617 ARG A C 2404 O O . ARG A 309 ? 0.6099 0.3560 0.2523 0.0758 -0.0303 -0.0386 617 ARG A O 2405 C CB . ARG A 309 ? 0.6406 0.3984 0.2788 0.0900 0.0028 -0.0277 617 ARG A CB 2406 C CG . ARG A 309 ? 0.6594 0.4225 0.3139 0.0901 0.0049 -0.0300 617 ARG A CG 2407 C CD . ARG A 309 ? 0.7251 0.4730 0.3653 0.0940 0.0069 -0.0354 617 ARG A CD 2408 N NE . ARG A 309 ? 0.7468 0.5004 0.4032 0.0947 0.0097 -0.0368 617 ARG A NE 2409 C CZ . ARG A 309 ? 0.7291 0.4923 0.3966 0.1002 0.0225 -0.0339 617 ARG A CZ 2410 N NH1 . ARG A 309 ? 0.7289 0.4970 0.4109 0.1006 0.0236 -0.0351 617 ARG A NH1 2411 N NH2 . ARG A 309 ? 0.6920 0.4605 0.3566 0.1049 0.0340 -0.0295 617 ARG A NH2 2412 N N . ILE A 310 ? 0.5774 0.3406 0.2289 0.0746 -0.0298 -0.0298 618 ILE A N 2413 C CA . ILE A 310 ? 0.5254 0.2970 0.1940 0.0675 -0.0421 -0.0308 618 ILE A CA 2414 C C . ILE A 310 ? 0.5563 0.3170 0.2146 0.0628 -0.0560 -0.0355 618 ILE A C 2415 O O . ILE A 310 ? 0.5807 0.3419 0.2490 0.0577 -0.0636 -0.0389 618 ILE A O 2416 C CB . ILE A 310 ? 0.5038 0.2894 0.1853 0.0654 -0.0447 -0.0252 618 ILE A CB 2417 C CG1 . ILE A 310 ? 0.5142 0.3118 0.2095 0.0685 -0.0322 -0.0208 618 ILE A CG1 2418 C CG2 . ILE A 310 ? 0.4631 0.2571 0.1611 0.0582 -0.0583 -0.0262 618 ILE A CG2 2419 C CD1 . ILE A 310 ? 0.5251 0.3339 0.2299 0.0674 -0.0327 -0.0146 618 ILE A CD1 2420 N N . HIS A 311 ? 0.5856 0.3362 0.2235 0.0642 -0.0592 -0.0355 619 HIS A N 2421 C CA . HIS A 311 ? 0.6223 0.3626 0.2490 0.0596 -0.0730 -0.0398 619 HIS A CA 2422 C C . HIS A 311 ? 0.6653 0.3903 0.2807 0.0599 -0.0729 -0.0462 619 HIS A C 2423 O O . HIS A 311 ? 0.6565 0.3771 0.2737 0.0538 -0.0845 -0.0502 619 HIS A O 2424 C CB . HIS A 311 ? 0.6539 0.3861 0.2591 0.0619 -0.0757 -0.0382 619 HIS A CB 2425 C CG . HIS A 311 ? 0.7000 0.4205 0.2911 0.0576 -0.0898 -0.0428 619 HIS A CG 2426 N ND1 . HIS A 311 ? 0.7538 0.4545 0.3187 0.0603 -0.0890 -0.0477 619 HIS A ND1 2427 C CD2 . HIS A 311 ? 0.7145 0.4409 0.3145 0.0507 -0.1050 -0.0432 619 HIS A CD2 2428 C CE1 . HIS A 311 ? 0.7726 0.4666 0.3300 0.0549 -0.1037 -0.0512 619 HIS A CE1 2429 N NE2 . HIS A 311 ? 0.7478 0.4580 0.3272 0.0489 -0.1137 -0.0483 619 HIS A NE2 2430 N N . GLN A 312 ? 0.7069 0.4241 0.3114 0.0669 -0.0597 -0.0469 620 GLN A N 2431 C CA . GLN A 312 ? 0.7557 0.4581 0.3497 0.0686 -0.0578 -0.0526 620 GLN A CA 2432 C C . GLN A 312 ? 0.6918 0.4005 0.3067 0.0633 -0.0622 -0.0544 620 GLN A C 2433 O O . GLN A 312 ? 0.6416 0.3384 0.2507 0.0600 -0.0688 -0.0595 620 GLN A O 2434 C CB . GLN A 312 ? 0.8175 0.5156 0.4021 0.0778 -0.0412 -0.0516 620 GLN A CB 2435 C CG . GLN A 312 ? 0.9102 0.5959 0.4887 0.0806 -0.0373 -0.0566 620 GLN A CG 2436 C CD . GLN A 312 ? 0.9567 0.6436 0.5333 0.0898 -0.0202 -0.0546 620 GLN A CD 2437 O OE1 . GLN A 312 ? 1.0241 0.7033 0.5820 0.0958 -0.0124 -0.0541 620 GLN A OE1 2438 N NE2 . GLN A 312 ? 0.9111 0.6086 0.5078 0.0910 -0.0141 -0.0533 620 GLN A NE2 2439 N N . ASP A 313 ? 0.6412 0.3678 0.2796 0.0622 -0.0588 -0.0503 621 ASP A N 2440 C CA . ASP A 313 ? 0.6133 0.3470 0.2719 0.0573 -0.0621 -0.0513 621 ASP A CA 2441 C C . ASP A 313 ? 0.5853 0.3215 0.2527 0.0477 -0.0776 -0.0529 621 ASP A C 2442 O O . ASP A 313 ? 0.6053 0.3440 0.2864 0.0426 -0.0818 -0.0544 621 ASP A O 2443 C CB . ASP A 313 ? 0.5865 0.3383 0.2664 0.0590 -0.0539 -0.0465 621 ASP A CB 2444 C CG . ASP A 313 ? 0.6262 0.3772 0.3028 0.0675 -0.0387 -0.0453 621 ASP A CG 2445 O OD1 . ASP A 313 ? 0.6538 0.3906 0.3156 0.0715 -0.0349 -0.0488 621 ASP A OD1 2446 O OD2 . ASP A 313 ? 0.6275 0.3924 0.3168 0.0701 -0.0307 -0.0408 621 ASP A OD2 2447 N N . GLY A 314 ? 0.5595 0.2958 0.2199 0.0453 -0.0860 -0.0521 622 GLY A N 2448 C CA . GLY A 314 ? 0.5577 0.2973 0.2263 0.0365 -0.1011 -0.0534 622 GLY A CA 2449 C C . GLY A 314 ? 0.5515 0.3123 0.2483 0.0315 -0.1048 -0.0494 622 GLY A C 2450 O O . GLY A 314 ? 0.5382 0.3043 0.2492 0.0237 -0.1144 -0.0505 622 GLY A O 2451 N N . ILE A 315 ? 0.4598 0.2326 0.1646 0.0359 -0.0970 -0.0447 623 ILE A N 2452 C CA . ILE A 315 ? 0.4285 0.2210 0.1589 0.0324 -0.0990 -0.0407 623 ILE A CA 2453 C C . ILE A 315 ? 0.4893 0.2910 0.2294 0.0262 -0.1125 -0.0393 623 ILE A C 2454 O O . ILE A 315 ? 0.4776 0.2759 0.2055 0.0276 -0.1171 -0.0383 623 ILE A O 2455 C CB . ILE A 315 ? 0.4577 0.2592 0.1914 0.0386 -0.0886 -0.0358 623 ILE A CB 2456 C CG1 . ILE A 315 ? 0.4757 0.2710 0.2026 0.0448 -0.0750 -0.0367 623 ILE A CG1 2457 C CG2 . ILE A 315 ? 0.4684 0.2894 0.2277 0.0353 -0.0908 -0.0321 623 ILE A CG2 2458 C CD1 . ILE A 315 ? 0.4885 0.2861 0.2288 0.0424 -0.0733 -0.0388 623 ILE A CD1 2459 N N . HIS A 316 ? 0.4729 0.2868 0.2355 0.0195 -0.1185 -0.0389 624 HIS A N 2460 C CA . HIS A 316 ? 0.4846 0.3111 0.2617 0.0137 -0.1304 -0.0369 624 HIS A CA 2461 C C . HIS A 316 ? 0.4516 0.2965 0.2458 0.0161 -0.1282 -0.0311 624 HIS A C 2462 O O . HIS A 316 ? 0.4578 0.3093 0.2536 0.0165 -0.1345 -0.0281 624 HIS A O 2463 C CB . HIS A 316 ? 0.4785 0.3105 0.2732 0.0051 -0.1373 -0.0388 624 HIS A CB 2464 C CG . HIS A 316 ? 0.4955 0.3093 0.2749 0.0017 -0.1410 -0.0443 624 HIS A CG 2465 N ND1 . HIS A 316 ? 0.4946 0.2972 0.2689 0.0025 -0.1340 -0.0473 624 HIS A ND1 2466 C CD2 . HIS A 316 ? 0.5325 0.3366 0.3000 -0.0021 -0.1513 -0.0473 624 HIS A CD2 2467 C CE1 . HIS A 316 ? 0.5114 0.2977 0.2712 -0.0007 -0.1395 -0.0519 624 HIS A CE1 2468 N NE2 . HIS A 316 ? 0.5450 0.3317 0.3001 -0.0038 -0.1501 -0.0523 624 HIS A NE2 2469 N N . ILE A 317 ? 0.4306 0.2831 0.2372 0.0179 -0.1197 -0.0296 625 ILE A N 2470 C CA . ILE A 317 ? 0.4249 0.2934 0.2473 0.0204 -0.1167 -0.0243 625 ILE A CA 2471 C C . ILE A 317 ? 0.4240 0.2885 0.2380 0.0273 -0.1040 -0.0230 625 ILE A C 2472 O O . ILE A 317 ? 0.3872 0.2490 0.2023 0.0279 -0.0970 -0.0250 625 ILE A O 2473 C CB . ILE A 317 ? 0.4432 0.3287 0.2934 0.0152 -0.1192 -0.0230 625 ILE A CB 2474 C CG1 . ILE A 317 ? 0.4592 0.3519 0.3212 0.0082 -0.1314 -0.0234 625 ILE A CG1 2475 C CG2 . ILE A 317 ? 0.4192 0.3195 0.2845 0.0190 -0.1146 -0.0180 625 ILE A CG2 2476 C CD1 . ILE A 317 ? 0.4488 0.3592 0.3391 0.0028 -0.1331 -0.0217 625 ILE A CD1 2477 N N . LEU A 318 ? 0.4118 0.2759 0.2171 0.0324 -0.1009 -0.0192 626 LEU A N 2478 C CA . LEU A 318 ? 0.3843 0.2457 0.1825 0.0384 -0.0885 -0.0171 626 LEU A CA 2479 C C . LEU A 318 ? 0.3623 0.2388 0.1792 0.0395 -0.0862 -0.0120 626 LEU A C 2480 O O . LEU A 318 ? 0.3813 0.2652 0.2054 0.0394 -0.0919 -0.0083 626 LEU A O 2481 C CB . LEU A 318 ? 0.4004 0.2498 0.1754 0.0433 -0.0850 -0.0157 626 LEU A CB 2482 C CG . LEU A 318 ? 0.4142 0.2583 0.1787 0.0491 -0.0709 -0.0141 626 LEU A CG 2483 C CD1 . LEU A 318 ? 0.3703 0.2062 0.1289 0.0501 -0.0647 -0.0189 626 LEU A CD1 2484 C CD2 . LEU A 318 ? 0.4607 0.2952 0.2047 0.0532 -0.0680 -0.0115 626 LEU A CD2 2485 N N . VAL A 319 ? 0.3275 0.2081 0.1518 0.0410 -0.0779 -0.0117 627 VAL A N 2486 C CA . VAL A 319 ? 0.3215 0.2160 0.1649 0.0416 -0.0762 -0.0076 627 VAL A CA 2487 C C . VAL A 319 ? 0.3544 0.2474 0.1920 0.0468 -0.0659 -0.0032 627 VAL A C 2488 O O . VAL A 319 ? 0.3671 0.2555 0.1973 0.0492 -0.0568 -0.0040 627 VAL A O 2489 C CB . VAL A 319 ? 0.3343 0.2369 0.1942 0.0384 -0.0759 -0.0099 627 VAL A CB 2490 C CG1 . VAL A 319 ? 0.3145 0.2320 0.1962 0.0389 -0.0721 -0.0059 627 VAL A CG1 2491 C CG2 . VAL A 319 ? 0.3127 0.2178 0.1807 0.0321 -0.0858 -0.0132 627 VAL A CG2 2492 N N . ASN A 320 ? 0.3315 0.2286 0.1734 0.0484 -0.0673 0.0019 628 ASN A N 2493 C CA . ASN A 320 ? 0.3398 0.2353 0.1783 0.0524 -0.0583 0.0071 628 ASN A CA 2494 C C . ASN A 320 ? 0.3163 0.2233 0.1767 0.0515 -0.0528 0.0087 628 ASN A C 2495 O O . ASN A 320 ? 0.3017 0.2174 0.1783 0.0509 -0.0572 0.0104 628 ASN A O 2496 C CB . ASN A 320 ? 0.3846 0.2779 0.2185 0.0540 -0.0619 0.0118 628 ASN A CB 2497 C CG . ASN A 320 ? 0.4006 0.2884 0.2265 0.0574 -0.0520 0.0176 628 ASN A CG 2498 O OD1 . ASN A 320 ? 0.3751 0.2647 0.2062 0.0580 -0.0433 0.0191 628 ASN A OD1 2499 N ND2 . ASN A 320 ? 0.3809 0.2620 0.1945 0.0591 -0.0535 0.0212 628 ASN A ND2 2500 N N . MET A 321 ? 0.3168 0.2250 0.1801 0.0510 -0.0422 0.0075 629 MET A N 2501 C CA . MET A 321 ? 0.2843 0.2037 0.1691 0.0489 -0.0363 0.0080 629 MET A CA 2502 C C . MET A 321 ? 0.2988 0.2178 0.1855 0.0502 -0.0281 0.0130 629 MET A C 2503 O O . MET A 321 ? 0.3206 0.2470 0.2227 0.0482 -0.0230 0.0132 629 MET A O 2504 C CB . MET A 321 ? 0.2696 0.1925 0.1598 0.0471 -0.0313 0.0039 629 MET A CB 2505 C CG . MET A 321 ? 0.2879 0.2105 0.1782 0.0448 -0.0388 -0.0009 629 MET A CG 2506 S SD . MET A 321 ? 0.3357 0.2574 0.2265 0.0441 -0.0328 -0.0049 629 MET A SD 2507 C CE . MET A 321 ? 0.3050 0.2405 0.2182 0.0423 -0.0261 -0.0031 629 MET A CE 2508 N N . ASN A 322 ? 0.2922 0.2014 0.1623 0.0531 -0.0271 0.0172 630 ASN A N 2509 C CA . ASN A 322 ? 0.3175 0.2247 0.1885 0.0535 -0.0190 0.0228 630 ASN A CA 2510 C C . ASN A 322 ? 0.3260 0.2290 0.1966 0.0552 -0.0235 0.0278 630 ASN A C 2511 O O . ASN A 322 ? 0.3112 0.2163 0.1937 0.0540 -0.0198 0.0304 630 ASN A O 2512 C CB . ASN A 322 ? 0.3535 0.2525 0.2066 0.0554 -0.0103 0.0253 630 ASN A CB 2513 C CG . ASN A 322 ? 0.3952 0.3008 0.2561 0.0539 -0.0013 0.0227 630 ASN A CG 2514 O OD1 . ASN A 322 ? 0.3548 0.2586 0.2077 0.0555 -0.0008 0.0187 630 ASN A OD1 2515 N ND2 . ASN A 322 ? 0.4170 0.3300 0.2941 0.0510 0.0053 0.0250 630 ASN A ND2 2516 N N . GLY A 323 ? 0.3378 0.2338 0.1940 0.0582 -0.0321 0.0292 631 GLY A N 2517 C CA . GLY A 323 ? 0.3362 0.2268 0.1896 0.0609 -0.0360 0.0350 631 GLY A CA 2518 C C . GLY A 323 ? 0.3743 0.2561 0.2190 0.0613 -0.0257 0.0413 631 GLY A C 2519 O O . GLY A 323 ? 0.3962 0.2732 0.2273 0.0611 -0.0182 0.0420 631 GLY A O 2520 N N . TYR A 324 ? 0.3238 0.2038 0.1775 0.0615 -0.0244 0.0457 632 TYR A N 2521 C CA . TYR A 324 ? 0.3657 0.2367 0.2121 0.0605 -0.0147 0.0523 632 TYR A CA 2522 C C . TYR A 324 ? 0.3776 0.2552 0.2406 0.0554 -0.0051 0.0509 632 TYR A C 2523 O O . TYR A 324 ? 0.3734 0.2481 0.2458 0.0534 -0.0020 0.0539 632 TYR A O 2524 C CB . TYR A 324 ? 0.3866 0.2514 0.2328 0.0619 -0.0181 0.0575 632 TYR A CB 2525 C CG . TYR A 324 ? 0.3895 0.2536 0.2249 0.0646 -0.0275 0.0570 632 TYR A CG 2526 C CD1 . TYR A 324 ? 0.3798 0.2385 0.1950 0.0649 -0.0260 0.0573 632 TYR A CD1 2527 C CD2 . TYR A 324 ? 0.3902 0.2596 0.2363 0.0668 -0.0376 0.0562 632 TYR A CD2 2528 C CE1 . TYR A 324 ? 0.4010 0.2581 0.2056 0.0669 -0.0352 0.0566 632 TYR A CE1 2529 C CE2 . TYR A 324 ? 0.3888 0.2586 0.2262 0.0688 -0.0468 0.0562 632 TYR A CE2 2530 C CZ . TYR A 324 ? 0.4053 0.2683 0.2215 0.0686 -0.0459 0.0563 632 TYR A CZ 2531 O OH . TYR A 324 ? 0.4209 0.2832 0.2276 0.0702 -0.0555 0.0560 632 TYR A OH 2532 N N . THR A 325 ? 0.3890 0.2752 0.2557 0.0532 -0.0010 0.0459 633 THR A N 2533 C CA . THR A 325 ? 0.3252 0.2199 0.2081 0.0482 0.0071 0.0442 633 THR A CA 2534 C C . THR A 325 ? 0.3568 0.2523 0.2316 0.0475 0.0169 0.0457 633 THR A C 2535 O O . THR A 325 ? 0.3733 0.2631 0.2293 0.0513 0.0172 0.0462 633 THR A O 2536 C CB . THR A 325 ? 0.3673 0.2741 0.2670 0.0465 0.0029 0.0366 633 THR A CB 2537 O OG1 . THR A 325 ? 0.3536 0.2628 0.2455 0.0488 -0.0014 0.0323 633 THR A OG1 2538 C CG2 . THR A 325 ? 0.3698 0.2775 0.2806 0.0470 -0.0042 0.0353 633 THR A CG2 2539 N N . LYS A 326 ? 0.3680 0.2709 0.2571 0.0429 0.0249 0.0464 634 LYS A N 2540 C CA . LYS A 326 ? 0.3732 0.2789 0.2588 0.0422 0.0359 0.0492 634 LYS A CA 2541 C C . LYS A 326 ? 0.3555 0.2642 0.2318 0.0465 0.0364 0.0446 634 LYS A C 2542 O O . LYS A 326 ? 0.3202 0.2357 0.2045 0.0468 0.0308 0.0381 634 LYS A O 2543 C CB . LYS A 326 ? 0.3812 0.2981 0.2890 0.0360 0.0417 0.0495 634 LYS A CB 2544 C CG . LYS A 326 ? 0.4349 0.3582 0.3448 0.0348 0.0537 0.0532 634 LYS A CG 2545 C CD . LYS A 326 ? 0.4926 0.4300 0.4275 0.0285 0.0562 0.0520 634 LYS A CD 2546 C CE . LYS A 326 ? 0.5416 0.4896 0.4831 0.0278 0.0677 0.0554 634 LYS A CE 2547 N NZ . LYS A 326 ? 0.6055 0.5478 0.5424 0.0249 0.0771 0.0643 634 LYS A NZ 2548 N N . GLY A 327 ? 0.3975 0.2997 0.2555 0.0499 0.0436 0.0480 635 GLY A N 2549 C CA . GLY A 327 ? 0.4009 0.3029 0.2470 0.0546 0.0454 0.0436 635 GLY A CA 2550 C C . GLY A 327 ? 0.4069 0.2970 0.2312 0.0590 0.0357 0.0403 635 GLY A C 2551 O O . GLY A 327 ? 0.4047 0.2905 0.2146 0.0630 0.0364 0.0363 635 GLY A O 2552 N N . ALA A 328 ? 0.3930 0.2775 0.2152 0.0582 0.0262 0.0419 636 ALA A N 2553 C CA . ALA A 328 ? 0.4072 0.2820 0.2110 0.0617 0.0152 0.0393 636 ALA A CA 2554 C C . ALA A 328 ? 0.4104 0.2743 0.1893 0.0652 0.0191 0.0404 636 ALA A C 2555 O O . ALA A 328 ? 0.4367 0.2978 0.2105 0.0651 0.0287 0.0461 636 ALA A O 2556 C CB . ALA A 328 ? 0.3798 0.2516 0.1871 0.0611 0.0057 0.0425 636 ALA A CB 2557 N N . ARG A 329 ? 0.3940 0.2534 0.1619 0.0669 0.0112 0.0339 637 ARG A N 2558 C CA . ARG A 329 ? 0.4553 0.3043 0.2021 0.0693 0.0117 0.0332 637 ARG A CA 2559 C C . ARG A 329 ? 0.4775 0.3217 0.2178 0.0689 -0.0035 0.0298 637 ARG A C 2560 O O . ARG A 329 ? 0.4730 0.3127 0.2045 0.0695 -0.0092 0.0235 637 ARG A O 2561 C CB . ARG A 329 ? 0.4765 0.3233 0.2150 0.0721 0.0195 0.0285 637 ARG A CB 2562 C CG . ARG A 329 ? 0.4651 0.3175 0.2095 0.0731 0.0358 0.0330 637 ARG A CG 2563 C CD . ARG A 329 ? 0.4762 0.3289 0.2175 0.0766 0.0429 0.0279 637 ARG A CD 2564 N NE . ARG A 329 ? 0.5012 0.3411 0.2203 0.0800 0.0418 0.0248 637 ARG A NE 2565 C CZ . ARG A 329 ? 0.4933 0.3298 0.2057 0.0840 0.0477 0.0206 637 ARG A CZ 2566 N NH1 . ARG A 329 ? 0.4955 0.3417 0.2231 0.0852 0.0549 0.0192 637 ARG A NH1 2567 N NH2 . ARG A 329 ? 0.4934 0.3166 0.1840 0.0869 0.0461 0.0179 637 ARG A NH2 2568 N N . ASN A 330 ? 0.4540 0.2996 0.2002 0.0676 -0.0101 0.0343 638 ASN A N 2569 C CA . ASN A 330 ? 0.4593 0.3042 0.2047 0.0670 -0.0247 0.0322 638 ASN A CA 2570 C C . ASN A 330 ? 0.4927 0.3265 0.2153 0.0687 -0.0285 0.0312 638 ASN A C 2571 O O . ASN A 330 ? 0.5128 0.3459 0.2332 0.0679 -0.0409 0.0284 638 ASN A O 2572 C CB . ASN A 330 ? 0.4629 0.3129 0.2225 0.0662 -0.0294 0.0377 638 ASN A CB 2573 C CG . ASN A 330 ? 0.4278 0.2880 0.2098 0.0644 -0.0277 0.0372 638 ASN A CG 2574 O OD1 . ASN A 330 ? 0.4143 0.2807 0.2051 0.0632 -0.0317 0.0314 638 ASN A OD1 2575 N ND2 . ASN A 330 ? 0.4067 0.2677 0.1974 0.0641 -0.0215 0.0432 638 ASN A ND2 2576 N N . GLU A 331 ? 0.4862 0.3121 0.1927 0.0710 -0.0176 0.0337 639 GLU A N 2577 C CA . GLU A 331 ? 0.5329 0.3469 0.2153 0.0732 -0.0191 0.0320 639 GLU A CA 2578 C C . GLU A 331 ? 0.5304 0.3414 0.2080 0.0727 -0.0262 0.0231 639 GLU A C 2579 O O . GLU A 331 ? 0.5593 0.3623 0.2220 0.0730 -0.0351 0.0206 639 GLU A O 2580 C CB . GLU A 331 ? 0.6072 0.4151 0.2763 0.0758 -0.0037 0.0355 639 GLU A CB 2581 C CG . GLU A 331 ? 0.6337 0.4408 0.3020 0.0757 0.0027 0.0449 639 GLU A CG 2582 C CD . GLU A 331 ? 0.6557 0.4733 0.3472 0.0730 0.0077 0.0492 639 GLU A CD 2583 O OE1 . GLU A 331 ? 0.7097 0.5263 0.4040 0.0720 0.0093 0.0566 639 GLU A OE1 2584 O OE2 . GLU A 331 ? 0.5923 0.4182 0.2989 0.0719 0.0097 0.0452 639 GLU A OE2 2585 N N . LEU A 332 ? 0.4956 0.3125 0.1856 0.0719 -0.0226 0.0187 640 LEU A N 2586 C CA . LEU A 332 ? 0.5059 0.3197 0.1939 0.0709 -0.0290 0.0106 640 LEU A CA 2587 C C . LEU A 332 ? 0.5053 0.3219 0.1997 0.0672 -0.0454 0.0082 640 LEU A C 2588 O O . LEU A 332 ? 0.5298 0.3387 0.2130 0.0662 -0.0535 0.0034 640 LEU A O 2589 C CB . LEU A 332 ? 0.4704 0.2920 0.1743 0.0704 -0.0229 0.0076 640 LEU A CB 2590 C CG . LEU A 332 ? 0.5047 0.3268 0.2071 0.0739 -0.0065 0.0096 640 LEU A CG 2591 C CD1 . LEU A 332 ? 0.4809 0.3129 0.2018 0.0731 -0.0028 0.0072 640 LEU A CD1 2592 C CD2 . LEU A 332 ? 0.5276 0.3370 0.2088 0.0777 -0.0015 0.0063 640 LEU A CD2 2593 N N . PHE A 333 ? 0.4656 0.2937 0.1790 0.0651 -0.0502 0.0119 641 PHE A N 2594 C CA . PHE A 333 ? 0.4621 0.2964 0.1861 0.0618 -0.0650 0.0106 641 PHE A CA 2595 C C . PHE A 333 ? 0.4827 0.3114 0.1934 0.0628 -0.0727 0.0140 641 PHE A C 2596 O O . PHE A 333 ? 0.4782 0.3076 0.1890 0.0605 -0.0852 0.0114 641 PHE A O 2597 C CB . PHE A 333 ? 0.4252 0.2742 0.1753 0.0601 -0.0665 0.0133 641 PHE A CB 2598 C CG . PHE A 333 ? 0.4035 0.2587 0.1673 0.0583 -0.0625 0.0093 641 PHE A CG 2599 C CD1 . PHE A 333 ? 0.3890 0.2503 0.1653 0.0543 -0.0713 0.0044 641 PHE A CD1 2600 C CD2 . PHE A 333 ? 0.3982 0.2533 0.1623 0.0603 -0.0497 0.0106 641 PHE A CD2 2601 C CE1 . PHE A 333 ? 0.3608 0.2270 0.1484 0.0527 -0.0677 0.0010 641 PHE A CE1 2602 C CE2 . PHE A 333 ? 0.3845 0.2452 0.1602 0.0591 -0.0464 0.0072 641 PHE A CE2 2603 C CZ . PHE A 333 ? 0.3687 0.2344 0.1554 0.0554 -0.0555 0.0022 641 PHE A CZ 2604 N N . ALA A 334 ? 0.4874 0.3106 0.1866 0.0662 -0.0652 0.0200 642 ALA A N 2605 C CA . ALA A 334 ? 0.4697 0.2860 0.1531 0.0678 -0.0714 0.0239 642 ALA A CA 2606 C C . ALA A 334 ? 0.5288 0.3326 0.1891 0.0680 -0.0760 0.0186 642 ALA A C 2607 O O . ALA A 334 ? 0.5463 0.3462 0.1962 0.0680 -0.0865 0.0195 642 ALA A O 2608 C CB . ALA A 334 ? 0.4845 0.2958 0.1588 0.0710 -0.0605 0.0315 642 ALA A CB 2609 N N . LEU A 335 ? 0.5324 0.3296 0.1845 0.0686 -0.0681 0.0133 643 LEU A N 2610 C CA . LEU A 335 ? 0.5909 0.3744 0.2206 0.0691 -0.0714 0.0076 643 LEU A CA 2611 C C . LEU A 335 ? 0.5917 0.3775 0.2292 0.0645 -0.0851 0.0011 643 LEU A C 2612 O O . LEU A 335 ? 0.6130 0.3873 0.2327 0.0640 -0.0911 -0.0036 643 LEU A O 2613 C CB . LEU A 335 ? 0.5889 0.3642 0.2072 0.0724 -0.0570 0.0048 643 LEU A CB 2614 C CG . LEU A 335 ? 0.6289 0.3974 0.2307 0.0770 -0.0442 0.0106 643 LEU A CG 2615 C CD1 . LEU A 335 ? 0.6323 0.4001 0.2346 0.0799 -0.0281 0.0094 643 LEU A CD1 2616 C CD2 . LEU A 335 ? 0.6719 0.4255 0.2452 0.0790 -0.0487 0.0099 643 LEU A CD2 2617 N N . ARG A 336 ? 0.5547 0.3551 0.2185 0.0610 -0.0898 0.0011 644 ARG A N 2618 C CA . ARG A 336 ? 0.5650 0.3704 0.2409 0.0556 -0.1023 -0.0040 644 ARG A CA 2619 C C . ARG A 336 ? 0.5612 0.3546 0.2249 0.0541 -0.1026 -0.0118 644 ARG A C 2620 O O . ARG A 336 ? 0.5652 0.3514 0.2181 0.0515 -0.1132 -0.0154 644 ARG A O 2621 C CB . ARG A 336 ? 0.6490 0.4580 0.3250 0.0537 -0.1169 -0.0019 644 ARG A CB 2622 C CG . ARG A 336 ? 0.7169 0.5403 0.4115 0.0547 -0.1191 0.0054 644 ARG A CG 2623 C CD . ARG A 336 ? 0.8164 0.6427 0.5090 0.0540 -0.1332 0.0080 644 ARG A CD 2624 N NE . ARG A 336 ? 0.8704 0.7077 0.5769 0.0566 -0.1340 0.0158 644 ARG A NE 2625 C CZ . ARG A 336 ? 0.9116 0.7539 0.6200 0.0574 -0.1451 0.0199 644 ARG A CZ 2626 N NH1 . ARG A 336 ? 0.9538 0.7918 0.6509 0.0551 -0.1570 0.0168 644 ARG A NH1 2627 N NH2 . ARG A 336 ? 0.9001 0.7514 0.6216 0.0606 -0.1445 0.0272 644 ARG A NH2 2628 N N . PRO A 337 ? 0.5427 0.3338 0.2082 0.0557 -0.0912 -0.0142 645 PRO A N 2629 C CA . PRO A 337 ? 0.5286 0.3082 0.1846 0.0546 -0.0913 -0.0213 645 PRO A CA 2630 C C . PRO A 337 ? 0.5114 0.2979 0.1857 0.0478 -0.1020 -0.0252 645 PRO A C 2631 O O . PRO A 337 ? 0.5343 0.3104 0.2007 0.0457 -0.1048 -0.0309 645 PRO A O 2632 C CB . PRO A 337 ? 0.5141 0.2930 0.1714 0.0589 -0.0756 -0.0212 645 PRO A CB 2633 C CG . PRO A 337 ? 0.4660 0.2612 0.1447 0.0588 -0.0716 -0.0157 645 PRO A CG 2634 C CD . PRO A 337 ? 0.5058 0.3043 0.1819 0.0588 -0.0780 -0.0105 645 PRO A CD 2635 N N . ALA A 338 ? 0.4644 0.2679 0.1627 0.0444 -0.1073 -0.0219 646 ALA A N 2636 C CA . ALA A 338 ? 0.5170 0.3291 0.2349 0.0376 -0.1166 -0.0247 646 ALA A CA 2637 C C . ALA A 338 ? 0.4998 0.3238 0.2302 0.0338 -0.1297 -0.0218 646 ALA A C 2638 O O . ALA A 338 ? 0.5059 0.3366 0.2383 0.0369 -0.1296 -0.0164 646 ALA A O 2639 C CB . ALA A 338 ? 0.4890 0.3123 0.2281 0.0369 -0.1094 -0.0241 646 ALA A CB 2640 N N . PRO A 339 ? 0.5165 0.3434 0.2558 0.0271 -0.1409 -0.0251 647 PRO A N 2641 C CA . PRO A 339 ? 0.5193 0.3588 0.2718 0.0235 -0.1539 -0.0224 647 PRO A CA 2642 C C . PRO A 339 ? 0.4945 0.3557 0.2762 0.0232 -0.1532 -0.0172 647 PRO A C 2643 O O . PRO A 339 ? 0.4962 0.3684 0.2869 0.0237 -0.1602 -0.0129 647 PRO A O 2644 C CB . PRO A 339 ? 0.5196 0.3563 0.2755 0.0158 -0.1639 -0.0277 647 PRO A CB 2645 C CG . PRO A 339 ? 0.4982 0.3269 0.2532 0.0149 -0.1552 -0.0318 647 PRO A CG 2646 C CD . PRO A 339 ? 0.5099 0.3270 0.2456 0.0228 -0.1421 -0.0313 647 PRO A CD 2647 N N . ILE A 340 ? 0.4472 0.3140 0.2429 0.0227 -0.1449 -0.0177 648 ILE A N 2648 C CA . ILE A 340 ? 0.4231 0.3090 0.2449 0.0231 -0.1427 -0.0131 648 ILE A CA 2649 C C . ILE A 340 ? 0.4307 0.3143 0.2497 0.0285 -0.1293 -0.0114 648 ILE A C 2650 O O . ILE A 340 ? 0.4168 0.2914 0.2281 0.0288 -0.1219 -0.0149 648 ILE A O 2651 C CB . ILE A 340 ? 0.3951 0.2933 0.2411 0.0163 -0.1465 -0.0150 648 ILE A CB 2652 C CG1 . ILE A 340 ? 0.4497 0.3507 0.2997 0.0100 -0.1598 -0.0167 648 ILE A CG1 2653 C CG2 . ILE A 340 ? 0.3967 0.3142 0.2689 0.0175 -0.1432 -0.0104 648 ILE A CG2 2654 C CD1 . ILE A 340 ? 0.4616 0.3708 0.3312 0.0022 -0.1629 -0.0191 648 ILE A CD1 2655 N N . GLN A 341 ? 0.4206 0.3119 0.2458 0.0330 -0.1262 -0.0057 649 GLN A N 2656 C CA . GLN A 341 ? 0.3929 0.2829 0.2169 0.0376 -0.1140 -0.0034 649 GLN A CA 2657 C C . GLN A 341 ? 0.3773 0.2840 0.2263 0.0384 -0.1128 0.0010 649 GLN A C 2658 O O . GLN A 341 ? 0.4075 0.3227 0.2657 0.0396 -0.1185 0.0050 649 GLN A O 2659 C CB . GLN A 341 ? 0.4166 0.2941 0.2174 0.0430 -0.1088 -0.0006 649 GLN A CB 2660 C CG . GLN A 341 ? 0.4184 0.2791 0.1939 0.0427 -0.1102 -0.0051 649 GLN A CG 2661 C CD . GLN A 341 ? 0.4504 0.2981 0.2020 0.0482 -0.1023 -0.0027 649 GLN A CD 2662 O OE1 . GLN A 341 ? 0.4624 0.2967 0.1950 0.0496 -0.0971 -0.0063 649 GLN A OE1 2663 N NE2 . GLN A 341 ? 0.4382 0.2895 0.1906 0.0514 -0.1011 0.0037 649 GLN A NE2 2664 N N . ALA A 342 ? 0.3408 0.2520 0.2005 0.0382 -0.1054 0.0001 650 ALA A N 2665 C CA . ALA A 342 ? 0.3052 0.2320 0.1893 0.0388 -0.1041 0.0032 650 ALA A CA 2666 C C . ALA A 342 ? 0.3240 0.2493 0.2081 0.0429 -0.0930 0.0056 650 ALA A C 2667 O O . ALA A 342 ? 0.3120 0.2287 0.1843 0.0436 -0.0859 0.0034 650 ALA A O 2668 C CB . ALA A 342 ? 0.2803 0.2175 0.1831 0.0332 -0.1075 0.0000 650 ALA A CB 2669 N N . MET A 343 ? 0.3152 0.2488 0.2130 0.0459 -0.0914 0.0101 651 MET A N 2670 C CA . MET A 343 ? 0.2766 0.2101 0.1783 0.0490 -0.0817 0.0123 651 MET A CA 2671 C C . MET A 343 ? 0.2835 0.2277 0.2043 0.0467 -0.0800 0.0097 651 MET A C 2672 O O . MET A 343 ? 0.2856 0.2417 0.2242 0.0446 -0.0853 0.0091 651 MET A O 2673 C CB . MET A 343 ? 0.2850 0.2209 0.1933 0.0530 -0.0809 0.0179 651 MET A CB 2674 C CG . MET A 343 ? 0.2991 0.2251 0.1897 0.0555 -0.0830 0.0216 651 MET A CG 2675 S SD . MET A 343 ? 0.3874 0.2976 0.2550 0.0575 -0.0719 0.0236 651 MET A SD 2676 C CE . MET A 343 ? 0.3516 0.2654 0.2349 0.0595 -0.0634 0.0272 651 MET A CE 2677 N N . TRP A 344 ? 0.2809 0.2224 0.2002 0.0464 -0.0708 0.0082 652 TRP A N 2678 C CA . TRP A 344 ? 0.2578 0.2100 0.1956 0.0429 -0.0664 0.0054 652 TRP A CA 2679 C C . TRP A 344 ? 0.2712 0.2235 0.2125 0.0433 -0.0549 0.0056 652 TRP A C 2680 O O . TRP A 344 ? 0.2673 0.2122 0.1968 0.0434 -0.0490 0.0050 652 TRP A O 2681 C CB . TRP A 344 ? 0.2751 0.2262 0.2102 0.0384 -0.0695 0.0008 652 TRP A CB 2682 C CG . TRP A 344 ? 0.2700 0.2301 0.2211 0.0348 -0.0645 -0.0014 652 TRP A CG 2683 C CD1 . TRP A 344 ? 0.2772 0.2503 0.2485 0.0333 -0.0649 -0.0008 652 TRP A CD1 2684 C CD2 . TRP A 344 ? 0.2705 0.2270 0.2180 0.0329 -0.0581 -0.0042 652 TRP A CD2 2685 N NE1 . TRP A 344 ? 0.2498 0.2267 0.2284 0.0301 -0.0592 -0.0029 652 TRP A NE1 2686 C CE2 . TRP A 344 ? 0.2684 0.2352 0.2330 0.0299 -0.0555 -0.0049 652 TRP A CE2 2687 C CE3 . TRP A 344 ? 0.2852 0.2307 0.2165 0.0341 -0.0540 -0.0058 652 TRP A CE3 2688 C CZ2 . TRP A 344 ? 0.2797 0.2456 0.2448 0.0279 -0.0501 -0.0068 652 TRP A CZ2 2689 C CZ3 . TRP A 344 ? 0.2873 0.2331 0.2214 0.0326 -0.0484 -0.0079 652 TRP A CZ3 2690 C CH2 . TRP A 344 ? 0.2920 0.2475 0.2424 0.0294 -0.0470 -0.0083 652 TRP A CH2 2691 N N . LEU A 345 ? 0.2509 0.2117 0.2088 0.0436 -0.0519 0.0063 653 LEU A N 2692 C CA . LEU A 345 ? 0.2765 0.2403 0.2419 0.0422 -0.0430 0.0052 653 LEU A CA 2693 C C . LEU A 345 ? 0.3021 0.2593 0.2619 0.0439 -0.0361 0.0077 653 LEU A C 2694 O O . LEU A 345 ? 0.2851 0.2448 0.2541 0.0440 -0.0321 0.0081 653 LEU A O 2695 C CB . LEU A 345 ? 0.2849 0.2502 0.2499 0.0386 -0.0406 0.0015 653 LEU A CB 2696 C CG . LEU A 345 ? 0.2903 0.2612 0.2654 0.0367 -0.0338 0.0001 653 LEU A CG 2697 C CD1 . LEU A 345 ? 0.2748 0.2546 0.2647 0.0366 -0.0345 -0.0002 653 LEU A CD1 2698 C CD2 . LEU A 345 ? 0.2596 0.2307 0.2328 0.0340 -0.0323 -0.0026 653 LEU A CD2 2699 N N . GLY A 346 ? 0.2773 0.2256 0.2216 0.0450 -0.0345 0.0095 654 GLY A N 2700 C CA . GLY A 346 ? 0.2683 0.2117 0.2088 0.0452 -0.0267 0.0122 654 GLY A CA 2701 C C . GLY A 346 ? 0.3227 0.2602 0.2613 0.0477 -0.0265 0.0169 654 GLY A C 2702 O O . GLY A 346 ? 0.4029 0.3370 0.3422 0.0466 -0.0200 0.0192 654 GLY A O 2703 N N . TYR A 347 ? 0.2892 0.2251 0.2260 0.0509 -0.0340 0.0188 655 TYR A N 2704 C CA . TYR A 347 ? 0.3054 0.2337 0.2389 0.0543 -0.0345 0.0240 655 TYR A CA 2705 C C . TYR A 347 ? 0.3183 0.2522 0.2650 0.0574 -0.0404 0.0241 655 TYR A C 2706 O O . TYR A 347 ? 0.2939 0.2325 0.2419 0.0592 -0.0488 0.0238 655 TYR A O 2707 C CB . TYR A 347 ? 0.3114 0.2294 0.2247 0.0570 -0.0375 0.0282 655 TYR A CB 2708 C CG . TYR A 347 ? 0.2933 0.2016 0.2010 0.0606 -0.0377 0.0347 655 TYR A CG 2709 C CD1 . TYR A 347 ? 0.2896 0.1906 0.1955 0.0590 -0.0289 0.0382 655 TYR A CD1 2710 C CD2 . TYR A 347 ? 0.3100 0.2180 0.2169 0.0642 -0.0462 0.0372 655 TYR A CD2 2711 C CE1 . TYR A 347 ? 0.3243 0.2143 0.2244 0.0620 -0.0288 0.0446 655 TYR A CE1 2712 C CE2 . TYR A 347 ? 0.3299 0.2305 0.2339 0.0664 -0.0455 0.0427 655 TYR A CE2 2713 C CZ . TYR A 347 ? 0.3645 0.2549 0.2641 0.0656 -0.0370 0.0465 655 TYR A CZ 2714 O OH . TYR A 347 ? 0.4084 0.2900 0.3048 0.0674 -0.0363 0.0523 655 TYR A OH 2715 N N . PRO A 348 ? 0.2806 0.2138 0.2375 0.0581 -0.0362 0.0244 656 PRO A N 2716 C CA . PRO A 348 ? 0.2900 0.2289 0.2607 0.0620 -0.0398 0.0240 656 PRO A CA 2717 C C . PRO A 348 ? 0.3065 0.2384 0.2732 0.0680 -0.0449 0.0297 656 PRO A C 2718 O O . PRO A 348 ? 0.2883 0.2160 0.2611 0.0706 -0.0421 0.0312 656 PRO A O 2719 C CB . PRO A 348 ? 0.2819 0.2195 0.2613 0.0603 -0.0323 0.0214 656 PRO A CB 2720 C CG . PRO A 348 ? 0.2954 0.2219 0.2636 0.0572 -0.0267 0.0240 656 PRO A CG 2721 C CD . PRO A 348 ? 0.2515 0.1791 0.2084 0.0549 -0.0276 0.0246 656 PRO A CD 2722 N N . GLY A 349 ? 0.2700 0.2023 0.2276 0.0682 -0.0512 0.0320 657 GLY A N 2723 C CA . GLY A 349 ? 0.3075 0.2367 0.2627 0.0717 -0.0554 0.0371 657 GLY A CA 2724 C C . GLY A 349 ? 0.3187 0.2497 0.2633 0.0709 -0.0633 0.0381 657 GLY A C 2725 O O . GLY A 349 ? 0.3022 0.2349 0.2401 0.0675 -0.0646 0.0346 657 GLY A O 2726 N N . THR A 350 ? 0.3310 0.2610 0.2738 0.0742 -0.0687 0.0427 658 THR A N 2727 C CA . THR A 350 ? 0.3563 0.2863 0.2870 0.0733 -0.0767 0.0437 658 THR A CA 2728 C C . THR A 350 ? 0.3249 0.2400 0.2311 0.0721 -0.0731 0.0458 658 THR A C 2729 O O . THR A 350 ? 0.3217 0.2263 0.2214 0.0731 -0.0661 0.0495 658 THR A O 2730 C CB . THR A 350 ? 0.3286 0.2638 0.2659 0.0776 -0.0844 0.0482 658 THR A CB 2731 O OG1 . THR A 350 ? 0.3806 0.3166 0.3064 0.0760 -0.0931 0.0481 658 THR A OG1 2732 C CG2 . THR A 350 ? 0.3589 0.2825 0.2900 0.0817 -0.0811 0.0546 658 THR A CG2 2733 N N . SER A 351 ? 0.3178 0.2315 0.2103 0.0696 -0.0774 0.0433 659 SER A N 2734 C CA . SER A 351 ? 0.3456 0.2456 0.2136 0.0692 -0.0739 0.0454 659 SER A CA 2735 C C . SER A 351 ? 0.3748 0.2686 0.2331 0.0725 -0.0784 0.0516 659 SER A C 2736 O O . SER A 351 ? 0.4079 0.2894 0.2479 0.0731 -0.0736 0.0555 659 SER A O 2737 C CB . SER A 351 ? 0.3840 0.2831 0.2396 0.0661 -0.0770 0.0400 659 SER A CB 2738 O OG . SER A 351 ? 0.3967 0.3003 0.2518 0.0660 -0.0883 0.0393 659 SER A OG 2739 N N . GLY A 352 ? 0.3922 0.2951 0.2632 0.0747 -0.0874 0.0529 660 GLY A N 2740 C CA . GLY A 352 ? 0.4084 0.3068 0.2710 0.0783 -0.0933 0.0590 660 GLY A CA 2741 C C . GLY A 352 ? 0.4739 0.3655 0.3138 0.0770 -0.0986 0.0582 660 GLY A C 2742 O O . GLY A 352 ? 0.4978 0.3839 0.3266 0.0798 -0.1036 0.0632 660 GLY A O 2743 N N . ALA A 353 ? 0.4736 0.3648 0.3063 0.0729 -0.0978 0.0517 661 ALA A N 2744 C CA . ALA A 353 ? 0.5366 0.4180 0.3447 0.0716 -0.1004 0.0498 661 ALA A CA 2745 C C . ALA A 353 ? 0.5370 0.4256 0.3475 0.0692 -0.1125 0.0451 661 ALA A C 2746 O O . ALA A 353 ? 0.5384 0.4376 0.3652 0.0660 -0.1149 0.0401 661 ALA A O 2747 C CB . ALA A 353 ? 0.5518 0.4247 0.3471 0.0694 -0.0897 0.0460 661 ALA A CB 2748 N N . LEU A 354 ? 0.5445 0.4269 0.3381 0.0702 -0.1201 0.0467 662 LEU A N 2749 C CA . LEU A 354 ? 0.5714 0.4598 0.3663 0.0674 -0.1325 0.0426 662 LEU A CA 2750 C C . LEU A 354 ? 0.5600 0.4438 0.3465 0.0625 -0.1315 0.0342 662 LEU A C 2751 O O . LEU A 354 ? 0.5603 0.4508 0.3539 0.0586 -0.1407 0.0298 662 LEU A O 2752 C CB . LEU A 354 ? 0.6555 0.5372 0.4326 0.0698 -0.1414 0.0465 662 LEU A CB 2753 C CG . LEU A 354 ? 0.6960 0.5862 0.4862 0.0745 -0.1472 0.0544 662 LEU A CG 2754 C CD1 . LEU A 354 ? 0.7505 0.6347 0.5224 0.0765 -0.1576 0.0578 662 LEU A CD1 2755 C CD2 . LEU A 354 ? 0.6744 0.5847 0.4963 0.0736 -0.1529 0.0533 662 LEU A CD2 2756 N N . PHE A 355 ? 0.5398 0.4121 0.3117 0.0626 -0.1201 0.0323 663 PHE A N 2757 C CA . PHE A 355 ? 0.5254 0.3921 0.2890 0.0590 -0.1181 0.0246 663 PHE A CA 2758 C C . PHE A 355 ? 0.4967 0.3743 0.2825 0.0558 -0.1153 0.0206 663 PHE A C 2759 O O . PHE A 355 ? 0.4558 0.3299 0.2381 0.0525 -0.1146 0.0144 663 PHE A O 2760 C CB . PHE A 355 ? 0.5421 0.3926 0.2803 0.0611 -0.1070 0.0240 663 PHE A CB 2761 C CG . PHE A 355 ? 0.5261 0.3758 0.2671 0.0640 -0.0941 0.0291 663 PHE A CG 2762 C CD1 . PHE A 355 ? 0.4895 0.3444 0.2438 0.0628 -0.0857 0.0269 663 PHE A CD1 2763 C CD2 . PHE A 355 ? 0.5373 0.3805 0.2671 0.0675 -0.0907 0.0362 663 PHE A CD2 2764 C CE1 . PHE A 355 ? 0.4945 0.3487 0.2517 0.0648 -0.0743 0.0316 663 PHE A CE1 2765 C CE2 . PHE A 355 ? 0.5138 0.3556 0.2466 0.0691 -0.0789 0.0411 663 PHE A CE2 2766 C CZ . PHE A 355 ? 0.4783 0.3258 0.2251 0.0676 -0.0708 0.0387 663 PHE A CZ 2767 N N . MET A 356 ? 0.4633 0.3531 0.2714 0.0569 -0.1136 0.0243 664 MET A N 2768 C CA . MET A 356 ? 0.4238 0.3256 0.2544 0.0538 -0.1126 0.0209 664 MET A CA 2769 C C . MET A 356 ? 0.4296 0.3460 0.2799 0.0516 -0.1242 0.0209 664 MET A C 2770 O O . MET A 356 ? 0.4001 0.3233 0.2589 0.0547 -0.1285 0.0262 664 MET A O 2771 C CB . MET A 356 ? 0.3602 0.2663 0.2036 0.0564 -0.1029 0.0242 664 MET A CB 2772 C CG . MET A 356 ? 0.3736 0.2675 0.2007 0.0581 -0.0907 0.0247 664 MET A CG 2773 S SD . MET A 356 ? 0.4174 0.3025 0.2294 0.0554 -0.0861 0.0175 664 MET A SD 2774 C CE . MET A 356 ? 0.3141 0.2127 0.1504 0.0511 -0.0894 0.0126 664 MET A CE 2775 N N . ASP A 357 ? 0.4141 0.3354 0.2722 0.0463 -0.1287 0.0155 665 ASP A N 2776 C CA . ASP A 357 ? 0.4181 0.3536 0.2944 0.0431 -0.1397 0.0153 665 ASP A CA 2777 C C . ASP A 357 ? 0.3985 0.3520 0.3045 0.0430 -0.1375 0.0169 665 ASP A C 2778 O O . ASP A 357 ? 0.3607 0.3280 0.2842 0.0445 -0.1431 0.0206 665 ASP A O 2779 C CB . ASP A 357 ? 0.4379 0.3691 0.3082 0.0366 -0.1458 0.0089 665 ASP A CB 2780 C CG . ASP A 357 ? 0.4821 0.3955 0.3229 0.0370 -0.1488 0.0069 665 ASP A CG 2781 O OD1 . ASP A 357 ? 0.4974 0.4106 0.3316 0.0387 -0.1568 0.0098 665 ASP A OD1 2782 O OD2 . ASP A 357 ? 0.4950 0.3945 0.3189 0.0361 -0.1430 0.0024 665 ASP A OD2 2783 N N . TYR A 358 ? 0.3671 0.3204 0.2785 0.0416 -0.1290 0.0142 666 TYR A N 2784 C CA . TYR A 358 ? 0.3187 0.2877 0.2565 0.0411 -0.1259 0.0148 666 TYR A CA 2785 C C . TYR A 358 ? 0.3156 0.2812 0.2540 0.0449 -0.1145 0.0161 666 TYR A C 2786 O O . TYR A 358 ? 0.3382 0.2900 0.2578 0.0462 -0.1085 0.0152 666 TYR A O 2787 C CB . TYR A 358 ? 0.2919 0.2658 0.2387 0.0341 -0.1278 0.0097 666 TYR A CB 2788 C CG . TYR A 358 ? 0.3538 0.3333 0.3052 0.0289 -0.1391 0.0083 666 TYR A CG 2789 C CD1 . TYR A 358 ? 0.3470 0.3451 0.3218 0.0286 -0.1447 0.0113 666 TYR A CD1 2790 C CD2 . TYR A 358 ? 0.3651 0.3313 0.2977 0.0245 -0.1438 0.0038 666 TYR A CD2 2791 C CE1 . TYR A 358 ? 0.3568 0.3611 0.3369 0.0233 -0.1553 0.0102 666 TYR A CE1 2792 C CE2 . TYR A 358 ? 0.3927 0.3632 0.3293 0.0191 -0.1547 0.0023 666 TYR A CE2 2793 C CZ . TYR A 358 ? 0.3804 0.3705 0.3413 0.0183 -0.1606 0.0056 666 TYR A CZ 2794 O OH . TYR A 358 ? 0.3861 0.3818 0.3524 0.0126 -0.1717 0.0043 666 TYR A OH 2795 N N . ILE A 359 ? 0.2988 0.2775 0.2594 0.0469 -0.1113 0.0180 667 ILE A N 2796 C CA . ILE A 359 ? 0.2890 0.2665 0.2542 0.0487 -0.1012 0.0176 667 ILE A CA 2797 C C . ILE A 359 ? 0.2722 0.2635 0.2587 0.0452 -0.1002 0.0148 667 ILE A C 2798 O O . ILE A 359 ? 0.2778 0.2837 0.2836 0.0449 -0.1039 0.0162 667 ILE A O 2799 C CB . ILE A 359 ? 0.2950 0.2717 0.2642 0.0551 -0.0961 0.0224 667 ILE A CB 2800 C CG1 . ILE A 359 ? 0.2819 0.2579 0.2575 0.0563 -0.0861 0.0212 667 ILE A CG1 2801 C CG2 . ILE A 359 ? 0.2803 0.2707 0.2684 0.0581 -0.1009 0.0259 667 ILE A CG2 2802 C CD1 . ILE A 359 ? 0.3155 0.2858 0.2910 0.0617 -0.0803 0.0253 667 ILE A CD1 2803 N N . ILE A 360 ? 0.2277 0.2146 0.2104 0.0426 -0.0951 0.0112 668 ILE A N 2804 C CA . ILE A 360 ? 0.2331 0.2315 0.2338 0.0389 -0.0935 0.0088 668 ILE A CA 2805 C C . ILE A 360 ? 0.2548 0.2604 0.2704 0.0433 -0.0857 0.0103 668 ILE A C 2806 O O . ILE A 360 ? 0.2677 0.2653 0.2756 0.0458 -0.0779 0.0100 668 ILE A O 2807 C CB . ILE A 360 ? 0.2446 0.2347 0.2344 0.0344 -0.0920 0.0045 668 ILE A CB 2808 C CG1 . ILE A 360 ? 0.2687 0.2505 0.2441 0.0300 -0.0998 0.0022 668 ILE A CG1 2809 C CG2 . ILE A 360 ? 0.2325 0.2338 0.2406 0.0301 -0.0875 0.0026 668 ILE A CG2 2810 C CD1 . ILE A 360 ? 0.3077 0.2773 0.2680 0.0269 -0.0978 -0.0021 668 ILE A CD1 2811 N N . THR A 361 ? 0.2387 0.2595 0.2753 0.0439 -0.0865 0.0118 669 THR A N 2812 C CA . THR A 361 ? 0.2265 0.2535 0.2766 0.0490 -0.0789 0.0130 669 THR A CA 2813 C C . THR A 361 ? 0.2056 0.2504 0.2788 0.0467 -0.0778 0.0125 669 THR A C 2814 O O . THR A 361 ? 0.2114 0.2607 0.2884 0.0401 -0.0808 0.0105 669 THR A O 2815 C CB . THR A 361 ? 0.1852 0.2093 0.2335 0.0556 -0.0792 0.0172 669 THR A CB 2816 O OG1 . THR A 361 ? 0.2114 0.2396 0.2720 0.0607 -0.0714 0.0178 669 THR A OG1 2817 C CG2 . THR A 361 ? 0.2125 0.2456 0.2673 0.0555 -0.0882 0.0202 669 THR A CG2 2818 N N . ASP A 362 ? 0.2225 0.2765 0.3107 0.0519 -0.0728 0.0143 670 ASP A N 2819 C CA . ASP A 362 ? 0.1941 0.2664 0.3046 0.0503 -0.0703 0.0144 670 ASP A CA 2820 C C . ASP A 362 ? 0.1867 0.2683 0.3101 0.0577 -0.0678 0.0176 670 ASP A C 2821 O O . ASP A 362 ? 0.1882 0.2607 0.3030 0.0639 -0.0676 0.0196 670 ASP A O 2822 C CB . ASP A 362 ? 0.1746 0.2482 0.2895 0.0482 -0.0614 0.0111 670 ASP A CB 2823 C CG . ASP A 362 ? 0.2000 0.2639 0.3073 0.0538 -0.0516 0.0097 670 ASP A CG 2824 O OD1 . ASP A 362 ? 0.2059 0.2766 0.3255 0.0602 -0.0468 0.0105 670 ASP A OD1 2825 O OD2 . ASP A 362 ? 0.2197 0.2692 0.3090 0.0519 -0.0487 0.0076 670 ASP A OD2 2826 N N . GLN A 363 ? 0.1751 0.2748 0.3189 0.0572 -0.0654 0.0183 671 GLN A N 2827 C CA . GLN A 363 ? 0.2157 0.3266 0.3729 0.0648 -0.0638 0.0213 671 GLN A CA 2828 C C . GLN A 363 ? 0.1928 0.2962 0.3472 0.0735 -0.0537 0.0206 671 GLN A C 2829 O O . GLN A 363 ? 0.1585 0.2616 0.3145 0.0815 -0.0537 0.0232 671 GLN A O 2830 C CB . GLN A 363 ? 0.2661 0.3987 0.4459 0.0618 -0.0625 0.0217 671 GLN A CB 2831 C CG . GLN A 363 ? 0.3713 0.5177 0.5667 0.0703 -0.0602 0.0240 671 GLN A CG 2832 C CD . GLN A 363 ? 0.4551 0.6232 0.6734 0.0670 -0.0572 0.0241 671 GLN A CD 2833 O OE1 . GLN A 363 ? 0.4743 0.6474 0.6971 0.0573 -0.0582 0.0234 671 GLN A OE1 2834 N NE2 . GLN A 363 ? 0.4941 0.6748 0.7271 0.0750 -0.0532 0.0251 671 GLN A NE2 2835 N N . GLU A 364 ? 0.1795 0.2757 0.3289 0.0719 -0.0456 0.0169 672 GLU A N 2836 C CA . GLU A 364 ? 0.2263 0.3127 0.3706 0.0790 -0.0361 0.0151 672 GLU A CA 2837 C C . GLU A 364 ? 0.2197 0.2861 0.3458 0.0813 -0.0386 0.0161 672 GLU A C 2838 O O . GLU A 364 ? 0.2427 0.3018 0.3665 0.0884 -0.0354 0.0177 672 GLU A O 2839 C CB . GLU A 364 ? 0.2534 0.3379 0.3966 0.0760 -0.0270 0.0105 672 GLU A CB 2840 C CG . GLU A 364 ? 0.2794 0.3824 0.4398 0.0734 -0.0220 0.0101 672 GLU A CG 2841 C CD . GLU A 364 ? 0.3020 0.4162 0.4749 0.0812 -0.0171 0.0107 672 GLU A CD 2842 O OE1 . GLU A 364 ? 0.2644 0.3683 0.4303 0.0893 -0.0132 0.0092 672 GLU A OE1 2843 O OE2 . GLU A 364 ? 0.3175 0.4501 0.5074 0.0790 -0.0175 0.0124 672 GLU A OE2 2844 N N . THR A 365 ? 0.1847 0.2417 0.2975 0.0754 -0.0440 0.0152 673 THR A N 2845 C CA . THR A 365 ? 0.1766 0.2152 0.2713 0.0766 -0.0458 0.0162 673 THR A CA 2846 C C . THR A 365 ? 0.2209 0.2587 0.3141 0.0803 -0.0527 0.0216 673 THR A C 2847 O O . THR A 365 ? 0.2380 0.2638 0.3237 0.0850 -0.0511 0.0240 673 THR A O 2848 C CB . THR A 365 ? 0.1932 0.2231 0.2732 0.0701 -0.0491 0.0140 673 THR A CB 2849 O OG1 . THR A 365 ? 0.2163 0.2487 0.2980 0.0660 -0.0430 0.0095 673 THR A OG1 2850 C CG2 . THR A 365 ? 0.2162 0.2276 0.2780 0.0715 -0.0482 0.0151 673 THR A CG2 2851 N N . SER A 366 ? 0.1948 0.2449 0.2948 0.0778 -0.0608 0.0236 674 SER A N 2852 C CA . SER A 366 ? 0.2148 0.2646 0.3117 0.0808 -0.0688 0.0286 674 SER A CA 2853 C C . SER A 366 ? 0.2151 0.2853 0.3313 0.0826 -0.0731 0.0308 674 SER A C 2854 O O . SER A 366 ? 0.2301 0.3084 0.3483 0.0773 -0.0816 0.0310 674 SER A O 2855 C CB . SER A 366 ? 0.2381 0.2783 0.3170 0.0750 -0.0766 0.0285 674 SER A CB 2856 O OG . SER A 366 ? 0.2471 0.2713 0.3097 0.0729 -0.0719 0.0259 674 SER A OG 2857 N N . PRO A 367 ? 0.2721 0.3505 0.4021 0.0901 -0.0672 0.0320 675 PRO A N 2858 C CA . PRO A 367 ? 0.2990 0.3984 0.4482 0.0930 -0.0707 0.0339 675 PRO A CA 2859 C C . PRO A 367 ? 0.3284 0.4301 0.4747 0.0934 -0.0826 0.0384 675 PRO A C 2860 O O . PRO A 367 ? 0.3179 0.4050 0.4496 0.0967 -0.0851 0.0417 675 PRO A O 2861 C CB . PRO A 367 ? 0.3172 0.4182 0.4745 0.1037 -0.0620 0.0345 675 PRO A CB 2862 C CG . PRO A 367 ? 0.3167 0.3949 0.4573 0.1060 -0.0559 0.0345 675 PRO A CG 2863 C CD . PRO A 367 ? 0.2697 0.3375 0.3972 0.0965 -0.0569 0.0313 675 PRO A CD 2864 N N . ALA A 368 ? 0.3225 0.4417 0.4820 0.0895 -0.0899 0.0385 676 ALA A N 2865 C CA . ALA A 368 ? 0.3698 0.4912 0.5252 0.0882 -0.1025 0.0418 676 ALA A CA 2866 C C . ALA A 368 ? 0.4048 0.5247 0.5597 0.0988 -0.1047 0.0474 676 ALA A C 2867 O O . ALA A 368 ? 0.4166 0.5317 0.5614 0.0990 -0.1141 0.0508 676 ALA A O 2868 C CB . ALA A 368 ? 0.3845 0.5266 0.5578 0.0822 -0.1093 0.0407 676 ALA A CB 2869 N N . GLU A 369 ? 0.4158 0.5388 0.5805 0.1080 -0.0957 0.0481 677 GLU A N 2870 C CA . GLU A 369 ? 0.4808 0.6007 0.6453 0.1192 -0.0962 0.0536 677 GLU A CA 2871 C C . GLU A 369 ? 0.4795 0.5751 0.6214 0.1196 -0.0966 0.0572 677 GLU A C 2872 O O . GLU A 369 ? 0.4971 0.5886 0.6348 0.1254 -0.1019 0.0632 677 GLU A O 2873 C CB . GLU A 369 ? 0.5185 0.6428 0.6949 0.1291 -0.0853 0.0520 677 GLU A CB 2874 C CG . GLU A 369 ? 0.5531 0.7007 0.7523 0.1287 -0.0832 0.0473 677 GLU A CG 2875 C CD . GLU A 369 ? 0.5643 0.7108 0.7639 0.1207 -0.0749 0.0413 677 GLU A CD 2876 O OE1 . GLU A 369 ? 0.5752 0.7121 0.7707 0.1252 -0.0643 0.0379 677 GLU A OE1 2877 O OE2 . GLU A 369 ? 0.5402 0.6942 0.7433 0.1100 -0.0792 0.0399 677 GLU A OE2 2878 N N . VAL A 370 ? 0.4505 0.5301 0.5785 0.1134 -0.0912 0.0537 678 VAL A N 2879 C CA . VAL A 370 ? 0.4649 0.5213 0.5722 0.1130 -0.0906 0.0561 678 VAL A CA 2880 C C . VAL A 370 ? 0.4497 0.4976 0.5383 0.1047 -0.0986 0.0549 678 VAL A C 2881 O O . VAL A 370 ? 0.4818 0.5110 0.5519 0.1021 -0.0959 0.0544 678 VAL A O 2882 C CB . VAL A 370 ? 0.4702 0.5114 0.5724 0.1131 -0.0789 0.0530 678 VAL A CB 2883 C CG1 . VAL A 370 ? 0.4955 0.5409 0.6126 0.1221 -0.0706 0.0542 678 VAL A CG1 2884 C CG2 . VAL A 370 ? 0.4722 0.5152 0.5729 0.1049 -0.0752 0.0461 678 VAL A CG2 2885 N N . ALA A 371 ? 0.4280 0.4893 0.5211 0.1006 -0.1080 0.0543 679 ALA A N 2886 C CA . ALA A 371 ? 0.4609 0.5136 0.5352 0.0933 -0.1160 0.0529 679 ALA A CA 2887 C C . ALA A 371 ? 0.4871 0.5229 0.5411 0.0966 -0.1194 0.0579 679 ALA A C 2888 O O . ALA A 371 ? 0.4865 0.5084 0.5192 0.0917 -0.1215 0.0564 679 ALA A O 2889 C CB . ALA A 371 ? 0.4785 0.5480 0.5624 0.0890 -0.1265 0.0518 679 ALA A CB 2890 N N . GLU A 372 ? 0.5027 0.5393 0.5631 0.1051 -0.1193 0.0640 680 GLU A N 2891 C CA . GLU A 372 ? 0.5284 0.5493 0.5712 0.1088 -0.1223 0.0698 680 GLU A CA 2892 C C . GLU A 372 ? 0.5057 0.5044 0.5307 0.1072 -0.1136 0.0691 680 GLU A C 2893 O O . GLU A 372 ? 0.5312 0.5148 0.5377 0.1082 -0.1154 0.0732 680 GLU A O 2894 C CB . GLU A 372 ? 0.5705 0.5977 0.6264 0.1189 -0.1238 0.0769 680 GLU A CB 2895 C CG . GLU A 372 ? 0.6065 0.6330 0.6769 0.1247 -0.1125 0.0770 680 GLU A CG 2896 C CD . GLU A 372 ? 0.6779 0.7099 0.7614 0.1356 -0.1135 0.0841 680 GLU A CD 2897 O OE1 . GLU A 372 ? 0.7052 0.7367 0.7825 0.1387 -0.1226 0.0901 680 GLU A OE1 2898 O OE2 . GLU A 372 ? 0.6919 0.7282 0.7912 0.1413 -0.1051 0.0838 680 GLU A OE2 2899 N N . GLN A 373 ? 0.4358 0.4329 0.4664 0.1048 -0.1042 0.0641 681 GLN A N 2900 C CA . GLN A 373 ? 0.4710 0.4489 0.4861 0.1024 -0.0962 0.0627 681 GLN A CA 2901 C C . GLN A 373 ? 0.4229 0.3932 0.4182 0.0950 -0.0979 0.0592 681 GLN A C 2902 O O . GLN A 373 ? 0.4383 0.3926 0.4170 0.0931 -0.0926 0.0594 681 GLN A O 2903 C CB . GLN A 373 ? 0.5501 0.5292 0.5774 0.1023 -0.0861 0.0581 681 GLN A CB 2904 C CG . GLN A 373 ? 0.6554 0.6386 0.7003 0.1099 -0.0817 0.0605 681 GLN A CG 2905 C CD . GLN A 373 ? 0.7207 0.6987 0.7710 0.1092 -0.0710 0.0555 681 GLN A CD 2906 O OE1 . GLN A 373 ? 0.7574 0.7225 0.7945 0.1043 -0.0666 0.0524 681 GLN A OE1 2907 N NE2 . GLN A 373 ? 0.7290 0.7172 0.7982 0.1142 -0.0667 0.0545 681 GLN A NE2 2908 N N . TYR A 374 ? 0.3732 0.3549 0.3708 0.0908 -0.1048 0.0560 682 TYR A N 2909 C CA . TYR A 374 ? 0.3649 0.3395 0.3449 0.0840 -0.1061 0.0518 682 TYR A CA 2910 C C . TYR A 374 ? 0.3800 0.3523 0.3454 0.0830 -0.1162 0.0538 682 TYR A C 2911 O O . TYR A 374 ? 0.4033 0.3872 0.3788 0.0853 -0.1246 0.0563 682 TYR A O 2912 C CB . TYR A 374 ? 0.3163 0.3030 0.3085 0.0787 -0.1057 0.0453 682 TYR A CB 2913 C CG . TYR A 374 ? 0.2958 0.2861 0.3024 0.0795 -0.0962 0.0427 682 TYR A CG 2914 C CD1 . TYR A 374 ? 0.3020 0.3052 0.3306 0.0840 -0.0942 0.0440 682 TYR A CD1 2915 C CD2 . TYR A 374 ? 0.3109 0.2918 0.3086 0.0760 -0.0889 0.0389 682 TYR A CD2 2916 C CE1 . TYR A 374 ? 0.3287 0.3340 0.3684 0.0848 -0.0851 0.0410 682 TYR A CE1 2917 C CE2 . TYR A 374 ? 0.3352 0.3191 0.3449 0.0766 -0.0807 0.0361 682 TYR A CE2 2918 C CZ . TYR A 374 ? 0.3139 0.3092 0.3437 0.0808 -0.0788 0.0369 682 TYR A CZ 2919 O OH . TYR A 374 ? 0.3318 0.3286 0.3713 0.0814 -0.0703 0.0336 682 TYR A OH 2920 N N . SER A 375 ? 0.3881 0.3458 0.3296 0.0799 -0.1153 0.0527 683 SER A N 2921 C CA . SER A 375 ? 0.4141 0.3679 0.3389 0.0783 -0.1245 0.0532 683 SER A CA 2922 C C . SER A 375 ? 0.3984 0.3603 0.3264 0.0720 -0.1300 0.0466 683 SER A C 2923 O O . SER A 375 ? 0.3912 0.3571 0.3160 0.0703 -0.1403 0.0463 683 SER A O 2924 C CB . SER A 375 ? 0.4570 0.3912 0.3535 0.0780 -0.1201 0.0546 683 SER A CB 2925 O OG . SER A 375 ? 0.4462 0.3741 0.3354 0.0738 -0.1121 0.0494 683 SER A OG 2926 N N . GLU A 376 ? 0.3736 0.3373 0.3079 0.0683 -0.1234 0.0415 684 GLU A N 2927 C CA . GLU A 376 ? 0.3702 0.3401 0.3084 0.0618 -0.1274 0.0353 684 GLU A CA 2928 C C . GLU A 376 ? 0.3528 0.3431 0.3180 0.0608 -0.1328 0.0350 684 GLU A C 2929 O O . GLU A 376 ? 0.3376 0.3381 0.3213 0.0655 -0.1300 0.0385 684 GLU A O 2930 C CB . GLU A 376 ? 0.3541 0.3187 0.2898 0.0587 -0.1182 0.0306 684 GLU A CB 2931 C CG . GLU A 376 ? 0.3778 0.3246 0.2902 0.0599 -0.1104 0.0309 684 GLU A CG 2932 C CD . GLU A 376 ? 0.3859 0.3296 0.3029 0.0644 -0.1015 0.0350 684 GLU A CD 2933 O OE1 . GLU A 376 ? 0.3822 0.3351 0.3170 0.0678 -0.1023 0.0382 684 GLU A OE1 2934 O OE2 . GLU A 376 ? 0.3859 0.3179 0.2889 0.0645 -0.0934 0.0351 684 GLU A OE2 2935 N N . LYS A 377 ? 0.3413 0.3373 0.3090 0.0547 -0.1400 0.0309 685 LYS A N 2936 C CA . LYS A 377 ? 0.3400 0.3559 0.3342 0.0522 -0.1435 0.0301 685 LYS A CA 2937 C C . LYS A 377 ? 0.3231 0.3433 0.3300 0.0502 -0.1340 0.0270 685 LYS A C 2938 O O . LYS A 377 ? 0.3109 0.3190 0.3044 0.0476 -0.1286 0.0235 685 LYS A O 2939 C CB . LYS A 377 ? 0.3239 0.3426 0.3162 0.0450 -0.1540 0.0265 685 LYS A CB 2940 C CG . LYS A 377 ? 0.3429 0.3585 0.3231 0.0465 -0.1648 0.0291 685 LYS A CG 2941 C CD . LYS A 377 ? 0.3652 0.3969 0.3642 0.0527 -0.1689 0.0353 685 LYS A CD 2942 C CE . LYS A 377 ? 0.4064 0.4363 0.3940 0.0536 -0.1813 0.0377 685 LYS A CE 2943 N NZ . LYS A 377 ? 0.4076 0.4524 0.4122 0.0608 -0.1855 0.0444 685 LYS A NZ 2944 N N . LEU A 378 ? 0.2890 0.3268 0.3216 0.0518 -0.1318 0.0285 686 LEU A N 2945 C CA . LEU A 378 ? 0.2875 0.3306 0.3330 0.0503 -0.1228 0.0259 686 LEU A CA 2946 C C . LEU A 378 ? 0.2811 0.3288 0.3315 0.0415 -0.1256 0.0213 686 LEU A C 2947 O O . LEU A 378 ? 0.2917 0.3497 0.3518 0.0372 -0.1336 0.0211 686 LEU A O 2948 C CB . LEU A 378 ? 0.2986 0.3582 0.3687 0.0558 -0.1183 0.0290 686 LEU A CB 2949 C CG . LEU A 378 ? 0.3321 0.3871 0.3998 0.0651 -0.1150 0.0338 686 LEU A CG 2950 C CD1 . LEU A 378 ? 0.3466 0.4178 0.4385 0.0709 -0.1099 0.0360 686 LEU A CD1 2951 C CD2 . LEU A 378 ? 0.3288 0.3649 0.3785 0.0667 -0.1072 0.0330 686 LEU A CD2 2952 N N . ALA A 379 ? 0.2440 0.2834 0.2877 0.0385 -0.1191 0.0177 687 ALA A N 2953 C CA . ALA A 379 ? 0.2493 0.2916 0.2981 0.0304 -0.1202 0.0137 687 ALA A CA 2954 C C . ALA A 379 ? 0.2487 0.2977 0.3115 0.0307 -0.1105 0.0128 687 ALA A C 2955 O O . ALA A 379 ? 0.2178 0.2561 0.2696 0.0329 -0.1037 0.0114 687 ALA A O 2956 C CB . ALA A 379 ? 0.2778 0.3012 0.3013 0.0265 -0.1225 0.0098 687 ALA A CB 2957 N N . TYR A 380 ? 0.2371 0.3042 0.3238 0.0285 -0.1095 0.0138 688 TYR A N 2958 C CA . TYR A 380 ? 0.2223 0.2977 0.3239 0.0296 -0.0996 0.0136 688 TYR A CA 2959 C C . TYR A 380 ? 0.1978 0.2709 0.2994 0.0220 -0.0975 0.0104 688 TYR A C 2960 O O . TYR A 380 ? 0.2032 0.2802 0.3096 0.0143 -0.1030 0.0095 688 TYR A O 2961 C CB . TYR A 380 ? 0.1982 0.2949 0.3259 0.0314 -0.0976 0.0164 688 TYR A CB 2962 C CG . TYR A 380 ? 0.2081 0.3093 0.3406 0.0410 -0.0960 0.0199 688 TYR A CG 2963 C CD1 . TYR A 380 ? 0.2066 0.2926 0.3214 0.0472 -0.0953 0.0208 688 TYR A CD1 2964 C CD2 . TYR A 380 ? 0.1944 0.3148 0.3493 0.0440 -0.0946 0.0224 688 TYR A CD2 2965 C CE1 . TYR A 380 ? 0.1927 0.2814 0.3118 0.0559 -0.0938 0.0244 688 TYR A CE1 2966 C CE2 . TYR A 380 ? 0.1986 0.3224 0.3576 0.0536 -0.0930 0.0255 688 TYR A CE2 2967 C CZ . TYR A 380 ? 0.2060 0.3133 0.3470 0.0594 -0.0928 0.0267 688 TYR A CZ 2968 O OH . TYR A 380 ? 0.2572 0.3667 0.4022 0.0689 -0.0913 0.0303 688 TYR A OH 2969 N N . MET A 381 ? 0.1867 0.2532 0.2832 0.0242 -0.0895 0.0087 689 MET A N 2970 C CA . MET A 381 ? 0.1958 0.2640 0.2967 0.0184 -0.0833 0.0068 689 MET A CA 2971 C C . MET A 381 ? 0.1912 0.2789 0.3175 0.0192 -0.0771 0.0091 689 MET A C 2972 O O . MET A 381 ? 0.1980 0.2936 0.3343 0.0265 -0.0749 0.0112 689 MET A O 2973 C CB . MET A 381 ? 0.1636 0.2174 0.2467 0.0207 -0.0734 0.0043 689 MET A CB 2974 C CG . MET A 381 ? 0.2148 0.2506 0.2739 0.0200 -0.0773 0.0021 689 MET A CG 2975 S SD . MET A 381 ? 0.2851 0.3143 0.3378 0.0106 -0.0826 -0.0006 689 MET A SD 2976 C CE . MET A 381 ? 0.2100 0.2361 0.2608 0.0088 -0.0700 -0.0020 689 MET A CE 2977 N N . PRO A 382 ? 0.2041 0.2986 0.3400 0.0120 -0.0734 0.0091 690 PRO A N 2978 C CA . PRO A 382 ? 0.2045 0.3193 0.3659 0.0121 -0.0678 0.0120 690 PRO A CA 2979 C C . PRO A 382 ? 0.1946 0.3110 0.3571 0.0193 -0.0543 0.0116 690 PRO A C 2980 O O . PRO A 382 ? 0.1587 0.2912 0.3409 0.0233 -0.0495 0.0139 690 PRO A O 2981 C CB . PRO A 382 ? 0.2196 0.3371 0.3862 0.0015 -0.0669 0.0122 690 PRO A CB 2982 C CG . PRO A 382 ? 0.1893 0.2854 0.3304 -0.0013 -0.0664 0.0087 690 PRO A CG 2983 C CD . PRO A 382 ? 0.2011 0.2846 0.3253 0.0036 -0.0741 0.0068 690 PRO A CD 2984 N N . HIS A 383 ? 0.1747 0.2750 0.3167 0.0210 -0.0483 0.0087 691 HIS A N 2985 C CA . HIS A 383 ? 0.1983 0.2980 0.3390 0.0270 -0.0366 0.0076 691 HIS A CA 2986 C C . HIS A 383 ? 0.2027 0.2895 0.3293 0.0342 -0.0369 0.0060 691 HIS A C 2987 O O . HIS A 383 ? 0.2423 0.3336 0.3768 0.0411 -0.0386 0.0075 691 HIS A O 2988 C CB . HIS A 383 ? 0.2126 0.3071 0.3449 0.0220 -0.0284 0.0060 691 HIS A CB 2989 C CG . HIS A 383 ? 0.2741 0.3813 0.4213 0.0151 -0.0264 0.0085 691 HIS A CG 2990 N ND1 . HIS A 383 ? 0.2871 0.3897 0.4302 0.0063 -0.0313 0.0089 691 HIS A ND1 2991 C CD2 . HIS A 383 ? 0.2890 0.4134 0.4559 0.0157 -0.0199 0.0112 691 HIS A CD2 2992 C CE1 . HIS A 383 ? 0.2952 0.4110 0.4548 0.0008 -0.0280 0.0120 691 HIS A CE1 2993 N NE2 . HIS A 383 ? 0.3133 0.4436 0.4881 0.0064 -0.0208 0.0136 691 HIS A NE2 2994 N N . THR A 384 ? 0.1656 0.2368 0.2724 0.0327 -0.0354 0.0034 692 THR A N 2995 C CA . THR A 384 ? 0.1755 0.2342 0.2691 0.0377 -0.0372 0.0028 692 THR A CA 2996 C C . THR A 384 ? 0.1847 0.2319 0.2626 0.0339 -0.0439 0.0022 692 THR A C 2997 O O . THR A 384 ? 0.1971 0.2428 0.2713 0.0277 -0.0450 0.0012 692 THR A O 2998 C CB . THR A 384 ? 0.1956 0.2459 0.2805 0.0408 -0.0281 0.0003 692 THR A CB 2999 O OG1 . THR A 384 ? 0.2265 0.2649 0.3000 0.0447 -0.0301 0.0004 692 THR A OG1 3000 C CG2 . THR A 384 ? 0.2051 0.2500 0.2799 0.0353 -0.0240 -0.0019 692 THR A CG2 3001 N N . PHE A 385 ? 0.1588 0.1972 0.2267 0.0377 -0.0479 0.0030 693 PHE A N 3002 C CA . PHE A 385 ? 0.1892 0.2152 0.2396 0.0353 -0.0522 0.0023 693 PHE A CA 3003 C C . PHE A 385 ? 0.1841 0.2006 0.2225 0.0344 -0.0447 0.0001 693 PHE A C 3004 O O . PHE A 385 ? 0.2061 0.2141 0.2319 0.0319 -0.0456 -0.0010 693 PHE A O 3005 C CB . PHE A 385 ? 0.2263 0.2459 0.2688 0.0398 -0.0585 0.0046 693 PHE A CB 3006 C CG . PHE A 385 ? 0.2164 0.2273 0.2515 0.0448 -0.0529 0.0055 693 PHE A CG 3007 C CD1 . PHE A 385 ? 0.2269 0.2249 0.2448 0.0442 -0.0505 0.0052 693 PHE A CD1 3008 C CD2 . PHE A 385 ? 0.2404 0.2555 0.2861 0.0500 -0.0496 0.0068 693 PHE A CD2 3009 C CE1 . PHE A 385 ? 0.2499 0.2400 0.2623 0.0475 -0.0454 0.0064 693 PHE A CE1 3010 C CE2 . PHE A 385 ? 0.2112 0.2161 0.2497 0.0538 -0.0449 0.0074 693 PHE A CE2 3011 C CZ . PHE A 385 ? 0.2216 0.2142 0.2439 0.0519 -0.0430 0.0074 693 PHE A CZ 3012 N N . PHE A 386 ? 0.1769 0.1947 0.2195 0.0368 -0.0374 -0.0006 694 PHE A N 3013 C CA . PHE A 386 ? 0.1768 0.1869 0.2097 0.0356 -0.0314 -0.0025 694 PHE A CA 3014 C C . PHE A 386 ? 0.2118 0.2240 0.2441 0.0307 -0.0292 -0.0042 694 PHE A C 3015 O O . PHE A 386 ? 0.2120 0.2323 0.2534 0.0283 -0.0297 -0.0040 694 PHE A O 3016 C CB . PHE A 386 ? 0.1912 0.1997 0.2264 0.0391 -0.0255 -0.0032 694 PHE A CB 3017 C CG . PHE A 386 ? 0.2236 0.2214 0.2480 0.0397 -0.0236 -0.0032 694 PHE A CG 3018 C CD1 . PHE A 386 ? 0.2280 0.2226 0.2476 0.0369 -0.0191 -0.0052 694 PHE A CD1 3019 C CD2 . PHE A 386 ? 0.2625 0.2536 0.2815 0.0426 -0.0266 -0.0005 694 PHE A CD2 3020 C CE1 . PHE A 386 ? 0.2713 0.2578 0.2834 0.0366 -0.0174 -0.0046 694 PHE A CE1 3021 C CE2 . PHE A 386 ? 0.2623 0.2439 0.2720 0.0424 -0.0240 0.0004 694 PHE A CE2 3022 C CZ . PHE A 386 ? 0.2585 0.2386 0.2660 0.0391 -0.0192 -0.0018 694 PHE A CZ 3023 N N . ILE A 387 ? 0.2009 0.2058 0.2229 0.0294 -0.0267 -0.0053 695 ILE A N 3024 C CA . ILE A 387 ? 0.1830 0.1878 0.2026 0.0257 -0.0250 -0.0064 695 ILE A CA 3025 C C . ILE A 387 ? 0.1740 0.1735 0.1862 0.0262 -0.0210 -0.0073 695 ILE A C 3026 O O . ILE A 387 ? 0.2125 0.2077 0.2209 0.0284 -0.0202 -0.0069 695 ILE A O 3027 C CB . ILE A 387 ? 0.2075 0.2087 0.2222 0.0231 -0.0302 -0.0062 695 ILE A CB 3028 C CG1 . ILE A 387 ? 0.2322 0.2325 0.2456 0.0194 -0.0286 -0.0068 695 ILE A CG1 3029 C CG2 . ILE A 387 ? 0.1971 0.1890 0.1996 0.0253 -0.0320 -0.0062 695 ILE A CG2 3030 C CD1 . ILE A 387 ? 0.1925 0.2015 0.2164 0.0168 -0.0261 -0.0060 695 ILE A CD1 3031 N N . GLY A 388 ? 0.2004 0.2003 0.2111 0.0240 -0.0187 -0.0080 696 GLY A N 3032 C CA . GLY A 388 ? 0.1990 0.1959 0.2047 0.0242 -0.0161 -0.0086 696 GLY A CA 3033 C C . GLY A 388 ? 0.2025 0.1986 0.2050 0.0224 -0.0160 -0.0085 696 GLY A C 3034 O O . GLY A 388 ? 0.2181 0.2162 0.2229 0.0203 -0.0165 -0.0081 696 GLY A O 3035 N N . ASP A 389 ? 0.1833 0.1768 0.1815 0.0233 -0.0152 -0.0083 697 ASP A N 3036 C CA . ASP A 389 ? 0.1715 0.1630 0.1663 0.0228 -0.0155 -0.0077 697 ASP A CA 3037 C C . ASP A 389 ? 0.1982 0.1931 0.1938 0.0218 -0.0141 -0.0077 697 ASP A C 3038 O O . ASP A 389 ? 0.1922 0.1858 0.1851 0.0224 -0.0145 -0.0067 697 ASP A O 3039 C CB . ASP A 389 ? 0.1897 0.1772 0.1799 0.0255 -0.0153 -0.0072 697 ASP A CB 3040 C CG . ASP A 389 ? 0.2324 0.2151 0.2181 0.0262 -0.0162 -0.0067 697 ASP A CG 3041 O OD1 . ASP A 389 ? 0.2775 0.2563 0.2614 0.0242 -0.0183 -0.0069 697 ASP A OD1 3042 O OD2 . ASP A 389 ? 0.2088 0.1917 0.1937 0.0287 -0.0148 -0.0059 697 ASP A OD2 3043 N N . HIS A 390 ? 0.1726 0.1709 0.1710 0.0209 -0.0126 -0.0089 698 HIS A N 3044 C CA . HIS A 390 ? 0.1548 0.1549 0.1514 0.0199 -0.0118 -0.0096 698 HIS A CA 3045 C C . HIS A 390 ? 0.1674 0.1671 0.1600 0.0189 -0.0120 -0.0080 698 HIS A C 3046 O O . HIS A 390 ? 0.1786 0.1786 0.1678 0.0189 -0.0131 -0.0076 698 HIS A O 3047 C CB . HIS A 390 ? 0.1803 0.1817 0.1783 0.0196 -0.0097 -0.0118 698 HIS A CB 3048 C CG . HIS A 390 ? 0.1923 0.1923 0.1932 0.0206 -0.0095 -0.0129 698 HIS A CG 3049 N ND1 . HIS A 390 ? 0.1803 0.1793 0.1840 0.0221 -0.0101 -0.0119 698 HIS A ND1 3050 C CD2 . HIS A 390 ? 0.1891 0.1873 0.1897 0.0201 -0.0092 -0.0148 698 HIS A CD2 3051 C CE1 . HIS A 390 ? 0.1789 0.1754 0.1836 0.0229 -0.0097 -0.0124 698 HIS A CE1 3052 N NE2 . HIS A 390 ? 0.1909 0.1867 0.1944 0.0214 -0.0090 -0.0143 698 HIS A NE2 3053 N N . ALA A 391 ? 0.1587 0.1573 0.1518 0.0176 -0.0115 -0.0067 699 ALA A N 3054 C CA . ALA A 391 ? 0.1840 0.1808 0.1727 0.0161 -0.0111 -0.0044 699 ALA A CA 3055 C C . ALA A 391 ? 0.2280 0.2201 0.2127 0.0177 -0.0137 -0.0026 699 ALA A C 3056 O O . ALA A 391 ? 0.2406 0.2308 0.2202 0.0178 -0.0143 -0.0006 699 ALA A O 3057 C CB . ALA A 391 ? 0.2250 0.2219 0.2169 0.0133 -0.0099 -0.0029 699 ALA A CB 3058 N N . ASN A 392 ? 0.2123 0.2023 0.1987 0.0197 -0.0151 -0.0033 700 ASN A N 3059 C CA . ASN A 392 ? 0.2377 0.2235 0.2212 0.0228 -0.0166 -0.0020 700 ASN A CA 3060 C C . ASN A 392 ? 0.2444 0.2354 0.2303 0.0253 -0.0170 -0.0021 700 ASN A C 3061 O O . ASN A 392 ? 0.2345 0.2255 0.2193 0.0277 -0.0183 -0.0002 700 ASN A O 3062 C CB . ASN A 392 ? 0.2861 0.2661 0.2684 0.0241 -0.0172 -0.0028 700 ASN A CB 3063 C CG . ASN A 392 ? 0.3323 0.3076 0.3114 0.0288 -0.0174 -0.0020 700 ASN A CG 3064 O OD1 . ASN A 392 ? 0.3691 0.3402 0.3451 0.0301 -0.0183 0.0000 700 ASN A OD1 3065 N ND2 . ASN A 392 ? 0.3021 0.2781 0.2819 0.0318 -0.0161 -0.0033 700 ASN A ND2 3066 N N . MET A 393 ? 0.2449 0.2405 0.2350 0.0247 -0.0160 -0.0040 701 MET A N 3067 C CA . MET A 393 ? 0.2284 0.2295 0.2228 0.0258 -0.0164 -0.0040 701 MET A CA 3068 C C . MET A 393 ? 0.1754 0.1806 0.1695 0.0238 -0.0185 -0.0043 701 MET A C 3069 O O . MET A 393 ? 0.1832 0.1930 0.1805 0.0248 -0.0207 -0.0032 701 MET A O 3070 C CB . MET A 393 ? 0.2043 0.2069 0.2026 0.0251 -0.0146 -0.0055 701 MET A CB 3071 C CG . MET A 393 ? 0.2098 0.2098 0.2078 0.0280 -0.0128 -0.0047 701 MET A CG 3072 S SD . MET A 393 ? 0.2208 0.2211 0.2212 0.0271 -0.0106 -0.0053 701 MET A SD 3073 C CE . MET A 393 ? 0.1765 0.1844 0.1849 0.0254 -0.0101 -0.0045 701 MET A CE 3074 N N . PHE A 394 ? 0.1720 0.1757 0.1623 0.0212 -0.0178 -0.0059 702 PHE A N 3075 C CA . PHE A 394 ? 0.1466 0.1521 0.1333 0.0193 -0.0197 -0.0071 702 PHE A CA 3076 C C . PHE A 394 ? 0.1548 0.1570 0.1330 0.0186 -0.0190 -0.0061 702 PHE A C 3077 O O . PHE A 394 ? 0.1857 0.1868 0.1594 0.0169 -0.0172 -0.0083 702 PHE A O 3078 C CB . PHE A 394 ? 0.1439 0.1495 0.1320 0.0172 -0.0186 -0.0107 702 PHE A CB 3079 C CG . PHE A 394 ? 0.2361 0.2434 0.2319 0.0174 -0.0180 -0.0109 702 PHE A CG 3080 C CD1 . PHE A 394 ? 0.2222 0.2343 0.2238 0.0173 -0.0201 -0.0096 702 PHE A CD1 3081 C CD2 . PHE A 394 ? 0.2383 0.2428 0.2359 0.0177 -0.0151 -0.0119 702 PHE A CD2 3082 C CE1 . PHE A 394 ? 0.2375 0.2511 0.2458 0.0171 -0.0184 -0.0091 702 PHE A CE1 3083 C CE2 . PHE A 394 ? 0.2042 0.2089 0.2069 0.0179 -0.0142 -0.0114 702 PHE A CE2 3084 C CZ . PHE A 394 ? 0.2480 0.2570 0.2556 0.0173 -0.0153 -0.0100 702 PHE A CZ 3085 N N . PRO A 395 ? 0.2005 0.2002 0.1758 0.0200 -0.0200 -0.0027 703 PRO A N 3086 C CA . PRO A 395 ? 0.2226 0.2184 0.1896 0.0187 -0.0185 -0.0007 703 PRO A CA 3087 C C . PRO A 395 ? 0.2183 0.2142 0.1763 0.0181 -0.0208 -0.0009 703 PRO A C 3088 O O . PRO A 395 ? 0.1878 0.1806 0.1371 0.0167 -0.0183 0.0002 703 PRO A O 3089 C CB . PRO A 395 ? 0.2181 0.2091 0.1840 0.0206 -0.0197 0.0033 703 PRO A CB 3090 C CG . PRO A 395 ? 0.2043 0.1985 0.1756 0.0240 -0.0231 0.0035 703 PRO A CG 3091 C CD . PRO A 395 ? 0.1864 0.1859 0.1650 0.0232 -0.0221 -0.0001 703 PRO A CD 3092 N N . HIS A 396 ? 0.1770 0.1769 0.1371 0.0186 -0.0255 -0.0020 704 HIS A N 3093 C CA . HIS A 396 ? 0.2122 0.2119 0.1629 0.0176 -0.0294 -0.0028 704 HIS A CA 3094 C C . HIS A 396 ? 0.1852 0.1826 0.1296 0.0151 -0.0265 -0.0075 704 HIS A C 3095 O O . HIS A 396 ? 0.2110 0.2057 0.1435 0.0141 -0.0286 -0.0088 704 HIS A O 3096 C CB . HIS A 396 ? 0.2026 0.2086 0.1596 0.0181 -0.0362 -0.0027 704 HIS A CB 3097 C CG . HIS A 396 ? 0.2211 0.2318 0.1896 0.0166 -0.0359 -0.0060 704 HIS A CG 3098 N ND1 . HIS A 396 ? 0.2126 0.2242 0.1904 0.0178 -0.0316 -0.0058 704 HIS A ND1 3099 C CD2 . HIS A 396 ? 0.1964 0.2103 0.1679 0.0136 -0.0396 -0.0092 704 HIS A CD2 3100 C CE1 . HIS A 396 ? 0.2016 0.2167 0.1872 0.0159 -0.0319 -0.0082 704 HIS A CE1 3101 N NE2 . HIS A 396 ? 0.1921 0.2087 0.1749 0.0130 -0.0367 -0.0103 704 HIS A NE2 3102 N N . LEU A 397 ? 0.2057 0.2035 0.1572 0.0146 -0.0218 -0.0102 705 LEU A N 3103 C CA . LEU A 397 ? 0.2314 0.2263 0.1781 0.0136 -0.0181 -0.0147 705 LEU A CA 3104 C C . LEU A 397 ? 0.2721 0.2651 0.2148 0.0142 -0.0111 -0.0137 705 LEU A C 3105 O O . LEU A 397 ? 0.2543 0.2456 0.1943 0.0145 -0.0065 -0.0172 705 LEU A O 3106 C CB . LEU A 397 ? 0.2047 0.2008 0.1618 0.0133 -0.0173 -0.0178 705 LEU A CB 3107 C CG . LEU A 397 ? 0.2026 0.2016 0.1658 0.0119 -0.0231 -0.0184 705 LEU A CG 3108 C CD1 . LEU A 397 ? 0.2175 0.2166 0.1902 0.0114 -0.0213 -0.0202 705 LEU A CD1 3109 C CD2 . LEU A 397 ? 0.2045 0.2012 0.1583 0.0094 -0.0282 -0.0213 705 LEU A CD2 3110 N N . LYS A 398 ? 0.1931 0.2773 0.2652 0.0210 0.0455 -0.0161 706 LYS A N 3111 C CA . LYS A 398 ? 0.2256 0.3267 0.3009 0.0174 0.0594 -0.0186 706 LYS A CA 3112 C C . LYS A 398 ? 0.2200 0.2997 0.2879 0.0094 0.0637 -0.0188 706 LYS A C 3113 O O . LYS A 398 ? 0.2352 0.3271 0.3182 0.0024 0.0683 -0.0283 706 LYS A O 3114 C CB . LYS A 398 ? 0.2730 0.3614 0.3489 -0.0050 0.0766 -0.0502 706 LYS A CB 3115 C CG . LYS A 398 ? 0.3067 0.4377 0.3920 -0.0060 0.0701 -0.0733 706 LYS A CG 3116 C CD . LYS A 398 ? 0.4146 0.5259 0.5032 -0.0357 0.0934 -0.1141 706 LYS A CD 3117 C CE . LYS A 398 ? 0.4664 0.6406 0.5652 -0.0425 0.0835 -0.1523 706 LYS A CE 3118 N NZ . LYS A 398 ? 0.4820 0.6733 0.5563 -0.0064 0.0657 -0.1267 706 LYS A NZ 3119 N N . LYS A 399 ? 0.1723 0.2107 0.2200 0.0088 0.0652 -0.0068 707 LYS A N 3120 C CA . LYS A 399 ? 0.2186 0.2291 0.2569 0.0049 0.0725 -0.0018 707 LYS A CA 3121 C C . LYS A 399 ? 0.2317 0.2229 0.2578 0.0181 0.0617 0.0194 707 LYS A C 3122 O O . LYS A 399 ? 0.2201 0.2064 0.2435 0.0305 0.0495 0.0385 707 LYS A O 3123 C CB . LYS A 399 ? 0.3208 0.2893 0.3462 -0.0053 0.0913 -0.0015 707 LYS A CB 3124 C CG . LYS A 399 ? 0.4238 0.3966 0.4677 -0.0235 0.1090 -0.0239 707 LYS A CG 3125 C CD . LYS A 399 ? 0.5296 0.4564 0.5640 -0.0303 0.1313 -0.0230 707 LYS A CD 3126 C CE . LYS A 399 ? 0.5857 0.5092 0.6434 -0.0532 0.1538 -0.0510 707 LYS A CE 3127 N NZ . LYS A 399 ? 0.6748 0.5516 0.7260 -0.0543 0.1802 -0.0485 707 LYS A NZ 3128 N N . LYS A 400 ? 0.2138 0.1960 0.2330 0.0186 0.0670 0.0193 708 LYS A N 3129 C CA . LYS A 400 ? 0.2070 0.1749 0.2164 0.0332 0.0606 0.0370 708 LYS A CA 3130 C C . LYS A 400 ? 0.2497 0.2012 0.2309 0.0265 0.0701 0.0327 708 LYS A C 3131 O O . LYS A 400 ? 0.2789 0.2324 0.2570 0.0164 0.0836 0.0204 708 LYS A O 3132 C CB . LYS A 400 ? 0.1987 0.1898 0.2289 0.0379 0.0479 0.0356 708 LYS A CB 3133 C CG . LYS A 400 ? 0.2464 0.2481 0.2903 0.0407 0.0549 0.0089 708 LYS A CG 3134 C CD . LYS A 400 ? 0.2803 0.2901 0.3459 0.0518 0.0343 0.0058 708 LYS A CD 3135 C CE . LYS A 400 ? 0.3193 0.3375 0.3939 0.0606 0.0449 -0.0163 708 LYS A CE 3136 N NZ . LYS A 400 ? 0.3139 0.3773 0.4012 0.0589 0.0489 -0.0243 708 LYS A NZ 3137 N N . ALA A 401 ? 0.2783 0.2274 0.2421 0.0266 0.0549 0.0420 709 ALA A N 3138 C CA . ALA A 401 ? 0.2819 0.2152 0.2080 0.0223 0.0629 0.0425 709 ALA A CA 3139 C C . ALA A 401 ? 0.2787 0.1879 0.1803 0.0269 0.0461 0.0493 709 ALA A C 3140 O O . ALA A 401 ? 0.2457 0.1696 0.1863 0.0255 0.0174 0.0545 709 ALA A O 3141 C CB . ALA A 401 ? 0.2809 0.2284 0.2024 0.0121 0.0544 0.0514 709 ALA A CB 3142 N N . VAL A 402 ? 0.3093 0.2089 0.1780 0.0242 0.0475 0.0264 710 VAL A N 3143 C CA . VAL A 402 ? 0.3539 0.2347 0.2189 0.0216 0.0173 0.0135 710 VAL A CA 3144 C C . VAL A 402 ? 0.3746 0.2545 0.1823 0.0089 0.0071 0.0148 710 VAL A C 3145 O O . VAL A 402 ? 0.4394 0.3369 0.2081 0.0078 0.0288 0.0233 710 VAL A O 3146 C CB . VAL A 402 ? 0.3740 0.2403 0.2600 0.0324 0.0224 -0.0268 710 VAL A CB 3147 C CG1 . VAL A 402 ? 0.2777 0.1615 0.2248 0.0460 0.0287 -0.0210 710 VAL A CG1 3148 C CG2 . VAL A 402 ? 0.4267 0.2977 0.2741 0.0364 0.0518 -0.0560 710 VAL A CG2 3149 N N . ILE A 403 ? 0.3914 0.2559 0.1976 -0.0016 -0.0266 0.0090 711 ILE A N 3150 C CA . ILE A 403 ? 0.4310 0.3025 0.1820 -0.0173 -0.0427 0.0019 711 ILE A CA 3151 C C . ILE A 403 ? 0.5021 0.3420 0.2358 -0.0196 -0.0489 -0.0551 711 ILE A C 3152 O O . ILE A 403 ? 0.5309 0.3358 0.3057 -0.0206 -0.0658 -0.0721 711 ILE A O 3153 C CB . ILE A 403 ? 0.4717 0.3538 0.2328 -0.0342 -0.0803 0.0369 711 ILE A CB 3154 C CG1 . ILE A 403 ? 0.4415 0.3718 0.2495 -0.0193 -0.0575 0.0809 711 ILE A CG1 3155 C CG2 . ILE A 403 ? 0.5411 0.4374 0.2472 -0.0553 -0.1033 0.0202 711 ILE A CG2 3156 C CD1 . ILE A 403 ? 0.4079 0.3666 0.2488 -0.0212 -0.0684 0.0958 711 ILE A CD1 3157 N N . ASP A 404 ? 0.5430 0.3944 0.2171 -0.0177 -0.0322 -0.0833 712 ASP A N 3158 C CA . ASP A 404 ? 0.7051 0.5246 0.3503 -0.0179 -0.0360 -0.1429 712 ASP A CA 3159 C C . ASP A 404 ? 0.8357 0.6482 0.4517 -0.0459 -0.0779 -0.1584 712 ASP A C 3160 O O . ASP A 404 ? 0.8814 0.7430 0.4522 -0.0571 -0.0865 -0.1451 712 ASP A O 3161 C CB . ASP A 404 ? 0.7517 0.6021 0.3517 -0.0021 -0.0011 -0.1645 712 ASP A CB 3162 C CG . ASP A 404 ? 0.8557 0.6951 0.4544 0.0026 0.0012 -0.2216 712 ASP A CG 3163 O OD1 . ASP A 404 ? 0.8999 0.7827 0.4608 0.0067 0.0134 -0.2378 712 ASP A OD1 3164 O OD2 . ASP A 404 ? 0.8725 0.6628 0.5138 0.0020 -0.0060 -0.2454 712 ASP A OD2 3165 N N . PHE A 405 ? 0.8844 0.6459 0.5411 -0.0561 -0.1019 -0.1820 713 PHE A N 3166 C CA . PHE A 405 ? 0.9489 0.7127 0.6096 -0.0866 -0.1393 -0.1929 713 PHE A CA 3167 C C . PHE A 405 ? 1.0738 0.8238 0.7209 -0.0900 -0.1314 -0.2592 713 PHE A C 3168 O O . PHE A 405 ? 1.1336 0.8670 0.8002 -0.1152 -0.1554 -0.2823 713 PHE A O 3169 C CB . PHE A 405 ? 0.9181 0.6501 0.6535 -0.0991 -0.1669 -0.1635 713 PHE A CB 3170 C CG . PHE A 405 ? 0.9350 0.6140 0.7341 -0.0816 -0.1488 -0.1846 713 PHE A CG 3171 C CD1 . PHE A 405 ? 0.8739 0.5457 0.7010 -0.0498 -0.1200 -0.1719 713 PHE A CD1 3172 C CD2 . PHE A 405 ? 0.9963 0.6408 0.8298 -0.0973 -0.1560 -0.2120 713 PHE A CD2 3173 C CE1 . PHE A 405 ? 0.8667 0.5107 0.7549 -0.0315 -0.0982 -0.1794 713 PHE A CE1 3174 C CE2 . PHE A 405 ? 1.0030 0.6033 0.8903 -0.0797 -0.1319 -0.2197 713 PHE A CE2 3175 C CZ . PHE A 405 ? 0.9409 0.5462 0.8547 -0.0453 -0.1032 -0.1999 713 PHE A CZ 3176 N N . LYS A 406 ? 1.1075 0.8690 0.7243 -0.0663 -0.0951 -0.2883 714 LYS A N 3177 C CA . LYS A 406 ? 1.1785 0.9318 0.7742 -0.0695 -0.0802 -0.3465 714 LYS A CA 3178 C C . LYS A 406 ? 1.1573 0.9797 0.6947 -0.0496 -0.0685 -0.3530 714 LYS A C 3179 O O . LYS A 406 ? 1.2163 0.9388 0.6618 -0.0469 -0.0286 -0.3469 714 LYS A O 3180 C CB . LYS A 406 ? 1.2186 0.9032 0.8428 -0.0538 -0.0414 -0.3603 714 LYS A CB 3181 C CG . LYS A 406 ? 1.2129 0.8346 0.9040 -0.0595 -0.0520 -0.3514 714 LYS A CG 3182 C CD . LYS A 406 ? 1.2563 0.8127 0.9596 -0.0337 -0.0157 -0.3599 714 LYS A CD 3183 C CE . LYS A 406 ? 1.2449 0.7408 1.0089 -0.0367 -0.0251 -0.3477 714 LYS A CE 3184 N NZ . LYS A 406 ? 1.2819 0.7151 1.0462 -0.0037 0.0036 -0.3544 714 LYS A NZ 3185 N N . HIS A 410 ? 1.2675 0.8962 0.8914 0.0495 0.0918 -0.3490 718 HIS A N 3186 C CA . HIS A 410 ? 1.1787 0.8685 0.8648 0.0652 0.1170 -0.3185 718 HIS A CA 3187 C C . HIS A 410 ? 1.0201 0.7704 0.7658 0.0564 0.0909 -0.2928 718 HIS A C 3188 O O . HIS A 410 ? 1.0347 0.7687 0.7611 0.0378 0.0599 -0.2919 718 HIS A O 3189 C CB . HIS A 410 ? 1.2524 0.8813 0.9409 0.1132 0.1243 -0.2979 718 HIS A CB 3190 C CG . HIS A 410 ? 1.4009 0.9928 1.0459 0.1380 0.1456 -0.3258 718 HIS A CG 3191 N ND1 . HIS A 410 ? 1.3371 1.0918 1.1147 0.1146 0.1811 -0.3750 718 HIS A ND1 3192 C CD2 . HIS A 410 ? 1.5240 1.0478 1.1381 0.1506 0.1349 -0.3612 718 HIS A CD2 3193 C CE1 . HIS A 410 ? 1.4495 1.1598 1.2001 0.1231 0.2082 -0.4071 718 HIS A CE1 3194 N NE2 . HIS A 410 ? 1.6073 1.1229 1.1850 0.1750 0.1695 -0.3762 718 HIS A NE2 3195 N N . ILE A 411 ? 0.7173 0.5409 0.4662 0.0721 0.1792 0.0070 719 ILE A N 3196 C CA . ILE A 411 ? 0.6515 0.4972 0.4207 0.0668 0.1676 0.0069 719 ILE A CA 3197 C C . ILE A 411 ? 0.5821 0.4530 0.3912 0.0644 0.1648 0.0049 719 ILE A C 3198 O O . ILE A 411 ? 0.5946 0.4766 0.4346 0.0672 0.1773 0.0116 719 ILE A O 3199 C CB . ILE A 411 ? 0.6750 0.5269 0.4567 0.0677 0.1768 0.0188 719 ILE A CB 3200 C CG1 . ILE A 411 ? 0.7284 0.5564 0.4691 0.0699 0.1762 0.0198 719 ILE A CG1 3201 C CG2 . ILE A 411 ? 0.6546 0.5295 0.4610 0.0618 0.1669 0.0198 719 ILE A CG2 3202 C CD1 . ILE A 411 ? 0.7460 0.5768 0.4967 0.0717 0.1867 0.0320 719 ILE A CD1 3203 N N . TYR A 412 ? 0.5378 0.4175 0.3464 0.0594 0.1470 -0.0038 720 TYR A N 3204 C CA . TYR A 412 ? 0.4740 0.3769 0.3183 0.0575 0.1420 -0.0070 720 TYR A CA 3205 C C . TYR A 412 ? 0.4095 0.3374 0.2873 0.0504 0.1278 -0.0028 720 TYR A C 3206 O O . TYR A 412 ? 0.4012 0.3243 0.2624 0.0466 0.1151 -0.0037 720 TYR A O 3207 C CB . TYR A 412 ? 0.4962 0.3925 0.3225 0.0545 0.1247 -0.0203 720 TYR A CB 3208 C CG . TYR A 412 ? 0.5515 0.4303 0.3592 0.0565 0.1285 -0.0248 720 TYR A CG 3209 C CD1 . TYR A 412 ? 0.5854 0.4641 0.4089 0.0616 0.1461 -0.0183 720 TYR A CD1 3210 C CD2 . TYR A 412 ? 0.6178 0.4811 0.3945 0.0526 0.1137 -0.0347 720 TYR A CD2 3211 C CE1 . TYR A 412 ? 0.6449 0.5050 0.4493 0.0637 0.1506 -0.0221 720 TYR A CE1 3212 C CE2 . TYR A 412 ? 0.6509 0.4980 0.4115 0.0537 0.1177 -0.0388 720 TYR A CE2 3213 C CZ . TYR A 412 ? 0.6882 0.5320 0.4605 0.0597 0.1369 -0.0327 720 TYR A CZ 3214 O OH . TYR A 412 ? 0.7341 0.5590 0.4878 0.0611 0.1418 -0.0365 720 TYR A OH 3215 N N . ASP A 413 ? 0.3027 0.2570 0.2273 0.0482 0.1281 0.0017 721 ASP A N 3216 C CA . ASP A 413 ? 0.2833 0.2600 0.2396 0.0403 0.1128 0.0046 721 ASP A CA 3217 C C . ASP A 413 ? 0.3018 0.2909 0.2687 0.0352 0.0902 -0.0046 721 ASP A C 3218 O O . ASP A 413 ? 0.2550 0.2609 0.2464 0.0290 0.0773 -0.0031 721 ASP A O 3219 C CB . ASP A 413 ? 0.3153 0.3145 0.3172 0.0390 0.1239 0.0157 721 ASP A CB 3220 C CG . ASP A 413 ? 0.3312 0.3490 0.3644 0.0406 0.1257 0.0152 721 ASP A CG 3221 O OD1 . ASP A 413 ? 0.3160 0.3263 0.3339 0.0440 0.1224 0.0066 721 ASP A OD1 3222 O OD2 . ASP A 413 ? 0.3285 0.3686 0.4024 0.0384 0.1306 0.0239 721 ASP A OD2 3223 N N . ASN A 414 ? 0.3074 0.2868 0.2551 0.0379 0.0859 -0.0139 722 ASN A N 3224 C CA . ASN A 414 ? 0.2602 0.2528 0.2229 0.0342 0.0674 -0.0215 722 ASN A CA 3225 C C . ASN A 414 ? 0.2872 0.2634 0.2180 0.0347 0.0569 -0.0324 722 ASN A C 3226 O O . ASN A 414 ? 0.2606 0.2446 0.2029 0.0342 0.0482 -0.0387 722 ASN A O 3227 C CB . ASN A 414 ? 0.2091 0.2220 0.2094 0.0360 0.0732 -0.0190 722 ASN A CB 3228 C CG . ASN A 414 ? 0.2723 0.2738 0.2626 0.0437 0.0921 -0.0193 722 ASN A CG 3229 O OD1 . ASN A 414 ? 0.2635 0.2397 0.2160 0.0474 0.1005 -0.0226 722 ASN A OD1 3230 N ND2 . ASN A 414 ? 0.2698 0.2892 0.2929 0.0465 0.0991 -0.0155 722 ASN A ND2 3231 N N . ARG A 415 ? 0.2964 0.2501 0.1873 0.0354 0.0575 -0.0344 723 ARG A N 3232 C CA . ARG A 415 ? 0.3070 0.2445 0.1655 0.0341 0.0454 -0.0444 723 ARG A CA 3233 C C . ARG A 415 ? 0.3243 0.2651 0.1760 0.0287 0.0246 -0.0452 723 ARG A C 3234 O O . ARG A 415 ? 0.2726 0.2183 0.1273 0.0255 0.0082 -0.0515 723 ARG A O 3235 C CB . ARG A 415 ? 0.3847 0.2930 0.1993 0.0383 0.0584 -0.0467 723 ARG A CB 3236 C CG . ARG A 415 ? 0.4339 0.3350 0.2481 0.0413 0.0691 -0.0510 723 ARG A CG 3237 C CD . ARG A 415 ? 0.4395 0.3530 0.2851 0.0473 0.0885 -0.0446 723 ARG A CD 3238 N NE . ARG A 415 ? 0.4196 0.3249 0.2636 0.0498 0.0985 -0.0452 723 ARG A NE 3239 C CZ . ARG A 415 ? 0.4252 0.3400 0.2953 0.0546 0.1141 -0.0381 723 ARG A CZ 3240 N NH1 . ARG A 415 ? 0.3872 0.3235 0.2917 0.0562 0.1208 -0.0294 723 ARG A NH1 3241 N NH2 . ARG A 415 ? 0.4219 0.3258 0.2857 0.0570 0.1218 -0.0388 723 ARG A NH2 3242 N N . ILE A 416 ? 0.2704 0.2081 0.1137 0.0282 0.0265 -0.0380 724 ILE A N 3243 C CA . ILE A 416 ? 0.3343 0.2759 0.1740 0.0242 0.0094 -0.0361 724 ILE A CA 3244 C C . ILE A 416 ? 0.2879 0.2409 0.1504 0.0231 0.0141 -0.0265 724 ILE A C 3245 O O . ILE A 416 ? 0.3304 0.2747 0.1824 0.0256 0.0281 -0.0198 724 ILE A O 3246 C CB . ILE A 416 ? 0.3849 0.3056 0.1803 0.0246 0.0047 -0.0372 724 ILE A CB 3247 C CG1 . ILE A 416 ? 0.3878 0.3017 0.1722 0.0223 0.0007 -0.0450 724 ILE A CG1 3248 C CG2 . ILE A 416 ? 0.4024 0.3301 0.1986 0.0211 -0.0132 -0.0338 724 ILE A CG2 3249 C CD1 . ILE A 416 ? 0.3994 0.3036 0.1607 0.0197 -0.0036 -0.0437 724 ILE A CD1 3250 N N . VAL A 417 ? 0.2294 0.2002 0.1215 0.0193 0.0028 -0.0257 725 VAL A N 3251 C CA . VAL A 417 ? 0.2014 0.1842 0.1206 0.0168 0.0070 -0.0180 725 VAL A CA 3252 C C . VAL A 417 ? 0.2159 0.2012 0.1359 0.0135 -0.0071 -0.0155 725 VAL A C 3253 O O . VAL A 417 ? 0.2475 0.2355 0.1655 0.0125 -0.0222 -0.0200 725 VAL A O 3254 C CB . VAL A 417 ? 0.2295 0.2316 0.1870 0.0150 0.0083 -0.0192 725 VAL A CB 3255 C CG1 . VAL A 417 ? 0.1921 0.2062 0.1775 0.0107 0.0109 -0.0119 725 VAL A CG1 3256 C CG2 . VAL A 417 ? 0.2807 0.2815 0.2400 0.0193 0.0234 -0.0203 725 VAL A CG2 3257 N N . LEU A 418 ? 0.2065 0.1899 0.1292 0.0124 -0.0010 -0.0074 726 LEU A N 3258 C CA . LEU A 418 ? 0.2003 0.1856 0.1273 0.0096 -0.0113 -0.0036 726 LEU A CA 3259 C C . LEU A 418 ? 0.1883 0.1852 0.1483 0.0049 -0.0073 0.0000 726 LEU A C 3260 O O . LEU A 418 ? 0.1994 0.1989 0.1720 0.0041 0.0064 0.0038 726 LEU A O 3261 C CB . LEU A 418 ? 0.3055 0.2761 0.2052 0.0120 -0.0072 0.0034 726 LEU A CB 3262 C CG . LEU A 418 ? 0.4035 0.3603 0.2652 0.0160 -0.0115 0.0016 726 LEU A CG 3263 C CD1 . LEU A 418 ? 0.4411 0.3850 0.2793 0.0188 -0.0055 0.0106 726 LEU A CD1 3264 C CD2 . LEU A 418 ? 0.3949 0.3558 0.2530 0.0150 -0.0305 -0.0032 726 LEU A CD2 3265 N N . ASN A 419 ? 0.1519 0.1548 0.1256 0.0016 -0.0191 -0.0007 727 ASN A N 3266 C CA . ASN A 419 ? 0.1701 0.1804 0.1704 -0.0041 -0.0175 0.0022 727 ASN A CA 3267 C C . ASN A 419 ? 0.2018 0.2056 0.1971 -0.0054 -0.0257 0.0053 727 ASN A C 3268 O O . ASN A 419 ? 0.2313 0.2329 0.2150 -0.0026 -0.0369 0.0031 727 ASN A O 3269 C CB . ASN A 419 ? 0.1770 0.2026 0.2036 -0.0072 -0.0242 -0.0036 727 ASN A CB 3270 C CG . ASN A 419 ? 0.1693 0.2032 0.2045 -0.0051 -0.0165 -0.0062 727 ASN A CG 3271 O OD1 . ASN A 419 ? 0.1753 0.2103 0.2028 -0.0013 -0.0210 -0.0120 727 ASN A OD1 3272 N ND2 . ASN A 419 ? 0.1294 0.1697 0.1828 -0.0078 -0.0047 -0.0014 727 ASN A ND2 3273 N N . GLY A 420 ? 0.2023 0.2032 0.2080 -0.0098 -0.0198 0.0108 728 GLY A N 3274 C CA . GLY A 420 ? 0.1952 0.1886 0.1978 -0.0109 -0.0261 0.0137 728 GLY A CA 3275 C C . GLY A 420 ? 0.2065 0.1942 0.2199 -0.0165 -0.0171 0.0196 728 GLY A C 3276 O O . GLY A 420 ? 0.1852 0.1712 0.2004 -0.0175 -0.0044 0.0243 728 GLY A O 3277 N N . ILE A 421 ? 0.2269 0.2101 0.2469 -0.0200 -0.0229 0.0195 729 ILE A N 3278 C CA . ILE A 421 ? 0.2577 0.2319 0.2858 -0.0261 -0.0153 0.0247 729 ILE A CA 3279 C C . ILE A 421 ? 0.2612 0.2229 0.2710 -0.0218 -0.0042 0.0339 729 ILE A C 3280 O O . ILE A 421 ? 0.2618 0.2183 0.2790 -0.0261 0.0073 0.0392 729 ILE A O 3281 C CB . ILE A 421 ? 0.2930 0.2595 0.3236 -0.0288 -0.0235 0.0229 729 ILE A CB 3282 C CG1 . ILE A 421 ? 0.2807 0.2587 0.3286 -0.0332 -0.0339 0.0141 729 ILE A CG1 3283 C CG2 . ILE A 421 ? 0.3605 0.3139 0.3961 -0.0353 -0.0150 0.0280 729 ILE A CG2 3284 C CD1 . ILE A 421 ? 0.3107 0.2990 0.3824 -0.0422 -0.0301 0.0120 729 ILE A CD1 3285 N N . ASP A 422 ? 0.2342 0.1914 0.2204 -0.0135 -0.0078 0.0363 730 ASP A N 3286 C CA . ASP A 422 ? 0.2579 0.2033 0.2235 -0.0083 0.0012 0.0457 730 ASP A CA 3287 C C . ASP A 422 ? 0.2492 0.1963 0.1982 -0.0031 0.0066 0.0463 730 ASP A C 3288 O O . ASP A 422 ? 0.2621 0.2001 0.1871 0.0031 0.0103 0.0528 730 ASP A O 3289 C CB . ASP A 422 ? 0.2973 0.2349 0.2464 -0.0026 -0.0065 0.0502 730 ASP A CB 3290 C CG . ASP A 422 ? 0.3387 0.2708 0.3007 -0.0066 -0.0100 0.0499 730 ASP A CG 3291 O OD1 . ASP A 422 ? 0.3474 0.2716 0.3199 -0.0124 -0.0008 0.0525 730 ASP A OD1 3292 O OD2 . ASP A 422 ? 0.3705 0.3051 0.3318 -0.0040 -0.0215 0.0470 730 ASP A OD2 3293 N N . LEU A 423 ? 0.2614 0.2191 0.2221 -0.0053 0.0076 0.0398 731 LEU A N 3294 C CA . LEU A 423 ? 0.2861 0.2432 0.2302 -0.0002 0.0139 0.0395 731 LEU A CA 3295 C C . LEU A 423 ? 0.2968 0.2430 0.2296 0.0023 0.0308 0.0487 731 LEU A C 3296 O O . LEU A 423 ? 0.3093 0.2467 0.2140 0.0089 0.0347 0.0514 731 LEU A O 3297 C CB . LEU A 423 ? 0.2945 0.2644 0.2574 -0.0030 0.0150 0.0323 731 LEU A CB 3298 C CG . LEU A 423 ? 0.3040 0.2710 0.2497 0.0025 0.0237 0.0316 731 LEU A CG 3299 C CD1 . LEU A 423 ? 0.2985 0.2587 0.2135 0.0081 0.0134 0.0280 731 LEU A CD1 3300 C CD2 . LEU A 423 ? 0.2964 0.2764 0.2641 0.0003 0.0267 0.0261 731 LEU A CD2 3301 N N . LYS A 424 ? 0.2688 0.2146 0.2225 -0.0032 0.0409 0.0535 732 LYS A N 3302 C CA . LYS A 424 ? 0.2907 0.2262 0.2371 -0.0008 0.0586 0.0632 732 LYS A CA 3303 C C . LYS A 424 ? 0.3119 0.2324 0.2277 0.0061 0.0594 0.0706 732 LYS A C 3304 O O . LYS A 424 ? 0.3367 0.2481 0.2279 0.0129 0.0683 0.0756 732 LYS A O 3305 C CB . LYS A 424 ? 0.3272 0.2648 0.3039 -0.0093 0.0678 0.0674 732 LYS A CB 3306 C CG . LYS A 424 ? 0.4535 0.3813 0.4265 -0.0070 0.0879 0.0781 732 LYS A CG 3307 C CD . LYS A 424 ? 0.5432 0.4741 0.5494 -0.0169 0.0961 0.0821 732 LYS A CD 3308 C CE . LYS A 424 ? 0.6331 0.5532 0.6361 -0.0142 0.1168 0.0939 732 LYS A CE 3309 N NZ . LYS A 424 ? 0.6819 0.6035 0.7175 -0.0250 0.1241 0.0983 732 LYS A NZ 3310 N N . ALA A 425 ? 0.3213 0.2388 0.2381 0.0048 0.0504 0.0720 733 ALA A N 3311 C CA . ALA A 425 ? 0.3547 0.2601 0.2454 0.0117 0.0500 0.0804 733 ALA A CA 3312 C C . ALA A 425 ? 0.3218 0.2265 0.1815 0.0194 0.0413 0.0788 733 ALA A C 3313 O O . ALA A 425 ? 0.3569 0.2513 0.1896 0.0261 0.0466 0.0866 733 ALA A O 3314 C CB . ALA A 425 ? 0.3935 0.2971 0.2929 0.0095 0.0411 0.0815 733 ALA A CB 3315 N N . PHE A 426 ? 0.3034 0.2186 0.1664 0.0179 0.0278 0.0689 734 PHE A N 3316 C CA . PHE A 426 ? 0.3317 0.2463 0.1672 0.0231 0.0183 0.0657 734 PHE A CA 3317 C C . PHE A 426 ? 0.3536 0.2600 0.1684 0.0269 0.0309 0.0665 734 PHE A C 3318 O O . PHE A 426 ? 0.3855 0.2820 0.1676 0.0330 0.0305 0.0708 734 PHE A O 3319 C CB . PHE A 426 ? 0.3264 0.2535 0.1739 0.0199 0.0036 0.0543 734 PHE A CB 3320 C CG . PHE A 426 ? 0.3624 0.2884 0.1841 0.0234 -0.0049 0.0492 734 PHE A CG 3321 C CD1 . PHE A 426 ? 0.3769 0.3065 0.2010 0.0220 -0.0031 0.0400 734 PHE A CD1 3322 C CD2 . PHE A 426 ? 0.3918 0.3126 0.1866 0.0279 -0.0146 0.0538 734 PHE A CD2 3323 C CE1 . PHE A 426 ? 0.4126 0.3382 0.2112 0.0244 -0.0104 0.0345 734 PHE A CE1 3324 C CE2 . PHE A 426 ? 0.4318 0.3534 0.2078 0.0285 -0.0231 0.0475 734 PHE A CE2 3325 C CZ . PHE A 426 ? 0.3848 0.3044 0.1557 0.0276 -0.0213 0.0383 734 PHE A CZ 3326 N N . LEU A 427 ? 0.3647 0.2750 0.1983 0.0237 0.0424 0.0632 735 LEU A N 3327 C CA . LEU A 427 ? 0.4180 0.3194 0.2347 0.0280 0.0577 0.0650 735 LEU A CA 3328 C C . LEU A 427 ? 0.4682 0.3548 0.2650 0.0333 0.0711 0.0771 735 LEU A C 3329 O O . LEU A 427 ? 0.4507 0.3246 0.2140 0.0399 0.0769 0.0797 735 LEU A O 3330 C CB . LEU A 427 ? 0.4279 0.3380 0.2749 0.0237 0.0696 0.0624 735 LEU A CB 3331 C CG . LEU A 427 ? 0.4077 0.3318 0.2733 0.0198 0.0599 0.0513 735 LEU A CG 3332 C CD1 . LEU A 427 ? 0.4082 0.3429 0.3081 0.0155 0.0721 0.0519 735 LEU A CD1 3333 C CD2 . LEU A 427 ? 0.4403 0.3582 0.2767 0.0248 0.0558 0.0444 735 LEU A CD2 3334 N N . ASP A 428 ? 0.4413 0.3282 0.2572 0.0304 0.0760 0.0844 736 ASP A N 3335 C CA . ASP A 428 ? 0.4891 0.3621 0.2899 0.0354 0.0899 0.0968 736 ASP A CA 3336 C C . ASP A 428 ? 0.5147 0.3781 0.2778 0.0431 0.0817 0.1020 736 ASP A C 3337 O O . ASP A 428 ? 0.5484 0.4048 0.3004 0.0474 0.0896 0.1076 736 ASP A O 3338 C CB . ASP A 428 ? 0.5231 0.3974 0.3533 0.0298 0.0958 0.1027 736 ASP A CB 3339 C CG . ASP A 428 ? 0.5667 0.4478 0.4315 0.0226 0.1084 0.1017 736 ASP A CG 3340 O OD1 . ASP A 428 ? 0.6119 0.4945 0.4759 0.0243 0.1178 0.1002 736 ASP A OD1 3341 O OD2 . ASP A 428 ? 0.5462 0.4307 0.4389 0.0150 0.1090 0.1029 736 ASP A OD2 3342 N N . SER A 429 ? 0.4595 0.3299 0.2153 0.0426 0.0616 0.0960 737 SER A N 3343 C CA . SER A 429 ? 0.4772 0.3499 0.2158 0.0455 0.0479 0.0963 737 SER A CA 3344 C C . SER A 429 ? 0.5392 0.4096 0.2525 0.0477 0.0435 0.0895 737 SER A C 3345 O O . SER A 429 ? 0.5498 0.4216 0.2475 0.0492 0.0341 0.0902 737 SER A O 3346 C CB . SER A 429 ? 0.4738 0.3584 0.2245 0.0425 0.0285 0.0935 737 SER A CB 3347 O OG . SER A 429 ? 0.4765 0.3686 0.2262 0.0399 0.0158 0.0828 737 SER A OG 3348 N N . LEU A 430 ? 0.5647 0.4315 0.2753 0.0471 0.0506 0.0831 738 LEU A N 3349 C CA . LEU A 430 ? 0.6296 0.4919 0.3171 0.0486 0.0477 0.0752 738 LEU A CA 3350 C C . LEU A 430 ? 0.7097 0.5579 0.3821 0.0538 0.0671 0.0792 738 LEU A C 3351 O O . LEU A 430 ? 0.7236 0.5682 0.4105 0.0547 0.0854 0.0845 738 LEU A O 3352 C CB . LEU A 430 ? 0.6102 0.4764 0.3037 0.0454 0.0439 0.0648 738 LEU A CB 3353 C CG . LEU A 430 ? 0.5786 0.4587 0.2881 0.0405 0.0244 0.0588 738 LEU A CG 3354 C CD1 . LEU A 430 ? 0.5694 0.4527 0.2882 0.0380 0.0251 0.0492 738 LEU A CD1 3355 C CD2 . LEU A 430 ? 0.5835 0.4715 0.2853 0.0384 0.0056 0.0548 738 LEU A CD2 3356 N N . PRO A 431 ? 0.7818 0.6227 0.4274 0.0565 0.0633 0.0770 739 PRO A N 3357 C CA . PRO A 431 ? 0.8667 0.6924 0.4953 0.0622 0.0812 0.0793 739 PRO A CA 3358 C C . PRO A 431 ? 0.9013 0.7216 0.5248 0.0619 0.0866 0.0700 739 PRO A C 3359 O O . PRO A 431 ? 0.8970 0.7247 0.5238 0.0573 0.0732 0.0609 739 PRO A O 3360 C CB . PRO A 431 ? 0.8924 0.7127 0.4931 0.0645 0.0720 0.0803 739 PRO A CB 3361 C CG . PRO A 431 ? 0.8668 0.7003 0.4685 0.0584 0.0484 0.0733 739 PRO A CG 3362 C CD . PRO A 431 ? 0.8159 0.6632 0.4481 0.0542 0.0429 0.0737 739 PRO A CD 3363 N N . ASP A 432 ? 0.9616 0.7694 0.5797 0.0670 0.1067 0.0728 740 ASP A N 3364 C CA . ASP A 432 ? 0.9840 0.7841 0.5955 0.0683 0.1145 0.0652 740 ASP A CA 3365 C C . ASP A 432 ? 0.8821 0.6936 0.5214 0.0643 0.1174 0.0612 740 ASP A C 3366 O O . ASP A 432 ? 0.8798 0.6877 0.5149 0.0643 0.1193 0.0533 740 ASP A O 3367 C CB . ASP A 432 ? 1.0809 0.8738 0.6626 0.0671 0.0995 0.0555 740 ASP A CB 3368 C CG . ASP A 432 ? 1.1928 0.9745 0.7457 0.0710 0.0975 0.0596 740 ASP A CG 3369 O OD1 . ASP A 432 ? 1.2294 0.9991 0.7755 0.0776 0.1152 0.0672 740 ASP A OD1 3370 O OD2 . ASP A 432 ? 1.2273 1.0135 0.7663 0.0673 0.0784 0.0558 740 ASP A OD2 3371 N N . VAL A 433 ? 0.7670 0.5917 0.4347 0.0607 0.1182 0.0667 741 VAL A N 3372 C CA . VAL A 433 ? 0.6834 0.5200 0.3808 0.0569 0.1239 0.0650 741 VAL A CA 3373 C C . VAL A 433 ? 0.6622 0.4966 0.3773 0.0601 0.1480 0.0703 741 VAL A C 3374 O O . VAL A 433 ? 0.6248 0.4554 0.3472 0.0627 0.1609 0.0797 741 VAL A O 3375 C CB . VAL A 433 ? 0.6369 0.4883 0.3634 0.0510 0.1177 0.0698 741 VAL A CB 3376 C CG1 . VAL A 433 ? 0.6034 0.4739 0.3771 0.0448 0.1209 0.0664 741 VAL A CG1 3377 C CG2 . VAL A 433 ? 0.6366 0.4935 0.3536 0.0479 0.0926 0.0638 741 VAL A CG2 3378 N N . LYS A 434 ? 0.6584 0.4962 0.3830 0.0600 0.1534 0.0645 742 LYS A N 3379 C CA . LYS A 434 ? 0.7029 0.5411 0.4485 0.0633 0.1747 0.0696 742 LYS A CA 3380 C C . LYS A 434 ? 0.6821 0.5429 0.4752 0.0574 0.1801 0.0723 742 LYS A C 3381 O O . LYS A 434 ? 0.6492 0.5236 0.4560 0.0518 0.1653 0.0643 742 LYS A O 3382 C CB . LYS A 434 ? 0.7673 0.5916 0.4901 0.0686 0.1784 0.0621 742 LYS A CB 3383 C CG . LYS A 434 ? 0.8334 0.6564 0.5766 0.0734 0.1999 0.0681 742 LYS A CG 3384 C CD . LYS A 434 ? 0.8725 0.6820 0.5958 0.0778 0.2027 0.0603 742 LYS A CD 3385 C CE . LYS A 434 ? 0.8856 0.6952 0.6329 0.0831 0.2237 0.0675 742 LYS A CE 3386 N NZ . LYS A 434 ? 0.9044 0.7013 0.6360 0.0870 0.2269 0.0605 742 LYS A NZ 3387 N N . ILE A 435 ? 0.6879 0.5556 0.5130 0.0574 0.1961 0.0817 743 ILE A N 3388 C CA . ILE A 435 ? 0.6278 0.5196 0.5036 0.0507 0.1999 0.0847 743 ILE A CA 3389 C C . ILE A 435 ? 0.6333 0.5279 0.5239 0.0552 0.2118 0.0846 743 ILE A C 3390 O O . ILE A 435 ? 0.6437 0.5268 0.5295 0.0618 0.2257 0.0904 743 ILE A O 3391 C CB . ILE A 435 ? 0.6152 0.5166 0.5248 0.0452 0.2055 0.0951 743 ILE A CB 3392 C CG1 . ILE A 435 ? 0.5863 0.4825 0.4809 0.0413 0.1945 0.0962 743 ILE A CG1 3393 C CG2 . ILE A 435 ? 0.5990 0.5270 0.5628 0.0365 0.2049 0.0969 743 ILE A CG2 3394 C CD1 . ILE A 435 ? 0.5799 0.4892 0.4827 0.0341 0.1681 0.0844 743 ILE A CD1 3395 N N . VAL A 436 ? 0.5949 0.5042 0.5036 0.0524 0.2063 0.0784 744 VAL A N 3396 C CA . VAL A 436 ? 0.6168 0.5298 0.5416 0.0568 0.2160 0.0788 744 VAL A CA 3397 C C . VAL A 436 ? 0.6390 0.5797 0.6211 0.0504 0.2177 0.0856 744 VAL A C 3398 O O . VAL A 436 ? 0.5932 0.5545 0.6025 0.0416 0.2057 0.0833 744 VAL A O 3399 C CB . VAL A 436 ? 0.5827 0.4921 0.4887 0.0589 0.2083 0.0671 744 VAL A CB 3400 C CG1 . VAL A 436 ? 0.6243 0.5375 0.5493 0.0634 0.2184 0.0688 744 VAL A CG1 3401 C CG2 . VAL A 436 ? 0.5826 0.4642 0.4321 0.0638 0.2031 0.0595 744 VAL A CG2 3402 N N . LYS A 437 ? 0.6973 0.6380 0.6974 0.0547 0.2312 0.0940 745 LYS A N 3403 C CA . LYS A 437 ? 0.7000 0.6658 0.7527 0.0489 0.2312 0.1011 745 LYS A CA 3404 C C . LYS A 437 ? 0.6832 0.6581 0.7531 0.0525 0.2335 0.1005 745 LYS A C 3405 O O . LYS A 437 ? 0.7024 0.6657 0.7459 0.0581 0.2337 0.0933 745 LYS A O 3406 C CB . LYS A 437 ? 0.7429 0.7041 0.8080 0.0509 0.2440 0.1125 745 LYS A CB 3407 C CG . LYS A 437 ? 0.7532 0.7068 0.8068 0.0469 0.2421 0.1146 745 LYS A CG 3408 C CD . LYS A 437 ? 0.7841 0.7346 0.8542 0.0490 0.2553 0.1259 745 LYS A CD 3409 C CE . LYS A 437 ? 0.8111 0.7525 0.8688 0.0457 0.2540 0.1281 745 LYS A CE 3410 N NZ . LYS A 437 ? 0.8439 0.7813 0.9170 0.0484 0.2677 0.1389 745 LYS A NZ 3411 N N . ASN A 455 ? 0.5090 0.5412 0.6475 0.0103 0.1757 0.0890 763 ASN A N 3412 C CA . ASN A 455 ? 0.5489 0.5573 0.6451 0.0149 0.1816 0.0885 763 ASN A CA 3413 C C . ASN A 455 ? 0.5387 0.5408 0.6062 0.0152 0.1615 0.0749 763 ASN A C 3414 O O . ASN A 455 ? 0.5519 0.5659 0.6345 0.0071 0.1422 0.0685 763 ASN A O 3415 C CB . ASN A 455 ? 0.6341 0.6380 0.7362 0.0086 0.1815 0.0946 763 ASN A CB 3416 C CG . ASN A 455 ? 0.7170 0.7176 0.8313 0.0116 0.1952 0.1040 763 ASN A CG 3417 O OD1 . ASN A 455 ? 0.7760 0.7561 0.8613 0.0200 0.2079 0.1082 763 ASN A OD1 3418 N ND2 . ASN A 455 ? 0.7274 0.7475 0.8833 0.0050 0.1917 0.1072 763 ASN A ND2 3419 N N . MET A 456 ? 0.5018 0.4841 0.5269 0.0245 0.1652 0.0702 764 MET A N 3420 C CA . MET A 456 ? 0.4645 0.4404 0.4622 0.0248 0.1457 0.0576 764 MET A CA 3421 C C . MET A 456 ? 0.4329 0.3834 0.3813 0.0304 0.1456 0.0562 764 MET A C 3422 O O . MET A 456 ? 0.4572 0.3896 0.3758 0.0389 0.1605 0.0583 764 MET A O 3423 C CB . MET A 456 ? 0.4481 0.4282 0.4451 0.0288 0.1449 0.0503 764 MET A CB 3424 C CG . MET A 456 ? 0.4414 0.4155 0.4124 0.0287 0.1252 0.0375 764 MET A CG 3425 S SD . MET A 456 ? 0.4857 0.4653 0.4606 0.0328 0.1253 0.0294 764 MET A SD 3426 C CE . MET A 456 ? 0.4407 0.3948 0.3807 0.0439 0.1507 0.0331 764 MET A CE 3427 N N . PRO A 457 ? 0.3858 0.3343 0.3248 0.0261 0.1292 0.0533 765 PRO A N 3428 C CA . PRO A 457 ? 0.4107 0.3381 0.3047 0.0310 0.1260 0.0528 765 PRO A CA 3429 C C . PRO A 457 ? 0.4150 0.3325 0.2761 0.0351 0.1166 0.0423 765 PRO A C 3430 O O . PRO A 457 ? 0.3839 0.3132 0.2578 0.0317 0.1026 0.0336 765 PRO A O 3431 C CB . PRO A 457 ? 0.3986 0.3317 0.3008 0.0246 0.1093 0.0525 765 PRO A CB 3432 C CG . PRO A 457 ? 0.3895 0.3424 0.3393 0.0163 0.1092 0.0551 765 PRO A CG 3433 C CD . PRO A 457 ? 0.3279 0.2934 0.2981 0.0167 0.1136 0.0515 765 PRO A CD 3434 N N . VAL A 458 ? 0.4171 0.3122 0.2350 0.0422 0.1242 0.0433 766 VAL A N 3435 C CA . VAL A 458 ? 0.4804 0.3626 0.2628 0.0454 0.1164 0.0334 766 VAL A CA 3436 C C . VAL A 458 ? 0.5083 0.3730 0.2468 0.0476 0.1066 0.0332 766 VAL A C 3437 O O . VAL A 458 ? 0.5468 0.3966 0.2626 0.0526 0.1187 0.0415 766 VAL A O 3438 C CB . VAL A 458 ? 0.5380 0.4059 0.3046 0.0525 0.1368 0.0333 766 VAL A CB 3439 C CG1 . VAL A 458 ? 0.5904 0.4410 0.3163 0.0548 0.1283 0.0221 766 VAL A CG1 3440 C CG2 . VAL A 458 ? 0.4944 0.3814 0.3057 0.0511 0.1464 0.0347 766 VAL A CG2 3441 N N . ILE A 459 ? 0.5398 0.5197 0.2615 -0.1135 0.0191 -0.1430 767 ILE A N 3442 C CA . ILE A 459 ? 0.5349 0.5233 0.2627 -0.1139 0.0108 -0.1530 767 ILE A CA 3443 C C . ILE A 459 ? 0.5922 0.5664 0.3091 -0.1062 -0.0011 -0.1707 767 ILE A C 3444 O O . ILE A 459 ? 0.5914 0.5424 0.3056 -0.1141 -0.0056 -0.1787 767 ILE A O 3445 C CB . ILE A 459 ? 0.5162 0.5103 0.2636 -0.1332 0.0144 -0.1550 767 ILE A CB 3446 C CG1 . ILE A 459 ? 0.4942 0.5009 0.2512 -0.1366 0.0221 -0.1422 767 ILE A CG1 3447 C CG2 . ILE A 459 ? 0.5113 0.5161 0.2663 -0.1319 0.0044 -0.1675 767 ILE A CG2 3448 C CD1 . ILE A 459 ? 0.5058 0.5269 0.2818 -0.1544 0.0281 -0.1463 767 ILE A CD1 3449 N N . PRO A 460 ? 0.6591 0.6432 0.3671 -0.0921 -0.0093 -0.1767 768 PRO A N 3450 C CA . PRO A 460 ? 0.7236 0.6923 0.4180 -0.0815 -0.0231 -0.1948 768 PRO A CA 3451 C C . PRO A 460 ? 0.7532 0.7083 0.4600 -0.0966 -0.0319 -0.2058 768 PRO A C 3452 O O . PRO A 460 ? 0.7209 0.6878 0.4474 -0.1146 -0.0252 -0.1999 768 PRO A O 3453 C CB . PRO A 460 ? 0.7344 0.7233 0.4175 -0.0695 -0.0260 -0.1929 768 PRO A CB 3454 C CG . PRO A 460 ? 0.7095 0.7179 0.4065 -0.0793 -0.0203 -0.1778 768 PRO A CG 3455 C CD . PRO A 460 ? 0.6627 0.6689 0.3693 -0.0875 -0.0089 -0.1659 768 PRO A CD 3456 N N . MET A 461 ? 0.8391 0.7707 0.5327 -0.0891 -0.0487 -0.2222 769 MET A N 3457 C CA . MET A 461 ? 0.8858 0.8030 0.5901 -0.1059 -0.0608 -0.2316 769 MET A CA 3458 C C . MET A 461 ? 0.8762 0.8125 0.5883 -0.1066 -0.0627 -0.2341 769 MET A C 3459 O O . MET A 461 ? 0.9303 0.8517 0.6301 -0.0988 -0.0777 -0.2461 769 MET A O 3460 C CB . MET A 461 ? 0.9606 0.8367 0.6477 -0.0972 -0.0853 -0.2493 769 MET A CB 3461 C CG . MET A 461 ? 1.0092 0.8686 0.7111 -0.1213 -0.1011 -0.2557 769 MET A CG 3462 S SD . MET A 461 ? 1.4338 1.3004 1.1548 -0.1621 -0.0866 -0.2357 769 MET A SD 3463 C CE . MET A 461 ? 1.5224 1.3706 1.2514 -0.1914 -0.1094 -0.2401 769 MET A CE 3464 N N . ASN A 462 ? 0.8141 0.7802 0.5447 -0.1149 -0.0500 -0.2238 770 ASN A N 3465 C CA . ASN A 462 ? 0.7984 0.7826 0.5383 -0.1148 -0.0542 -0.2272 770 ASN A CA 3466 C C . ASN A 462 ? 0.7738 0.7762 0.5384 -0.1356 -0.0525 -0.2300 770 ASN A C 3467 O O . ASN A 462 ? 0.7238 0.7225 0.4949 -0.1547 -0.0501 -0.2293 770 ASN A O 3468 C CB . ASN A 462 ? 0.8195 0.8218 0.5570 -0.1036 -0.0493 -0.2170 770 ASN A CB 3469 C CG . ASN A 462 ? 0.8192 0.8319 0.5665 -0.1086 -0.0372 -0.2044 770 ASN A CG 3470 O OD1 . ASN A 462 ? 0.8094 0.8257 0.5713 -0.1228 -0.0299 -0.2042 770 ASN A OD1 3471 N ND2 . ASN A 462 ? 0.8236 0.8419 0.5607 -0.0994 -0.0365 -0.1931 770 ASN A ND2 3472 N N . THR A 463 ? 0.7866 0.8113 0.5632 -0.1329 -0.0551 -0.2332 771 THR A N 3473 C CA . THR A 463 ? 0.7784 0.8334 0.5797 -0.1486 -0.0539 -0.2396 771 THR A CA 3474 C C . THR A 463 ? 0.7650 0.8431 0.5817 -0.1622 -0.0399 -0.2341 771 THR A C 3475 O O . THR A 463 ? 0.7437 0.8451 0.5743 -0.1850 -0.0360 -0.2378 771 THR A O 3476 C CB . THR A 463 ? 0.7636 0.8378 0.5741 -0.1366 -0.0612 -0.2451 771 THR A CB 3477 O OG1 . THR A 463 ? 0.7827 0.8378 0.5776 -0.1275 -0.0735 -0.2493 771 THR A OG1 3478 C CG2 . THR A 463 ? 0.7690 0.8852 0.6074 -0.1493 -0.0602 -0.2563 771 THR A CG2 3479 N N . ILE A 464 ? 0.7674 0.8413 0.5793 -0.1505 -0.0330 -0.2245 772 ILE A N 3480 C CA . ILE A 464 ? 0.7809 0.8738 0.6045 -0.1607 -0.0199 -0.2188 772 ILE A CA 3481 C C . ILE A 464 ? 0.7994 0.8813 0.6177 -0.1842 -0.0124 -0.2135 772 ILE A C 3482 O O . ILE A 464 ? 0.7945 0.9055 0.6263 -0.2066 -0.0044 -0.2140 772 ILE A O 3483 C CB . ILE A 464 ? 0.7777 0.8567 0.5907 -0.1441 -0.0172 -0.2068 772 ILE A CB 3484 C CG1 . ILE A 464 ? 0.8161 0.8929 0.6247 -0.1245 -0.0317 -0.2090 772 ILE A CG1 3485 C CG2 . ILE A 464 ? 0.7508 0.8499 0.5767 -0.1524 -0.0055 -0.2026 772 ILE A CG2 3486 C CD1 . ILE A 464 ? 0.8295 0.9369 0.6601 -0.1222 -0.0394 -0.2232 772 ILE A CD1 3487 N N . ALA A 465 ? 0.6083 0.5812 0.3725 0.0610 -0.0615 -0.0125 773 ALA A N 3488 C CA . ALA A 465 ? 0.5854 0.5591 0.3580 0.0562 -0.0588 -0.0195 773 ALA A CA 3489 C C . ALA A 465 ? 0.5759 0.5506 0.3572 0.0514 -0.0731 -0.0312 773 ALA A C 3490 O O . ALA A 465 ? 0.5213 0.5009 0.3195 0.0452 -0.0741 -0.0363 773 ALA A O 3491 C CB . ALA A 465 ? 0.6279 0.5915 0.3824 0.0607 -0.0463 -0.0186 773 ALA A CB 3492 N N . GLU A 466 ? 0.6029 0.5726 0.3735 0.0543 -0.0841 -0.0351 774 GLU A N 3493 C CA . GLU A 466 ? 0.5891 0.5600 0.3705 0.0493 -0.0980 -0.0455 774 GLU A CA 3494 C C . GLU A 466 ? 0.5144 0.5000 0.3263 0.0424 -0.1054 -0.0450 774 GLU A C 3495 O O . GLU A 466 ? 0.4453 0.4359 0.2774 0.0354 -0.1096 -0.0512 774 GLU A O 3496 C CB . GLU A 466 ? 0.6450 0.6074 0.4080 0.0545 -0.1086 -0.0494 774 GLU A CB 3497 C CG . GLU A 466 ? 0.7247 0.6716 0.4579 0.0618 -0.1017 -0.0512 774 GLU A CG 3498 C CD . GLU A 466 ? 0.7936 0.7315 0.5043 0.0691 -0.1105 -0.0527 774 GLU A CD 3499 O OE1 . GLU A 466 ? 0.7999 0.7441 0.5183 0.0685 -0.1219 -0.0518 774 GLU A OE1 3500 O OE2 . GLU A 466 ? 0.8241 0.7484 0.5091 0.0760 -0.1058 -0.0545 774 GLU A OE2 3501 N N . ALA A 467 ? 0.5105 0.5026 0.3263 0.0447 -0.1058 -0.0370 775 ALA A N 3502 C CA . ALA A 467 ? 0.4887 0.4950 0.3331 0.0396 -0.1113 -0.0349 775 ALA A CA 3503 C C . ALA A 467 ? 0.4240 0.4375 0.2881 0.0339 -0.1039 -0.0347 775 ALA A C 3504 O O . ALA A 467 ? 0.4403 0.4641 0.3310 0.0279 -0.1089 -0.0371 775 ALA A O 3505 C CB . ALA A 467 ? 0.4709 0.4805 0.3123 0.0445 -0.1106 -0.0253 775 ALA A CB 3506 N N . VAL A 468 ? 0.4494 0.4578 0.3013 0.0360 -0.0914 -0.0315 776 VAL A N 3507 C CA . VAL A 468 ? 0.4132 0.4278 0.2812 0.0314 -0.0843 -0.0317 776 VAL A CA 3508 C C . VAL A 468 ? 0.4362 0.4497 0.3143 0.0256 -0.0872 -0.0413 776 VAL A C 3509 O O . VAL A 468 ? 0.3798 0.4022 0.2849 0.0187 -0.0869 -0.0425 776 VAL A O 3510 C CB . VAL A 468 ? 0.4428 0.4532 0.3004 0.0339 -0.0677 -0.0239 776 VAL A CB 3511 C CG1 . VAL A 468 ? 0.3979 0.4141 0.2778 0.0268 -0.0577 -0.0232 776 VAL A CG1 3512 C CG2 . VAL A 468 ? 0.4542 0.4662 0.3075 0.0382 -0.0641 -0.0135 776 VAL A CG2 3513 N N . ILE A 469 ? 0.4383 0.4399 0.2975 0.0277 -0.0875 -0.0467 777 ILE A N 3514 C CA . ILE A 469 ? 0.4267 0.4247 0.2936 0.0226 -0.0901 -0.0559 777 ILE A CA 3515 C C . ILE A 469 ? 0.4030 0.4076 0.2927 0.0165 -0.1031 -0.0608 777 ILE A C 3516 O O . ILE A 469 ? 0.3674 0.3746 0.2767 0.0099 -0.1046 -0.0657 777 ILE A O 3517 C CB . ILE A 469 ? 0.5313 0.5139 0.3715 0.0273 -0.0875 -0.0603 777 ILE A CB 3518 C CG1 . ILE A 469 ? 0.5692 0.5467 0.3905 0.0334 -0.0722 -0.0538 777 ILE A CG1 3519 C CG2 . ILE A 469 ? 0.5499 0.5273 0.3979 0.0223 -0.0900 -0.0696 777 ILE A CG2 3520 C CD1 . ILE A 469 ? 0.5994 0.5625 0.3958 0.0390 -0.0672 -0.0569 777 ILE A CD1 3521 N N . GLU A 470 ? 0.4447 0.4523 0.3333 0.0188 -0.1118 -0.0586 778 GLU A N 3522 C CA . GLU A 470 ? 0.4616 0.4768 0.3731 0.0136 -0.1236 -0.0619 778 GLU A CA 3523 C C . GLU A 470 ? 0.3903 0.4202 0.3346 0.0078 -0.1210 -0.0582 778 GLU A C 3524 O O . GLU A 470 ? 0.3918 0.4270 0.3603 0.0011 -0.1245 -0.0617 778 GLU A O 3525 C CB . GLU A 470 ? 0.5117 0.5277 0.4143 0.0184 -0.1329 -0.0595 778 GLU A CB 3526 C CG . GLU A 470 ? 0.5865 0.6114 0.5135 0.0137 -0.1451 -0.0624 778 GLU A CG 3527 C CD . GLU A 470 ? 0.6686 0.6938 0.5854 0.0190 -0.1551 -0.0606 778 GLU A CD 3528 O OE1 . GLU A 470 ? 0.7108 0.7260 0.5978 0.0264 -0.1533 -0.0588 778 GLU A OE1 3529 O OE2 . GLU A 470 ? 0.6952 0.7307 0.6342 0.0161 -0.1640 -0.0604 778 GLU A OE2 3530 N N . MET A 471 ? 0.3504 0.3861 0.2952 0.0106 -0.1141 -0.0506 779 MET A N 3531 C CA . MET A 471 ? 0.3172 0.3657 0.2903 0.0065 -0.1099 -0.0466 779 MET A CA 3532 C C . MET A 471 ? 0.3122 0.3611 0.2999 0.0003 -0.1044 -0.0509 779 MET A C 3533 O O . MET A 471 ? 0.2861 0.3433 0.3016 -0.0054 -0.1050 -0.0511 779 MET A O 3534 C CB . MET A 471 ? 0.2772 0.3281 0.2431 0.0111 -0.1012 -0.0384 779 MET A CB 3535 C CG . MET A 471 ? 0.2437 0.3046 0.2359 0.0070 -0.0919 -0.0328 779 MET A CG 3536 S SD . MET A 471 ? 0.3252 0.3849 0.3090 0.0110 -0.0789 -0.0224 779 MET A SD 3537 C CE . MET A 471 ? 0.3174 0.3662 0.2812 0.0109 -0.0676 -0.0232 779 MET A CE 3538 N N . ILE A 472 ? 0.3431 0.3821 0.3123 0.0017 -0.0961 -0.0526 780 ILE A N 3539 C CA . ILE A 472 ? 0.3474 0.3846 0.3273 -0.0034 -0.0871 -0.0545 780 ILE A CA 3540 C C . ILE A 472 ? 0.3608 0.3962 0.3544 -0.0089 -0.0966 -0.0634 780 ILE A C 3541 O O . ILE A 472 ? 0.3791 0.4202 0.3975 -0.0148 -0.0926 -0.0628 780 ILE A O 3542 C CB . ILE A 472 ? 0.3945 0.4205 0.3502 0.0001 -0.0768 -0.0544 780 ILE A CB 3543 C CG1 . ILE A 472 ? 0.3734 0.4004 0.3162 0.0053 -0.0683 -0.0455 780 ILE A CG1 3544 C CG2 . ILE A 472 ? 0.3971 0.4219 0.3648 -0.0045 -0.0670 -0.0552 780 ILE A CG2 3545 C CD1 . ILE A 472 ? 0.3627 0.3985 0.3241 0.0025 -0.0585 -0.0379 780 ILE A CD1 3546 N N . ASN A 473 ? 0.4055 0.4316 0.3830 -0.0071 -0.1051 -0.0687 781 ASN A N 3547 C CA . ASN A 473 ? 0.4300 0.4521 0.4191 -0.0125 -0.1116 -0.0750 781 ASN A CA 3548 C C . ASN A 473 ? 0.4349 0.4696 0.4559 -0.0179 -0.1171 -0.0725 781 ASN A C 3549 O O . ASN A 473 ? 0.4491 0.4851 0.4913 -0.0241 -0.1165 -0.0745 781 ASN A O 3550 C CB . ASN A 473 ? 0.4668 0.4761 0.4303 -0.0085 -0.1198 -0.0810 781 ASN A CB 3551 C CG . ASN A 473 ? 0.4774 0.4724 0.4118 -0.0035 -0.1125 -0.0840 781 ASN A CG 3552 O OD1 . ASN A 473 ? 0.4732 0.4670 0.4101 -0.0047 -0.1028 -0.0837 781 ASN A OD1 3553 N ND2 . ASN A 473 ? 0.4800 0.4644 0.3869 0.0027 -0.1164 -0.0866 781 ASN A ND2 3554 N N . ARG A 474 ? 0.4101 0.4537 0.4345 -0.0151 -0.1213 -0.0675 782 ARG A N 3555 C CA . ARG A 474 ? 0.3666 0.4228 0.4204 -0.0189 -0.1257 -0.0644 782 ARG A CA 3556 C C . ARG A 474 ? 0.3307 0.3980 0.4095 -0.0218 -0.1150 -0.0578 782 ARG A C 3557 O O . ARG A 474 ? 0.3354 0.4130 0.4403 -0.0248 -0.1152 -0.0542 782 ARG A O 3558 C CB . ARG A 474 ? 0.3750 0.4363 0.4228 -0.0140 -0.1340 -0.0614 782 ARG A CB 3559 C CG . ARG A 474 ? 0.4273 0.4780 0.4521 -0.0108 -0.1453 -0.0676 782 ARG A CG 3560 C CD . ARG A 474 ? 0.4659 0.5210 0.4827 -0.0051 -0.1526 -0.0637 782 ARG A CD 3561 N NE . ARG A 474 ? 0.5010 0.5716 0.5482 -0.0076 -0.1551 -0.0588 782 ARG A NE 3562 C CZ . ARG A 474 ? 0.5230 0.5987 0.5874 -0.0105 -0.1655 -0.0615 782 ARG A CZ 3563 N NH1 . ARG A 474 ? 0.5484 0.6144 0.6024 -0.0116 -0.1754 -0.0695 782 ARG A NH1 3564 N NH2 . ARG A 474 ? 0.5100 0.6002 0.6022 -0.0119 -0.1658 -0.0561 782 ARG A NH2 3565 N N . GLY A 475 ? 0.3286 0.3935 0.3987 -0.0203 -0.1052 -0.0560 783 GLY A N 3566 C CA . GLY A 475 ? 0.3206 0.3947 0.4108 -0.0220 -0.0946 -0.0499 783 GLY A CA 3567 C C . GLY A 475 ? 0.3179 0.4025 0.4153 -0.0181 -0.0941 -0.0427 783 GLY A C 3568 O O . GLY A 475 ? 0.3508 0.4442 0.4692 -0.0192 -0.0867 -0.0371 783 GLY A O 3569 N N . GLN A 476 ? 0.3130 0.3954 0.3915 -0.0129 -0.1013 -0.0425 784 GLN A N 3570 C CA . GLN A 476 ? 0.2914 0.3817 0.3732 -0.0082 -0.1013 -0.0357 784 GLN A CA 3571 C C . GLN A 476 ? 0.2538 0.3446 0.3322 -0.0057 -0.0895 -0.0304 784 GLN A C 3572 O O . GLN A 476 ? 0.2355 0.3170 0.2958 -0.0056 -0.0816 -0.0310 784 GLN A O 3573 C CB . GLN A 476 ? 0.3335 0.4188 0.3921 -0.0027 -0.1105 -0.0362 784 GLN A CB 3574 C CG . GLN A 476 ? 0.4356 0.5220 0.4991 -0.0041 -0.1221 -0.0397 784 GLN A CG 3575 C CD . GLN A 476 ? 0.5251 0.6033 0.5606 0.0017 -0.1305 -0.0412 784 GLN A CD 3576 O OE1 . GLN A 476 ? 0.6109 0.6884 0.6461 0.0014 -0.1410 -0.0449 784 GLN A OE1 3577 N NE2 . GLN A 476 ? 0.5079 0.5796 0.5197 0.0072 -0.1257 -0.0380 784 GLN A NE2 3578 N N . ILE A 477 ? 0.2024 0.3016 0.2954 -0.0035 -0.0854 -0.0239 785 ILE A N 3579 C CA . ILE A 477 ? 0.1958 0.2926 0.2847 -0.0016 -0.0716 -0.0179 785 ILE A CA 3580 C C . ILE A 477 ? 0.1714 0.2601 0.2346 0.0032 -0.0695 -0.0148 785 ILE A C 3581 O O . ILE A 477 ? 0.1523 0.2344 0.2046 0.0033 -0.0598 -0.0127 785 ILE A O 3582 C CB . ILE A 477 ? 0.2618 0.3685 0.3733 0.0001 -0.0679 -0.0122 785 ILE A CB 3583 C CG1 . ILE A 477 ? 0.3129 0.4281 0.4525 -0.0046 -0.0675 -0.0137 785 ILE A CG1 3584 C CG2 . ILE A 477 ? 0.3006 0.4027 0.4053 0.0028 -0.0551 -0.0071 785 ILE A CG2 3585 C CD1 . ILE A 477 ? 0.3317 0.4409 0.4696 -0.0096 -0.0606 -0.0169 785 ILE A CD1 3586 N N . GLN A 478 ? 0.1935 0.2828 0.2484 0.0074 -0.0789 -0.0140 786 GLN A N 3587 C CA . GLN A 478 ? 0.1964 0.2785 0.2296 0.0126 -0.0764 -0.0093 786 GLN A CA 3588 C C . GLN A 478 ? 0.2343 0.3162 0.2565 0.0173 -0.0889 -0.0098 786 GLN A C 3589 O O . GLN A 478 ? 0.2295 0.3191 0.2654 0.0169 -0.1001 -0.0128 786 GLN A O 3590 C CB . GLN A 478 ? 0.1890 0.2733 0.2307 0.0150 -0.0686 -0.0025 786 GLN A CB 3591 C CG . GLN A 478 ? 0.2328 0.3271 0.2934 0.0178 -0.0749 0.0000 786 GLN A CG 3592 C CD . GLN A 478 ? 0.2818 0.3787 0.3561 0.0194 -0.0657 0.0049 786 GLN A CD 3593 O OE1 . GLN A 478 ? 0.3169 0.4063 0.3826 0.0193 -0.0561 0.0070 786 GLN A OE1 3594 N NE2 . GLN A 478 ? 0.3108 0.4181 0.4067 0.0213 -0.0688 0.0067 786 GLN A NE2 3595 N N . ILE A 479 ? 0.2509 0.3239 0.2485 0.0219 -0.0873 -0.0066 787 ILE A N 3596 C CA . ILE A 479 ? 0.2595 0.3305 0.2425 0.0281 -0.0979 -0.0053 787 ILE A CA 3597 C C . ILE A 479 ? 0.2519 0.3171 0.2217 0.0334 -0.0910 0.0035 787 ILE A C 3598 O O . ILE A 479 ? 0.2928 0.3557 0.2664 0.0315 -0.0792 0.0075 787 ILE A O 3599 C CB . ILE A 479 ? 0.2981 0.3605 0.2573 0.0296 -0.1047 -0.0114 787 ILE A CB 3600 C CG1 . ILE A 479 ? 0.3096 0.3613 0.2483 0.0299 -0.0923 -0.0097 787 ILE A CG1 3601 C CG2 . ILE A 479 ? 0.2678 0.3336 0.2413 0.0231 -0.1108 -0.0199 787 ILE A CG2 3602 C CD1 . ILE A 479 ? 0.3314 0.3735 0.2460 0.0320 -0.0968 -0.0161 787 ILE A CD1 3603 N N . THR A 480 ? 0.2572 0.3194 0.2118 0.0402 -0.0988 0.0065 788 THR A N 3604 C CA . THR A 480 ? 0.2867 0.3420 0.2279 0.0457 -0.0926 0.0156 788 THR A CA 3605 C C . THR A 480 ? 0.3267 0.3709 0.2376 0.0506 -0.0939 0.0168 788 THR A C 3606 O O . THR A 480 ? 0.3581 0.4013 0.2625 0.0513 -0.1027 0.0130 788 THR A O 3607 C CB . THR A 480 ? 0.3164 0.3777 0.2696 0.0504 -0.0987 0.0207 788 THR A CB 3608 O OG1 . THR A 480 ? 0.2829 0.3534 0.2641 0.0462 -0.0951 0.0201 788 THR A OG1 3609 C CG2 . THR A 480 ? 0.3425 0.3947 0.2812 0.0561 -0.0922 0.0304 788 THR A CG2 3610 N N . ILE A 481 ? 0.3087 0.3441 0.2038 0.0526 -0.0827 0.0226 789 ILE A N 3611 C CA . ILE A 481 ? 0.3284 0.3523 0.1963 0.0574 -0.0799 0.0257 789 ILE A CA 3612 C C . ILE A 481 ? 0.3261 0.3438 0.1876 0.0615 -0.0708 0.0372 789 ILE A C 3613 O O . ILE A 481 ? 0.3211 0.3385 0.1907 0.0589 -0.0606 0.0415 789 ILE A O 3614 C CB . ILE A 481 ? 0.3308 0.3487 0.1846 0.0558 -0.0731 0.0216 789 ILE A CB 3615 C CG1 . ILE A 481 ? 0.3489 0.3708 0.2087 0.0514 -0.0821 0.0099 789 ILE A CG1 3616 C CG2 . ILE A 481 ? 0.3293 0.3351 0.1566 0.0613 -0.0675 0.0259 789 ILE A CG2 3617 C CD1 . ILE A 481 ? 0.3880 0.4046 0.2375 0.0495 -0.0752 0.0051 789 ILE A CD1 3618 N N . ASN A 482 ? 0.3696 0.3819 0.2195 0.0666 -0.0739 0.0418 790 ASN A N 3619 C CA . ASN A 482 ? 0.3909 0.3960 0.2353 0.0705 -0.0657 0.0529 790 ASN A CA 3620 C C . ASN A 482 ? 0.3604 0.3700 0.2257 0.0688 -0.0628 0.0574 790 ASN A C 3621 O O . ASN A 482 ? 0.3911 0.3944 0.2563 0.0691 -0.0525 0.0656 790 ASN A O 3622 C CB . ASN A 482 ? 0.3754 0.3709 0.2038 0.0712 -0.0521 0.0580 790 ASN A CB 3623 C CG . ASN A 482 ? 0.4072 0.3959 0.2123 0.0751 -0.0532 0.0550 790 ASN A CG 3624 O OD1 . ASN A 482 ? 0.4289 0.4179 0.2269 0.0781 -0.0643 0.0510 790 ASN A OD1 3625 N ND2 . ASN A 482 ? 0.3965 0.3787 0.1901 0.0754 -0.0414 0.0572 790 ASN A ND2 3626 N N . GLY A 483 ? 0.3346 0.3548 0.2189 0.0669 -0.0715 0.0520 791 GLY A N 3627 C CA . GLY A 483 ? 0.3035 0.3279 0.2084 0.0659 -0.0691 0.0551 791 GLY A CA 3628 C C . GLY A 483 ? 0.2838 0.3105 0.2047 0.0572 -0.0601 0.0510 791 GLY A C 3629 O O . GLY A 483 ? 0.2817 0.3110 0.2208 0.0548 -0.0575 0.0512 791 GLY A O 3630 N N . PHE A 484 ? 0.2541 0.2790 0.1669 0.0533 -0.0555 0.0473 792 PHE A N 3631 C CA . PHE A 484 ? 0.2704 0.2969 0.1964 0.0456 -0.0475 0.0437 792 PHE A CA 3632 C C . PHE A 484 ? 0.2927 0.3290 0.2324 0.0412 -0.0530 0.0342 792 PHE A C 3633 O O . PHE A 484 ? 0.3012 0.3406 0.2345 0.0425 -0.0612 0.0291 792 PHE A O 3634 C CB . PHE A 484 ? 0.2871 0.3072 0.1999 0.0440 -0.0385 0.0456 792 PHE A CB 3635 C CG . PHE A 484 ? 0.3126 0.3236 0.2179 0.0466 -0.0301 0.0559 792 PHE A CG 3636 C CD1 . PHE A 484 ? 0.3108 0.3191 0.2299 0.0418 -0.0223 0.0593 792 PHE A CD1 3637 C CD2 . PHE A 484 ? 0.3416 0.3458 0.2259 0.0539 -0.0303 0.0624 792 PHE A CD2 3638 C CE1 . PHE A 484 ? 0.3067 0.3064 0.2220 0.0432 -0.0148 0.0690 792 PHE A CE1 3639 C CE2 . PHE A 484 ? 0.3606 0.3561 0.2396 0.0561 -0.0213 0.0731 792 PHE A CE2 3640 C CZ . PHE A 484 ? 0.3223 0.3158 0.2185 0.0502 -0.0136 0.0764 792 PHE A CZ 3641 N N . SER A 485 ? 0.2338 0.2736 0.1915 0.0363 -0.0487 0.0321 793 SER A N 3642 C CA . SER A 485 ? 0.2455 0.2939 0.2179 0.0320 -0.0516 0.0245 793 SER A CA 3643 C C . SER A 485 ? 0.2407 0.2876 0.2079 0.0274 -0.0474 0.0198 793 SER A C 3644 O O . SER A 485 ? 0.3079 0.3504 0.2744 0.0245 -0.0388 0.0215 793 SER A O 3645 C CB . SER A 485 ? 0.3047 0.3558 0.2956 0.0299 -0.0472 0.0247 793 SER A CB 3646 O OG . SER A 485 ? 0.4045 0.4537 0.3981 0.0348 -0.0483 0.0302 793 SER A OG 3647 N N . ILE A 486 ? 0.2671 0.3173 0.2314 0.0267 -0.0541 0.0136 794 ILE A N 3648 C CA . ILE A 486 ? 0.2789 0.3270 0.2381 0.0230 -0.0506 0.0086 794 ILE A CA 3649 C C . ILE A 486 ? 0.2739 0.3292 0.2515 0.0180 -0.0529 0.0021 794 ILE A C 3650 O O . ILE A 486 ? 0.2894 0.3502 0.2741 0.0181 -0.0622 -0.0019 794 ILE A O 3651 C CB . ILE A 486 ? 0.3158 0.3588 0.2537 0.0266 -0.0560 0.0059 794 ILE A CB 3652 C CG1 . ILE A 486 ? 0.3662 0.4020 0.2847 0.0330 -0.0542 0.0134 794 ILE A CG1 3653 C CG2 . ILE A 486 ? 0.3066 0.3456 0.2378 0.0238 -0.0504 0.0015 794 ILE A CG2 3654 C CD1 . ILE A 486 ? 0.3457 0.3765 0.2621 0.0321 -0.0413 0.0202 794 ILE A CD1 3655 N N . SER A 487 ? 0.2309 0.2861 0.2167 0.0138 -0.0446 0.0015 795 SER A N 3656 C CA . SER A 487 ? 0.2174 0.2786 0.2213 0.0097 -0.0445 -0.0027 795 SER A CA 3657 C C . SER A 487 ? 0.2193 0.2786 0.2206 0.0061 -0.0435 -0.0085 795 SER A C 3658 O O . SER A 487 ? 0.2171 0.2704 0.2061 0.0061 -0.0381 -0.0082 795 SER A O 3659 C CB . SER A 487 ? 0.2298 0.2910 0.2435 0.0084 -0.0362 0.0005 795 SER A CB 3660 O OG . SER A 487 ? 0.2637 0.3260 0.2818 0.0117 -0.0370 0.0051 795 SER A OG 3661 N N . ASN A 488 ? 0.1865 0.2509 0.2013 0.0032 -0.0484 -0.0134 796 ASN A N 3662 C CA . ASN A 488 ? 0.1892 0.2512 0.2055 -0.0007 -0.0467 -0.0188 796 ASN A CA 3663 C C . ASN A 488 ? 0.1658 0.2271 0.1888 -0.0029 -0.0361 -0.0165 796 ASN A C 3664 O O . ASN A 488 ? 0.1616 0.2276 0.1992 -0.0036 -0.0331 -0.0141 796 ASN A O 3665 C CB . ASN A 488 ? 0.2163 0.2843 0.2498 -0.0038 -0.0545 -0.0236 796 ASN A CB 3666 C CG . ASN A 488 ? 0.2039 0.2674 0.2378 -0.0077 -0.0545 -0.0298 796 ASN A CG 3667 O OD1 . ASN A 488 ? 0.2115 0.2700 0.2397 -0.0086 -0.0460 -0.0296 796 ASN A OD1 3668 N ND2 . ASN A 488 ? 0.2093 0.2744 0.2508 -0.0100 -0.0648 -0.0356 796 ASN A ND2 3669 N N . GLY A 489 ? 0.1392 0.1945 0.1515 -0.0034 -0.0304 -0.0172 797 GLY A N 3670 C CA . GLY A 489 ? 0.1250 0.1793 0.1421 -0.0049 -0.0218 -0.0149 797 GLY A CA 3671 C C . GLY A 489 ? 0.1626 0.2197 0.1953 -0.0080 -0.0195 -0.0168 797 GLY A C 3672 O O . GLY A 489 ? 0.1471 0.2035 0.1837 -0.0082 -0.0131 -0.0143 797 GLY A O 3673 N N . LEU A 490 ? 0.1604 0.2200 0.2017 -0.0101 -0.0250 -0.0210 798 LEU A N 3674 C CA . LEU A 490 ? 0.1474 0.2098 0.2060 -0.0132 -0.0222 -0.0217 798 LEU A CA 3675 C C . LEU A 490 ? 0.1769 0.2469 0.2515 -0.0124 -0.0218 -0.0180 798 LEU A C 3676 O O . LEU A 490 ? 0.1509 0.2238 0.2408 -0.0140 -0.0175 -0.0168 798 LEU A O 3677 C CB . LEU A 490 ? 0.1442 0.2056 0.2085 -0.0167 -0.0284 -0.0278 798 LEU A CB 3678 C CG . LEU A 490 ? 0.1594 0.2120 0.2108 -0.0174 -0.0271 -0.0323 798 LEU A CG 3679 C CD1 . LEU A 490 ? 0.1525 0.2024 0.2086 -0.0206 -0.0357 -0.0394 798 LEU A CD1 3680 C CD2 . LEU A 490 ? 0.1504 0.2002 0.2049 -0.0181 -0.0171 -0.0298 798 LEU A CD2 3681 N N . ALA A 491 ? 0.1660 0.2388 0.2372 -0.0093 -0.0254 -0.0155 799 ALA A N 3682 C CA . ALA A 491 ? 0.1655 0.2459 0.2525 -0.0076 -0.0259 -0.0122 799 ALA A CA 3683 C C . ALA A 491 ? 0.1896 0.2682 0.2719 -0.0034 -0.0200 -0.0071 799 ALA A C 3684 O O . ALA A 491 ? 0.1751 0.2587 0.2665 -0.0005 -0.0207 -0.0042 799 ALA A O 3685 C CB . ALA A 491 ? 0.1841 0.2699 0.2749 -0.0069 -0.0369 -0.0137 799 ALA A CB 3686 N N . THR A 492 ? 0.1807 0.2520 0.2499 -0.0029 -0.0145 -0.0064 800 THR A N 3687 C CA . THR A 492 ? 0.2123 0.2796 0.2751 0.0007 -0.0106 -0.0027 800 THR A CA 3688 C C . THR A 492 ? 0.2041 0.2736 0.2778 0.0037 -0.0055 0.0001 800 THR A C 3689 O O . THR A 492 ? 0.2074 0.2755 0.2794 0.0077 -0.0052 0.0027 800 THR A O 3690 C CB . THR A 492 ? 0.2548 0.3143 0.3050 -0.0001 -0.0065 -0.0027 800 THR A CB 3691 O OG1 . THR A 492 ? 0.3312 0.3895 0.3853 -0.0013 -0.0011 -0.0036 800 THR A OG1 3692 C CG2 . THR A 492 ? 0.2464 0.3041 0.2864 -0.0020 -0.0097 -0.0044 800 THR A CG2 3693 N N . THR A 493 ? 0.1852 0.2573 0.2698 0.0025 -0.0008 -0.0001 801 THR A N 3694 C CA . THR A 493 ? 0.1557 0.2294 0.2496 0.0065 0.0060 0.0034 801 THR A CA 3695 C C . THR A 493 ? 0.1582 0.2407 0.2671 0.0088 0.0031 0.0056 801 THR A C 3696 O O . THR A 493 ? 0.1856 0.2682 0.2985 0.0141 0.0084 0.0091 801 THR A O 3697 C CB . THR A 493 ? 0.2022 0.2767 0.3054 0.0051 0.0131 0.0041 801 THR A CB 3698 O OG1 . THR A 493 ? 0.2052 0.2873 0.3242 0.0002 0.0089 0.0022 801 THR A OG1 3699 C CG2 . THR A 493 ? 0.1922 0.2577 0.2803 0.0041 0.0162 0.0026 801 THR A CG2 3700 N N . GLN A 494 ? 0.1356 0.2250 0.2521 0.0056 -0.0056 0.0035 802 GLN A N 3701 C CA . GLN A 494 ? 0.1526 0.2517 0.2849 0.0077 -0.0106 0.0055 802 GLN A CA 3702 C C . GLN A 494 ? 0.1893 0.2856 0.3103 0.0121 -0.0150 0.0071 802 GLN A C 3703 O O . GLN A 494 ? 0.2130 0.3159 0.3453 0.0159 -0.0173 0.0100 802 GLN A O 3704 C CB . GLN A 494 ? 0.1569 0.2634 0.3011 0.0026 -0.0202 0.0020 802 GLN A CB 3705 C CG . GLN A 494 ? 0.1585 0.2682 0.3187 -0.0021 -0.0165 0.0008 802 GLN A CG 3706 C CD . GLN A 494 ? 0.1914 0.3049 0.3592 -0.0077 -0.0275 -0.0044 802 GLN A CD 3707 O OE1 . GLN A 494 ? 0.2610 0.3823 0.4421 -0.0081 -0.0355 -0.0045 802 GLN A OE1 3708 N NE2 . GLN A 494 ? 0.1784 0.2841 0.3340 -0.0116 -0.0281 -0.0089 802 GLN A NE2 3709 N N . ILE A 495 ? 0.1586 0.2455 0.2589 0.0116 -0.0159 0.0057 803 ILE A N 3710 C CA . ILE A 495 ? 0.1952 0.2778 0.2840 0.0151 -0.0196 0.0077 803 ILE A CA 3711 C C . ILE A 495 ? 0.2323 0.3062 0.3133 0.0192 -0.0126 0.0102 803 ILE A C 3712 O O . ILE A 495 ? 0.2329 0.3060 0.3155 0.0242 -0.0127 0.0132 803 ILE A O 3713 C CB . ILE A 495 ? 0.2022 0.2795 0.2743 0.0123 -0.0244 0.0057 803 ILE A CB 3714 C CG1 . ILE A 495 ? 0.2245 0.3082 0.3010 0.0092 -0.0324 0.0022 803 ILE A CG1 3715 C CG2 . ILE A 495 ? 0.2363 0.3083 0.2970 0.0160 -0.0269 0.0090 803 ILE A CG2 3716 C CD1 . ILE A 495 ? 0.2146 0.2922 0.2742 0.0067 -0.0345 -0.0007 803 ILE A CD1 3717 N N . ASN A 496 ? 0.1943 0.2609 0.2666 0.0174 -0.0073 0.0087 804 ASN A N 3718 C CA . ASN A 496 ? 0.2046 0.2612 0.2679 0.0210 -0.0019 0.0097 804 ASN A CA 3719 C C . ASN A 496 ? 0.1847 0.2372 0.2443 0.0195 0.0038 0.0079 804 ASN A C 3720 O O . ASN A 496 ? 0.1847 0.2333 0.2357 0.0156 0.0027 0.0059 804 ASN A O 3721 C CB . ASN A 496 ? 0.2035 0.2513 0.2530 0.0207 -0.0054 0.0102 804 ASN A CB 3722 C CG . ASN A 496 ? 0.2161 0.2518 0.2564 0.0238 -0.0018 0.0102 804 ASN A CG 3723 O OD1 . ASN A 496 ? 0.2226 0.2555 0.2633 0.0270 0.0035 0.0096 804 ASN A OD1 3724 N ND2 . ASN A 496 ? 0.2095 0.2373 0.2411 0.0232 -0.0048 0.0111 804 ASN A ND2 3725 N N . ASN A 497 ? 0.2019 0.2551 0.2678 0.0231 0.0106 0.0091 805 ASN A N 3726 C CA A ASN A 497 ? 0.2005 0.2496 0.2624 0.0226 0.0165 0.0082 805 ASN A CA 3727 C CA B ASN A 497 ? 0.2154 0.2645 0.2773 0.0227 0.0166 0.0082 805 ASN A CA 3728 C C . ASN A 497 ? 0.1987 0.2351 0.2425 0.0237 0.0166 0.0064 805 ASN A C 3729 O O . ASN A 497 ? 0.2159 0.2494 0.2541 0.0212 0.0175 0.0049 805 ASN A O 3730 C CB A ASN A 497 ? 0.2475 0.2996 0.3195 0.0274 0.0251 0.0111 805 ASN A CB 3731 C CB B ASN A 497 ? 0.2563 0.3080 0.3279 0.0278 0.0253 0.0112 805 ASN A CB 3732 C CG A ASN A 497 ? 0.2784 0.3289 0.3499 0.0261 0.0313 0.0112 805 ASN A CG 3733 C CG B ASN A 497 ? 0.2781 0.3246 0.3461 0.0355 0.0286 0.0133 805 ASN A CG 3734 O OD1 A ASN A 497 ? 0.3203 0.3770 0.4005 0.0205 0.0295 0.0102 805 ASN A OD1 3735 O OD1 B ASN A 497 ? 0.2933 0.3311 0.3486 0.0371 0.0246 0.0118 805 ASN A OD1 3736 N ND2 A ASN A 497 ? 0.2555 0.2964 0.3153 0.0319 0.0382 0.0122 805 ASN A ND2 3737 N ND2 B ASN A 497 ? 0.3186 0.3702 0.3989 0.0405 0.0363 0.0169 805 ASN A ND2 3738 N N . LYS A 498 ? 0.1709 0.1993 0.2064 0.0273 0.0148 0.0065 806 LYS A N 3739 C CA . LYS A 498 ? 0.1713 0.1873 0.1916 0.0275 0.0126 0.0043 806 LYS A CA 3740 C C . LYS A 498 ? 0.1985 0.2158 0.2170 0.0208 0.0068 0.0032 806 LYS A C 3741 O O . LYS A 498 ? 0.2233 0.2346 0.2342 0.0191 0.0055 0.0014 806 LYS A O 3742 C CB . LYS A 498 ? 0.2108 0.2171 0.2242 0.0324 0.0112 0.0044 806 LYS A CB 3743 C CG . LYS A 498 ? 0.3391 0.3408 0.3504 0.0407 0.0180 0.0053 806 LYS A CG 3744 C CD . LYS A 498 ? 0.4570 0.4443 0.4513 0.0449 0.0200 0.0025 806 LYS A CD 3745 C CE . LYS A 498 ? 0.5341 0.5137 0.5223 0.0548 0.0273 0.0034 806 LYS A CE 3746 N NZ . LYS A 498 ? 0.5857 0.5487 0.5529 0.0602 0.0283 -0.0001 806 LYS A NZ 3747 N N . ALA A 499 ? 0.1790 0.2039 0.2041 0.0177 0.0035 0.0044 807 ALA A N 3748 C CA . ALA A 499 ? 0.2087 0.2350 0.2317 0.0124 -0.0002 0.0041 807 ALA A CA 3749 C C . ALA A 499 ? 0.1978 0.2291 0.2231 0.0092 0.0017 0.0025 807 ALA A C 3750 O O . ALA A 499 ? 0.2305 0.2601 0.2521 0.0062 0.0008 0.0018 807 ALA A O 3751 C CB . ALA A 499 ? 0.2118 0.2434 0.2379 0.0114 -0.0039 0.0061 807 ALA A CB 3752 N N . ALA A 500 ? 0.1848 0.2221 0.2179 0.0099 0.0047 0.0022 808 ALA A N 3753 C CA . ALA A 500 ? 0.1984 0.2390 0.2345 0.0070 0.0069 0.0007 808 ALA A CA 3754 C C . ALA A 500 ? 0.2100 0.2437 0.2388 0.0080 0.0100 0.0002 808 ALA A C 3755 O O . ALA A 500 ? 0.2222 0.2561 0.2494 0.0052 0.0100 -0.0008 808 ALA A O 3756 C CB . ALA A 500 ? 0.1882 0.2360 0.2368 0.0073 0.0096 0.0011 808 ALA A CB 3757 N N . THR A 501 ? 0.1706 0.1976 0.1938 0.0127 0.0124 0.0008 809 THR A N 3758 C CA . THR A 501 ? 0.1904 0.2096 0.2042 0.0151 0.0145 0.0001 809 THR A CA 3759 C C . THR A 501 ? 0.1942 0.2063 0.1992 0.0140 0.0088 -0.0014 809 THR A C 3760 O O . THR A 501 ? 0.2020 0.2077 0.1991 0.0156 0.0081 -0.0024 809 THR A O 3761 C CB . THR A 501 ? 0.2719 0.2850 0.2806 0.0219 0.0198 0.0011 809 THR A CB 3762 O OG1 . THR A 501 ? 0.2675 0.2752 0.2716 0.0249 0.0172 0.0007 809 THR A OG1 3763 C CG2 . THR A 501 ? 0.3160 0.3369 0.3370 0.0230 0.0266 0.0037 809 THR A CG2 3764 N N . GLY A 502 ? 0.2017 0.2147 0.2088 0.0115 0.0043 -0.0011 810 GLY A N 3765 C CA . GLY A 502 ? 0.1992 0.2063 0.2020 0.0097 -0.0010 -0.0017 810 GLY A CA 3766 C C . GLY A 502 ? 0.2192 0.2150 0.2142 0.0135 -0.0037 -0.0029 810 GLY A C 3767 O O . GLY A 502 ? 0.2515 0.2406 0.2439 0.0119 -0.0091 -0.0039 810 GLY A O 3768 N N . GLU A 503 ? 0.2240 0.2175 0.2164 0.0187 0.0002 -0.0028 811 GLU A N 3769 C CA . GLU A 503 ? 0.2350 0.2162 0.2183 0.0236 -0.0016 -0.0044 811 GLU A CA 3770 C C . GLU A 503 ? 0.2493 0.2289 0.2368 0.0216 -0.0055 -0.0031 811 GLU A C 3771 O O . GLU A 503 ? 0.2640 0.2316 0.2447 0.0236 -0.0093 -0.0049 811 GLU A O 3772 C CB . GLU A 503 ? 0.2504 0.2296 0.2301 0.0309 0.0054 -0.0039 811 GLU A CB 3773 C CG . GLU A 503 ? 0.2776 0.2517 0.2474 0.0353 0.0094 -0.0049 811 GLU A CG 3774 C CD . GLU A 503 ? 0.3414 0.3138 0.3087 0.0432 0.0183 -0.0031 811 GLU A CD 3775 O OE1 . GLU A 503 ? 0.3997 0.3817 0.3762 0.0430 0.0251 -0.0001 811 GLU A OE1 3776 O OE2 . GLU A 503 ? 0.3579 0.3192 0.3151 0.0495 0.0188 -0.0044 811 GLU A OE2 3777 N N . GLU A 504 ? 0.2103 0.2009 0.2077 0.0182 -0.0047 -0.0002 812 GLU A N 3778 C CA . GLU A 504 ? 0.2209 0.2110 0.2220 0.0166 -0.0077 0.0023 812 GLU A CA 3779 C C . GLU A 504 ? 0.1998 0.1989 0.2071 0.0107 -0.0088 0.0046 812 GLU A C 3780 O O . GLU A 504 ? 0.1910 0.1984 0.2011 0.0089 -0.0067 0.0042 812 GLU A O 3781 C CB . GLU A 504 ? 0.2276 0.2215 0.2324 0.0210 -0.0051 0.0044 812 GLU A CB 3782 C CG . GLU A 504 ? 0.2908 0.2743 0.2894 0.0279 -0.0033 0.0031 812 GLU A CG 3783 C CD . GLU A 504 ? 0.2981 0.2871 0.3034 0.0327 -0.0005 0.0059 812 GLU A CD 3784 O OE1 . GLU A 504 ? 0.3225 0.3046 0.3239 0.0395 0.0029 0.0054 812 GLU A OE1 3785 O OE2 . GLU A 504 ? 0.2767 0.2767 0.2907 0.0302 -0.0018 0.0087 812 GLU A OE2 3786 N N . VAL A 505 ? 0.2025 0.1988 0.2113 0.0082 -0.0115 0.0074 813 VAL A N 3787 C CA . VAL A 505 ? 0.2179 0.2218 0.2307 0.0043 -0.0110 0.0106 813 VAL A CA 3788 C C . VAL A 505 ? 0.2207 0.2316 0.2343 0.0067 -0.0101 0.0125 813 VAL A C 3789 O O . VAL A 505 ? 0.2183 0.2262 0.2316 0.0103 -0.0109 0.0137 813 VAL A O 3790 C CB . VAL A 505 ? 0.2243 0.2223 0.2393 0.0013 -0.0131 0.0141 813 VAL A CB 3791 C CG1 . VAL A 505 ? 0.2138 0.2191 0.2311 -0.0014 -0.0107 0.0184 813 VAL A CG1 3792 C CG2 . VAL A 505 ? 0.2380 0.2291 0.2545 -0.0013 -0.0161 0.0117 813 VAL A CG2 3793 N N . PRO A 506 ? 0.1978 0.2176 0.2124 0.0050 -0.0090 0.0124 814 PRO A N 3794 C CA . PRO A 506 ? 0.1890 0.2151 0.2041 0.0071 -0.0102 0.0135 814 PRO A CA 3795 C C . PRO A 506 ? 0.2140 0.2364 0.2259 0.0087 -0.0119 0.0183 814 PRO A C 3796 O O . PRO A 506 ? 0.2110 0.2286 0.2208 0.0066 -0.0109 0.0214 814 PRO A O 3797 C CB . PRO A 506 ? 0.2216 0.2542 0.2354 0.0045 -0.0095 0.0122 814 PRO A CB 3798 C CG . PRO A 506 ? 0.2259 0.2574 0.2410 0.0018 -0.0070 0.0098 814 PRO A CG 3799 C CD . PRO A 506 ? 0.2029 0.2265 0.2180 0.0015 -0.0073 0.0110 814 PRO A CD 3800 N N . ARG A 507 ? 0.1994 0.2243 0.2123 0.0126 -0.0141 0.0195 815 ARG A N 3801 C CA . ARG A 507 ? 0.2108 0.2315 0.2199 0.0152 -0.0158 0.0246 815 ARG A CA 3802 C C . ARG A 507 ? 0.2158 0.2429 0.2202 0.0168 -0.0187 0.0262 815 ARG A C 3803 O O . ARG A 507 ? 0.2426 0.2672 0.2423 0.0201 -0.0206 0.0308 815 ARG A O 3804 C CB . ARG A 507 ? 0.1841 0.2003 0.1965 0.0198 -0.0167 0.0255 815 ARG A CB 3805 C CG . ARG A 507 ? 0.1924 0.1984 0.2051 0.0190 -0.0147 0.0237 815 ARG A CG 3806 C CD . ARG A 507 ? 0.2096 0.2085 0.2232 0.0246 -0.0149 0.0243 815 ARG A CD 3807 N NE . ARG A 507 ? 0.2200 0.2268 0.2393 0.0290 -0.0142 0.0227 815 ARG A NE 3808 C CZ . ARG A 507 ? 0.2361 0.2440 0.2578 0.0301 -0.0111 0.0189 815 ARG A CZ 3809 N NH1 . ARG A 507 ? 0.1874 0.1882 0.2040 0.0276 -0.0095 0.0156 815 ARG A NH1 3810 N NH2 . ARG A 507 ? 0.2486 0.2646 0.2783 0.0342 -0.0095 0.0189 815 ARG A NH2 3811 N N . THR A 508 ? 0.1960 0.2301 0.2005 0.0147 -0.0194 0.0222 816 THR A N 3812 C CA . THR A 508 ? 0.2210 0.2591 0.2183 0.0161 -0.0231 0.0223 816 THR A CA 3813 C C . THR A 508 ? 0.1897 0.2264 0.1789 0.0134 -0.0197 0.0218 816 THR A C 3814 O O . THR A 508 ? 0.2064 0.2413 0.1988 0.0099 -0.0151 0.0210 816 THR A O 3815 C CB . THR A 508 ? 0.2481 0.2950 0.2527 0.0165 -0.0282 0.0175 816 THR A CB 3816 O OG1 . THR A 508 ? 0.2505 0.3001 0.2607 0.0124 -0.0253 0.0127 816 THR A OG1 3817 C CG2 . THR A 508 ? 0.2384 0.2883 0.2541 0.0198 -0.0302 0.0186 816 THR A CG2 3818 N N . ILE A 509 ? 0.2144 0.2516 0.1924 0.0156 -0.0222 0.0223 817 ILE A N 3819 C CA . ILE A 509 ? 0.2238 0.2595 0.1927 0.0144 -0.0185 0.0213 817 ILE A CA 3820 C C . ILE A 509 ? 0.2468 0.2874 0.2188 0.0122 -0.0215 0.0137 817 ILE A C 3821 O O . ILE A 509 ? 0.3030 0.3475 0.2766 0.0135 -0.0286 0.0102 817 ILE A O 3822 C CB . ILE A 509 ? 0.2516 0.2833 0.2036 0.0191 -0.0191 0.0254 817 ILE A CB 3823 C CG1 . ILE A 509 ? 0.2565 0.2823 0.2070 0.0205 -0.0139 0.0341 817 ILE A CG1 3824 C CG2 . ILE A 509 ? 0.2588 0.2887 0.1994 0.0193 -0.0155 0.0233 817 ILE A CG2 3825 C CD1 . ILE A 509 ? 0.2726 0.2937 0.2067 0.0266 -0.0150 0.0398 817 ILE A CD1 3826 N N . ILE A 510 ? 0.1909 0.2314 0.1653 0.0090 -0.0165 0.0114 818 ILE A N 3827 C CA . ILE A 510 ? 0.1587 0.2026 0.1382 0.0065 -0.0183 0.0047 818 ILE A CA 3828 C C . ILE A 510 ? 0.1821 0.2229 0.1494 0.0072 -0.0169 0.0019 818 ILE A C 3829 O O . ILE A 510 ? 0.1984 0.2356 0.1581 0.0083 -0.0107 0.0055 818 ILE A O 3830 C CB . ILE A 510 ? 0.1626 0.2078 0.1545 0.0030 -0.0139 0.0037 818 ILE A CB 3831 C CG1 . ILE A 510 ? 0.1744 0.2207 0.1755 0.0035 -0.0149 0.0059 818 ILE A CG1 3832 C CG2 . ILE A 510 ? 0.1808 0.2288 0.1786 0.0006 -0.0149 -0.0022 818 ILE A CG2 3833 C CD1 . ILE A 510 ? 0.2415 0.2872 0.2510 0.0013 -0.0110 0.0049 818 ILE A CD1 3834 N N . VAL A 511 ? 0.1973 0.2392 0.1636 0.0068 -0.0227 -0.0044 819 VAL A N 3835 C CA . VAL A 511 ? 0.2017 0.2388 0.1552 0.0080 -0.0223 -0.0086 819 VAL A CA 3836 C C . VAL A 511 ? 0.2076 0.2455 0.1708 0.0040 -0.0196 -0.0133 819 VAL A C 3837 O O . VAL A 511 ? 0.2071 0.2493 0.1848 0.0008 -0.0227 -0.0161 819 VAL A O 3838 C CB . VAL A 511 ? 0.2585 0.2939 0.2024 0.0104 -0.0325 -0.0137 819 VAL A CB 3839 C CG1 . VAL A 511 ? 0.3166 0.3438 0.2416 0.0132 -0.0317 -0.0181 819 VAL A CG1 3840 C CG2 . VAL A 511 ? 0.2974 0.3330 0.2338 0.0147 -0.0371 -0.0091 819 VAL A CG2 3841 N N . THR A 512 ? 0.2198 0.2534 0.1753 0.0048 -0.0131 -0.0136 820 THR A N 3842 C CA . THR A 512 ? 0.1868 0.2198 0.1498 0.0020 -0.0099 -0.0175 820 THR A CA 3843 C C . THR A 512 ? 0.1999 0.2256 0.1477 0.0047 -0.0093 -0.0222 820 THR A C 3844 O O . THR A 512 ? 0.2176 0.2392 0.1505 0.0092 -0.0050 -0.0192 820 THR A O 3845 C CB . THR A 512 ? 0.1597 0.1949 0.1308 0.0007 -0.0016 -0.0125 820 THR A CB 3846 O OG1 . THR A 512 ? 0.1788 0.2181 0.1587 -0.0005 -0.0026 -0.0081 820 THR A OG1 3847 C CG2 . THR A 512 ? 0.1713 0.2066 0.1520 -0.0020 0.0009 -0.0158 820 THR A CG2 3848 N N . THR A 513 ? 0.1923 0.2152 0.1431 0.0026 -0.0134 -0.0293 821 THR A N 3849 C CA . THR A 513 ? 0.1952 0.2088 0.1295 0.0058 -0.0141 -0.0351 821 THR A CA 3850 C C . THR A 513 ? 0.2157 0.2255 0.1573 0.0031 -0.0119 -0.0401 821 THR A C 3851 O O . THR A 513 ? 0.2203 0.2345 0.1798 -0.0018 -0.0133 -0.0409 821 THR A O 3852 C CB . THR A 513 ? 0.3225 0.3317 0.2456 0.0073 -0.0259 -0.0412 821 THR A CB 3853 O OG1 . THR A 513 ? 0.3286 0.3404 0.2682 0.0019 -0.0339 -0.0468 821 THR A OG1 3854 C CG2 . THR A 513 ? 0.2915 0.3045 0.2086 0.0102 -0.0297 -0.0362 821 THR A CG2 3855 N N . ARG A 514 ? 0.2248 0.2257 0.1517 0.0069 -0.0078 -0.0432 822 ARG A N 3856 C CA . ARG A 514 ? 0.1998 0.1947 0.1314 0.0052 -0.0062 -0.0486 822 ARG A CA 3857 C C . ARG A 514 ? 0.2298 0.2217 0.1684 0.0007 -0.0171 -0.0566 822 ARG A C 3858 O O . ARG A 514 ? 0.2424 0.2337 0.1958 -0.0035 -0.0164 -0.0588 822 ARG A O 3859 C CB . ARG A 514 ? 0.2385 0.2229 0.1506 0.0115 0.0001 -0.0509 822 ARG A CB 3860 C CG . ARG A 514 ? 0.2630 0.2523 0.1778 0.0143 0.0125 -0.0424 822 ARG A CG 3861 C CD . ARG A 514 ? 0.2628 0.2427 0.1630 0.0207 0.0206 -0.0442 822 ARG A CD 3862 N NE . ARG A 514 ? 0.2941 0.2808 0.2040 0.0222 0.0317 -0.0359 822 ARG A NE 3863 C CZ . ARG A 514 ? 0.2722 0.2544 0.1771 0.0275 0.0410 -0.0351 822 ARG A CZ 3864 N NH1 . ARG A 514 ? 0.2332 0.2020 0.1209 0.0321 0.0410 -0.0425 822 ARG A NH1 3865 N NH2 . ARG A 514 ? 0.2634 0.2541 0.1811 0.0282 0.0496 -0.0270 822 ARG A NH2 3866 N N . SER A 515 ? 0.2080 0.1979 0.1371 0.0018 -0.0274 -0.0605 823 SER A N 3867 C CA . SER A 515 ? 0.2854 0.2739 0.2245 -0.0029 -0.0395 -0.0680 823 SER A CA 3868 C C . SER A 515 ? 0.2804 0.2809 0.2480 -0.0095 -0.0406 -0.0642 823 SER A C 3869 O O . SER A 515 ? 0.2846 0.2847 0.2679 -0.0147 -0.0467 -0.0689 823 SER A O 3870 C CB . SER A 515 ? 0.3095 0.2941 0.2323 0.0002 -0.0517 -0.0726 823 SER A CB 3871 O OG . SER A 515 ? 0.3127 0.3074 0.2374 0.0015 -0.0527 -0.0656 823 SER A OG 3872 N N . GLN A 516 ? 0.2490 0.2593 0.2236 -0.0092 -0.0344 -0.0557 824 GLN A N 3873 C CA . GLN A 516 ? 0.2313 0.2517 0.2299 -0.0138 -0.0335 -0.0516 824 GLN A CA 3874 C C . GLN A 516 ? 0.2677 0.2865 0.2800 -0.0172 -0.0267 -0.0515 824 GLN A C 3875 O O . GLN A 516 ? 0.2575 0.2819 0.2898 -0.0212 -0.0267 -0.0498 824 GLN A O 3876 C CB . GLN A 516 ? 0.2182 0.2464 0.2176 -0.0117 -0.0277 -0.0432 824 GLN A CB 3877 C CG . GLN A 516 ? 0.2115 0.2443 0.2067 -0.0096 -0.0346 -0.0414 824 GLN A CG 3878 C CD . GLN A 516 ? 0.2223 0.2595 0.2150 -0.0071 -0.0284 -0.0335 824 GLN A CD 3879 O OE1 . GLN A 516 ? 0.1876 0.2231 0.1768 -0.0062 -0.0198 -0.0302 824 GLN A OE1 3880 N NE2 . GLN A 516 ? 0.2412 0.2837 0.2368 -0.0060 -0.0331 -0.0306 824 GLN A NE2 3881 N N . TYR A 517 ? 0.2545 0.2655 0.2560 -0.0149 -0.0201 -0.0525 825 TYR A N 3882 C CA . TYR A 517 ? 0.2547 0.2634 0.2672 -0.0170 -0.0129 -0.0513 825 TYR A CA 3883 C C . TYR A 517 ? 0.2528 0.2493 0.2594 -0.0172 -0.0141 -0.0586 825 TYR A C 3884 O O . TYR A 517 ? 0.2389 0.2312 0.2514 -0.0179 -0.0076 -0.0578 825 TYR A O 3885 C CB . TYR A 517 ? 0.2264 0.2381 0.2357 -0.0139 -0.0030 -0.0443 825 TYR A CB 3886 C CG . TYR A 517 ? 0.1889 0.2105 0.2034 -0.0138 -0.0025 -0.0380 825 TYR A CG 3887 C CD1 . TYR A 517 ? 0.1331 0.1603 0.1635 -0.0164 -0.0012 -0.0346 825 TYR A CD1 3888 C CD2 . TYR A 517 ? 0.1810 0.2050 0.1840 -0.0107 -0.0030 -0.0353 825 TYR A CD2 3889 C CE1 . TYR A 517 ? 0.1800 0.2143 0.2135 -0.0156 -0.0008 -0.0296 825 TYR A CE1 3890 C CE2 . TYR A 517 ? 0.1281 0.1593 0.1359 -0.0106 -0.0030 -0.0300 825 TYR A CE2 3891 C CZ . TYR A 517 ? 0.1720 0.2079 0.1943 -0.0129 -0.0021 -0.0276 825 TYR A CZ 3892 O OH . TYR A 517 ? 0.1587 0.1999 0.1841 -0.0120 -0.0020 -0.0230 825 TYR A OH 3893 N N . GLY A 518 ? 0.2342 0.2238 0.2278 -0.0160 -0.0227 -0.0658 826 GLY A N 3894 C CA . GLY A 518 ? 0.2781 0.2538 0.2638 -0.0159 -0.0254 -0.0742 826 GLY A CA 3895 C C . GLY A 518 ? 0.3029 0.2704 0.2717 -0.0098 -0.0158 -0.0736 826 GLY A C 3896 O O . GLY A 518 ? 0.3188 0.2748 0.2847 -0.0094 -0.0140 -0.0786 826 GLY A O 3897 N N . LEU A 519 ? 0.2778 0.2512 0.2366 -0.0051 -0.0093 -0.0672 827 LEU A N 3898 C CA . LEU A 519 ? 0.3035 0.2717 0.2492 0.0010 0.0007 -0.0650 827 LEU A CA 3899 C C . LEU A 519 ? 0.3085 0.2648 0.2284 0.0072 -0.0015 -0.0713 827 LEU A C 3900 O O . LEU A 519 ? 0.2851 0.2410 0.1937 0.0084 -0.0092 -0.0737 827 LEU A O 3901 C CB . LEU A 519 ? 0.2728 0.2525 0.2215 0.0030 0.0083 -0.0552 827 LEU A CB 3902 C CG . LEU A 519 ? 0.2670 0.2566 0.2365 -0.0012 0.0116 -0.0489 827 LEU A CG 3903 C CD1 . LEU A 519 ? 0.2384 0.2384 0.2094 0.0001 0.0152 -0.0408 827 LEU A CD1 3904 C CD2 . LEU A 519 ? 0.2500 0.2353 0.2259 -0.0005 0.0186 -0.0482 827 LEU A CD2 3905 N N . PRO A 520 ? 0.3522 0.2979 0.2614 0.0122 0.0055 -0.0737 828 PRO A N 3906 C CA . PRO A 520 ? 0.3947 0.3264 0.2764 0.0195 0.0045 -0.0802 828 PRO A CA 3907 C C . PRO A 520 ? 0.3586 0.2950 0.2242 0.0258 0.0093 -0.0740 828 PRO A C 3908 O O . PRO A 520 ? 0.2930 0.2399 0.1668 0.0270 0.0190 -0.0644 828 PRO A O 3909 C CB . PRO A 520 ? 0.4158 0.3373 0.2934 0.0239 0.0141 -0.0818 828 PRO A CB 3910 C CG . PRO A 520 ? 0.3962 0.3308 0.2960 0.0213 0.0229 -0.0722 828 PRO A CG 3911 C CD . PRO A 520 ? 0.3226 0.2684 0.2430 0.0126 0.0154 -0.0700 828 PRO A CD 3912 N N . GLU A 521 ? 0.4059 0.3338 0.2488 0.0299 0.0021 -0.0793 829 GLU A N 3913 C CA . GLU A 521 ? 0.4587 0.3885 0.2831 0.0369 0.0068 -0.0734 829 GLU A CA 3914 C C . GLU A 521 ? 0.4738 0.3984 0.2858 0.0448 0.0203 -0.0692 829 GLU A C 3915 O O . GLU A 521 ? 0.5112 0.4415 0.3181 0.0492 0.0282 -0.0603 829 GLU A O 3916 C CB . GLU A 521 ? 0.5419 0.4663 0.3506 0.0377 -0.0059 -0.0784 829 GLU A CB 3917 C CG . GLU A 521 ? 0.6238 0.5528 0.4464 0.0300 -0.0212 -0.0838 829 GLU A CG 3918 C CD . GLU A 521 ? 0.6479 0.5950 0.4915 0.0251 -0.0198 -0.0741 829 GLU A CD 3919 O OE1 . GLU A 521 ? 0.6042 0.5601 0.4737 0.0170 -0.0234 -0.0737 829 GLU A OE1 3920 O OE2 . GLU A 521 ? 0.6655 0.6169 0.4993 0.0296 -0.0147 -0.0665 829 GLU A OE2 3921 N N . ASP A 522 ? 0.4705 0.3855 0.2816 0.0461 0.0229 -0.0746 830 ASP A N 3922 C CA . ASP A 522 ? 0.5382 0.4484 0.3392 0.0536 0.0340 -0.0711 830 ASP A CA 3923 C C . ASP A 522 ? 0.5311 0.4441 0.3473 0.0543 0.0448 -0.0677 830 ASP A C 3924 O O . ASP A 522 ? 0.5800 0.4850 0.3896 0.0593 0.0504 -0.0693 830 ASP A O 3925 C CB . ASP A 522 ? 0.6245 0.5185 0.4057 0.0568 0.0273 -0.0805 830 ASP A CB 3926 C CG . ASP A 522 ? 0.6671 0.5519 0.4555 0.0514 0.0190 -0.0912 830 ASP A CG 3927 O OD1 . ASP A 522 ? 0.6102 0.5009 0.4179 0.0447 0.0164 -0.0917 830 ASP A OD1 3928 O OD2 . ASP A 522 ? 0.7271 0.5979 0.5022 0.0540 0.0152 -0.0989 830 ASP A OD2 3929 N N . ALA A 523 ? 0.4355 0.3597 0.2717 0.0498 0.0475 -0.0630 831 ALA A N 3930 C CA . ALA A 523 ? 0.4319 0.3591 0.2843 0.0500 0.0560 -0.0597 831 ALA A CA 3931 C C . ALA A 523 ? 0.3411 0.2849 0.2140 0.0474 0.0623 -0.0493 831 ALA A C 3932 O O . ALA A 523 ? 0.2781 0.2314 0.1566 0.0431 0.0579 -0.0456 831 ALA A O 3933 C CB . ALA A 523 ? 0.4527 0.3692 0.3100 0.0459 0.0498 -0.0691 831 ALA A CB 3934 N N . ILE A 524 ? 0.3006 0.2496 0.1882 0.0489 0.0703 -0.0439 832 ILE A N 3935 C CA . ILE A 524 ? 0.2536 0.2185 0.1634 0.0459 0.0745 -0.0344 832 ILE A CA 3936 C C . ILE A 524 ? 0.2742 0.2429 0.1999 0.0376 0.0666 -0.0363 832 ILE A C 3937 O O . ILE A 524 ? 0.2753 0.2355 0.2027 0.0359 0.0637 -0.0422 832 ILE A O 3938 C CB . ILE A 524 ? 0.2855 0.2551 0.2080 0.0495 0.0822 -0.0282 832 ILE A CB 3939 C CG1 . ILE A 524 ? 0.2723 0.2420 0.1863 0.0555 0.0887 -0.0235 832 ILE A CG1 3940 C CG2 . ILE A 524 ? 0.2607 0.2454 0.2073 0.0455 0.0832 -0.0201 832 ILE A CG2 3941 C CD1 . ILE A 524 ? 0.2839 0.2656 0.2039 0.0543 0.0907 -0.0147 832 ILE A CD1 3942 N N . VAL A 525 ? 0.2193 0.2006 0.1574 0.0322 0.0627 -0.0308 833 VAL A N 3943 C CA . VAL A 525 ? 0.2039 0.1902 0.1579 0.0249 0.0559 -0.0310 833 VAL A CA 3944 C C . VAL A 525 ? 0.2169 0.2141 0.1890 0.0244 0.0600 -0.0230 833 VAL A C 3945 O O . VAL A 525 ? 0.2078 0.2151 0.1861 0.0241 0.0615 -0.0164 833 VAL A O 3946 C CB . VAL A 525 ? 0.2028 0.1938 0.1572 0.0193 0.0473 -0.0317 833 VAL A CB 3947 C CG1 . VAL A 525 ? 0.2140 0.2108 0.1850 0.0131 0.0425 -0.0304 833 VAL A CG1 3948 C CG2 . VAL A 525 ? 0.2322 0.2127 0.1705 0.0194 0.0407 -0.0403 833 VAL A CG2 3949 N N . TYR A 526 ? 0.1957 0.1900 0.1759 0.0244 0.0613 -0.0235 834 TYR A N 3950 C CA . TYR A 526 ? 0.1353 0.1389 0.1315 0.0237 0.0625 -0.0168 834 TYR A CA 3951 C C . TYR A 526 ? 0.2040 0.2097 0.2071 0.0176 0.0553 -0.0173 834 TYR A C 3952 O O . TYR A 526 ? 0.2197 0.2178 0.2201 0.0149 0.0522 -0.0226 834 TYR A O 3953 C CB . TYR A 526 ? 0.1551 0.1539 0.1555 0.0282 0.0679 -0.0162 834 TYR A CB 3954 C CG . TYR A 526 ? 0.1676 0.1650 0.1635 0.0356 0.0766 -0.0146 834 TYR A CG 3955 C CD1 . TYR A 526 ? 0.1512 0.1604 0.1577 0.0376 0.0791 -0.0065 834 TYR A CD1 3956 C CD2 . TYR A 526 ? 0.2151 0.1988 0.1967 0.0399 0.0801 -0.0210 834 TYR A CD2 3957 C CE1 . TYR A 526 ? 0.1578 0.1665 0.1621 0.0428 0.0844 -0.0040 834 TYR A CE1 3958 C CE2 . TYR A 526 ? 0.2336 0.2165 0.2109 0.0457 0.0851 -0.0186 834 TYR A CE2 3959 C CZ . TYR A 526 ? 0.2120 0.2077 0.2013 0.0471 0.0878 -0.0098 834 TYR A CZ 3960 O OH . TYR A 526 ? 0.2330 0.2277 0.2196 0.0528 0.0938 -0.0070 834 TYR A OH 3961 N N . CYS A 527 ? 0.2313 0.2468 0.2437 0.0155 0.0529 -0.0119 835 CYS A N 3962 C CA . CYS A 527 ? 0.1664 0.1831 0.1835 0.0110 0.0473 -0.0121 835 CYS A CA 3963 C C . CYS A 527 ? 0.2043 0.2246 0.2304 0.0119 0.0469 -0.0072 835 CYS A C 3964 O O . CYS A 527 ? 0.2165 0.2417 0.2482 0.0150 0.0490 -0.0030 835 CYS A O 3965 C CB . CYS A 527 ? 0.1658 0.1876 0.1812 0.0074 0.0425 -0.0118 835 CYS A CB 3966 S SG . CYS A 527 ? 0.2443 0.2765 0.2663 0.0078 0.0420 -0.0050 835 CYS A SG 3967 N N . ASN A 528 ? 0.1889 0.2067 0.2165 0.0095 0.0443 -0.0078 836 ASN A N 3968 C CA . ASN A 528 ? 0.1822 0.2029 0.2144 0.0104 0.0422 -0.0034 836 ASN A CA 3969 C C . ASN A 528 ? 0.1624 0.1814 0.1933 0.0073 0.0394 -0.0043 836 ASN A C 3970 O O . ASN A 528 ? 0.1484 0.1616 0.1792 0.0058 0.0412 -0.0068 836 ASN A O 3971 C CB . ASN A 528 ? 0.2026 0.2191 0.2372 0.0146 0.0456 -0.0011 836 ASN A CB 3972 C CG . ASN A 528 ? 0.2632 0.2821 0.2997 0.0166 0.0423 0.0035 836 ASN A CG 3973 O OD1 . ASN A 528 ? 0.2538 0.2704 0.2873 0.0154 0.0404 0.0038 836 ASN A OD1 3974 N ND2 . ASN A 528 ? 0.2697 0.2932 0.3112 0.0203 0.0415 0.0070 836 ASN A ND2 3975 N N . PHE A 529 ? 0.1351 0.1588 0.1661 0.0064 0.0353 -0.0024 837 PHE A N 3976 C CA . PHE A 529 ? 0.1589 0.1815 0.1885 0.0043 0.0334 -0.0030 837 PHE A CA 3977 C C . PHE A 529 ? 0.1806 0.2004 0.2082 0.0072 0.0332 0.0003 837 PHE A C 3978 O O . PHE A 529 ? 0.1674 0.1867 0.1926 0.0069 0.0317 0.0008 837 PHE A O 3979 C CB . PHE A 529 ? 0.1885 0.2161 0.2171 0.0019 0.0293 -0.0036 837 PHE A CB 3980 C CG . PHE A 529 ? 0.1782 0.2073 0.2056 -0.0002 0.0294 -0.0066 837 PHE A CG 3981 C CD1 . PHE A 529 ? 0.1864 0.2111 0.2131 -0.0012 0.0314 -0.0103 837 PHE A CD1 3982 C CD2 . PHE A 529 ? 0.2188 0.2523 0.2451 -0.0008 0.0274 -0.0056 837 PHE A CD2 3983 C CE1 . PHE A 529 ? 0.1833 0.2077 0.2056 -0.0022 0.0304 -0.0137 837 PHE A CE1 3984 C CE2 . PHE A 529 ? 0.2170 0.2506 0.2391 -0.0015 0.0279 -0.0078 837 PHE A CE2 3985 C CZ . PHE A 529 ? 0.1872 0.2161 0.2061 -0.0018 0.0289 -0.0122 837 PHE A CZ 3986 N N . ASN A 530 ? 0.1710 0.1883 0.1985 0.0108 0.0348 0.0027 838 ASN A N 3987 C CA . ASN A 530 ? 0.1838 0.1969 0.2064 0.0148 0.0345 0.0060 838 ASN A CA 3988 C C . ASN A 530 ? 0.1887 0.1949 0.2100 0.0155 0.0403 0.0071 838 ASN A C 3989 O O . ASN A 530 ? 0.1501 0.1544 0.1768 0.0127 0.0443 0.0052 838 ASN A O 3990 C CB . ASN A 530 ? 0.2062 0.2192 0.2292 0.0192 0.0332 0.0089 838 ASN A CB 3991 C CG . ASN A 530 ? 0.2652 0.2851 0.2910 0.0192 0.0263 0.0094 838 ASN A CG 3992 O OD1 . ASN A 530 ? 0.3606 0.3804 0.3821 0.0194 0.0208 0.0095 838 ASN A OD1 3993 N ND2 . ASN A 530 ? 0.2255 0.2508 0.2592 0.0192 0.0268 0.0099 838 ASN A ND2 3994 N N . GLN A 531 ? 0.1611 0.1629 0.1753 0.0193 0.0408 0.0103 839 GLN A N 3995 C CA . GLN A 531 ? 0.1372 0.1319 0.1505 0.0214 0.0480 0.0134 839 GLN A CA 3996 C C . GLN A 531 ? 0.1736 0.1643 0.1900 0.0231 0.0516 0.0149 839 GLN A C 3997 O O . GLN A 531 ? 0.1818 0.1739 0.1963 0.0261 0.0482 0.0156 839 GLN A O 3998 C CB . GLN A 531 ? 0.1605 0.1498 0.1617 0.0276 0.0482 0.0174 839 GLN A CB 3999 C CG . GLN A 531 ? 0.1750 0.1662 0.1716 0.0272 0.0455 0.0159 839 GLN A CG 4000 C CD . GLN A 531 ? 0.2199 0.2030 0.2017 0.0345 0.0473 0.0196 839 GLN A CD 4001 O OE1 . GLN A 531 ? 0.2157 0.1932 0.1959 0.0373 0.0559 0.0238 839 GLN A OE1 4002 N NE2 . GLN A 531 ? 0.2218 0.2033 0.1925 0.0379 0.0392 0.0183 839 GLN A NE2 4003 N N . LEU A 532 ? 0.1578 0.1435 0.1805 0.0212 0.0582 0.0155 840 LEU A N 4004 C CA . LEU A 532 ? 0.1646 0.1448 0.1911 0.0222 0.0619 0.0161 840 LEU A CA 4005 C C . LEU A 532 ? 0.1982 0.1726 0.2171 0.0297 0.0637 0.0219 840 LEU A C 4006 O O . LEU A 532 ? 0.1838 0.1550 0.2048 0.0320 0.0652 0.0226 840 LEU A O 4007 C CB . LEU A 532 ? 0.2128 0.1874 0.2488 0.0181 0.0681 0.0156 840 LEU A CB 4008 C CG . LEU A 532 ? 0.2059 0.1855 0.2501 0.0109 0.0650 0.0093 840 LEU A CG 4009 C CD1 . LEU A 532 ? 0.1346 0.1082 0.1906 0.0065 0.0698 0.0089 840 LEU A CD1 4010 C CD2 . LEU A 532 ? 0.2129 0.1958 0.2555 0.0097 0.0601 0.0039 840 LEU A CD2 4011 N N . TYR A 533 ? 0.1711 0.1435 0.1801 0.0344 0.0633 0.0260 841 TYR A N 4012 C CA . TYR A 533 ? 0.2096 0.1753 0.2086 0.0425 0.0642 0.0318 841 TYR A CA 4013 C C . TYR A 533 ? 0.1961 0.1667 0.1946 0.0454 0.0566 0.0308 841 TYR A C 4014 O O . TYR A 533 ? 0.2350 0.2011 0.2296 0.0516 0.0570 0.0350 841 TYR A O 4015 C CB . TYR A 533 ? 0.2578 0.2190 0.2426 0.0479 0.0646 0.0357 841 TYR A CB 4016 C CG . TYR A 533 ? 0.2580 0.2242 0.2338 0.0496 0.0542 0.0328 841 TYR A CG 4017 C CD1 . TYR A 533 ? 0.2619 0.2277 0.2297 0.0553 0.0465 0.0341 841 TYR A CD1 4018 C CD2 . TYR A 533 ? 0.2816 0.2525 0.2578 0.0454 0.0516 0.0290 841 TYR A CD2 4019 C CE1 . TYR A 533 ? 0.2372 0.2067 0.1988 0.0561 0.0360 0.0311 841 TYR A CE1 4020 C CE2 . TYR A 533 ? 0.2548 0.2287 0.2235 0.0466 0.0420 0.0262 841 TYR A CE2 4021 C CZ . TYR A 533 ? 0.2879 0.2608 0.2496 0.0516 0.0339 0.0271 841 TYR A CZ 4022 O OH . TYR A 533 ? 0.3356 0.3106 0.2916 0.0522 0.0232 0.0240 841 TYR A OH 4023 N N . LYS A 534 ? 0.1788 0.1590 0.1824 0.0410 0.0501 0.0260 842 LYS A N 4024 C CA . LYS A 534 ? 0.1947 0.1817 0.2018 0.0430 0.0432 0.0256 842 LYS A CA 4025 C C . LYS A 534 ? 0.2219 0.2094 0.2385 0.0432 0.0473 0.0254 842 LYS A C 4026 O O . LYS A 534 ? 0.2152 0.2079 0.2364 0.0462 0.0435 0.0266 842 LYS A O 4027 C CB . LYS A 534 ? 0.1673 0.1639 0.1782 0.0381 0.0363 0.0215 842 LYS A CB 4028 C CG . LYS A 534 ? 0.1795 0.1747 0.1805 0.0387 0.0314 0.0211 842 LYS A CG 4029 C CD . LYS A 534 ? 0.1650 0.1690 0.1710 0.0348 0.0233 0.0179 842 LYS A CD 4030 C CE . LYS A 534 ? 0.1782 0.1787 0.1731 0.0360 0.0175 0.0170 842 LYS A CE 4031 N NZ . LYS A 534 ? 0.1847 0.1925 0.1858 0.0312 0.0105 0.0138 842 LYS A NZ 4032 N N . ILE A 535 ? 0.2174 0.1991 0.2375 0.0401 0.0547 0.0237 843 ILE A N 4033 C CA . ILE A 535 ? 0.2168 0.1956 0.2435 0.0409 0.0593 0.0228 843 ILE A CA 4034 C C . ILE A 535 ? 0.2505 0.2195 0.2745 0.0473 0.0640 0.0283 843 ILE A C 4035 O O . ILE A 535 ? 0.2277 0.1893 0.2457 0.0489 0.0672 0.0320 843 ILE A O 4036 C CB . ILE A 535 ? 0.2115 0.1864 0.2426 0.0344 0.0637 0.0173 843 ILE A CB 4037 C CG1 . ILE A 535 ? 0.1990 0.1819 0.2307 0.0285 0.0593 0.0127 843 ILE A CG1 4038 C CG2 . ILE A 535 ? 0.2061 0.1778 0.2416 0.0356 0.0671 0.0147 843 ILE A CG2 4039 C CD1 . ILE A 535 ? 0.2281 0.2074 0.2634 0.0224 0.0617 0.0074 843 ILE A CD1 4040 N N . ASP A 536 ? 0.2231 0.1918 0.2515 0.0516 0.0652 0.0294 844 ASP A N 4041 C CA . ASP A 536 ? 0.2606 0.2188 0.2873 0.0579 0.0704 0.0347 844 ASP A CA 4042 C C . ASP A 536 ? 0.2076 0.1602 0.2411 0.0579 0.0763 0.0317 844 ASP A C 4043 O O . ASP A 536 ? 0.2015 0.1591 0.2393 0.0539 0.0757 0.0259 844 ASP A O 4044 C CB . ASP A 536 ? 0.2890 0.2509 0.3119 0.0662 0.0648 0.0407 844 ASP A CB 4045 C CG . ASP A 536 ? 0.3028 0.2772 0.3347 0.0676 0.0592 0.0394 844 ASP A CG 4046 O OD1 . ASP A 536 ? 0.3026 0.2813 0.3420 0.0634 0.0615 0.0346 844 ASP A OD1 4047 O OD2 . ASP A 536 ? 0.3103 0.2899 0.3420 0.0733 0.0524 0.0436 844 ASP A OD2 4048 N N . PRO A 537 ? 0.2052 0.1459 0.2384 0.0627 0.0823 0.0357 845 PRO A N 4049 C CA . PRO A 537 ? 0.2497 0.1832 0.2877 0.0626 0.0873 0.0320 845 PRO A CA 4050 C C . PRO A 537 ? 0.2614 0.2047 0.3035 0.0648 0.0847 0.0296 845 PRO A C 4051 O O . PRO A 537 ? 0.2828 0.2240 0.3262 0.0616 0.0868 0.0234 845 PRO A O 4052 C CB . PRO A 537 ? 0.2870 0.2101 0.3224 0.0673 0.0912 0.0384 845 PRO A CB 4053 C CG . PRO A 537 ? 0.2743 0.1932 0.3042 0.0673 0.0924 0.0435 845 PRO A CG 4054 C CD . PRO A 537 ? 0.2185 0.1495 0.2454 0.0672 0.0856 0.0430 845 PRO A CD 4055 N N . SER A 538 ? 0.2467 0.2003 0.2910 0.0704 0.0799 0.0346 846 SER A N 4056 C CA A SER A 538 ? 0.2519 0.2163 0.3032 0.0726 0.0781 0.0338 846 SER A CA 4057 C CA B SER A 538 ? 0.2544 0.2189 0.3057 0.0726 0.0780 0.0338 846 SER A CA 4058 C CA C SER A 538 ? 0.2538 0.2184 0.3051 0.0726 0.0779 0.0339 846 SER A CA 4059 C C . SER A 538 ? 0.2331 0.2063 0.2868 0.0670 0.0767 0.0281 846 SER A C 4060 O O . SER A 538 ? 0.2279 0.2037 0.2839 0.0665 0.0789 0.0250 846 SER A O 4061 C CB A SER A 538 ? 0.2670 0.2419 0.3232 0.0790 0.0717 0.0405 846 SER A CB 4062 C CB B SER A 538 ? 0.2661 0.2414 0.3223 0.0789 0.0715 0.0405 846 SER A CB 4063 C CB C SER A 538 ? 0.2681 0.2436 0.3242 0.0788 0.0712 0.0405 846 SER A CB 4064 O OG A SER A 538 ? 0.2591 0.2412 0.3139 0.0782 0.0650 0.0418 846 SER A OG 4065 O OG B SER A 538 ? 0.2745 0.2611 0.3408 0.0806 0.0702 0.0407 846 SER A OG 4066 O OG C SER A 538 ? 0.2709 0.2599 0.3374 0.0795 0.0688 0.0403 846 SER A OG 4067 N N . THR A 539 ? 0.2116 0.1888 0.2625 0.0623 0.0726 0.0269 847 THR A N 4068 C CA . THR A 539 ? 0.2101 0.1954 0.2617 0.0559 0.0702 0.0219 847 THR A CA 4069 C C . THR A 539 ? 0.2042 0.1805 0.2515 0.0516 0.0753 0.0149 847 THR A C 4070 O O . THR A 539 ? 0.2035 0.1834 0.2513 0.0509 0.0769 0.0113 847 THR A O 4071 C CB . THR A 539 ? 0.1972 0.1880 0.2451 0.0511 0.0632 0.0222 847 THR A CB 4072 O OG1 . THR A 539 ? 0.2362 0.2349 0.2869 0.0552 0.0566 0.0275 847 THR A OG1 4073 C CG2 . THR A 539 ? 0.1668 0.1649 0.2152 0.0448 0.0610 0.0175 847 THR A CG2 4074 N N . LEU A 540 ? 0.2034 0.1673 0.2465 0.0490 0.0778 0.0131 848 LEU A N 4075 C CA . LEU A 540 ? 0.2191 0.1739 0.2592 0.0443 0.0805 0.0056 848 LEU A CA 4076 C C . LEU A 540 ? 0.2307 0.1784 0.2695 0.0489 0.0854 0.0029 848 LEU A C 4077 O O . LEU A 540 ? 0.2245 0.1690 0.2586 0.0469 0.0860 -0.0037 848 LEU A O 4078 C CB . LEU A 540 ? 0.2363 0.1796 0.2763 0.0402 0.0820 0.0050 848 LEU A CB 4079 C CG . LEU A 540 ? 0.2599 0.1944 0.2988 0.0339 0.0821 -0.0033 848 LEU A CG 4080 C CD1 . LEU A 540 ? 0.2209 0.1654 0.2575 0.0284 0.0765 -0.0077 848 LEU A CD1 4081 C CD2 . LEU A 540 ? 0.2942 0.2180 0.3379 0.0297 0.0841 -0.0026 848 LEU A CD2 4082 N N . GLN A 541 ? 0.2371 0.1828 0.2781 0.0546 0.0872 0.0083 849 GLN A N 4083 C CA . GLN A 541 ? 0.2481 0.1882 0.2872 0.0587 0.0907 0.0066 849 GLN A CA 4084 C C . GLN A 541 ? 0.2408 0.1925 0.2802 0.0602 0.0900 0.0058 849 GLN A C 4085 O O . GLN A 541 ? 0.2351 0.1815 0.2686 0.0611 0.0928 0.0008 849 GLN A O 4086 C CB . GLN A 541 ? 0.2965 0.2340 0.3390 0.0649 0.0925 0.0135 849 GLN A CB 4087 C CG . GLN A 541 ? 0.3925 0.3254 0.4339 0.0699 0.0965 0.0126 849 GLN A CG 4088 C CD . GLN A 541 ? 0.4789 0.3943 0.5133 0.0680 0.1001 0.0053 849 GLN A CD 4089 O OE1 . GLN A 541 ? 0.5026 0.4061 0.5368 0.0659 0.1012 0.0052 849 GLN A OE1 4090 N NE2 . GLN A 541 ? 0.5139 0.4270 0.5423 0.0689 0.1016 -0.0007 849 GLN A NE2 4091 N N . MET A 542 ? 0.2263 0.1933 0.2725 0.0607 0.0863 0.0108 850 MET A N 4092 C CA A MET A 542 ? 0.2285 0.2077 0.2778 0.0611 0.0857 0.0114 850 MET A CA 4093 C CA B MET A 542 ? 0.2285 0.2077 0.2779 0.0611 0.0857 0.0114 850 MET A CA 4094 C C . MET A 542 ? 0.2193 0.1963 0.2602 0.0563 0.0860 0.0045 850 MET A C 4095 O O . MET A 542 ? 0.2110 0.1883 0.2476 0.0580 0.0888 0.0023 850 MET A O 4096 C CB A MET A 542 ? 0.2210 0.2158 0.2805 0.0608 0.0803 0.0172 850 MET A CB 4097 C CB B MET A 542 ? 0.2213 0.2161 0.2809 0.0609 0.0803 0.0174 850 MET A CB 4098 C CG A MET A 542 ? 0.1995 0.2014 0.2695 0.0667 0.0790 0.0243 850 MET A CG 4099 C CG B MET A 542 ? 0.2034 0.2115 0.2721 0.0627 0.0801 0.0209 850 MET A CG 4100 S SD A MET A 542 ? 0.3918 0.4141 0.4764 0.0659 0.0738 0.0291 850 MET A SD 4101 S SD B MET A 542 ? 0.3731 0.3980 0.4575 0.0635 0.0723 0.0282 850 MET A SD 4102 C CE A MET A 542 ? 0.3486 0.3746 0.4313 0.0606 0.0671 0.0279 850 MET A CE 4103 C CE B MET A 542 ? 0.1413 0.1575 0.2216 0.0666 0.0695 0.0303 850 MET A CE 4104 N N . TRP A 543 ? 0.2131 0.1876 0.2513 0.0510 0.0832 0.0014 851 TRP A N 4105 C CA . TRP A 543 ? 0.2005 0.1729 0.2309 0.0465 0.0825 -0.0052 851 TRP A CA 4106 C C . TRP A 543 ? 0.2291 0.1860 0.2491 0.0474 0.0857 -0.0126 851 TRP A C 4107 O O . TRP A 543 ? 0.2644 0.2197 0.2754 0.0473 0.0862 -0.0174 851 TRP A O 4108 C CB . TRP A 543 ? 0.2089 0.1823 0.2400 0.0401 0.0778 -0.0064 851 TRP A CB 4109 C CG . TRP A 543 ? 0.1782 0.1660 0.2158 0.0385 0.0728 -0.0008 851 TRP A CG 4110 C CD1 . TRP A 543 ? 0.1460 0.1459 0.1908 0.0417 0.0727 0.0043 851 TRP A CD1 4111 C CD2 . TRP A 543 ? 0.1847 0.1755 0.2227 0.0333 0.0671 0.0002 851 TRP A CD2 4112 N NE1 . TRP A 543 ? 0.1564 0.1655 0.2053 0.0384 0.0660 0.0075 851 TRP A NE1 4113 C CE2 . TRP A 543 ? 0.1607 0.1639 0.2041 0.0338 0.0629 0.0050 851 TRP A CE2 4114 C CE3 . TRP A 543 ? 0.2020 0.1859 0.2373 0.0286 0.0655 -0.0024 851 TRP A CE3 4115 C CZ2 . TRP A 543 ? 0.1442 0.1514 0.1872 0.0302 0.0570 0.0065 851 TRP A CZ2 4116 C CZ3 . TRP A 543 ? 0.2163 0.2057 0.2525 0.0255 0.0610 0.0001 851 TRP A CZ3 4117 C CH2 . TRP A 543 ? 0.1828 0.1829 0.2213 0.0267 0.0567 0.0041 851 TRP A CH2 4118 N N . ALA A 544 ? 0.2680 0.2127 0.2884 0.0487 0.0877 -0.0134 852 ALA A N 4119 C CA . ALA A 544 ? 0.2733 0.2017 0.2846 0.0497 0.0898 -0.0207 852 ALA A CA 4120 C C . ALA A 544 ? 0.3009 0.2299 0.3065 0.0561 0.0935 -0.0204 852 ALA A C 4121 O O . ALA A 544 ? 0.3011 0.2205 0.2947 0.0572 0.0941 -0.0275 852 ALA A O 4122 C CB . ALA A 544 ? 0.2955 0.2111 0.3108 0.0495 0.0913 -0.0201 852 ALA A CB 4123 N N . ASN A 545 ? 0.2314 0.1711 0.2456 0.0606 0.0955 -0.0122 853 ASN A N 4124 C CA . ASN A 545 ? 0.2888 0.2310 0.3009 0.0668 0.0999 -0.0103 853 ASN A CA 4125 C C . ASN A 545 ? 0.2701 0.2191 0.2757 0.0663 0.1002 -0.0121 853 ASN A C 4126 O O . ASN A 545 ? 0.2623 0.2061 0.2585 0.0706 0.1042 -0.0148 853 ASN A O 4127 C CB . ASN A 545 ? 0.2442 0.1985 0.2703 0.0707 0.1010 -0.0008 853 ASN A CB 4128 C CG . ASN A 545 ? 0.3211 0.2667 0.3506 0.0738 0.1024 0.0015 853 ASN A CG 4129 O OD1 . ASN A 545 ? 0.3268 0.2565 0.3487 0.0735 0.1039 -0.0039 853 ASN A OD1 4130 N ND2 . ASN A 545 ? 0.2940 0.2497 0.3353 0.0769 0.1016 0.0096 853 ASN A ND2 4131 N N . ILE A 546 ? 0.2403 0.2003 0.2503 0.0614 0.0962 -0.0104 854 ILE A N 4132 C CA . ILE A 546 ? 0.2281 0.1952 0.2327 0.0604 0.0962 -0.0109 854 ILE A CA 4133 C C . ILE A 546 ? 0.2694 0.2234 0.2563 0.0591 0.0953 -0.0205 854 ILE A C 4134 O O . ILE A 546 ? 0.3014 0.2527 0.2771 0.0626 0.0981 -0.0225 854 ILE A O 4135 C CB . ILE A 546 ? 0.2225 0.2039 0.2371 0.0552 0.0915 -0.0065 854 ILE A CB 4136 C CG1 . ILE A 546 ? 0.1894 0.1840 0.2207 0.0571 0.0912 0.0025 854 ILE A CG1 4137 C CG2 . ILE A 546 ? 0.2510 0.2373 0.2586 0.0535 0.0913 -0.0076 854 ILE A CG2 4138 C CD1 . ILE A 546 ? 0.1534 0.1588 0.1950 0.0523 0.0852 0.0060 854 ILE A CD1 4139 N N . LEU A 547 ? 0.2146 0.1598 0.1991 0.0544 0.0912 -0.0263 855 LEU A N 4140 C CA . LEU A 547 ? 0.2606 0.1920 0.2295 0.0525 0.0883 -0.0364 855 LEU A CA 4141 C C . LEU A 547 ? 0.2723 0.1889 0.2284 0.0580 0.0908 -0.0421 855 LEU A C 4142 O O . LEU A 547 ? 0.2898 0.1992 0.2298 0.0595 0.0894 -0.0485 855 LEU A O 4143 C CB . LEU A 547 ? 0.2583 0.1819 0.2317 0.0459 0.0837 -0.0411 855 LEU A CB 4144 C CG . LEU A 547 ? 0.3179 0.2549 0.3010 0.0397 0.0798 -0.0372 855 LEU A CG 4145 C CD1 . LEU A 547 ? 0.3129 0.2452 0.3033 0.0321 0.0736 -0.0396 855 LEU A CD1 4146 C CD2 . LEU A 547 ? 0.2949 0.2380 0.2687 0.0381 0.0765 -0.0391 855 LEU A CD2 4147 N N . LYS A 548 ? 0.2686 0.1802 0.2308 0.0612 0.0942 -0.0398 856 LYS A N 4148 C CA . LYS A 548 ? 0.3571 0.2547 0.3081 0.0670 0.0972 -0.0447 856 LYS A CA 4149 C C . LYS A 548 ? 0.3474 0.2506 0.2909 0.0736 0.1028 -0.0416 856 LYS A C 4150 O O . LYS A 548 ? 0.3756 0.2668 0.3033 0.0779 0.1041 -0.0478 856 LYS A O 4151 C CB . LYS A 548 ? 0.3787 0.2711 0.3394 0.0694 0.1003 -0.0414 856 LYS A CB 4152 C CG . LYS A 548 ? 0.4426 0.3245 0.4088 0.0637 0.0961 -0.0448 856 LYS A CG 4153 C CD . LYS A 548 ? 0.5195 0.3996 0.4965 0.0666 0.1000 -0.0386 856 LYS A CD 4154 C CE . LYS A 548 ? 0.5936 0.4637 0.5775 0.0608 0.0971 -0.0402 856 LYS A CE 4155 N NZ . LYS A 548 ? 0.6632 0.5146 0.6376 0.0576 0.0928 -0.0515 856 LYS A NZ 4156 N N . ARG A 549 ? 0.3024 0.2233 0.2578 0.0743 0.1058 -0.0319 857 ARG A N 4157 C CA . ARG A 549 ? 0.3199 0.2469 0.2717 0.0801 0.1121 -0.0272 857 ARG A CA 4158 C C . ARG A 549 ? 0.3105 0.2395 0.2498 0.0789 0.1107 -0.0294 857 ARG A C 4159 O O . ARG A 549 ? 0.3190 0.2485 0.2504 0.0840 0.1162 -0.0271 857 ARG A O 4160 C CB . ARG A 549 ? 0.2979 0.2425 0.2698 0.0810 0.1153 -0.0156 857 ARG A CB 4161 C CG . ARG A 549 ? 0.3217 0.2644 0.3032 0.0855 0.1190 -0.0118 857 ARG A CG 4162 C CD . ARG A 549 ? 0.3256 0.2862 0.3269 0.0864 0.1208 -0.0009 857 ARG A CD 4163 N NE . ARG A 549 ? 0.3578 0.3258 0.3585 0.0894 0.1260 0.0035 857 ARG A NE 4164 C CZ . ARG A 549 ? 0.4171 0.4008 0.4351 0.0898 0.1277 0.0127 857 ARG A CZ 4165 N NH1 . ARG A 549 ? 0.3654 0.3593 0.4015 0.0876 0.1236 0.0179 857 ARG A NH1 4166 N NH2 . ARG A 549 ? 0.4493 0.4378 0.4664 0.0926 0.1334 0.0169 857 ARG A NH2 4167 N N . VAL A 550 ? 0.3016 0.2313 0.2391 0.0724 0.1038 -0.0334 858 VAL A N 4168 C CA . VAL A 550 ? 0.3288 0.2603 0.2542 0.0710 0.1015 -0.0355 858 VAL A CA 4169 C C . VAL A 550 ? 0.3708 0.2874 0.2814 0.0677 0.0939 -0.0472 858 VAL A C 4170 O O . VAL A 550 ? 0.3728 0.2920 0.2876 0.0613 0.0878 -0.0493 858 VAL A O 4171 C CB . VAL A 550 ? 0.3251 0.2741 0.2648 0.0656 0.0995 -0.0282 858 VAL A CB 4172 C CG1 . VAL A 550 ? 0.2574 0.2083 0.1846 0.0648 0.0978 -0.0290 858 VAL A CG1 4173 C CG2 . VAL A 550 ? 0.2757 0.2391 0.2343 0.0675 0.1045 -0.0173 858 VAL A CG2 4174 N N . PRO A 551 ? 0.4407 0.3411 0.3348 0.0719 0.0937 -0.0551 859 PRO A N 4175 C CA . PRO A 551 ? 0.5059 0.3903 0.3883 0.0683 0.0847 -0.0673 859 PRO A CA 4176 C C . PRO A 551 ? 0.5220 0.4090 0.3972 0.0632 0.0769 -0.0708 859 PRO A C 4177 O O . PRO A 551 ? 0.5284 0.4091 0.4055 0.0568 0.0684 -0.0776 859 PRO A O 4178 C CB . PRO A 551 ? 0.5455 0.4146 0.4088 0.0751 0.0864 -0.0736 859 PRO A CB 4179 C CG . PRO A 551 ? 0.5390 0.4173 0.4001 0.0822 0.0966 -0.0643 859 PRO A CG 4180 C CD . PRO A 551 ? 0.5019 0.3978 0.3869 0.0802 0.1014 -0.0531 859 PRO A CD 4181 N N . ASN A 552 ? 0.4841 0.3801 0.3524 0.0658 0.0798 -0.0654 860 ASN A N 4182 C CA . ASN A 552 ? 0.5054 0.4043 0.3661 0.0617 0.0727 -0.0676 860 ASN A CA 4183 C C . ASN A 552 ? 0.4531 0.3680 0.3317 0.0563 0.0729 -0.0602 860 ASN A C 4184 O O . ASN A 552 ? 0.4468 0.3735 0.3267 0.0570 0.0760 -0.0528 860 ASN A O 4185 C CB . ASN A 552 ? 0.6096 0.5083 0.4523 0.0674 0.0755 -0.0653 860 ASN A CB 4186 C CG . ASN A 552 ? 0.6776 0.5723 0.5055 0.0645 0.0655 -0.0711 860 ASN A CG 4187 O OD1 . ASN A 552 ? 0.7207 0.6077 0.5475 0.0590 0.0550 -0.0802 860 ASN A OD1 4188 N ND2 . ASN A 552 ? 0.7013 0.6012 0.5192 0.0679 0.0683 -0.0654 860 ASN A ND2 4189 N N . SER A 553 ? 0.3647 0.2791 0.2574 0.0508 0.0701 -0.0620 861 SER A N 4190 C CA . SER A 553 ? 0.3063 0.2346 0.2160 0.0456 0.0705 -0.0554 861 SER A CA 4191 C C . SER A 553 ? 0.3068 0.2342 0.2312 0.0370 0.0626 -0.0583 861 SER A C 4192 O O . SER A 553 ? 0.3217 0.2362 0.2463 0.0364 0.0613 -0.0642 861 SER A O 4193 C CB . SER A 553 ? 0.2658 0.2083 0.1925 0.0482 0.0785 -0.0442 861 SER A CB 4194 O OG . SER A 553 ? 0.2808 0.2185 0.2170 0.0491 0.0809 -0.0442 861 SER A OG 4195 N N . VAL A 554 ? 0.2517 0.1929 0.1895 0.0304 0.0578 -0.0534 862 VAL A N 4196 C CA . VAL A 554 ? 0.2471 0.1901 0.2008 0.0228 0.0519 -0.0538 862 VAL A CA 4197 C C . VAL A 554 ? 0.2411 0.1992 0.2116 0.0208 0.0545 -0.0441 862 VAL A C 4198 O O . VAL A 554 ? 0.2351 0.2038 0.2064 0.0232 0.0577 -0.0380 862 VAL A O 4199 C CB . VAL A 554 ? 0.2595 0.2017 0.2118 0.0163 0.0411 -0.0594 862 VAL A CB 4200 C CG1 . VAL A 554 ? 0.2855 0.2110 0.2210 0.0179 0.0360 -0.0703 862 VAL A CG1 4201 C CG2 . VAL A 554 ? 0.2620 0.2167 0.2120 0.0156 0.0388 -0.0549 862 VAL A CG2 4202 N N . LEU A 555 ? 0.2389 0.1969 0.2226 0.0168 0.0532 -0.0427 863 LEU A N 4203 C CA . LEU A 555 ? 0.2323 0.2024 0.2290 0.0151 0.0540 -0.0346 863 LEU A CA 4204 C C . LEU A 555 ? 0.2419 0.2166 0.2447 0.0084 0.0472 -0.0352 863 LEU A C 4205 O O . LEU A 555 ? 0.2256 0.1932 0.2313 0.0044 0.0437 -0.0400 863 LEU A O 4206 C CB . LEU A 555 ? 0.2401 0.2065 0.2451 0.0173 0.0587 -0.0311 863 LEU A CB 4207 C CG . LEU A 555 ? 0.2185 0.1948 0.2344 0.0165 0.0587 -0.0234 863 LEU A CG 4208 C CD1 . LEU A 555 ? 0.2290 0.2173 0.2463 0.0196 0.0599 -0.0177 863 LEU A CD1 4209 C CD2 . LEU A 555 ? 0.2605 0.2299 0.2822 0.0188 0.0627 -0.0207 863 LEU A CD2 4210 N N . TRP A 556 ? 0.1913 0.1776 0.1973 0.0072 0.0455 -0.0303 864 TRP A N 4211 C CA . TRP A 556 ? 0.1850 0.1765 0.1961 0.0020 0.0397 -0.0303 864 TRP A CA 4212 C C . TRP A 556 ? 0.1977 0.1946 0.2187 0.0012 0.0411 -0.0242 864 TRP A C 4213 O O . TRP A 556 ? 0.1801 0.1836 0.2018 0.0036 0.0425 -0.0191 864 TRP A O 4214 C CB . TRP A 556 ? 0.1842 0.1827 0.1888 0.0021 0.0368 -0.0296 864 TRP A CB 4215 C CG . TRP A 556 ? 0.1867 0.1901 0.1948 -0.0023 0.0305 -0.0302 864 TRP A CG 4216 C CD1 . TRP A 556 ? 0.1992 0.2014 0.2159 -0.0065 0.0272 -0.0322 864 TRP A CD1 4217 C CD2 . TRP A 556 ? 0.1559 0.1663 0.1604 -0.0025 0.0275 -0.0281 864 TRP A CD2 4218 N NE1 . TRP A 556 ? 0.1826 0.1913 0.2013 -0.0089 0.0221 -0.0316 864 TRP A NE1 4219 C CE2 . TRP A 556 ? 0.1742 0.1874 0.1848 -0.0065 0.0220 -0.0293 864 TRP A CE2 4220 C CE3 . TRP A 556 ? 0.2114 0.2258 0.2094 0.0003 0.0294 -0.0248 864 TRP A CE3 4221 C CZ2 . TRP A 556 ? 0.1755 0.1946 0.1843 -0.0071 0.0181 -0.0277 864 TRP A CZ2 4222 C CZ3 . TRP A 556 ? 0.2377 0.2575 0.2341 -0.0009 0.0256 -0.0229 864 TRP A CZ3 4223 C CH2 . TRP A 556 ? 0.1838 0.2056 0.1849 -0.0044 0.0198 -0.0246 864 TRP A CH2 4224 N N . LEU A 557 ? 0.1781 0.1715 0.2067 -0.0018 0.0409 -0.0244 865 LEU A N 4225 C CA . LEU A 557 ? 0.1805 0.1767 0.2155 -0.0013 0.0431 -0.0185 865 LEU A CA 4226 C C . LEU A 557 ? 0.1806 0.1800 0.2223 -0.0054 0.0406 -0.0181 865 LEU A C 4227 O O . LEU A 557 ? 0.1696 0.1689 0.2140 -0.0091 0.0366 -0.0225 865 LEU A O 4228 C CB . LEU A 557 ? 0.1913 0.1792 0.2297 0.0007 0.0484 -0.0166 865 LEU A CB 4229 C CG . LEU A 557 ? 0.1892 0.1725 0.2234 0.0055 0.0520 -0.0167 865 LEU A CG 4230 C CD1 . LEU A 557 ? 0.1749 0.1485 0.2134 0.0070 0.0569 -0.0148 865 LEU A CD1 4231 C CD2 . LEU A 557 ? 0.1987 0.1902 0.2307 0.0097 0.0522 -0.0117 865 LEU A CD2 4232 N N . LEU A 558 ? 0.1610 0.1630 0.2053 -0.0040 0.0428 -0.0127 866 LEU A N 4233 C CA . LEU A 558 ? 0.1595 0.1650 0.2103 -0.0065 0.0420 -0.0113 866 LEU A CA 4234 C C . LEU A 558 ? 0.1872 0.1874 0.2463 -0.0067 0.0478 -0.0079 866 LEU A C 4235 O O . LEU A 558 ? 0.2046 0.1990 0.2614 -0.0035 0.0524 -0.0048 866 LEU A O 4236 C CB . LEU A 558 ? 0.1577 0.1690 0.2032 -0.0040 0.0406 -0.0077 866 LEU A CB 4237 C CG . LEU A 558 ? 0.1875 0.2040 0.2266 -0.0039 0.0357 -0.0095 866 LEU A CG 4238 C CD1 . LEU A 558 ? 0.1826 0.2031 0.2182 -0.0021 0.0337 -0.0064 866 LEU A CD1 4239 C CD2 . LEU A 558 ? 0.1595 0.1780 0.2001 -0.0075 0.0316 -0.0144 866 LEU A CD2 4240 N N . ARG A 559 ? 0.1629 0.1654 0.2327 -0.0103 0.0477 -0.0079 867 ARG A N 4241 C CA . ARG A 559 ? 0.1764 0.1752 0.2565 -0.0105 0.0546 -0.0030 867 ARG A CA 4242 C C . ARG A 559 ? 0.1708 0.1713 0.2440 -0.0050 0.0591 0.0035 867 ARG A C 4243 O O . ARG A 559 ? 0.1512 0.1566 0.2282 -0.0050 0.0598 0.0056 867 ARG A O 4244 C CB . ARG A 559 ? 0.1957 0.1979 0.2930 -0.0163 0.0528 -0.0049 867 ARG A CB 4245 C CG . ARG A 559 ? 0.2229 0.2219 0.3246 -0.0214 0.0462 -0.0128 867 ARG A CG 4246 C CD . ARG A 559 ? 0.2350 0.2361 0.3572 -0.0277 0.0439 -0.0144 867 ARG A CD 4247 N NE . ARG A 559 ? 0.2796 0.2768 0.4029 -0.0321 0.0350 -0.0233 867 ARG A NE 4248 C CZ . ARG A 559 ? 0.3200 0.3230 0.4430 -0.0344 0.0255 -0.0286 867 ARG A CZ 4249 N NH1 . ARG A 559 ? 0.2849 0.2983 0.4084 -0.0331 0.0242 -0.0256 867 ARG A NH1 4250 N NH2 . ARG A 559 ? 0.3417 0.3390 0.4625 -0.0375 0.0171 -0.0371 867 ARG A NH2 4251 N N . PHE A 560 ? 0.1904 0.1859 0.2525 0.0001 0.0616 0.0066 868 PHE A N 4252 C CA . PHE A 560 ? 0.1579 0.1535 0.2080 0.0062 0.0628 0.0110 868 PHE A CA 4253 C C . PHE A 560 ? 0.1830 0.1701 0.2271 0.0118 0.0692 0.0168 868 PHE A C 4254 O O . PHE A 560 ? 0.1535 0.1387 0.1862 0.0163 0.0666 0.0177 868 PHE A O 4255 C CB . PHE A 560 ? 0.1406 0.1404 0.1809 0.0072 0.0552 0.0077 868 PHE A CB 4256 C CG . PHE A 560 ? 0.1922 0.1946 0.2234 0.0104 0.0522 0.0090 868 PHE A CG 4257 C CD1 . PHE A 560 ? 0.2102 0.2170 0.2362 0.0100 0.0451 0.0062 868 PHE A CD1 4258 C CD2 . PHE A 560 ? 0.1987 0.1984 0.2266 0.0140 0.0568 0.0131 868 PHE A CD2 4259 C CE1 . PHE A 560 ? 0.2016 0.2093 0.2198 0.0125 0.0414 0.0068 868 PHE A CE1 4260 C CE2 . PHE A 560 ? 0.2083 0.2084 0.2259 0.0175 0.0534 0.0133 868 PHE A CE2 4261 C CZ . PHE A 560 ? 0.1986 0.2022 0.2116 0.0164 0.0451 0.0097 868 PHE A CZ 4262 N N . PRO A 561 ? 0.1886 0.1707 0.2410 0.0117 0.0775 0.0214 869 PRO A N 4263 C CA . PRO A 561 ? 0.2082 0.1934 0.2771 0.0068 0.0810 0.0219 869 PRO A CA 4264 C C . PRO A 561 ? 0.2111 0.1947 0.2960 -0.0003 0.0801 0.0178 869 PRO A C 4265 O O . PRO A 561 ? 0.1935 0.1707 0.2754 -0.0001 0.0796 0.0161 869 PRO A O 4266 C CB . PRO A 561 ? 0.2073 0.1856 0.2733 0.0122 0.0893 0.0300 869 PRO A CB 4267 C CG . PRO A 561 ? 0.2105 0.1799 0.2660 0.0174 0.0931 0.0335 869 PRO A CG 4268 C CD . PRO A 561 ? 0.2094 0.1821 0.2552 0.0177 0.0846 0.0279 869 PRO A CD 4269 N N . ALA A 562 ? 0.1681 0.1568 0.2699 -0.0062 0.0793 0.0163 870 ALA A N 4270 C CA . ALA A 562 ? 0.1690 0.1555 0.2866 -0.0134 0.0763 0.0113 870 ALA A CA 4271 C C . ALA A 562 ? 0.1636 0.1389 0.2866 -0.0133 0.0834 0.0148 870 ALA A C 4272 O O . ALA A 562 ? 0.2022 0.1713 0.3280 -0.0167 0.0798 0.0093 870 ALA A O 4273 C CB . ALA A 562 ? 0.1322 0.1259 0.2685 -0.0185 0.0739 0.0106 870 ALA A CB 4274 N N . VAL A 563 ? 0.1989 0.1699 0.3186 -0.0074 0.0913 0.0230 871 VAL A N 4275 C CA . VAL A 563 ? 0.2260 0.1860 0.3496 -0.0059 0.0977 0.0269 871 VAL A CA 4276 C C . VAL A 563 ? 0.2538 0.2054 0.3652 -0.0032 0.0993 0.0265 871 VAL A C 4277 O O . VAL A 563 ? 0.2613 0.2030 0.3757 -0.0022 0.1036 0.0286 871 VAL A O 4278 C CB . VAL A 563 ? 0.2653 0.2224 0.3875 0.0008 0.1058 0.0359 871 VAL A CB 4279 C CG1 . VAL A 563 ? 0.1892 0.1531 0.3289 -0.0027 0.1054 0.0366 871 VAL A CG1 4280 C CG2 . VAL A 563 ? 0.3033 0.2604 0.4035 0.0093 0.1074 0.0402 871 VAL A CG2 4281 N N . GLY A 564 ? 0.2584 0.2151 0.3542 -0.0004 0.0926 0.0224 872 GLY A N 4282 C CA . GLY A 564 ? 0.2393 0.1908 0.3234 0.0032 0.0899 0.0199 872 GLY A CA 4283 C C . GLY A 564 ? 0.2625 0.2118 0.3519 -0.0024 0.0838 0.0107 872 GLY A C 4284 O O . GLY A 564 ? 0.2502 0.1920 0.3345 0.0001 0.0841 0.0089 872 GLY A O 4285 N N . GLU A 565 ? 0.2621 0.2174 0.3603 -0.0089 0.0779 0.0048 873 GLU A N 4286 C CA . GLU A 565 ? 0.2703 0.2228 0.3703 -0.0135 0.0708 -0.0048 873 GLU A CA 4287 C C . GLU A 565 ? 0.2440 0.1825 0.3514 -0.0156 0.0735 -0.0069 873 GLU A C 4288 O O . GLU A 565 ? 0.2694 0.2012 0.3676 -0.0135 0.0713 -0.0120 873 GLU A O 4289 C CB . GLU A 565 ? 0.2820 0.2426 0.3911 -0.0200 0.0633 -0.0102 873 GLU A CB 4290 C CG . GLU A 565 ? 0.3108 0.2661 0.4207 -0.0245 0.0553 -0.0204 873 GLU A CG 4291 C CD . GLU A 565 ? 0.2917 0.2554 0.4078 -0.0297 0.0462 -0.0258 873 GLU A CD 4292 O OE1 . GLU A 565 ? 0.2763 0.2508 0.3975 -0.0299 0.0467 -0.0213 873 GLU A OE1 4293 O OE2 . GLU A 565 ? 0.2644 0.2231 0.3793 -0.0330 0.0383 -0.0346 873 GLU A OE2 4294 N N . PRO A 566 ? 0.2703 0.2038 0.3948 -0.0193 0.0789 -0.0026 874 PRO A N 4295 C CA . PRO A 566 ? 0.2590 0.1775 0.3907 -0.0216 0.0809 -0.0051 874 PRO A CA 4296 C C . PRO A 566 ? 0.2836 0.1926 0.4026 -0.0139 0.0872 -0.0010 874 PRO A C 4297 O O . PRO A 566 ? 0.2997 0.1965 0.4177 -0.0139 0.0866 -0.0058 874 PRO A O 4298 C CB . PRO A 566 ? 0.2663 0.1867 0.4172 -0.0251 0.0850 0.0008 874 PRO A CB 4299 C CG . PRO A 566 ? 0.3074 0.2388 0.4570 -0.0215 0.0899 0.0090 874 PRO A CG 4300 C CD . PRO A 566 ? 0.2825 0.2223 0.4214 -0.0216 0.0839 0.0046 874 PRO A CD 4301 N N . ASN A 567 ? 0.2491 0.1630 0.3583 -0.0068 0.0926 0.0075 875 ASN A N 4302 C CA . ASN A 567 ? 0.2810 0.1871 0.3787 0.0012 0.0973 0.0117 875 ASN A CA 4303 C C . ASN A 567 ? 0.2485 0.1562 0.3332 0.0045 0.0914 0.0048 875 ASN A C 4304 O O . ASN A 567 ? 0.2838 0.1812 0.3657 0.0075 0.0932 0.0029 875 ASN A O 4305 C CB . ASN A 567 ? 0.2682 0.1782 0.3575 0.0084 0.1030 0.0222 875 ASN A CB 4306 C CG . ASN A 567 ? 0.2872 0.1919 0.3868 0.0080 0.1121 0.0308 875 ASN A CG 4307 O OD1 . ASN A 567 ? 0.3179 0.2171 0.4288 0.0046 0.1137 0.0294 875 ASN A OD1 4308 N ND2 . ASN A 567 ? 0.2695 0.1804 0.3629 0.0125 0.1157 0.0380 875 ASN A ND2 4309 N N . ILE A 568 ? 0.2056 0.1262 0.2832 0.0043 0.0851 0.0016 876 ILE A N 4310 C CA . ILE A 568 ? 0.2339 0.1576 0.3010 0.0069 0.0802 -0.0045 876 ILE A CA 4311 C C . ILE A 568 ? 0.2691 0.1827 0.3380 0.0034 0.0775 -0.0137 876 ILE A C 4312 O O . ILE A 568 ? 0.2869 0.1938 0.3485 0.0079 0.0788 -0.0165 876 ILE A O 4313 C CB . ILE A 568 ? 0.2133 0.1516 0.2754 0.0056 0.0740 -0.0064 876 ILE A CB 4314 C CG1 . ILE A 568 ? 0.2673 0.2137 0.3246 0.0102 0.0755 0.0015 876 ILE A CG1 4315 C CG2 . ILE A 568 ? 0.2547 0.1958 0.3075 0.0076 0.0700 -0.0124 876 ILE A CG2 4316 C CD1 . ILE A 568 ? 0.3197 0.2644 0.3697 0.0181 0.0778 0.0060 876 ILE A CD1 4317 N N . GLN A 569 ? 0.2917 0.2033 0.3703 -0.0044 0.0737 -0.0186 877 GLN A N 4318 C CA . GLN A 569 ? 0.3008 0.2012 0.3796 -0.0079 0.0692 -0.0287 877 GLN A CA 4319 C C . GLN A 569 ? 0.3075 0.1905 0.3895 -0.0061 0.0747 -0.0286 877 GLN A C 4320 O O . GLN A 569 ? 0.3491 0.2212 0.4228 -0.0038 0.0732 -0.0358 877 GLN A O 4321 C CB . GLN A 569 ? 0.3207 0.2232 0.4117 -0.0169 0.0622 -0.0339 877 GLN A CB 4322 C CG . GLN A 569 ? 0.3713 0.2878 0.4564 -0.0184 0.0548 -0.0370 877 GLN A CG 4323 C CD . GLN A 569 ? 0.4445 0.3582 0.5129 -0.0158 0.0490 -0.0459 877 GLN A CD 4324 O OE1 . GLN A 569 ? 0.5421 0.4445 0.6012 -0.0115 0.0515 -0.0493 877 GLN A OE1 4325 N NE2 . GLN A 569 ? 0.4082 0.3317 0.4721 -0.0177 0.0419 -0.0493 877 GLN A NE2 4326 N N . GLN A 570 ? 0.2851 0.1643 0.3780 -0.0063 0.0817 -0.0201 878 GLN A N 4327 C CA . GLN A 570 ? 0.3399 0.2050 0.4350 -0.0041 0.0865 -0.0183 878 GLN A CA 4328 C C . GLN A 570 ? 0.3343 0.1963 0.4150 0.0056 0.0903 -0.0166 878 GLN A C 4329 O O . GLN A 570 ? 0.3669 0.2184 0.4426 0.0078 0.0900 -0.0208 878 GLN A O 4330 C CB . GLN A 570 ? 0.3621 0.2282 0.4692 -0.0051 0.0931 -0.0078 878 GLN A CB 4331 C CG . GLN A 570 ? 0.4425 0.2963 0.5518 -0.0033 0.0971 -0.0056 878 GLN A CG 4332 C CD . GLN A 570 ? 0.5327 0.3761 0.6479 -0.0097 0.0903 -0.0156 878 GLN A CD 4333 O OE1 . GLN A 570 ? 0.5984 0.4441 0.7278 -0.0177 0.0860 -0.0179 878 GLN A OE1 4334 N NE2 . GLN A 570 ? 0.5081 0.3401 0.6120 -0.0057 0.0888 -0.0215 878 GLN A NE2 4335 N N . TYR A 571 ? 0.3155 0.1878 0.3897 0.0116 0.0929 -0.0102 879 TYR A N 4336 C CA . TYR A 571 ? 0.3332 0.2062 0.3967 0.0209 0.0957 -0.0073 879 TYR A CA 4337 C C . TYR A 571 ? 0.3265 0.1996 0.3805 0.0229 0.0919 -0.0163 879 TYR A C 4338 O O . TYR A 571 ? 0.3707 0.2396 0.4182 0.0287 0.0938 -0.0164 879 TYR A O 4339 C CB . TYR A 571 ? 0.3181 0.2051 0.3775 0.0260 0.0965 0.0015 879 TYR A CB 4340 C CG . TYR A 571 ? 0.3516 0.2348 0.4154 0.0278 0.1023 0.0116 879 TYR A CG 4341 C CD1 . TYR A 571 ? 0.4291 0.3025 0.4949 0.0295 0.1069 0.0157 879 TYR A CD1 4342 C CD2 . TYR A 571 ? 0.3329 0.2266 0.3960 0.0271 0.1015 0.0172 879 TYR A CD2 4343 C CE1 . TYR A 571 ? 0.4675 0.3395 0.5351 0.0314 0.1123 0.0254 879 TYR A CE1 4344 C CE2 . TYR A 571 ? 0.3581 0.2472 0.4224 0.0300 0.1079 0.0269 879 TYR A CE2 4345 C CZ . TYR A 571 ? 0.4244 0.3042 0.4905 0.0319 0.1130 0.0310 879 TYR A CZ 4346 O OH . TYR A 571 ? 0.4257 0.3041 0.4907 0.0349 0.1189 0.0405 879 TYR A OH 4347 N N . ALA A 572 ? 0.3048 0.1860 0.3564 0.0178 0.0854 -0.0225 880 ALA A N 4348 C CA . ALA A 572 ? 0.3462 0.2268 0.3865 0.0198 0.0822 -0.0309 880 ALA A CA 4349 C C . ALA A 572 ? 0.3687 0.2301 0.4064 0.0189 0.0818 -0.0394 880 ALA A C 4350 O O . ALA A 572 ? 0.3725 0.2292 0.3989 0.0246 0.0825 -0.0429 880 ALA A O 4351 C CB . ALA A 572 ? 0.3167 0.2092 0.3545 0.0145 0.0749 -0.0350 880 ALA A CB 4352 N N . GLN A 573 ? 0.3838 0.2373 0.4320 0.0112 0.0787 -0.0418 881 GLN A N 4353 C CA . GLN A 573 ? 0.4567 0.2943 0.5032 0.0087 0.0749 -0.0494 881 GLN A CA 4354 C C . GLN A 573 ? 0.4690 0.2975 0.5132 0.0152 0.0810 -0.0450 881 GLN A C 4355 O O . GLN A 573 ? 0.4823 0.2986 0.5172 0.0183 0.0794 -0.0515 881 GLN A O 4356 C CB . GLN A 573 ? 0.5299 0.3643 0.5924 -0.0015 0.0699 -0.0511 881 GLN A CB 4357 C CG . GLN A 573 ? 0.6465 0.4640 0.7091 -0.0046 0.0644 -0.0588 881 GLN A CG 4358 C CD . GLN A 573 ? 0.7181 0.5355 0.7985 -0.0151 0.0579 -0.0601 881 GLN A CD 4359 O OE1 . GLN A 573 ? 0.7548 0.5646 0.8470 -0.0182 0.0595 -0.0569 881 GLN A OE1 4360 N NE2 . GLN A 573 ? 0.7220 0.5489 0.8053 -0.0205 0.0505 -0.0643 881 GLN A NE2 4361 N N . ASN A 574 ? 0.4547 0.2889 0.5062 0.0179 0.0877 -0.0339 882 ASN A N 4362 C CA . ASN A 574 ? 0.4813 0.3090 0.5307 0.0247 0.0936 -0.0284 882 ASN A CA 4363 C C . ASN A 574 ? 0.4752 0.3066 0.5116 0.0337 0.0952 -0.0292 882 ASN A C 4364 O O . ASN A 574 ? 0.4950 0.3176 0.5269 0.0392 0.0980 -0.0293 882 ASN A O 4365 C CB . ASN A 574 ? 0.4792 0.3134 0.5366 0.0264 0.0995 -0.0159 882 ASN A CB 4366 C CG . ASN A 574 ? 0.5070 0.3364 0.5781 0.0189 0.1003 -0.0131 882 ASN A CG 4367 O OD1 . ASN A 574 ? 0.4955 0.3175 0.5727 0.0116 0.0955 -0.0204 882 ASN A OD1 4368 N ND2 . ASN A 574 ? 0.5015 0.3358 0.5774 0.0211 0.1061 -0.0021 882 ASN A ND2 4369 N N . MET A 575 ? 0.4471 0.2923 0.4789 0.0352 0.0938 -0.0292 883 MET A N 4370 C CA . MET A 575 ? 0.5006 0.3529 0.5229 0.0432 0.0955 -0.0287 883 MET A CA 4371 C C . MET A 575 ? 0.5347 0.3787 0.5446 0.0442 0.0927 -0.0394 883 MET A C 4372 O O . MET A 575 ? 0.5475 0.3962 0.5493 0.0510 0.0949 -0.0393 883 MET A O 4373 C CB . MET A 575 ? 0.4666 0.3379 0.4901 0.0443 0.0949 -0.0236 883 MET A CB 4374 C CG . MET A 575 ? 0.4552 0.3356 0.4867 0.0464 0.0971 -0.0126 883 MET A CG 4375 S SD . MET A 575 ? 0.6040 0.5047 0.6373 0.0457 0.0939 -0.0088 883 MET A SD 4376 C CE . MET A 575 ? 0.4494 0.3547 0.4887 0.0486 0.0952 0.0028 883 MET A CE 4377 N N . GLY A 576 ? 0.5432 0.3753 0.5519 0.0377 0.0873 -0.0483 884 GLY A N 4378 C CA . GLY A 576 ? 0.5698 0.3913 0.5643 0.0392 0.0830 -0.0593 884 GLY A CA 4379 C C . GLY A 576 ? 0.5622 0.3899 0.5485 0.0361 0.0774 -0.0656 884 GLY A C 4380 O O . GLY A 576 ? 0.5719 0.3926 0.5430 0.0392 0.0741 -0.0738 884 GLY A O 4381 N N . LEU A 577 ? 0.4798 0.3201 0.4752 0.0307 0.0763 -0.0616 885 LEU A N 4382 C CA . LEU A 577 ? 0.4812 0.3278 0.4701 0.0273 0.0708 -0.0672 885 LEU A CA 4383 C C . LEU A 577 ? 0.5137 0.3533 0.5097 0.0173 0.0620 -0.0743 885 LEU A C 4384 O O . LEU A 577 ? 0.5197 0.3614 0.5329 0.0111 0.0622 -0.0698 885 LEU A O 4385 C CB . LEU A 577 ? 0.4552 0.3209 0.4502 0.0273 0.0739 -0.0592 885 LEU A CB 4386 C CG . LEU A 577 ? 0.4699 0.3488 0.4637 0.0353 0.0804 -0.0503 885 LEU A CG 4387 C CD1 . LEU A 577 ? 0.4443 0.3413 0.4482 0.0324 0.0796 -0.0423 885 LEU A CD1 4388 C CD2 . LEU A 577 ? 0.4982 0.3794 0.4767 0.0411 0.0810 -0.0533 885 LEU A CD2 4389 N N . PRO A 578 ? 0.5561 0.3881 0.5391 0.0160 0.0538 -0.0847 886 PRO A N 4390 C CA . PRO A 578 ? 0.5674 0.3962 0.5589 0.0060 0.0431 -0.0911 886 PRO A CA 4391 C C . PRO A 578 ? 0.5453 0.3931 0.5484 0.0002 0.0409 -0.0863 886 PRO A C 4392 O O . PRO A 578 ? 0.4933 0.3562 0.4907 0.0043 0.0446 -0.0799 886 PRO A O 4393 C CB . PRO A 578 ? 0.6143 0.4318 0.5842 0.0086 0.0342 -0.1027 886 PRO A CB 4394 C CG . PRO A 578 ? 0.6382 0.4577 0.5890 0.0199 0.0420 -0.1010 886 PRO A CG 4395 C CD . PRO A 578 ? 0.5966 0.4205 0.5573 0.0242 0.0533 -0.0908 886 PRO A CD 4396 N N . GLN A 579 ? 0.5519 0.4007 0.5720 -0.0092 0.0338 -0.0877 887 GLN A N 4397 C CA . GLN A 579 ? 0.5396 0.4076 0.5730 -0.0146 0.0311 -0.0813 887 GLN A CA 4398 C C . GLN A 579 ? 0.4492 0.3292 0.4682 -0.0123 0.0263 -0.0828 887 GLN A C 4399 O O . GLN A 579 ? 0.4576 0.3544 0.4817 -0.0128 0.0279 -0.0752 887 GLN A O 4400 C CB . GLN A 579 ? 0.6201 0.4854 0.6739 -0.0248 0.0233 -0.0846 887 GLN A CB 4401 C CG . GLN A 579 ? 0.6956 0.5800 0.7649 -0.0299 0.0213 -0.0778 887 GLN A CG 4402 C CD . GLN A 579 ? 0.7832 0.6671 0.8743 -0.0394 0.0133 -0.0801 887 GLN A CD 4403 O OE1 . GLN A 579 ? 0.8367 0.7085 0.9294 -0.0418 0.0084 -0.0844 887 GLN A OE1 4404 N NE2 . GLN A 579 ? 0.7984 0.6981 0.9047 -0.0437 0.0117 -0.0751 887 GLN A NE2 4405 N N . ASN A 580 ? 0.3972 0.2670 0.3968 -0.0090 0.0208 -0.0924 888 ASN A N 4406 C CA . ASN A 580 ? 0.4556 0.3343 0.4399 -0.0064 0.0161 -0.0940 888 ASN A CA 4407 C C . ASN A 580 ? 0.4083 0.2972 0.3811 0.0016 0.0256 -0.0863 888 ASN A C 4408 O O . ASN A 580 ? 0.4511 0.3480 0.4126 0.0039 0.0233 -0.0859 888 ASN A O 4409 C CB . ASN A 580 ? 0.5413 0.4043 0.5061 -0.0048 0.0066 -0.1068 888 ASN A CB 4410 C CG . ASN A 580 ? 0.6189 0.4667 0.5609 0.0049 0.0136 -0.1108 888 ASN A CG 4411 O OD1 . ASN A 580 ? 0.6008 0.4462 0.5464 0.0090 0.0243 -0.1057 888 ASN A OD1 4412 N ND2 . ASN A 580 ? 0.7042 0.5412 0.6217 0.0096 0.0076 -0.1200 888 ASN A ND2 4413 N N . ARG A 581 ? 0.3761 0.2647 0.3530 0.0058 0.0359 -0.0800 889 ARG A N 4414 C CA . ARG A 581 ? 0.3635 0.2626 0.3338 0.0129 0.0443 -0.0724 889 ARG A CA 4415 C C . ARG A 581 ? 0.3234 0.2411 0.3082 0.0098 0.0457 -0.0625 889 ARG A C 4416 O O . ARG A 581 ? 0.2855 0.2142 0.2678 0.0139 0.0502 -0.0561 889 ARG A O 4417 C CB . ARG A 581 ? 0.3881 0.2789 0.3559 0.0202 0.0541 -0.0702 889 ARG A CB 4418 C CG . ARG A 581 ? 0.3983 0.2685 0.3496 0.0252 0.0547 -0.0799 889 ARG A CG 4419 C CD . ARG A 581 ? 0.4132 0.2806 0.3415 0.0308 0.0534 -0.0852 889 ARG A CD 4420 N NE . ARG A 581 ? 0.3929 0.2749 0.3183 0.0369 0.0615 -0.0765 889 ARG A NE 4421 C CZ . ARG A 581 ? 0.4063 0.2914 0.3304 0.0447 0.0697 -0.0707 889 ARG A CZ 4422 N NH1 . ARG A 581 ? 0.4016 0.2752 0.3249 0.0482 0.0719 -0.0731 889 ARG A NH1 4423 N NH2 . ARG A 581 ? 0.3899 0.2906 0.3161 0.0483 0.0753 -0.0621 889 ARG A NH2 4424 N N . ILE A 582 ? 0.3140 0.2346 0.3144 0.0027 0.0419 -0.0610 890 ILE A N 4425 C CA . ILE A 582 ? 0.3151 0.2511 0.3272 0.0004 0.0430 -0.0524 890 ILE A CA 4426 C C . ILE A 582 ? 0.3159 0.2580 0.3353 -0.0065 0.0350 -0.0543 890 ILE A C 4427 O O . ILE A 582 ? 0.3494 0.2847 0.3776 -0.0118 0.0305 -0.0589 890 ILE A O 4428 C CB . ILE A 582 ? 0.3073 0.2421 0.3319 0.0005 0.0492 -0.0456 890 ILE A CB 4429 C CG1 . ILE A 582 ? 0.3195 0.2481 0.3383 0.0078 0.0566 -0.0436 890 ILE A CG1 4430 C CG2 . ILE A 582 ? 0.3187 0.2678 0.3506 -0.0004 0.0502 -0.0372 890 ILE A CG2 4431 C CD1 . ILE A 582 ? 0.3625 0.2909 0.3913 0.0094 0.0624 -0.0357 890 ILE A CD1 4432 N N . ILE A 583 ? 0.2621 0.2169 0.2794 -0.0064 0.0331 -0.0507 891 ILE A N 4433 C CA . ILE A 583 ? 0.2682 0.2301 0.2922 -0.0118 0.0258 -0.0519 891 ILE A CA 4434 C C . ILE A 583 ? 0.2287 0.2025 0.2639 -0.0131 0.0286 -0.0435 891 ILE A C 4435 O O . ILE A 583 ? 0.1979 0.1784 0.2285 -0.0094 0.0324 -0.0380 891 ILE A O 4436 C CB . ILE A 583 ? 0.2830 0.2477 0.2924 -0.0100 0.0201 -0.0557 891 ILE A CB 4437 C CG1 . ILE A 583 ? 0.3604 0.3110 0.3556 -0.0079 0.0167 -0.0649 891 ILE A CG1 4438 C CG2 . ILE A 583 ? 0.3016 0.2750 0.3186 -0.0147 0.0125 -0.0558 891 ILE A CG2 4439 C CD1 . ILE A 583 ? 0.3811 0.3319 0.3575 -0.0042 0.0127 -0.0681 891 ILE A CD1 4440 N N . PHE A 584 ? 0.1725 0.1483 0.2227 -0.0181 0.0268 -0.0425 892 PHE A N 4441 C CA . PHE A 584 ? 0.2144 0.1998 0.2734 -0.0185 0.0299 -0.0350 892 PHE A CA 4442 C C . PHE A 584 ? 0.2283 0.2234 0.2904 -0.0209 0.0238 -0.0353 892 PHE A C 4443 O O . PHE A 584 ? 0.2118 0.2062 0.2776 -0.0246 0.0166 -0.0408 892 PHE A O 4444 C CB . PHE A 584 ? 0.2147 0.1963 0.2888 -0.0209 0.0350 -0.0312 892 PHE A CB 4445 C CG . PHE A 584 ? 0.2426 0.2174 0.3133 -0.0167 0.0428 -0.0271 892 PHE A CG 4446 C CD1 . PHE A 584 ? 0.2153 0.1945 0.2840 -0.0126 0.0482 -0.0194 892 PHE A CD1 4447 C CD2 . PHE A 584 ? 0.2700 0.2332 0.3383 -0.0161 0.0440 -0.0312 892 PHE A CD2 4448 C CE1 . PHE A 584 ? 0.2240 0.1971 0.2890 -0.0080 0.0543 -0.0154 892 PHE A CE1 4449 C CE2 . PHE A 584 ? 0.2511 0.2081 0.3165 -0.0115 0.0511 -0.0269 892 PHE A CE2 4450 C CZ . PHE A 584 ? 0.2462 0.2087 0.3103 -0.0074 0.0560 -0.0188 892 PHE A CZ 4451 N N . SER A 585 ? 0.1711 0.1744 0.2312 -0.0186 0.0259 -0.0297 893 SER A N 4452 C CA . SER A 585 ? 0.1700 0.1821 0.2345 -0.0203 0.0214 -0.0287 893 SER A CA 4453 C C . SER A 585 ? 0.1587 0.1751 0.2325 -0.0196 0.0269 -0.0220 893 SER A C 4454 O O . SER A 585 ? 0.1752 0.1882 0.2467 -0.0167 0.0334 -0.0177 893 SER A O 4455 C CB . SER A 585 ? 0.1531 0.1697 0.2042 -0.0174 0.0186 -0.0286 893 SER A CB 4456 O OG . SER A 585 ? 0.2092 0.2217 0.2499 -0.0170 0.0142 -0.0342 893 SER A OG 4457 N N . PRO A 586 ? 0.1848 0.2081 0.2681 -0.0214 0.0244 -0.0208 894 PRO A N 4458 C CA . PRO A 586 ? 0.1757 0.2025 0.2646 -0.0192 0.0304 -0.0142 894 PRO A CA 4459 C C . PRO A 586 ? 0.1541 0.1822 0.2285 -0.0145 0.0313 -0.0115 894 PRO A C 4460 O O . PRO A 586 ? 0.1371 0.1665 0.2017 -0.0141 0.0266 -0.0141 894 PRO A O 4461 C CB . PRO A 586 ? 0.2078 0.2426 0.3098 -0.0217 0.0264 -0.0143 894 PRO A CB 4462 C CG . PRO A 586 ? 0.2029 0.2372 0.3097 -0.0263 0.0180 -0.0211 894 PRO A CG 4463 C CD . PRO A 586 ? 0.1555 0.1831 0.2448 -0.0249 0.0160 -0.0254 894 PRO A CD 4464 N N . VAL A 587 ? 0.1709 0.1978 0.2437 -0.0108 0.0374 -0.0061 895 VAL A N 4465 C CA . VAL A 587 ? 0.1276 0.1553 0.1886 -0.0067 0.0368 -0.0039 895 VAL A CA 4466 C C . VAL A 587 ? 0.1521 0.1862 0.2156 -0.0076 0.0322 -0.0050 895 VAL A C 4467 O O . VAL A 587 ? 0.1279 0.1660 0.2038 -0.0095 0.0325 -0.0046 895 VAL A O 4468 C CB . VAL A 587 ? 0.1318 0.1555 0.1894 -0.0019 0.0437 0.0015 895 VAL A CB 4469 C CG1 . VAL A 587 ? 0.1082 0.1315 0.1537 0.0023 0.0415 0.0027 895 VAL A CG1 4470 C CG2 . VAL A 587 ? 0.1958 0.2128 0.2495 -0.0001 0.0478 0.0032 895 VAL A CG2 4471 N N . ALA A 588 ? 0.1358 0.1709 0.1894 -0.0064 0.0279 -0.0058 896 ALA A N 4472 C CA . ALA A 588 ? 0.1375 0.1775 0.1921 -0.0068 0.0233 -0.0065 896 ALA A CA 4473 C C . ALA A 588 ? 0.1326 0.1711 0.1803 -0.0028 0.0241 -0.0037 896 ALA A C 4474 O O . ALA A 588 ? 0.1412 0.1748 0.1804 -0.0001 0.0259 -0.0024 896 ALA A O 4475 C CB . ALA A 588 ? 0.1185 0.1597 0.1670 -0.0087 0.0176 -0.0097 896 ALA A CB 4476 N N . PRO A 589 ? 0.1348 0.1769 0.1856 -0.0021 0.0221 -0.0032 897 PRO A N 4477 C CA . PRO A 589 ? 0.1735 0.2125 0.2159 0.0016 0.0213 -0.0017 897 PRO A CA 4478 C C . PRO A 589 ? 0.1717 0.2076 0.2043 0.0009 0.0173 -0.0027 897 PRO A C 4479 O O . PRO A 589 ? 0.1882 0.2264 0.2211 -0.0021 0.0149 -0.0043 897 PRO A O 4480 C CB . PRO A 589 ? 0.1833 0.2274 0.2314 0.0014 0.0180 -0.0017 897 PRO A CB 4481 C CG . PRO A 589 ? 0.1750 0.2254 0.2370 -0.0013 0.0182 -0.0024 897 PRO A CG 4482 C CD . PRO A 589 ? 0.1485 0.1971 0.2107 -0.0045 0.0190 -0.0044 897 PRO A CD 4483 N N . LYS A 590 ? 0.1552 0.1856 0.1796 0.0040 0.0167 -0.0018 898 LYS A N 4484 C CA . LYS A 590 ? 0.1465 0.1740 0.1647 0.0032 0.0129 -0.0021 898 LYS A CA 4485 C C . LYS A 590 ? 0.1800 0.2115 0.2004 -0.0002 0.0092 -0.0024 898 LYS A C 4486 O O . LYS A 590 ? 0.1480 0.1810 0.1687 -0.0021 0.0088 -0.0024 898 LYS A O 4487 C CB . LYS A 590 ? 0.1868 0.2070 0.1969 0.0068 0.0108 -0.0019 898 LYS A CB 4488 C CG . LYS A 590 ? 0.2185 0.2355 0.2250 0.0057 0.0055 -0.0023 898 LYS A CG 4489 C CD . LYS A 590 ? 0.2230 0.2370 0.2255 0.0076 0.0060 -0.0022 898 LYS A CD 4490 C CE . LYS A 590 ? 0.2172 0.2293 0.2192 0.0064 -0.0005 -0.0025 898 LYS A CE 4491 N NZ . LYS A 590 ? 0.2078 0.2161 0.2046 0.0094 -0.0016 -0.0025 898 LYS A NZ 4492 N N . GLU A 591 ? 0.1693 0.2023 0.1908 -0.0002 0.0073 -0.0020 899 GLU A N 4493 C CA . GLU A 591 ? 0.1429 0.1784 0.1643 -0.0024 0.0044 -0.0012 899 GLU A CA 4494 C C . GLU A 591 ? 0.1363 0.1762 0.1592 -0.0044 0.0053 -0.0025 899 GLU A C 4495 O O . GLU A 591 ? 0.1386 0.1791 0.1591 -0.0056 0.0053 -0.0017 899 GLU A O 4496 C CB . GLU A 591 ? 0.1697 0.2051 0.1912 -0.0011 0.0021 -0.0001 899 GLU A CB 4497 C CG . GLU A 591 ? 0.1995 0.2356 0.2190 -0.0025 -0.0003 0.0020 899 GLU A CG 4498 C CD . GLU A 591 ? 0.2282 0.2693 0.2472 -0.0032 -0.0009 0.0012 899 GLU A CD 4499 O OE1 . GLU A 591 ? 0.2084 0.2527 0.2314 -0.0029 -0.0013 -0.0010 899 GLU A OE1 4500 O OE2 . GLU A 591 ? 0.2097 0.2509 0.2245 -0.0038 -0.0011 0.0029 899 GLU A OE2 4501 N N . GLU A 592 ? 0.0878 0.1302 0.1149 -0.0047 0.0063 -0.0044 900 GLU A N 4502 C CA . GLU A 592 ? 0.1440 0.1885 0.1715 -0.0065 0.0059 -0.0069 900 GLU A CA 4503 C C . GLU A 592 ? 0.1793 0.2216 0.2048 -0.0070 0.0091 -0.0075 900 GLU A C 4504 O O . GLU A 592 ? 0.1543 0.1964 0.1757 -0.0075 0.0093 -0.0086 900 GLU A O 4505 C CB . GLU A 592 ? 0.1432 0.1905 0.1789 -0.0075 0.0052 -0.0091 900 GLU A CB 4506 C CG . GLU A 592 ? 0.1678 0.2151 0.2036 -0.0096 0.0036 -0.0129 900 GLU A CG 4507 C CD . GLU A 592 ? 0.1986 0.2481 0.2464 -0.0116 0.0031 -0.0149 900 GLU A CD 4508 O OE1 . GLU A 592 ? 0.1595 0.2127 0.2164 -0.0109 0.0036 -0.0128 900 GLU A OE1 4509 O OE2 . GLU A 592 ? 0.1792 0.2264 0.2283 -0.0137 0.0024 -0.0185 900 GLU A OE2 4510 N N . HIS A 593 ? 0.1817 0.2217 0.2090 -0.0061 0.0119 -0.0066 901 HIS A N 4511 C CA . HIS A 593 ? 0.1626 0.2006 0.1887 -0.0058 0.0147 -0.0065 901 HIS A CA 4512 C C . HIS A 593 ? 0.1574 0.1963 0.1807 -0.0057 0.0139 -0.0047 901 HIS A C 4513 O O . HIS A 593 ? 0.1199 0.1592 0.1425 -0.0057 0.0160 -0.0051 901 HIS A O 4514 C CB . HIS A 593 ? 0.1625 0.1972 0.1889 -0.0036 0.0168 -0.0050 901 HIS A CB 4515 C CG . HIS A 593 ? 0.1442 0.1771 0.1685 -0.0022 0.0174 -0.0036 901 HIS A CG 4516 N ND1 . HIS A 593 ? 0.1010 0.1337 0.1266 -0.0022 0.0201 -0.0041 901 HIS A ND1 4517 C CD2 . HIS A 593 ? 0.1544 0.1853 0.1759 -0.0005 0.0148 -0.0020 901 HIS A CD2 4518 C CE1 . HIS A 593 ? 0.1229 0.1549 0.1478 -0.0004 0.0194 -0.0022 901 HIS A CE1 4519 N NE2 . HIS A 593 ? 0.1752 0.2063 0.1979 0.0004 0.0156 -0.0010 901 HIS A NE2 4520 N N . VAL A 594 ? 0.1396 0.1785 0.1624 -0.0056 0.0113 -0.0025 902 VAL A N 4521 C CA . VAL A 594 ? 0.1245 0.1648 0.1483 -0.0062 0.0108 0.0002 902 VAL A CA 4522 C C . VAL A 594 ? 0.1662 0.2086 0.1872 -0.0066 0.0123 0.0007 902 VAL A C 4523 O O . VAL A 594 ? 0.1773 0.2212 0.1984 -0.0061 0.0154 0.0021 902 VAL A O 4524 C CB . VAL A 594 ? 0.1335 0.1718 0.1587 -0.0065 0.0070 0.0021 902 VAL A CB 4525 C CG1 . VAL A 594 ? 0.1180 0.1585 0.1483 -0.0079 0.0067 0.0057 902 VAL A CG1 4526 C CG2 . VAL A 594 ? 0.1513 0.1855 0.1752 -0.0047 0.0051 0.0010 902 VAL A CG2 4527 N N . ARG A 595 ? 0.1544 0.1966 0.1720 -0.0066 0.0101 -0.0003 903 ARG A N 4528 C CA . ARG A 595 ? 0.1667 0.2095 0.1784 -0.0060 0.0104 0.0001 903 ARG A CA 4529 C C . ARG A 595 ? 0.1544 0.1964 0.1613 -0.0051 0.0128 -0.0030 903 ARG A C 4530 O O . ARG A 595 ? 0.1512 0.1925 0.1519 -0.0035 0.0157 -0.0015 903 ARG A O 4531 C CB . ARG A 595 ? 0.1503 0.1932 0.1599 -0.0057 0.0062 -0.0007 903 ARG A CB 4532 C CG . ARG A 595 ? 0.1977 0.2403 0.1986 -0.0042 0.0051 -0.0002 903 ARG A CG 4533 C CD . ARG A 595 ? 0.1786 0.2218 0.1791 -0.0033 0.0003 0.0005 903 ARG A CD 4534 N NE . ARG A 595 ? 0.1672 0.2124 0.1758 -0.0042 -0.0022 -0.0022 903 ARG A NE 4535 C CZ . ARG A 595 ? 0.1782 0.2253 0.1902 -0.0050 -0.0040 -0.0063 903 ARG A CZ 4536 N NH1 . ARG A 595 ? 0.1749 0.2208 0.1812 -0.0052 -0.0050 -0.0096 903 ARG A NH1 4537 N NH2 . ARG A 595 ? 0.1580 0.2075 0.1795 -0.0055 -0.0046 -0.0071 903 ARG A NH2 4538 N N . ARG A 596 ? 0.1586 0.1996 0.1679 -0.0059 0.0124 -0.0070 904 ARG A N 4539 C CA . ARG A 596 ? 0.1565 0.1947 0.1609 -0.0052 0.0137 -0.0110 904 ARG A CA 4540 C C . ARG A 596 ? 0.1540 0.1910 0.1578 -0.0036 0.0192 -0.0097 904 ARG A C 4541 O O . ARG A 596 ? 0.1251 0.1584 0.1226 -0.0019 0.0214 -0.0125 904 ARG A O 4542 C CB . ARG A 596 ? 0.1574 0.1942 0.1670 -0.0071 0.0114 -0.0153 904 ARG A CB 4543 C CG . ARG A 596 ? 0.1426 0.1787 0.1598 -0.0076 0.0147 -0.0145 904 ARG A CG 4544 C CD . ARG A 596 ? 0.1678 0.2032 0.1924 -0.0097 0.0134 -0.0173 904 ARG A CD 4545 N NE . ARG A 596 ? 0.1548 0.1888 0.1853 -0.0093 0.0175 -0.0153 904 ARG A NE 4546 C CZ . ARG A 596 ? 0.1750 0.2080 0.2137 -0.0107 0.0188 -0.0158 904 ARG A CZ 4547 N NH1 . ARG A 596 ? 0.2169 0.2511 0.2617 -0.0133 0.0154 -0.0188 904 ARG A NH1 4548 N NH2 . ARG A 596 ? 0.1522 0.1829 0.1935 -0.0092 0.0234 -0.0130 904 ARG A NH2 4549 N N . GLY A 597 ? 0.1566 0.1963 0.1672 -0.0037 0.0210 -0.0056 905 GLY A N 4550 C CA . GLY A 597 ? 0.1384 0.1789 0.1512 -0.0018 0.0259 -0.0032 905 GLY A CA 4551 C C . GLY A 597 ? 0.1651 0.2058 0.1715 0.0006 0.0299 -0.0010 905 GLY A C 4552 O O . GLY A 597 ? 0.1196 0.1600 0.1256 0.0033 0.0354 0.0000 905 GLY A O 4553 N N . GLN A 598 ? 0.1497 0.1906 0.1507 0.0004 0.0280 0.0004 906 GLN A N 4554 C CA . GLN A 598 ? 0.1465 0.1864 0.1390 0.0036 0.0327 0.0035 906 GLN A CA 4555 C C . GLN A 598 ? 0.2011 0.2348 0.1798 0.0072 0.0350 -0.0014 906 GLN A C 4556 O O . GLN A 598 ? 0.2053 0.2370 0.1754 0.0115 0.0411 0.0011 906 GLN A O 4557 C CB . GLN A 598 ? 0.1859 0.2257 0.1734 0.0032 0.0294 0.0058 906 GLN A CB 4558 C CG . GLN A 598 ? 0.1479 0.1916 0.1470 0.0003 0.0280 0.0110 906 GLN A CG 4559 C CD . GLN A 598 ? 0.1455 0.1878 0.1391 0.0004 0.0249 0.0132 906 GLN A CD 4560 O OE1 . GLN A 598 ? 0.1951 0.2375 0.1882 0.0015 0.0285 0.0193 906 GLN A OE1 4561 N NE2 . GLN A 598 ? 0.1492 0.1902 0.1398 -0.0004 0.0185 0.0088 906 GLN A NE2 4562 N N . LEU A 599 ? 0.2282 0.2582 0.2047 0.0058 0.0303 -0.0082 907 LEU A N 4563 C CA . LEU A 599 ? 0.1951 0.2172 0.1580 0.0088 0.0304 -0.0143 907 LEU A CA 4564 C C . LEU A 599 ? 0.2107 0.2296 0.1741 0.0116 0.0371 -0.0152 907 LEU A C 4565 O O . LEU A 599 ? 0.2326 0.2436 0.1826 0.0157 0.0395 -0.0192 907 LEU A O 4566 C CB . LEU A 599 ? 0.1858 0.2050 0.1494 0.0055 0.0222 -0.0211 907 LEU A CB 4567 C CG . LEU A 599 ? 0.2039 0.2264 0.1684 0.0032 0.0150 -0.0209 907 LEU A CG 4568 C CD1 . LEU A 599 ? 0.2082 0.2299 0.1797 -0.0005 0.0081 -0.0267 907 LEU A CD1 4569 C CD2 . LEU A 599 ? 0.1959 0.2148 0.1434 0.0072 0.0134 -0.0207 907 LEU A CD2 4570 N N . ALA A 600 ? 0.1855 0.2096 0.1634 0.0100 0.0397 -0.0117 908 ALA A N 4571 C CA . ALA A 600 ? 0.1895 0.2113 0.1698 0.0131 0.0458 -0.0118 908 ALA A CA 4572 C C . ALA A 600 ? 0.2369 0.2614 0.2157 0.0180 0.0544 -0.0060 908 ALA A C 4573 O O . ALA A 600 ? 0.2397 0.2697 0.2206 0.0177 0.0556 -0.0003 908 ALA A O 4574 C CB . ALA A 600 ? 0.1595 0.1856 0.1549 0.0104 0.0447 -0.0099 908 ALA A CB 4575 N N . ASP A 601 ? 0.2330 0.2535 0.2092 0.0227 0.0611 -0.0068 909 ASP A N 4576 C CA . ASP A 601 ? 0.1793 0.2039 0.1581 0.0280 0.0710 -0.0001 909 ASP A CA 4577 C C . ASP A 601 ? 0.1727 0.2076 0.1734 0.0266 0.0726 0.0062 909 ASP A C 4578 O O . ASP A 601 ? 0.1591 0.2019 0.1708 0.0262 0.0747 0.0134 909 ASP A O 4579 C CB . ASP A 601 ? 0.1811 0.1957 0.1456 0.0352 0.0780 -0.0038 909 ASP A CB 4580 C CG . ASP A 601 ? 0.2667 0.2701 0.2067 0.0382 0.0765 -0.0098 909 ASP A CG 4581 O OD1 . ASP A 601 ? 0.2908 0.2840 0.2204 0.0372 0.0705 -0.0188 909 ASP A OD1 4582 O OD2 . ASP A 601 ? 0.2975 0.3024 0.2307 0.0401 0.0788 -0.0053 909 ASP A OD2 4583 N N . VAL A 602 ? 0.1814 0.2147 0.1883 0.0252 0.0693 0.0031 910 VAL A N 4584 C CA . VAL A 602 ? 0.1852 0.2263 0.2102 0.0254 0.0700 0.0080 910 VAL A CA 4585 C C . VAL A 602 ? 0.1804 0.2194 0.2089 0.0214 0.0624 0.0046 910 VAL A C 4586 O O . VAL A 602 ? 0.2123 0.2424 0.2316 0.0210 0.0609 -0.0015 910 VAL A O 4587 C CB . VAL A 602 ? 0.1763 0.2137 0.2010 0.0307 0.0753 0.0082 910 VAL A CB 4588 C CG1 . VAL A 602 ? 0.1317 0.1766 0.1744 0.0308 0.0735 0.0131 910 VAL A CG1 4589 C CG2 . VAL A 602 ? 0.2104 0.2468 0.2288 0.0347 0.0814 0.0110 910 VAL A CG2 4590 N N . CYS A 603 ? 0.1207 0.1672 0.1625 0.0189 0.0577 0.0087 911 CYS A N 4591 C CA . CYS A 603 ? 0.1278 0.1720 0.1721 0.0171 0.0521 0.0069 911 CYS A CA 4592 C C . CYS A 603 ? 0.1284 0.1736 0.1808 0.0214 0.0548 0.0095 911 CYS A C 4593 O O . CYS A 603 ? 0.1591 0.2123 0.2233 0.0238 0.0568 0.0147 911 CYS A O 4594 C CB . CYS A 603 ? 0.1954 0.2450 0.2461 0.0130 0.0446 0.0092 911 CYS A CB 4595 S SG . CYS A 603 ? 0.2691 0.3151 0.3202 0.0125 0.0386 0.0082 911 CYS A SG 4596 N N . LEU A 604 ? 0.1711 0.2082 0.2186 0.0226 0.0551 0.0063 912 LEU A N 4597 C CA . LEU A 604 ? 0.1799 0.2171 0.2344 0.0272 0.0570 0.0092 912 LEU A CA 4598 C C . LEU A 604 ? 0.2037 0.2415 0.2611 0.0260 0.0501 0.0109 912 LEU A C 4599 O O . LEU A 604 ? 0.1699 0.1999 0.2201 0.0245 0.0489 0.0082 912 LEU A O 4600 C CB . LEU A 604 ? 0.1906 0.2167 0.2375 0.0305 0.0628 0.0053 912 LEU A CB 4601 C CG . LEU A 604 ? 0.2328 0.2545 0.2719 0.0331 0.0695 0.0022 912 LEU A CG 4602 C CD1 . LEU A 604 ? 0.2599 0.2678 0.2904 0.0355 0.0732 -0.0032 912 LEU A CD1 4603 C CD2 . LEU A 604 ? 0.2186 0.2481 0.2651 0.0368 0.0727 0.0076 912 LEU A CD2 4604 N N . ASP A 605 ? 0.1817 0.2282 0.2498 0.0269 0.0457 0.0157 913 ASP A N 4605 C CA . ASP A 605 ? 0.1578 0.2041 0.2259 0.0265 0.0379 0.0170 913 ASP A CA 4606 C C . ASP A 605 ? 0.1390 0.1791 0.2047 0.0315 0.0392 0.0184 913 ASP A C 4607 O O . ASP A 605 ? 0.2166 0.2566 0.2871 0.0359 0.0443 0.0201 913 ASP A O 4608 C CB . ASP A 605 ? 0.1573 0.2141 0.2382 0.0258 0.0311 0.0210 913 ASP A CB 4609 C CG . ASP A 605 ? 0.2042 0.2590 0.2820 0.0262 0.0216 0.0215 913 ASP A CG 4610 O OD1 . ASP A 605 ? 0.1763 0.2240 0.2418 0.0241 0.0196 0.0184 913 ASP A OD1 4611 O OD2 . ASP A 605 ? 0.2214 0.2816 0.3088 0.0290 0.0159 0.0249 913 ASP A OD2 4612 N N . THR A 606 ? 0.1402 0.1744 0.1978 0.0314 0.0352 0.0180 914 THR A N 4613 C CA . THR A 606 ? 0.1486 0.1757 0.2022 0.0366 0.0363 0.0203 914 THR A CA 4614 C C . THR A 606 ? 0.1769 0.2095 0.2368 0.0414 0.0294 0.0249 914 THR A C 4615 O O . THR A 606 ? 0.2210 0.2563 0.2796 0.0404 0.0208 0.0253 914 THR A O 4616 C CB . THR A 606 ? 0.1655 0.1835 0.2069 0.0354 0.0358 0.0191 914 THR A CB 4617 O OG1 . THR A 606 ? 0.1896 0.2111 0.2281 0.0322 0.0290 0.0179 914 THR A OG1 4618 C CG2 . THR A 606 ? 0.1471 0.1586 0.1852 0.0317 0.0428 0.0152 914 THR A CG2 4619 N N . PRO A 607 ? 0.1375 0.1709 0.2041 0.0469 0.0326 0.0282 915 PRO A N 4620 C CA . PRO A 607 ? 0.1535 0.1938 0.2289 0.0518 0.0250 0.0329 915 PRO A CA 4621 C C . PRO A 607 ? 0.2186 0.2515 0.2821 0.0560 0.0183 0.0347 915 PRO A C 4622 O O . PRO A 607 ? 0.2280 0.2663 0.2955 0.0583 0.0079 0.0369 915 PRO A O 4623 C CB . PRO A 607 ? 0.2120 0.2536 0.2965 0.0574 0.0320 0.0359 915 PRO A CB 4624 C CG . PRO A 607 ? 0.2202 0.2589 0.3033 0.0542 0.0421 0.0321 915 PRO A CG 4625 C CD . PRO A 607 ? 0.1716 0.2014 0.2406 0.0488 0.0425 0.0274 915 PRO A CD 4626 N N . LEU A 608 ? 0.2175 0.2380 0.2668 0.0573 0.0240 0.0342 916 LEU A N 4627 C CA . LEU A 608 ? 0.2151 0.2268 0.2506 0.0627 0.0200 0.0370 916 LEU A CA 4628 C C . LEU A 608 ? 0.2034 0.2160 0.2308 0.0607 0.0102 0.0350 916 LEU A C 4629 O O . LEU A 608 ? 0.2240 0.2363 0.2466 0.0654 0.0004 0.0370 916 LEU A O 4630 C CB . LEU A 608 ? 0.1985 0.1969 0.2226 0.0633 0.0300 0.0374 916 LEU A CB 4631 C CG . LEU A 608 ? 0.2435 0.2314 0.2514 0.0698 0.0286 0.0415 916 LEU A CG 4632 C CD1 . LEU A 608 ? 0.2491 0.2364 0.2578 0.0786 0.0248 0.0470 916 LEU A CD1 4633 C CD2 . LEU A 608 ? 0.2492 0.2252 0.2493 0.0688 0.0397 0.0423 916 LEU A CD2 4634 N N . CYS A 609 ? 0.1655 0.1782 0.1906 0.0540 0.0124 0.0308 917 CYS A N 4635 C CA . CYS A 609 ? 0.1771 0.1908 0.1966 0.0513 0.0038 0.0280 917 CYS A CA 4636 C C . CYS A 609 ? 0.1877 0.2085 0.2169 0.0433 0.0066 0.0244 917 CYS A C 4637 O O . CYS A 609 ? 0.2168 0.2346 0.2444 0.0402 0.0154 0.0226 917 CYS A O 4638 C CB . CYS A 609 ? 0.2189 0.2205 0.2187 0.0538 0.0059 0.0278 917 CYS A CB 4639 S SG . CYS A 609 ? 0.2547 0.2555 0.2461 0.0504 -0.0026 0.0234 917 CYS A SG 4640 N N . ASN A 610 ? 0.1976 0.1566 0.2243 0.0400 0.0116 0.0081 918 ASN A N 4641 C CA . ASN A 610 ? 0.1803 0.1553 0.2194 0.0343 0.0122 0.0037 918 ASN A CA 4642 C C . ASN A 610 ? 0.2034 0.1843 0.2405 0.0271 0.0134 0.0016 918 ASN A C 4643 O O . ASN A 610 ? 0.1972 0.1732 0.2257 0.0267 0.0128 0.0037 918 ASN A O 4644 C CB . ASN A 610 ? 0.1795 0.1691 0.2301 0.0376 0.0051 0.0036 918 ASN A CB 4645 C CG . ASN A 610 ? 0.2225 0.2112 0.2784 0.0458 0.0022 0.0049 918 ASN A CG 4646 O OD1 . ASN A 610 ? 0.2042 0.2034 0.2686 0.0494 -0.0044 0.0052 918 ASN A OD1 4647 N ND2 . ASN A 610 ? 0.1959 0.1724 0.2475 0.0490 0.0072 0.0050 918 ASN A ND2 4648 N N . GLY A 611 ? 0.1993 0.1909 0.2440 0.0223 0.0148 -0.0028 919 GLY A N 4649 C CA . GLY A 611 ? 0.2040 0.2053 0.2490 0.0180 0.0127 -0.0051 919 GLY A CA 4650 C C . GLY A 611 ? 0.1900 0.1975 0.2359 0.0215 0.0050 -0.0022 919 GLY A C 4651 O O . GLY A 611 ? 0.1661 0.1779 0.2187 0.0247 0.0015 -0.0011 919 GLY A O 4652 N N . HIS A 612 ? 0.1824 0.1903 0.2219 0.0208 0.0024 -0.0014 920 HIS A N 4653 C CA . HIS A 612 ? 0.1481 0.1608 0.1872 0.0235 -0.0052 0.0007 920 HIS A CA 4654 C C . HIS A 612 ? 0.1730 0.1941 0.2124 0.0200 -0.0066 -0.0025 920 HIS A C 4655 O O . HIS A 612 ? 0.1778 0.2048 0.2226 0.0187 -0.0075 -0.0043 920 HIS A O 4656 C CB . HIS A 612 ? 0.1685 0.1730 0.1977 0.0272 -0.0082 0.0045 920 HIS A CB 4657 C CG . HIS A 612 ? 0.2046 0.1986 0.2308 0.0323 -0.0078 0.0079 920 HIS A CG 4658 N ND1 . HIS A 612 ? 0.2379 0.2203 0.2517 0.0366 -0.0092 0.0116 920 HIS A ND1 4659 C CD2 . HIS A 612 ? 0.1937 0.1858 0.2259 0.0348 -0.0062 0.0080 920 HIS A CD2 4660 C CE1 . HIS A 612 ? 0.2257 0.1986 0.2373 0.0418 -0.0090 0.0139 920 HIS A CE1 4661 N NE2 . HIS A 612 ? 0.2167 0.1959 0.2400 0.0409 -0.0072 0.0116 920 HIS A NE2 4662 N N . THR A 613 ? 0.1914 0.2123 0.2239 0.0188 -0.0063 -0.0035 921 THR A N 4663 C CA . THR A 613 ? 0.1541 0.1826 0.1860 0.0165 -0.0072 -0.0076 921 THR A CA 4664 C C . THR A 613 ? 0.1870 0.2193 0.2247 0.0135 -0.0030 -0.0120 921 THR A C 4665 O O . THR A 613 ? 0.1627 0.1996 0.2009 0.0130 -0.0049 -0.0144 921 THR A O 4666 C CB . THR A 613 ? 0.1882 0.2174 0.2145 0.0157 -0.0054 -0.0095 921 THR A CB 4667 O OG1 . THR A 613 ? 0.2091 0.2324 0.2278 0.0190 -0.0084 -0.0053 921 THR A OG1 4668 C CG2 . THR A 613 ? 0.1521 0.1897 0.1773 0.0154 -0.0079 -0.0141 921 THR A CG2 4669 N N . THR A 614 ? 0.1496 0.1779 0.1897 0.0115 0.0030 -0.0129 922 THR A N 4670 C CA . THR A 614 ? 0.1405 0.1710 0.1852 0.0084 0.0072 -0.0176 922 THR A CA 4671 C C . THR A 614 ? 0.1698 0.2010 0.2185 0.0098 0.0063 -0.0171 922 THR A C 4672 O O . THR A 614 ? 0.1614 0.1961 0.2110 0.0083 0.0073 -0.0212 922 THR A O 4673 C CB . THR A 614 ? 0.1556 0.1788 0.2010 0.0057 0.0142 -0.0184 922 THR A CB 4674 O OG1 . THR A 614 ? 0.1539 0.1762 0.1954 0.0036 0.0164 -0.0188 922 THR A OG1 4675 C CG2 . THR A 614 ? 0.1421 0.1677 0.1918 0.0019 0.0182 -0.0245 922 THR A CG2 4676 N N . GLY A 615 ? 0.1443 0.1727 0.1952 0.0128 0.0045 -0.0124 923 GLY A N 4677 C CA . GLY A 615 ? 0.1570 0.1878 0.2134 0.0138 0.0044 -0.0120 923 GLY A CA 4678 C C . GLY A 615 ? 0.1621 0.1979 0.2162 0.0129 0.0010 -0.0131 923 GLY A C 4679 O O . GLY A 615 ? 0.1263 0.1635 0.1811 0.0117 0.0033 -0.0154 923 GLY A O 4680 N N . MET A 616 ? 0.1443 0.1809 0.1937 0.0136 -0.0042 -0.0114 924 MET A N 4681 C CA . MET A 616 ? 0.1499 0.1882 0.1943 0.0129 -0.0075 -0.0122 924 MET A CA 4682 C C . MET A 616 ? 0.1445 0.1837 0.1830 0.0120 -0.0060 -0.0170 924 MET A C 4683 O O . MET A 616 ? 0.1692 0.2074 0.2035 0.0117 -0.0059 -0.0184 924 MET A O 4684 C CB . MET A 616 ? 0.1110 0.1483 0.1497 0.0144 -0.0135 -0.0100 924 MET A CB 4685 C CG . MET A 616 ? 0.1365 0.1729 0.1797 0.0159 -0.0168 -0.0060 924 MET A CG 4686 S SD . MET A 616 ? 0.1792 0.2186 0.2311 0.0141 -0.0175 -0.0050 924 MET A SD 4687 C CE . MET A 616 ? 0.1271 0.1634 0.1689 0.0121 -0.0216 -0.0054 924 MET A CE 4688 N N . ASP A 617 ? 0.1156 0.1566 0.1539 0.0117 -0.0046 -0.0200 925 ASP A N 4689 C CA . ASP A 617 ? 0.1332 0.1774 0.1678 0.0113 -0.0043 -0.0259 925 ASP A CA 4690 C C . ASP A 617 ? 0.1240 0.1666 0.1594 0.0104 -0.0007 -0.0286 925 ASP A C 4691 O O . ASP A 617 ? 0.1480 0.1902 0.1761 0.0117 -0.0024 -0.0318 925 ASP A O 4692 C CB . ASP A 617 ? 0.1613 0.2093 0.1990 0.0097 -0.0021 -0.0294 925 ASP A CB 4693 C CG . ASP A 617 ? 0.1942 0.2438 0.2293 0.0109 -0.0048 -0.0276 925 ASP A CG 4694 O OD1 . ASP A 617 ? 0.1668 0.2158 0.1957 0.0137 -0.0098 -0.0257 925 ASP A OD1 4695 O OD2 . ASP A 617 ? 0.1445 0.1948 0.1827 0.0088 -0.0011 -0.0284 925 ASP A OD2 4696 N N . VAL A 618 ? 0.1126 0.1529 0.1548 0.0090 0.0040 -0.0274 926 VAL A N 4697 C CA . VAL A 618 ? 0.1282 0.1664 0.1708 0.0085 0.0080 -0.0303 926 VAL A CA 4698 C C . VAL A 618 ? 0.1652 0.2011 0.2049 0.0095 0.0084 -0.0279 926 VAL A C 4699 O O . VAL A 618 ? 0.1680 0.2014 0.2019 0.0098 0.0102 -0.0309 926 VAL A O 4700 C CB . VAL A 618 ? 0.2873 0.3222 0.3369 0.0074 0.0134 -0.0301 926 VAL A CB 4701 C CG1 . VAL A 618 ? 0.3382 0.3730 0.3896 0.0052 0.0144 -0.0319 926 VAL A CG1 4702 C CG2 . VAL A 618 ? 0.2335 0.2665 0.2890 0.0093 0.0145 -0.0244 926 VAL A CG2 4703 N N . LEU A 619 ? 0.1313 0.1676 0.1745 0.0098 0.0068 -0.0229 927 LEU A N 4704 C CA . LEU A 619 ? 0.1593 0.1940 0.2014 0.0092 0.0082 -0.0210 927 LEU A CA 4705 C C . LEU A 619 ? 0.1815 0.2123 0.2105 0.0095 0.0053 -0.0221 927 LEU A C 4706 O O . LEU A 619 ? 0.2064 0.2326 0.2295 0.0087 0.0083 -0.0222 927 LEU A O 4707 C CB . LEU A 619 ? 0.1457 0.1833 0.1968 0.0089 0.0067 -0.0165 927 LEU A CB 4708 C CG . LEU A 619 ? 0.1569 0.1973 0.2200 0.0103 0.0097 -0.0153 927 LEU A CG 4709 C CD1 . LEU A 619 ? 0.1621 0.2065 0.2336 0.0112 0.0058 -0.0117 927 LEU A CD1 4710 C CD2 . LEU A 619 ? 0.1699 0.2103 0.2368 0.0101 0.0164 -0.0171 927 LEU A CD2 4711 N N . TRP A 620 ? 0.1515 0.1830 0.1747 0.0109 -0.0002 -0.0229 928 TRP A N 4712 C CA . TRP A 620 ? 0.1606 0.1871 0.1695 0.0127 -0.0038 -0.0243 928 TRP A CA 4713 C C . TRP A 620 ? 0.1730 0.1966 0.1727 0.0147 -0.0026 -0.0294 928 TRP A C 4714 O O . TRP A 620 ? 0.2109 0.2265 0.1965 0.0165 -0.0035 -0.0301 928 TRP A O 4715 C CB . TRP A 620 ? 0.1659 0.1946 0.1712 0.0148 -0.0101 -0.0245 928 TRP A CB 4716 C CG . TRP A 620 ? 0.1959 0.2178 0.1853 0.0179 -0.0143 -0.0256 928 TRP A CG 4717 C CD1 . TRP A 620 ? 0.1955 0.2181 0.1756 0.0223 -0.0184 -0.0305 928 TRP A CD1 4718 C CD2 . TRP A 620 ? 0.1828 0.1949 0.1629 0.0169 -0.0148 -0.0221 928 TRP A CD2 4719 N NE1 . TRP A 620 ? 0.2052 0.2177 0.1689 0.0254 -0.0219 -0.0298 928 TRP A NE1 4720 C CE2 . TRP A 620 ? 0.2079 0.2127 0.1706 0.0215 -0.0192 -0.0245 928 TRP A CE2 4721 C CE3 . TRP A 620 ? 0.2032 0.2123 0.1884 0.0125 -0.0119 -0.0178 928 TRP A CE3 4722 C CZ2 . TRP A 620 ? 0.2094 0.2008 0.1573 0.0216 -0.0202 -0.0220 928 TRP A CZ2 4723 C CZ3 . TRP A 620 ? 0.1686 0.1666 0.1416 0.0113 -0.0125 -0.0158 928 TRP A CZ3 4724 C CH2 . TRP A 620 ? 0.2234 0.2112 0.1767 0.0157 -0.0163 -0.0175 928 TRP A CH2 4725 N N . ALA A 621 ? 0.1757 0.2042 0.1823 0.0143 -0.0006 -0.0332 929 ALA A N 4726 C CA . ALA A 621 ? 0.1932 0.2195 0.1922 0.0161 0.0002 -0.0389 929 ALA A CA 4727 C C . ALA A 621 ? 0.2230 0.2425 0.2195 0.0151 0.0066 -0.0377 929 ALA A C 4728 O O . ALA A 621 ? 0.1946 0.2099 0.1823 0.0170 0.0077 -0.0421 929 ALA A O 4729 C CB . ALA A 621 ? 0.1652 0.1989 0.1725 0.0152 0.0000 -0.0442 929 ALA A CB 4730 N N . GLY A 622 ? 0.2113 0.2306 0.2159 0.0125 0.0108 -0.0324 930 GLY A N 4731 C CA . GLY A 622 ? 0.2063 0.2209 0.2103 0.0114 0.0179 -0.0313 930 GLY A CA 4732 C C . GLY A 622 ? 0.2014 0.2191 0.2160 0.0110 0.0229 -0.0331 930 GLY A C 4733 O O . GLY A 622 ? 0.2040 0.2178 0.2167 0.0111 0.0290 -0.0338 930 GLY A O 4734 N N . THR A 623 ? 0.1681 0.1915 0.1929 0.0106 0.0207 -0.0335 931 THR A N 4735 C CA . THR A 623 ? 0.1845 0.2083 0.2172 0.0105 0.0250 -0.0354 931 THR A CA 4736 C C . THR A 623 ? 0.1827 0.2093 0.2282 0.0105 0.0283 -0.0308 931 THR A C 4737 O O . THR A 623 ? 0.1782 0.2085 0.2301 0.0103 0.0249 -0.0273 931 THR A O 4738 C CB . THR A 623 ? 0.2157 0.2421 0.2516 0.0095 0.0220 -0.0384 931 THR A CB 4739 O OG1 . THR A 623 ? 0.2821 0.3096 0.3090 0.0100 0.0173 -0.0431 931 THR A OG1 4740 C CG2 . THR A 623 ? 0.1869 0.2100 0.2270 0.0089 0.0267 -0.0415 931 THR A CG2 4741 N N . PRO A 624 ? 0.1760 0.2009 0.2248 0.0114 0.0345 -0.0313 932 PRO A N 4742 C CA . PRO A 624 ? 0.1963 0.2254 0.2586 0.0129 0.0370 -0.0281 932 PRO A CA 4743 C C . PRO A 624 ? 0.2204 0.2485 0.2878 0.0141 0.0348 -0.0276 932 PRO A C 4744 O O . PRO A 624 ? 0.2196 0.2426 0.2822 0.0135 0.0355 -0.0310 932 PRO A O 4745 C CB . PRO A 624 ? 0.1867 0.2132 0.2495 0.0145 0.0447 -0.0304 932 PRO A CB 4746 C CG . PRO A 624 ? 0.1976 0.2188 0.2460 0.0131 0.0462 -0.0329 932 PRO A CG 4747 C CD . PRO A 624 ? 0.1631 0.1823 0.2029 0.0122 0.0394 -0.0351 932 PRO A CD 4748 N N . MET A 625 ? 0.2115 0.2435 0.2877 0.0158 0.0323 -0.0236 933 MET A N 4749 C CA . MET A 625 ? 0.1986 0.2269 0.2769 0.0177 0.0306 -0.0222 933 MET A CA 4750 C C . MET A 625 ? 0.1759 0.2049 0.2636 0.0226 0.0328 -0.0205 933 MET A C 4751 O O . MET A 625 ? 0.1612 0.1982 0.2578 0.0244 0.0316 -0.0187 933 MET A O 4752 C CB . MET A 625 ? 0.2169 0.2475 0.2942 0.0169 0.0242 -0.0190 933 MET A CB 4753 C CG . MET A 625 ? 0.2329 0.2580 0.3100 0.0191 0.0227 -0.0167 933 MET A CG 4754 S SD . MET A 625 ? 0.2723 0.2985 0.3442 0.0176 0.0163 -0.0140 933 MET A SD 4755 C CE . MET A 625 ? 0.3213 0.3568 0.3987 0.0180 0.0116 -0.0118 933 MET A CE 4756 N N . VAL A 626 ? 0.1790 0.1995 0.2648 0.0250 0.0360 -0.0218 934 VAL A N 4757 C CA . VAL A 626 ? 0.1772 0.1968 0.2703 0.0314 0.0375 -0.0205 934 VAL A CA 4758 C C . VAL A 626 ? 0.1626 0.1769 0.2541 0.0346 0.0328 -0.0167 934 VAL A C 4759 O O . VAL A 626 ? 0.1485 0.1534 0.2310 0.0320 0.0327 -0.0165 934 VAL A O 4760 C CB . VAL A 626 ? 0.1847 0.1945 0.2738 0.0333 0.0438 -0.0239 934 VAL A CB 4761 C CG1 . VAL A 626 ? 0.2190 0.2269 0.3146 0.0415 0.0450 -0.0228 934 VAL A CG1 4762 C CG2 . VAL A 626 ? 0.1710 0.1840 0.2586 0.0306 0.0485 -0.0278 934 VAL A CG2 4763 N N . THR A 627 ? 0.1533 0.1737 0.2532 0.0403 0.0288 -0.0142 935 THR A N 4764 C CA . THR A 627 ? 0.1837 0.1974 0.2794 0.0445 0.0237 -0.0105 935 THR A CA 4765 C C . THR A 627 ? 0.1995 0.2128 0.3014 0.0543 0.0219 -0.0096 935 THR A C 4766 O O . THR A 627 ? 0.1742 0.1976 0.2879 0.0575 0.0237 -0.0118 935 THR A O 4767 C CB . THR A 627 ? 0.2439 0.2654 0.3407 0.0421 0.0168 -0.0080 935 THR A CB 4768 O OG1 . THR A 627 ? 0.2363 0.2482 0.3248 0.0458 0.0125 -0.0046 935 THR A OG1 4769 C CG2 . THR A 627 ? 0.2253 0.2623 0.3367 0.0442 0.0134 -0.0084 935 THR A CG2 4770 N N . MET A 628 ? 0.2287 0.2296 0.3217 0.0596 0.0187 -0.0065 936 MET A N 4771 C CA . MET A 628 ? 0.2435 0.2421 0.3397 0.0709 0.0152 -0.0055 936 MET A CA 4772 C C . MET A 628 ? 0.2679 0.2636 0.3586 0.0751 0.0068 -0.0017 936 MET A C 4773 O O . MET A 628 ? 0.2843 0.2620 0.3586 0.0758 0.0071 0.0014 936 MET A O 4774 C CB . MET A 628 ? 0.2419 0.2208 0.3267 0.0756 0.0205 -0.0056 936 MET A CB 4775 C CG . MET A 628 ? 0.2598 0.2347 0.3461 0.0892 0.0165 -0.0049 936 MET A CG 4776 S SD . MET A 628 ? 0.3339 0.2812 0.4032 0.0952 0.0230 -0.0047 936 MET A SD 4777 C CE . MET A 628 ? 0.4441 0.3675 0.4903 0.0907 0.0233 0.0003 936 MET A CE 4778 N N . PRO A 629 ? 0.2355 0.2482 0.3393 0.0772 -0.0004 -0.0022 937 PRO A N 4779 C CA . PRO A 629 ? 0.2482 0.2585 0.3460 0.0810 -0.0093 0.0009 937 PRO A CA 4780 C C . PRO A 629 ? 0.2640 0.2593 0.3515 0.0934 -0.0133 0.0032 937 PRO A C 4781 O O . PRO A 629 ? 0.2498 0.2470 0.3437 0.1008 -0.0126 0.0014 937 PRO A O 4782 C CB . PRO A 629 ? 0.2419 0.2751 0.3589 0.0806 -0.0157 -0.0016 937 PRO A CB 4783 C CG . PRO A 629 ? 0.2357 0.2818 0.3683 0.0799 -0.0099 -0.0056 937 PRO A CG 4784 C CD . PRO A 629 ? 0.2540 0.2884 0.3778 0.0749 0.0000 -0.0059 937 PRO A CD 4785 N N . GLY A 630 ? 0.2740 0.2534 0.3436 0.0951 -0.0164 0.0073 938 GLY A N 4786 C CA . GLY A 630 ? 0.2940 0.2558 0.3489 0.1042 -0.0193 0.0103 938 GLY A CA 4787 C C . GLY A 630 ? 0.3119 0.2821 0.3680 0.1070 -0.0293 0.0117 938 GLY A C 4788 O O . GLY A 630 ? 0.3127 0.3050 0.3864 0.1053 -0.0337 0.0091 938 GLY A O 4789 N N . GLU A 631 ? 0.3286 0.2807 0.3648 0.1107 -0.0321 0.0154 939 GLU A N 4790 C CA . GLU A 631 ? 0.3947 0.3531 0.4297 0.1141 -0.0416 0.0160 939 GLU A CA 4791 C C . GLU A 631 ? 0.4241 0.3790 0.4484 0.1090 -0.0442 0.0182 939 GLU A C 4792 O O . GLU A 631 ? 0.4806 0.4484 0.5109 0.1082 -0.0515 0.0171 939 GLU A O 4793 C CB . GLU A 631 ? 0.4442 0.3877 0.4654 0.1237 -0.0446 0.0174 939 GLU A CB 4794 C CG . GLU A 631 ? 0.5041 0.4531 0.5371 0.1297 -0.0432 0.0147 939 GLU A CG 4795 C CD . GLU A 631 ? 0.5746 0.5097 0.5937 0.1402 -0.0474 0.0156 939 GLU A CD 4796 O OE1 . GLU A 631 ? 0.5793 0.5115 0.5885 0.1439 -0.0549 0.0166 939 GLU A OE1 4797 O OE2 . GLU A 631 ? 0.6294 0.5559 0.6466 0.1451 -0.0434 0.0150 939 GLU A OE2 4798 N N . THR A 632 ? 0.3482 0.2858 0.3567 0.1052 -0.0377 0.0211 940 THR A N 4799 C CA . THR A 632 ? 0.2919 0.2259 0.2898 0.1005 -0.0390 0.0232 940 THR A CA 4800 C C . THR A 632 ? 0.2808 0.2342 0.2950 0.0932 -0.0398 0.0206 940 THR A C 4801 O O . THR A 632 ? 0.2661 0.2291 0.2946 0.0906 -0.0359 0.0179 940 THR A O 4802 C CB . THR A 632 ? 0.2939 0.2039 0.2700 0.0980 -0.0301 0.0268 940 THR A CB 4803 O OG1 . THR A 632 ? 0.2808 0.1916 0.2638 0.0931 -0.0218 0.0255 940 THR A OG1 4804 C CG2 . THR A 632 ? 0.3501 0.2382 0.3081 0.1040 -0.0273 0.0293 940 THR A CG2 4805 N N . LEU A 633 ? 0.2373 0.1949 0.2478 0.0898 -0.0445 0.0211 941 LEU A N 4806 C CA . LEU A 633 ? 0.2311 0.2041 0.2531 0.0825 -0.0455 0.0189 941 LEU A CA 4807 C C . LEU A 633 ? 0.2372 0.2079 0.2605 0.0769 -0.0368 0.0183 941 LEU A C 4808 O O . LEU A 633 ? 0.1831 0.1694 0.2224 0.0703 -0.0347 0.0150 941 LEU A O 4809 C CB . LEU A 633 ? 0.2640 0.2341 0.2744 0.0799 -0.0496 0.0203 941 LEU A CB 4810 C CG . LEU A 633 ? 0.2517 0.2370 0.2716 0.0728 -0.0528 0.0179 941 LEU A CG 4811 C CD1 . LEU A 633 ? 0.2717 0.2526 0.2792 0.0724 -0.0575 0.0188 941 LEU A CD1 4812 C CD2 . LEU A 633 ? 0.2510 0.2375 0.2728 0.0674 -0.0476 0.0172 941 LEU A CD2 4813 N N . ALA A 634 ? 0.2349 0.1876 0.2410 0.0751 -0.0292 0.0211 942 ALA A N 4814 C CA . ALA A 634 ? 0.2442 0.1973 0.2513 0.0647 -0.0188 0.0196 942 ALA A CA 4815 C C . ALA A 634 ? 0.2455 0.2040 0.2649 0.0624 -0.0131 0.0167 942 ALA A C 4816 O O . ALA A 634 ? 0.2102 0.1756 0.2360 0.0540 -0.0071 0.0138 942 ALA A O 4817 C CB . ALA A 634 ? 0.2531 0.1857 0.2400 0.0631 -0.0112 0.0227 942 ALA A CB 4818 N N . SER A 635 ? 0.2450 0.1998 0.2669 0.0707 -0.0154 0.0170 943 SER A N 4819 C CA . SER A 635 ? 0.2289 0.1875 0.2614 0.0702 -0.0102 0.0142 943 SER A CA 4820 C C . SER A 635 ? 0.2189 0.2000 0.2726 0.0700 -0.0145 0.0106 943 SER A C 4821 O O . SER A 635 ? 0.2336 0.2199 0.2974 0.0702 -0.0104 0.0080 943 SER A O 4822 C CB . SER A 635 ? 0.2722 0.2138 0.2955 0.0801 -0.0095 0.0160 943 SER A CB 4823 O OG . SER A 635 ? 0.2562 0.2034 0.2843 0.0912 -0.0196 0.0164 943 SER A OG 4824 N N . ARG A 636 ? 0.1670 0.1603 0.2269 0.0693 -0.0221 0.0104 944 ARG A N 4825 C CA . ARG A 636 ? 0.1418 0.1556 0.2218 0.0685 -0.0257 0.0069 944 ARG A CA 4826 C C . ARG A 636 ? 0.1608 0.1859 0.2463 0.0586 -0.0250 0.0053 944 ARG A C 4827 O O . ARG A 636 ? 0.1446 0.1848 0.2452 0.0559 -0.0261 0.0025 944 ARG A O 4828 C CB . ARG A 636 ? 0.1549 0.1751 0.2407 0.0771 -0.0362 0.0067 944 ARG A CB 4829 C CG . ARG A 636 ? 0.2007 0.2118 0.2810 0.0865 -0.0364 0.0081 944 ARG A CG 4830 C CD . ARG A 636 ? 0.2065 0.2263 0.2907 0.0904 -0.0444 0.0078 944 ARG A CD 4831 N NE . ARG A 636 ? 0.1912 0.2337 0.2964 0.0866 -0.0456 0.0035 944 ARG A NE 4832 C CZ . ARG A 636 ? 0.2488 0.3012 0.3676 0.0892 -0.0425 0.0007 944 ARG A CZ 4833 N NH1 . ARG A 636 ? 0.2465 0.2875 0.3599 0.0962 -0.0385 0.0018 944 ARG A NH1 4834 N NH2 . ARG A 636 ? 0.2657 0.3381 0.4028 0.0847 -0.0426 -0.0033 944 ARG A NH2 4835 N N . VAL A 637 ? 0.1677 0.1847 0.2403 0.0535 -0.0227 0.0069 945 VAL A N 4836 C CA . VAL A 637 ? 0.1830 0.2081 0.2574 0.0458 -0.0232 0.0056 945 VAL A CA 4837 C C . VAL A 637 ? 0.1698 0.2034 0.2534 0.0396 -0.0170 0.0024 945 VAL A C 4838 O O . VAL A 637 ? 0.1231 0.1668 0.2144 0.0357 -0.0186 0.0008 945 VAL A O 4839 C CB . VAL A 637 ? 0.1842 0.1997 0.2432 0.0427 -0.0216 0.0073 945 VAL A CB 4840 C CG1 . VAL A 637 ? 0.1769 0.1996 0.2367 0.0356 -0.0209 0.0052 945 VAL A CG1 4841 C CG2 . VAL A 637 ? 0.1906 0.1985 0.2392 0.0481 -0.0285 0.0104 945 VAL A CG2 4842 N N . ALA A 638 ? 0.1861 0.2139 0.2673 0.0387 -0.0096 0.0015 946 ALA A N 4843 C CA . ALA A 638 ? 0.1937 0.2274 0.2808 0.0337 -0.0036 -0.0017 946 ALA A CA 4844 C C . ALA A 638 ? 0.1843 0.2297 0.2863 0.0350 -0.0038 -0.0034 946 ALA A C 4845 O O . ALA A 638 ? 0.1534 0.2058 0.2598 0.0299 -0.0016 -0.0053 946 ALA A O 4846 C CB . ALA A 638 ? 0.2139 0.2386 0.2959 0.0332 0.0036 -0.0031 946 ALA A CB 4847 N N . ALA A 639 ? 0.1777 0.2249 0.2870 0.0419 -0.0063 -0.0030 947 ALA A N 4848 C CA . ALA A 639 ? 0.1837 0.2446 0.3100 0.0434 -0.0065 -0.0054 947 ALA A CA 4849 C C . ALA A 639 ? 0.1841 0.2559 0.3178 0.0393 -0.0119 -0.0059 947 ALA A C 4850 O O . ALA A 639 ? 0.1629 0.2456 0.3083 0.0352 -0.0089 -0.0084 947 ALA A O 4851 C CB . ALA A 639 ? 0.1961 0.2574 0.3287 0.0533 -0.0097 -0.0054 947 ALA A CB 4852 N N . SER A 640 ? 0.1655 0.2331 0.2913 0.0402 -0.0193 -0.0037 948 SER A N 4853 C CA . SER A 640 ? 0.1682 0.2432 0.2982 0.0359 -0.0249 -0.0043 948 SER A CA 4854 C C . SER A 640 ? 0.1383 0.2123 0.2631 0.0272 -0.0198 -0.0049 948 SER A C 4855 O O . SER A 640 ? 0.1226 0.2044 0.2556 0.0219 -0.0193 -0.0068 948 SER A O 4856 C CB . SER A 640 ? 0.1777 0.2455 0.2966 0.0393 -0.0335 -0.0018 948 SER A CB 4857 O OG . SER A 640 ? 0.1951 0.2693 0.3179 0.0353 -0.0395 -0.0029 948 SER A OG 4858 N N . GLN A 641 ? 0.1043 0.1681 0.2151 0.0257 -0.0161 -0.0038 949 GLN A N 4859 C CA . GLN A 641 ? 0.1139 0.1754 0.2175 0.0194 -0.0120 -0.0047 949 GLN A CA 4860 C C . GLN A 641 ? 0.1301 0.1969 0.2418 0.0162 -0.0046 -0.0071 949 GLN A C 4861 O O . GLN A 641 ? 0.1296 0.1976 0.2403 0.0109 -0.0025 -0.0080 949 GLN A O 4862 C CB . GLN A 641 ? 0.1603 0.2125 0.2503 0.0194 -0.0095 -0.0043 949 GLN A CB 4863 C CG . GLN A 641 ? 0.1526 0.1988 0.2329 0.0218 -0.0148 -0.0021 949 GLN A CG 4864 C CD . GLN A 641 ? 0.1642 0.2035 0.2349 0.0212 -0.0106 -0.0028 949 GLN A CD 4865 O OE1 . GLN A 641 ? 0.1314 0.1697 0.2036 0.0202 -0.0047 -0.0047 949 GLN A OE1 4866 N NE2 . GLN A 641 ? 0.1487 0.1835 0.2098 0.0216 -0.0134 -0.0016 949 GLN A NE2 4867 N N . LEU A 642 ? 0.1089 0.1772 0.2270 0.0198 0.0000 -0.0081 950 LEU A N 4868 C CA . LEU A 642 ? 0.1304 0.2030 0.2552 0.0176 0.0080 -0.0105 950 LEU A CA 4869 C C . LEU A 642 ? 0.1682 0.2533 0.3092 0.0155 0.0083 -0.0119 950 LEU A C 4870 O O . LEU A 642 ? 0.1680 0.2560 0.3120 0.0108 0.0152 -0.0136 950 LEU A O 4871 C CB . LEU A 642 ? 0.1536 0.2235 0.2802 0.0226 0.0126 -0.0115 950 LEU A CB 4872 C CG . LEU A 642 ? 0.1783 0.2364 0.2901 0.0222 0.0148 -0.0115 950 LEU A CG 4873 C CD1 . LEU A 642 ? 0.1861 0.2390 0.2988 0.0272 0.0183 -0.0123 950 LEU A CD1 4874 C CD2 . LEU A 642 ? 0.2175 0.2731 0.3215 0.0172 0.0198 -0.0136 950 LEU A CD2 4875 N N . THR A 643 ? 0.1421 0.2344 0.2932 0.0190 0.0011 -0.0117 951 THR A N 4876 C CA . THR A 643 ? 0.1610 0.2679 0.3306 0.0167 0.0003 -0.0142 951 THR A CA 4877 C C . THR A 643 ? 0.1705 0.2762 0.3360 0.0079 -0.0001 -0.0142 951 THR A C 4878 O O . THR A 643 ? 0.1558 0.2687 0.3310 0.0018 0.0055 -0.0165 951 THR A O 4879 C CB . THR A 643 ? 0.1595 0.2734 0.3382 0.0234 -0.0090 -0.0146 951 THR A CB 4880 O OG1 . THR A 643 ? 0.1139 0.2249 0.2914 0.0318 -0.0078 -0.0141 951 THR A OG1 4881 C CG2 . THR A 643 ? 0.2049 0.3326 0.3980 0.0200 -0.0098 -0.0176 951 THR A CG2 4882 N N . CYS A 644 ? 0.1536 0.2493 0.3040 0.0074 -0.0062 -0.0117 952 CYS A N 4883 C CA . CYS A 644 ? 0.1496 0.2405 0.2922 0.0001 -0.0072 -0.0113 952 CYS A CA 4884 C C . CYS A 644 ? 0.1781 0.2615 0.3106 -0.0049 0.0022 -0.0115 952 CYS A C 4885 O O . CYS A 644 ? 0.1927 0.2756 0.3259 -0.0120 0.0062 -0.0124 952 CYS A O 4886 C CB . CYS A 644 ? 0.1719 0.2529 0.2988 0.0023 -0.0153 -0.0088 952 CYS A CB 4887 S SG . CYS A 644 ? 0.1776 0.2489 0.2903 -0.0049 -0.0168 -0.0083 952 CYS A SG 4888 N N . LEU A 645 ? 0.1450 0.2214 0.2672 -0.0014 0.0057 -0.0108 953 LEU A N 4889 C CA . LEU A 645 ? 0.1800 0.2482 0.2904 -0.0043 0.0137 -0.0113 953 LEU A CA 4890 C C . LEU A 645 ? 0.2424 0.3170 0.3640 -0.0078 0.0230 -0.0133 953 LEU A C 4891 O O . LEU A 645 ? 0.2500 0.3175 0.3624 -0.0127 0.0297 -0.0136 953 LEU A O 4892 C CB . LEU A 645 ? 0.1941 0.2564 0.2953 0.0006 0.0149 -0.0114 953 LEU A CB 4893 C CG . LEU A 645 ? 0.2095 0.2620 0.2951 -0.0008 0.0206 -0.0126 953 LEU A CG 4894 C CD1 . LEU A 645 ? 0.2062 0.2495 0.2755 -0.0029 0.0162 -0.0116 953 LEU A CD1 4895 C CD2 . LEU A 645 ? 0.1762 0.2257 0.2574 0.0035 0.0217 -0.0140 953 LEU A CD2 4896 N N . GLY A 646 ? 0.2245 0.3120 0.3652 -0.0047 0.0238 -0.0149 954 GLY A N 4897 C CA . GLY A 646 ? 0.2428 0.3396 0.3977 -0.0074 0.0329 -0.0175 954 GLY A CA 4898 C C . GLY A 646 ? 0.2727 0.3683 0.4269 -0.0027 0.0400 -0.0187 954 GLY A C 4899 O O . GLY A 646 ? 0.3269 0.4245 0.4844 -0.0054 0.0500 -0.0206 954 GLY A O 4900 N N . CYS A 647 ? 0.2345 0.3260 0.3838 0.0042 0.0356 -0.0178 955 CYS A N 4901 C CA . CYS A 647 ? 0.2280 0.3164 0.3755 0.0089 0.0415 -0.0193 955 CYS A CA 4902 C C . CYS A 647 ? 0.2090 0.3051 0.3702 0.0166 0.0383 -0.0200 955 CYS A C 4903 O O . CYS A 647 ? 0.2108 0.2989 0.3643 0.0217 0.0350 -0.0190 955 CYS A O 4904 C CB . CYS A 647 ? 0.2262 0.2999 0.3532 0.0098 0.0404 -0.0185 955 CYS A CB 4905 S SG . CYS A 647 ? 0.3511 0.4134 0.4585 0.0037 0.0447 -0.0186 955 CYS A SG 4906 N N . LEU A 648 ? 0.1687 0.2784 0.3469 0.0175 0.0388 -0.0217 956 LEU A N 4907 C CA . LEU A 648 ? 0.1988 0.3136 0.3844 0.0257 0.0339 -0.0220 956 LEU A CA 4908 C C . LEU A 648 ? 0.2133 0.3210 0.3933 0.0317 0.0391 -0.0229 956 LEU A C 4909 O O . LEU A 648 ? 0.2086 0.3139 0.3888 0.0396 0.0348 -0.0225 956 LEU A O 4910 C CB . LEU A 648 ? 0.2381 0.3686 0.4396 0.0248 0.0333 -0.0241 956 LEU A CB 4911 C CG . LEU A 648 ? 0.2857 0.4235 0.4939 0.0193 0.0269 -0.0240 956 LEU A CG 4912 C CD1 . LEU A 648 ? 0.3100 0.4639 0.5349 0.0173 0.0279 -0.0270 956 LEU A CD1 4913 C CD2 . LEU A 648 ? 0.2960 0.4302 0.5003 0.0248 0.0153 -0.0218 956 LEU A CD2 4914 N N . GLU A 649 ? 0.2069 0.3096 0.3803 0.0283 0.0483 -0.0242 957 GLU A N 4915 C CA . GLU A 649 ? 0.2515 0.3470 0.4188 0.0333 0.0537 -0.0257 957 GLU A CA 4916 C C . GLU A 649 ? 0.2247 0.3058 0.3799 0.0366 0.0513 -0.0248 957 GLU A C 4917 O O . GLU A 649 ? 0.2241 0.2971 0.3735 0.0410 0.0546 -0.0262 957 GLU A O 4918 C CB . GLU A 649 ? 0.3246 0.4169 0.4854 0.0285 0.0638 -0.0275 957 GLU A CB 4919 C CG . GLU A 649 ? 0.3880 0.4697 0.5346 0.0227 0.0661 -0.0270 957 GLU A CG 4920 C CD . GLU A 649 ? 0.4713 0.5582 0.6209 0.0154 0.0661 -0.0259 957 GLU A CD 4921 O OE1 . GLU A 649 ? 0.4649 0.5625 0.6275 0.0145 0.0604 -0.0250 957 GLU A OE1 4922 O OE2 . GLU A 649 ? 0.5395 0.6181 0.6762 0.0105 0.0714 -0.0261 957 GLU A OE2 4923 N N . LEU A 650 ? 0.1940 0.2717 0.3454 0.0342 0.0458 -0.0228 958 LEU A N 4924 C CA . LEU A 650 ? 0.1733 0.2366 0.3097 0.0351 0.0429 -0.0216 958 LEU A CA 4925 C C . LEU A 650 ? 0.1941 0.2547 0.3324 0.0412 0.0360 -0.0193 958 LEU A C 4926 O O . LEU A 650 ? 0.1609 0.2090 0.2873 0.0416 0.0342 -0.0181 958 LEU A O 4927 C CB . LEU A 650 ? 0.1680 0.2261 0.2918 0.0281 0.0404 -0.0205 958 LEU A CB 4928 C CG . LEU A 650 ? 0.2009 0.2545 0.3149 0.0238 0.0469 -0.0229 958 LEU A CG 4929 C CD1 . LEU A 650 ? 0.1580 0.2078 0.2603 0.0184 0.0433 -0.0221 958 LEU A CD1 4930 C CD2 . LEU A 650 ? 0.1829 0.2263 0.2888 0.0263 0.0509 -0.0257 958 LEU A CD2 4931 N N . ILE A 651 ? 0.2150 0.2872 0.3681 0.0460 0.0323 -0.0192 959 ILE A N 4932 C CA . ILE A 651 ? 0.1684 0.2378 0.3220 0.0530 0.0245 -0.0169 959 ILE A CA 4933 C C . ILE A 651 ? 0.2000 0.2666 0.3552 0.0621 0.0259 -0.0181 959 ILE A C 4934 O O . ILE A 651 ? 0.2374 0.3156 0.4021 0.0641 0.0275 -0.0202 959 ILE A O 4935 C CB . ILE A 651 ? 0.1733 0.2560 0.3369 0.0525 0.0167 -0.0161 959 ILE A CB 4936 C CG1 . ILE A 651 ? 0.1379 0.2221 0.2981 0.0435 0.0154 -0.0150 959 ILE A CG1 4937 C CG2 . ILE A 651 ? 0.1759 0.2537 0.3362 0.0606 0.0079 -0.0137 959 ILE A CG2 4938 C CD1 . ILE A 651 ? 0.1412 0.2378 0.3115 0.0415 0.0085 -0.0150 959 ILE A CD1 4939 N N . ALA A 652 ? 0.1749 0.2251 0.3197 0.0674 0.0258 -0.0167 960 ALA A N 4940 C CA . ALA A 652 ? 0.1784 0.2213 0.3202 0.0764 0.0274 -0.0177 960 ALA A CA 4941 C C . ALA A 652 ? 0.1853 0.2278 0.3273 0.0863 0.0187 -0.0157 960 ALA A C 4942 O O . ALA A 652 ? 0.2105 0.2470 0.3468 0.0869 0.0126 -0.0126 960 ALA A O 4943 C CB . ALA A 652 ? 0.1615 0.1831 0.2883 0.0758 0.0330 -0.0175 960 ALA A CB 4944 N N . LYS A 653 ? 0.1973 0.2453 0.3439 0.0948 0.0183 -0.0174 961 LYS A N 4945 C CA . LYS A 653 ? 0.2784 0.3258 0.4239 0.1054 0.0106 -0.0150 961 LYS A CA 4946 C C . LYS A 653 ? 0.2796 0.3017 0.4077 0.1143 0.0113 -0.0124 961 LYS A C 4947 O O . LYS A 653 ? 0.2869 0.3012 0.4129 0.1199 0.0056 -0.0087 961 LYS A O 4948 C CB . LYS A 653 ? 0.3561 0.4225 0.5172 0.1102 0.0104 -0.0171 961 LYS A CB 4949 C CG . LYS A 653 ? 0.4292 0.5191 0.6072 0.1019 0.0088 -0.0192 961 LYS A CG 4950 C CD . LYS A 653 ? 0.5331 0.6415 0.7275 0.1066 0.0089 -0.0218 961 LYS A CD 4951 C CE . LYS A 653 ? 0.5747 0.7043 0.7854 0.0963 0.0104 -0.0247 961 LYS A CE 4952 N NZ . LYS A 653 ? 0.5958 0.7236 0.8040 0.0867 0.0198 -0.0263 961 LYS A NZ 4953 N N . ASN A 654 ? 0.2727 0.2807 0.3919 0.1120 0.0174 -0.0156 962 ASN A N 4954 C CA . ASN A 654 ? 0.2909 0.2721 0.3950 0.1161 0.0179 -0.0151 962 ASN A CA 4955 C C . ASN A 654 ? 0.2795 0.2456 0.3716 0.1077 0.0283 -0.0148 962 ASN A C 4956 O O . ASN A 654 ? 0.2529 0.2307 0.3531 0.0992 0.0334 -0.0167 962 ASN A O 4957 C CB . ASN A 654 ? 0.3192 0.2983 0.4297 0.1253 0.0167 -0.0170 962 ASN A CB 4958 C CG . ASN A 654 ? 0.3249 0.3181 0.4447 0.1261 0.0210 -0.0237 962 ASN A CG 4959 O OD1 . ASN A 654 ? 0.3144 0.3058 0.4277 0.1201 0.0293 -0.0244 962 ASN A OD1 4960 N ND2 . ASN A 654 ? 0.3540 0.3584 0.4917 0.1311 0.0232 -0.0213 962 ASN A ND2 4961 N N . ARG A 655 ? 0.2579 0.1981 0.3313 0.1089 0.0310 -0.0131 963 ARG A N 4962 C CA . ARG A 655 ? 0.2874 0.2123 0.3496 0.0998 0.0401 -0.0138 963 ARG A CA 4963 C C . ARG A 655 ? 0.3020 0.2336 0.3704 0.0974 0.0463 -0.0190 963 ARG A C 4964 O O . ARG A 655 ? 0.2752 0.2081 0.3438 0.0878 0.0520 -0.0212 963 ARG A O 4965 C CB . ARG A 655 ? 0.3743 0.2695 0.4144 0.1009 0.0419 -0.0113 963 ARG A CB 4966 C CG . ARG A 655 ? 0.4307 0.3162 0.4602 0.1008 0.0376 -0.0059 963 ARG A CG 4967 C CD . ARG A 655 ? 0.5594 0.4150 0.5657 0.1009 0.0403 -0.0032 963 ARG A CD 4968 N NE . ARG A 655 ? 0.6896 0.5369 0.6917 0.1101 0.0386 -0.0042 963 ARG A NE 4969 C CZ . ARG A 655 ? 0.7838 0.6342 0.7874 0.1210 0.0306 -0.0025 963 ARG A CZ 4970 N NH1 . ARG A 655 ? 0.8103 0.6717 0.8188 0.1237 0.0230 0.0004 963 ARG A NH1 4971 N NH2 . ARG A 655 ? 0.8156 0.6581 0.8157 0.1292 0.0300 -0.0038 963 ARG A NH2 4972 N N . GLN A 656 ? 0.2962 0.2319 0.3690 0.1063 0.0446 -0.0215 964 GLN A N 4973 C CA . GLN A 656 ? 0.3139 0.2565 0.3918 0.1053 0.0503 -0.0263 964 GLN A CA 4974 C C . GLN A 656 ? 0.2634 0.2296 0.3560 0.0984 0.0522 -0.0278 964 GLN A C 4975 O O . GLN A 656 ? 0.2254 0.1911 0.3157 0.0912 0.0583 -0.0304 964 GLN A O 4976 C CB . GLN A 656 ? 0.3691 0.3145 0.4516 0.1169 0.0478 -0.0292 964 GLN A CB 4977 C CG . GLN A 656 ? 0.3972 0.3481 0.4828 0.1165 0.0542 -0.0341 964 GLN A CG 4978 C CD . GLN A 656 ? 0.4803 0.4099 0.5494 0.1097 0.0610 -0.0352 964 GLN A CD 4979 O OE1 . GLN A 656 ? 0.5359 0.4704 0.6056 0.1017 0.0662 -0.0374 964 GLN A OE1 4980 N NE2 . GLN A 656 ? 0.4704 0.3758 0.5243 0.1124 0.0607 -0.0339 964 GLN A NE2 4981 N N . GLU A 657 ? 0.2753 0.2607 0.3815 0.1000 0.0466 -0.0264 965 GLU A N 4982 C CA . GLU A 657 ? 0.2826 0.2887 0.4013 0.0921 0.0485 -0.0273 965 GLU A CA 4983 C C . GLU A 657 ? 0.2179 0.2188 0.3311 0.0809 0.0511 -0.0261 965 GLU A C 4984 O O . GLU A 657 ? 0.1635 0.1718 0.2789 0.0737 0.0554 -0.0282 965 GLU A O 4985 C CB . GLU A 657 ? 0.3485 0.3754 0.4821 0.0950 0.0418 -0.0261 965 GLU A CB 4986 C CG . GLU A 657 ? 0.3916 0.4370 0.5364 0.0855 0.0443 -0.0268 965 GLU A CG 4987 C CD . GLU A 657 ? 0.3986 0.4656 0.5594 0.0873 0.0394 -0.0267 965 GLU A CD 4988 O OE1 . GLU A 657 ? 0.3143 0.3830 0.4769 0.0911 0.0313 -0.0243 965 GLU A OE1 4989 O OE2 . GLU A 657 ? 0.4410 0.5224 0.6118 0.0845 0.0439 -0.0291 965 GLU A OE2 4990 N N . TYR A 658 ? 0.2059 0.1935 0.3106 0.0801 0.0483 -0.0230 966 TYR A N 4991 C CA . TYR A 658 ? 0.1880 0.1704 0.2847 0.0693 0.0496 -0.0226 966 TYR A CA 4992 C C . TYR A 658 ? 0.1917 0.1637 0.2794 0.0642 0.0567 -0.0267 966 TYR A C 4993 O O . TYR A 658 ? 0.1928 0.1707 0.2798 0.0562 0.0584 -0.0289 966 TYR A O 4994 C CB . TYR A 658 ? 0.2112 0.1796 0.2963 0.0689 0.0453 -0.0185 966 TYR A CB 4995 C CG . TYR A 658 ? 0.2083 0.1731 0.2851 0.0579 0.0453 -0.0181 966 TYR A CG 4996 C CD1 . TYR A 658 ? 0.1985 0.1716 0.2772 0.0548 0.0395 -0.0150 966 TYR A CD1 4997 C CD2 . TYR A 658 ? 0.1968 0.1498 0.2639 0.0512 0.0508 -0.0214 966 TYR A CD2 4998 C CE1 . TYR A 658 ? 0.2226 0.1933 0.2943 0.0459 0.0396 -0.0151 966 TYR A CE1 4999 C CE2 . TYR A 658 ? 0.1836 0.1357 0.2454 0.0418 0.0505 -0.0220 966 TYR A CE2 5000 C CZ . TYR A 658 ? 0.2272 0.1884 0.2913 0.0395 0.0451 -0.0188 966 TYR A CZ 5001 O OH . TYR A 658 ? 0.2151 0.1764 0.2745 0.0310 0.0450 -0.0199 966 TYR A OH 5002 N N . GLU A 659 ? 0.2008 0.1560 0.2803 0.0694 0.0604 -0.0282 967 GLU A N 5003 C CA . GLU A 659 ? 0.2263 0.1709 0.2967 0.0649 0.0665 -0.0328 967 GLU A CA 5004 C C . GLU A 659 ? 0.2328 0.1914 0.3092 0.0641 0.0692 -0.0361 967 GLU A C 5005 O O . GLU A 659 ? 0.2662 0.2243 0.3378 0.0573 0.0722 -0.0395 967 GLU A O 5006 C CB . GLU A 659 ? 0.2963 0.2202 0.3546 0.0702 0.0682 -0.0332 967 GLU A CB 5007 C CG . GLU A 659 ? 0.3642 0.2691 0.4114 0.0692 0.0671 -0.0299 967 GLU A CG 5008 C CD . GLU A 659 ? 0.4098 0.2928 0.4433 0.0745 0.0685 -0.0298 967 GLU A CD 5009 O OE1 . GLU A 659 ? 0.3619 0.2441 0.3947 0.0783 0.0705 -0.0330 967 GLU A OE1 5010 O OE2 . GLU A 659 ? 0.4026 0.2685 0.4248 0.0747 0.0676 -0.0263 967 GLU A OE2 5011 N N . ASP A 660 ? 0.2270 0.1978 0.3131 0.0712 0.0681 -0.0352 968 ASP A N 5012 C CA . ASP A 660 ? 0.2088 0.1917 0.2998 0.0707 0.0719 -0.0380 968 ASP A CA 5013 C C . ASP A 660 ? 0.2180 0.2137 0.3136 0.0626 0.0723 -0.0377 968 ASP A C 5014 O O . ASP A 660 ? 0.2142 0.2104 0.3047 0.0586 0.0766 -0.0403 968 ASP A O 5015 C CB . ASP A 660 ? 0.2402 0.2355 0.3426 0.0797 0.0706 -0.0377 968 ASP A CB 5016 C CG . ASP A 660 ? 0.3261 0.3084 0.4219 0.0887 0.0712 -0.0395 968 ASP A CG 5017 O OD1 . ASP A 660 ? 0.3544 0.3184 0.4364 0.0867 0.0744 -0.0414 968 ASP A OD1 5018 O OD2 . ASP A 660 ? 0.2858 0.2762 0.3900 0.0978 0.0682 -0.0396 968 ASP A OD2 5019 N N . ILE A 661 ? 0.2139 0.2186 0.3174 0.0607 0.0675 -0.0344 969 ILE A N 5020 C CA . ILE A 661 ? 0.2302 0.2448 0.3362 0.0532 0.0672 -0.0339 969 ILE A CA 5021 C C . ILE A 661 ? 0.2172 0.2210 0.3106 0.0467 0.0688 -0.0365 969 ILE A C 5022 O O . ILE A 661 ? 0.1785 0.1841 0.2667 0.0425 0.0718 -0.0387 969 ILE A O 5023 C CB . ILE A 661 ? 0.2016 0.2257 0.3171 0.0525 0.0608 -0.0302 969 ILE A CB 5024 C CG1 . ILE A 661 ? 0.2433 0.2821 0.3727 0.0576 0.0582 -0.0290 969 ILE A CG1 5025 C CG2 . ILE A 661 ? 0.1755 0.2055 0.2895 0.0443 0.0602 -0.0299 969 ILE A CG2 5026 C CD1 . ILE A 661 ? 0.2197 0.2661 0.3572 0.0588 0.0503 -0.0257 969 ILE A CD1 5027 N N . ALA A 662 ? 0.1983 0.1906 0.2848 0.0455 0.0661 -0.0361 970 ALA A N 5028 C CA . ALA A 662 ? 0.2303 0.2145 0.3050 0.0384 0.0657 -0.0391 970 ALA A CA 5029 C C . ALA A 662 ? 0.1949 0.1708 0.2612 0.0381 0.0714 -0.0448 970 ALA A C 5030 O O . ALA A 662 ? 0.2289 0.2046 0.2877 0.0331 0.0712 -0.0482 970 ALA A O 5031 C CB . ALA A 662 ? 0.1951 0.1682 0.2642 0.0363 0.0627 -0.0379 970 ALA A CB 5032 N N . VAL A 663 ? 0.1767 0.1457 0.2423 0.0439 0.0749 -0.0455 971 VAL A N 5033 C CA . VAL A 663 ? 0.1896 0.1503 0.2449 0.0437 0.0786 -0.0501 971 VAL A CA 5034 C C . VAL A 663 ? 0.2073 0.1781 0.2629 0.0437 0.0812 -0.0506 971 VAL A C 5035 O O . VAL A 663 ? 0.2352 0.2013 0.2801 0.0410 0.0826 -0.0545 971 VAL A O 5036 C CB . VAL A 663 ? 0.3078 0.2576 0.3605 0.0502 0.0808 -0.0504 971 VAL A CB 5037 C CG1 . VAL A 663 ? 0.2563 0.2005 0.3001 0.0513 0.0847 -0.0548 971 VAL A CG1 5038 C CG2 . VAL A 663 ? 0.2963 0.2299 0.3428 0.0485 0.0797 -0.0508 971 VAL A CG2 5039 N N . LYS A 664 ? 0.2017 0.1857 0.2688 0.0466 0.0816 -0.0469 972 LYS A N 5040 C CA . LYS A 664 ? 0.2102 0.2033 0.2780 0.0455 0.0852 -0.0469 972 LYS A CA 5041 C C . LYS A 664 ? 0.2228 0.2160 0.2828 0.0391 0.0840 -0.0478 972 LYS A C 5042 O O . LYS A 664 ? 0.2311 0.2207 0.2804 0.0378 0.0871 -0.0502 972 LYS A O 5043 C CB . LYS A 664 ? 0.1880 0.1967 0.2717 0.0481 0.0853 -0.0433 972 LYS A CB 5044 C CG . LYS A 664 ? 0.2014 0.2187 0.2864 0.0458 0.0906 -0.0433 972 LYS A CG 5045 C CD . LYS A 664 ? 0.2207 0.2547 0.3235 0.0477 0.0908 -0.0410 972 LYS A CD 5046 C CE . LYS A 664 ? 0.2870 0.3281 0.3908 0.0441 0.0976 -0.0413 972 LYS A CE 5047 N NZ . LYS A 664 ? 0.2812 0.3400 0.4037 0.0444 0.0980 -0.0399 972 LYS A NZ 5048 N N . LEU A 665 ? 0.2012 0.1977 0.2653 0.0360 0.0792 -0.0460 973 LEU A N 5049 C CA . LEU A 665 ? 0.1758 0.1725 0.2321 0.0310 0.0771 -0.0473 973 LEU A CA 5050 C C . LEU A 665 ? 0.2099 0.1953 0.2511 0.0291 0.0762 -0.0530 973 LEU A C 5051 O O . LEU A 665 ? 0.2587 0.2420 0.2887 0.0273 0.0759 -0.0554 973 LEU A O 5052 C CB . LEU A 665 ? 0.1496 0.1523 0.2120 0.0280 0.0699 -0.0437 973 LEU A CB 5053 C CG . LEU A 665 ? 0.2254 0.2404 0.3011 0.0287 0.0691 -0.0388 973 LEU A CG 5054 C CD1 . LEU A 665 ? 0.1786 0.1967 0.2595 0.0276 0.0614 -0.0352 973 LEU A CD1 5055 C CD2 . LEU A 665 ? 0.2322 0.2512 0.3033 0.0251 0.0709 -0.0382 973 LEU A CD2 5056 N N . GLY A 666 ? 0.1713 0.1485 0.2116 0.0298 0.0754 -0.0554 974 GLY A N 5057 C CA . GLY A 666 ? 0.2027 0.1702 0.2305 0.0272 0.0738 -0.0616 974 GLY A CA 5058 C C . GLY A 666 ? 0.2411 0.2012 0.2580 0.0299 0.0773 -0.0647 974 GLY A C 5059 O O . GLY A 666 ? 0.2499 0.2027 0.2558 0.0281 0.0749 -0.0702 974 GLY A O 5060 N N . THR A 667 ? 0.2357 0.1985 0.2561 0.0343 0.0823 -0.0616 975 THR A N 5061 C CA . THR A 667 ? 0.2461 0.2015 0.2563 0.0375 0.0861 -0.0646 975 THR A CA 5062 C C . THR A 667 ? 0.2816 0.2421 0.2888 0.0391 0.0909 -0.0627 975 THR A C 5063 O O . THR A 667 ? 0.2688 0.2225 0.2627 0.0403 0.0929 -0.0658 975 THR A O 5064 C CB . THR A 667 ? 0.2410 0.1915 0.2560 0.0421 0.0890 -0.0645 975 THR A CB 5065 O OG1 . THR A 667 ? 0.2211 0.1821 0.2507 0.0455 0.0911 -0.0594 975 THR A OG1 5066 C CG2 . THR A 667 ? 0.2759 0.2166 0.2900 0.0400 0.0857 -0.0669 975 THR A CG2 5067 N N . ASP A 668 ? 0.2421 0.2139 0.2613 0.0388 0.0929 -0.0578 976 ASP A N 5068 C CA . ASP A 668 ? 0.2192 0.1958 0.2367 0.0387 0.0986 -0.0558 976 ASP A CA 5069 C C . ASP A 668 ? 0.2679 0.2434 0.2761 0.0344 0.0960 -0.0554 976 ASP A C 5070 O O . ASP A 668 ? 0.2407 0.2244 0.2581 0.0318 0.0947 -0.0520 976 ASP A O 5071 C CB . ASP A 668 ? 0.2332 0.2234 0.2698 0.0398 0.1015 -0.0515 976 ASP A CB 5072 C CG . ASP A 668 ? 0.2639 0.2598 0.3012 0.0386 0.1089 -0.0499 976 ASP A CG 5073 O OD1 . ASP A 668 ? 0.2989 0.2876 0.3211 0.0362 0.1115 -0.0506 976 ASP A OD1 5074 O OD2 . ASP A 668 ? 0.2451 0.2526 0.2980 0.0403 0.1119 -0.0481 976 ASP A OD2 5075 N N . LEU A 669 ? 0.2868 0.2519 0.2762 0.0345 0.0946 -0.0591 977 LEU A N 5076 C CA . LEU A 669 ? 0.3032 0.2654 0.2811 0.0319 0.0900 -0.0598 977 LEU A CA 5077 C C . LEU A 669 ? 0.2786 0.2434 0.2544 0.0299 0.0947 -0.0554 977 LEU A C 5078 O O . LEU A 669 ? 0.2626 0.2278 0.2347 0.0276 0.0910 -0.0544 977 LEU A O 5079 C CB . LEU A 669 ? 0.3376 0.2887 0.2957 0.0337 0.0856 -0.0655 977 LEU A CB 5080 C CG . LEU A 669 ? 0.3444 0.2923 0.3042 0.0342 0.0807 -0.0707 977 LEU A CG 5081 C CD1 . LEU A 669 ? 0.3758 0.3156 0.3179 0.0354 0.0741 -0.0772 977 LEU A CD1 5082 C CD2 . LEU A 669 ? 0.3770 0.3316 0.3516 0.0310 0.0765 -0.0699 977 LEU A CD2 5083 N N . GLU A 670 ? 0.2282 0.1941 0.2060 0.0304 0.1031 -0.0531 978 GLU A N 5084 C CA . GLU A 670 ? 0.3000 0.2682 0.2777 0.0270 0.1089 -0.0490 978 GLU A CA 5085 C C . GLU A 670 ? 0.2595 0.2418 0.2591 0.0240 0.1079 -0.0456 978 GLU A C 5086 O O . GLU A 670 ? 0.2609 0.2444 0.2596 0.0202 0.1083 -0.0430 978 GLU A O 5087 C CB . GLU A 670 ? 0.3436 0.3103 0.3194 0.0275 0.1188 -0.0481 978 GLU A CB 5088 C CG . GLU A 670 ? 0.3995 0.3508 0.3508 0.0301 0.1201 -0.0508 978 GLU A CG 5089 C CD . GLU A 670 ? 0.4761 0.4157 0.4060 0.0288 0.1167 -0.0502 978 GLU A CD 5090 O OE1 . GLU A 670 ? 0.5443 0.4812 0.4699 0.0253 0.1226 -0.0464 978 GLU A OE1 5091 O OE2 . GLU A 670 ? 0.4908 0.4240 0.4083 0.0313 0.1076 -0.0539 978 GLU A OE2 5092 N N . TYR A 671 ? 0.2156 0.2076 0.2336 0.0261 0.1062 -0.0455 979 TYR A N 5093 C CA . TYR A 671 ? 0.2073 0.2128 0.2460 0.0244 0.1032 -0.0425 979 TYR A CA 5094 C C . TYR A 671 ? 0.1726 0.1766 0.2084 0.0226 0.0957 -0.0425 979 TYR A C 5095 O O . TYR A 671 ? 0.1929 0.2036 0.2359 0.0192 0.0941 -0.0397 979 TYR A O 5096 C CB . TYR A 671 ? 0.1875 0.2003 0.2419 0.0287 0.1015 -0.0428 979 TYR A CB 5097 C CG . TYR A 671 ? 0.2485 0.2751 0.3232 0.0283 0.0973 -0.0397 979 TYR A CG 5098 C CD1 . TYR A 671 ? 0.2918 0.3304 0.3793 0.0256 0.1004 -0.0375 979 TYR A CD1 5099 C CD2 . TYR A 671 ? 0.2340 0.2610 0.3144 0.0304 0.0901 -0.0393 979 TYR A CD2 5100 C CE1 . TYR A 671 ? 0.2748 0.3262 0.3802 0.0255 0.0951 -0.0353 979 TYR A CE1 5101 C CE2 . TYR A 671 ? 0.2610 0.2994 0.3579 0.0309 0.0853 -0.0365 979 TYR A CE2 5102 C CZ . TYR A 671 ? 0.2678 0.3187 0.3771 0.0287 0.0872 -0.0347 979 TYR A CZ 5103 O OH . TYR A 671 ? 0.2284 0.2910 0.3535 0.0295 0.0813 -0.0325 979 TYR A OH 5104 N N . LEU A 672 ? 0.1748 0.1704 0.2000 0.0243 0.0907 -0.0461 980 LEU A N 5105 C CA . LEU A 672 ? 0.2234 0.2181 0.2444 0.0223 0.0815 -0.0464 980 LEU A CA 5106 C C . LEU A 672 ? 0.1695 0.1610 0.1780 0.0195 0.0797 -0.0444 980 LEU A C 5107 O O . LEU A 672 ? 0.1657 0.1625 0.1787 0.0169 0.0734 -0.0414 980 LEU A O 5108 C CB . LEU A 672 ? 0.1936 0.1797 0.2039 0.0238 0.0774 -0.0520 980 LEU A CB 5109 C CG . LEU A 672 ? 0.2342 0.2213 0.2411 0.0215 0.0673 -0.0531 980 LEU A CG 5110 C CD1 . LEU A 672 ? 0.1822 0.1786 0.2054 0.0196 0.0629 -0.0488 980 LEU A CD1 5111 C CD2 . LEU A 672 ? 0.2617 0.2420 0.2608 0.0221 0.0643 -0.0599 980 LEU A CD2 5112 N N . LYS A 673 ? 0.2227 0.2039 0.2137 0.0204 0.0852 -0.0462 981 LYS A N 5113 C CA . LYS A 673 ? 0.2806 0.2547 0.2556 0.0185 0.0842 -0.0442 981 LYS A CA 5114 C C . LYS A 673 ? 0.2700 0.2514 0.2564 0.0140 0.0874 -0.0388 981 LYS A C 5115 O O . LYS A 673 ? 0.2448 0.2249 0.2262 0.0117 0.0817 -0.0362 981 LYS A O 5116 C CB . LYS A 673 ? 0.3653 0.3244 0.3172 0.0210 0.0911 -0.0468 981 LYS A CB 5117 C CG . LYS A 673 ? 0.4679 0.4153 0.3987 0.0200 0.0906 -0.0446 981 LYS A CG 5118 C CD . LYS A 673 ? 0.5879 0.5203 0.4949 0.0233 0.0926 -0.0461 981 LYS A CD 5119 C CE . LYS A 673 ? 0.6460 0.5768 0.5465 0.0280 0.0836 -0.0521 981 LYS A CE 5120 N NZ . LYS A 673 ? 0.7460 0.6640 0.6252 0.0313 0.0839 -0.0536 981 LYS A NZ 5121 N N . LYS A 674 ? 0.2434 0.2328 0.2455 0.0129 0.0963 -0.0376 982 LYS A N 5122 C CA . LYS A 674 ? 0.2270 0.2263 0.2443 0.0080 0.0994 -0.0336 982 LYS A CA 5123 C C . LYS A 674 ? 0.2442 0.2539 0.2758 0.0066 0.0888 -0.0313 982 LYS A C 5124 O O . LYS A 674 ? 0.2267 0.2365 0.2570 0.0026 0.0857 -0.0284 982 LYS A O 5125 C CB . LYS A 674 ? 0.2428 0.2530 0.2790 0.0082 0.1094 -0.0343 982 LYS A CB 5126 C CG . LYS A 674 ? 0.3268 0.3506 0.3827 0.0029 0.1117 -0.0316 982 LYS A CG 5127 C CD . LYS A 674 ? 0.4181 0.4547 0.4929 0.0042 0.1151 -0.0320 982 LYS A CD 5128 C CE . LYS A 674 ? 0.4926 0.5443 0.5880 -0.0009 0.1151 -0.0304 982 LYS A CE 5129 N NZ . LYS A 674 ? 0.5422 0.6093 0.6580 0.0023 0.1154 -0.0318 982 LYS A NZ 5130 N N . VAL A 675 ? 0.2277 0.2443 0.2714 0.0101 0.0837 -0.0324 983 VAL A N 5131 C CA . VAL A 675 ? 0.2187 0.2437 0.2742 0.0096 0.0742 -0.0301 983 VAL A CA 5132 C C . VAL A 675 ? 0.2437 0.2618 0.2848 0.0086 0.0654 -0.0296 983 VAL A C 5133 O O . VAL A 675 ? 0.2098 0.2318 0.2548 0.0062 0.0597 -0.0268 983 VAL A O 5134 C CB . VAL A 675 ? 0.2219 0.2524 0.2903 0.0139 0.0717 -0.0312 983 VAL A CB 5135 C CG1 . VAL A 675 ? 0.1904 0.2262 0.2664 0.0137 0.0621 -0.0287 983 VAL A CG1 5136 C CG2 . VAL A 675 ? 0.2543 0.2940 0.3394 0.0161 0.0789 -0.0316 983 VAL A CG2 5137 N N . ARG A 676 ? 0.2132 0.2216 0.2378 0.0107 0.0639 -0.0330 984 ARG A N 5138 C CA . ARG A 676 ? 0.2107 0.2142 0.2222 0.0107 0.0556 -0.0336 984 ARG A CA 5139 C C . ARG A 676 ? 0.2427 0.2399 0.2424 0.0084 0.0561 -0.0309 984 ARG A C 5140 O O . ARG A 676 ? 0.2483 0.2456 0.2448 0.0076 0.0491 -0.0293 984 ARG A O 5141 C CB . ARG A 676 ? 0.2473 0.2431 0.2444 0.0139 0.0534 -0.0391 984 ARG A CB 5142 C CG . ARG A 676 ? 0.2224 0.2227 0.2298 0.0150 0.0514 -0.0421 984 ARG A CG 5143 C CD . ARG A 676 ? 0.2251 0.2190 0.2198 0.0170 0.0484 -0.0486 984 ARG A CD 5144 N NE . ARG A 676 ? 0.2242 0.2167 0.2071 0.0177 0.0406 -0.0505 984 ARG A NE 5145 C CZ . ARG A 676 ? 0.1908 0.1902 0.1797 0.0167 0.0334 -0.0513 984 ARG A CZ 5146 N NH1 . ARG A 676 ? 0.2038 0.2102 0.2086 0.0145 0.0334 -0.0496 984 ARG A NH1 5147 N NH2 . ARG A 676 ? 0.2153 0.2140 0.1932 0.0185 0.0265 -0.0537 984 ARG A NH2 5148 N N . GLY A 677 ? 0.2575 0.2481 0.2499 0.0071 0.0652 -0.0304 985 GLY A N 5149 C CA . GLY A 677 ? 0.2909 0.2723 0.2702 0.0040 0.0677 -0.0276 985 GLY A CA 5150 C C . GLY A 677 ? 0.2767 0.2681 0.2732 -0.0010 0.0666 -0.0238 985 GLY A C 5151 O O . GLY A 677 ? 0.2578 0.2436 0.2461 -0.0034 0.0632 -0.0215 985 GLY A O 5152 N N . LYS A 678 ? 0.2209 0.2265 0.2407 -0.0018 0.0690 -0.0236 986 LYS A N 5153 C CA . LYS A 678 ? 0.2708 0.2880 0.3094 -0.0057 0.0669 -0.0210 986 LYS A CA 5154 C C . LYS A 678 ? 0.2394 0.2590 0.2787 -0.0045 0.0552 -0.0196 986 LYS A C 5155 O O . LYS A 678 ? 0.2112 0.2304 0.2505 -0.0079 0.0517 -0.0174 986 LYS A O 5156 C CB . LYS A 678 ? 0.3180 0.3501 0.3804 -0.0046 0.0710 -0.0220 986 LYS A CB 5157 C CG . LYS A 678 ? 0.3528 0.3982 0.4359 -0.0084 0.0700 -0.0205 986 LYS A CG 5158 C CD . LYS A 678 ? 0.4129 0.4731 0.5185 -0.0059 0.0748 -0.0225 986 LYS A CD 5159 C CE . LYS A 678 ? 0.4462 0.5220 0.5741 -0.0090 0.0721 -0.0222 986 LYS A CE 5160 N NZ . LYS A 678 ? 0.4776 0.5692 0.6282 -0.0040 0.0733 -0.0245 986 LYS A NZ 5161 N N . VAL A 679 ? 0.1939 0.2150 0.2332 0.0001 0.0496 -0.0212 987 VAL A N 5162 C CA . VAL A 679 ? 0.1902 0.2133 0.2292 0.0013 0.0397 -0.0203 987 VAL A CA 5163 C C . VAL A 679 ? 0.2084 0.2210 0.2279 0.0010 0.0356 -0.0201 987 VAL A C 5164 O O . VAL A 679 ? 0.2091 0.2222 0.2283 -0.0002 0.0298 -0.0180 987 VAL A O 5165 C CB . VAL A 679 ? 0.1897 0.2151 0.2313 0.0052 0.0364 -0.0227 987 VAL A CB 5166 C CG1 . VAL A 679 ? 0.2125 0.2392 0.2520 0.0061 0.0276 -0.0221 987 VAL A CG1 5167 C CG2 . VAL A 679 ? 0.1962 0.2297 0.2553 0.0066 0.0396 -0.0224 987 VAL A CG2 5168 N N . TRP A 680 ? 0.2317 0.2338 0.2337 0.0029 0.0382 -0.0225 988 TRP A N 5169 C CA . TRP A 680 ? 0.2397 0.2301 0.2203 0.0046 0.0339 -0.0230 988 TRP A CA 5170 C C . TRP A 680 ? 0.2503 0.2337 0.2250 0.0005 0.0352 -0.0192 988 TRP A C 5171 O O . TRP A 680 ? 0.2701 0.2488 0.2356 0.0014 0.0285 -0.0182 988 TRP A O 5172 C CB . TRP A 680 ? 0.2636 0.2428 0.2256 0.0080 0.0374 -0.0263 988 TRP A CB 5173 C CG . TRP A 680 ? 0.2894 0.2558 0.2273 0.0120 0.0317 -0.0277 988 TRP A CG 5174 C CD1 . TRP A 680 ? 0.3444 0.2939 0.2605 0.0121 0.0352 -0.0261 988 TRP A CD1 5175 C CD2 . TRP A 680 ? 0.2688 0.2378 0.2014 0.0170 0.0218 -0.0313 988 TRP A CD2 5176 N NE1 . TRP A 680 ? 0.3792 0.3199 0.2756 0.0182 0.0270 -0.0284 988 TRP A NE1 5177 C CE2 . TRP A 680 ? 0.3542 0.3084 0.2619 0.0213 0.0185 -0.0319 988 TRP A CE2 5178 C CE3 . TRP A 680 ? 0.3199 0.3023 0.2664 0.0183 0.0158 -0.0342 988 TRP A CE3 5179 C CZ2 . TRP A 680 ? 0.3701 0.3247 0.2682 0.0276 0.0086 -0.0360 988 TRP A CZ2 5180 C CZ3 . TRP A 680 ? 0.3212 0.3046 0.2592 0.0232 0.0071 -0.0383 988 TRP A CZ3 5181 C CH2 . TRP A 680 ? 0.3108 0.2816 0.2258 0.0282 0.0032 -0.0395 988 TRP A CH2 5182 N N . LYS A 681 ? 0.2447 0.2274 0.2248 -0.0043 0.0444 -0.0176 989 LYS A N 5183 C CA . LYS A 681 ? 0.2695 0.2454 0.2456 -0.0101 0.0472 -0.0146 989 LYS A CA 5184 C C . LYS A 681 ? 0.2435 0.2313 0.2382 -0.0133 0.0416 -0.0128 989 LYS A C 5185 O O . LYS A 681 ? 0.2663 0.2474 0.2531 -0.0151 0.0369 -0.0111 989 LYS A O 5186 C CB . LYS A 681 ? 0.3293 0.3026 0.3079 -0.0154 0.0601 -0.0141 989 LYS A CB 5187 C CG . LYS A 681 ? 0.4301 0.3976 0.4080 -0.0233 0.0644 -0.0115 989 LYS A CG 5188 C CD . LYS A 681 ? 0.5365 0.5062 0.5232 -0.0298 0.0783 -0.0117 989 LYS A CD 5189 C CE . LYS A 681 ? 0.5885 0.5534 0.5767 -0.0394 0.0829 -0.0099 989 LYS A CE 5190 N NZ . LYS A 681 ? 0.5680 0.5466 0.5754 -0.0415 0.0731 -0.0097 989 LYS A NZ 5191 N N . GLN A 682 ? 0.2012 0.2054 0.2193 -0.0132 0.0415 -0.0133 990 GLN A N 5192 C CA A GLN A 682 ? 0.2061 0.2222 0.2428 -0.0157 0.0365 -0.0120 990 GLN A CA 5193 C CA B GLN A 682 ? 0.2030 0.2185 0.2390 -0.0159 0.0366 -0.0120 990 GLN A CA 5194 C C . GLN A 682 ? 0.2214 0.2376 0.2544 -0.0122 0.0254 -0.0112 990 GLN A C 5195 O O . GLN A 682 ? 0.2412 0.2619 0.2821 -0.0143 0.0203 -0.0099 990 GLN A O 5196 C CB A GLN A 682 ? 0.2061 0.2384 0.2666 -0.0145 0.0389 -0.0131 990 GLN A CB 5197 C CB B GLN A 682 ? 0.2101 0.2419 0.2708 -0.0160 0.0402 -0.0130 990 GLN A CB 5198 C CG A GLN A 682 ? 0.2260 0.2631 0.2969 -0.0188 0.0498 -0.0142 990 GLN A CG 5199 C CG B GLN A 682 ? 0.2367 0.2700 0.3036 -0.0213 0.0517 -0.0139 990 GLN A CG 5200 C CD A GLN A 682 ? 0.2536 0.2934 0.3325 -0.0266 0.0519 -0.0137 990 GLN A CD 5201 C CD B GLN A 682 ? 0.2571 0.3063 0.3466 -0.0194 0.0561 -0.0159 990 GLN A CD 5202 O OE1 A GLN A 682 ? 0.2946 0.3236 0.3620 -0.0322 0.0594 -0.0132 990 GLN A OE1 5203 O OE1 B GLN A 682 ? 0.2919 0.3434 0.3865 -0.0221 0.0665 -0.0173 990 GLN A OE1 5204 N NE2 A GLN A 682 ? 0.2489 0.3022 0.3467 -0.0271 0.0453 -0.0139 990 GLN A NE2 5205 N NE2 B GLN A 682 ? 0.2512 0.3104 0.3533 -0.0143 0.0485 -0.0160 990 GLN A NE2 5206 N N . ARG A 683 ? 0.1783 0.1903 0.1997 -0.0069 0.0217 -0.0124 991 ARG A N 5207 C CA . ARG A 683 ? 0.2663 0.2793 0.2847 -0.0038 0.0123 -0.0120 991 ARG A CA 5208 C C . ARG A 683 ? 0.2576 0.2596 0.2614 -0.0056 0.0089 -0.0105 991 ARG A C 5209 O O . ARG A 683 ? 0.2748 0.2777 0.2782 -0.0045 0.0017 -0.0096 991 ARG A O 5210 C CB . ARG A 683 ? 0.3325 0.3452 0.3437 0.0015 0.0096 -0.0146 991 ARG A CB 5211 C CG . ARG A 683 ? 0.3202 0.3211 0.3101 0.0040 0.0089 -0.0166 991 ARG A CG 5212 C CD . ARG A 683 ? 0.2591 0.2605 0.2446 0.0078 0.0099 -0.0207 991 ARG A CD 5213 N NE . ARG A 683 ? 0.2721 0.2602 0.2367 0.0098 0.0114 -0.0221 991 ARG A NE 5214 C CZ . ARG A 683 ? 0.3071 0.2893 0.2555 0.0150 0.0056 -0.0250 991 ARG A CZ 5215 N NH1 . ARG A 683 ? 0.3052 0.2958 0.2580 0.0181 -0.0015 -0.0274 991 ARG A NH1 5216 N NH2 . ARG A 683 ? 0.3229 0.2905 0.2501 0.0175 0.0070 -0.0258 991 ARG A NH2 5217 N N . ILE A 684 ? 0.2243 0.2145 0.2152 -0.0086 0.0147 -0.0102 992 ILE A N 5218 C CA . ILE A 684 ? 0.2643 0.2403 0.2390 -0.0109 0.0131 -0.0087 992 ILE A CA 5219 C C . ILE A 684 ? 0.2672 0.2449 0.2533 -0.0193 0.0170 -0.0070 992 ILE A C 5220 O O . ILE A 684 ? 0.3209 0.2951 0.3053 -0.0217 0.0118 -0.0060 992 ILE A O 5221 C CB . ILE A 684 ? 0.3059 0.2636 0.2553 -0.0091 0.0173 -0.0092 992 ILE A CB 5222 C CG1 . ILE A 684 ? 0.3384 0.2959 0.2773 -0.0006 0.0122 -0.0121 992 ILE A CG1 5223 C CG2 . ILE A 684 ? 0.3563 0.2959 0.2861 -0.0112 0.0158 -0.0072 992 ILE A CG2 5224 C CD1 . ILE A 684 ? 0.3452 0.3061 0.2822 0.0043 0.0019 -0.0128 992 ILE A CD1 5225 N N . SER A 685 ? 0.2515 0.2352 0.2500 -0.0239 0.0261 -0.0075 993 SER A N 5226 C CA . SER A 685 ? 0.2946 0.2806 0.3046 -0.0329 0.0313 -0.0071 993 SER A CA 5227 C C . SER A 685 ? 0.2502 0.2557 0.2872 -0.0346 0.0262 -0.0079 993 SER A C 5228 O O . SER A 685 ? 0.2321 0.2405 0.2788 -0.0417 0.0267 -0.0084 993 SER A O 5229 C CB . SER A 685 ? 0.3319 0.3157 0.3430 -0.0377 0.0445 -0.0077 993 SER A CB 5230 O OG . SER A 685 ? 0.3233 0.3217 0.3502 -0.0339 0.0474 -0.0093 993 SER A OG 5231 N N . SER A 686 ? 0.1863 0.2043 0.2346 -0.0281 0.0212 -0.0084 994 SER A N 5232 C CA . SER A 686 ? 0.1659 0.2001 0.2362 -0.0274 0.0151 -0.0091 994 SER A CA 5233 C C . SER A 686 ? 0.2131 0.2433 0.2764 -0.0254 0.0042 -0.0079 994 SER A C 5234 O O . SER A 686 ? 0.2017 0.2180 0.2443 -0.0237 0.0016 -0.0068 994 SER A O 5235 C CB . SER A 686 ? 0.1465 0.1916 0.2278 -0.0206 0.0149 -0.0097 994 SER A CB 5236 O OG . SER A 686 ? 0.1833 0.2239 0.2536 -0.0143 0.0081 -0.0087 994 SER A OG 5237 N N . PRO A 687 ? 0.1895 0.2315 0.2691 -0.0247 -0.0025 -0.0085 995 PRO A N 5238 C CA . PRO A 687 ? 0.1981 0.2354 0.2692 -0.0219 -0.0127 -0.0075 995 PRO A CA 5239 C C . PRO A 687 ? 0.1864 0.2224 0.2493 -0.0136 -0.0172 -0.0061 995 PRO A C 5240 O O . PRO A 687 ? 0.1825 0.2138 0.2367 -0.0109 -0.0246 -0.0053 995 PRO A O 5241 C CB . PRO A 687 ? 0.1941 0.2447 0.2854 -0.0233 -0.0184 -0.0090 995 PRO A CB 5242 C CG . PRO A 687 ? 0.2038 0.2653 0.3136 -0.0291 -0.0104 -0.0115 995 PRO A CG 5243 C CD . PRO A 687 ? 0.2181 0.2770 0.3228 -0.0269 -0.0013 -0.0107 995 PRO A CD 5244 N N . LEU A 688 ? 0.1686 0.2084 0.2343 -0.0100 -0.0126 -0.0063 996 LEU A N 5245 C CA . LEU A 688 ? 0.1521 0.1928 0.2144 -0.0034 -0.0161 -0.0057 996 LEU A CA 5246 C C . LEU A 688 ? 0.1733 0.2047 0.2178 -0.0007 -0.0207 -0.0051 996 LEU A C 5247 O O . LEU A 688 ? 0.1876 0.2200 0.2306 0.0032 -0.0261 -0.0043 996 LEU A O 5248 C CB . LEU A 688 ? 0.1487 0.1920 0.2141 -0.0011 -0.0095 -0.0066 996 LEU A CB 5249 C CG . LEU A 688 ? 0.1475 0.1923 0.2127 0.0043 -0.0119 -0.0062 996 LEU A CG 5250 C CD1 . LEU A 688 ? 0.1545 0.2047 0.2297 0.0070 -0.0175 -0.0047 996 LEU A CD1 5251 C CD2 . LEU A 688 ? 0.1068 0.1533 0.1758 0.0057 -0.0054 -0.0077 996 LEU A CD2 5252 N N . PHE A 689 ? 0.1613 0.1835 0.1915 -0.0020 -0.0185 -0.0058 997 PHE A N 5253 C CA . PHE A 689 ? 0.1809 0.1954 0.1945 0.0018 -0.0228 -0.0062 997 PHE A CA 5254 C C . PHE A 689 ? 0.1691 0.1732 0.1707 -0.0002 -0.0267 -0.0055 997 PHE A C 5255 O O . PHE A 689 ? 0.2332 0.2286 0.2184 0.0032 -0.0295 -0.0062 997 PHE A O 5256 C CB . PHE A 689 ? 0.1830 0.1938 0.1867 0.0040 -0.0188 -0.0083 997 PHE A CB 5257 C CG . PHE A 689 ? 0.1541 0.1733 0.1669 0.0062 -0.0158 -0.0097 997 PHE A CG 5258 C CD1 . PHE A 689 ? 0.1712 0.1942 0.1833 0.0101 -0.0188 -0.0109 997 PHE A CD1 5259 C CD2 . PHE A 689 ? 0.1399 0.1626 0.1618 0.0041 -0.0093 -0.0102 997 PHE A CD2 5260 C CE1 . PHE A 689 ? 0.1540 0.1829 0.1739 0.0110 -0.0153 -0.0125 997 PHE A CE1 5261 C CE2 . PHE A 689 ? 0.1522 0.1805 0.1810 0.0061 -0.0065 -0.0118 997 PHE A CE2 5262 C CZ . PHE A 689 ? 0.1502 0.1810 0.1779 0.0091 -0.0095 -0.0129 997 PHE A CZ 5263 N N . ASN A 690 ? 0.1816 0.1865 0.1915 -0.0056 -0.0271 -0.0047 998 ASN A N 5264 C CA . ASN A 690 ? 0.2180 0.2111 0.2166 -0.0091 -0.0299 -0.0043 998 ASN A CA 5265 C C . ASN A 690 ? 0.1857 0.1793 0.1836 -0.0066 -0.0388 -0.0039 998 ASN A C 5266 O O . ASN A 690 ? 0.1890 0.1896 0.2000 -0.0092 -0.0419 -0.0040 998 ASN A O 5267 C CB . ASN A 690 ? 0.2145 0.2083 0.2232 -0.0179 -0.0246 -0.0046 998 ASN A CB 5268 C CG . ASN A 690 ? 0.2797 0.2570 0.2733 -0.0231 -0.0248 -0.0044 998 ASN A CG 5269 O OD1 . ASN A 690 ? 0.2674 0.2367 0.2501 -0.0212 -0.0319 -0.0042 998 ASN A OD1 5270 N ND2 . ASN A 690 ? 0.3314 0.3025 0.3236 -0.0301 -0.0163 -0.0046 998 ASN A ND2 5271 N N . THR A 691 ? 0.2091 0.1960 0.1915 -0.0007 -0.0429 -0.0039 999 THR A N 5272 C CA . THR A 691 ? 0.2426 0.2295 0.2221 0.0032 -0.0506 -0.0036 999 THR A CA 5273 C C . THR A 691 ? 0.2216 0.1995 0.1961 -0.0009 -0.0556 -0.0037 999 THR A C 5274 O O . THR A 691 ? 0.2465 0.2273 0.2251 0.0002 -0.0618 -0.0036 999 THR A O 5275 C CB . THR A 691 ? 0.2626 0.2457 0.2275 0.0106 -0.0527 -0.0044 999 THR A CB 5276 O OG1 . THR A 691 ? 0.3070 0.2787 0.2561 0.0113 -0.0509 -0.0053 999 THR A OG1 5277 C CG2 . THR A 691 ? 0.2433 0.2378 0.2170 0.0140 -0.0491 -0.0049 999 THR A CG2 5278 N N . LYS A 692 ? 0.1970 0.1625 0.1613 -0.0057 -0.0528 -0.0039 1000 LYS A N 5279 C CA . LYS A 692 ? 0.2297 0.1854 0.1897 -0.0113 -0.0565 -0.0045 1000 LYS A CA 5280 C C . LYS A 692 ? 0.2161 0.1844 0.1990 -0.0184 -0.0563 -0.0056 1000 LYS A C 5281 O O . LYS A 692 ? 0.1933 0.1632 0.1809 -0.0197 -0.0633 -0.0067 1000 LYS A O 5282 C CB . LYS A 692 ? 0.2767 0.2138 0.2193 -0.0157 -0.0521 -0.0044 1000 LYS A CB 5283 C CG . LYS A 692 ? 0.2979 0.2216 0.2334 -0.0222 -0.0557 -0.0053 1000 LYS A CG 5284 C CD . LYS A 692 ? 0.2966 0.2147 0.2206 -0.0154 -0.0655 -0.0057 1000 LYS A CD 5285 C CE . LYS A 692 ? 0.3729 0.2755 0.2876 -0.0216 -0.0696 -0.0070 1000 LYS A CE 5286 N NZ . LYS A 692 ? 0.3915 0.2871 0.2924 -0.0140 -0.0790 -0.0076 1000 LYS A NZ 5287 N N . GLN A 693 ? 0.1812 0.1592 0.1786 -0.0223 -0.0488 -0.0057 1001 GLN A N 5288 C CA . GLN A 693 ? 0.2362 0.2291 0.2578 -0.0280 -0.0485 -0.0075 1001 GLN A CA 5289 C C . GLN A 693 ? 0.2081 0.2136 0.2408 -0.0215 -0.0563 -0.0077 1001 GLN A C 5290 O O . GLN A 693 ? 0.2297 0.2421 0.2743 -0.0238 -0.0624 -0.0098 1001 GLN A O 5291 C CB . GLN A 693 ? 0.2388 0.2406 0.2734 -0.0315 -0.0384 -0.0077 1001 GLN A CB 5292 C CG . GLN A 693 ? 0.3091 0.3281 0.3703 -0.0369 -0.0375 -0.0105 1001 GLN A CG 5293 C CD . GLN A 693 ? 0.3807 0.4073 0.4537 -0.0406 -0.0263 -0.0110 1001 GLN A CD 5294 O OE1 . GLN A 693 ? 0.4260 0.4437 0.4857 -0.0392 -0.0194 -0.0092 1001 GLN A OE1 5295 N NE2 . GLN A 693 ? 0.4097 0.4531 0.5073 -0.0449 -0.0247 -0.0140 1001 GLN A NE2 5296 N N . TYR A 694 ? 0.2015 0.2092 0.2293 -0.0134 -0.0562 -0.0058 1002 TYR A N 5297 C CA . TYR A 694 ? 0.1917 0.2081 0.2264 -0.0067 -0.0620 -0.0053 1002 TYR A CA 5298 C C . TYR A 694 ? 0.2051 0.2151 0.2308 -0.0044 -0.0718 -0.0057 1002 TYR A C 5299 O O . TYR A 694 ? 0.2068 0.2236 0.2423 -0.0030 -0.0784 -0.0068 1002 TYR A O 5300 C CB . TYR A 694 ? 0.1661 0.1825 0.1939 0.0001 -0.0588 -0.0033 1002 TYR A CB 5301 C CG . TYR A 694 ? 0.1746 0.1975 0.2081 0.0065 -0.0628 -0.0023 1002 TYR A CG 5302 C CD1 . TYR A 694 ? 0.1694 0.2027 0.2180 0.0078 -0.0596 -0.0022 1002 TYR A CD1 5303 C CD2 . TYR A 694 ? 0.2087 0.2253 0.2298 0.0112 -0.0667 -0.0013 1002 TYR A CD2 5304 C CE1 . TYR A 694 ? 0.1788 0.2146 0.2294 0.0142 -0.0631 -0.0009 1002 TYR A CE1 5305 C CE2 . TYR A 694 ? 0.2224 0.2411 0.2440 0.0159 -0.0655 0.0001 1002 TYR A CE2 5306 C CZ . TYR A 694 ? 0.2220 0.2491 0.2569 0.0176 -0.0643 0.0005 1002 TYR A CZ 5307 O OH . TYR A 694 ? 0.2175 0.2435 0.2497 0.0227 -0.0639 0.0022 1002 TYR A OH 5308 N N . THR A 695 ? 0.2047 0.2008 0.2107 -0.0032 -0.0733 -0.0051 1003 THR A N 5309 C CA . THR A 695 ? 0.2283 0.2162 0.2229 -0.0005 -0.0796 -0.0055 1003 THR A CA 5310 C C . THR A 695 ? 0.2181 0.2068 0.2216 -0.0073 -0.0860 -0.0084 1003 THR A C 5311 O O . THR A 695 ? 0.2115 0.2018 0.2164 -0.0044 -0.0888 -0.0090 1003 THR A O 5312 C CB . THR A 695 ? 0.2414 0.2144 0.2145 0.0018 -0.0774 -0.0048 1003 THR A CB 5313 O OG1 . THR A 695 ? 0.2453 0.2214 0.2145 0.0075 -0.0705 -0.0034 1003 THR A OG1 5314 C CG2 . THR A 695 ? 0.2465 0.2120 0.2104 0.0049 -0.0788 -0.0051 1003 THR A CG2 5315 N N . MET A 696 ? 0.1844 0.1719 0.1939 -0.0165 -0.0818 -0.0099 1004 MET A N 5316 C CA . MET A 696 ? 0.2343 0.2238 0.2549 -0.0250 -0.0855 -0.0136 1004 MET A CA 5317 C C . MET A 696 ? 0.2494 0.2588 0.2948 -0.0246 -0.0895 -0.0160 1004 MET A C 5318 O O . MET A 696 ? 0.2291 0.2420 0.2807 -0.0260 -0.0955 -0.0192 1004 MET A O 5319 C CB . MET A 696 ? 0.2718 0.2547 0.2927 -0.0357 -0.0766 -0.0144 1004 MET A CB 5320 C CG . MET A 696 ? 0.2868 0.2462 0.2802 -0.0359 -0.0751 -0.0128 1004 MET A CG 5321 S SD . MET A 696 ? 0.3163 0.2627 0.3043 -0.0475 -0.0635 -0.0129 1004 MET A SD 5322 C CE . MET A 696 ? 0.3130 0.2677 0.3230 -0.0607 -0.0655 -0.0182 1004 MET A CE 5323 N N . GLU A 697 ? 0.2331 0.2560 0.2499 0.0000 -0.0482 -0.0182 1005 GLU A N 5324 C CA . GLU A 697 ? 0.2630 0.2953 0.2879 0.0027 -0.0605 -0.0198 1005 GLU A CA 5325 C C . GLU A 697 ? 0.2856 0.2965 0.3000 0.0037 -0.0681 -0.0192 1005 GLU A C 5326 O O . GLU A 697 ? 0.2796 0.3001 0.2997 0.0011 -0.0808 -0.0187 1005 GLU A O 5327 C CB . GLU A 697 ? 0.2912 0.3257 0.3202 0.0146 -0.0572 -0.0256 1005 GLU A CB 5328 C CG . GLU A 697 ? 0.3518 0.4129 0.3942 0.0144 -0.0529 -0.0247 1005 GLU A CG 5329 C CD . GLU A 697 ? 0.4410 0.5379 0.5080 0.0057 -0.0652 -0.0142 1005 GLU A CD 5330 O OE1 . GLU A 697 ? 0.4506 0.5539 0.5210 0.0025 -0.0765 -0.0124 1005 GLU A OE1 5331 O OE2 . GLU A 697 ? 0.5231 0.6420 0.6088 0.0032 -0.0632 -0.0076 1005 GLU A OE2 5332 N N . LEU A 698 ? 0.2772 0.2610 0.2780 0.0073 -0.0607 -0.0174 1006 LEU A N 5333 C CA . LEU A 698 ? 0.2962 0.2592 0.2856 0.0063 -0.0670 -0.0140 1006 LEU A CA 5334 C C . LEU A 698 ? 0.2840 0.2532 0.2710 -0.0029 -0.0749 -0.0117 1006 LEU A C 5335 O O . LEU A 698 ? 0.2680 0.2351 0.2525 -0.0047 -0.0864 -0.0117 1006 LEU A O 5336 C CB . LEU A 698 ? 0.3091 0.2468 0.2881 0.0099 -0.0567 -0.0093 1006 LEU A CB 5337 C CG . LEU A 698 ? 0.3391 0.2633 0.3080 0.0080 -0.0573 -0.0058 1006 LEU A CG 5338 C CD1 . LEU A 698 ? 0.3491 0.2644 0.3181 0.0129 -0.0683 -0.0102 1006 LEU A CD1 5339 C CD2 . LEU A 698 ? 0.3151 0.2657 0.2852 0.0046 -0.0391 -0.0031 1006 LEU A CD2 5340 N N . GLU A 699 ? 0.2556 0.2315 0.2433 -0.0083 -0.0694 -0.0106 1007 GLU A N 5341 C CA . GLU A 699 ? 0.2809 0.2597 0.2668 -0.0163 -0.0777 -0.0104 1007 GLU A CA 5342 C C . GLU A 699 ? 0.2925 0.2931 0.2935 -0.0206 -0.0918 -0.0139 1007 GLU A C 5343 O O . GLU A 699 ? 0.2664 0.2643 0.2652 -0.0242 -0.1037 -0.0143 1007 GLU A O 5344 C CB . GLU A 699 ? 0.2679 0.2486 0.2526 -0.0206 -0.0694 -0.0091 1007 GLU A CB 5345 C CG . GLU A 699 ? 0.2826 0.2425 0.2530 -0.0175 -0.0578 -0.0030 1007 GLU A CG 5346 C CD . GLU A 699 ? 0.3167 0.2788 0.2853 -0.0210 -0.0492 -0.0004 1007 GLU A CD 5347 O OE1 . GLU A 699 ? 0.3152 0.2948 0.2947 -0.0228 -0.0464 -0.0040 1007 GLU A OE1 5348 O OE2 . GLU A 699 ? 0.3028 0.2495 0.2592 -0.0224 -0.0457 0.0053 1007 GLU A OE2 5349 N N . ARG A 700 ? 0.2887 0.3127 0.3063 -0.0199 -0.0907 -0.0157 1008 ARG A N 5350 C CA . ARG A 700 ? 0.3294 0.3797 0.3664 -0.0233 -0.1035 -0.0168 1008 ARG A CA 5351 C C . ARG A 700 ? 0.2833 0.3278 0.3172 -0.0191 -0.1143 -0.0167 1008 ARG A C 5352 O O . ARG A 700 ? 0.2607 0.3151 0.3028 -0.0231 -0.1276 -0.0170 1008 ARG A O 5353 C CB . ARG A 700 ? 0.3602 0.4404 0.4157 -0.0212 -0.0989 -0.0165 1008 ARG A CB 5354 C CG . ARG A 700 ? 0.4513 0.5670 0.5330 -0.0246 -0.1108 -0.0156 1008 ARG A CG 5355 C CD . ARG A 700 ? 0.5131 0.6629 0.6129 -0.0188 -0.1061 -0.0124 1008 ARG A CD 5356 N NE . ARG A 700 ? 0.5754 0.7276 0.6729 -0.0191 -0.0920 -0.0114 1008 ARG A NE 5357 C CZ . ARG A 700 ? 0.6345 0.8052 0.7487 -0.0226 -0.0881 -0.0142 1008 ARG A CZ 5358 N NH1 . ARG A 700 ? 0.6601 0.8514 0.8000 -0.0286 -0.1005 -0.0161 1008 ARG A NH1 5359 N NH2 . ARG A 700 ? 0.6332 0.7992 0.7420 -0.0203 -0.0740 -0.0153 1008 ARG A NH2 5360 N N . LEU A 701 ? 0.2732 0.3006 0.2959 -0.0110 -0.1092 -0.0165 1009 LEU A N 5361 C CA . LEU A 701 ? 0.2828 0.3024 0.3016 -0.0065 -0.1189 -0.0164 1009 LEU A CA 5362 C C . LEU A 701 ? 0.3131 0.3148 0.3174 -0.0101 -0.1254 -0.0151 1009 LEU A C 5363 O O . LEU A 701 ? 0.3314 0.3385 0.3383 -0.0109 -0.1382 -0.0153 1009 LEU A O 5364 C CB . LEU A 701 ? 0.3066 0.3089 0.3178 0.0027 -0.1120 -0.0171 1009 LEU A CB 5365 C CG . LEU A 701 ? 0.3337 0.3261 0.3409 0.0079 -0.1216 -0.0172 1009 LEU A CG 5366 C CD1 . LEU A 701 ? 0.3142 0.3333 0.3385 0.0087 -0.1345 -0.0174 1009 LEU A CD1 5367 C CD2 . LEU A 701 ? 0.3379 0.3123 0.3396 0.0164 -0.1149 -0.0196 1009 LEU A CD2 5368 N N . TYR A 702 ? 0.2733 0.2556 0.2626 -0.0118 -0.1167 -0.0136 1010 TYR A N 5369 C CA . TYR A 702 ? 0.3017 0.2702 0.2768 -0.0149 -0.1223 -0.0125 1010 TYR A CA 5370 C C . TYR A 702 ? 0.3472 0.3296 0.3302 -0.0209 -0.1358 -0.0152 1010 TYR A C 5371 O O . TYR A 702 ? 0.3666 0.3469 0.3445 -0.0214 -0.1472 -0.0160 1010 TYR A O 5372 C CB . TYR A 702 ? 0.3121 0.2636 0.2738 -0.0159 -0.1107 -0.0101 1010 TYR A CB 5373 C CG . TYR A 702 ? 0.3025 0.2359 0.2551 -0.0110 -0.0993 -0.0065 1010 TYR A CG 5374 C CD1 . TYR A 702 ? 0.3193 0.2459 0.2703 -0.0068 -0.1025 -0.0060 1010 TYR A CD1 5375 C CD2 . TYR A 702 ? 0.2906 0.2134 0.2375 -0.0111 -0.0864 -0.0030 1010 TYR A CD2 5376 C CE1 . TYR A 702 ? 0.3293 0.2376 0.2737 -0.0037 -0.0936 -0.0031 1010 TYR A CE1 5377 C CE2 . TYR A 702 ? 0.2810 0.1873 0.2227 -0.0076 -0.0770 0.0008 1010 TYR A CE2 5378 C CZ . TYR A 702 ? 0.2947 0.1930 0.2353 -0.0043 -0.0808 0.0002 1010 TYR A CZ 5379 O OH . TYR A 702 ? 0.3146 0.2073 0.2545 -0.0026 -0.0693 0.0020 1010 TYR A OH 5380 N N . LEU A 703 ? 0.3480 0.3452 0.3445 -0.0259 -0.1350 -0.0165 1011 LEU A N 5381 C CA . LEU A 703 ? 0.3745 0.3839 0.3820 -0.0330 -0.1486 -0.0187 1011 LEU A CA 5382 C C . LEU A 703 ? 0.3748 0.4035 0.3980 -0.0326 -0.1618 -0.0193 1011 LEU A C 5383 O O . LEU A 703 ? 0.3763 0.4081 0.4027 -0.0363 -0.1758 -0.0209 1011 LEU A O 5384 C CB . LEU A 703 ? 0.3899 0.4115 0.4112 -0.0394 -0.1448 -0.0188 1011 LEU A CB 5385 C CG . LEU A 703 ? 0.4276 0.4308 0.4341 -0.0407 -0.1346 -0.0180 1011 LEU A CG 5386 C CD1 . LEU A 703 ? 0.4336 0.4509 0.4552 -0.0463 -0.1293 -0.0176 1011 LEU A CD1 5387 C CD2 . LEU A 703 ? 0.4874 0.4740 0.4804 -0.0433 -0.1445 -0.0198 1011 LEU A CD2 5388 N N . GLN A 704 ? 0.3594 0.4014 0.3926 -0.0274 -0.1579 -0.0181 1012 GLN A N 5389 C CA . GLN A 704 ? 0.4173 0.4779 0.4646 -0.0252 -0.1698 -0.0179 1012 GLN A CA 5390 C C . GLN A 704 ? 0.3847 0.4283 0.4158 -0.0219 -0.1780 -0.0179 1012 GLN A C 5391 O O . GLN A 704 ? 0.3714 0.4245 0.4092 -0.0235 -0.1920 -0.0186 1012 GLN A O 5392 C CB . GLN A 704 ? 0.4838 0.5603 0.5425 -0.0182 -0.1639 -0.0165 1012 GLN A CB 5393 C CG . GLN A 704 ? 0.5577 0.6630 0.6381 -0.0208 -0.1588 -0.0157 1012 GLN A CG 5394 C CD . GLN A 704 ? 0.6251 0.7463 0.7141 -0.0118 -0.1525 -0.0140 1012 GLN A CD 5395 O OE1 . GLN A 704 ? 0.6600 0.7770 0.7462 -0.0041 -0.1572 -0.0136 1012 GLN A OE1 5396 N NE2 . GLN A 704 ? 0.6303 0.7691 0.7295 -0.0121 -0.1425 -0.0128 1012 GLN A NE2 5397 N N . MET A 705 ? 0.3592 0.3791 0.3701 -0.0175 -0.1693 -0.0168 1013 MET A N 5398 C CA . MET A 705 ? 0.3910 0.3963 0.3860 -0.0147 -0.1756 -0.0159 1013 MET A CA 5399 C C . MET A 705 ? 0.4108 0.4127 0.3978 -0.0195 -0.1849 -0.0182 1013 MET A C 5400 O O . MET A 705 ? 0.4178 0.4239 0.4036 -0.0189 -0.1978 -0.0189 1013 MET A O 5401 C CB . MET A 705 ? 0.3971 0.3792 0.3739 -0.0111 -0.1636 -0.0134 1013 MET A CB 5402 C CG . MET A 705 ? 0.3979 0.3770 0.3792 -0.0052 -0.1564 -0.0120 1013 MET A CG 5403 S SD . MET A 705 ? 0.3801 0.3304 0.3419 -0.0032 -0.1434 -0.0090 1013 MET A SD 5404 C CE . MET A 705 ? 0.3849 0.3315 0.3546 0.0042 -0.1407 -0.0095 1013 MET A CE 5405 N N . TRP A 706 ? 0.3949 0.3888 0.3763 -0.0235 -0.1791 -0.0196 1014 TRP A N 5406 C CA . TRP A 706 ? 0.4042 0.3916 0.3759 -0.0267 -0.1882 -0.0228 1014 TRP A CA 5407 C C . TRP A 706 ? 0.4157 0.4191 0.4037 -0.0314 -0.2048 -0.0258 1014 TRP A C 5408 O O . TRP A 706 ? 0.4323 0.4342 0.4137 -0.0309 -0.2176 -0.0283 1014 TRP A O 5409 C CB . TRP A 706 ? 0.3899 0.3647 0.3528 -0.0294 -0.1795 -0.0237 1014 TRP A CB 5410 C CG . TRP A 706 ? 0.4512 0.4196 0.4051 -0.0316 -0.1914 -0.0282 1014 TRP A CG 5411 C CD1 . TRP A 706 ? 0.4783 0.4498 0.4419 -0.0377 -0.2010 -0.0315 1014 TRP A CD1 5412 C CD2 . TRP A 706 ? 0.4694 0.4281 0.4036 -0.0275 -0.1968 -0.0304 1014 TRP A CD2 5413 N NE1 . TRP A 706 ? 0.5042 0.4656 0.4541 -0.0367 -0.2126 -0.0364 1014 TRP A NE1 5414 C CE2 . TRP A 706 ? 0.5005 0.4556 0.4318 -0.0300 -0.2097 -0.0361 1014 TRP A CE2 5415 C CE3 . TRP A 706 ? 0.4773 0.4309 0.3963 -0.0220 -0.1924 -0.0281 1014 TRP A CE3 5416 C CZ2 . TRP A 706 ? 0.5330 0.4807 0.4456 -0.0258 -0.2180 -0.0404 1014 TRP A CZ2 5417 C CZ3 . TRP A 706 ? 0.5166 0.4659 0.4181 -0.0190 -0.1999 -0.0314 1014 TRP A CZ3 5418 C CH2 . TRP A 706 ? 0.5370 0.4839 0.4348 -0.0201 -0.2124 -0.0380 1014 TRP A CH2 5419 N N . GLU A 707 ? 0.4307 0.4510 0.4410 -0.0359 -0.2048 -0.0252 1015 GLU A N 5420 C CA . GLU A 707 ? 0.4836 0.5217 0.5143 -0.0416 -0.2206 -0.0268 1015 GLU A CA 5421 C C . GLU A 707 ? 0.4491 0.4982 0.4846 -0.0377 -0.2318 -0.0265 1015 GLU A C 5422 O O . GLU A 707 ? 0.4445 0.4978 0.4841 -0.0402 -0.2473 -0.0289 1015 GLU A O 5423 C CB . GLU A 707 ? 0.5346 0.5941 0.5912 -0.0470 -0.2169 -0.0247 1015 GLU A CB 5424 C CG . GLU A 707 ? 0.6108 0.6615 0.6662 -0.0529 -0.2098 -0.0249 1015 GLU A CG 5425 C CD . GLU A 707 ? 0.6843 0.7581 0.7640 -0.0570 -0.2028 -0.0219 1015 GLU A CD 5426 O OE1 . GLU A 707 ? 0.7179 0.8177 0.8180 -0.0555 -0.2054 -0.0200 1015 GLU A OE1 5427 O OE2 . GLU A 707 ? 0.7114 0.7790 0.7901 -0.0610 -0.1947 -0.0212 1015 GLU A OE2 5428 N N . HIS A 708 ? 0.4043 0.4569 0.4388 -0.0312 -0.2246 -0.0235 1016 HIS A N 5429 C CA . HIS A 708 ? 0.4176 0.4789 0.4550 -0.0263 -0.2343 -0.0223 1016 HIS A CA 5430 C C . HIS A 708 ? 0.4430 0.4894 0.4597 -0.0244 -0.2428 -0.0241 1016 HIS A C 5431 O O . HIS A 708 ? 0.4929 0.5486 0.5148 -0.0244 -0.2574 -0.0253 1016 HIS A O 5432 C CB . HIS A 708 ? 0.3891 0.4497 0.4251 -0.0190 -0.2244 -0.0189 1016 HIS A CB 5433 C CG . HIS A 708 ? 0.4026 0.4751 0.4461 -0.0137 -0.2344 -0.0170 1016 HIS A CG 5434 N ND1 . HIS A 708 ? 0.4133 0.5130 0.4813 -0.0143 -0.2439 -0.0167 1016 HIS A ND1 5435 C CD2 . HIS A 708 ? 0.4387 0.5003 0.4695 -0.0077 -0.2366 -0.0149 1016 HIS A CD2 5436 C CE1 . HIS A 708 ? 0.4422 0.5462 0.5111 -0.0081 -0.2515 -0.0148 1016 HIS A CE1 5437 N NE2 . HIS A 708 ? 0.4287 0.5090 0.4751 -0.0043 -0.2475 -0.0136 1016 HIS A NE2 5438 N N . TYR A 709 ? 0.4314 0.4571 0.4253 -0.0224 -0.2336 -0.0241 1017 TYR A N 5439 C CA . TYR A 709 ? 0.4619 0.4767 0.4348 -0.0200 -0.2400 -0.0257 1017 TYR A CA 5440 C C . TYR A 709 ? 0.4738 0.4880 0.4455 -0.0240 -0.2524 -0.0315 1017 TYR A C 5441 O O . TYR A 709 ? 0.4691 0.4862 0.4351 -0.0222 -0.2658 -0.0339 1017 TYR A O 5442 C CB . TYR A 709 ? 0.4720 0.4685 0.4234 -0.0172 -0.2260 -0.0238 1017 TYR A CB 5443 C CG . TYR A 709 ? 0.5249 0.5142 0.4545 -0.0149 -0.2312 -0.0259 1017 TYR A CG 5444 C CD1 . TYR A 709 ? 0.5348 0.5282 0.4549 -0.0106 -0.2371 -0.0232 1017 TYR A CD1 5445 C CD2 . TYR A 709 ? 0.5312 0.5113 0.4499 -0.0164 -0.2308 -0.0306 1017 TYR A CD2 5446 C CE1 . TYR A 709 ? 0.5608 0.5526 0.4609 -0.0078 -0.2417 -0.0250 1017 TYR A CE1 5447 C CE2 . TYR A 709 ? 0.5579 0.5344 0.4564 -0.0128 -0.2360 -0.0334 1017 TYR A CE2 5448 C CZ . TYR A 709 ? 0.5812 0.5651 0.4704 -0.0085 -0.2410 -0.0305 1017 TYR A CZ 5449 O OH . TYR A 709 ? 0.6278 0.6127 0.4967 -0.0044 -0.2459 -0.0329 1017 TYR A OH 5450 N N . ALA A 710 ? 0.4372 0.4468 0.4141 -0.0291 -0.2486 -0.0336 1018 ALA A N 5451 C CA . ALA A 710 ? 0.4877 0.4921 0.4632 -0.0330 -0.2610 -0.0394 1018 ALA A CA 5452 C C . ALA A 710 ? 0.5151 0.5349 0.5095 -0.0363 -0.2796 -0.0413 1018 ALA A C 5453 O O . ALA A 710 ? 0.5118 0.5266 0.5008 -0.0367 -0.2945 -0.0466 1018 ALA A O 5454 C CB . ALA A 710 ? 0.4951 0.4930 0.4764 -0.0386 -0.2538 -0.0398 1018 ALA A CB 5455 N N . ALA A 711 ? 0.5081 0.5472 0.5252 -0.0381 -0.2790 -0.0373 1019 ALA A N 5456 C CA . ALA A 711 ? 0.5310 0.5887 0.5697 -0.0413 -0.2955 -0.0378 1019 ALA A CA 5457 C C . ALA A 711 ? 0.5044 0.5655 0.5339 -0.0347 -0.3046 -0.0380 1019 ALA A C 5458 O O . ALA A 711 ? 0.5206 0.5970 0.5660 -0.0359 -0.3187 -0.0384 1019 ALA A O 5459 C CB . ALA A 711 ? 0.5022 0.5835 0.5696 -0.0447 -0.2909 -0.0331 1019 ALA A CB 5460 N N . GLY A 712 ? 0.5020 0.5502 0.5069 -0.0280 -0.2965 -0.0371 1020 GLY A N 5461 C CA . GLY A 712 ? 0.5222 0.5728 0.5153 -0.0219 -0.3048 -0.0366 1020 GLY A CA 5462 C C . GLY A 712 ? 0.5070 0.5689 0.5081 -0.0177 -0.3012 -0.0305 1020 GLY A C 5463 O O . GLY A 712 ? 0.5324 0.6033 0.5343 -0.0142 -0.3122 -0.0296 1020 GLY A O 5464 N N . ASN A 713 ? 0.4804 0.5414 0.4871 -0.0172 -0.2868 -0.0267 1021 ASN A N 5465 C CA . ASN A 713 ? 0.4786 0.5475 0.4925 -0.0120 -0.2839 -0.0215 1021 ASN A CA 5466 C C . ASN A 713 ? 0.4627 0.5148 0.4563 -0.0073 -0.2725 -0.0176 1021 ASN A C 5467 O O . ASN A 713 ? 0.4474 0.4847 0.4280 -0.0087 -0.2608 -0.0180 1021 ASN A O 5468 C CB . ASN A 713 ? 0.4863 0.5701 0.5243 -0.0135 -0.2781 -0.0200 1021 ASN A CB 5469 C CG . ASN A 713 ? 0.5079 0.6127 0.5702 -0.0193 -0.2891 -0.0223 1021 ASN A CG 5470 O OD1 . ASN A 713 ? 0.4731 0.5942 0.5482 -0.0180 -0.3018 -0.0218 1021 ASN A OD1 5471 N ND2 . ASN A 713 ? 0.5085 0.6136 0.5783 -0.0260 -0.2845 -0.0242 1021 ASN A ND2 5472 N N . LYS A 714 ? 0.4765 0.5311 0.4687 -0.0020 -0.2766 -0.0133 1022 LYS A N 5473 C CA . LYS A 714 ? 0.5069 0.5469 0.4850 0.0018 -0.2671 -0.0084 1022 LYS A CA 5474 C C . LYS A 714 ? 0.4810 0.5183 0.4709 0.0029 -0.2558 -0.0074 1022 LYS A C 5475 O O . LYS A 714 ? 0.4258 0.4784 0.4360 0.0024 -0.2577 -0.0093 1022 LYS A O 5476 C CB . LYS A 714 ? 0.5365 0.5805 0.5115 0.0067 -0.2772 -0.0037 1022 LYS A CB 5477 C CG . LYS A 714 ? 0.5936 0.6415 0.5537 0.0069 -0.2873 -0.0040 1022 LYS A CG 5478 C CD . LYS A 714 ? 0.6514 0.7043 0.6084 0.0117 -0.2966 0.0019 1022 LYS A CD 5479 C CE . LYS A 714 ? 0.7097 0.7704 0.6515 0.0128 -0.3066 0.0018 1022 LYS A CE 5480 N NZ . LYS A 714 ? 0.7618 0.8298 0.7014 0.0175 -0.3163 0.0086 1022 LYS A NZ 5481 N N . PRO A 715 ? 0.4621 0.4817 0.4399 0.0044 -0.2442 -0.0044 1023 PRO A N 5482 C CA . PRO A 715 ? 0.4307 0.4461 0.4178 0.0062 -0.2334 -0.0045 1023 PRO A CA 5483 C C . PRO A 715 ? 0.3979 0.4276 0.4044 0.0116 -0.2398 -0.0042 1023 PRO A C 5484 O O . PRO A 715 ? 0.4155 0.4483 0.4231 0.0153 -0.2505 -0.0016 1023 PRO A O 5485 C CB . PRO A 715 ? 0.4148 0.4082 0.3852 0.0074 -0.2248 -0.0005 1023 PRO A CB 5486 C CG . PRO A 715 ? 0.4394 0.4277 0.3913 0.0040 -0.2252 0.0005 1023 PRO A CG 5487 C CD . PRO A 715 ? 0.4700 0.4747 0.4255 0.0041 -0.2402 -0.0010 1023 PRO A CD 5488 N N . ASP A 716 ? 0.3951 0.4354 0.4169 0.0124 -0.2335 -0.0066 1024 ASP A N 5489 C CA . ASP A 716 ? 0.4110 0.4676 0.4514 0.0190 -0.2377 -0.0065 1024 ASP A CA 5490 C C . ASP A 716 ? 0.3714 0.4248 0.4157 0.0221 -0.2248 -0.0082 1024 ASP A C 5491 O O . ASP A 716 ? 0.3407 0.3856 0.3779 0.0174 -0.2136 -0.0095 1024 ASP A O 5492 C CB . ASP A 716 ? 0.4714 0.5588 0.5330 0.0170 -0.2468 -0.0076 1024 ASP A CB 5493 C CG . ASP A 716 ? 0.5253 0.6319 0.6044 0.0251 -0.2555 -0.0062 1024 ASP A CG 5494 O OD1 . ASP A 716 ? 0.5397 0.6341 0.6148 0.0329 -0.2541 -0.0054 1024 ASP A OD1 5495 O OD2 . ASP A 716 ? 0.5515 0.6852 0.6490 0.0238 -0.2643 -0.0059 1024 ASP A OD2 5496 N N . HIS A 717 ? 0.3567 0.4172 0.4120 0.0308 -0.2266 -0.0085 1025 HIS A N 5497 C CA . HIS A 717 ? 0.3430 0.4014 0.4016 0.0356 -0.2153 -0.0110 1025 HIS A CA 5498 C C . HIS A 717 ? 0.3454 0.4257 0.4159 0.0306 -0.2069 -0.0117 1025 HIS A C 5499 O O . HIS A 717 ? 0.3623 0.4722 0.4506 0.0277 -0.2128 -0.0102 1025 HIS A O 5500 C CB . HIS A 717 ? 0.3533 0.4211 0.4241 0.0474 -0.2211 -0.0121 1025 HIS A CB 5501 C CG . HIS A 717 ? 0.3738 0.4189 0.4340 0.0522 -0.2305 -0.0115 1025 HIS A CG 5502 N ND1 . HIS A 717 ? 0.3943 0.4058 0.4361 0.0517 -0.2265 -0.0120 1025 HIS A ND1 5503 C CD2 . HIS A 717 ? 0.4079 0.4601 0.4746 0.0571 -0.2444 -0.0097 1025 HIS A CD2 5504 C CE1 . HIS A 717 ? 0.4120 0.4109 0.4496 0.0553 -0.2379 -0.0100 1025 HIS A CE1 5505 N NE2 . HIS A 717 ? 0.4231 0.4455 0.4749 0.0591 -0.2488 -0.0089 1025 HIS A NE2 5506 N N . MET A 718 ? 0.3382 0.4041 0.3996 0.0290 -0.1934 -0.0136 1026 MET A N 5507 C CA . MET A 718 ? 0.3451 0.4295 0.4164 0.0242 -0.1843 -0.0137 1026 MET A CA 5508 C C . MET A 718 ? 0.3698 0.4624 0.4492 0.0329 -0.1762 -0.0152 1026 MET A C 5509 O O . MET A 718 ? 0.3534 0.4268 0.4211 0.0338 -0.1646 -0.0180 1026 MET A O 5510 C CB . MET A 718 ? 0.3211 0.3830 0.3751 0.0162 -0.1747 -0.0146 1026 MET A CB 5511 C CG . MET A 718 ? 0.3522 0.4047 0.3960 0.0090 -0.1823 -0.0136 1026 MET A CG 5512 S SD . MET A 718 ? 0.5821 0.6662 0.6457 0.0011 -0.1926 -0.0135 1026 MET A SD 5513 C CE . MET A 718 ? 0.5492 0.6171 0.5973 -0.0022 -0.2048 -0.0136 1026 MET A CE 5514 N N . ILE A 719 ? 0.3952 0.5169 0.4946 0.0400 -0.1824 -0.0131 1027 ILE A N 5515 C CA . ILE A 719 ? 0.4258 0.5536 0.5317 0.0518 -0.1772 -0.0150 1027 ILE A CA 5516 C C . ILE A 719 ? 0.4643 0.6340 0.5952 0.0526 -0.1727 -0.0089 1027 ILE A C 5517 O O . ILE A 719 ? 0.4498 0.6350 0.5933 0.0646 -0.1722 -0.0082 1027 ILE A O 5518 C CB . ILE A 719 ? 0.4390 0.5610 0.5458 0.0640 -0.1880 -0.0174 1027 ILE A CB 5519 C CG1 . ILE A 719 ? 0.4461 0.5980 0.5713 0.0634 -0.2010 -0.0117 1027 ILE A CG1 5520 C CG2 . ILE A 719 ? 0.4435 0.5225 0.5262 0.0634 -0.1909 -0.0216 1027 ILE A CG2 5521 C CD1 . ILE A 719 ? 0.4680 0.6176 0.5964 0.0762 -0.2121 -0.0136 1027 ILE A CD1 5522 N N . LYS A 720 ? 0.4992 0.6866 0.6376 0.0402 -0.1698 -0.0044 1028 LYS A N 5523 C CA . LYS A 720 ? 0.5435 0.7717 0.7068 0.0380 -0.1647 0.0043 1028 LYS A CA 5524 C C . LYS A 720 ? 0.5708 0.7950 0.7274 0.0258 -0.1550 0.0037 1028 LYS A C 5525 O O . LYS A 720 ? 0.5868 0.8251 0.7530 0.0257 -0.1451 0.0090 1028 LYS A O 5526 C CB . LYS A 720 ? 0.5807 0.8515 0.7698 0.0357 -0.1757 0.0118 1028 LYS A CB 5527 C CG . LYS A 720 ? 0.6213 0.9079 0.8261 0.0494 -0.1836 0.0162 1028 LYS A CG 5528 C CD . LYS A 720 ? 0.6608 0.9873 0.8883 0.0462 -0.1951 0.0228 1028 LYS A CD 5529 C CE . LYS A 720 ? 0.6730 1.0362 0.9199 0.0379 -0.1876 0.0287 1028 LYS A CE 5530 N NZ . LYS A 720 ? 0.6962 1.0936 0.9604 0.0361 -0.1980 0.0271 1028 LYS A NZ 5531 N N . TYR B 1 ? 0.2138 0.2703 0.2745 -0.0011 0.0273 -0.0209 13 TYR B N 5532 C CA . TYR B 1 ? 0.2305 0.2824 0.2942 -0.0062 0.0223 -0.0246 13 TYR B CA 5533 C C . TYR B 1 ? 0.2212 0.2913 0.2964 -0.0087 0.0182 -0.0149 13 TYR B C 5534 O O . TYR B 1 ? 0.2133 0.3079 0.2881 -0.0027 0.0212 -0.0087 13 TYR B O 5535 C CB . TYR B 1 ? 0.1966 0.2426 0.2440 -0.0047 0.0222 -0.0308 13 TYR B CB 5536 C CG . TYR B 1 ? 0.1958 0.2417 0.2352 0.0011 0.0184 -0.0280 13 TYR B CG 5537 C CD1 . TYR B 1 ? 0.2066 0.2590 0.2468 0.0030 0.0140 -0.0281 13 TYR B CD1 5538 C CD2 . TYR B 1 ? 0.1932 0.2295 0.2260 0.0067 0.0139 -0.0278 13 TYR B CD2 5539 C CE1 . TYR B 1 ? 0.2638 0.3142 0.2985 0.0126 0.0045 -0.0305 13 TYR B CE1 5540 C CE2 . TYR B 1 ? 0.2448 0.2746 0.2735 0.0167 0.0003 -0.0309 13 TYR B CE2 5541 C CZ . TYR B 1 ? 0.2746 0.3121 0.3043 0.0208 -0.0047 -0.0336 13 TYR B CZ 5542 O OH . TYR B 1 ? 0.2785 0.3082 0.3059 0.0349 -0.0236 -0.0413 13 TYR B OH 5543 N N . PRO B 2 ? 0.2004 0.2649 0.2869 -0.0158 0.0088 -0.0147 14 PRO B N 5544 C CA . PRO B 2 ? 0.2459 0.3313 0.3468 -0.0222 0.0023 -0.0002 14 PRO B CA 5545 C C . PRO B 2 ? 0.2762 0.3795 0.3639 -0.0132 0.0090 -0.0026 14 PRO B C 5546 O O . PRO B 2 ? 0.3342 0.4202 0.4076 -0.0087 0.0097 -0.0148 14 PRO B O 5547 C CB . PRO B 2 ? 0.2575 0.3212 0.3695 -0.0281 -0.0138 -0.0066 14 PRO B CB 5548 C CG . PRO B 2 ? 0.2630 0.3032 0.3747 -0.0240 -0.0190 -0.0223 14 PRO B CG 5549 C CD . PRO B 2 ? 0.2383 0.2825 0.3273 -0.0159 -0.0003 -0.0293 14 PRO B CD 5550 N N . GLY B 3 ? 0.2461 0.3907 0.3398 -0.0095 0.0112 0.0090 15 GLY B N 5551 C CA . GLY B 3 ? 0.2657 0.4316 0.3485 0.0056 0.0129 0.0010 15 GLY B CA 5552 C C . GLY B 3 ? 0.2756 0.4398 0.3433 0.0247 0.0144 -0.0140 15 GLY B C 5553 O O . GLY B 3 ? 0.3185 0.4985 0.3790 0.0433 0.0085 -0.0261 15 GLY B O 5554 N N . GLY B 4 ? 0.2037 0.3471 0.2684 0.0220 0.0178 -0.0152 16 GLY B N 5555 C CA . GLY B 4 ? 0.2023 0.3363 0.2551 0.0383 0.0144 -0.0285 16 GLY B CA 5556 C C . GLY B 4 ? 0.2615 0.4042 0.3182 0.0365 0.0211 -0.0230 16 GLY B C 5557 O O . GLY B 4 ? 0.2805 0.4595 0.3507 0.0287 0.0263 -0.0075 16 GLY B O 5558 N N . SER B 5 ? 0.2293 0.3405 0.2764 0.0409 0.0180 -0.0317 17 SER B N 5559 C CA . SER B 5 ? 0.2783 0.3934 0.3282 0.0393 0.0241 -0.0276 17 SER B CA 5560 C C . SER B 5 ? 0.2660 0.3368 0.3085 0.0320 0.0226 -0.0305 17 SER B C 5561 O O . SER B 5 ? 0.2893 0.3342 0.3233 0.0335 0.0118 -0.0355 17 SER B O 5562 C CB . SER B 5 ? 0.3650 0.5181 0.4120 0.0623 0.0203 -0.0368 17 SER B CB 5563 O OG . SER B 5 ? 0.4419 0.5654 0.4777 0.0802 0.0037 -0.0561 17 SER B OG 5564 N N . THR B 6 ? 0.1945 0.2613 0.2426 0.0221 0.0305 -0.0240 18 THR B N 5565 C CA . THR B 6 ? 0.1865 0.2259 0.2288 0.0163 0.0306 -0.0257 18 THR B CA 5566 C C . THR B 6 ? 0.2373 0.2818 0.2822 0.0203 0.0344 -0.0244 18 THR B C 5567 O O . THR B 6 ? 0.1942 0.2484 0.2502 0.0131 0.0401 -0.0174 18 THR B O 5568 C CB . THR B 6 ? 0.2192 0.2514 0.2653 0.0039 0.0344 -0.0252 18 THR B CB 5569 O OG1 . THR B 6 ? 0.2061 0.2383 0.2477 0.0014 0.0306 -0.0269 18 THR B OG1 5570 C CG2 . THR B 6 ? 0.1808 0.2039 0.2216 0.0002 0.0360 -0.0266 18 THR B CG2 5571 N N . PRO B 7 ? 0.2376 0.2743 0.2746 0.0325 0.0262 -0.0310 19 PRO B N 5572 C CA . PRO B 7 ? 0.2187 0.2605 0.2564 0.0386 0.0284 -0.0318 19 PRO B CA 5573 C C . PRO B 7 ? 0.1805 0.2014 0.2197 0.0246 0.0344 -0.0260 19 PRO B C 5574 O O . PRO B 7 ? 0.1990 0.2033 0.2341 0.0154 0.0318 -0.0241 19 PRO B O 5575 C CB . PRO B 7 ? 0.2504 0.2782 0.2798 0.0568 0.0093 -0.0447 19 PRO B CB 5576 C CG . PRO B 7 ? 0.2937 0.2951 0.3199 0.0509 -0.0045 -0.0438 19 PRO B CG 5577 C CD . PRO B 7 ? 0.2225 0.2426 0.2520 0.0424 0.0082 -0.0389 19 PRO B CD 5578 N N . VAL B 8 ? 0.1424 0.1728 0.1880 0.0233 0.0415 -0.0222 20 VAL B N 5579 C CA . VAL B 8 ? 0.1386 0.1532 0.1868 0.0137 0.0458 -0.0201 20 VAL B CA 5580 C C . VAL B 8 ? 0.1430 0.1587 0.1911 0.0192 0.0468 -0.0193 20 VAL B C 5581 O O . VAL B 8 ? 0.1419 0.1783 0.1889 0.0310 0.0449 -0.0208 20 VAL B O 5582 C CB . VAL B 8 ? 0.1968 0.2155 0.2590 0.0041 0.0484 -0.0171 20 VAL B CB 5583 C CG1 . VAL B 8 ? 0.2100 0.2275 0.2717 0.0010 0.0456 -0.0215 20 VAL B CG1 5584 C CG2 . VAL B 8 ? 0.2079 0.2500 0.2840 0.0016 0.0474 -0.0049 20 VAL B CG2 5585 N N . SER B 9 ? 0.1562 0.1548 0.2022 0.0129 -0.0408 -0.0446 21 SER B N 5586 C CA . SER B 9 ? 0.2002 0.1827 0.2233 0.0247 -0.0289 -0.0386 21 SER B CA 5587 C C . SER B 9 ? 0.2572 0.1961 0.2573 0.0117 -0.0208 -0.0345 21 SER B C 5588 O O . SER B 9 ? 0.2829 0.1811 0.2602 0.0079 -0.0322 -0.0387 21 SER B O 5589 C CB . SER B 9 ? 0.2535 0.2329 0.2497 0.0512 -0.0354 -0.0344 21 SER B CB 5590 O OG . SER B 9 ? 0.2690 0.2978 0.3000 0.0604 -0.0443 -0.0260 21 SER B OG 5591 N N . SER B 10 ? 0.2563 0.2035 0.2616 0.0072 -0.0039 -0.0251 22 SER B N 5592 C CA . SER B 10 ? 0.3083 0.2318 0.3060 -0.0080 0.0058 -0.0101 22 SER B CA 5593 C C . SER B 10 ? 0.3130 0.2309 0.2802 0.0063 0.0215 -0.0018 22 SER B C 5594 O O . SER B 10 ? 0.2899 0.2288 0.2512 0.0235 0.0259 -0.0086 22 SER B O 5595 C CB . SER B 10 ? 0.3314 0.2920 0.3753 -0.0290 0.0157 0.0045 22 SER B CB 5596 O OG . SER B 10 ? 0.3752 0.3630 0.4548 -0.0366 0.0047 -0.0045 22 SER B OG 5597 N N . ALA B 11 ? 0.2954 0.1824 0.2440 -0.0013 0.0256 0.0140 23 ALA B N 5598 C CA . ALA B 11 ? 0.3399 0.2240 0.2569 0.0114 0.0403 0.0253 23 ALA B CA 5599 C C . ALA B 11 ? 0.3420 0.2726 0.2702 0.0140 0.0636 0.0382 23 ALA B C 5600 O O . ALA B 11 ? 0.3235 0.2855 0.2918 -0.0013 0.0711 0.0511 23 ALA B O 5601 C CB . ALA B 11 ? 0.3819 0.2229 0.2817 0.0018 0.0370 0.0431 23 ALA B CB 5602 N N . ASN B 12 ? 0.3297 0.2660 0.2204 0.0366 0.0736 0.0363 24 ASN B N 5603 C CA . ASN B 12 ? 0.3619 0.3411 0.2463 0.0503 0.0985 0.0484 24 ASN B CA 5604 C C . ASN B 12 ? 0.4229 0.4124 0.3059 0.0392 0.1167 0.0871 24 ASN B C 5605 O O . ASN B 12 ? 0.4119 0.3624 0.2852 0.0258 0.1063 0.0984 24 ASN B O 5606 C CB . ASN B 12 ? 0.3906 0.3656 0.2258 0.0838 0.0957 0.0265 24 ASN B CB 5607 C CG . ASN B 12 ? 0.4564 0.3935 0.2433 0.0905 0.0865 0.0301 24 ASN B CG 5608 O OD1 . ASN B 12 ? 0.4754 0.3826 0.2680 0.0736 0.0772 0.0401 24 ASN B OD1 5609 N ND2 . ASN B 12 ? 0.5234 0.4588 0.2590 0.1183 0.0867 0.0210 24 ASN B ND2 5610 N N . MET B 13 ? 0.4477 0.4941 0.3441 0.0471 0.1438 0.1117 25 MET B N 5611 C CA . MET B 13 ? 0.5601 0.6339 0.4688 0.0355 0.1622 0.1610 25 MET B CA 5612 C C . MET B 13 ? 0.6241 0.6810 0.4719 0.0544 0.1681 0.1664 25 MET B C 5613 O O . MET B 13 ? 0.6489 0.6940 0.4444 0.0847 0.1636 0.1331 25 MET B O 5614 C CB . MET B 13 ? 0.6231 0.7767 0.5647 0.0459 0.1904 0.1899 25 MET B CB 5615 C CG . MET B 13 ? 0.6308 0.8118 0.6450 0.0204 0.1871 0.2027 25 MET B CG 5616 S SD . MET B 13 ? 1.1910 1.3964 1.2827 -0.0233 0.1756 0.2611 25 MET B SD 5617 C CE . MET B 13 ? 1.0415 1.1559 1.1269 -0.0595 0.1416 0.2619 25 MET B CE 5618 N N . MET B 14 ? 0.6652 0.7147 0.5295 0.0320 0.1656 0.2027 26 MET B N 5619 C CA . MET B 14 ? 0.7447 0.7849 0.5672 0.0438 0.1643 0.2064 26 MET B CA 5620 C C . MET B 14 ? 0.8071 0.8839 0.6687 0.0252 0.1719 0.2550 26 MET B C 5621 O O . MET B 14 ? 0.8118 0.9250 0.7331 0.0064 0.1759 0.2840 26 MET B O 5622 C CB . MET B 14 ? 0.7703 0.7381 0.5634 0.0375 0.1411 0.1901 26 MET B CB 5623 C CG . MET B 14 ? 0.7983 0.7218 0.6299 0.0038 0.1243 0.2144 26 MET B CG 5624 S SD . MET B 14 ? 0.8415 0.6901 0.6375 0.0071 0.0985 0.1952 26 MET B SD 5625 C CE . MET B 14 ? 0.9507 0.7439 0.7935 -0.0267 0.0742 0.2172 26 MET B CE 5626 N N . ALA C 28 ? 0.7232 1.5078 0.9329 0.2679 -0.2910 -0.2137 336 ALA C N 5627 C CA . ALA C 28 ? 0.6881 1.4819 0.9113 0.2695 -0.2618 -0.1971 336 ALA C CA 5628 C C . ALA C 28 ? 0.6409 1.4315 0.8862 0.2481 -0.2441 -0.1986 336 ALA C C 5629 O O . ALA C 28 ? 0.5833 1.3919 0.8668 0.2363 -0.2298 -0.1941 336 ALA C O 5630 C CB . ALA C 28 ? 0.7043 1.4875 0.8842 0.2922 -0.2506 -0.1865 336 ALA C CB 5631 N N . VAL C 29 ? 0.6595 1.4287 0.8803 0.2444 -0.2443 -0.2044 337 VAL C N 5632 C CA . VAL C 29 ? 0.6468 1.4162 0.8849 0.2256 -0.2289 -0.2026 337 VAL C CA 5633 C C . VAL C 29 ? 0.6446 1.4300 0.9289 0.2046 -0.2344 -0.2073 337 VAL C C 5634 O O . VAL C 29 ? 0.6131 1.4166 0.9244 0.1913 -0.2168 -0.2019 337 VAL C O 5635 C CB . VAL C 29 ? 0.6589 1.4022 0.8669 0.2273 -0.2302 -0.2056 337 VAL C CB 5636 C CG1 . VAL C 29 ? 0.6293 1.3786 0.8600 0.2075 -0.2162 -0.2001 337 VAL C CG1 5637 C CG2 . VAL C 29 ? 0.6706 1.4012 0.8363 0.2482 -0.2197 -0.1972 337 VAL C CG2 5638 N N . ARG C 30 ? 0.6675 1.4481 0.9612 0.2021 -0.2588 -0.2177 338 ARG C N 5639 C CA . ARG C 30 ? 0.6537 1.4501 0.9962 0.1829 -0.2656 -0.2198 338 ARG C CA 5640 C C . ARG C 30 ? 0.6007 1.4270 0.9794 0.1803 -0.2557 -0.2126 338 ARG C C 5641 O O . ARG C 30 ? 0.5640 1.4089 0.9820 0.1648 -0.2454 -0.2087 338 ARG C O 5642 C CB . ARG C 30 ? 0.7062 1.4918 1.0542 0.1810 -0.2971 -0.2333 338 ARG C CB 5643 C CG . ARG C 30 ? 0.7207 1.5205 1.1244 0.1598 -0.3048 -0.2332 338 ARG C CG 5644 C CD . ARG C 30 ? 0.7862 1.5795 1.2012 0.1573 -0.3393 -0.2477 338 ARG C CD 5645 N NE . ARG C 30 ? 0.8197 1.6295 1.2282 0.1703 -0.3540 -0.2489 338 ARG C NE 5646 C CZ . ARG C 30 ? 0.8227 1.6637 1.2754 0.1655 -0.3553 -0.2395 338 ARG C CZ 5647 N NH1 . ARG C 30 ? 0.8048 1.6633 1.3087 0.1484 -0.3418 -0.2301 338 ARG C NH1 5648 N NH2 . ARG C 30 ? 0.8349 1.6920 1.2815 0.1793 -0.3686 -0.2374 338 ARG C NH2 5649 N N . LEU C 31 ? 0.5975 1.4290 0.9644 0.1968 -0.2569 -0.2093 339 LEU C N 5650 C CA . LEU C 31 ? 0.5833 1.4402 0.9869 0.1974 -0.2456 -0.2017 339 LEU C CA 5651 C C . LEU C 31 ? 0.5582 1.4213 0.9669 0.1936 -0.2143 -0.1968 339 LEU C C 5652 O O . LEU C 31 ? 0.4994 1.3821 0.9457 0.1857 -0.1996 -0.1952 339 LEU C O 5653 C CB . LEU C 31 ? 0.6069 1.4691 1.0007 0.2176 -0.2569 -0.1963 339 LEU C CB 5654 C CG . LEU C 31 ? 0.6411 1.5087 1.0391 0.2200 -0.2900 -0.2018 339 LEU C CG 5655 C CD1 . LEU C 31 ? 0.6578 1.5376 1.0440 0.2419 -0.2991 -0.1921 339 LEU C CD1 5656 C CD2 . LEU C 31 ? 0.6306 1.5188 1.0851 0.2021 -0.2963 -0.2020 339 LEU C CD2 5657 N N . TYR C 32 ? 0.5507 1.3975 0.9219 0.1995 -0.2043 -0.1954 340 TYR C N 5658 C CA . TYR C 32 ? 0.5311 1.3838 0.9044 0.1938 -0.1780 -0.1930 340 TYR C CA 5659 C C . TYR C 32 ? 0.5204 1.3857 0.9121 0.1732 -0.1684 -0.1964 340 TYR C C 5660 O O . TYR C 32 ? 0.4675 1.3511 0.8823 0.1648 -0.1497 -0.1984 340 TYR C O 5661 C CB . TYR C 32 ? 0.5547 1.3895 0.8864 0.2037 -0.1723 -0.1884 340 TYR C CB 5662 C CG . TYR C 32 ? 0.5814 1.4115 0.9016 0.2241 -0.1702 -0.1803 340 TYR C CG 5663 C CD1 . TYR C 32 ? 0.5817 1.4257 0.9344 0.2278 -0.1593 -0.1767 340 TYR C CD1 5664 C CD2 . TYR C 32 ? 0.6163 1.4287 0.8957 0.2410 -0.1770 -0.1744 340 TYR C CD2 5665 C CE1 . TYR C 32 ? 0.5951 1.4368 0.9436 0.2472 -0.1558 -0.1649 340 TYR C CE1 5666 C CE2 . TYR C 32 ? 0.6384 1.4505 0.9091 0.2612 -0.1733 -0.1627 340 TYR C CE2 5667 C CZ . TYR C 32 ? 0.6300 1.4573 0.9370 0.2639 -0.1629 -0.1566 340 TYR C CZ 5668 O OH . TYR C 32 ? 0.6533 1.4820 0.9576 0.2848 -0.1578 -0.1408 340 TYR C OH 5669 N N . ARG C 33 ? 0.5228 1.3789 0.9050 0.1661 -0.1803 -0.1968 341 ARG C N 5670 C CA . ARG C 33 ? 0.5232 1.3936 0.9240 0.1481 -0.1716 -0.1947 341 ARG C CA 5671 C C . ARG C 33 ? 0.5233 1.4180 0.9702 0.1387 -0.1693 -0.1955 341 ARG C C 5672 O O . ARG C 33 ? 0.5000 1.4167 0.9649 0.1267 -0.1522 -0.1931 341 ARG C O 5673 C CB . ARG C 33 ? 0.5346 1.3876 0.9250 0.1440 -0.1859 -0.1928 341 ARG C CB 5674 C CG . ARG C 33 ? 0.5376 1.3677 0.8849 0.1534 -0.1845 -0.1902 341 ARG C CG 5675 C CD . ARG C 33 ? 0.5584 1.3711 0.9033 0.1483 -0.1946 -0.1882 341 ARG C CD 5676 N NE . ARG C 33 ? 0.5793 1.3673 0.8841 0.1605 -0.1936 -0.1860 341 ARG C NE 5677 C CZ . ARG C 33 ? 0.5891 1.3818 0.8798 0.1587 -0.1767 -0.1744 341 ARG C CZ 5678 N NH1 . ARG C 33 ? 0.5729 1.3953 0.8822 0.1447 -0.1607 -0.1661 341 ARG C NH1 5679 N NH2 . ARG C 33 ? 0.6166 1.3867 0.8742 0.1716 -0.1758 -0.1708 341 ARG C NH2 5680 N N . LYS C 34 ? 0.5548 1.4485 1.0205 0.1451 -0.1863 -0.1975 342 LYS C N 5681 C CA . LYS C 34 ? 0.5641 1.4819 1.0783 0.1383 -0.1847 -0.1956 342 LYS C CA 5682 C C . LYS C 34 ? 0.5446 1.4795 1.0732 0.1413 -0.1597 -0.1969 342 LYS C C 5683 O O . LYS C 34 ? 0.5202 1.4782 1.0827 0.1329 -0.1450 -0.1959 342 LYS C O 5684 C CB . LYS C 34 ? 0.5983 1.5133 1.1286 0.1453 -0.2113 -0.1960 342 LYS C CB 5685 C CG . LYS C 34 ? 0.6151 1.5568 1.2017 0.1380 -0.2125 -0.1909 342 LYS C CG 5686 C CD . LYS C 34 ? 0.6264 1.5794 1.2411 0.1203 -0.2098 -0.1863 342 LYS C CD 5687 C CE . LYS C 34 ? 0.6354 1.6172 1.3102 0.1140 -0.2098 -0.1783 342 LYS C CE 5688 N NZ . LYS C 34 ? 0.6401 1.6361 1.3473 0.0976 -0.2053 -0.1695 342 LYS C NZ 5689 N N . ALA C 35 ? 0.5550 1.4776 1.0595 0.1537 -0.1536 -0.1992 343 ALA C N 5690 C CA . ALA C 35 ? 0.5414 1.4744 1.0609 0.1566 -0.1296 -0.2031 343 ALA C CA 5691 C C . ALA C 35 ? 0.5144 1.4583 1.0252 0.1436 -0.1075 -0.2098 343 ALA C C 5692 O O . ALA C 35 ? 0.4770 1.4371 1.0098 0.1398 -0.0868 -0.2171 343 ALA C O 5693 C CB . ALA C 35 ? 0.5491 1.4656 1.0492 0.1726 -0.1293 -0.2012 343 ALA C CB 5694 N N . LEU C 36 ? 0.5328 1.4691 1.0109 0.1375 -0.1118 -0.2075 344 LEU C N 5695 C CA . LEU C 36 ? 0.5337 1.4857 0.9999 0.1250 -0.0941 -0.2108 344 LEU C CA 5696 C C . LEU C 36 ? 0.5391 1.5167 1.0310 0.1128 -0.0887 -0.2071 344 LEU C C 5697 O O . LEU C 36 ? 0.5328 1.5342 1.0268 0.1041 -0.0691 -0.2118 344 LEU C O 5698 C CB . LEU C 36 ? 0.5257 1.4640 0.9531 0.1241 -0.1005 -0.2046 344 LEU C CB 5699 C CG . LEU C 36 ? 0.5245 1.4403 0.9256 0.1368 -0.1033 -0.2047 344 LEU C CG 5700 C CD1 . LEU C 36 ? 0.5095 1.4139 0.8761 0.1365 -0.1082 -0.1960 344 LEU C CD1 5701 C CD2 . LEU C 36 ? 0.5207 1.4444 0.9287 0.1364 -0.0844 -0.2146 344 LEU C CD2 5702 N N . GLU C 37 ? 0.5579 1.5320 1.0698 0.1122 -0.1063 -0.1985 345 GLU C N 5703 C CA . GLU C 37 ? 0.5708 1.5693 1.1161 0.1014 -0.1025 -0.1906 345 GLU C CA 5704 C C . GLU C 37 ? 0.5745 1.5960 1.1554 0.1024 -0.0855 -0.1955 345 GLU C C 5705 O O . GLU C 37 ? 0.5777 1.6276 1.1783 0.0944 -0.0693 -0.1916 345 GLU C O 5706 C CB . GLU C 37 ? 0.5845 1.5707 1.1493 0.1002 -0.1283 -0.1821 345 GLU C CB 5707 C CG . GLU C 37 ? 0.5954 1.6054 1.2007 0.0880 -0.1260 -0.1696 345 GLU C CG 5708 C CD . GLU C 37 ? 0.6191 1.6136 1.2477 0.0849 -0.1540 -0.1640 345 GLU C CD 5709 O OE1 . GLU C 37 ? 0.6182 1.6312 1.2912 0.0751 -0.1551 -0.1524 345 GLU C OE1 5710 O OE2 . GLU C 37 ? 0.6367 1.6012 1.2399 0.0922 -0.1747 -0.1718 345 GLU C OE2 5711 N N . VAL C 38 ? 0.5723 1.5828 1.1627 0.1137 -0.0876 -0.2022 346 VAL C N 5712 C CA . VAL C 38 ? 0.5837 1.6121 1.2112 0.1173 -0.0700 -0.2068 346 VAL C CA 5713 C C . VAL C 38 ? 0.5917 1.6258 1.2037 0.1170 -0.0427 -0.2228 346 VAL C C 5714 O O . VAL C 38 ? 0.5902 1.6476 1.2213 0.1136 -0.0204 -0.2290 346 VAL C O 5715 C CB . VAL C 38 ? 0.5975 1.6141 1.2479 0.1306 -0.0833 -0.2039 346 VAL C CB 5716 C CG1 . VAL C 38 ? 0.6021 1.6354 1.2940 0.1361 -0.0614 -0.2076 346 VAL C CG1 5717 C CG2 . VAL C 38 ? 0.6011 1.6166 1.2698 0.1292 -0.1122 -0.1916 346 VAL C CG2 5718 N N . PHE C 39 ? 0.6022 1.6156 1.1802 0.1207 -0.0446 -0.2301 347 PHE C N 5719 C CA . PHE C 39 ? 0.6165 1.6320 1.1814 0.1191 -0.0226 -0.2477 347 PHE C CA 5720 C C . PHE C 39 ? 0.5951 1.6008 1.1147 0.1138 -0.0278 -0.2490 347 PHE C C 5721 O O . PHE C 39 ? 0.5819 1.5642 1.0868 0.1216 -0.0368 -0.2473 347 PHE C O 5722 C CB . PHE C 39 ? 0.6547 1.6543 1.2428 0.1318 -0.0163 -0.2543 347 PHE C CB 5723 C CG . PHE C 39 ? 0.7012 1.7012 1.2883 0.1293 0.0078 -0.2759 347 PHE C CG 5724 C CD1 . PHE C 39 ? 0.7213 1.7435 1.2948 0.1171 0.0251 -0.2913 347 PHE C CD1 5725 C CD2 . PHE C 39 ? 0.7193 1.6987 1.3203 0.1392 0.0128 -0.2810 347 PHE C CD2 5726 C CE1 . PHE C 39 ? 0.7439 1.7660 1.3151 0.1136 0.0452 -0.3160 347 PHE C CE1 5727 C CE2 . PHE C 39 ? 0.7369 1.7137 1.3424 0.1354 0.0340 -0.3035 347 PHE C CE2 5728 C CZ . PHE C 39 ? 0.7499 1.7472 1.3391 0.1219 0.0493 -0.3235 347 PHE C CZ 5729 N N . PRO C 40 ? 0.6057 1.6328 1.1051 0.1016 -0.0212 -0.2491 348 PRO C N 5730 C CA . PRO C 40 ? 0.6121 1.6372 1.0719 0.0954 -0.0258 -0.2463 348 PRO C CA 5731 C C . PRO C 40 ? 0.6224 1.6392 1.0665 0.0954 -0.0169 -0.2623 348 PRO C C 5732 O O . PRO C 40 ? 0.6068 1.6161 1.0231 0.0935 -0.0241 -0.2568 348 PRO C O 5733 C CB . PRO C 40 ? 0.6155 1.6759 1.0676 0.0829 -0.0154 -0.2428 348 PRO C CB 5734 C CG . PRO C 40 ? 0.6084 1.6819 1.0964 0.0840 -0.0134 -0.2351 348 PRO C CG 5735 C CD . PRO C 40 ? 0.6112 1.6701 1.1281 0.0940 -0.0092 -0.2467 348 PRO C CD 5736 N N . GLU C 41 ? 0.4862 1.0928 0.8560 -0.0148 0.1495 0.1114 349 GLU C N 5737 C CA . GLU C 41 ? 0.4748 1.0504 0.8129 0.0075 0.1496 0.1104 349 GLU C CA 5738 C C . GLU C 41 ? 0.4310 1.0281 0.7856 0.0211 0.1247 0.1201 349 GLU C C 5739 O O . GLU C 41 ? 0.4260 1.0193 0.7939 0.0425 0.1289 0.1227 349 GLU C O 5740 C CB . GLU C 41 ? 0.5112 1.0714 0.8553 0.0229 0.1775 0.1038 349 GLU C CB 5741 C CG . GLU C 41 ? 0.5474 1.0760 0.8578 0.0127 0.2032 0.0945 349 GLU C CG 5742 C CD . GLU C 41 ? 0.5690 1.0497 0.8152 0.0119 0.1991 0.0892 349 GLU C CD 5743 O OE1 . GLU C 41 ? 0.5816 1.0351 0.8032 0.0288 0.2020 0.0829 349 GLU C OE1 5744 O OE2 . GLU C 41 ? 0.5846 1.0547 0.8076 -0.0060 0.1927 0.0906 349 GLU C OE2 5745 N N . PHE C 42 ? 0.3869 1.0039 0.7379 0.0078 0.0994 0.1250 350 PHE C N 5746 C CA . PHE C 42 ? 0.3547 0.9926 0.7145 0.0183 0.0744 0.1359 350 PHE C CA 5747 C C . PHE C 42 ? 0.3404 0.9490 0.6493 0.0185 0.0627 0.1348 350 PHE C C 5748 O O . PHE C 42 ? 0.3353 0.9497 0.6244 -0.0008 0.0481 0.1317 350 PHE C O 5749 C CB . PHE C 42 ? 0.3380 1.0250 0.7323 0.0023 0.0527 0.1406 350 PHE C CB 5750 C CG . PHE C 42 ? 0.3166 1.0316 0.7302 0.0162 0.0296 0.1541 350 PHE C CG 5751 C CD1 . PHE C 42 ? 0.3071 0.9993 0.7000 0.0385 0.0277 0.1626 350 PHE C CD1 5752 C CD2 . PHE C 42 ? 0.3230 1.0849 0.7754 0.0066 0.0098 0.1584 350 PHE C CD2 5753 C CE1 . PHE C 42 ? 0.3062 1.0199 0.7134 0.0512 0.0083 0.1775 350 PHE C CE1 5754 C CE2 . PHE C 42 ? 0.3228 1.1085 0.7885 0.0198 -0.0124 0.1720 350 PHE C CE2 5755 C CZ . PHE C 42 ? 0.3185 1.0792 0.7601 0.0424 -0.0122 0.1828 350 PHE C CZ 5756 N N . ALA C 43 ? 0.3246 0.9010 0.6156 0.0395 0.0702 0.1356 351 ALA C N 5757 C CA . ALA C 43 ? 0.3335 0.8774 0.5804 0.0418 0.0641 0.1330 351 ALA C CA 5758 C C . ALA C 43 ? 0.3401 0.9056 0.5794 0.0374 0.0388 0.1425 351 ALA C C 5759 O O . ALA C 43 ? 0.3210 0.8738 0.5272 0.0263 0.0314 0.1375 351 ALA C O 5760 C CB . ALA C 43 ? 0.3388 0.8453 0.5771 0.0651 0.0771 0.1309 351 ALA C CB 5761 N N . ALA C 44 ? 0.3615 0.9585 0.6299 0.0461 0.0261 0.1557 352 ALA C N 5762 C CA . ALA C 44 ? 0.3727 0.9892 0.6288 0.0427 0.0015 0.1653 352 ALA C CA 5763 C C . ALA C 44 ? 0.3708 1.0145 0.6210 0.0142 -0.0152 0.1572 352 ALA C C 5764 O O . ALA C 44 ? 0.3991 1.0401 0.6163 0.0032 -0.0306 0.1544 352 ALA C O 5765 C CB . ALA C 44 ? 0.4250 1.0647 0.7118 0.0598 -0.0073 0.1822 352 ALA C CB 5766 N N . ALA C 45 ? 0.3707 1.0372 0.6531 0.0013 -0.0107 0.1516 353 ALA C N 5767 C CA . ALA C 45 ? 0.3768 1.0652 0.6597 -0.0279 -0.0246 0.1413 353 ALA C CA 5768 C C . ALA C 45 ? 0.3426 1.0000 0.5840 -0.0467 -0.0197 0.1272 353 ALA C C 5769 O O . ALA C 45 ? 0.3340 0.9954 0.5533 -0.0668 -0.0372 0.1188 353 ALA C O 5770 C CB . ALA C 45 ? 0.3891 1.1018 0.7194 -0.0371 -0.0149 0.1378 353 ALA C CB 5771 N N . HIS C 46 ? 0.3189 0.9413 0.5477 -0.0402 0.0042 0.1232 354 HIS C N 5772 C CA . HIS C 46 ? 0.3069 0.8945 0.4970 -0.0555 0.0111 0.1113 354 HIS C CA 5773 C C . HIS C 46 ? 0.3218 0.8855 0.4717 -0.0504 -0.0024 0.1103 354 HIS C C 5774 O O . HIS C 46 ? 0.3643 0.9047 0.4813 -0.0693 -0.0112 0.0982 354 HIS C O 5775 C CB . HIS C 46 ? 0.2845 0.8310 0.4617 -0.0452 0.0380 0.1079 354 HIS C CB 5776 C CG . HIS C 46 ? 0.2968 0.8431 0.4916 -0.0578 0.0539 0.1035 354 HIS C CG 5777 N ND1 . HIS C 46 ? 0.3078 0.8415 0.4905 -0.0839 0.0564 0.0948 354 HIS C ND1 5778 C CD2 . HIS C 46 ? 0.3127 0.8671 0.5370 -0.0478 0.0704 0.1068 354 HIS C CD2 5779 C CE1 . HIS C 46 ? 0.3092 0.8439 0.5133 -0.0888 0.0740 0.0948 354 HIS C CE1 5780 N NE2 . HIS C 46 ? 0.3125 0.8613 0.5417 -0.0675 0.0832 0.1014 354 HIS C NE2 5781 N N . SER C 47 ? 0.3067 0.8676 0.4579 -0.0242 -0.0020 0.1219 355 SER C N 5782 C CA . SER C 47 ? 0.3326 0.8627 0.4452 -0.0163 -0.0111 0.1225 355 SER C CA 5783 C C . SER C 47 ? 0.3362 0.8939 0.4370 -0.0293 -0.0365 0.1239 355 SER C C 5784 O O . SER C 47 ? 0.3135 0.8405 0.3717 -0.0372 -0.0426 0.1156 355 SER C O 5785 C CB . SER C 47 ? 0.3708 0.8954 0.4955 0.0143 -0.0036 0.1368 355 SER C CB 5786 O OG . SER C 47 ? 0.4436 0.9434 0.5362 0.0214 -0.0113 0.1404 355 SER C OG 5787 N N . ASN C 48 ? 0.3610 0.9724 0.4974 -0.0313 -0.0503 0.1330 356 ASN C N 5788 C CA . ASN C 48 ? 0.4004 1.0278 0.5197 -0.0439 -0.0737 0.1308 356 ASN C CA 5789 C C . ASN C 48 ? 0.3877 1.0107 0.4887 -0.0768 -0.0811 0.1092 356 ASN C C 5790 O O . ASN C 48 ? 0.4170 1.0227 0.4777 -0.0880 -0.0928 0.0992 356 ASN C O 5791 C CB . ASN C 48 ? 0.4652 1.1331 0.6247 -0.0366 -0.0841 0.1427 356 ASN C CB 5792 C CG . ASN C 48 ? 0.4989 1.1659 0.6698 -0.0057 -0.0804 0.1640 356 ASN C CG 5793 O OD1 . ASN C 48 ? 0.4954 1.1328 0.6368 0.0081 -0.0754 0.1701 356 ASN C OD1 5794 N ND2 . ASN C 48 ? 0.5159 1.2127 0.7325 0.0050 -0.0815 0.1749 356 ASN C ND2 5795 N N . LEU C 49 ? 0.3500 0.9822 0.4802 -0.0919 -0.0706 0.1010 357 LEU C N 5796 C CA . LEU C 49 ? 0.3518 0.9739 0.4709 -0.1240 -0.0731 0.0805 357 LEU C CA 5797 C C . LEU C 49 ? 0.3368 0.8988 0.4052 -0.1291 -0.0633 0.0678 357 LEU C C 5798 O O . LEU C 49 ? 0.3644 0.9100 0.4044 -0.1502 -0.0722 0.0511 357 LEU C O 5799 C CB . LEU C 49 ? 0.3540 0.9856 0.5140 -0.1354 -0.0565 0.0776 357 LEU C CB 5800 C CG . LEU C 49 ? 0.3699 0.9865 0.5266 -0.1683 -0.0547 0.0581 357 LEU C CG 5801 C CD1 . LEU C 49 ? 0.3689 1.0051 0.5235 -0.1851 -0.0797 0.0464 357 LEU C CD1 5802 C CD2 . LEU C 49 ? 0.3710 0.9906 0.5666 -0.1741 -0.0335 0.0601 357 LEU C CD2 5803 N N . ALA C 50 ? 0.3113 0.8344 0.3682 -0.1084 -0.0439 0.0743 358 ALA C N 5804 C CA . ALA C 50 ? 0.3232 0.7842 0.3366 -0.1085 -0.0333 0.0638 358 ALA C CA 5805 C C . ALA C 50 ? 0.3596 0.8086 0.3351 -0.1074 -0.0464 0.0603 358 ALA C C 5806 O O . ALA C 50 ? 0.3886 0.8055 0.3331 -0.1236 -0.0465 0.0441 358 ALA C O 5807 C CB . ALA C 50 ? 0.2867 0.7162 0.2992 -0.0847 -0.0144 0.0717 358 ALA C CB 5808 N N . SER C 51 ? 0.3642 0.8379 0.3427 -0.0875 -0.0555 0.0765 359 SER C N 5809 C CA . SER C 51 ? 0.4175 0.8830 0.3579 -0.0838 -0.0662 0.0777 359 SER C CA 5810 C C . SER C 51 ? 0.4557 0.9299 0.3799 -0.1083 -0.0811 0.0612 359 SER C C 5811 O O . SER C 51 ? 0.4893 0.9274 0.3757 -0.1143 -0.0793 0.0487 359 SER C O 5812 C CB . SER C 51 ? 0.4588 0.9471 0.4150 -0.0574 -0.0704 0.1005 359 SER C CB 5813 O OG . SER C 51 ? 0.5476 1.0136 0.4711 -0.0520 -0.0739 0.1010 359 SER C OG 5814 N N . VAL C 52 ? 0.4359 0.9544 0.3924 -0.1214 -0.0935 0.0599 360 VAL C N 5815 C CA . VAL C 52 ? 0.4774 1.0039 0.4236 -0.1448 -0.1079 0.0425 360 VAL C CA 5816 C C . VAL C 52 ? 0.4950 0.9863 0.4237 -0.1710 -0.0993 0.0179 360 VAL C C 5817 O O . VAL C 52 ? 0.5431 1.0085 0.4382 -0.1831 -0.1024 0.0007 360 VAL C O 5818 C CB . VAL C 52 ? 0.5153 1.0954 0.5076 -0.1512 -0.1222 0.0470 360 VAL C CB 5819 C CG1 . VAL C 52 ? 0.5588 1.1421 0.5469 -0.1801 -0.1343 0.0237 360 VAL C CG1 5820 C CG2 . VAL C 52 ? 0.5303 1.1405 0.5321 -0.1280 -0.1353 0.0680 360 VAL C CG2 5821 N N . LEU C 53 ? 0.4414 0.9299 0.3940 -0.1791 -0.0870 0.0164 361 LEU C N 5822 C CA . LEU C 53 ? 0.4499 0.8960 0.3897 -0.2012 -0.0747 -0.0039 361 LEU C CA 5823 C C . LEU C 53 ? 0.4790 0.8685 0.3712 -0.1934 -0.0644 -0.0111 361 LEU C C 5824 O O . LEU C 53 ? 0.5127 0.8710 0.3815 -0.2125 -0.0617 -0.0319 361 LEU C O 5825 C CB . LEU C 53 ? 0.4091 0.8415 0.3811 -0.1995 -0.0541 0.0027 361 LEU C CB 5826 C CG . LEU C 53 ? 0.4063 0.8858 0.4290 -0.2141 -0.0568 0.0053 361 LEU C CG 5827 C CD1 . LEU C 53 ? 0.3854 0.8465 0.4300 -0.2073 -0.0322 0.0153 361 LEU C CD1 5828 C CD2 . LEU C 53 ? 0.4262 0.9089 0.4536 -0.2467 -0.0656 -0.0164 361 LEU C CD2 5829 N N . GLN C 54 ? 0.4658 0.8425 0.3483 -0.1655 -0.0573 0.0054 362 GLN C N 5830 C CA . GLN C 54 ? 0.5024 0.8295 0.3476 -0.1557 -0.0462 0.0009 362 GLN C CA 5831 C C . GLN C 54 ? 0.5357 0.8544 0.3515 -0.1613 -0.0537 -0.0102 362 GLN C C 5832 O O . GLN C 54 ? 0.5340 0.8100 0.3248 -0.1689 -0.0439 -0.0262 362 GLN C O 5833 C CB . GLN C 54 ? 0.5127 0.8327 0.3621 -0.1247 -0.0379 0.0213 362 GLN C CB 5834 C CG . GLN C 54 ? 0.5742 0.8446 0.3969 -0.1124 -0.0256 0.0180 362 GLN C CG 5835 C CD . GLN C 54 ? 0.5852 0.8482 0.4191 -0.0834 -0.0177 0.0365 362 GLN C CD 5836 O OE1 . GLN C 54 ? 0.5725 0.8667 0.4312 -0.0713 -0.0206 0.0519 362 GLN C OE1 5837 N NE2 . GLN C 54 ? 0.5818 0.8039 0.3997 -0.0728 -0.0065 0.0342 362 GLN C NE2 5838 N N . GLN C 55 ? 0.5830 0.9404 0.4033 -0.1561 -0.0700 -0.0014 363 GLN C N 5839 C CA . GLN C 55 ? 0.6554 1.0066 0.4445 -0.1603 -0.0786 -0.0109 363 GLN C CA 5840 C C . GLN C 55 ? 0.6688 1.0093 0.4486 -0.1893 -0.0813 -0.0380 363 GLN C C 5841 O O . GLN C 55 ? 0.6988 1.0111 0.4449 -0.1947 -0.0787 -0.0530 363 GLN C O 5842 C CB . GLN C 55 ? 0.7132 1.1107 0.5103 -0.1499 -0.0983 0.0048 363 GLN C CB 5843 C CG . GLN C 55 ? 0.7594 1.1598 0.5597 -0.1201 -0.0945 0.0306 363 GLN C CG 5844 C CD . GLN C 55 ? 0.8496 1.2877 0.6503 -0.1099 -0.1137 0.0455 363 GLN C CD 5845 O OE1 . GLN C 55 ? 0.8803 1.3608 0.7041 -0.1199 -0.1312 0.0449 363 GLN C OE1 5846 N NE2 . GLN C 55 ? 0.8931 1.3145 0.6690 -0.0902 -0.1105 0.0593 363 GLN C NE2 5847 N N . GLN C 56 ? 0.6360 0.9973 0.4475 -0.2075 -0.0847 -0.0442 364 GLN C N 5848 C CA . GLN C 56 ? 0.6500 0.9994 0.4615 -0.2355 -0.0854 -0.0696 364 GLN C CA 5849 C C . GLN C 56 ? 0.6344 0.9270 0.4318 -0.2442 -0.0639 -0.0847 364 GLN C C 5850 O O . GLN C 56 ? 0.6874 0.9578 0.4813 -0.2647 -0.0599 -0.1065 364 GLN C O 5851 C CB . GLN C 56 ? 0.6494 1.0374 0.5067 -0.2513 -0.0935 -0.0696 364 GLN C CB 5852 C CG . GLN C 56 ? 0.6962 1.1399 0.5730 -0.2473 -0.1166 -0.0603 364 GLN C CG 5853 C CD . GLN C 56 ? 0.7185 1.1966 0.6463 -0.2637 -0.1220 -0.0625 364 GLN C CD 5854 O OE1 . GLN C 56 ? 0.7079 1.1896 0.6669 -0.2635 -0.1091 -0.0531 364 GLN C OE1 5855 N NE2 . GLN C 56 ? 0.7569 1.2595 0.6947 -0.2779 -0.1404 -0.0753 364 GLN C NE2 5856 N N . GLY C 57 ? 0.5562 0.8240 0.3480 -0.2273 -0.0501 -0.0728 365 GLY C N 5857 C CA . GLY C 57 ? 0.5652 0.7787 0.3469 -0.2324 -0.0305 -0.0844 365 GLY C CA 5858 C C . GLY C 57 ? 0.5423 0.7508 0.3522 -0.2450 -0.0237 -0.0842 365 GLY C C 5859 O O . GLY C 57 ? 0.5636 0.7237 0.3742 -0.2470 -0.0066 -0.0904 365 GLY C O 5860 N N . LYS C 58 ? 0.5071 0.7605 0.3505 -0.2461 -0.0328 -0.0714 366 LYS C N 5861 C CA . LYS C 58 ? 0.4719 0.7180 0.3501 -0.2489 -0.0206 -0.0629 366 LYS C CA 5862 C C . LYS C 58 ? 0.4658 0.7003 0.3479 -0.2192 -0.0101 -0.0407 366 LYS C C 5863 O O . LYS C 58 ? 0.4390 0.7082 0.3446 -0.2077 -0.0124 -0.0241 366 LYS C O 5864 C CB . LYS C 58 ? 0.4656 0.7654 0.3814 -0.2650 -0.0318 -0.0610 366 LYS C CB 5865 C CG . LYS C 58 ? 0.5169 0.8236 0.4330 -0.2905 -0.0418 -0.0834 366 LYS C CG 5866 C CD . LYS C 58 ? 0.5251 0.8791 0.4852 -0.3007 -0.0508 -0.0797 366 LYS C CD 5867 C CE . LYS C 58 ? 0.5774 0.9318 0.5383 -0.3202 -0.0609 -0.1020 366 LYS C CE 5868 N NZ . LYS C 58 ? 0.5753 0.9766 0.5836 -0.3303 -0.0715 -0.0997 366 LYS C NZ 5869 N N . LEU C 59 ? 0.4820 0.6676 0.3434 -0.2072 0.0018 -0.0421 367 LEU C N 5870 C CA . LEU C 59 ? 0.4573 0.6294 0.3182 -0.1793 0.0089 -0.0254 367 LEU C CA 5871 C C . LEU C 59 ? 0.4674 0.6351 0.3497 -0.1736 0.0184 -0.0129 367 LEU C C 5872 O O . LEU C 59 ? 0.4773 0.6624 0.3690 -0.1544 0.0190 0.0016 367 LEU C O 5873 C CB . LEU C 59 ? 0.4442 0.5670 0.2827 -0.1704 0.0180 -0.0324 367 LEU C CB 5874 C CG . LEU C 59 ? 0.4805 0.6012 0.2915 -0.1762 0.0136 -0.0459 367 LEU C CG 5875 C CD1 . LEU C 59 ? 0.4655 0.5374 0.2616 -0.1663 0.0269 -0.0519 367 LEU C CD1 5876 C CD2 . LEU C 59 ? 0.4858 0.6495 0.2902 -0.1643 0.0012 -0.0344 367 LEU C CD2 5877 N N . GLN C 60 ? 0.4797 0.6220 0.3679 -0.1899 0.0272 -0.0185 368 GLN C N 5878 C CA . GLN C 60 ? 0.4542 0.5893 0.3559 -0.1858 0.0380 -0.0054 368 GLN C CA 5879 C C . GLN C 60 ? 0.4055 0.5918 0.3323 -0.1871 0.0359 0.0046 368 GLN C C 5880 O O . GLN C 60 ? 0.3650 0.5584 0.2975 -0.1709 0.0427 0.0184 368 GLN C O 5881 C CB . GLN C 60 ? 0.4925 0.5914 0.3970 -0.2049 0.0486 -0.0111 368 GLN C CB 5882 C CG . GLN C 60 ? 0.5553 0.5994 0.4419 -0.1961 0.0546 -0.0140 368 GLN C CG 5883 C CD . GLN C 60 ? 0.6578 0.6643 0.5501 -0.2141 0.0655 -0.0183 368 GLN C CD 5884 O OE1 . GLN C 60 ? 0.7231 0.6906 0.6099 -0.2044 0.0730 -0.0094 368 GLN C OE1 5885 N NE2 . GLN C 60 ? 0.6578 0.6754 0.5630 -0.2405 0.0656 -0.0319 368 GLN C NE2 5886 N N . GLU C 61 ? 0.3977 0.6207 0.3405 -0.2062 0.0262 -0.0036 369 GLU C N 5887 C CA . GLU C 61 ? 0.3905 0.6676 0.3658 -0.2085 0.0229 0.0053 369 GLU C CA 5888 C C . GLU C 61 ? 0.3665 0.6744 0.3433 -0.1831 0.0150 0.0169 369 GLU C C 5889 O O . GLU C 61 ? 0.3516 0.6884 0.3521 -0.1724 0.0204 0.0297 369 GLU C O 5890 C CB . GLU C 61 ? 0.4108 0.7218 0.4063 -0.2363 0.0106 -0.0083 369 GLU C CB 5891 C CG . GLU C 61 ? 0.4029 0.7576 0.4432 -0.2479 0.0146 -0.0012 369 GLU C CG 5892 C CD . GLU C 61 ? 0.4386 0.8279 0.5042 -0.2777 0.0001 -0.0171 369 GLU C CD 5893 O OE1 . GLU C 61 ? 0.4571 0.8266 0.4983 -0.2900 -0.0107 -0.0357 369 GLU C OE1 5894 O OE2 . GLU C 61 ? 0.4357 0.8600 0.5407 -0.2806 0.0002 -0.0117 369 GLU C OE2 5895 N N . ALA C 62 ? 0.3700 0.6695 0.3225 -0.1732 0.0046 0.0129 370 ALA C N 5896 C CA . ALA C 62 ? 0.3837 0.7049 0.3367 -0.1481 -0.0012 0.0254 370 ALA C CA 5897 C C . ALA C 62 ? 0.4058 0.7033 0.3581 -0.1252 0.0133 0.0359 370 ALA C C 5898 O O . ALA C 62 ? 0.4106 0.7333 0.3801 -0.1072 0.0147 0.0478 370 ALA C O 5899 C CB . ALA C 62 ? 0.4060 0.7146 0.3290 -0.1432 -0.0110 0.0197 370 ALA C CB 5900 N N . LEU C 63 ? 0.3930 0.6418 0.3262 -0.1262 0.0233 0.0307 371 LEU C N 5901 C CA . LEU C 63 ? 0.4002 0.6228 0.3267 -0.1062 0.0337 0.0375 371 LEU C CA 5902 C C . LEU C 63 ? 0.3905 0.6348 0.3360 -0.1026 0.0441 0.0469 371 LEU C C 5903 O O . LEU C 63 ? 0.3744 0.6198 0.3217 -0.0824 0.0498 0.0534 371 LEU C O 5904 C CB . LEU C 63 ? 0.4463 0.6164 0.3513 -0.1103 0.0392 0.0307 371 LEU C CB 5905 C CG . LEU C 63 ? 0.4767 0.6131 0.3676 -0.0892 0.0408 0.0316 371 LEU C CG 5906 C CD1 . LEU C 63 ? 0.4935 0.6353 0.3827 -0.0782 0.0340 0.0296 371 LEU C CD1 5907 C CD2 . LEU C 63 ? 0.4683 0.5579 0.3443 -0.0952 0.0441 0.0262 371 LEU C CD2 5908 N N . MET C 64 ? 0.3722 0.6329 0.3331 -0.1230 0.0484 0.0466 372 MET C N 5909 C CA . MET C 64 ? 0.3461 0.6299 0.3278 -0.1223 0.0620 0.0558 372 MET C CA 5910 C C . MET C 64 ? 0.3388 0.6681 0.3472 -0.1061 0.0602 0.0636 372 MET C C 5911 O O . MET C 64 ? 0.3538 0.6871 0.3676 -0.0909 0.0736 0.0704 372 MET C O 5912 C CB . MET C 64 ? 0.3506 0.6521 0.3545 -0.1497 0.0660 0.0537 372 MET C CB 5913 C CG . MET C 64 ? 0.3756 0.6323 0.3614 -0.1637 0.0774 0.0521 372 MET C CG 5914 S SD . MET C 64 ? 0.4532 0.7333 0.4750 -0.1964 0.0854 0.0503 372 MET C SD 5915 C CE . MET C 64 ? 0.4276 0.7357 0.4762 -0.1816 0.1015 0.0636 372 MET C CE 5916 N N . HIS C 65 ? 0.3122 0.6756 0.3367 -0.1090 0.0439 0.0627 373 HIS C N 5917 C CA . HIS C 65 ? 0.2881 0.6990 0.3448 -0.0942 0.0406 0.0728 373 HIS C CA 5918 C C . HIS C 65 ? 0.2757 0.6716 0.3210 -0.0660 0.0415 0.0779 373 HIS C C 5919 O O . HIS C 65 ? 0.2603 0.6787 0.3297 -0.0485 0.0494 0.0864 373 HIS C O 5920 C CB . HIS C 65 ? 0.2748 0.7311 0.3530 -0.1074 0.0204 0.0721 373 HIS C CB 5921 C CG . HIS C 65 ? 0.3187 0.7972 0.4207 -0.1354 0.0205 0.0662 373 HIS C CG 5922 N ND1 . HIS C 65 ? 0.3226 0.8392 0.4684 -0.1388 0.0315 0.0734 373 HIS C ND1 5923 C CD2 . HIS C 65 ? 0.3478 0.8129 0.4389 -0.1618 0.0137 0.0528 373 HIS C CD2 5924 C CE1 . HIS C 65 ? 0.3484 0.8709 0.5092 -0.1654 0.0302 0.0650 373 HIS C CE1 5925 N NE2 . HIS C 65 ? 0.3789 0.8747 0.5090 -0.1816 0.0195 0.0524 373 HIS C NE2 5926 N N . TYR C 66 ? 0.2800 0.6367 0.2926 -0.0620 0.0357 0.0719 374 TYR C N 5927 C CA . TYR C 66 ? 0.2867 0.6225 0.2905 -0.0375 0.0388 0.0749 374 TYR C CA 5928 C C . TYR C 66 ? 0.3076 0.6231 0.3085 -0.0257 0.0555 0.0740 374 TYR C C 5929 O O . TYR C 66 ? 0.3186 0.6390 0.3320 -0.0054 0.0619 0.0779 374 TYR C O 5930 C CB . TYR C 66 ? 0.3094 0.6046 0.2821 -0.0380 0.0324 0.0674 374 TYR C CB 5931 C CG . TYR C 66 ? 0.2941 0.6062 0.2630 -0.0407 0.0184 0.0699 374 TYR C CG 5932 C CD1 . TYR C 66 ? 0.2882 0.6353 0.2768 -0.0260 0.0126 0.0830 374 TYR C CD1 5933 C CD2 . TYR C 66 ? 0.2882 0.5803 0.2320 -0.0572 0.0118 0.0596 374 TYR C CD2 5934 C CE1 . TYR C 66 ? 0.2852 0.6476 0.2636 -0.0276 -0.0010 0.0875 374 TYR C CE1 5935 C CE2 . TYR C 66 ? 0.3011 0.6076 0.2336 -0.0598 0.0000 0.0609 374 TYR C CE2 5936 C CZ . TYR C 66 ? 0.3150 0.6570 0.2623 -0.0450 -0.0071 0.0757 374 TYR C CZ 5937 O OH . TYR C 66 ? 0.3488 0.7048 0.2783 -0.0467 -0.0198 0.0792 374 TYR C OH 5938 N N . LYS C 67 ? 0.2833 0.5748 0.2663 -0.0386 0.0628 0.0686 375 LYS C N 5939 C CA . LYS C 67 ? 0.2989 0.5684 0.2699 -0.0286 0.0772 0.0674 375 LYS C CA 5940 C C . LYS C 67 ? 0.2998 0.6002 0.2990 -0.0219 0.0892 0.0725 375 LYS C C 5941 O O . LYS C 67 ? 0.2627 0.5515 0.2595 -0.0049 0.0989 0.0702 375 LYS C O 5942 C CB . LYS C 67 ? 0.3407 0.5742 0.2848 -0.0430 0.0807 0.0635 375 LYS C CB 5943 C CG . LYS C 67 ? 0.3724 0.5678 0.2904 -0.0453 0.0708 0.0574 375 LYS C CG 5944 C CD . LYS C 67 ? 0.4193 0.5820 0.3157 -0.0597 0.0742 0.0568 375 LYS C CD 5945 C CE . LYS C 67 ? 0.4173 0.5420 0.2969 -0.0603 0.0637 0.0500 375 LYS C CE 5946 N NZ . LYS C 67 ? 0.4284 0.5199 0.2913 -0.0733 0.0666 0.0511 375 LYS C NZ 5947 N N . GLU C 68 ? 0.3058 0.6456 0.3336 -0.0360 0.0887 0.0780 376 GLU C N 5948 C CA . GLU C 68 ? 0.3675 0.7394 0.4301 -0.0296 0.0995 0.0832 376 GLU C CA 5949 C C . GLU C 68 ? 0.3506 0.7412 0.4355 -0.0067 0.0966 0.0875 376 GLU C C 5950 O O . GLU C 68 ? 0.3593 0.7452 0.4536 0.0086 0.1101 0.0864 376 GLU C O 5951 C CB . GLU C 68 ? 0.4343 0.8484 0.5306 -0.0499 0.0953 0.0875 376 GLU C CB 5952 C CG . GLU C 68 ? 0.5213 0.9175 0.6076 -0.0710 0.1057 0.0846 376 GLU C CG 5953 C CD . GLU C 68 ? 0.5928 0.9649 0.6690 -0.0623 0.1291 0.0850 376 GLU C CD 5954 O OE1 . GLU C 68 ? 0.5693 0.9628 0.6720 -0.0498 0.1399 0.0874 376 GLU C OE1 5955 O OE2 . GLU C 68 ? 0.6641 0.9944 0.7043 -0.0676 0.1370 0.0829 376 GLU C OE2 5956 N N . ALA C 69 ? 0.3172 0.7264 0.4091 -0.0047 0.0802 0.0926 377 ALA C N 5957 C CA . ALA C 69 ? 0.3028 0.7270 0.4170 0.0174 0.0765 0.1001 377 ALA C CA 5958 C C . ALA C 69 ? 0.3014 0.6851 0.3999 0.0375 0.0878 0.0933 377 ALA C C 5959 O O . ALA C 69 ? 0.3136 0.7007 0.4343 0.0539 0.0963 0.0949 377 ALA C O 5960 C CB . ALA C 69 ? 0.2867 0.7295 0.4000 0.0160 0.0581 0.1074 377 ALA C CB 5961 N N . ILE C 70 ? 0.3327 0.6768 0.3943 0.0349 0.0875 0.0842 378 ILE C N 5962 C CA . ILE C 70 ? 0.3462 0.6542 0.3942 0.0522 0.0945 0.0756 378 ILE C CA 5963 C C . ILE C 70 ? 0.3601 0.6527 0.4001 0.0563 0.1107 0.0666 378 ILE C C 5964 O O . ILE C 70 ? 0.3890 0.6626 0.4283 0.0719 0.1180 0.0588 378 ILE C O 5965 C CB . ILE C 70 ? 0.3569 0.6285 0.3713 0.0492 0.0875 0.0682 378 ILE C CB 5966 C CG1 . ILE C 70 ? 0.3656 0.6153 0.3481 0.0316 0.0873 0.0620 378 ILE C CG1 5967 C CG2 . ILE C 70 ? 0.3488 0.6258 0.3672 0.0458 0.0727 0.0747 378 ILE C CG2 5968 C CD1 . ILE C 70 ? 0.3852 0.5909 0.3376 0.0307 0.0789 0.0529 378 ILE C CD1 5969 N N . ARG C 71 ? 0.3229 0.6222 0.3563 0.0415 0.1173 0.0671 379 ARG C N 5970 C CA . ARG C 71 ? 0.4109 0.6971 0.4336 0.0444 0.1352 0.0601 379 ARG C CA 5971 C C . ARG C 71 ? 0.4336 0.7473 0.4964 0.0555 0.1468 0.0629 379 ARG C C 5972 O O . ARG C 71 ? 0.4796 0.7792 0.5396 0.0677 0.1603 0.0538 379 ARG C O 5973 C CB . ARG C 71 ? 0.4135 0.6956 0.4189 0.0252 0.1416 0.0621 379 ARG C CB 5974 C CG . ARG C 71 ? 0.4848 0.7565 0.4788 0.0274 0.1630 0.0571 379 ARG C CG 5975 C CD . ARG C 71 ? 0.5213 0.7920 0.5064 0.0083 0.1724 0.0626 379 ARG C CD 5976 N NE . ARG C 71 ? 0.4943 0.8056 0.5227 -0.0039 0.1691 0.0720 379 ARG C NE 5977 C CZ . ARG C 71 ? 0.4928 0.8406 0.5650 -0.0015 0.1792 0.0756 379 ARG C CZ 5978 N NH1 . ARG C 71 ? 0.5060 0.8530 0.5847 0.0128 0.1956 0.0701 379 ARG C NH1 5979 N NH2 . ARG C 71 ? 0.5108 0.8969 0.6222 -0.0142 0.1721 0.0833 379 ARG C NH2 5980 N N . ILE C 72 ? 0.3950 0.7484 0.4955 0.0506 0.1407 0.0745 380 ILE C N 5981 C CA . ILE C 72 ? 0.3382 0.7209 0.4830 0.0606 0.1489 0.0793 380 ILE C CA 5982 C C . ILE C 72 ? 0.3496 0.7212 0.5065 0.0815 0.1468 0.0779 380 ILE C C 5983 O O . ILE C 72 ? 0.3507 0.7205 0.5258 0.0934 0.1612 0.0726 380 ILE C O 5984 C CB . ILE C 72 ? 0.3186 0.7476 0.5007 0.0508 0.1364 0.0927 380 ILE C CB 5985 C CG1 . ILE C 72 ? 0.3146 0.7525 0.4900 0.0275 0.1398 0.0924 380 ILE C CG1 5986 C CG2 . ILE C 72 ? 0.3241 0.7833 0.5554 0.0626 0.1428 0.0985 380 ILE C CG2 5987 C CD1 . ILE C 72 ? 0.3220 0.8058 0.5324 0.0138 0.1243 0.1021 380 ILE C CD1 5988 N N . SER C 73 ? 0.3636 0.7259 0.5106 0.0850 0.1304 0.0820 381 SER C N 5989 C CA . SER C 73 ? 0.3979 0.7430 0.5548 0.1028 0.1283 0.0816 381 SER C CA 5990 C C . SER C 73 ? 0.4475 0.7540 0.5698 0.1044 0.1236 0.0718 381 SER C C 5991 O O . SER C 73 ? 0.4320 0.7380 0.5422 0.0988 0.1100 0.0776 381 SER C O 5992 C CB . SER C 73 ? 0.3797 0.7527 0.5654 0.1078 0.1137 0.0997 381 SER C CB 5993 O OG . SER C 73 ? 0.3712 0.7218 0.5643 0.1235 0.1129 0.1011 381 SER C OG 5994 N N . PRO C 74 ? 0.4924 0.7679 0.5996 0.1114 0.1349 0.0554 382 PRO C N 5995 C CA . PRO C 74 ? 0.4932 0.7325 0.5714 0.1136 0.1302 0.0435 382 PRO C CA 5996 C C . PRO C 74 ? 0.4992 0.7243 0.5947 0.1235 0.1219 0.0466 382 PRO C C 5997 O O . PRO C 74 ? 0.5278 0.7253 0.6066 0.1243 0.1165 0.0379 382 PRO C O 5998 C CB . PRO C 74 ? 0.4931 0.7104 0.5557 0.1190 0.1448 0.0245 382 PRO C CB 5999 C CG . PRO C 74 ? 0.5426 0.7837 0.6136 0.1142 0.1586 0.0276 382 PRO C CG 6000 C CD . PRO C 74 ? 0.5244 0.7999 0.6379 0.1156 0.1535 0.0453 382 PRO C CD 6001 N N . THR C 75 ? 0.4968 0.7390 0.6253 0.1305 0.1210 0.0593 383 THR C N 6002 C CA . THR C 75 ? 0.5030 0.7297 0.6459 0.1384 0.1147 0.0655 383 THR C CA 6003 C C . THR C 75 ? 0.4804 0.7290 0.6245 0.1348 0.1019 0.0866 383 THR C C 6004 O O . THR C 75 ? 0.5158 0.7572 0.6703 0.1413 0.0979 0.0974 383 THR C O 6005 C CB . THR C 75 ? 0.5673 0.7932 0.7429 0.1504 0.1231 0.0662 383 THR C CB 6006 O OG1 . THR C 75 ? 0.5699 0.8331 0.7681 0.1520 0.1246 0.0809 383 THR C OG1 6007 C CG2 . THR C 75 ? 0.5700 0.7749 0.7437 0.1544 0.1361 0.0423 383 THR C CG2 6008 N N . PHE C 76 ? 0.4284 0.7048 0.5607 0.1234 0.0962 0.0919 384 PHE C N 6009 C CA . PHE C 76 ? 0.3661 0.6721 0.4990 0.1180 0.0831 0.1095 384 PHE C CA 6010 C C . PHE C 76 ? 0.3080 0.5927 0.4181 0.1151 0.0770 0.1084 384 PHE C C 6011 O O . PHE C 76 ? 0.2632 0.5534 0.3517 0.1019 0.0725 0.1039 384 PHE C O 6012 C CB . PHE C 76 ? 0.3246 0.6672 0.4553 0.1024 0.0791 0.1112 384 PHE C CB 6013 C CG . PHE C 76 ? 0.2894 0.6762 0.4344 0.0976 0.0649 0.1290 384 PHE C CG 6014 C CD1 . PHE C 76 ? 0.2728 0.6969 0.4265 0.0821 0.0600 0.1303 384 PHE C CD1 6015 C CD2 . PHE C 76 ? 0.2898 0.6802 0.4385 0.1073 0.0563 0.1440 384 PHE C CD2 6016 C CE1 . PHE C 76 ? 0.2836 0.7505 0.4507 0.0756 0.0434 0.1439 384 PHE C CE1 6017 C CE2 . PHE C 76 ? 0.2693 0.7018 0.4258 0.1025 0.0406 0.1598 384 PHE C CE2 6018 C CZ . PHE C 76 ? 0.2987 0.7702 0.4646 0.0863 0.0324 0.1585 384 PHE C CZ 6019 N N . ALA C 77 ? 0.2614 0.5199 0.3775 0.1259 0.0787 0.1119 385 ALA C N 6020 C CA . ALA C 77 ? 0.2420 0.4751 0.3414 0.1245 0.0765 0.1098 385 ALA C CA 6021 C C . ALA C 77 ? 0.2260 0.4899 0.3129 0.1177 0.0672 0.1235 385 ALA C C 6022 O O . ALA C 77 ? 0.2004 0.4402 0.2593 0.1048 0.0629 0.1135 385 ALA C O 6023 C CB . ALA C 77 ? 0.2738 0.4755 0.3865 0.1348 0.0819 0.1129 385 ALA C CB 6024 N N . ASP C 78 ? 0.2525 0.5556 0.3510 0.1199 0.0595 0.1419 386 ASP C N 6025 C CA . ASP C 78 ? 0.2735 0.5964 0.3490 0.1074 0.0446 0.1510 386 ASP C CA 6026 C C . ASP C 78 ? 0.2612 0.5836 0.3103 0.0825 0.0371 0.1342 386 ASP C C 6027 O O . ASP C 78 ? 0.2623 0.5730 0.2806 0.0681 0.0294 0.1294 386 ASP C O 6028 C CB . ASP C 78 ? 0.3453 0.7183 0.4430 0.1154 0.0344 0.1735 386 ASP C CB 6029 C CG . ASP C 78 ? 0.4648 0.8521 0.5331 0.1066 0.0179 0.1845 386 ASP C CG 6030 O OD1 . ASP C 78 ? 0.5219 0.8815 0.5700 0.1124 0.0217 0.1905 386 ASP C OD1 6031 O OD2 . ASP C 78 ? 0.5013 0.9272 0.5665 0.0930 0.0018 0.1859 386 ASP C OD2 6032 N N . ALA C 79 ? 0.2489 0.5815 0.3101 0.0778 0.0418 0.1253 387 ALA C N 6033 C CA . ALA C 79 ? 0.2406 0.5708 0.2812 0.0550 0.0377 0.1117 387 ALA C CA 6034 C C . ALA C 79 ? 0.2483 0.5288 0.2603 0.0485 0.0419 0.0956 387 ALA C C 6035 O O . ALA C 79 ? 0.2532 0.5217 0.2410 0.0304 0.0357 0.0876 387 ALA C O 6036 C CB . ALA C 79 ? 0.2462 0.5999 0.3082 0.0531 0.0453 0.1095 387 ALA C CB 6037 N N . TYR C 80 ? 0.2170 0.4692 0.2350 0.0632 0.0520 0.0901 388 TYR C N 6038 C CA . TYR C 80 ? 0.2288 0.4364 0.2263 0.0597 0.0533 0.0760 388 TYR C CA 6039 C C . TYR C 80 ? 0.2274 0.4190 0.2104 0.0548 0.0483 0.0778 388 TYR C C 6040 O O . TYR C 80 ? 0.2400 0.4076 0.2024 0.0421 0.0455 0.0677 388 TYR C O 6041 C CB . TYR C 80 ? 0.2473 0.4314 0.2588 0.0771 0.0624 0.0693 388 TYR C CB 6042 C CG . TYR C 80 ? 0.2673 0.4456 0.2731 0.0771 0.0676 0.0579 388 TYR C CG 6043 C CD1 . TYR C 80 ? 0.2986 0.4513 0.2780 0.0661 0.0636 0.0461 388 TYR C CD1 6044 C CD2 . TYR C 80 ? 0.2679 0.4652 0.2937 0.0891 0.0777 0.0598 388 TYR C CD2 6045 C CE1 . TYR C 80 ? 0.3160 0.4625 0.2829 0.0668 0.0686 0.0378 388 TYR C CE1 6046 C CE2 . TYR C 80 ? 0.3142 0.5048 0.3284 0.0893 0.0850 0.0488 388 TYR C CE2 6047 C CZ . TYR C 80 ? 0.3441 0.5092 0.3259 0.0780 0.0800 0.0384 388 TYR C CZ 6048 O OH . TYR C 80 ? 0.4332 0.5910 0.3968 0.0788 0.0874 0.0296 388 TYR C OH 6049 N N . SER C 81 ? 0.2195 0.4239 0.2132 0.0656 0.0487 0.0919 389 SER C N 6050 C CA . SER C 81 ? 0.2387 0.4279 0.2156 0.0627 0.0477 0.0953 389 SER C CA 6051 C C . SER C 81 ? 0.2875 0.4893 0.2368 0.0420 0.0376 0.0919 389 SER C C 6052 O O . SER C 81 ? 0.2895 0.4650 0.2176 0.0313 0.0386 0.0818 389 SER C O 6053 C CB . SER C 81 ? 0.2955 0.4980 0.2863 0.0794 0.0509 0.1152 389 SER C CB 6054 O OG . SER C 81 ? 0.3165 0.5015 0.2868 0.0773 0.0533 0.1195 389 SER C OG 6055 N N . ASN C 82 ? 0.2836 0.5261 0.2371 0.0362 0.0283 0.0991 390 ASN C N 6056 C CA . ASN C 82 ? 0.3025 0.5601 0.2333 0.0149 0.0173 0.0936 390 ASN C CA 6057 C C . ASN C 82 ? 0.2745 0.5096 0.1942 -0.0031 0.0190 0.0756 390 ASN C C 6058 O O . ASN C 82 ? 0.2915 0.5153 0.1881 -0.0201 0.0153 0.0655 390 ASN C O 6059 C CB . ASN C 82 ? 0.2999 0.6104 0.2455 0.0125 0.0049 0.1051 390 ASN C CB 6060 C CG . ASN C 82 ? 0.3622 0.6947 0.3031 0.0238 -0.0029 0.1233 390 ASN C CG 6061 O OD1 . ASN C 82 ? 0.3987 0.7045 0.3162 0.0231 -0.0012 0.1205 390 ASN C OD1 6062 N ND2 . ASN C 82 ? 0.4004 0.7758 0.3698 0.0347 -0.0100 0.1399 390 ASN C ND2 6063 N N . MET C 83 ? 0.2596 0.4863 0.1941 0.0013 0.0255 0.0719 391 MET C N 6064 C CA . MET C 83 ? 0.2579 0.4595 0.1810 -0.0126 0.0281 0.0587 391 MET C CA 6065 C C . MET C 83 ? 0.2688 0.4261 0.1762 -0.0124 0.0317 0.0494 391 MET C C 6066 O O . MET C 83 ? 0.3011 0.4381 0.1937 -0.0274 0.0312 0.0394 391 MET C O 6067 C CB . MET C 83 ? 0.2408 0.4417 0.1769 -0.0051 0.0350 0.0585 391 MET C CB 6068 C CG . MET C 83 ? 0.2642 0.4416 0.1862 -0.0186 0.0376 0.0495 391 MET C CG 6069 S SD . MET C 83 ? 0.3652 0.5415 0.2922 -0.0087 0.0471 0.0505 391 MET C SD 6070 C CE . MET C 83 ? 0.4341 0.5670 0.3353 -0.0194 0.0473 0.0425 391 MET C CE 6071 N N . GLY C 84 ? 0.2506 0.3931 0.1659 0.0048 0.0366 0.0528 392 GLY C N 6072 C CA . GLY C 84 ? 0.2743 0.3789 0.1830 0.0062 0.0413 0.0450 392 GLY C CA 6073 C C . GLY C 84 ? 0.2799 0.3805 0.1672 -0.0069 0.0409 0.0417 392 GLY C C 6074 O O . GLY C 84 ? 0.2972 0.3686 0.1752 -0.0156 0.0442 0.0305 392 GLY C O 6075 N N . ASN C 85 ? 0.2675 0.3976 0.1466 -0.0077 0.0366 0.0512 393 ASN C N 6076 C CA . ASN C 85 ? 0.3044 0.4348 0.1556 -0.0212 0.0347 0.0466 393 ASN C CA 6077 C C . ASN C 85 ? 0.3318 0.4573 0.1705 -0.0438 0.0303 0.0314 393 ASN C C 6078 O O . ASN C 85 ? 0.3778 0.4796 0.1972 -0.0549 0.0349 0.0191 393 ASN C O 6079 C CB . ASN C 85 ? 0.3058 0.4709 0.1533 -0.0177 0.0250 0.0590 393 ASN C CB 6080 C CG . ASN C 85 ? 0.3796 0.5409 0.2339 0.0028 0.0320 0.0746 393 ASN C CG 6081 O OD1 . ASN C 85 ? 0.3985 0.5299 0.2565 0.0117 0.0457 0.0740 393 ASN C OD1 6082 N ND2 . ASN C 85 ? 0.3803 0.5735 0.2394 0.0104 0.0233 0.0896 393 ASN C ND2 6083 N N . THR C 86 ? 0.2959 0.4427 0.1476 -0.0506 0.0238 0.0321 394 THR C N 6084 C CA . THR C 86 ? 0.3136 0.4547 0.1593 -0.0724 0.0215 0.0195 394 THR C CA 6085 C C . THR C 86 ? 0.3233 0.4181 0.1685 -0.0739 0.0307 0.0097 394 THR C C 6086 O O . THR C 86 ? 0.3719 0.4451 0.2051 -0.0893 0.0334 -0.0030 394 THR C O 6087 C CB . THR C 86 ? 0.3379 0.5125 0.2025 -0.0783 0.0159 0.0250 394 THR C CB 6088 O OG1 . THR C 86 ? 0.3486 0.5692 0.2181 -0.0784 0.0051 0.0334 394 THR C OG1 6089 C CG2 . THR C 86 ? 0.3495 0.5140 0.2118 -0.1016 0.0166 0.0132 394 THR C CG2 6090 N N . LEU C 87 ? 0.3081 0.3876 0.1673 -0.0574 0.0347 0.0150 395 LEU C N 6091 C CA . LEU C 87 ? 0.3060 0.3450 0.1675 -0.0561 0.0397 0.0081 395 LEU C CA 6092 C C . LEU C 87 ? 0.3427 0.3527 0.1987 -0.0552 0.0466 -0.0001 395 LEU C C 6093 O O . LEU C 87 ? 0.3786 0.3583 0.2335 -0.0627 0.0509 -0.0093 395 LEU C O 6094 C CB . LEU C 87 ? 0.2645 0.2970 0.1402 -0.0383 0.0393 0.0141 395 LEU C CB 6095 C CG . LEU C 87 ? 0.3019 0.3538 0.1802 -0.0389 0.0369 0.0203 395 LEU C CG 6096 C CD1 . LEU C 87 ? 0.3202 0.3630 0.2063 -0.0209 0.0367 0.0226 395 LEU C CD1 6097 C CD2 . LEU C 87 ? 0.3213 0.3611 0.1910 -0.0561 0.0378 0.0173 395 LEU C CD2 6098 N N . LYS C 88 ? 0.3191 0.3376 0.1736 -0.0451 0.0498 0.0044 396 LYS C N 6099 C CA . LYS C 88 ? 0.3391 0.3334 0.1864 -0.0445 0.0602 -0.0023 396 LYS C CA 6100 C C . LYS C 88 ? 0.3829 0.3700 0.2068 -0.0649 0.0625 -0.0154 396 LYS C C 6101 O O . LYS C 88 ? 0.3969 0.3515 0.2203 -0.0694 0.0724 -0.0269 396 LYS C O 6102 C CB . LYS C 88 ? 0.3510 0.3604 0.1952 -0.0319 0.0642 0.0085 396 LYS C CB 6103 C CG . LYS C 88 ? 0.4094 0.3937 0.2460 -0.0294 0.0793 0.0040 396 LYS C CG 6104 C CD . LYS C 88 ? 0.4651 0.4649 0.2958 -0.0168 0.0843 0.0190 396 LYS C CD 6105 C CE . LYS C 88 ? 0.5771 0.5525 0.3957 -0.0150 0.1032 0.0163 396 LYS C CE 6106 N NZ . LYS C 88 ? 0.6052 0.5494 0.4597 -0.0050 0.1159 0.0122 396 LYS C NZ 6107 N N . GLU C 89 ? 0.3992 0.4172 0.2071 -0.0775 0.0532 -0.0151 397 GLU C N 6108 C CA . GLU C 89 ? 0.4472 0.4618 0.2322 -0.0990 0.0533 -0.0305 397 GLU C CA 6109 C C . GLU C 89 ? 0.4480 0.4382 0.2431 -0.1132 0.0555 -0.0417 397 GLU C C 6110 O O . GLU C 89 ? 0.4673 0.4370 0.2498 -0.1289 0.0617 -0.0582 397 GLU C O 6111 C CB . GLU C 89 ? 0.5142 0.5735 0.2846 -0.1088 0.0392 -0.0272 397 GLU C CB 6112 C CG . GLU C 89 ? 0.6233 0.6821 0.3714 -0.1296 0.0361 -0.0449 397 GLU C CG 6113 C CD . GLU C 89 ? 0.6590 0.7630 0.4019 -0.1333 0.0184 -0.0394 397 GLU C CD 6114 O OE1 . GLU C 89 ? 0.6368 0.7691 0.3914 -0.1168 0.0110 -0.0203 397 GLU C OE1 6115 O OE2 . GLU C 89 ? 0.6874 0.7979 0.4166 -0.1526 0.0120 -0.0545 397 GLU C OE2 6116 N N . MET C 90 ? 0.3993 0.3899 0.2157 -0.1072 0.0518 -0.0324 398 MET C N 6117 C CA . MET C 90 ? 0.4377 0.4017 0.2641 -0.1168 0.0550 -0.0375 398 MET C CA 6118 C C . MET C 90 ? 0.4428 0.3654 0.2813 -0.1048 0.0636 -0.0393 398 MET C C 6119 O O . MET C 90 ? 0.4682 0.3649 0.3170 -0.1082 0.0658 -0.0400 398 MET C O 6120 C CB . MET C 90 ? 0.4188 0.4010 0.2576 -0.1148 0.0485 -0.0248 398 MET C CB 6121 C CG . MET C 90 ? 0.4251 0.4505 0.2627 -0.1269 0.0408 -0.0222 398 MET C CG 6122 S SD . MET C 90 ? 0.4667 0.5137 0.3205 -0.1206 0.0386 -0.0063 398 MET C SD 6123 C CE . MET C 90 ? 0.6075 0.6152 0.4638 -0.1329 0.0467 -0.0083 398 MET C CE 6124 N N . GLN C 91 ? 0.4302 0.3480 0.2706 -0.0903 0.0683 -0.0384 399 GLN C N 6125 C CA . GLN C 91 ? 0.4996 0.3839 0.3591 -0.0776 0.0760 -0.0404 399 GLN C CA 6126 C C . GLN C 91 ? 0.4969 0.3769 0.3776 -0.0626 0.0674 -0.0295 399 GLN C C 6127 O O . GLN C 91 ? 0.5192 0.3719 0.4196 -0.0544 0.0692 -0.0309 399 GLN C O 6128 C CB . GLN C 91 ? 0.5789 0.4278 0.4401 -0.0890 0.0871 -0.0545 399 GLN C CB 6129 C CG . GLN C 91 ? 0.6932 0.5419 0.5294 -0.1030 0.0973 -0.0694 399 GLN C CG 6130 C CD . GLN C 91 ? 0.8130 0.6226 0.6536 -0.1126 0.1121 -0.0862 399 GLN C CD 6131 O OE1 . GLN C 91 ? 0.8430 0.6258 0.7089 -0.1085 0.1139 -0.0843 399 GLN C OE1 6132 N NE2 . GLN C 91 ? 0.8595 0.6650 0.6743 -0.1248 0.1229 -0.1025 399 GLN C NE2 6133 N N . ASP C 92 ? 0.4124 0.3204 0.2892 -0.0585 0.0579 -0.0194 400 ASP C N 6134 C CA . ASP C 92 ? 0.4078 0.3143 0.2978 -0.0434 0.0498 -0.0113 400 ASP C CA 6135 C C . ASP C 92 ? 0.3879 0.3047 0.2903 -0.0274 0.0503 -0.0089 400 ASP C C 6136 O O . ASP C 92 ? 0.3502 0.2943 0.2489 -0.0227 0.0476 -0.0024 400 ASP C O 6137 C CB . ASP C 92 ? 0.4073 0.3354 0.2866 -0.0473 0.0431 -0.0030 400 ASP C CB 6138 C CG . ASP C 92 ? 0.4495 0.3755 0.3345 -0.0318 0.0354 0.0033 400 ASP C CG 6139 O OD1 . ASP C 92 ? 0.4533 0.3596 0.3528 -0.0198 0.0320 0.0005 400 ASP C OD1 6140 O OD2 . ASP C 92 ? 0.4107 0.3552 0.2861 -0.0321 0.0330 0.0099 400 ASP C OD2 6141 N N . VAL C 93 ? 0.3720 0.2664 0.2940 -0.0191 0.0552 -0.0138 401 VAL C N 6142 C CA . VAL C 93 ? 0.4054 0.3045 0.3444 -0.0059 0.0597 -0.0123 401 VAL C CA 6143 C C . VAL C 93 ? 0.3692 0.2762 0.3233 0.0080 0.0495 -0.0084 401 VAL C C 6144 O O . VAL C 93 ? 0.3899 0.3138 0.3492 0.0161 0.0516 -0.0038 401 VAL C O 6145 C CB . VAL C 93 ? 0.5711 0.4437 0.5327 -0.0023 0.0708 -0.0195 401 VAL C CB 6146 C CG1 . VAL C 93 ? 0.5789 0.4534 0.5675 0.0120 0.0753 -0.0173 401 VAL C CG1 6147 C CG2 . VAL C 93 ? 0.6106 0.4773 0.5521 -0.0148 0.0853 -0.0251 401 VAL C CG2 6148 N N . GLN C 94 ? 0.3786 0.2726 0.3388 0.0112 0.0384 -0.0104 402 GLN C N 6149 C CA . GLN C 94 ? 0.4088 0.3088 0.3769 0.0232 0.0273 -0.0100 402 GLN C CA 6150 C C . GLN C 94 ? 0.3888 0.3154 0.3361 0.0224 0.0269 -0.0039 402 GLN C C 6151 O O . GLN C 94 ? 0.4128 0.3513 0.3693 0.0327 0.0263 -0.0039 402 GLN C O 6152 C CB . GLN C 94 ? 0.5051 0.3877 0.4731 0.0258 0.0134 -0.0116 402 GLN C CB 6153 C CG . GLN C 94 ? 0.6113 0.4722 0.6126 0.0327 0.0088 -0.0180 402 GLN C CG 6154 C CD . GLN C 94 ? 0.6968 0.5451 0.6966 0.0382 -0.0099 -0.0173 402 GLN C CD 6155 O OE1 . GLN C 94 ? 0.7115 0.5683 0.6920 0.0429 -0.0211 -0.0161 402 GLN C OE1 6156 N NE2 . GLN C 94 ? 0.7374 0.5650 0.7562 0.0382 -0.0127 -0.0174 402 GLN C NE2 6157 N N . GLY C 95 ? 0.4090 0.3445 0.3331 0.0098 0.0284 0.0008 403 GLY C N 6158 C CA . GLY C 95 ? 0.3770 0.3404 0.2866 0.0075 0.0292 0.0071 403 GLY C CA 6159 C C . GLY C 95 ? 0.3342 0.3211 0.2519 0.0117 0.0356 0.0111 403 GLY C C 6160 O O . GLY C 95 ? 0.3195 0.3250 0.2423 0.0208 0.0359 0.0148 403 GLY C O 6161 N N . ALA C 96 ? 0.3319 0.3167 0.2495 0.0059 0.0414 0.0108 404 ALA C N 6162 C CA . ALA C 96 ? 0.3185 0.3235 0.2395 0.0108 0.0470 0.0176 404 ALA C CA 6163 C C . ALA C 96 ? 0.3157 0.3159 0.2608 0.0284 0.0497 0.0189 404 ALA C C 6164 O O . ALA C 96 ? 0.2697 0.2905 0.2221 0.0373 0.0515 0.0267 404 ALA C O 6165 C CB . ALA C 96 ? 0.2938 0.2907 0.2046 0.0024 0.0539 0.0157 404 ALA C CB 6166 N N . LEU C 97 ? 0.2995 0.2726 0.2614 0.0333 0.0500 0.0108 405 LEU C N 6167 C CA . LEU C 97 ? 0.3296 0.2957 0.3200 0.0480 0.0523 0.0088 405 LEU C CA 6168 C C . LEU C 97 ? 0.2837 0.2614 0.2763 0.0561 0.0457 0.0072 405 LEU C C 6169 O O . LEU C 97 ? 0.2806 0.2653 0.2913 0.0672 0.0508 0.0097 405 LEU C O 6170 C CB . LEU C 97 ? 0.4053 0.3432 0.4187 0.0502 0.0507 -0.0016 405 LEU C CB 6171 C CG . LEU C 97 ? 0.4743 0.4035 0.5252 0.0625 0.0561 -0.0048 405 LEU C CG 6172 C CD1 . LEU C 97 ? 0.4997 0.4152 0.5689 0.0561 0.0567 -0.0095 405 LEU C CD1 6173 C CD2 . LEU C 97 ? 0.5031 0.4322 0.5654 0.0695 0.0425 -0.0146 405 LEU C CD2 6174 N N . GLN C 98 ? 0.3136 0.2913 0.2873 0.0509 0.0366 0.0033 406 GLN C N 6175 C CA . GLN C 98 ? 0.3125 0.3003 0.2814 0.0579 0.0330 0.0007 406 GLN C CA 6176 C C . GLN C 98 ? 0.2794 0.2967 0.2484 0.0608 0.0412 0.0107 406 GLN C C 6177 O O . GLN C 98 ? 0.2823 0.3061 0.2649 0.0725 0.0449 0.0089 406 GLN C O 6178 C CB . GLN C 98 ? 0.3963 0.3787 0.3383 0.0509 0.0246 -0.0016 406 GLN C CB 6179 C CG . GLN C 98 ? 0.4489 0.4039 0.3917 0.0508 0.0133 -0.0095 406 GLN C CG 6180 C CD . GLN C 98 ? 0.5049 0.4470 0.4763 0.0624 0.0081 -0.0207 406 GLN C CD 6181 O OE1 . GLN C 98 ? 0.4939 0.4418 0.4716 0.0716 0.0082 -0.0270 406 GLN C OE1 6182 N NE2 . GLN C 98 ? 0.5173 0.4415 0.5101 0.0616 0.0047 -0.0244 406 GLN C NE2 6183 N N . CYS C 99 ? 0.2432 0.2785 0.1995 0.0503 0.0434 0.0204 407 CYS C N 6184 C CA . CYS C 99 ? 0.2415 0.3093 0.2023 0.0530 0.0483 0.0319 407 CYS C CA 6185 C C . CYS C 99 ? 0.2173 0.2888 0.2012 0.0664 0.0550 0.0390 407 CYS C C 6186 O O . CYS C 99 ? 0.2649 0.3535 0.2644 0.0776 0.0598 0.0447 407 CYS C O 6187 C CB . CYS C 99 ? 0.2413 0.3284 0.1861 0.0374 0.0460 0.0389 407 CYS C CB 6188 S SG . CYS C 99 ? 0.3132 0.4033 0.2373 0.0208 0.0422 0.0352 407 CYS C SG 6189 N N . TYR C 100 ? 0.2277 0.2825 0.2149 0.0655 0.0578 0.0401 408 TYR C N 6190 C CA . TYR C 100 ? 0.2301 0.2852 0.2380 0.0780 0.0668 0.0500 408 TYR C CA 6191 C C . TYR C 100 ? 0.2268 0.2681 0.2636 0.0922 0.0710 0.0425 408 TYR C C 6192 O O . TYR C 100 ? 0.2215 0.2719 0.2792 0.1050 0.0787 0.0516 408 TYR C O 6193 C CB . TYR C 100 ? 0.2543 0.2895 0.2596 0.0741 0.0727 0.0512 408 TYR C CB 6194 C CG . TYR C 100 ? 0.2338 0.2786 0.2082 0.0599 0.0703 0.0554 408 TYR C CG 6195 C CD1 . TYR C 100 ? 0.2545 0.3324 0.2127 0.0559 0.0649 0.0665 408 TYR C CD1 6196 C CD2 . TYR C 100 ? 0.2309 0.2522 0.1951 0.0503 0.0733 0.0465 408 TYR C CD2 6197 C CE1 . TYR C 100 ? 0.2520 0.3386 0.1813 0.0411 0.0609 0.0667 408 TYR C CE1 6198 C CE2 . TYR C 100 ? 0.2380 0.2648 0.1726 0.0365 0.0725 0.0467 408 TYR C CE2 6199 C CZ . TYR C 100 ? 0.2831 0.3422 0.1986 0.0313 0.0655 0.0558 408 TYR C CZ 6200 O OH . TYR C 100 ? 0.3389 0.4031 0.2242 0.0159 0.0632 0.0524 408 TYR C OH 6201 N N . THR C 101 ? 0.2549 0.2691 0.1986 0.0213 0.0411 0.0276 409 THR C N 6202 C CA . THR C 101 ? 0.2348 0.2484 0.1674 0.0121 0.0429 0.0243 409 THR C CA 6203 C C . THR C 101 ? 0.2737 0.2816 0.1977 0.0094 0.0509 0.0164 409 THR C C 6204 O O . THR C 101 ? 0.2967 0.2914 0.2093 0.0070 0.0587 0.0097 409 THR C O 6205 C CB . THR C 101 ? 0.2560 0.2837 0.1841 0.0034 0.0368 0.0324 409 THR C CB 6206 O OG1 . THR C 101 ? 0.3195 0.3555 0.2567 0.0102 0.0316 0.0416 409 THR C OG1 6207 C CG2 . THR C 101 ? 0.3463 0.3777 0.2591 -0.0123 0.0387 0.0276 409 THR C CG2 6208 N N . ARG C 102 ? 0.3058 0.3209 0.2323 0.0091 0.0512 0.0170 410 ARG C N 6209 C CA . ARG C 102 ? 0.2846 0.2997 0.2054 0.0085 0.0598 0.0103 410 ARG C CA 6210 C C . ARG C 102 ? 0.2906 0.3030 0.2173 0.0229 0.0675 0.0069 410 ARG C C 6211 O O . ARG C 102 ? 0.3217 0.3235 0.2389 0.0270 0.0786 0.0018 410 ARG C O 6212 C CB . ARG C 102 ? 0.3018 0.3292 0.2247 0.0038 0.0585 0.0120 410 ARG C CB 6213 C CG . ARG C 102 ? 0.3068 0.3352 0.2185 -0.0089 0.0549 0.0158 410 ARG C CG 6214 C CD . ARG C 102 ? 0.3574 0.3817 0.2542 -0.0181 0.0607 0.0094 410 ARG C CD 6215 N NE . ARG C 102 ? 0.3599 0.3852 0.2532 -0.0170 0.0710 0.0016 410 ARG C NE 6216 C CZ . ARG C 102 ? 0.3623 0.3756 0.2476 -0.0125 0.0832 -0.0067 410 ARG C CZ 6217 N NH1 . ARG C 102 ? 0.3467 0.3413 0.2232 -0.0122 0.0866 -0.0096 410 ARG C NH1 6218 N NH2 . ARG C 102 ? 0.3629 0.3811 0.2465 -0.0083 0.0939 -0.0117 410 ARG C NH2 6219 N N . ALA C 103 ? 0.2641 0.2853 0.2043 0.0315 0.0631 0.0109 411 ALA C N 6220 C CA . ALA C 103 ? 0.2931 0.3193 0.2401 0.0470 0.0691 0.0113 411 ALA C CA 6221 C C . ALA C 103 ? 0.3165 0.3164 0.2517 0.0538 0.0773 0.0093 411 ALA C C 6222 O O . ALA C 103 ? 0.3430 0.3358 0.2729 0.0670 0.0897 0.0086 411 ALA C O 6223 C CB . ALA C 103 ? 0.2597 0.3004 0.2196 0.0503 0.0617 0.0157 411 ALA C CB 6224 N N . ILE C 104 ? 0.3237 0.3090 0.2527 0.0448 0.0722 0.0091 412 ILE C N 6225 C CA . ILE C 104 ? 0.3095 0.2670 0.2226 0.0448 0.0802 0.0060 412 ILE C CA 6226 C C . ILE C 104 ? 0.3940 0.3291 0.2834 0.0354 0.0927 -0.0019 412 ILE C C 6227 O O . ILE C 104 ? 0.4470 0.3506 0.3171 0.0398 0.1075 -0.0059 412 ILE C O 6228 C CB . ILE C 104 ? 0.4293 0.3871 0.3433 0.0340 0.0704 0.0080 412 ILE C CB 6229 C CG1 . ILE C 104 ? 0.4038 0.3729 0.3351 0.0453 0.0635 0.0140 412 ILE C CG1 6230 C CG2 . ILE C 104 ? 0.4844 0.4149 0.3756 0.0238 0.0789 0.0027 412 ILE C CG2 6231 C CD1 . ILE C 104 ? 0.3950 0.3730 0.3328 0.0378 0.0534 0.0177 412 ILE C CD1 6232 N N . GLN C 105 ? 0.3670 0.3145 0.2544 0.0221 0.0887 -0.0041 413 GLN C N 6233 C CA . GLN C 105 ? 0.4170 0.3455 0.2800 0.0101 0.1007 -0.0127 413 GLN C CA 6234 C C . GLN C 105 ? 0.4629 0.3810 0.3223 0.0275 0.1170 -0.0152 413 GLN C C 6235 O O . GLN C 105 ? 0.5052 0.3891 0.3392 0.0274 0.1355 -0.0224 413 GLN C O 6236 C CB . GLN C 105 ? 0.3853 0.3352 0.2479 -0.0079 0.0911 -0.0123 413 GLN C CB 6237 C CG . GLN C 105 ? 0.4537 0.4165 0.3143 -0.0251 0.0788 -0.0083 413 GLN C CG 6238 C CD . GLN C 105 ? 0.4687 0.4539 0.3258 -0.0405 0.0712 -0.0051 413 GLN C CD 6239 O OE1 . GLN C 105 ? 0.4688 0.4635 0.3334 -0.0355 0.0699 -0.0029 413 GLN C OE1 6240 N NE2 . GLN C 105 ? 0.4724 0.4693 0.3167 -0.0604 0.0663 -0.0041 413 GLN C NE2 6241 N N . ILE C 106 ? 0.4163 0.3642 0.2991 0.0419 0.1119 -0.0091 414 ILE C N 6242 C CA . ILE C 106 ? 0.4410 0.3939 0.3266 0.0617 0.1261 -0.0082 414 ILE C CA 6243 C C . ILE C 106 ? 0.4718 0.4058 0.3566 0.0825 0.1348 -0.0033 414 ILE C C 6244 O O . ILE C 106 ? 0.4793 0.3947 0.3557 0.0926 0.1466 -0.0033 414 ILE C O 6245 C CB . ILE C 106 ? 0.4234 0.4226 0.3352 0.0667 0.1159 -0.0021 414 ILE C CB 6246 C CG1 . ILE C 106 ? 0.3532 0.3646 0.2635 0.0452 0.1071 -0.0056 414 ILE C CG1 6247 C CG2 . ILE C 106 ? 0.4129 0.4303 0.3336 0.0868 0.1267 0.0013 414 ILE C CG2 6248 C CD1 . ILE C 106 ? 0.3379 0.3865 0.2672 0.0428 0.0971 -0.0011 414 ILE C CD1 6249 N N . ASN C 107 ? 0.4725 0.4105 0.3661 0.0875 0.1268 0.0023 415 ASN C N 6250 C CA . ASN C 107 ? 0.4936 0.4156 0.3872 0.1040 0.1305 0.0096 415 ASN C CA 6251 C C . ASN C 107 ? 0.4739 0.3749 0.3585 0.0962 0.1271 0.0085 415 ASN C C 6252 O O . ASN C 107 ? 0.4302 0.3555 0.3319 0.0987 0.1155 0.0135 415 ASN C O 6253 C CB . ASN C 107 ? 0.4842 0.4494 0.4043 0.1220 0.1226 0.0213 415 ASN C CB 6254 C CG . ASN C 107 ? 0.5073 0.4608 0.4250 0.1395 0.1259 0.0323 415 ASN C CG 6255 O OD1 . ASN C 107 ? 0.5293 0.4381 0.4249 0.1390 0.1355 0.0313 415 ASN C OD1 6256 N ND2 . ASN C 107 ? 0.4973 0.4921 0.4340 0.1527 0.1188 0.0435 415 ASN C ND2 6257 N N . PRO C 108 ? 0.5357 0.3919 0.3916 0.0842 0.1378 0.0015 416 PRO C N 6258 C CA . PRO C 108 ? 0.5459 0.3820 0.3888 0.0725 0.1362 -0.0011 416 PRO C CA 6259 C C . PRO C 108 ? 0.5594 0.3971 0.4135 0.0905 0.1331 0.0097 416 PRO C C 6260 O O . PRO C 108 ? 0.5628 0.3994 0.4169 0.0832 0.1268 0.0095 416 PRO C O 6261 C CB . PRO C 108 ? 0.6346 0.4216 0.4418 0.0552 0.1512 -0.0101 416 PRO C CB 6262 C CG . PRO C 108 ? 0.6237 0.4113 0.4260 0.0510 0.1571 -0.0154 416 PRO C CG 6263 C CD . PRO C 108 ? 0.5804 0.4029 0.4120 0.0772 0.1527 -0.0054 416 PRO C CD 6264 N N . ALA C 109 ? 0.5561 0.4017 0.4196 0.1117 0.1360 0.0203 417 ALA C N 6265 C CA . ALA C 109 ? 0.5179 0.3687 0.3877 0.1272 0.1334 0.0327 417 ALA C CA 6266 C C . ALA C 109 ? 0.4517 0.3565 0.3530 0.1341 0.1165 0.0393 417 ALA C C 6267 O O . ALA C 109 ? 0.4870 0.4073 0.3951 0.1462 0.1131 0.0502 417 ALA C O 6268 C CB . ALA C 109 ? 0.5267 0.3598 0.3838 0.1456 0.1476 0.0430 417 ALA C CB 6269 N N . PHE C 110 ? 0.3747 0.3073 0.2911 0.1243 0.1074 0.0330 418 PHE C N 6270 C CA . PHE C 110 ? 0.3638 0.3444 0.3055 0.1260 0.0937 0.0376 418 PHE C CA 6271 C C . PHE C 110 ? 0.2967 0.2788 0.2432 0.1196 0.0850 0.0374 418 PHE C C 6272 O O . PHE C 110 ? 0.3209 0.3012 0.2690 0.1018 0.0765 0.0310 418 PHE C O 6273 C CB . PHE C 110 ? 0.3866 0.3911 0.3374 0.1166 0.0906 0.0315 418 PHE C CB 6274 C CG . PHE C 110 ? 0.3978 0.4510 0.3693 0.1158 0.0806 0.0357 418 PHE C CG 6275 C CD1 . PHE C 110 ? 0.3953 0.4727 0.3764 0.1237 0.0749 0.0443 418 PHE C CD1 6276 C CD2 . PHE C 110 ? 0.3868 0.4578 0.3637 0.1001 0.0746 0.0305 418 PHE C CD2 6277 C CE1 . PHE C 110 ? 0.4042 0.5285 0.3998 0.1178 0.0673 0.0464 418 PHE C CE1 6278 C CE2 . PHE C 110 ? 0.3905 0.5011 0.3801 0.0932 0.0671 0.0324 418 PHE C CE2 6279 C CZ . PHE C 110 ? 0.3883 0.5278 0.3870 0.1012 0.0642 0.0397 418 PHE C CZ 6280 N N . ALA C 111 ? 0.3072 0.2942 0.2556 0.1282 0.0825 0.0457 419 ALA C N 6281 C CA . ALA C 111 ? 0.3478 0.3333 0.2990 0.1229 0.0756 0.0458 419 ALA C CA 6282 C C . ALA C 111 ? 0.3430 0.3573 0.3100 0.1095 0.0627 0.0422 419 ALA C C 6283 O O . ALA C 111 ? 0.3145 0.3171 0.2802 0.0960 0.0569 0.0375 419 ALA C O 6284 C CB . ALA C 111 ? 0.4107 0.4022 0.3599 0.1338 0.0757 0.0562 419 ALA C CB 6285 N N . ASP C 112 ? 0.3332 0.3845 0.3124 0.1109 0.0591 0.0448 420 ASP C N 6286 C CA . ASP C 112 ? 0.3339 0.4045 0.3207 0.0940 0.0496 0.0403 420 ASP C CA 6287 C C . ASP C 112 ? 0.3111 0.3613 0.2937 0.0798 0.0475 0.0329 420 ASP C C 6288 O O . ASP C 112 ? 0.3032 0.3480 0.2857 0.0692 0.0427 0.0303 420 ASP C O 6289 C CB . ASP C 112 ? 0.3841 0.4979 0.3798 0.0925 0.0482 0.0427 420 ASP C CB 6290 C CG . ASP C 112 ? 0.4447 0.5940 0.4468 0.1042 0.0476 0.0526 420 ASP C CG 6291 O OD1 . ASP C 112 ? 0.4547 0.5924 0.4536 0.1100 0.0467 0.0565 420 ASP C OD1 6292 O OD2 . ASP C 112 ? 0.4795 0.6732 0.4899 0.1069 0.0479 0.0574 420 ASP C OD2 6293 N N . ALA C 113 ? 0.2912 0.3303 0.2689 0.0809 0.0524 0.0306 421 ALA C N 6294 C CA . ALA C 113 ? 0.2633 0.2898 0.2365 0.0681 0.0499 0.0260 421 ALA C CA 6295 C C . ALA C 113 ? 0.2701 0.2761 0.2379 0.0633 0.0477 0.0255 421 ALA C C 6296 O O . ALA C 113 ? 0.2726 0.2776 0.2412 0.0552 0.0432 0.0258 421 ALA C O 6297 C CB . ALA C 113 ? 0.2539 0.2773 0.2214 0.0680 0.0559 0.0233 421 ALA C CB 6298 N N . HIS C 114 ? 0.2824 0.2733 0.2433 0.0688 0.0522 0.0260 422 HIS C N 6299 C CA . HIS C 114 ? 0.3094 0.2872 0.2647 0.0614 0.0504 0.0254 422 HIS C CA 6300 C C . HIS C 114 ? 0.2879 0.2756 0.2532 0.0614 0.0439 0.0282 422 HIS C C 6301 O O . HIS C 114 ? 0.2673 0.2572 0.2345 0.0553 0.0402 0.0293 422 HIS C O 6302 C CB . HIS C 114 ? 0.3173 0.2712 0.2577 0.0645 0.0591 0.0244 422 HIS C CB 6303 C CG . HIS C 114 ? 0.3212 0.2544 0.2435 0.0590 0.0688 0.0194 422 HIS C CG 6304 N ND1 . HIS C 114 ? 0.3181 0.2472 0.2296 0.0406 0.0679 0.0146 422 HIS C ND1 6305 C CD2 . HIS C 114 ? 0.3548 0.2709 0.2657 0.0692 0.0811 0.0184 422 HIS C CD2 6306 C CE1 . HIS C 114 ? 0.3387 0.2454 0.2302 0.0360 0.0794 0.0089 422 HIS C CE1 6307 N NE2 . HIS C 114 ? 0.3305 0.2257 0.2210 0.0548 0.0887 0.0111 422 HIS C NE2 6308 N N . SER C 115 ? 0.2737 0.2702 0.2443 0.0687 0.0435 0.0302 423 SER C N 6309 C CA . SER C 115 ? 0.2630 0.2660 0.2390 0.0669 0.0396 0.0312 423 SER C CA 6310 C C . SER C 115 ? 0.2776 0.2839 0.2561 0.0602 0.0377 0.0300 423 SER C C 6311 O O . SER C 115 ? 0.2570 0.2578 0.2359 0.0585 0.0375 0.0311 423 SER C O 6312 C CB . SER C 115 ? 0.2829 0.3006 0.2615 0.0726 0.0396 0.0336 423 SER C CB 6313 O OG . SER C 115 ? 0.3135 0.3347 0.2930 0.0677 0.0373 0.0329 423 SER C OG 6314 N N . ASN C 116 ? 0.2586 0.2720 0.2368 0.0573 0.0383 0.0286 424 ASN C N 6315 C CA . ASN C 116 ? 0.2659 0.2752 0.2409 0.0502 0.0390 0.0278 424 ASN C CA 6316 C C . ASN C 116 ? 0.2701 0.2696 0.2440 0.0511 0.0385 0.0317 424 ASN C C 6317 O O . ASN C 116 ? 0.3108 0.3011 0.2818 0.0517 0.0408 0.0349 424 ASN C O 6318 C CB . ASN C 116 ? 0.2997 0.3200 0.2729 0.0447 0.0401 0.0254 424 ASN C CB 6319 C CG . ASN C 116 ? 0.3317 0.3731 0.3061 0.0407 0.0404 0.0233 424 ASN C CG 6320 O OD1 . ASN C 116 ? 0.3175 0.3607 0.2906 0.0385 0.0401 0.0228 424 ASN C OD1 6321 N ND2 . ASN C 116 ? 0.3079 0.3703 0.2846 0.0386 0.0411 0.0226 424 ASN C ND2 6322 N N . LEU C 117 ? 0.2076 0.2097 0.1814 0.0512 0.0370 0.0322 425 LEU C N 6323 C CA . LEU C 117 ? 0.2671 0.2714 0.2400 0.0495 0.0351 0.0371 425 LEU C CA 6324 C C . LEU C 117 ? 0.2644 0.2717 0.2418 0.0533 0.0343 0.0413 425 LEU C C 6325 O O . LEU C 117 ? 0.2519 0.2652 0.2316 0.0571 0.0343 0.0490 425 LEU C O 6326 C CB . LEU C 117 ? 0.2426 0.2492 0.2097 0.0431 0.0350 0.0345 425 LEU C CB 6327 C CG . LEU C 117 ? 0.2775 0.2973 0.2424 0.0365 0.0318 0.0399 425 LEU C CG 6328 C CD1 . LEU C 117 ? 0.3148 0.3417 0.2811 0.0391 0.0302 0.0477 425 LEU C CD1 6329 C CD2 . LEU C 117 ? 0.2485 0.2665 0.2009 0.0242 0.0339 0.0341 425 LEU C CD2 6330 N N . ALA C 118 ? 0.2373 0.2417 0.2155 0.0540 0.0347 0.0379 426 ALA C N 6331 C CA . ALA C 118 ? 0.2532 0.2617 0.2354 0.0566 0.0347 0.0409 426 ALA C CA 6332 C C . ALA C 118 ? 0.2849 0.2888 0.2697 0.0637 0.0380 0.0443 426 ALA C C 6333 O O . ALA C 118 ? 0.2671 0.2785 0.2560 0.0693 0.0397 0.0510 426 ALA C O 6334 C CB . ALA C 118 ? 0.2515 0.2532 0.2311 0.0562 0.0356 0.0367 426 ALA C CB 6335 N N . SER C 119 ? 0.2823 0.2745 0.2626 0.0626 0.0407 0.0400 427 SER C N 6336 C CA . SER C 119 ? 0.3146 0.2921 0.2890 0.0652 0.0478 0.0407 427 SER C CA 6337 C C . SER C 119 ? 0.3329 0.3036 0.3042 0.0720 0.0523 0.0491 427 SER C C 6338 O O . SER C 119 ? 0.3558 0.3137 0.3228 0.0808 0.0607 0.0541 427 SER C O 6339 C CB . SER C 119 ? 0.3632 0.3331 0.3288 0.0560 0.0501 0.0331 427 SER C CB 6340 O OG . SER C 119 ? 0.3718 0.3540 0.3410 0.0532 0.0462 0.0291 427 SER C OG 6341 N N . ILE C 120 ? 0.3153 0.2934 0.2869 0.0696 0.0483 0.0518 428 ILE C N 6342 C CA . ILE C 120 ? 0.3032 0.2799 0.2718 0.0774 0.0516 0.0629 428 ILE C CA 6343 C C . ILE C 120 ? 0.3335 0.3335 0.3125 0.0880 0.0498 0.0741 428 ILE C C 6344 O O . ILE C 120 ? 0.3735 0.3708 0.3512 0.1026 0.0571 0.0861 428 ILE C O 6345 C CB . ILE C 120 ? 0.3062 0.2909 0.2725 0.0702 0.0465 0.0633 428 ILE C CB 6346 C CG1 . ILE C 120 ? 0.3678 0.3350 0.3240 0.0604 0.0498 0.0544 428 ILE C CG1 6347 C CG2 . ILE C 120 ? 0.3418 0.3312 0.3053 0.0795 0.0487 0.0780 428 ILE C CG2 6348 C CD1 . ILE C 120 ? 0.4493 0.3857 0.3895 0.0617 0.0613 0.0557 428 ILE C CD1 6349 N N . HIS C 121 ? 0.2783 0.3015 0.2658 0.0807 0.0419 0.0708 429 HIS C N 6350 C CA . HIS C 121 ? 0.2860 0.3400 0.2831 0.0852 0.0395 0.0802 429 HIS C CA 6351 C C . HIS C 121 ? 0.2929 0.3414 0.2939 0.0971 0.0468 0.0828 429 HIS C C 6352 O O . HIS C 121 ? 0.3124 0.3809 0.3203 0.1109 0.0506 0.0959 429 HIS C O 6353 C CB . HIS C 121 ? 0.2873 0.3595 0.2854 0.0690 0.0321 0.0732 429 HIS C CB 6354 C CG . HIS C 121 ? 0.3509 0.4323 0.3428 0.0568 0.0272 0.0718 429 HIS C CG 6355 N ND1 . HIS C 121 ? 0.3854 0.4869 0.3779 0.0598 0.0252 0.0832 429 HIS C ND1 6356 C CD2 . HIS C 121 ? 0.3565 0.4280 0.3390 0.0423 0.0257 0.0609 429 HIS C CD2 6357 C CE1 . HIS C 121 ? 0.3627 0.4679 0.3466 0.0447 0.0215 0.0778 429 HIS C CE1 6358 N NE2 . HIS C 121 ? 0.3034 0.3883 0.2805 0.0343 0.0229 0.0638 429 HIS C NE2 6359 N N . LYS C 122 ? 0.2954 0.3199 0.2915 0.0926 0.0495 0.0713 430 LYS C N 6360 C CA . LYS C 122 ? 0.3224 0.3372 0.3185 0.1007 0.0575 0.0710 430 LYS C CA 6361 C C . LYS C 122 ? 0.3758 0.3683 0.3629 0.1141 0.0704 0.0778 430 LYS C C 6362 O O . LYS C 122 ? 0.3675 0.3663 0.3558 0.1225 0.0768 0.0838 430 LYS C O 6363 C CB . LYS C 122 ? 0.3111 0.3066 0.3005 0.0901 0.0573 0.0576 430 LYS C CB 6364 C CG . LYS C 122 ? 0.3729 0.3591 0.3599 0.0944 0.0652 0.0553 430 LYS C CG 6365 C CD . LYS C 122 ? 0.4001 0.3736 0.3791 0.0822 0.0635 0.0436 430 LYS C CD 6366 C CE . LYS C 122 ? 0.4245 0.3945 0.4010 0.0827 0.0692 0.0406 430 LYS C CE 6367 N NZ . LYS C 122 ? 0.4682 0.4148 0.4340 0.0910 0.0845 0.0416 430 LYS C NZ 6368 N N . ASP C 123 ? 0.4120 0.3763 0.3859 0.1122 0.0750 0.0754 431 ASP C N 6369 C CA . ASP C 123 ? 0.5306 0.4643 0.4877 0.1190 0.0898 0.0787 431 ASP C CA 6370 C C . ASP C 123 ? 0.5625 0.5169 0.5246 0.1317 0.0915 0.0936 431 ASP C C 6371 O O . ASP C 123 ? 0.6171 0.5543 0.5681 0.1426 0.1055 0.0998 431 ASP C O 6372 C CB . ASP C 123 ? 0.6101 0.5060 0.5478 0.1106 0.0958 0.0720 431 ASP C CB 6373 C CG . ASP C 123 ? 0.6996 0.5853 0.6305 0.0919 0.0941 0.0554 431 ASP C CG 6374 O OD1 . ASP C 123 ? 0.7266 0.6158 0.6608 0.0921 0.0954 0.0511 431 ASP C OD1 6375 O OD2 . ASP C 123 ? 0.7337 0.6137 0.6561 0.0760 0.0911 0.0472 431 ASP C OD2 6376 N N . SER C 124 ? 0.4984 0.4902 0.4753 0.1302 0.0788 0.0998 432 SER C N 6377 C CA . SER C 124 ? 0.5081 0.5301 0.4917 0.1406 0.0788 0.1150 432 SER C CA 6378 C C . SER C 124 ? 0.5001 0.5609 0.4970 0.1477 0.0780 0.1236 432 SER C C 6379 O O . SER C 124 ? 0.5192 0.6127 0.5224 0.1575 0.0794 0.1382 432 SER C O 6380 C CB . SER C 124 ? 0.5070 0.5543 0.4971 0.1324 0.0658 0.1181 432 SER C CB 6381 O OG . SER C 124 ? 0.5227 0.5362 0.4992 0.1263 0.0671 0.1121 432 SER C OG 6382 N N . GLY C 125 ? 0.4594 0.5200 0.4605 0.1425 0.0761 0.1156 433 GLY C N 6383 C CA . GLY C 125 ? 0.4286 0.5257 0.4409 0.1475 0.0754 0.1231 433 GLY C CA 6384 C C . GLY C 125 ? 0.4043 0.5527 0.4320 0.1362 0.0612 0.1255 433 GLY C C 6385 O O . GLY C 125 ? 0.4560 0.6430 0.4928 0.1372 0.0596 0.1325 433 GLY C O 6386 N N . ASN C 126 ? 0.3266 0.4765 0.3550 0.1242 0.0513 0.1202 434 ASN C N 6387 C CA . ASN C 126 ? 0.2928 0.4867 0.3299 0.1084 0.0386 0.1205 434 ASN C CA 6388 C C . ASN C 126 ? 0.2951 0.4658 0.3264 0.0908 0.0368 0.1020 434 ASN C C 6389 O O . ASN C 126 ? 0.2619 0.4090 0.2826 0.0750 0.0326 0.0893 434 ASN C O 6390 C CB . ASN C 126 ? 0.3148 0.5114 0.3442 0.0951 0.0310 0.1192 434 ASN C CB 6391 C CG . ASN C 126 ? 0.3160 0.5580 0.3450 0.0711 0.0215 0.1182 434 ASN C CG 6392 O OD1 . ASN C 126 ? 0.3628 0.6253 0.3942 0.0592 0.0202 0.1140 434 ASN C OD1 6393 N ND2 . ASN C 126 ? 0.3185 0.5750 0.3411 0.0608 0.0160 0.1211 434 ASN C ND2 6394 N N . ILE C 127 ? 0.2780 0.4559 0.3153 0.0956 0.0412 0.1020 435 ILE C N 6395 C CA . ILE C 127 ? 0.2111 0.3654 0.2414 0.0820 0.0408 0.0870 435 ILE C CA 6396 C C . ILE C 127 ? 0.1602 0.3220 0.1813 0.0560 0.0337 0.0779 435 ILE C C 6397 O O . ILE C 127 ? 0.1985 0.3252 0.2079 0.0473 0.0337 0.0660 435 ILE C O 6398 C CB . ILE C 127 ? 0.2712 0.4342 0.3086 0.0913 0.0478 0.0893 435 ILE C CB 6399 C CG1 . ILE C 127 ? 0.3198 0.4648 0.3590 0.1163 0.0591 0.0972 435 ILE C CG1 6400 C CG2 . ILE C 127 ? 0.2216 0.3546 0.2494 0.0794 0.0480 0.0751 435 ILE C CG2 6401 C CD1 . ILE C 127 ? 0.3466 0.4381 0.3718 0.1171 0.0635 0.0870 435 ILE C CD1 6402 N N . PRO C 128 ? 0.2566 0.4642 0.2802 0.0430 0.0293 0.0840 436 PRO C N 6403 C CA . PRO C 128 ? 0.2820 0.4858 0.2884 0.0142 0.0264 0.0729 436 PRO C CA 6404 C C . PRO C 128 ? 0.2976 0.4650 0.2894 0.0074 0.0255 0.0642 436 PRO C C 6405 O O . PRO C 128 ? 0.3139 0.4471 0.2883 -0.0055 0.0287 0.0524 436 PRO C O 6406 C CB . PRO C 128 ? 0.3180 0.5847 0.3285 -0.0005 0.0218 0.0822 436 PRO C CB 6407 C CG . PRO C 128 ? 0.3146 0.6212 0.3479 0.0227 0.0237 0.0979 436 PRO C CG 6408 C CD . PRO C 128 ? 0.2763 0.5428 0.3158 0.0520 0.0286 0.1009 436 PRO C CD 6409 N N . GLU C 129 ? 0.2600 0.4339 0.2577 0.0178 0.0230 0.0711 437 GLU C N 6410 C CA . GLU C 129 ? 0.2841 0.4266 0.2700 0.0135 0.0229 0.0635 437 GLU C CA 6411 C C . GLU C 129 ? 0.2717 0.3689 0.2561 0.0259 0.0270 0.0559 437 GLU C C 6412 O O . GLU C 129 ? 0.2873 0.3560 0.2594 0.0198 0.0292 0.0468 437 GLU C O 6413 C CB . GLU C 129 ? 0.3267 0.4896 0.3191 0.0217 0.0195 0.0742 437 GLU C CB 6414 C CG . GLU C 129 ? 0.4277 0.5776 0.4052 0.0073 0.0183 0.0671 437 GLU C CG 6415 C CD . GLU C 129 ? 0.5270 0.6931 0.4875 -0.0218 0.0177 0.0604 437 GLU C CD 6416 O OE1 . GLU C 129 ? 0.5721 0.7859 0.5338 -0.0329 0.0126 0.0693 437 GLU C OE1 6417 O OE2 . GLU C 129 ? 0.5352 0.6661 0.4782 -0.0343 0.0238 0.0468 437 GLU C OE2 6418 N N . ALA C 130 ? 0.2311 0.3240 0.2267 0.0431 0.0292 0.0603 438 ALA C N 6419 C CA . ALA C 130 ? 0.2116 0.2709 0.2047 0.0505 0.0324 0.0534 438 ALA C CA 6420 C C . ALA C 130 ? 0.2540 0.2978 0.2381 0.0421 0.0340 0.0455 438 ALA C C 6421 O O . ALA C 130 ? 0.2721 0.2926 0.2485 0.0425 0.0356 0.0397 438 ALA C O 6422 C CB . ALA C 130 ? 0.2167 0.2730 0.2177 0.0657 0.0367 0.0583 438 ALA C CB 6423 N N . ILE C 131 ? 0.2047 0.2632 0.1891 0.0355 0.0345 0.0467 439 ILE C N 6424 C CA . ILE C 131 ? 0.2288 0.2689 0.1999 0.0259 0.0376 0.0403 439 ILE C CA 6425 C C . ILE C 131 ? 0.2387 0.2570 0.1905 0.0135 0.0406 0.0340 439 ILE C C 6426 O O . ILE C 131 ? 0.2332 0.2206 0.1728 0.0163 0.0456 0.0301 439 ILE C O 6427 C CB . ILE C 131 ? 0.2736 0.3365 0.2455 0.0161 0.0384 0.0423 439 ILE C CB 6428 C CG1 . ILE C 131 ? 0.2344 0.3062 0.2205 0.0307 0.0395 0.0466 439 ILE C CG1 6429 C CG2 . ILE C 131 ? 0.2913 0.3292 0.2418 0.0010 0.0434 0.0354 439 ILE C CG2 6430 C CD1 . ILE C 131 ? 0.2370 0.3462 0.2313 0.0260 0.0403 0.0520 439 ILE C CD1 6431 N N . ALA C 132 ? 0.2433 0.2778 0.1910 0.0013 0.0389 0.0341 440 ALA C N 6432 C CA . ALA C 132 ? 0.2929 0.3038 0.2176 -0.0135 0.0445 0.0266 440 ALA C CA 6433 C C . ALA C 132 ? 0.3237 0.3060 0.2464 0.0007 0.0477 0.0241 440 ALA C C 6434 O O . ALA C 132 ? 0.3987 0.3464 0.3022 -0.0001 0.0568 0.0190 440 ALA C O 6435 C CB . ALA C 132 ? 0.2925 0.3338 0.2135 -0.0315 0.0411 0.0275 440 ALA C CB 6436 N N . SER C 133 ? 0.2815 0.2782 0.2223 0.0143 0.0418 0.0287 441 SER C N 6437 C CA . SER C 133 ? 0.3169 0.2969 0.2580 0.0257 0.0440 0.0269 441 SER C CA 6438 C C . SER C 133 ? 0.3074 0.2729 0.2510 0.0395 0.0466 0.0276 441 SER C C 6439 O O . SER C 133 ? 0.3314 0.2808 0.2682 0.0471 0.0521 0.0264 441 SER C O 6440 C CB . SER C 133 ? 0.2959 0.2943 0.2510 0.0314 0.0383 0.0311 441 SER C CB 6441 O OG . SER C 133 ? 0.3343 0.3449 0.2837 0.0197 0.0367 0.0314 441 SER C OG 6442 N N . TYR C 134 ? 0.2863 0.2606 0.2389 0.0434 0.0435 0.0305 442 TYR C N 6443 C CA . TYR C 134 ? 0.2924 0.2583 0.2454 0.0536 0.0452 0.0319 442 TYR C CA 6444 C C . TYR C 134 ? 0.3153 0.2559 0.2500 0.0533 0.0531 0.0315 442 TYR C C 6445 O O . TYR C 134 ? 0.3107 0.2423 0.2420 0.0657 0.0568 0.0349 442 TYR C O 6446 C CB . TYR C 134 ? 0.3164 0.2946 0.2791 0.0550 0.0418 0.0340 442 TYR C CB 6447 C CG . TYR C 134 ? 0.3134 0.3035 0.2876 0.0596 0.0388 0.0347 442 TYR C CG 6448 C CD1 . TYR C 134 ? 0.3008 0.2923 0.2762 0.0637 0.0383 0.0339 442 TYR C CD1 6449 C CD2 . TYR C 134 ? 0.3196 0.3189 0.3006 0.0596 0.0385 0.0367 442 TYR C CD2 6450 C CE1 . TYR C 134 ? 0.3309 0.3272 0.3102 0.0629 0.0380 0.0329 442 TYR C CE1 6451 C CE2 . TYR C 134 ? 0.3367 0.3355 0.3211 0.0636 0.0400 0.0371 442 TYR C CE2 6452 C CZ . TYR C 134 ? 0.3551 0.3496 0.3366 0.0629 0.0399 0.0341 442 TYR C CZ 6453 O OH . TYR C 134 ? 0.3861 0.3743 0.3646 0.0621 0.0437 0.0329 442 TYR C OH 6454 N N . ARG C 135 ? 0.3299 0.2601 0.2507 0.0388 0.0569 0.0283 443 ARG C N 6455 C CA . ARG C 135 ? 0.3803 0.2757 0.2756 0.0353 0.0682 0.0269 443 ARG C CA 6456 C C . ARG C 135 ? 0.4077 0.2754 0.2866 0.0410 0.0785 0.0251 443 ARG C C 6457 O O . ARG C 135 ? 0.3974 0.2341 0.2595 0.0528 0.0899 0.0283 443 ARG C O 6458 C CB . ARG C 135 ? 0.4448 0.3379 0.3255 0.0120 0.0706 0.0222 443 ARG C CB 6459 C CG . ARG C 135 ? 0.4513 0.3623 0.3419 0.0102 0.0657 0.0252 443 ARG C CG 6460 C CD . ARG C 135 ? 0.4870 0.4099 0.3674 -0.0146 0.0668 0.0214 443 ARG C CD 6461 N NE . ARG C 135 ? 0.4802 0.4157 0.3673 -0.0146 0.0648 0.0243 443 ARG C NE 6462 C CZ . ARG C 135 ? 0.4740 0.4368 0.3625 -0.0318 0.0632 0.0235 443 ARG C CZ 6463 N NH1 . ARG C 135 ? 0.5056 0.4914 0.3895 -0.0521 0.0622 0.0208 443 ARG C NH1 6464 N NH2 . ARG C 135 ? 0.4009 0.3733 0.2954 -0.0296 0.0626 0.0260 443 ARG C NH2 6465 N N . THR C 136 ? 0.3874 0.2663 0.2706 0.0346 0.0759 0.0211 444 THR C N 6466 C CA . THR C 136 ? 0.4199 0.2757 0.2896 0.0414 0.0863 0.0190 444 THR C CA 6467 C C . THR C 136 ? 0.3838 0.2469 0.2672 0.0676 0.0866 0.0268 444 THR C C 6468 O O . THR C 136 ? 0.4465 0.2833 0.3148 0.0822 0.1000 0.0301 444 THR C O 6469 C CB . THR C 136 ? 0.4385 0.3098 0.3110 0.0284 0.0823 0.0137 444 THR C CB 6470 O OG1 . THR C 136 ? 0.4335 0.3031 0.2895 0.0022 0.0833 0.0077 444 THR C OG1 6471 C CG2 . THR C 136 ? 0.4647 0.3132 0.3238 0.0363 0.0942 0.0109 444 THR C CG2 6472 N N . ALA C 137 ? 0.3319 0.2315 0.2415 0.0731 0.0735 0.0306 445 ALA C N 6473 C CA . ALA C 137 ? 0.3528 0.2721 0.2763 0.0918 0.0717 0.0375 445 ALA C CA 6474 C C . ALA C 137 ? 0.3792 0.2889 0.2956 0.1072 0.0776 0.0461 445 ALA C C 6475 O O . ALA C 137 ? 0.3939 0.3133 0.3119 0.1227 0.0814 0.0536 445 ALA C O 6476 C CB . ALA C 137 ? 0.3325 0.2866 0.2778 0.0875 0.0586 0.0374 445 ALA C CB 6477 N N . LEU C 138 ? 0.3463 0.2434 0.2552 0.0995 0.0768 0.0458 446 LEU C N 6478 C CA . LEU C 138 ? 0.3740 0.2584 0.2727 0.1124 0.0827 0.0548 446 LEU C CA 6479 C C . LEU C 138 ? 0.4729 0.3123 0.3421 0.1166 0.1002 0.0560 446 LEU C C 6480 O O . LEU C 138 ? 0.5052 0.3419 0.3666 0.1283 0.1063 0.0641 446 LEU C O 6481 C CB . LEU C 138 ? 0.3925 0.2811 0.2929 0.0998 0.0760 0.0531 446 LEU C CB 6482 C CG . LEU C 138 ? 0.3377 0.2668 0.2620 0.0968 0.0622 0.0527 446 LEU C CG 6483 C CD1 . LEU C 138 ? 0.3146 0.2450 0.2407 0.0813 0.0577 0.0475 446 LEU C CD1 6484 C CD2 . LEU C 138 ? 0.3495 0.3005 0.2791 0.1114 0.0601 0.0629 446 LEU C CD2 6485 N N . LYS C 139 ? 0.5183 0.3249 0.3692 0.1032 0.1087 0.0465 447 LYS C N 6486 C CA . LYS C 139 ? 0.5979 0.3561 0.4148 0.1023 0.1283 0.0449 447 LYS C CA 6487 C C . LYS C 139 ? 0.5895 0.3615 0.4122 0.1199 0.1326 0.0519 447 LYS C C 6488 O O . LYS C 139 ? 0.5778 0.3324 0.3839 0.1324 0.1454 0.0599 447 LYS C O 6489 C CB . LYS C 139 ? 0.6492 0.3783 0.4443 0.0751 0.1345 0.0305 447 LYS C CB 6490 C CG . LYS C 139 ? 0.8108 0.4807 0.5623 0.0673 0.1579 0.0258 447 LYS C CG 6491 C CD . LYS C 139 ? 0.8837 0.5368 0.6128 0.0310 0.1611 0.0096 447 LYS C CD 6492 C CE . LYS C 139 ? 1.0125 0.6034 0.6920 0.0153 0.1857 0.0040 447 LYS C CE 6493 N NZ . LYS C 139 ? 1.0434 0.6235 0.6997 -0.0279 0.1866 -0.0133 447 LYS C NZ 6494 N N . LEU C 140 ? 0.5656 0.3700 0.4113 0.1212 0.1226 0.0497 448 LEU C N 6495 C CA . LEU C 140 ? 0.5441 0.3686 0.3989 0.1360 0.1244 0.0564 448 LEU C CA 6496 C C . LEU C 140 ? 0.5466 0.4109 0.4183 0.1535 0.1179 0.0697 448 LEU C C 6497 O O . LEU C 140 ? 0.5599 0.4267 0.4257 0.1699 0.1269 0.0797 448 LEU C O 6498 C CB . LEU C 140 ? 0.4578 0.3073 0.3311 0.1296 0.1155 0.0490 448 LEU C CB 6499 C CG . LEU C 140 ? 0.5020 0.3160 0.3547 0.1150 0.1260 0.0367 448 LEU C CG 6500 C CD1 . LEU C 140 ? 0.4397 0.2822 0.3098 0.1057 0.1163 0.0282 448 LEU C CD1 6501 C CD2 . LEU C 140 ? 0.4162 0.2045 0.2503 0.1239 0.1417 0.0405 448 LEU C CD2 6502 N N . LYS C 141 ? 0.4550 0.3510 0.3459 0.1496 0.1035 0.0703 449 LYS C N 6503 C CA . LYS C 141 ? 0.4126 0.3493 0.3173 0.1616 0.0974 0.0815 449 LYS C CA 6504 C C . LYS C 141 ? 0.4461 0.3841 0.3514 0.1574 0.0921 0.0826 449 LYS C C 6505 O O . LYS C 141 ? 0.3863 0.3467 0.3072 0.1474 0.0795 0.0783 449 LYS C O 6506 C CB . LYS C 141 ? 0.3783 0.3646 0.3078 0.1596 0.0847 0.0812 449 LYS C CB 6507 C CG . LYS C 141 ? 0.4245 0.4584 0.3653 0.1697 0.0797 0.0931 449 LYS C CG 6508 C CD . LYS C 141 ? 0.4525 0.5325 0.4101 0.1693 0.0729 0.0942 449 LYS C CD 6509 C CE . LYS C 141 ? 0.4201 0.5179 0.3925 0.1519 0.0610 0.0837 449 LYS C CE 6510 N NZ . LYS C 141 ? 0.4280 0.5642 0.4131 0.1487 0.0570 0.0826 449 LYS C NZ 6511 N N . PRO C 142 ? 0.5221 0.4336 0.4082 0.1654 0.1032 0.0886 450 PRO C N 6512 C CA . PRO C 142 ? 0.5171 0.4235 0.3997 0.1620 0.1005 0.0901 450 PRO C CA 6513 C C . PRO C 142 ? 0.4581 0.4153 0.3631 0.1627 0.0861 0.0953 450 PRO C C 6514 O O . PRO C 142 ? 0.4382 0.3965 0.3468 0.1524 0.0783 0.0919 450 PRO C O 6515 C CB . PRO C 142 ? 0.5771 0.4558 0.4366 0.1769 0.1172 0.0991 450 PRO C CB 6516 C CG . PRO C 142 ? 0.6444 0.4895 0.4854 0.1799 0.1317 0.0967 450 PRO C CG 6517 C CD . PRO C 142 ? 0.5939 0.4731 0.4568 0.1783 0.1217 0.0943 450 PRO C CD 6518 N N . ASP C 143 ? 0.4419 0.4410 0.3592 0.1737 0.0838 0.1041 451 ASP C N 6519 C CA . ASP C 143 ? 0.4284 0.4803 0.3638 0.1714 0.0715 0.1089 451 ASP C CA 6520 C C . ASP C 143 ? 0.3412 0.4199 0.2927 0.1598 0.0611 0.1012 451 ASP C C 6521 O O . ASP C 143 ? 0.3286 0.4334 0.2871 0.1644 0.0614 0.1041 451 ASP C O 6522 C CB . ASP C 143 ? 0.5227 0.6123 0.4606 0.1885 0.0760 0.1244 451 ASP C CB 6523 C CG . ASP C 143 ? 0.5445 0.6903 0.4972 0.1831 0.0644 0.1301 451 ASP C CG 6524 O OD1 . ASP C 143 ? 0.5365 0.6844 0.4936 0.1669 0.0540 0.1222 451 ASP C OD1 6525 O OD2 . ASP C 143 ? 0.5934 0.7831 0.5514 0.1942 0.0665 0.1431 451 ASP C OD2 6526 N N . PHE C 144 ? 0.3177 0.3887 0.2732 0.1455 0.0532 0.0922 452 PHE C N 6527 C CA . PHE C 144 ? 0.3061 0.3909 0.2735 0.1349 0.0461 0.0836 452 PHE C CA 6528 C C . PHE C 144 ? 0.2819 0.3687 0.2503 0.1150 0.0386 0.0749 452 PHE C C 6529 O O . PHE C 144 ? 0.2819 0.3373 0.2465 0.1050 0.0394 0.0656 452 PHE C O 6530 C CB . PHE C 144 ? 0.3102 0.3551 0.2723 0.1317 0.0519 0.0744 452 PHE C CB 6531 C CG . PHE C 144 ? 0.2751 0.3332 0.2478 0.1213 0.0476 0.0657 452 PHE C CG 6532 C CD1 . PHE C 144 ? 0.2499 0.3424 0.2317 0.1082 0.0398 0.0623 452 PHE C CD1 6533 C CD2 . PHE C 144 ? 0.2993 0.3321 0.2682 0.1201 0.0525 0.0596 452 PHE C CD2 6534 C CE1 . PHE C 144 ? 0.2604 0.3572 0.2465 0.0958 0.0379 0.0539 452 PHE C CE1 6535 C CE2 . PHE C 144 ? 0.3206 0.3634 0.2966 0.1088 0.0488 0.0522 452 PHE C CE2 6536 C CZ . PHE C 144 ? 0.2978 0.3705 0.2822 0.0977 0.0418 0.0498 452 PHE C CZ 6537 N N . PRO C 145 ? 0.2713 0.3972 0.2428 0.1075 0.0325 0.0777 453 PRO C N 6538 C CA . PRO C 145 ? 0.2927 0.4169 0.2597 0.0881 0.0288 0.0691 453 PRO C CA 6539 C C . PRO C 145 ? 0.3050 0.4054 0.2723 0.0721 0.0296 0.0543 453 PRO C C 6540 O O . PRO C 145 ? 0.2785 0.3543 0.2413 0.0662 0.0314 0.0486 453 PRO C O 6541 C CB . PRO C 145 ? 0.2920 0.4686 0.2600 0.0789 0.0234 0.0733 453 PRO C CB 6542 C CG . PRO C 145 ? 0.2962 0.5039 0.2699 0.1019 0.0238 0.0909 453 PRO C CG 6543 C CD . PRO C 145 ? 0.2854 0.4633 0.2630 0.1173 0.0302 0.0906 453 PRO C CD 6544 N N . ASP C 146 ? 0.3002 0.4088 0.2721 0.0669 0.0293 0.0497 454 ASP C N 6545 C CA . ASP C 146 ? 0.3482 0.4317 0.3181 0.0551 0.0317 0.0387 454 ASP C CA 6546 C C . ASP C 146 ? 0.3261 0.3761 0.2974 0.0628 0.0341 0.0379 454 ASP C C 6547 O O . ASP C 146 ? 0.3163 0.3484 0.2850 0.0573 0.0364 0.0330 454 ASP C O 6548 C CB . ASP C 146 ? 0.3688 0.4630 0.3414 0.0498 0.0318 0.0356 454 ASP C CB 6549 C CG . ASP C 146 ? 0.4330 0.5583 0.3996 0.0318 0.0308 0.0321 454 ASP C CG 6550 O OD1 . ASP C 146 ? 0.4374 0.5703 0.3952 0.0205 0.0308 0.0298 454 ASP C OD1 6551 O OD2 . ASP C 146 ? 0.4552 0.5983 0.4237 0.0260 0.0306 0.0308 454 ASP C OD2 6552 N N . ALA C 147 ? 0.2987 0.3418 0.2720 0.0748 0.0351 0.0429 455 ALA C N 6553 C CA . ALA C 147 ? 0.2698 0.2862 0.2411 0.0764 0.0377 0.0410 455 ALA C CA 6554 C C . ALA C 147 ? 0.2523 0.2566 0.2183 0.0753 0.0389 0.0420 455 ALA C C 6555 O O . ALA C 147 ? 0.2331 0.2267 0.1995 0.0698 0.0397 0.0387 455 ALA C O 6556 C CB . ALA C 147 ? 0.2852 0.2917 0.2532 0.0855 0.0415 0.0441 455 ALA C CB 6557 N N . TYR C 148 ? 0.2063 0.2168 0.1675 0.0808 0.0391 0.0479 456 TYR C N 6558 C CA . TYR C 148 ? 0.2326 0.2313 0.1867 0.0785 0.0408 0.0490 456 TYR C CA 6559 C C . TYR C 148 ? 0.2594 0.2637 0.2170 0.0679 0.0394 0.0428 456 TYR C C 6560 O O . TYR C 148 ? 0.2444 0.2384 0.2012 0.0637 0.0416 0.0402 456 TYR C O 6561 C CB . TYR C 148 ? 0.2712 0.2762 0.2176 0.0879 0.0418 0.0588 456 TYR C CB 6562 C CG . TYR C 148 ? 0.3018 0.2889 0.2370 0.0854 0.0450 0.0607 456 TYR C CG 6563 C CD1 . TYR C 148 ? 0.3255 0.2819 0.2465 0.0893 0.0524 0.0638 456 TYR C CD1 6564 C CD2 . TYR C 148 ? 0.3275 0.3254 0.2629 0.0766 0.0425 0.0582 456 TYR C CD2 6565 C CE1 . TYR C 148 ? 0.3892 0.3280 0.2969 0.0838 0.0563 0.0649 456 TYR C CE1 6566 C CE2 . TYR C 148 ? 0.3607 0.3442 0.2856 0.0731 0.0457 0.0598 456 TYR C CE2 6567 C CZ . TYR C 148 ? 0.3874 0.3425 0.2989 0.0763 0.0521 0.0634 456 TYR C CZ 6568 O OH . TYR C 148 ? 0.3903 0.3300 0.2885 0.0698 0.0563 0.0644 456 TYR C OH 6569 N N . CYS C 149 ? 0.2654 0.2862 0.2244 0.0627 0.0376 0.0402 457 CYS C N 6570 C CA . CYS C 149 ? 0.2982 0.3162 0.2543 0.0529 0.0405 0.0336 457 CYS C CA 6571 C C . CYS C 149 ? 0.2924 0.2960 0.2532 0.0527 0.0444 0.0291 457 CYS C C 6572 O O . CYS C 149 ? 0.2556 0.2511 0.2155 0.0517 0.0495 0.0267 457 CYS C O 6573 C CB . CYS C 149 ? 0.3258 0.3610 0.2753 0.0423 0.0402 0.0303 457 CYS C CB 6574 S SG . CYS C 149 ? 0.3200 0.3845 0.2642 0.0427 0.0350 0.0389 457 CYS C SG 6575 N N . ASN C 150 ? 0.2895 0.2924 0.2550 0.0553 0.0429 0.0294 458 ASN C N 6576 C CA . ASN C 150 ? 0.2467 0.2397 0.2165 0.0574 0.0461 0.0285 458 ASN C CA 6577 C C . ASN C 150 ? 0.2510 0.2445 0.2264 0.0613 0.0454 0.0321 458 ASN C C 6578 O O . ASN C 150 ? 0.2572 0.2517 0.2368 0.0641 0.0489 0.0338 458 ASN C O 6579 C CB . ASN C 150 ? 0.2621 0.2559 0.2338 0.0575 0.0443 0.0284 458 ASN C CB 6580 C CG . ASN C 150 ? 0.3582 0.3487 0.3214 0.0492 0.0482 0.0235 458 ASN C CG 6581 O OD1 . ASN C 150 ? 0.4722 0.4506 0.4261 0.0444 0.0553 0.0197 458 ASN C OD1 6582 N ND2 . ASN C 150 ? 0.4211 0.4207 0.3845 0.0458 0.0455 0.0229 458 ASN C ND2 6583 N N . LEU C 151 ? 0.2291 0.2228 0.2021 0.0612 0.0423 0.0341 459 LEU C N 6584 C CA . LEU C 151 ? 0.2427 0.2359 0.2150 0.0583 0.0429 0.0357 459 LEU C CA 6585 C C . LEU C 151 ? 0.2401 0.2373 0.2121 0.0562 0.0457 0.0357 459 LEU C C 6586 O O . LEU C 151 ? 0.2296 0.2376 0.2064 0.0539 0.0472 0.0371 459 LEU C O 6587 C CB . LEU C 151 ? 0.2547 0.2354 0.2163 0.0572 0.0434 0.0368 459 LEU C CB 6588 C CG . LEU C 151 ? 0.2722 0.2458 0.2242 0.0480 0.0464 0.0365 459 LEU C CG 6589 C CD1 . LEU C 151 ? 0.2842 0.2736 0.2422 0.0400 0.0450 0.0357 459 LEU C CD1 6590 C CD2 . LEU C 151 ? 0.3048 0.2527 0.2386 0.0480 0.0517 0.0373 459 LEU C CD2 6591 N N . ALA C 152 ? 0.2375 0.2315 0.2041 0.0563 0.0464 0.0348 460 ALA C N 6592 C CA . ALA C 152 ? 0.2516 0.2483 0.2161 0.0534 0.0499 0.0340 460 ALA C CA 6593 C C . ALA C 152 ? 0.2447 0.2468 0.2166 0.0568 0.0555 0.0325 460 ALA C C 6594 O O . ALA C 152 ? 0.2320 0.2431 0.2073 0.0570 0.0595 0.0337 460 ALA C O 6595 C CB . ALA C 152 ? 0.2340 0.2294 0.1896 0.0516 0.0495 0.0335 460 ALA C CB 6596 N N . HIS C 153 ? 0.2016 0.2008 0.2151 0.0358 0.0658 0.0423 461 HIS C N 6597 C CA . HIS C 153 ? 0.2064 0.2025 0.2155 0.0306 0.0587 0.0425 461 HIS C CA 6598 C C . HIS C 153 ? 0.2325 0.2238 0.2331 0.0282 0.0604 0.0380 461 HIS C C 6599 O O . HIS C 153 ? 0.2380 0.2238 0.2352 0.0277 0.0550 0.0336 461 HIS C O 6600 C CB . HIS C 153 ? 0.2303 0.2331 0.2454 0.0251 0.0521 0.0493 461 HIS C CB 6601 C CG . HIS C 153 ? 0.2608 0.2536 0.2725 0.0219 0.0393 0.0488 461 HIS C CG 6602 N ND1 . HIS C 153 ? 0.2665 0.2543 0.2737 0.0147 0.0325 0.0529 461 HIS C ND1 6603 C CD2 . HIS C 153 ? 0.2976 0.2840 0.3087 0.0262 0.0306 0.0433 461 HIS C CD2 6604 C CE1 . HIS C 153 ? 0.3050 0.2805 0.3112 0.0159 0.0180 0.0494 461 HIS C CE1 6605 N NE2 . HIS C 153 ? 0.2746 0.2514 0.2837 0.0236 0.0175 0.0420 461 HIS C NE2 6606 N N . CYS C 154 ? 0.2616 0.2574 0.2595 0.0277 0.0673 0.0373 462 CYS C N 6607 C CA . CYS C 154 ? 0.2558 0.2462 0.2440 0.0263 0.0683 0.0319 462 CYS C CA 6608 C C . CYS C 154 ? 0.2318 0.2134 0.2197 0.0285 0.0686 0.0252 462 CYS C C 6609 O O . CYS C 154 ? 0.2355 0.2138 0.2204 0.0266 0.0639 0.0209 462 CYS C O 6610 C CB . CYS C 154 ? 0.2284 0.2266 0.2123 0.0280 0.0767 0.0292 462 CYS C CB 6611 S SG . CYS C 154 ? 0.2976 0.3145 0.2791 0.0209 0.0789 0.0379 462 CYS C SG 6612 N N . LEU C 155 ? 0.2298 0.2082 0.2215 0.0318 0.0729 0.0249 463 LEU C N 6613 C CA . LEU C 155 ? 0.2377 0.2083 0.2286 0.0300 0.0734 0.0217 463 LEU C CA 6614 C C . LEU C 155 ? 0.2183 0.1946 0.2104 0.0271 0.0697 0.0215 463 LEU C C 6615 O O . LEU C 155 ? 0.2348 0.2135 0.2273 0.0235 0.0696 0.0166 463 LEU C O 6616 C CB . LEU C 155 ? 0.2278 0.1894 0.2205 0.0328 0.0755 0.0246 463 LEU C CB 6617 C CG . LEU C 155 ? 0.2641 0.2211 0.2576 0.0392 0.0778 0.0198 463 LEU C CG 6618 C CD1 . LEU C 155 ? 0.2761 0.2208 0.2732 0.0446 0.0756 0.0217 463 LEU C CD1 6619 C CD2 . LEU C 155 ? 0.3153 0.2657 0.3035 0.0371 0.0781 0.0115 463 LEU C CD2 6620 N N . GLN C 156 ? 0.1730 0.1542 0.1671 0.0291 0.0661 0.0252 464 GLN C N 6621 C CA . GLN C 156 ? 0.1816 0.1705 0.1764 0.0293 0.0613 0.0216 464 GLN C CA 6622 C C . GLN C 156 ? 0.1840 0.1754 0.1803 0.0298 0.0548 0.0139 464 GLN C C 6623 O O . GLN C 156 ? 0.2053 0.2062 0.2045 0.0303 0.0534 0.0059 464 GLN C O 6624 C CB . GLN C 156 ? 0.2032 0.1937 0.1994 0.0326 0.0557 0.0255 464 GLN C CB 6625 C CG . GLN C 156 ? 0.2680 0.2670 0.2634 0.0354 0.0500 0.0191 464 GLN C CG 6626 C CD . GLN C 156 ? 0.2768 0.2826 0.2661 0.0340 0.0558 0.0212 464 GLN C CD 6627 O OE1 . GLN C 156 ? 0.3099 0.3082 0.2961 0.0321 0.0599 0.0299 464 GLN C OE1 6628 N NE2 . GLN C 156 ? 0.2332 0.2539 0.2201 0.0353 0.0553 0.0129 464 GLN C NE2 6629 N N . ILE C 157 ? 0.1844 0.1691 0.1788 0.0295 0.0501 0.0166 465 ILE C N 6630 C CA . ILE C 157 ? 0.1587 0.1401 0.1521 0.0299 0.0400 0.0117 465 ILE C CA 6631 C C . ILE C 157 ? 0.2090 0.1939 0.2033 0.0294 0.0419 0.0033 465 ILE C C 6632 O O . ILE C 157 ? 0.2255 0.2141 0.2242 0.0326 0.0330 -0.0053 465 ILE C O 6633 C CB . ILE C 157 ? 0.1900 0.1634 0.1764 0.0257 0.0367 0.0202 465 ILE C CB 6634 C CG1 . ILE C 157 ? 0.1919 0.1629 0.1808 0.0240 0.0298 0.0281 465 ILE C CG1 6635 C CG2 . ILE C 157 ? 0.1773 0.1433 0.1576 0.0248 0.0265 0.0170 465 ILE C CG2 6636 C CD1 . ILE C 157 ? 0.2092 0.1796 0.1925 0.0160 0.0302 0.0395 465 ILE C CD1 6637 N N . VAL C 158 ? 0.1601 0.1438 0.1522 0.0262 0.0517 0.0046 466 VAL C N 6638 C CA . VAL C 158 ? 0.2153 0.2011 0.2094 0.0239 0.0523 -0.0030 466 VAL C CA 6639 C C . VAL C 158 ? 0.2310 0.2260 0.2322 0.0196 0.0593 -0.0052 466 VAL C C 6640 O O . VAL C 158 ? 0.2174 0.2144 0.2223 0.0149 0.0606 -0.0099 466 VAL C O 6641 C CB . VAL C 158 ? 0.2390 0.2148 0.2243 0.0223 0.0549 -0.0022 466 VAL C CB 6642 C CG1 . VAL C 158 ? 0.2118 0.1827 0.1870 0.0233 0.0488 0.0020 466 VAL C CG1 6643 C CG2 . VAL C 158 ? 0.2487 0.2191 0.2325 0.0222 0.0641 0.0023 466 VAL C CG2 6644 N N . CYS C 159 ? 0.2170 0.2178 0.2191 0.0197 0.0630 -0.0009 467 CYS C N 6645 C CA . CYS C 159 ? 0.2344 0.2455 0.2393 0.0130 0.0698 0.0005 467 CYS C CA 6646 C C . CYS C 159 ? 0.2321 0.2291 0.2344 0.0055 0.0744 0.0061 467 CYS C C 6647 O O . CYS C 159 ? 0.2086 0.2119 0.2155 -0.0039 0.0770 0.0053 467 CYS C O 6648 C CB . CYS C 159 ? 0.2847 0.3197 0.2997 0.0114 0.0688 -0.0102 467 CYS C CB 6649 S SG . CYS C 159 ? 0.2475 0.2976 0.2667 0.0233 0.0602 -0.0204 467 CYS C SG 6650 N N . ASP C 160 ? 0.2431 0.2221 0.2396 0.0097 0.0742 0.0109 468 ASP C N 6651 C CA . ASP C 160 ? 0.2513 0.2126 0.2452 0.0061 0.0755 0.0150 468 ASP C CA 6652 C C . ASP C 160 ? 0.2516 0.2084 0.2416 0.0049 0.0768 0.0253 468 ASP C C 6653 O O . ASP C 160 ? 0.2647 0.2199 0.2529 0.0127 0.0761 0.0285 468 ASP C O 6654 C CB . ASP C 160 ? 0.2447 0.1933 0.2352 0.0143 0.0740 0.0113 468 ASP C CB 6655 C CG . ASP C 160 ? 0.3245 0.2526 0.3138 0.0136 0.0720 0.0105 468 ASP C CG 6656 O OD1 . ASP C 160 ? 0.3595 0.2769 0.3487 0.0081 0.0707 0.0180 468 ASP C OD1 6657 O OD2 . ASP C 160 ? 0.3772 0.2984 0.3639 0.0188 0.0704 0.0021 468 ASP C OD2 6658 N N . TRP C 161 ? 0.2489 0.2049 0.2373 -0.0063 0.0781 0.0315 469 TRP C N 6659 C CA . TRP C 161 ? 0.2657 0.2167 0.2462 -0.0096 0.0780 0.0433 469 TRP C CA 6660 C C . TRP C 161 ? 0.2754 0.1970 0.2517 -0.0144 0.0725 0.0517 469 TRP C C 6661 O O . TRP C 161 ? 0.2917 0.2062 0.2597 -0.0245 0.0708 0.0642 469 TRP C O 6662 C CB . TRP C 161 ? 0.2695 0.2453 0.2475 -0.0202 0.0833 0.0462 469 TRP C CB 6663 C CG . TRP C 161 ? 0.2347 0.2370 0.2182 -0.0124 0.0853 0.0348 469 TRP C CG 6664 C CD1 . TRP C 161 ? 0.2447 0.2460 0.2295 0.0006 0.0815 0.0298 469 TRP C CD1 6665 C CD2 . TRP C 161 ? 0.2196 0.2524 0.2097 -0.0169 0.0894 0.0263 469 TRP C CD2 6666 N NE1 . TRP C 161 ? 0.2222 0.2455 0.2124 0.0049 0.0806 0.0192 469 TRP C NE1 6667 C CE2 . TRP C 161 ? 0.2246 0.2690 0.2189 -0.0039 0.0856 0.0152 469 TRP C CE2 6668 C CE3 . TRP C 161 ? 0.2161 0.2693 0.2104 -0.0311 0.0953 0.0266 469 TRP C CE3 6669 C CZ2 . TRP C 161 ? 0.1797 0.2537 0.1827 -0.0012 0.0861 0.0019 469 TRP C CZ2 6670 C CZ3 . TRP C 161 ? 0.2602 0.3496 0.2648 -0.0294 0.0985 0.0134 469 TRP C CZ3 6671 C CH2 . TRP C 161 ? 0.2350 0.3335 0.2438 -0.0129 0.0932 0.0000 469 TRP C CH2 6672 N N . THR C 162 ? 0.3173 0.2209 0.2978 -0.0070 0.0682 0.0446 470 THR C N 6673 C CA . THR C 162 ? 0.3660 0.2374 0.3438 -0.0075 0.0591 0.0493 470 THR C CA 6674 C C . THR C 162 ? 0.3625 0.2237 0.3353 0.0007 0.0545 0.0577 470 THR C C 6675 O O . THR C 162 ? 0.3111 0.1852 0.2877 0.0135 0.0571 0.0530 470 THR C O 6676 C CB . THR C 162 ? 0.4448 0.3029 0.4278 0.0037 0.0551 0.0354 470 THR C CB 6677 O OG1 . THR C 162 ? 0.4369 0.3069 0.4236 -0.0020 0.0585 0.0265 470 THR C OG1 6678 C CG2 . THR C 162 ? 0.4820 0.3034 0.4636 0.0039 0.0424 0.0371 470 THR C CG2 6679 N N . ASP C 163 ? 0.3890 0.2276 0.3535 -0.0082 0.0464 0.0712 471 ASP C N 6680 C CA . ASP C 163 ? 0.4439 0.2692 0.4023 -0.0009 0.0386 0.0805 471 ASP C CA 6681 C C . ASP C 163 ? 0.4348 0.2885 0.3907 0.0035 0.0458 0.0821 471 ASP C C 6682 O O . ASP C 163 ? 0.3576 0.2105 0.3167 0.0168 0.0413 0.0812 471 ASP C O 6683 C CB . ASP C 163 ? 0.4912 0.2974 0.4590 0.0186 0.0293 0.0703 471 ASP C CB 6684 C CG . ASP C 163 ? 0.5926 0.3662 0.5622 0.0173 0.0185 0.0659 471 ASP C CG 6685 O OD1 . ASP C 163 ? 0.6654 0.4188 0.6263 -0.0006 0.0123 0.0784 471 ASP C OD1 6686 O OD2 . ASP C 163 ? 0.6454 0.4147 0.6248 0.0336 0.0157 0.0495 471 ASP C OD2 6687 N N . TYR C 164 ? 0.4058 0.2855 0.3579 -0.0072 0.0556 0.0829 472 TYR C N 6688 C CA . TYR C 164 ? 0.3801 0.2866 0.3315 -0.0016 0.0611 0.0798 472 TYR C CA 6689 C C . TYR C 164 ? 0.3673 0.2684 0.3076 0.0014 0.0546 0.0904 472 TYR C C 6690 O O . TYR C 164 ? 0.3224 0.2308 0.2682 0.0137 0.0522 0.0860 472 TYR C O 6691 C CB . TYR C 164 ? 0.4010 0.3358 0.3506 -0.0121 0.0705 0.0765 472 TYR C CB 6692 C CG . TYR C 164 ? 0.3667 0.3262 0.3151 -0.0051 0.0732 0.0708 472 TYR C CG 6693 C CD1 . TYR C 164 ? 0.3358 0.3051 0.2959 0.0059 0.0734 0.0587 472 TYR C CD1 6694 C CD2 . TYR C 164 ? 0.3953 0.3667 0.3292 -0.0100 0.0738 0.0778 472 TYR C CD2 6695 C CE1 . TYR C 164 ? 0.3370 0.3236 0.2966 0.0120 0.0722 0.0532 472 TYR C CE1 6696 C CE2 . TYR C 164 ? 0.3844 0.3762 0.3169 -0.0021 0.0739 0.0700 472 TYR C CE2 6697 C CZ . TYR C 164 ? 0.3668 0.3642 0.3133 0.0091 0.0721 0.0575 472 TYR C CZ 6698 O OH . TYR C 164 ? 0.3889 0.4019 0.3342 0.0166 0.0688 0.0495 472 TYR C OH 6699 N N . ASP C 165 ? 0.3501 0.2384 0.2743 -0.0112 0.0505 0.1052 473 ASP C N 6700 C CA . ASP C 165 ? 0.4228 0.3043 0.3320 -0.0095 0.0425 0.1169 473 ASP C CA 6701 C C . ASP C 165 ? 0.4223 0.2813 0.3404 0.0072 0.0298 0.1157 473 ASP C C 6702 O O . ASP C 165 ? 0.4445 0.3102 0.3617 0.0166 0.0249 0.1159 473 ASP C O 6703 C CB . ASP C 165 ? 0.5244 0.3934 0.4118 -0.0291 0.0385 0.1351 473 ASP C CB 6704 C CG . ASP C 165 ? 0.5681 0.4707 0.4458 -0.0449 0.0518 0.1333 473 ASP C CG 6705 O OD1 . ASP C 165 ? 0.5290 0.4636 0.4152 -0.0373 0.0616 0.1211 473 ASP C OD1 6706 O OD2 . ASP C 165 ? 0.6270 0.5276 0.4967 -0.0581 0.0547 0.1419 473 ASP C OD2 6707 N N . GLU C 166 ? 0.4220 0.2564 0.3500 0.0117 0.0235 0.1128 474 GLU C N 6708 C CA . GLU C 166 ? 0.4492 0.2671 0.3897 0.0301 0.0116 0.1076 474 GLU C CA 6709 C C . GLU C 166 ? 0.3543 0.2006 0.3144 0.0443 0.0195 0.0919 474 GLU C C 6710 O O . GLU C 166 ? 0.3467 0.1979 0.3169 0.0576 0.0131 0.0890 474 GLU C O 6711 C CB . GLU C 166 ? 0.5875 0.3736 0.5339 0.0328 0.0025 0.1045 474 GLU C CB 6712 C CG . GLU C 166 ? 0.7074 0.4839 0.6717 0.0555 -0.0080 0.0924 474 GLU C CG 6713 C CD . GLU C 166 ? 0.8024 0.5510 0.7737 0.0609 -0.0164 0.0834 474 GLU C CD 6714 O OE1 . GLU C 166 ? 0.8393 0.5878 0.8289 0.0804 -0.0237 0.0689 474 GLU C OE1 6715 O OE2 . GLU C 166 ? 0.8317 0.5644 0.7935 0.0449 -0.0157 0.0889 474 GLU C OE2 6716 N N . ARG C 167 ? 0.3273 0.1931 0.2933 0.0401 0.0324 0.0827 475 ARG C N 6717 C CA . ARG C 167 ? 0.3098 0.2015 0.2907 0.0489 0.0397 0.0710 475 ARG C CA 6718 C C . ARG C 167 ? 0.3292 0.2385 0.3087 0.0501 0.0385 0.0745 475 ARG C C 6719 O O . ARG C 167 ? 0.3199 0.2417 0.3131 0.0596 0.0365 0.0699 475 ARG C O 6720 C CB . ARG C 167 ? 0.3151 0.2201 0.2975 0.0421 0.0506 0.0634 475 ARG C CB 6721 C CG . ARG C 167 ? 0.3418 0.2694 0.3366 0.0484 0.0564 0.0541 475 ARG C CG 6722 C CD . ARG C 167 ? 0.3912 0.3298 0.3833 0.0407 0.0637 0.0492 475 ARG C CD 6723 N NE . ARG C 167 ? 0.3988 0.3247 0.3870 0.0351 0.0654 0.0467 475 ARG C NE 6724 C CZ . ARG C 167 ? 0.4199 0.3529 0.4057 0.0271 0.0697 0.0431 475 ARG C CZ 6725 N NH1 . ARG C 167 ? 0.4052 0.3562 0.3915 0.0255 0.0720 0.0407 475 ARG C NH1 6726 N NH2 . ARG C 167 ? 0.4319 0.3533 0.4163 0.0213 0.0697 0.0408 475 ARG C NH2 6727 N N . MET C 168 ? 0.3278 0.2402 0.2909 0.0400 0.0396 0.0817 476 MET C N 6728 C CA . MET C 168 ? 0.2995 0.2270 0.2583 0.0418 0.0368 0.0828 476 MET C CA 6729 C C . MET C 168 ? 0.3036 0.2207 0.2624 0.0501 0.0241 0.0893 476 MET C C 6730 O O . MET C 168 ? 0.3254 0.2555 0.2936 0.0570 0.0196 0.0858 476 MET C O 6731 C CB . MET C 168 ? 0.3085 0.2453 0.2478 0.0307 0.0411 0.0867 476 MET C CB 6732 C CG . MET C 168 ? 0.3028 0.2561 0.2453 0.0247 0.0517 0.0776 476 MET C CG 6733 S SD . MET C 168 ? 0.3489 0.3190 0.3088 0.0333 0.0522 0.0639 476 MET C SD 6734 C CE . MET C 168 ? 0.3751 0.3369 0.3496 0.0347 0.0569 0.0598 476 MET C CE 6735 N N . LYS C 169 ? 0.2977 0.1898 0.2470 0.0491 0.0161 0.0989 477 LYS C N 6736 C CA . LYS C 169 ? 0.3556 0.2344 0.3051 0.0586 0.0007 0.1049 477 LYS C CA 6737 C C . LYS C 169 ? 0.3702 0.2578 0.3485 0.0746 -0.0027 0.0938 477 LYS C C 6738 O O . LYS C 169 ? 0.3576 0.2530 0.3451 0.0836 -0.0121 0.0933 477 LYS C O 6739 C CB . LYS C 169 ? 0.4164 0.2607 0.3498 0.0543 -0.0105 0.1181 477 LYS C CB 6740 C CG . LYS C 169 ? 0.4919 0.3305 0.3940 0.0365 -0.0096 0.1337 477 LYS C CG 6741 C CD . LYS C 169 ? 0.5712 0.3792 0.4640 0.0299 -0.0227 0.1475 477 LYS C CD 6742 C CE . LYS C 169 ? 0.6349 0.4451 0.4981 0.0106 -0.0153 0.1597 477 LYS C CE 6743 N NZ . LYS C 169 ? 0.6937 0.4759 0.5497 0.0039 -0.0257 0.1698 477 LYS C NZ 6744 N N . LYS C 170 ? 0.3319 0.2214 0.3245 0.0779 0.0049 0.0842 478 LYS C N 6745 C CA . LYS C 170 ? 0.3432 0.2484 0.3625 0.0922 0.0046 0.0723 478 LYS C CA 6746 C C . LYS C 170 ? 0.3012 0.2394 0.3341 0.0912 0.0113 0.0676 478 LYS C C 6747 O O . LYS C 170 ? 0.3250 0.2799 0.3778 0.1006 0.0060 0.0635 478 LYS C O 6748 C CB . LYS C 170 ? 0.3944 0.2962 0.4220 0.0958 0.0117 0.0617 478 LYS C CB 6749 C CG . LYS C 170 ? 0.4358 0.3575 0.4899 0.1122 0.0115 0.0480 478 LYS C CG 6750 C CD . LYS C 170 ? 0.5005 0.4107 0.5589 0.1203 0.0125 0.0361 478 LYS C CD 6751 C CE . LYS C 170 ? 0.5572 0.4927 0.6424 0.1390 0.0119 0.0198 478 LYS C CE 6752 N NZ . LYS C 170 ? 0.5729 0.5007 0.6617 0.1468 0.0115 0.0038 478 LYS C NZ 6753 N N . LEU C 171 ? 0.2823 0.2295 0.3058 0.0796 0.0210 0.0681 479 LEU C N 6754 C CA . LEU C 171 ? 0.2833 0.2546 0.3167 0.0764 0.0240 0.0653 479 LEU C CA 6755 C C . LEU C 171 ? 0.2660 0.2414 0.3007 0.0791 0.0120 0.0696 479 LEU C C 6756 O O . LEU C 171 ? 0.2783 0.2730 0.3323 0.0816 0.0088 0.0669 479 LEU C O 6757 C CB . LEU C 171 ? 0.2930 0.2660 0.3130 0.0655 0.0315 0.0647 479 LEU C CB 6758 C CG . LEU C 171 ? 0.3193 0.2936 0.3399 0.0615 0.0424 0.0594 479 LEU C CG 6759 C CD1 . LEU C 171 ? 0.2761 0.2515 0.2844 0.0528 0.0460 0.0582 479 LEU C CD1 6760 C CD2 . LEU C 171 ? 0.3026 0.2959 0.3414 0.0636 0.0469 0.0544 479 LEU C CD2 6761 N N . VAL C 172 ? 0.2752 0.2338 0.2881 0.0771 0.0051 0.0769 480 VAL C N 6762 C CA . VAL C 172 ? 0.3186 0.2786 0.3278 0.0803 -0.0081 0.0808 480 VAL C CA 6763 C C . VAL C 172 ? 0.3086 0.2696 0.3377 0.0924 -0.0191 0.0804 480 VAL C C 6764 O O . VAL C 172 ? 0.3299 0.3061 0.3743 0.0965 -0.0279 0.0784 480 VAL C O 6765 C CB . VAL C 172 ? 0.3670 0.3097 0.3443 0.0750 -0.0127 0.0900 480 VAL C CB 6766 C CG1 . VAL C 172 ? 0.3796 0.3233 0.3500 0.0794 -0.0279 0.0934 480 VAL C CG1 6767 C CG2 . VAL C 172 ? 0.3500 0.2994 0.3112 0.0646 -0.0013 0.0873 480 VAL C CG2 6768 N N . SER C 173 ? 0.2765 0.2216 0.3074 0.0988 -0.0203 0.0810 481 SER C N 6769 C CA A SER C 173 ? 0.2738 0.2194 0.3258 0.1139 -0.0321 0.0775 481 SER C CA 6770 C CA B SER C 173 ? 0.3102 0.2559 0.3622 0.1139 -0.0322 0.0775 481 SER C CA 6771 C C . SER C 173 ? 0.2974 0.2791 0.3842 0.1195 -0.0258 0.0660 481 SER C C 6772 O O . SER C 173 ? 0.2992 0.2974 0.4081 0.1287 -0.0361 0.0628 481 SER C O 6773 C CB A SER C 173 ? 0.2963 0.2149 0.3437 0.1203 -0.0354 0.0774 481 SER C CB 6774 C CB B SER C 173 ? 0.2973 0.2155 0.3445 0.1206 -0.0362 0.0778 481 SER C CB 6775 O OG A SER C 173 ? 0.3079 0.2308 0.3801 0.1354 -0.0476 0.0680 481 SER C OG 6776 O OG B SER C 173 ? 0.3622 0.2476 0.3789 0.1130 -0.0464 0.0911 481 SER C OG 6777 N N . ILE C 174 ? 0.2667 0.2623 0.3581 0.1127 -0.0093 0.0605 482 ILE C N 6778 C CA . ILE C 174 ? 0.2608 0.2933 0.3808 0.1135 -0.0007 0.0522 482 ILE C CA 6779 C C . ILE C 174 ? 0.2571 0.3101 0.3876 0.1056 -0.0053 0.0558 482 ILE C C 6780 O O . ILE C 174 ? 0.2473 0.3291 0.4061 0.1098 -0.0087 0.0519 482 ILE C O 6781 C CB . ILE C 174 ? 0.2753 0.3146 0.3904 0.1050 0.0166 0.0485 482 ILE C CB 6782 C CG1 . ILE C 174 ? 0.3255 0.3521 0.4386 0.1149 0.0204 0.0406 482 ILE C CG1 6783 C CG2 . ILE C 174 ? 0.2329 0.3107 0.3703 0.0990 0.0253 0.0452 482 ILE C CG2 6784 C CD1 . ILE C 174 ? 0.3498 0.3744 0.4506 0.1063 0.0346 0.0379 482 ILE C CD1 6785 N N . VAL C 175 ? 0.2800 0.3196 0.3891 0.0945 -0.0062 0.0620 483 VAL C N 6786 C CA . VAL C 175 ? 0.2750 0.3273 0.3912 0.0870 -0.0138 0.0642 483 VAL C CA 6787 C C . VAL C 175 ? 0.2809 0.3359 0.4074 0.0957 -0.0310 0.0652 483 VAL C C 6788 O O . VAL C 175 ? 0.2760 0.3551 0.4276 0.0940 -0.0374 0.0637 483 VAL C O 6789 C CB . VAL C 175 ? 0.2918 0.3266 0.3814 0.0777 -0.0143 0.0669 483 VAL C CB 6790 C CG1 . VAL C 175 ? 0.2765 0.3179 0.3715 0.0731 -0.0277 0.0671 483 VAL C CG1 6791 C CG2 . VAL C 175 ? 0.2847 0.3206 0.3697 0.0691 -0.0004 0.0651 483 VAL C CG2 6792 N N . ALA C 176 ? 0.2948 0.3249 0.4016 0.1039 -0.0397 0.0687 484 ALA C N 6793 C CA . ALA C 176 ? 0.3197 0.3478 0.4319 0.1133 -0.0586 0.0705 484 ALA C CA 6794 C C . ALA C 176 ? 0.3185 0.3742 0.4704 0.1242 -0.0625 0.0634 484 ALA C C 6795 O O . ALA C 176 ? 0.3048 0.3780 0.4762 0.1269 -0.0754 0.0618 484 ALA C O 6796 C CB . ALA C 176 ? 0.3533 0.3472 0.4352 0.1189 -0.0672 0.0780 484 ALA C CB 6797 N N . ASP C 177 ? 0.3010 0.3632 0.4650 0.1308 -0.0515 0.0573 485 ASP C N 6798 C CA . ASP C 177 ? 0.2926 0.3859 0.4922 0.1427 -0.0528 0.0459 485 ASP C CA 6799 C C . ASP C 177 ? 0.2590 0.3985 0.4917 0.1328 -0.0446 0.0439 485 ASP C C 6800 O O . ASP C 177 ? 0.2655 0.4346 0.5256 0.1366 -0.0523 0.0379 485 ASP C O 6801 C CB . ASP C 177 ? 0.3612 0.4500 0.5612 0.1521 -0.0428 0.0366 485 ASP C CB 6802 C CG . ASP C 177 ? 0.4649 0.5880 0.6973 0.1647 -0.0401 0.0260 485 ASP C CG 6803 O OD1 . ASP C 177 ? 0.4810 0.6041 0.7221 0.1721 -0.0540 0.0255 485 ASP C OD1 6804 O OD2 . ASP C 177 ? 0.4934 0.6416 0.7450 0.1634 -0.0245 0.0167 485 ASP C OD2 6805 N N . GLN C 178 ? 0.2251 0.3677 0.4469 0.1166 -0.0292 0.0474 486 GLN C N 6806 C CA . GLN C 178 ? 0.2193 0.4004 0.4654 0.1021 -0.0215 0.0481 486 GLN C CA 6807 C C . GLN C 178 ? 0.2303 0.4160 0.4856 0.0939 -0.0378 0.0535 486 GLN C C 6808 O O . GLN C 178 ? 0.2700 0.4938 0.5592 0.0883 -0.0401 0.0524 486 GLN C O 6809 C CB . GLN C 178 ? 0.2009 0.3758 0.4283 0.0867 -0.0055 0.0524 486 GLN C CB 6810 C CG . GLN C 178 ? 0.2258 0.4032 0.4482 0.0939 0.0105 0.0453 486 GLN C CG 6811 C CD . GLN C 178 ? 0.2465 0.4186 0.4503 0.0791 0.0245 0.0495 486 GLN C CD 6812 O OE1 . GLN C 178 ? 0.2777 0.4194 0.4562 0.0714 0.0215 0.0556 486 GLN C OE1 6813 N NE2 . GLN C 178 ? 0.2459 0.4497 0.4620 0.0761 0.0394 0.0451 486 GLN C NE2 6814 N N . LEU C 179 ? 0.2663 0.4157 0.4921 0.0929 -0.0494 0.0586 487 LEU C N 6815 C CA . LEU C 179 ? 0.2968 0.4458 0.5271 0.0878 -0.0678 0.0613 487 LEU C CA 6816 C C . LEU C 179 ? 0.3101 0.4782 0.5680 0.1006 -0.0832 0.0572 487 LEU C C 6817 O O . LEU C 179 ? 0.3230 0.5137 0.6053 0.0939 -0.0939 0.0566 487 LEU C O 6818 C CB . LEU C 179 ? 0.2978 0.4071 0.4876 0.0877 -0.0765 0.0645 487 LEU C CB 6819 C CG . LEU C 179 ? 0.3005 0.3935 0.4668 0.0754 -0.0671 0.0663 487 LEU C CG 6820 C CD1 . LEU C 179 ? 0.3216 0.3844 0.4510 0.0784 -0.0760 0.0662 487 LEU C CD1 6821 C CD2 . LEU C 179 ? 0.2783 0.3884 0.4651 0.0596 -0.0698 0.0677 487 LEU C CD2 6822 N N . GLU C 180 ? 0.3406 0.4954 0.5890 0.1174 -0.0846 0.0528 488 GLU C N 6823 C CA . GLU C 180 ? 0.3988 0.5649 0.6603 0.1298 -0.0969 0.0465 488 GLU C CA 6824 C C . GLU C 180 ? 0.4237 0.6421 0.7304 0.1299 -0.0897 0.0380 488 GLU C C 6825 O O . GLU C 180 ? 0.4433 0.6859 0.7725 0.1305 -0.1003 0.0352 488 GLU C O 6826 C CB . GLU C 180 ? 0.4661 0.6031 0.7054 0.1455 -0.0985 0.0460 488 GLU C CB 6827 C CG . GLU C 180 ? 0.5655 0.6569 0.7610 0.1448 -0.1084 0.0555 488 GLU C CG 6828 C CD . GLU C 180 ? 0.6523 0.7167 0.8322 0.1564 -0.1137 0.0574 488 GLU C CD 6829 O OE1 . GLU C 180 ? 0.6285 0.7091 0.8339 0.1675 -0.1151 0.0496 488 GLU C OE1 6830 O OE2 . GLU C 180 ? 0.7247 0.7527 0.8676 0.1533 -0.1168 0.0667 488 GLU C OE2 6831 N N . LYS C 181 ? 0.4246 0.6629 0.7433 0.1288 -0.0708 0.0337 489 LYS C N 6832 C CA . LYS C 181 ? 0.4327 0.7259 0.7891 0.1293 -0.0602 0.0241 489 LYS C CA 6833 C C . LYS C 181 ? 0.4198 0.7474 0.8001 0.1049 -0.0534 0.0292 489 LYS C C 6834 O O . LYS C 181 ? 0.4012 0.7760 0.8097 0.0985 -0.0407 0.0218 489 LYS C O 6835 C CB . LYS C 181 ? 0.4541 0.7537 0.8072 0.1400 -0.0425 0.0165 489 LYS C CB 6836 C CG . LYS C 181 ? 0.5186 0.7814 0.8573 0.1595 -0.0498 0.0157 489 LYS C CG 6837 C CD . LYS C 181 ? 0.5699 0.8271 0.9062 0.1665 -0.0345 0.0077 489 LYS C CD 6838 C CE . LYS C 181 ? 0.6258 0.8498 0.9504 0.1850 -0.0466 0.0015 489 LYS C CE 6839 N NZ . LYS C 181 ? 0.6559 0.8686 0.9728 0.1920 -0.0352 -0.0083 489 LYS C NZ 6840 N N . ASN C 182 ? 0.4348 0.7369 0.8009 0.0903 -0.0624 0.0421 490 ASN C N 6841 C CA . ASN C 182 ? 0.4589 0.7828 0.8415 0.0651 -0.0612 0.0514 490 ASN C CA 6842 C C . ASN C 182 ? 0.4454 0.7928 0.8313 0.0499 -0.0379 0.0558 490 ASN C C 6843 O O . ASN C 182 ? 0.4393 0.8275 0.8485 0.0344 -0.0298 0.0555 490 ASN C O 6844 C CB . ASN C 182 ? 0.5140 0.8748 0.9300 0.0603 -0.0721 0.0461 490 ASN C CB 6845 C CG . ASN C 182 ? 0.5599 0.9284 0.9867 0.0327 -0.0783 0.0573 490 ASN C CG 6846 O OD1 . ASN C 182 ? 0.5844 0.9163 0.9926 0.0267 -0.0945 0.0642 490 ASN C OD1 6847 N ND2 . ASN C 182 ? 0.5729 0.9867 1.0265 0.0155 -0.0662 0.0576 490 ASN C ND2 6848 N N . ARG C 183 ? 0.4304 0.7475 0.7849 0.0533 -0.0269 0.0583 491 ARG C N 6849 C CA . ARG C 183 ? 0.4207 0.7510 0.7677 0.0390 -0.0064 0.0627 491 ARG C CA 6850 C C . ARG C 183 ? 0.3961 0.6785 0.7041 0.0276 -0.0084 0.0717 491 ARG C C 6851 O O . ARG C 183 ? 0.3957 0.6360 0.6783 0.0369 -0.0194 0.0705 491 ARG C O 6852 C CB . ARG C 183 ? 0.4605 0.8021 0.8042 0.0561 0.0106 0.0503 491 ARG C CB 6853 C CG . ARG C 183 ? 0.5393 0.9162 0.9116 0.0693 0.0105 0.0327 491 ARG C CG 6854 C CD . ARG C 183 ? 0.6004 0.9975 0.9728 0.0736 0.0306 0.0194 491 ARG C CD 6855 N NE . ARG C 183 ? 0.6453 1.0609 1.0096 0.0491 0.0467 0.0284 491 ARG C NE 6856 C CZ . ARG C 183 ? 0.6724 1.1064 1.0324 0.0470 0.0649 0.0204 491 ARG C CZ 6857 N NH1 . ARG C 183 ? 0.6886 1.1257 1.0553 0.0684 0.0697 0.0033 491 ARG C NH1 6858 N NH2 . ARG C 183 ? 0.6830 1.1280 1.0301 0.0235 0.0764 0.0312 491 ARG C NH2 6859 N N . LEU C 184 ? 0.3598 0.6508 0.6632 0.0074 0.0016 0.0806 492 LEU C N 6860 C CA . LEU C 184 ? 0.3224 0.5704 0.5920 -0.0022 -0.0015 0.0875 492 LEU C CA 6861 C C . LEU C 184 ? 0.3133 0.5321 0.5530 0.0144 0.0080 0.0800 492 LEU C C 6862 O O . LEU C 184 ? 0.3368 0.5723 0.5763 0.0201 0.0245 0.0752 492 LEU C O 6863 C CB . LEU C 184 ? 0.3423 0.6058 0.6127 -0.0267 0.0065 0.0995 492 LEU C CB 6864 C CG . LEU C 184 ? 0.3568 0.5764 0.5969 -0.0378 -0.0015 0.1071 492 LEU C CG 6865 C CD1 . LEU C 184 ? 0.3615 0.5552 0.6035 -0.0443 -0.0263 0.1103 492 LEU C CD1 6866 C CD2 . LEU C 184 ? 0.3871 0.6216 0.6235 -0.0598 0.0084 0.1196 492 LEU C CD2 6867 N N . PRO C 185 ? 0.2705 0.4479 0.4853 0.0220 -0.0029 0.0782 493 PRO C N 6868 C CA . PRO C 185 ? 0.2500 0.4008 0.4382 0.0353 0.0047 0.0725 493 PRO C CA 6869 C C . PRO C 185 ? 0.2736 0.4206 0.4464 0.0282 0.0192 0.0740 493 PRO C C 6870 O O . PRO C 185 ? 0.2667 0.4149 0.4376 0.0120 0.0184 0.0813 493 PRO C O 6871 C CB . PRO C 185 ? 0.2366 0.3523 0.4025 0.0380 -0.0097 0.0725 493 PRO C CB 6872 C CG . PRO C 185 ? 0.2550 0.3810 0.4400 0.0357 -0.0265 0.0739 493 PRO C CG 6873 C CD . PRO C 185 ? 0.2606 0.4185 0.4729 0.0195 -0.0234 0.0800 493 PRO C CD 6874 N N . SER C 186 ? 0.2497 0.3901 0.4113 0.0400 0.0301 0.0673 494 SER C N 6875 C CA . SER C 186 ? 0.2372 0.3742 0.3835 0.0352 0.0431 0.0669 494 SER C CA 6876 C C . SER C 186 ? 0.2321 0.3342 0.3518 0.0312 0.0385 0.0689 494 SER C C 6877 O O . SER C 186 ? 0.2779 0.3743 0.3844 0.0253 0.0454 0.0697 494 SER C O 6878 C CB . SER C 186 ? 0.2327 0.3749 0.3786 0.0499 0.0541 0.0569 494 SER C CB 6879 O OG . SER C 186 ? 0.2441 0.4243 0.4171 0.0556 0.0588 0.0517 494 SER C OG 6880 N N . VAL C 187 ? 0.1950 0.2766 0.3070 0.0354 0.0265 0.0685 495 VAL C N 6881 C CA . VAL C 187 ? 0.2199 0.2758 0.3105 0.0327 0.0212 0.0677 495 VAL C CA 6882 C C . VAL C 187 ? 0.2192 0.2723 0.3140 0.0213 0.0084 0.0722 495 VAL C C 6883 O O . VAL C 187 ? 0.1876 0.2459 0.2948 0.0197 -0.0032 0.0740 495 VAL C O 6884 C CB . VAL C 187 ? 0.2543 0.2927 0.3308 0.0426 0.0158 0.0639 495 VAL C CB 6885 C CG1 . VAL C 187 ? 0.1962 0.2175 0.2549 0.0404 0.0097 0.0605 495 VAL C CG1 6886 C CG2 . VAL C 187 ? 0.2580 0.2910 0.3272 0.0510 0.0257 0.0615 495 VAL C CG2 6887 N N . HIS C 188 ? 0.2029 0.2453 0.2874 0.0135 0.0079 0.0737 496 HIS C N 6888 C CA . HIS C 188 ? 0.2273 0.2596 0.3141 0.0025 -0.0079 0.0782 496 HIS C CA 6889 C C . HIS C 188 ? 0.2244 0.2373 0.3026 0.0107 -0.0229 0.0697 496 HIS C C 6890 O O . HIS C 188 ? 0.2104 0.2151 0.2735 0.0213 -0.0182 0.0612 496 HIS C O 6891 C CB . HIS C 188 ? 0.2131 0.2350 0.2885 -0.0057 -0.0066 0.0816 496 HIS C CB 6892 C CG . HIS C 188 ? 0.2178 0.2276 0.2966 -0.0200 -0.0243 0.0899 496 HIS C CG 6893 N ND1 . HIS C 188 ? 0.2302 0.2146 0.3042 -0.0169 -0.0448 0.0838 496 HIS C ND1 6894 C CD2 . HIS C 188 ? 0.2247 0.2435 0.3104 -0.0383 -0.0260 0.1040 496 HIS C CD2 6895 C CE1 . HIS C 188 ? 0.2826 0.2555 0.3612 -0.0323 -0.0609 0.0940 496 HIS C CE1 6896 N NE2 . HIS C 188 ? 0.2584 0.2521 0.3434 -0.0473 -0.0494 0.1082 496 HIS C NE2 6897 N N . PRO C 189 ? 0.2305 0.2379 0.3180 0.0051 -0.0412 0.0712 497 PRO C N 6898 C CA . PRO C 189 ? 0.2271 0.2183 0.3052 0.0147 -0.0566 0.0601 497 PRO C CA 6899 C C . PRO C 189 ? 0.2542 0.2274 0.3148 0.0212 -0.0600 0.0497 497 PRO C C 6900 O O . PRO C 189 ? 0.2551 0.2253 0.3030 0.0333 -0.0615 0.0377 497 PRO C O 6901 C CB . PRO C 189 ? 0.2532 0.2388 0.3465 0.0046 -0.0781 0.0641 497 PRO C CB 6902 C CG . PRO C 189 ? 0.2760 0.2714 0.3831 -0.0135 -0.0740 0.0793 497 PRO C CG 6903 C CD . PRO C 189 ? 0.2486 0.2668 0.3560 -0.0109 -0.0489 0.0828 497 PRO C CD 6904 N N . HIS C 190 ? 0.2423 0.2064 0.3017 0.0134 -0.0610 0.0541 498 HIS C N 6905 C CA . HIS C 190 ? 0.2433 0.1930 0.2894 0.0213 -0.0650 0.0429 498 HIS C CA 6906 C C . HIS C 190 ? 0.3099 0.2715 0.3449 0.0309 -0.0450 0.0364 498 HIS C C 6907 O O . HIS C 190 ? 0.3565 0.3162 0.3820 0.0412 -0.0467 0.0229 498 HIS C O 6908 C CB . HIS C 190 ? 0.2870 0.2228 0.3328 0.0108 -0.0717 0.0507 498 HIS C CB 6909 C CG . HIS C 190 ? 0.3669 0.2853 0.4032 0.0204 -0.0829 0.0373 498 HIS C CG 6910 N ND1 . HIS C 190 ? 0.3908 0.3123 0.4190 0.0238 -0.0714 0.0343 498 HIS C ND1 6911 C CD2 . HIS C 190 ? 0.4024 0.3020 0.4380 0.0290 -0.1060 0.0239 498 HIS C CD2 6912 C CE1 . HIS C 190 ? 0.4075 0.3152 0.4322 0.0339 -0.0864 0.0201 498 HIS C CE1 6913 N NE2 . HIS C 190 ? 0.4318 0.3259 0.4606 0.0382 -0.1075 0.0127 498 HIS C NE2 6914 N N . HIS C 191 ? 0.2804 0.2558 0.3179 0.0272 -0.0270 0.0452 499 HIS C N 6915 C CA . HIS C 191 ? 0.2563 0.2388 0.2842 0.0336 -0.0101 0.0412 499 HIS C CA 6916 C C . HIS C 191 ? 0.2505 0.2393 0.2728 0.0411 -0.0068 0.0378 499 HIS C C 6917 O O . HIS C 191 ? 0.2575 0.2498 0.2694 0.0450 0.0037 0.0344 499 HIS C O 6918 C CB . HIS C 191 ? 0.2485 0.2396 0.2803 0.0282 0.0051 0.0498 499 HIS C CB 6919 C CG . HIS C 191 ? 0.2792 0.2666 0.3116 0.0193 0.0036 0.0551 499 HIS C CG 6920 N ND1 . HIS C 191 ? 0.2528 0.2518 0.2887 0.0129 0.0150 0.0628 499 HIS C ND1 6921 C CD2 . HIS C 191 ? 0.2828 0.2558 0.3109 0.0161 -0.0091 0.0535 499 HIS C CD2 6922 C CE1 . HIS C 191 ? 0.2883 0.2811 0.3195 0.0042 0.0104 0.0677 499 HIS C CE1 6923 N NE2 . HIS C 191 ? 0.2654 0.2398 0.2921 0.0059 -0.0054 0.0630 499 HIS C NE2 6924 N N . SER C 192 ? 0.2478 0.2379 0.2762 0.0417 -0.0168 0.0398 500 SER C N 6925 C CA . SER C 192 ? 0.2497 0.2447 0.2711 0.0480 -0.0154 0.0394 500 SER C CA 6926 C C . SER C 192 ? 0.2674 0.2627 0.2699 0.0549 -0.0157 0.0290 500 SER C C 6927 O O . SER C 192 ? 0.2719 0.2714 0.2619 0.0578 -0.0100 0.0309 500 SER C O 6928 C CB . SER C 192 ? 0.2492 0.2462 0.2819 0.0475 -0.0289 0.0426 500 SER C CB 6929 O OG . SER C 192 ? 0.2923 0.2813 0.3230 0.0491 -0.0464 0.0339 500 SER C OG 6930 N N . MET C 193 ? 0.2704 0.2626 0.2706 0.0574 -0.0229 0.0178 501 MET C N 6931 C CA . MET C 193 ? 0.3089 0.3093 0.2939 0.0648 -0.0215 0.0046 501 MET C CA 6932 C C . MET C 193 ? 0.2717 0.2822 0.2483 0.0623 -0.0029 0.0067 501 MET C C 6933 O O . MET C 193 ? 0.2763 0.3007 0.2396 0.0655 0.0022 -0.0010 501 MET C O 6934 C CB . MET C 193 ? 0.3129 0.3079 0.3021 0.0703 -0.0353 -0.0103 501 MET C CB 6935 C CG . MET C 193 ? 0.3266 0.3123 0.3260 0.0650 -0.0342 -0.0066 501 MET C CG 6936 S SD . MET C 193 ? 0.5466 0.5184 0.5513 0.0726 -0.0570 -0.0231 501 MET C SD 6937 C CE . MET C 193 ? 0.4269 0.3911 0.4371 0.0652 -0.0509 -0.0152 501 MET C CE 6938 N N . LEU C 194 ? 0.2243 0.2297 0.2086 0.0558 0.0067 0.0166 502 LEU C N 6939 C CA . LEU C 194 ? 0.2366 0.2479 0.2155 0.0522 0.0214 0.0179 502 LEU C CA 6940 C C . LEU C 194 ? 0.2618 0.2722 0.2320 0.0484 0.0305 0.0291 502 LEU C C 6941 O O . LEU C 194 ? 0.2186 0.2323 0.1825 0.0435 0.0409 0.0314 502 LEU C O 6942 C CB . LEU C 194 ? 0.1999 0.2042 0.1891 0.0481 0.0252 0.0204 502 LEU C CB 6943 C CG . LEU C 194 ? 0.2329 0.2322 0.2293 0.0501 0.0140 0.0126 502 LEU C CG 6944 C CD1 . LEU C 194 ? 0.2919 0.2843 0.2936 0.0444 0.0183 0.0185 502 LEU C CD1 6945 C CD2 . LEU C 194 ? 0.2664 0.2761 0.2594 0.0567 0.0107 -0.0031 502 LEU C CD2 6946 N N . TYR C 195 ? 0.2815 0.2860 0.2524 0.0502 0.0245 0.0364 503 TYR C N 6947 C CA . TYR C 195 ? 0.2743 0.2719 0.2389 0.0483 0.0286 0.0478 503 TYR C CA 6948 C C . TYR C 195 ? 0.2925 0.2924 0.2413 0.0507 0.0216 0.0501 503 TYR C C 6949 O O . TYR C 195 ? 0.3076 0.3126 0.2562 0.0555 0.0117 0.0430 503 TYR C O 6950 C CB . TYR C 195 ? 0.2711 0.2618 0.2529 0.0503 0.0263 0.0536 503 TYR C CB 6951 C CG . TYR C 195 ? 0.2933 0.2849 0.2883 0.0479 0.0322 0.0510 503 TYR C CG 6952 C CD1 . TYR C 195 ? 0.2975 0.2877 0.2878 0.0442 0.0411 0.0482 503 TYR C CD1 6953 C CD2 . TYR C 195 ? 0.3035 0.2994 0.3148 0.0479 0.0285 0.0519 503 TYR C CD2 6954 C CE1 . TYR C 195 ? 0.2961 0.2865 0.2949 0.0422 0.0451 0.0458 503 TYR C CE1 6955 C CE2 . TYR C 195 ? 0.2748 0.2730 0.2935 0.0442 0.0340 0.0510 503 TYR C CE2 6956 C CZ . TYR C 195 ? 0.2866 0.2807 0.2977 0.0422 0.0418 0.0477 503 TYR C CZ 6957 O OH . TYR C 195 ? 0.2748 0.2705 0.2900 0.0389 0.0460 0.0468 503 TYR C OH 6958 N N . PRO C 196 ? 0.3181 0.3118 0.2518 0.0469 0.0248 0.0606 504 PRO C N 6959 C CA . PRO C 196 ? 0.3283 0.3247 0.2405 0.0474 0.0184 0.0644 504 PRO C CA 6960 C C . PRO C 196 ? 0.3638 0.3515 0.2814 0.0546 0.0041 0.0684 504 PRO C C 6961 O O . PRO C 196 ? 0.3653 0.3433 0.2685 0.0544 -0.0020 0.0790 504 PRO C O 6962 C CB . PRO C 196 ? 0.3692 0.3576 0.2636 0.0378 0.0252 0.0779 504 PRO C CB 6963 C CG . PRO C 196 ? 0.3190 0.2915 0.2309 0.0370 0.0286 0.0821 504 PRO C CG 6964 C CD . PRO C 196 ? 0.3308 0.3131 0.2635 0.0406 0.0330 0.0693 504 PRO C CD 6965 N N . LEU C 197 ? 0.3554 0.3467 0.2941 0.0597 -0.0025 0.0606 505 LEU C N 6966 C CA . LEU C 197 ? 0.3850 0.3740 0.3341 0.0655 -0.0168 0.0621 505 LEU C CA 6967 C C . LEU C 197 ? 0.4143 0.4084 0.3449 0.0690 -0.0282 0.0564 505 LEU C C 6968 O O . LEU C 197 ? 0.4659 0.4692 0.3848 0.0691 -0.0261 0.0458 505 LEU C O 6969 C CB . LEU C 197 ? 0.3408 0.3348 0.3188 0.0657 -0.0196 0.0571 505 LEU C CB 6970 C CG . LEU C 197 ? 0.3701 0.3638 0.3659 0.0631 -0.0085 0.0607 505 LEU C CG 6971 C CD1 . LEU C 197 ? 0.3677 0.3686 0.3824 0.0591 -0.0089 0.0560 505 LEU C CD1 6972 C CD2 . LEU C 197 ? 0.3865 0.3786 0.3952 0.0679 -0.0116 0.0675 505 LEU C CD2 6973 N N . SER C 198 ? 0.4177 0.4071 0.3463 0.0733 -0.0415 0.0615 506 SER C N 6974 C CA . SER C 198 ? 0.4184 0.4122 0.3284 0.0776 -0.0546 0.0551 506 SER C CA 6975 C C . SER C 198 ? 0.3930 0.3924 0.3206 0.0804 -0.0643 0.0408 506 SER C C 6976 O O . SER C 198 ? 0.3641 0.3627 0.3201 0.0778 -0.0639 0.0408 506 SER C O 6977 C CB . SER C 198 ? 0.4418 0.4275 0.3484 0.0820 -0.0696 0.0641 506 SER C CB 6978 O OG . SER C 198 ? 0.4091 0.3952 0.3507 0.0848 -0.0772 0.0648 506 SER C OG 6979 N N . HIS C 199 ? 0.3921 0.3967 0.3017 0.0852 -0.0738 0.0284 507 HIS C N 6980 C CA A HIS C 199 ? 0.3941 0.3980 0.3192 0.0884 -0.0880 0.0139 507 HIS C CA 6981 C CA B HIS C 199 ? 0.3938 0.3977 0.3187 0.0885 -0.0881 0.0139 507 HIS C CA 6982 C C . HIS C 199 ? 0.3748 0.3730 0.3270 0.0870 -0.1035 0.0194 507 HIS C C 6983 O O . HIS C 199 ? 0.3048 0.2999 0.2816 0.0833 -0.1111 0.0156 507 HIS C O 6984 C CB A HIS C 199 ? 0.4159 0.4263 0.3151 0.0967 -0.0982 -0.0030 507 HIS C CB 6985 C CB B HIS C 199 ? 0.4165 0.4269 0.3154 0.0968 -0.0984 -0.0031 507 HIS C CB 6986 C CG A HIS C 199 ? 0.4175 0.4424 0.2939 0.0980 -0.0823 -0.0109 507 HIS C CG 6987 C CG B HIS C 199 ? 0.4557 0.4677 0.3300 0.1004 -0.1076 0.0010 507 HIS C CG 6988 N ND1 A HIS C 199 ? 0.4098 0.4381 0.2986 0.0969 -0.0725 -0.0183 507 HIS C ND1 6989 N ND1 B HIS C 199 ? 0.4710 0.4765 0.3526 0.1046 -0.1299 -0.0021 507 HIS C ND1 6990 C CD2 A HIS C 199 ? 0.4477 0.4879 0.2903 0.0991 -0.0742 -0.0120 507 HIS C CD2 6991 C CD2 B HIS C 199 ? 0.4848 0.5034 0.3261 0.0993 -0.0990 0.0091 507 HIS C CD2 6992 C CE1 A HIS C 199 ? 0.4286 0.4761 0.2960 0.0982 -0.0590 -0.0253 507 HIS C CE1 6993 C CE1 B HIS C 199 ? 0.5077 0.5152 0.3608 0.1076 -0.1351 0.0030 507 HIS C CE1 6994 N NE2 A HIS C 199 ? 0.4488 0.5052 0.2873 0.0985 -0.0588 -0.0211 507 HIS C NE2 6995 N NE2 B HIS C 199 ? 0.5153 0.5300 0.3423 0.1038 -0.1165 0.0109 507 HIS C NE2 6996 N N . GLY C 200 ? 0.3855 0.3830 0.3337 0.0890 -0.1088 0.0291 508 GLY C N 6997 C CA . GLY C 200 ? 0.3907 0.3892 0.3679 0.0882 -0.1226 0.0340 508 GLY C CA 6998 C C . GLY C 200 ? 0.3372 0.3411 0.3473 0.0814 -0.1111 0.0421 508 GLY C C 6999 O O . GLY C 200 ? 0.3190 0.3291 0.3588 0.0761 -0.1195 0.0419 508 GLY C O 7000 N N . PHE C 201 ? 0.3204 0.3231 0.3245 0.0805 -0.0924 0.0492 509 PHE C N 7001 C CA . PHE C 201 ? 0.3244 0.3341 0.3553 0.0754 -0.0800 0.0547 509 PHE C CA 7002 C C . PHE C 201 ? 0.3034 0.3144 0.3450 0.0674 -0.0764 0.0497 509 PHE C C 7003 O O . PHE C 201 ? 0.2850 0.3056 0.3533 0.0604 -0.0751 0.0533 509 PHE C O 7004 C CB . PHE C 201 ? 0.3464 0.3507 0.3654 0.0768 -0.0630 0.0611 509 PHE C CB 7005 C CG . PHE C 201 ? 0.3722 0.3734 0.3934 0.0836 -0.0672 0.0688 509 PHE C CG 7006 C CD1 . PHE C 201 ? 0.3564 0.3602 0.3840 0.0893 -0.0851 0.0694 509 PHE C CD1 7007 C CD2 . PHE C 201 ? 0.4047 0.3982 0.4226 0.0852 -0.0558 0.0745 509 PHE C CD2 7008 C CE1 . PHE C 201 ? 0.4318 0.4305 0.4622 0.0975 -0.0921 0.0758 509 PHE C CE1 7009 C CE2 . PHE C 201 ? 0.4090 0.3948 0.4295 0.0933 -0.0633 0.0805 509 PHE C CE2 7010 C CZ . PHE C 201 ? 0.4368 0.4253 0.4637 0.1000 -0.0817 0.0813 509 PHE C CZ 7011 N N . ARG C 202 ? 0.2867 0.2897 0.3070 0.0683 -0.0753 0.0414 510 ARG C N 7012 C CA . ARG C 202 ? 0.2852 0.2847 0.3137 0.0625 -0.0752 0.0363 510 ARG C CA 7013 C C . ARG C 202 ? 0.2615 0.2585 0.3091 0.0574 -0.0951 0.0339 510 ARG C C 7014 O O . ARG C 202 ? 0.2525 0.2494 0.3190 0.0473 -0.0958 0.0385 510 ARG C O 7015 C CB . ARG C 202 ? 0.3407 0.3350 0.3452 0.0675 -0.0722 0.0247 510 ARG C CB 7016 C CG . ARG C 202 ? 0.3948 0.3928 0.3848 0.0678 -0.0519 0.0284 510 ARG C CG 7017 C CD . ARG C 202 ? 0.4331 0.4319 0.4117 0.0699 -0.0475 0.0166 510 ARG C CD 7018 N NE . ARG C 202 ? 0.4363 0.4421 0.3991 0.0692 -0.0298 0.0191 510 ARG C NE 7019 C CZ . ARG C 202 ? 0.4279 0.4423 0.3672 0.0721 -0.0262 0.0164 510 ARG C CZ 7020 N NH1 . ARG C 202 ? 0.3842 0.4015 0.3110 0.0782 -0.0389 0.0094 510 ARG C NH1 7021 N NH2 . ARG C 202 ? 0.4560 0.4769 0.3834 0.0677 -0.0104 0.0211 510 ARG C NH2 7022 N N . LYS C 203 ? 0.2988 0.2933 0.3405 0.0629 -0.1123 0.0277 511 LYS C N 7023 C CA . LYS C 203 ? 0.3254 0.3160 0.3867 0.0572 -0.1343 0.0253 511 LYS C CA 7024 C C . LYS C 203 ? 0.2905 0.2969 0.3846 0.0468 -0.1328 0.0387 511 LYS C C 7025 O O . LYS C 203 ? 0.2651 0.2724 0.3819 0.0339 -0.1413 0.0432 511 LYS C O 7026 C CB . LYS C 203 ? 0.3557 0.3414 0.4021 0.0666 -0.1538 0.0143 511 LYS C CB 7027 C CG . LYS C 203 ? 0.3850 0.3629 0.4507 0.0602 -0.1791 0.0097 511 LYS C CG 7028 C CD . LYS C 203 ? 0.4491 0.4170 0.4920 0.0696 -0.1939 -0.0075 511 LYS C CD 7029 C CE . LYS C 203 ? 0.4711 0.4493 0.5038 0.0758 -0.1950 -0.0050 511 LYS C CE 7030 N NZ . LYS C 203 ? 0.5115 0.4803 0.5286 0.0817 -0.2128 -0.0207 511 LYS C NZ 7031 N N . ALA C 204 ? 0.2735 0.2935 0.3703 0.0522 -0.1227 0.0449 512 ALA C N 7032 C CA . ALA C 204 ? 0.2584 0.3005 0.3884 0.0460 -0.1204 0.0541 512 ALA C CA 7033 C C . ALA C 204 ? 0.2345 0.2880 0.3807 0.0345 -0.1038 0.0615 512 ALA C C 7034 O O . ALA C 204 ? 0.2215 0.2944 0.3972 0.0225 -0.1058 0.0680 512 ALA C O 7035 C CB . ALA C 204 ? 0.2376 0.2881 0.3652 0.0579 -0.1151 0.0566 512 ALA C CB 7036 N N . ILE C 205 ? 0.2227 0.2667 0.3492 0.0373 -0.0873 0.0609 513 ILE C N 7037 C CA . ILE C 205 ? 0.2092 0.2611 0.3447 0.0272 -0.0725 0.0670 513 ILE C CA 7038 C C . ILE C 205 ? 0.2442 0.2889 0.3886 0.0119 -0.0851 0.0701 513 ILE C C 7039 O O . ILE C 205 ? 0.2429 0.3042 0.4077 -0.0026 -0.0813 0.0796 513 ILE C O 7040 C CB . ILE C 205 ? 0.2187 0.2574 0.3293 0.0329 -0.0570 0.0640 513 ILE C CB 7041 C CG1 . ILE C 205 ? 0.2331 0.2767 0.3373 0.0442 -0.0445 0.0642 513 ILE C CG1 7042 C CG2 . ILE C 205 ? 0.2072 0.2494 0.3227 0.0218 -0.0463 0.0693 513 ILE C CG2 7043 C CD1 . ILE C 205 ? 0.2544 0.2843 0.3343 0.0485 -0.0316 0.0615 513 ILE C CD1 7044 N N . ALA C 206 ? 0.2413 0.2616 0.3696 0.0152 -0.1012 0.0618 514 ALA C N 7045 C CA . ALA C 206 ? 0.2447 0.2490 0.3792 0.0026 -0.1190 0.0632 514 ALA C CA 7046 C C . ALA C 206 ? 0.2497 0.2654 0.4124 -0.0109 -0.1350 0.0705 514 ALA C C 7047 O O . ALA C 206 ? 0.2952 0.3121 0.4734 -0.0299 -0.1404 0.0816 514 ALA C O 7048 C CB . ALA C 206 ? 0.2903 0.2674 0.4026 0.0137 -0.1348 0.0480 514 ALA C CB 7049 N N . GLU C 207 ? 0.2607 0.2851 0.4295 -0.0026 -0.1434 0.0654 515 GLU C N 7050 C CA . GLU C 207 ? 0.2977 0.3370 0.4965 -0.0144 -0.1596 0.0708 515 GLU C CA 7051 C C . GLU C 207 ? 0.2553 0.3300 0.4842 -0.0305 -0.1445 0.0855 515 GLU C C 7052 O O . GLU C 207 ? 0.2574 0.3437 0.5123 -0.0502 -0.1560 0.0947 515 GLU C O 7053 C CB . GLU C 207 ? 0.3539 0.4002 0.5524 0.0005 -0.1684 0.0625 515 GLU C CB 7054 C CG . GLU C 207 ? 0.4482 0.5065 0.6767 -0.0096 -0.1905 0.0645 515 GLU C CG 7055 C CD . GLU C 207 ? 0.5185 0.6195 0.7834 -0.0172 -0.1792 0.0745 515 GLU C CD 7056 O OE1 . GLU C 207 ? 0.5246 0.6438 0.7887 -0.0110 -0.1550 0.0776 515 GLU C OE1 7057 O OE2 . GLU C 207 ? 0.5464 0.6610 0.8363 -0.0284 -0.1916 0.0764 515 GLU C OE2 7058 N N . ARG C 208 ? 0.2292 0.2837 0.4705 0.1115 -0.0355 0.0757 516 ARG C N 7059 C CA . ARG C 208 ? 0.2809 0.3399 0.5378 0.1178 -0.0253 0.0735 516 ARG C CA 7060 C C . ARG C 208 ? 0.2801 0.3433 0.5399 0.1122 -0.0156 0.0690 516 ARG C C 7061 O O . ARG C 208 ? 0.2696 0.3462 0.5469 0.1138 -0.0094 0.0680 516 ARG C O 7062 C CB . ARG C 208 ? 0.3099 0.3502 0.5581 0.1257 -0.0196 0.0728 516 ARG C CB 7063 C CG . ARG C 208 ? 0.3999 0.4356 0.6474 0.1331 -0.0277 0.0779 516 ARG C CG 7064 C CD . ARG C 208 ? 0.4937 0.5457 0.7643 0.1409 -0.0284 0.0800 516 ARG C CD 7065 N NE . ARG C 208 ? 0.5667 0.6117 0.8361 0.1497 -0.0345 0.0848 516 ARG C NE 7066 C CZ . ARG C 208 ? 0.6385 0.6930 0.9260 0.1590 -0.0349 0.0870 516 ARG C CZ 7067 N NH1 . ARG C 208 ? 0.6571 0.7293 0.9658 0.1604 -0.0289 0.0848 516 ARG C NH1 7068 N NH2 . ARG C 208 ? 0.6519 0.6982 0.9364 0.1671 -0.0410 0.0917 516 ARG C NH2 7069 N N . HIS C 209 ? 0.2755 0.3273 0.5180 0.1058 -0.0140 0.0665 517 HIS C N 7070 C CA . HIS C 209 ? 0.3061 0.3611 0.5490 0.1003 -0.0058 0.0628 517 HIS C CA 7071 C C . HIS C 209 ? 0.3109 0.3840 0.5661 0.0933 -0.0105 0.0640 517 HIS C C 7072 O O . HIS C 209 ? 0.3499 0.4321 0.6153 0.0910 -0.0029 0.0623 517 HIS C O 7073 C CB . HIS C 209 ? 0.2912 0.3294 0.5127 0.0957 -0.0038 0.0601 517 HIS C CB 7074 C CG . HIS C 209 ? 0.3138 0.3340 0.5247 0.1012 0.0040 0.0571 517 HIS C CG 7075 N ND1 . HIS C 209 ? 0.3786 0.3918 0.5835 0.1008 0.0149 0.0521 517 HIS C ND1 7076 C CD2 . HIS C 209 ? 0.3204 0.3275 0.5254 0.1073 0.0025 0.0581 517 HIS C CD2 7077 C CE1 . HIS C 209 ? 0.3771 0.3733 0.5724 0.1060 0.0194 0.0493 517 HIS C CE1 7078 N NE2 . HIS C 209 ? 0.3680 0.3599 0.5639 0.1099 0.0121 0.0531 517 HIS C NE2 7079 N N . GLY C 210 ? 0.2915 0.3691 0.5450 0.0899 -0.0228 0.0668 518 GLY C N 7080 C CA . GLY C 210 ? 0.2921 0.3861 0.5577 0.0835 -0.0287 0.0675 518 GLY C CA 7081 C C . GLY C 210 ? 0.3306 0.4415 0.6205 0.0873 -0.0263 0.0689 518 GLY C C 7082 O O . GLY C 210 ? 0.3496 0.4728 0.6530 0.0825 -0.0231 0.0682 518 GLY C O 7083 N N . ASN C 211 ? 0.3515 0.4627 0.6475 0.0960 -0.0277 0.0711 519 ASN C N 7084 C CA . ASN C 211 ? 0.3599 0.4876 0.6800 0.1008 -0.0254 0.0727 519 ASN C CA 7085 C C . ASN C 211 ? 0.3285 0.4587 0.6577 0.1029 -0.0102 0.0702 519 ASN C C 7086 O O . ASN C 211 ? 0.3202 0.4668 0.6701 0.1029 -0.0066 0.0710 519 ASN C O 7087 C CB . ASN C 211 ? 0.4424 0.5690 0.7660 0.1106 -0.0306 0.0759 519 ASN C CB 7088 C CG . ASN C 211 ? 0.5075 0.6456 0.8371 0.1092 -0.0453 0.0795 519 ASN C CG 7089 O OD1 . ASN C 211 ? 0.5150 0.6470 0.8290 0.1043 -0.0545 0.0800 519 ASN C OD1 7090 N ND2 . ASN C 211 ? 0.5192 0.6745 0.8714 0.1137 -0.0476 0.0817 519 ASN C ND2 7091 N N . LEU C 212 ? 0.3317 0.4454 0.6449 0.1046 -0.0012 0.0671 520 LEU C N 7092 C CA . LEU C 212 ? 0.3673 0.4810 0.6838 0.1060 0.0136 0.0640 520 LEU C CA 7093 C C . LEU C 212 ? 0.3467 0.4720 0.6706 0.0971 0.0166 0.0638 520 LEU C C 7094 O O . LEU C 212 ? 0.3507 0.4873 0.6896 0.0980 0.0256 0.0639 520 LEU C O 7095 C CB . LEU C 212 ? 0.4161 0.5088 0.7105 0.1078 0.0207 0.0601 520 LEU C CB 7096 C CG . LEU C 212 ? 0.4925 0.5751 0.7849 0.1178 0.0300 0.0575 520 LEU C CG 7097 C CD1 . LEU C 212 ? 0.4987 0.5612 0.7689 0.1173 0.0372 0.0526 520 LEU C CD1 7098 C CD2 . LEU C 212 ? 0.5353 0.6322 0.8468 0.1220 0.0404 0.0571 520 LEU C CD2 7099 N N . CYS C 213 ? 0.2918 0.4136 0.6049 0.0887 0.0094 0.0637 521 CYS C N 7100 C CA . CYS C 213 ? 0.2553 0.3863 0.5746 0.0798 0.0110 0.0638 521 CYS C CA 7101 C C . CYS C 213 ? 0.2646 0.4153 0.6078 0.0775 0.0064 0.0665 521 CYS C C 7102 O O . CYS C 213 ? 0.2744 0.4352 0.6304 0.0741 0.0138 0.0670 521 CYS C O 7103 C CB . CYS C 213 ? 0.2059 0.3289 0.5093 0.0719 0.0026 0.0630 521 CYS C CB 7104 S SG . CYS C 213 ? 0.3489 0.4499 0.6253 0.0734 0.0071 0.0599 521 CYS C SG 7105 N N . LEU C 214 ? 0.2597 0.4156 0.6085 0.0794 -0.0058 0.0685 522 LEU C N 7106 C CA . LEU C 214 ? 0.3102 0.4853 0.6820 0.0776 -0.0118 0.0709 522 LEU C CA 7107 C C . LEU C 214 ? 0.3315 0.5185 0.7238 0.0838 -0.0012 0.0721 522 LEU C C 7108 O O . LEU C 214 ? 0.3270 0.5293 0.7385 0.0796 0.0009 0.0733 522 LEU C O 7109 C CB . LEU C 214 ? 0.3525 0.5301 0.7241 0.0801 -0.0268 0.0728 522 LEU C CB 7110 C CG . LEU C 214 ? 0.3655 0.5376 0.7222 0.0725 -0.0395 0.0720 522 LEU C CG 7111 C CD1 . LEU C 214 ? 0.3902 0.5607 0.7408 0.0774 -0.0519 0.0742 522 LEU C CD1 7112 C CD2 . LEU C 214 ? 0.3638 0.5487 0.7334 0.0628 -0.0442 0.0714 522 LEU C CD2 7113 N N . ASP C 215 ? 0.3360 0.5155 0.7242 0.0937 0.0057 0.0715 523 ASP C N 7114 C CA . ASP C 215 ? 0.3714 0.5606 0.7771 0.1008 0.0169 0.0721 523 ASP C CA 7115 C C . ASP C 215 ? 0.3612 0.5531 0.7694 0.0964 0.0308 0.0708 523 ASP C C 7116 O O . ASP C 215 ? 0.3613 0.5679 0.7893 0.0975 0.0380 0.0723 523 ASP C O 7117 C CB . ASP C 215 ? 0.4132 0.5895 0.8099 0.1121 0.0224 0.0706 523 ASP C CB 7118 C CG . ASP C 215 ? 0.4607 0.6365 0.8591 0.1183 0.0102 0.0731 523 ASP C CG 7119 O OD1 . ASP C 215 ? 0.4838 0.6444 0.8695 0.1260 0.0119 0.0720 523 ASP C OD1 7120 O OD2 . ASP C 215 ? 0.4633 0.6533 0.8751 0.1156 -0.0011 0.0761 523 ASP C OD2 7121 N N . LYS C 216 ? 0.3419 0.5196 0.7295 0.0916 0.0348 0.0683 524 LYS C N 7122 C CA . LYS C 216 ? 0.3815 0.5594 0.7673 0.0880 0.0483 0.0674 524 LYS C CA 7123 C C . LYS C 216 ? 0.3677 0.5589 0.7673 0.0780 0.0461 0.0699 524 LYS C C 7124 O O . LYS C 216 ? 0.4020 0.6000 0.8098 0.0762 0.0575 0.0709 524 LYS C O 7125 C CB . LYS C 216 ? 0.4162 0.5747 0.7753 0.0868 0.0531 0.0640 524 LYS C CB 7126 C CG . LYS C 216 ? 0.4640 0.6081 0.8095 0.0966 0.0586 0.0607 524 LYS C CG 7127 C CD . LYS C 216 ? 0.4889 0.6142 0.8084 0.0947 0.0621 0.0571 524 LYS C CD 7128 C CE . LYS C 216 ? 0.5311 0.6408 0.8372 0.1039 0.0668 0.0533 524 LYS C CE 7129 N NZ . LYS C 216 ? 0.5493 0.6404 0.8303 0.1019 0.0691 0.0494 524 LYS C NZ 7130 N N . ILE C 217 ? 0.3090 0.5029 0.7102 0.0713 0.0318 0.0708 525 ILE C N 7131 C CA . ILE C 217 ? 0.3066 0.5117 0.7209 0.0614 0.0285 0.0725 525 ILE C CA 7132 C C . ILE C 217 ? 0.3318 0.5569 0.7735 0.0616 0.0234 0.0752 525 ILE C C 7133 O O . ILE C 217 ? 0.3171 0.5535 0.7743 0.0546 0.0247 0.0768 525 ILE C O 7134 C CB . ILE C 217 ? 0.2898 0.4866 0.6904 0.0528 0.0167 0.0712 525 ILE C CB 7135 C CG1 . ILE C 217 ? 0.2922 0.4875 0.6887 0.0552 0.0015 0.0708 525 ILE C CG1 7136 C CG2 . ILE C 217 ? 0.2979 0.4777 0.6748 0.0517 0.0233 0.0691 525 ILE C CG2 7137 C CD1 . ILE C 217 ? 0.2916 0.5001 0.7034 0.0491 -0.0114 0.0717 525 ILE C CD1 7138 N N . ASN C 218 ? 0.3588 0.5881 0.8068 0.0696 0.0175 0.0757 526 ASN C N 7139 C CA . ASN C 218 ? 0.4109 0.6602 0.8856 0.0711 0.0122 0.0783 526 ASN C CA 7140 C C . ASN C 218 ? 0.4256 0.6882 0.9204 0.0729 0.0265 0.0801 526 ASN C C 7141 O O . ASN C 218 ? 0.4412 0.7222 0.9604 0.0697 0.0240 0.0825 526 ASN C O 7142 C CB . ASN C 218 ? 0.4592 0.7093 0.9354 0.0808 0.0041 0.0790 526 ASN C CB 7143 C CG . ASN C 218 ? 0.4866 0.7298 0.9490 0.0778 -0.0126 0.0784 526 ASN C CG 7144 O OD1 . ASN C 218 ? 0.4830 0.7289 0.9451 0.0683 -0.0213 0.0778 526 ASN C OD1 7145 N ND2 . ASN C 218 ? 0.5005 0.7336 0.9505 0.0861 -0.0168 0.0785 526 ASN C ND2 7146 N N . VAL C 219 ? 0.4161 0.6693 0.9001 0.0780 0.0416 0.0789 527 VAL C N 7147 C CA . VAL C 219 ? 0.4339 0.6978 0.9331 0.0806 0.0569 0.0804 527 VAL C CA 7148 C C . VAL C 219 ? 0.4300 0.6995 0.9352 0.0697 0.0620 0.0821 527 VAL C C 7149 O O . VAL C 219 ? 0.4654 0.7472 0.9873 0.0698 0.0729 0.0844 527 VAL C O 7150 C CB . VAL C 219 ? 0.4609 0.7116 0.9435 0.0893 0.0717 0.0778 527 VAL C CB 7151 C CG1 . VAL C 219 ? 0.4878 0.7280 0.9600 0.0990 0.0659 0.0756 527 VAL C CG1 7152 C CG2 . VAL C 219 ? 0.4206 0.6552 0.8790 0.0836 0.0782 0.0759 527 VAL C CG2 7153 N N . LEU C 220 ? 0.3906 0.6506 0.8821 0.0606 0.0542 0.0812 528 LEU C N 7154 C CA . LEU C 220 ? 0.3777 0.6410 0.8741 0.0499 0.0572 0.0830 528 LEU C CA 7155 C C . LEU C 220 ? 0.3646 0.6460 0.8870 0.0435 0.0469 0.0850 528 LEU C C 7156 O O . LEU C 220 ? 0.3594 0.6479 0.8935 0.0352 0.0503 0.0871 528 LEU C O 7157 C CB . LEU C 220 ? 0.3763 0.6222 0.8486 0.0431 0.0523 0.0809 528 LEU C CB 7158 C CG . LEU C 220 ? 0.3980 0.6258 0.8437 0.0475 0.0620 0.0787 528 LEU C CG 7159 C CD1 . LEU C 220 ? 0.3881 0.6008 0.8127 0.0415 0.0535 0.0766 528 LEU C CD1 7160 C CD2 . LEU C 220 ? 0.4289 0.6572 0.8738 0.0472 0.0794 0.0806 528 LEU C CD2 7161 N N . HIS C 221 ? 0.3828 0.6711 0.9135 0.0474 0.0341 0.0845 529 HIS C N 7162 C CA . HIS C 221 ? 0.4077 0.7138 0.9624 0.0423 0.0222 0.0859 529 HIS C CA 7163 C C . HIS C 221 ? 0.3819 0.6858 0.9354 0.0291 0.0145 0.0851 529 HIS C C 7164 O O . HIS C 221 ? 0.3950 0.7139 0.9709 0.0223 0.0116 0.0867 529 HIS C O 7165 C CB . HIS C 221 ? 0.4598 0.7869 1.0440 0.0453 0.0311 0.0892 529 HIS C CB 7166 C CG . HIS C 221 ? 0.5127 0.8435 1.1009 0.0588 0.0371 0.0896 529 HIS C CG 7167 N ND1 . HIS C 221 ? 0.5424 0.8673 1.1235 0.0658 0.0543 0.0896 529 HIS C ND1 7168 C CD2 . HIS C 221 ? 0.5345 0.8731 1.1321 0.0668 0.0280 0.0899 529 HIS C CD2 7169 C CE1 . HIS C 221 ? 0.5647 0.8934 1.1513 0.0775 0.0558 0.0894 529 HIS C CE1 7170 N NE2 . HIS C 221 ? 0.5636 0.9006 1.1606 0.0785 0.0400 0.0899 529 HIS C NE2 7171 N N . LYS C 222 ? 0.3418 0.6269 0.8697 0.0257 0.0112 0.0825 530 LYS C N 7172 C CA . LYS C 222 ? 0.3347 0.6148 0.8583 0.0140 0.0038 0.0811 530 LYS C CA 7173 C C . LYS C 222 ? 0.3469 0.6316 0.8739 0.0108 -0.0153 0.0788 530 LYS C C 7174 O O . LYS C 222 ? 0.3648 0.6463 0.8823 0.0175 -0.0233 0.0775 530 LYS C O 7175 C CB . LYS C 222 ? 0.3330 0.5917 0.8281 0.0122 0.0076 0.0791 530 LYS C CB 7176 C CG . LYS C 222 ? 0.3404 0.5936 0.8293 0.0148 0.0259 0.0811 530 LYS C CG 7177 C CD . LYS C 222 ? 0.3009 0.5341 0.7619 0.0133 0.0283 0.0792 530 LYS C CD 7178 C CE . LYS C 222 ? 0.3041 0.5315 0.7616 0.0022 0.0218 0.0783 530 LYS C CE 7179 N NZ . LYS C 222 ? 0.3072 0.5398 0.7769 -0.0039 0.0321 0.0817 530 LYS C NZ 7180 N N . PRO C 223 ? 0.3568 0.6488 0.8969 0.0006 -0.0225 0.0782 531 PRO C N 7181 C CA . PRO C 223 ? 0.3428 0.6389 0.8847 -0.0033 -0.0410 0.0753 531 PRO C CA 7182 C C . PRO C 223 ? 0.3073 0.5836 0.8200 -0.0055 -0.0490 0.0713 531 PRO C C 7183 O O . PRO C 223 ? 0.2708 0.5321 0.7662 -0.0063 -0.0403 0.0709 531 PRO C O 7184 C CB . PRO C 223 ? 0.3661 0.6728 0.9283 -0.0146 -0.0435 0.0753 531 PRO C CB 7185 C CG . PRO C 223 ? 0.3728 0.6705 0.9305 -0.0186 -0.0283 0.0771 531 PRO C CG 7186 C CD . PRO C 223 ? 0.3619 0.6571 0.9137 -0.0081 -0.0138 0.0800 531 PRO C CD 7187 N N . PRO C 224 ? 0.3115 0.5883 0.8182 -0.0059 -0.0651 0.0685 532 PRO C N 7188 C CA . PRO C 224 ? 0.3080 0.5667 0.7876 -0.0088 -0.0728 0.0644 532 PRO C CA 7189 C C . PRO C 224 ? 0.2723 0.5237 0.7498 -0.0201 -0.0724 0.0618 532 PRO C C 7190 O O . PRO C 224 ? 0.2762 0.5387 0.7740 -0.0271 -0.0736 0.0621 532 PRO C O 7191 C CB . PRO C 224 ? 0.3301 0.5947 0.8081 -0.0078 -0.0902 0.0623 532 PRO C CB 7192 C CG . PRO C 224 ? 0.3583 0.6449 0.8662 -0.0086 -0.0933 0.0644 532 PRO C CG 7193 C CD . PRO C 224 ? 0.3487 0.6425 0.8721 -0.0033 -0.0769 0.0690 532 PRO C CD 7194 N N . TYR C 225 ? 0.2330 0.4660 0.6867 -0.0216 -0.0705 0.0594 533 TYR C N 7195 C CA . TYR C 225 ? 0.2495 0.4733 0.6992 -0.0313 -0.0696 0.0570 533 TYR C CA 7196 C C . TYR C 225 ? 0.2722 0.4949 0.7190 -0.0387 -0.0855 0.0517 533 TYR C C 7197 O O . TYR C 225 ? 0.2789 0.5005 0.7144 -0.0355 -0.0971 0.0491 533 TYR C O 7198 C CB . TYR C 225 ? 0.2338 0.4387 0.6591 -0.0297 -0.0625 0.0563 533 TYR C CB 7199 C CG . TYR C 225 ? 0.2433 0.4467 0.6694 -0.0249 -0.0456 0.0608 533 TYR C CG 7200 C CD1 . TYR C 225 ? 0.2466 0.4511 0.6829 -0.0299 -0.0347 0.0634 533 TYR C CD1 7201 C CD2 . TYR C 225 ? 0.2310 0.4308 0.6459 -0.0153 -0.0404 0.0622 533 TYR C CD2 7202 C CE1 . TYR C 225 ? 0.2473 0.4500 0.6817 -0.0253 -0.0191 0.0674 533 TYR C CE1 7203 C CE2 . TYR C 225 ? 0.2282 0.4259 0.6419 -0.0109 -0.0250 0.0655 533 TYR C CE2 7204 C CZ . TYR C 225 ? 0.2540 0.4533 0.6767 -0.0158 -0.0144 0.0680 533 TYR C CZ 7205 O OH . TYR C 225 ? 0.2700 0.4670 0.6892 -0.0111 0.0010 0.0712 533 TYR C OH 7206 N N . GLU C 226 ? 0.2619 0.4842 0.7180 -0.0485 -0.0859 0.0500 534 GLU C N 7207 C CA . GLU C 226 ? 0.2958 0.5127 0.7453 -0.0562 -0.0997 0.0438 534 GLU C CA 7208 C C . GLU C 226 ? 0.2882 0.4838 0.7103 -0.0570 -0.0993 0.0403 534 GLU C C 7209 O O . GLU C 226 ? 0.2918 0.4779 0.7099 -0.0587 -0.0883 0.0420 534 GLU C O 7210 C CB . GLU C 226 ? 0.3360 0.5596 0.8064 -0.0667 -0.1001 0.0432 534 GLU C CB 7211 C CG . GLU C 226 ? 0.4010 0.6474 0.9000 -0.0673 -0.1033 0.0458 534 GLU C CG 7212 C CD . GLU C 226 ? 0.4748 0.7275 0.9948 -0.0786 -0.1037 0.0451 534 GLU C CD 7213 O OE1 . GLU C 226 ? 0.4934 0.7320 1.0058 -0.0853 -0.0995 0.0434 534 GLU C OE1 7214 O OE2 . GLU C 226 ? 0.5127 0.7846 1.0573 -0.0808 -0.1083 0.0464 534 GLU C OE2 7215 N N . HIS C 227 ? 0.2843 0.4729 0.6873 -0.0553 -0.1109 0.0356 535 HIS C N 7216 C CA . HIS C 227 ? 0.2447 0.4142 0.6212 -0.0549 -0.1109 0.0321 535 HIS C CA 7217 C C . HIS C 227 ? 0.2651 0.4251 0.6348 -0.0640 -0.1196 0.0252 535 HIS C C 7218 O O . HIS C 227 ? 0.2805 0.4486 0.6608 -0.0694 -0.1296 0.0221 535 HIS C O 7219 C CB . HIS C 227 ? 0.2388 0.4052 0.5960 -0.0468 -0.1168 0.0316 535 HIS C CB 7220 C CG . HIS C 227 ? 0.2159 0.3878 0.5762 -0.0375 -0.1078 0.0376 535 HIS C CG 7221 N ND1 . HIS C 227 ? 0.2614 0.4407 0.6202 -0.0302 -0.1135 0.0394 535 HIS C ND1 7222 C CD2 . HIS C 227 ? 0.2127 0.3828 0.5763 -0.0341 -0.0935 0.0420 535 HIS C CD2 7223 C CE1 . HIS C 227 ? 0.2358 0.4171 0.5974 -0.0228 -0.1029 0.0443 535 HIS C CE1 7224 N NE2 . HIS C 227 ? 0.2058 0.3817 0.5699 -0.0250 -0.0907 0.0458 535 HIS C NE2 7225 N N . PRO C 228 ? 0.2594 0.4020 0.6114 -0.0658 -0.1158 0.0225 536 PRO C N 7226 C CA . PRO C 228 ? 0.2944 0.4253 0.6368 -0.0734 -0.1238 0.0151 536 PRO C CA 7227 C C . PRO C 228 ? 0.3252 0.4554 0.6525 -0.0724 -0.1387 0.0091 536 PRO C C 7228 O O . PRO C 228 ? 0.3254 0.4562 0.6394 -0.0647 -0.1405 0.0106 536 PRO C O 7229 C CB . PRO C 228 ? 0.2822 0.3953 0.6066 -0.0723 -0.1158 0.0146 536 PRO C CB 7230 C CG . PRO C 228 ? 0.2767 0.3919 0.5949 -0.0632 -0.1080 0.0202 536 PRO C CG 7231 C CD . PRO C 228 ? 0.2617 0.3947 0.6022 -0.0606 -0.1039 0.0261 536 PRO C CD 7232 N N . LYS C 229 ? 0.3415 0.4703 0.6701 -0.0800 -0.1488 0.0026 537 LYS C N 7233 C CA . LYS C 229 ? 0.3880 0.5161 0.7008 -0.0795 -0.1631 -0.0035 537 LYS C CA 7234 C C . LYS C 229 ? 0.3731 0.4815 0.6610 -0.0824 -0.1669 -0.0116 537 LYS C C 7235 O O . LYS C 229 ? 0.3712 0.4760 0.6409 -0.0815 -0.1775 -0.0173 537 LYS C O 7236 C CB . LYS C 229 ? 0.4766 0.6191 0.8075 -0.0855 -0.1737 -0.0058 537 LYS C CB 7237 C CG . LYS C 229 ? 0.5335 0.6965 0.8809 -0.0799 -0.1758 0.0004 537 LYS C CG 7238 C CD . LYS C 229 ? 0.5892 0.7660 0.9507 -0.0857 -0.1891 -0.0031 537 LYS C CD 7239 C CE . LYS C 229 ? 0.6135 0.8103 0.9886 -0.0790 -0.1929 0.0027 537 LYS C CE 7240 N NZ . LYS C 229 ? 0.6405 0.8520 1.0295 -0.0846 -0.2069 -0.0007 537 LYS C NZ 7241 N N . ASP C 230 ? 0.3705 0.4661 0.6572 -0.0854 -0.1578 -0.0121 538 ASP C N 7242 C CA . ASP C 230 ? 0.3672 0.4431 0.6319 -0.0879 -0.1598 -0.0198 538 ASP C CA 7243 C C . ASP C 230 ? 0.3396 0.4035 0.6019 -0.0868 -0.1467 -0.0167 538 ASP C C 7244 O O . ASP C 230 ? 0.3197 0.3906 0.5949 -0.0838 -0.1365 -0.0086 538 ASP C O 7245 C CB . ASP C 230 ? 0.3879 0.4596 0.6569 -0.0976 -0.1681 -0.0277 538 ASP C CB 7246 C CG . ASP C 230 ? 0.4327 0.5115 0.7297 -0.1048 -0.1627 -0.0240 538 ASP C CG 7247 O OD1 . ASP C 230 ? 0.4828 0.5761 0.7977 -0.1093 -0.1696 -0.0241 538 ASP C OD1 7248 O OD2 . ASP C 230 ? 0.4264 0.4965 0.7275 -0.1060 -0.1515 -0.0208 538 ASP C OD2 7249 N N . LEU C 231 ? 0.3594 0.4050 0.6046 -0.0890 -0.1469 -0.0232 539 LEU C N 7250 C CA . LEU C 231 ? 0.3754 0.4085 0.6162 -0.0876 -0.1354 -0.0206 539 LEU C CA 7251 C C . LEU C 231 ? 0.4032 0.4265 0.6537 -0.0956 -0.1317 -0.0226 539 LEU C C 7252 O O . LEU C 231 ? 0.4030 0.4125 0.6470 -0.0951 -0.1236 -0.0220 539 LEU C O 7253 C CB . LEU C 231 ? 0.3476 0.3661 0.5607 -0.0825 -0.1367 -0.0256 539 LEU C CB 7254 C CG . LEU C 231 ? 0.3604 0.3856 0.5595 -0.0749 -0.1410 -0.0243 539 LEU C CG 7255 C CD1 . LEU C 231 ? 0.3634 0.3732 0.5354 -0.0707 -0.1410 -0.0294 539 LEU C CD1 7256 C CD2 . LEU C 231 ? 0.3305 0.3688 0.5423 -0.0697 -0.1332 -0.0143 539 LEU C CD2 7257 N N . LYS C 232 ? 0.4210 0.4513 0.6873 -0.1029 -0.1376 -0.0248 540 LYS C N 7258 C CA . LYS C 232 ? 0.4491 0.4695 0.7244 -0.1115 -0.1353 -0.0273 540 LYS C CA 7259 C C . LYS C 232 ? 0.4509 0.4707 0.7405 -0.1121 -0.1212 -0.0184 540 LYS C C 7260 O O . LYS C 232 ? 0.4672 0.4711 0.7527 -0.1150 -0.1156 -0.0194 540 LYS C O 7261 C CB . LYS C 232 ? 0.4944 0.5247 0.7857 -0.1198 -0.1450 -0.0311 540 LYS C CB 7262 C CG . LYS C 232 ? 0.5499 0.5785 0.8254 -0.1206 -0.1595 -0.0409 540 LYS C CG 7263 C CD . LYS C 232 ? 0.6172 0.6545 0.9095 -0.1300 -0.1690 -0.0450 540 LYS C CD 7264 C CE . LYS C 232 ? 0.6832 0.7187 0.9582 -0.1310 -0.1837 -0.0551 540 LYS C CE 7265 N NZ . LYS C 232 ? 0.7030 0.7520 0.9699 -0.1226 -0.1889 -0.0523 540 LYS C NZ 7266 N N . LEU C 233 ? 0.4331 0.4697 0.7385 -0.1090 -0.1152 -0.0096 541 LEU C N 7267 C CA . LEU C 233 ? 0.4419 0.4792 0.7595 -0.1091 -0.1013 -0.0007 541 LEU C CA 7268 C C . LEU C 233 ? 0.4089 0.4336 0.7094 -0.1026 -0.0923 0.0021 541 LEU C C 7269 O O . LEU C 233 ? 0.4264 0.4452 0.7306 -0.1033 -0.0813 0.0079 541 LEU C O 7270 C CB . LEU C 233 ? 0.4635 0.5221 0.8012 -0.1068 -0.0967 0.0073 541 LEU C CB 7271 C CG . LEU C 233 ? 0.5145 0.5875 0.8747 -0.1138 -0.1030 0.0066 541 LEU C CG 7272 C CD1 . LEU C 233 ? 0.5202 0.6129 0.9006 -0.1107 -0.0955 0.0154 541 LEU C CD1 7273 C CD2 . LEU C 233 ? 0.5391 0.6027 0.9079 -0.1239 -0.1023 0.0044 541 LEU C CD2 7274 N N . SER C 234 ? 0.3605 0.3811 0.6419 -0.0965 -0.0970 -0.0017 542 SER C N 7275 C CA . SER C 234 ? 0.3583 0.3683 0.6237 -0.0903 -0.0895 0.0006 542 SER C CA 7276 C C . SER C 234 ? 0.3829 0.3726 0.6293 -0.0912 -0.0932 -0.0075 542 SER C C 7277 O O . SER C 234 ? 0.3791 0.3600 0.6089 -0.0856 -0.0906 -0.0081 542 SER C O 7278 C CB . SER C 234 ? 0.3598 0.3791 0.6173 -0.0823 -0.0905 0.0027 542 SER C CB 7279 O OG . SER C 234 ? 0.3527 0.3754 0.6021 -0.0817 -0.1029 -0.0039 542 SER C OG 7280 N N . ASP C 235 ? 0.4236 0.4059 0.6729 -0.0984 -0.0990 -0.0138 543 ASP C N 7281 C CA . ASP C 235 ? 0.4815 0.4432 0.7135 -0.0996 -0.1022 -0.0224 543 ASP C CA 7282 C C . ASP C 235 ? 0.4392 0.3961 0.6484 -0.0937 -0.1090 -0.0292 543 ASP C C 7283 O O . ASP C 235 ? 0.4401 0.3812 0.6324 -0.0901 -0.1063 -0.0327 543 ASP C O 7284 C CB . ASP C 235 ? 0.5672 0.5139 0.7963 -0.0987 -0.0911 -0.0181 543 ASP C CB 7285 C CG . ASP C 235 ? 0.6562 0.6034 0.9043 -0.1057 -0.0851 -0.0127 543 ASP C CG 7286 O OD1 . ASP C 235 ? 0.6558 0.6096 0.9172 -0.1129 -0.0913 -0.0155 543 ASP C OD1 7287 O OD2 . ASP C 235 ? 0.7013 0.6422 0.9505 -0.1040 -0.0743 -0.0055 543 ASP C OD2 7288 N N . GLY C 236 ? 0.3854 0.3561 0.5940 -0.0922 -0.1173 -0.0307 544 GLY C N 7289 C CA . GLY C 236 ? 0.3691 0.3362 0.5554 -0.0870 -0.1245 -0.0370 544 GLY C CA 7290 C C . GLY C 236 ? 0.3308 0.3017 0.5085 -0.0788 -0.1192 -0.0315 544 GLY C C 7291 O O . GLY C 236 ? 0.3454 0.3138 0.5041 -0.0741 -0.1240 -0.0356 544 GLY C O 7292 N N . ARG C 237 ? 0.2959 0.2725 0.4867 -0.0773 -0.1091 -0.0222 545 ARG C N 7293 C CA . ARG C 237 ? 0.2857 0.2652 0.4695 -0.0702 -0.1033 -0.0169 545 ARG C CA 7294 C C . ARG C 237 ? 0.2864 0.2850 0.4795 -0.0672 -0.1047 -0.0111 545 ARG C C 7295 O O . ARG C 237 ? 0.2887 0.2993 0.5007 -0.0702 -0.1042 -0.0072 545 ARG C O 7296 C CB . ARG C 237 ? 0.3083 0.2822 0.4983 -0.0696 -0.0908 -0.0100 545 ARG C CB 7297 C CG . ARG C 237 ? 0.3287 0.2832 0.5112 -0.0719 -0.0882 -0.0144 545 ARG C CG 7298 C CD . ARG C 237 ? 0.3578 0.3086 0.5487 -0.0717 -0.0760 -0.0060 545 ARG C CD 7299 N NE . ARG C 237 ? 0.3623 0.3126 0.5447 -0.0651 -0.0692 -0.0009 545 ARG C NE 7300 C CZ . ARG C 237 ? 0.3536 0.3034 0.5403 -0.0633 -0.0584 0.0077 545 ARG C CZ 7301 N NH1 . ARG C 237 ? 0.3510 0.3008 0.5502 -0.0674 -0.0529 0.0123 545 ARG C NH1 7302 N NH2 . ARG C 237 ? 0.3331 0.2823 0.5106 -0.0573 -0.0532 0.0117 545 ARG C NH2 7303 N N . LEU C 238 ? 0.2611 0.2620 0.4409 -0.0611 -0.1061 -0.0105 546 LEU C N 7304 C CA . LEU C 238 ? 0.2763 0.2933 0.4633 -0.0568 -0.1061 -0.0044 546 LEU C CA 7305 C C . LEU C 238 ? 0.2534 0.2750 0.4506 -0.0542 -0.0940 0.0041 546 LEU C C 7306 O O . LEU C 238 ? 0.2399 0.2532 0.4273 -0.0518 -0.0883 0.0051 546 LEU C O 7307 C CB . LEU C 238 ? 0.2974 0.3141 0.4645 -0.0512 -0.1124 -0.0068 546 LEU C CB 7308 C CG . LEU C 238 ? 0.3340 0.3652 0.5049 -0.0466 -0.1153 -0.0020 546 LEU C CG 7309 C CD1 . LEU C 238 ? 0.3263 0.3663 0.5081 -0.0501 -0.1234 -0.0039 546 LEU C CD1 7310 C CD2 . LEU C 238 ? 0.3332 0.3609 0.4814 -0.0408 -0.1195 -0.0034 546 LEU C CD2 7311 N N . ARG C 239 ? 0.2331 0.2675 0.4494 -0.0548 -0.0899 0.0099 547 ARG C N 7312 C CA . ARG C 239 ? 0.2011 0.2401 0.4261 -0.0521 -0.0777 0.0177 547 ARG C CA 7313 C C . ARG C 239 ? 0.1765 0.2237 0.3971 -0.0449 -0.0764 0.0213 547 ARG C C 7314 O O . ARG C 239 ? 0.1879 0.2462 0.4153 -0.0425 -0.0802 0.0226 547 ARG C O 7315 C CB . ARG C 239 ? 0.2005 0.2486 0.4471 -0.0556 -0.0722 0.0222 547 ARG C CB 7316 C CG . ARG C 239 ? 0.2085 0.2469 0.4595 -0.0625 -0.0705 0.0203 547 ARG C CG 7317 C CD . ARG C 239 ? 0.2536 0.3016 0.5262 -0.0665 -0.0653 0.0249 547 ARG C CD 7318 N NE . ARG C 239 ? 0.2869 0.3242 0.5621 -0.0721 -0.0605 0.0253 547 ARG C NE 7319 C CZ . ARG C 239 ? 0.3022 0.3433 0.5938 -0.0784 -0.0596 0.0265 547 ARG C CZ 7320 N NH1 . ARG C 239 ? 0.2905 0.3470 0.5986 -0.0799 -0.0634 0.0272 547 ARG C NH1 7321 N NH2 . ARG C 239 ? 0.3130 0.3425 0.6049 -0.0831 -0.0549 0.0271 547 ARG C NH2 7322 N N . VAL C 240 ? 0.1341 0.1750 0.3423 -0.0412 -0.0707 0.0229 548 VAL C N 7323 C CA . VAL C 240 ? 0.1588 0.2038 0.3568 -0.0334 -0.0681 0.0256 548 VAL C CA 7324 C C . VAL C 240 ? 0.1733 0.2209 0.3754 -0.0301 -0.0550 0.0318 548 VAL C C 7325 O O . VAL C 240 ? 0.2032 0.2425 0.3992 -0.0309 -0.0472 0.0330 548 VAL C O 7326 C CB . VAL C 240 ? 0.1990 0.2322 0.3696 -0.0295 -0.0701 0.0216 548 VAL C CB 7327 C CG1 . VAL C 240 ? 0.1805 0.2167 0.3413 -0.0223 -0.0666 0.0248 548 VAL C CG1 7328 C CG2 . VAL C 240 ? 0.2199 0.2502 0.3838 -0.0322 -0.0826 0.0151 548 VAL C CG2 7329 N N . GLY C 241 ? 0.1525 0.2113 0.3644 -0.0260 -0.0527 0.0357 549 GLY C N 7330 C CA . GLY C 241 ? 0.1488 0.2101 0.3632 -0.0223 -0.0403 0.0407 549 GLY C CA 7331 C C . GLY C 241 ? 0.1566 0.2148 0.3545 -0.0149 -0.0376 0.0411 549 GLY C C 7332 O O . GLY C 241 ? 0.2038 0.2673 0.4035 -0.0113 -0.0431 0.0411 549 GLY C O 7333 N N . TYR C 242 ? 0.1386 0.1879 0.3208 -0.0127 -0.0297 0.0417 550 TYR C N 7334 C CA . TYR C 242 ? 0.1615 0.2069 0.3284 -0.0067 -0.0265 0.0418 550 TYR C CA 7335 C C . TYR C 242 ? 0.1838 0.2339 0.3574 -0.0032 -0.0162 0.0455 550 TYR C C 7336 O O . TYR C 242 ? 0.1530 0.2015 0.3269 -0.0045 -0.0081 0.0476 550 TYR C O 7337 C CB . TYR C 242 ? 0.1623 0.1959 0.3080 -0.0066 -0.0250 0.0396 550 TYR C CB 7338 C CG . TYR C 242 ? 0.1658 0.1940 0.3016 -0.0083 -0.0339 0.0355 550 TYR C CG 7339 C CD1 . TYR C 242 ? 0.1475 0.1752 0.2744 -0.0055 -0.0395 0.0340 550 TYR C CD1 7340 C CD2 . TYR C 242 ? 0.1850 0.2075 0.3192 -0.0125 -0.0360 0.0331 550 TYR C CD2 7341 C CE1 . TYR C 242 ? 0.1575 0.1802 0.2734 -0.0068 -0.0467 0.0303 550 TYR C CE1 7342 C CE2 . TYR C 242 ? 0.1878 0.2047 0.3115 -0.0135 -0.0434 0.0285 550 TYR C CE2 7343 C CZ . TYR C 242 ? 0.1756 0.1931 0.2897 -0.0107 -0.0484 0.0271 550 TYR C CZ 7344 O OH . TYR C 242 ? 0.2110 0.2228 0.3128 -0.0114 -0.0548 0.0226 550 TYR C OH 7345 N N . VAL C 243 ? 0.1580 0.2133 0.3364 0.0017 -0.0163 0.0464 551 VAL C N 7346 C CA . VAL C 243 ? 0.1412 0.2011 0.3268 0.0058 -0.0063 0.0491 551 VAL C CA 7347 C C . VAL C 243 ? 0.1455 0.1969 0.3132 0.0111 -0.0026 0.0477 551 VAL C C 7348 O O . VAL C 243 ? 0.1445 0.1934 0.3072 0.0141 -0.0080 0.0466 551 VAL C O 7349 C CB . VAL C 243 ? 0.1561 0.2293 0.3647 0.0081 -0.0081 0.0514 551 VAL C CB 7350 C CG1 . VAL C 243 ? 0.1393 0.2174 0.3558 0.0130 0.0038 0.0539 551 VAL C CG1 7351 C CG2 . VAL C 243 ? 0.1346 0.2170 0.3624 0.0018 -0.0134 0.0523 551 VAL C CG2 7352 N N . SER C 244 ? 0.1585 0.2047 0.3160 0.0119 0.0064 0.0479 552 SER C N 7353 C CA . SER C 244 ? 0.1819 0.2190 0.3214 0.0156 0.0092 0.0456 552 SER C CA 7354 C C . SER C 244 ? 0.1819 0.2170 0.3158 0.0181 0.0203 0.0460 552 SER C C 7355 O O . SER C 244 ? 0.1625 0.1991 0.2972 0.0156 0.0256 0.0482 552 SER C O 7356 C CB . SER C 244 ? 0.2000 0.2282 0.3218 0.0127 0.0040 0.0433 552 SER C CB 7357 O OG . SER C 244 ? 0.1960 0.2161 0.3021 0.0152 0.0060 0.0411 552 SER C OG 7358 N N . SER C 245 ? 0.1693 0.1998 0.2963 0.0230 0.0238 0.0440 553 SER C N 7359 C CA . SER C 245 ? 0.1930 0.2190 0.3090 0.0256 0.0335 0.0429 553 SER C CA 7360 C C . SER C 245 ? 0.1931 0.2088 0.2870 0.0235 0.0316 0.0401 553 SER C C 7361 O O . SER C 245 ? 0.1910 0.2017 0.2721 0.0251 0.0378 0.0384 553 SER C O 7362 C CB . SER C 245 ? 0.2006 0.2251 0.3191 0.0321 0.0381 0.0409 553 SER C CB 7363 O OG . SER C 245 ? 0.2205 0.2369 0.3310 0.0332 0.0314 0.0383 553 SER C OG 7364 N N . ASP C 246 ? 0.1776 0.1907 0.2671 0.0201 0.0229 0.0394 554 ASP C N 7365 C CA . ASP C 246 ? 0.2052 0.2103 0.2766 0.0184 0.0204 0.0368 554 ASP C CA 7366 C C . ASP C 246 ? 0.2102 0.2155 0.2773 0.0143 0.0169 0.0382 554 ASP C C 7367 O O . ASP C 246 ? 0.2190 0.2204 0.2771 0.0126 0.0117 0.0365 554 ASP C O 7368 C CB . ASP C 246 ? 0.2105 0.2104 0.2776 0.0190 0.0147 0.0343 554 ASP C CB 7369 C CG . ASP C 246 ? 0.2599 0.2567 0.3293 0.0237 0.0185 0.0328 554 ASP C CG 7370 O OD1 . ASP C 246 ? 0.2879 0.2811 0.3501 0.0259 0.0253 0.0307 554 ASP C OD1 7371 O OD2 . ASP C 246 ? 0.3182 0.3159 0.3961 0.0256 0.0148 0.0337 554 ASP C OD2 7372 N N . PHE C 247 ? 0.1967 0.2062 0.2710 0.0129 0.0201 0.0415 555 PHE C N 7373 C CA . PHE C 247 ? 0.1641 0.1718 0.2331 0.0099 0.0182 0.0431 555 PHE C CA 7374 C C . PHE C 247 ? 0.2078 0.2113 0.2616 0.0111 0.0229 0.0433 555 PHE C C 7375 O O . PHE C 247 ? 0.2172 0.2219 0.2710 0.0120 0.0300 0.0463 555 PHE C O 7376 C CB . PHE C 247 ? 0.1562 0.1685 0.2391 0.0074 0.0199 0.0469 555 PHE C CB 7377 C CG . PHE C 247 ? 0.1860 0.2027 0.2833 0.0053 0.0136 0.0463 555 PHE C CG 7378 C CD1 . PHE C 247 ? 0.2089 0.2228 0.3016 0.0044 0.0055 0.0433 555 PHE C CD1 7379 C CD2 . PHE C 247 ? 0.1629 0.1870 0.2782 0.0043 0.0156 0.0486 555 PHE C CD2 7380 C CE1 . PHE C 247 ? 0.2301 0.2475 0.3334 0.0027 -0.0009 0.0425 555 PHE C CE1 7381 C CE2 . PHE C 247 ? 0.1719 0.2006 0.3001 0.0021 0.0085 0.0477 555 PHE C CE2 7382 C CZ . PHE C 247 ? 0.1916 0.2163 0.3125 0.0014 -0.0001 0.0445 555 PHE C CZ 7383 N N . GLY C 248 ? 0.1994 0.1985 0.2404 0.0111 0.0190 0.0404 556 GLY C N 7384 C CA . GLY C 248 ? 0.1686 0.1640 0.1941 0.0122 0.0215 0.0397 556 GLY C CA 7385 C C . GLY C 248 ? 0.2028 0.1948 0.2194 0.0118 0.0163 0.0352 556 GLY C C 7386 O O . GLY C 248 ? 0.1845 0.1772 0.2059 0.0102 0.0109 0.0342 556 GLY C O 7387 N N . ASN C 249 ? 0.2032 0.1914 0.2067 0.0128 0.0179 0.0324 557 ASN C N 7388 C CA . ASN C 249 ? 0.2034 0.1882 0.1995 0.0113 0.0128 0.0281 557 ASN C CA 7389 C C . ASN C 249 ? 0.2072 0.1887 0.2084 0.0119 0.0130 0.0250 557 ASN C C 7390 O O . ASN C 249 ? 0.2053 0.1820 0.2014 0.0139 0.0169 0.0218 557 ASN C O 7391 C CB . ASN C 249 ? 0.2364 0.2178 0.2164 0.0115 0.0133 0.0255 557 ASN C CB 7392 C CG . ASN C 249 ? 0.2520 0.2308 0.2259 0.0087 0.0072 0.0210 557 ASN C CG 7393 O OD1 . ASN C 249 ? 0.2245 0.2055 0.2055 0.0064 0.0025 0.0213 557 ASN C OD1 7394 N ND2 . ASN C 249 ? 0.2460 0.2201 0.2066 0.0086 0.0074 0.0168 557 ASN C ND2 7395 N N . HIS C 250 ? 0.1934 0.1767 0.2038 0.0106 0.0088 0.0259 558 HIS C N 7396 C CA . HIS C 250 ? 0.1916 0.1719 0.2076 0.0115 0.0082 0.0246 558 HIS C CA 7397 C C . HIS C 250 ? 0.1780 0.1602 0.1984 0.0091 0.0023 0.0259 558 HIS C C 7398 O O . HIS C 250 ? 0.1644 0.1513 0.1878 0.0079 0.0002 0.0281 558 HIS C O 7399 C CB . HIS C 250 ? 0.2234 0.2065 0.2505 0.0149 0.0125 0.0266 558 HIS C CB 7400 C CG . HIS C 250 ? 0.2090 0.1890 0.2424 0.0171 0.0120 0.0258 558 HIS C CG 7401 N ND1 . HIS C 250 ? 0.1732 0.1549 0.2138 0.0164 0.0068 0.0279 558 HIS C ND1 7402 C CD2 . HIS C 250 ? 0.2143 0.1886 0.2469 0.0206 0.0161 0.0234 558 HIS C CD2 7403 C CE1 . HIS C 250 ? 0.2074 0.1851 0.2520 0.0194 0.0073 0.0276 558 HIS C CE1 7404 N NE2 . HIS C 250 ? 0.2208 0.1937 0.2614 0.0221 0.0131 0.0247 558 HIS C NE2 7405 N N . PRO C 251 ? 0.1654 0.1431 0.1854 0.0085 0.0001 0.0247 559 PRO C N 7406 C CA . PRO C 251 ? 0.2039 0.1831 0.2261 0.0063 -0.0045 0.0263 559 PRO C CA 7407 C C . PRO C 251 ? 0.1701 0.1549 0.2003 0.0072 -0.0064 0.0292 559 PRO C C 7408 O O . PRO C 251 ? 0.1703 0.1578 0.1997 0.0054 -0.0095 0.0299 559 PRO C O 7409 C CB . PRO C 251 ? 0.2147 0.1871 0.2373 0.0070 -0.0049 0.0260 559 PRO C CB 7410 C CG . PRO C 251 ? 0.2279 0.1937 0.2450 0.0077 -0.0015 0.0225 559 PRO C CG 7411 C CD . PRO C 251 ? 0.1668 0.1364 0.1825 0.0095 0.0023 0.0216 559 PRO C CD 7412 N N . THR C 252 ? 0.2062 0.1932 0.2446 0.0098 -0.0044 0.0304 560 THR C N 7413 C CA . THR C 252 ? 0.2134 0.2058 0.2606 0.0098 -0.0072 0.0325 560 THR C CA 7414 C C . THR C 252 ? 0.1891 0.1845 0.2349 0.0076 -0.0079 0.0327 560 THR C C 7415 O O . THR C 252 ? 0.1791 0.1757 0.2252 0.0063 -0.0119 0.0328 560 THR C O 7416 C CB . THR C 252 ? 0.2815 0.2777 0.3403 0.0126 -0.0047 0.0340 560 THR C CB 7417 O OG1 . THR C 252 ? 0.2963 0.2896 0.3577 0.0154 -0.0052 0.0343 560 THR C OG1 7418 C CG2 . THR C 252 ? 0.2577 0.2601 0.3265 0.0113 -0.0083 0.0357 560 THR C CG2 7419 N N . SER C 253 ? 0.1843 0.1798 0.2271 0.0077 -0.0039 0.0327 561 SER C N 7420 C CA . SER C 253 ? 0.1737 0.1706 0.2148 0.0063 -0.0045 0.0336 561 SER C CA 7421 C C . SER C 253 ? 0.1837 0.1795 0.2169 0.0050 -0.0075 0.0323 561 SER C C 7422 O O . SER C 253 ? 0.1838 0.1807 0.2175 0.0044 -0.0094 0.0327 561 SER C O 7423 C CB . SER C 253 ? 0.1789 0.1758 0.2176 0.0070 0.0005 0.0351 561 SER C CB 7424 O OG . SER C 253 ? 0.1716 0.1710 0.2198 0.0079 0.0043 0.0369 561 SER C OG 7425 N N . HIS C 254 ? 0.1662 0.1599 0.1932 0.0046 -0.0077 0.0307 562 HIS C N 7426 C CA . HIS C 254 ? 0.1927 0.1872 0.2148 0.0030 -0.0102 0.0297 562 HIS C CA 7427 C C . HIS C 254 ? 0.2128 0.2082 0.2371 0.0024 -0.0130 0.0300 562 HIS C C 7428 O O . HIS C 254 ? 0.2350 0.2324 0.2569 0.0016 -0.0143 0.0296 562 HIS C O 7429 C CB . HIS C 254 ? 0.1909 0.1825 0.2075 0.0016 -0.0100 0.0278 562 HIS C CB 7430 C CG . HIS C 254 ? 0.1965 0.1861 0.2081 0.0022 -0.0076 0.0264 562 HIS C CG 7431 N ND1 . HIS C 254 ? 0.1974 0.1820 0.2041 0.0013 -0.0069 0.0237 562 HIS C ND1 7432 C CD2 . HIS C 254 ? 0.2069 0.1979 0.2160 0.0036 -0.0055 0.0274 562 HIS C CD2 7433 C CE1 . HIS C 254 ? 0.1702 0.1534 0.1708 0.0024 -0.0046 0.0223 562 HIS C CE1 7434 N NE2 . HIS C 254 ? 0.1945 0.1819 0.1962 0.0039 -0.0036 0.0250 562 HIS C NE2 7435 N N . LEU C 255 ? 0.1938 0.1881 0.2224 0.0031 -0.0140 0.0306 563 LEU C N 7436 C CA . LEU C 255 ? 0.2000 0.1946 0.2285 0.0029 -0.0171 0.0308 563 LEU C CA 7437 C C . LEU C 255 ? 0.1998 0.1960 0.2321 0.0031 -0.0190 0.0304 563 LEU C C 7438 O O . LEU C 255 ? 0.1765 0.1728 0.2056 0.0029 -0.0208 0.0293 563 LEU C O 7439 C CB . LEU C 255 ? 0.2180 0.2104 0.2482 0.0037 -0.0186 0.0319 563 LEU C CB 7440 C CG . LEU C 255 ? 0.2408 0.2291 0.2671 0.0032 -0.0172 0.0323 563 LEU C CG 7441 C CD1 . LEU C 255 ? 0.2483 0.2337 0.2763 0.0048 -0.0192 0.0344 563 LEU C CD1 7442 C CD2 . LEU C 255 ? 0.2256 0.2140 0.2457 0.0007 -0.0169 0.0320 563 LEU C CD2 7443 N N . MET C 256 ? 0.1463 0.1435 0.1859 0.0035 -0.0181 0.0311 564 MET C N 7444 C CA . MET C 256 ? 0.1535 0.1514 0.1986 0.0028 -0.0206 0.0306 564 MET C CA 7445 C C . MET C 256 ? 0.1501 0.1476 0.1992 0.0023 -0.0181 0.0313 564 MET C C 7446 O O . MET C 256 ? 0.1555 0.1528 0.2110 0.0010 -0.0199 0.0309 564 MET C O 7447 C CB . MET C 256 ? 0.1737 0.1739 0.2270 0.0028 -0.0235 0.0312 564 MET C CB 7448 C CG . MET C 256 ? 0.1621 0.1646 0.2229 0.0041 -0.0199 0.0333 564 MET C CG 7449 S SD . MET C 256 ? 0.2079 0.2118 0.2748 0.0036 -0.0141 0.0348 564 MET C SD 7450 C CE . MET C 256 ? 0.1805 0.1871 0.2595 0.0008 -0.0178 0.0349 564 MET C CE 7451 N N . GLN C 257 ? 0.1614 0.1584 0.2063 0.0031 -0.0145 0.0324 565 GLN C N 7452 C CA . GLN C 257 ? 0.1969 0.1929 0.2447 0.0029 -0.0118 0.0344 565 GLN C CA 7453 C C . GLN C 257 ? 0.1718 0.1646 0.2210 0.0024 -0.0139 0.0335 565 GLN C C 7454 O O . GLN C 257 ? 0.1746 0.1653 0.2291 0.0016 -0.0123 0.0354 565 GLN C O 7455 C CB . GLN C 257 ? 0.2078 0.2036 0.2486 0.0043 -0.0085 0.0361 565 GLN C CB 7456 C CG . GLN C 257 ? 0.1825 0.1786 0.2163 0.0052 -0.0104 0.0349 565 GLN C CG 7457 C CD . GLN C 257 ? 0.2338 0.2305 0.2617 0.0064 -0.0086 0.0368 565 GLN C CD 7458 O OE1 . GLN C 257 ? 0.1886 0.1842 0.2162 0.0068 -0.0056 0.0395 565 GLN C OE1 7459 N NE2 . GLN C 257 ? 0.2361 0.2353 0.2593 0.0068 -0.0105 0.0357 565 GLN C NE2 7460 N N . SER C 258 ? 0.1910 0.1829 0.2356 0.0029 -0.0169 0.0306 566 SER C N 7461 C CA . SER C 258 ? 0.1906 0.1781 0.2352 0.0031 -0.0185 0.0288 566 SER C CA 7462 C C . SER C 258 ? 0.1994 0.1847 0.2490 0.0008 -0.0223 0.0260 566 SER C C 7463 O O . SER C 258 ? 0.1824 0.1623 0.2335 0.0003 -0.0236 0.0240 566 SER C O 7464 C CB . SER C 258 ? 0.1839 0.1716 0.2209 0.0053 -0.0189 0.0266 566 SER C CB 7465 O OG . SER C 258 ? 0.2062 0.1964 0.2406 0.0073 -0.0164 0.0289 566 SER C OG 7466 N N . ILE C 259 ? 0.1643 0.1532 0.2163 -0.0004 -0.0247 0.0258 567 ILE C N 7467 C CA . ILE C 259 ? 0.1621 0.1504 0.2181 -0.0025 -0.0301 0.0229 567 ILE C CA 7468 C C . ILE C 259 ? 0.1886 0.1750 0.2561 -0.0057 -0.0310 0.0231 567 ILE C C 7469 O O . ILE C 259 ? 0.2034 0.1850 0.2711 -0.0075 -0.0350 0.0192 567 ILE C O 7470 C CB . ILE C 259 ? 0.2424 0.2356 0.2990 -0.0024 -0.0332 0.0235 567 ILE C CB 7471 C CG1 . ILE C 259 ? 0.2808 0.2734 0.3249 -0.0003 -0.0333 0.0227 567 ILE C CG1 7472 C CG2 . ILE C 259 ? 0.2810 0.2751 0.3436 -0.0048 -0.0398 0.0212 567 ILE C CG2 7473 C CD1 . ILE C 259 ? 0.3123 0.3080 0.3556 0.0003 -0.0363 0.0241 567 ILE C CD1 7474 N N . PRO C 260 ? 0.1788 0.1685 0.2557 -0.0067 -0.0270 0.0273 568 PRO C N 7475 C CA . PRO C 260 ? 0.2053 0.1934 0.2945 -0.0105 -0.0271 0.0282 568 PRO C CA 7476 C C . PRO C 260 ? 0.2086 0.1873 0.2950 -0.0111 -0.0268 0.0266 568 PRO C C 7477 O O . PRO C 260 ? 0.2203 0.1948 0.3133 -0.0148 -0.0305 0.0239 568 PRO C O 7478 C CB . PRO C 260 ? 0.1851 0.1776 0.2809 -0.0101 -0.0202 0.0338 568 PRO C CB 7479 C CG . PRO C 260 ? 0.1599 0.1579 0.2507 -0.0070 -0.0192 0.0344 568 PRO C CG 7480 C CD . PRO C 260 ? 0.1582 0.1527 0.2352 -0.0047 -0.0221 0.0311 568 PRO C CD 7481 N N . GLY C 261 ? 0.1706 0.1458 0.2477 -0.0076 -0.0230 0.0280 569 GLY C N 7482 C CA . GLY C 261 ? 0.1817 0.1475 0.2562 -0.0068 -0.0222 0.0271 569 GLY C CA 7483 C C . GLY C 261 ? 0.2086 0.1688 0.2764 -0.0060 -0.0269 0.0203 569 GLY C C 7484 O O . GLY C 261 ? 0.2376 0.1885 0.3049 -0.0057 -0.0270 0.0182 569 GLY C O 7485 N N . MET C 262 ? 0.1912 0.1562 0.2530 -0.0054 -0.0303 0.0170 570 MET C N 7486 C CA . MET C 262 ? 0.2155 0.1756 0.2683 -0.0043 -0.0341 0.0106 570 MET C CA 7487 C C . MET C 262 ? 0.2243 0.1821 0.2803 -0.0086 -0.0410 0.0057 570 MET C C 7488 O O . MET C 262 ? 0.2153 0.1675 0.2625 -0.0080 -0.0445 -0.0005 570 MET C O 7489 C CB . MET C 262 ? 0.2410 0.2066 0.2830 -0.0010 -0.0334 0.0102 570 MET C CB 7490 C CG . MET C 262 ? 0.2715 0.2383 0.3095 0.0031 -0.0280 0.0130 570 MET C CG 7491 S SD . MET C 262 ? 0.2979 0.2717 0.3258 0.0056 -0.0269 0.0130 570 MET C SD 7492 C CE . MET C 262 ? 0.2807 0.2560 0.3076 0.0098 -0.0216 0.0154 570 MET C CE 7493 N N . HIS C 263 ? 0.1931 0.1558 0.2618 -0.0127 -0.0430 0.0083 571 HIS C N 7494 C CA . HIS C 263 ? 0.2166 0.1785 0.2912 -0.0174 -0.0506 0.0038 571 HIS C CA 7495 C C . HIS C 263 ? 0.2521 0.2016 0.3278 -0.0201 -0.0523 -0.0012 571 HIS C C 7496 O O . HIS C 263 ? 0.2551 0.1984 0.3352 -0.0199 -0.0471 0.0016 571 HIS C O 7497 C CB . HIS C 263 ? 0.2447 0.2160 0.3362 -0.0213 -0.0516 0.0082 571 HIS C CB 7498 C CG . HIS C 263 ? 0.2461 0.2279 0.3368 -0.0195 -0.0541 0.0102 571 HIS C CG 7499 N ND1 . HIS C 263 ? 0.2749 0.2586 0.3600 -0.0198 -0.0623 0.0061 571 HIS C ND1 7500 C CD2 . HIS C 263 ? 0.2757 0.2655 0.3700 -0.0170 -0.0495 0.0157 571 HIS C CD2 7501 C CE1 . HIS C 263 ? 0.2880 0.2804 0.3741 -0.0174 -0.0626 0.0099 571 HIS C CE1 7502 N NE2 . HIS C 263 ? 0.2603 0.2562 0.3523 -0.0157 -0.0548 0.0153 571 HIS C NE2 7503 N N . ASN C 264 ? 0.2187 0.1639 0.2897 -0.0225 -0.0600 -0.0086 572 ASN C N 7504 C CA . ASN C 264 ? 0.2754 0.2071 0.3461 -0.0254 -0.0628 -0.0151 572 ASN C CA 7505 C C . ASN C 264 ? 0.2780 0.2094 0.3687 -0.0327 -0.0647 -0.0130 572 ASN C C 7506 O O . ASN C 264 ? 0.2477 0.1873 0.3483 -0.0375 -0.0713 -0.0136 572 ASN C O 7507 C CB . ASN C 264 ? 0.2910 0.2186 0.3482 -0.0257 -0.0710 -0.0243 572 ASN C CB 7508 C CG . ASN C 264 ? 0.3081 0.2209 0.3652 -0.0297 -0.0754 -0.0327 572 ASN C CG 7509 O OD1 . ASN C 264 ? 0.3068 0.2099 0.3712 -0.0307 -0.0710 -0.0318 572 ASN C OD1 7510 N ND2 . ASN C 264 ? 0.2906 0.2006 0.3381 -0.0318 -0.0844 -0.0411 572 ASN C ND2 7511 N N . PRO C 265 ? 0.2701 0.1926 0.3674 -0.0334 -0.0588 -0.0100 573 PRO C N 7512 C CA . PRO C 265 ? 0.2641 0.1866 0.3814 -0.0408 -0.0590 -0.0065 573 PRO C CA 7513 C C . PRO C 265 ? 0.2769 0.1925 0.4010 -0.0484 -0.0682 -0.0145 573 PRO C C 7514 O O . PRO C 265 ? 0.2826 0.2024 0.4259 -0.0557 -0.0701 -0.0119 573 PRO C O 7515 C CB . PRO C 265 ? 0.2809 0.1931 0.3996 -0.0388 -0.0503 -0.0012 573 PRO C CB 7516 C CG . PRO C 265 ? 0.3078 0.2109 0.4079 -0.0313 -0.0485 -0.0054 573 PRO C CG 7517 C CD . PRO C 265 ? 0.2442 0.1581 0.3323 -0.0273 -0.0513 -0.0081 573 PRO C CD 7518 N N . ASP C 266 ? 0.2531 0.1584 0.3618 -0.0468 -0.0737 -0.0242 574 ASP C N 7519 C CA . ASP C 266 ? 0.2840 0.1817 0.3962 -0.0541 -0.0838 -0.0334 574 ASP C CA 7520 C C . ASP C 266 ? 0.2990 0.2121 0.4175 -0.0582 -0.0934 -0.0348 574 ASP C C 7521 O O . ASP C 266 ? 0.2885 0.2036 0.4139 -0.0639 -0.0990 -0.0383 574 ASP C O 7522 C CB . ASP C 266 ? 0.3184 0.2002 0.4093 -0.0503 -0.0863 -0.0442 574 ASP C CB 7523 C CG . ASP C 266 ? 0.3765 0.2505 0.4666 -0.0566 -0.0949 -0.0539 574 ASP C CG 7524 O OD1 . ASP C 266 ? 0.3638 0.2368 0.4688 -0.0628 -0.0938 -0.0517 574 ASP C OD1 7525 O OD2 . ASP C 266 ? 0.3912 0.2616 0.4637 -0.0549 -0.1015 -0.0631 574 ASP C OD2 7526 N N . LYS C 267 ? 0.2817 0.2085 0.3941 -0.0528 -0.0923 -0.0303 575 LYS C N 7527 C CA . LYS C 267 ? 0.2909 0.2314 0.4068 -0.0550 -0.1020 -0.0314 575 LYS C CA 7528 C C . LYS C 267 ? 0.2683 0.2267 0.3993 -0.0539 -0.0981 -0.0213 575 LYS C C 7529 O O . LYS C 267 ? 0.2543 0.2255 0.3943 -0.0560 -0.1056 -0.0206 575 LYS C O 7530 C CB . LYS C 267 ? 0.3598 0.2986 0.4507 -0.0493 -0.1064 -0.0370 575 LYS C CB 7531 C CG . LYS C 267 ? 0.4094 0.3315 0.4837 -0.0502 -0.1115 -0.0486 575 LYS C CG 7532 C CD . LYS C 267 ? 0.4563 0.3792 0.5375 -0.0575 -0.1216 -0.0545 575 LYS C CD 7533 C CE . LYS C 267 ? 0.5101 0.4167 0.5711 -0.0573 -0.1253 -0.0662 575 LYS C CE 7534 N NZ . LYS C 267 ? 0.5307 0.4389 0.5971 -0.0641 -0.1333 -0.0714 575 LYS C NZ 7535 N N . PHE C 268 ? 0.2280 0.1871 0.3610 -0.0500 -0.0865 -0.0138 576 PHE C N 7536 C CA . PHE C 268 ? 0.2283 0.2025 0.3725 -0.0479 -0.0814 -0.0049 576 PHE C CA 7537 C C . PHE C 268 ? 0.2612 0.2354 0.4197 -0.0495 -0.0713 0.0024 576 PHE C C 7538 O O . PHE C 268 ? 0.3045 0.2665 0.4571 -0.0487 -0.0654 0.0028 576 PHE C O 7539 C CB . PHE C 268 ? 0.2240 0.2014 0.3505 -0.0396 -0.0777 -0.0027 576 PHE C CB 7540 C CG . PHE C 268 ? 0.2280 0.2072 0.3410 -0.0378 -0.0868 -0.0079 576 PHE C CG 7541 C CD1 . PHE C 268 ? 0.2370 0.2294 0.3568 -0.0373 -0.0924 -0.0052 576 PHE C CD1 7542 C CD2 . PHE C 268 ? 0.2418 0.2092 0.3354 -0.0363 -0.0898 -0.0154 576 PHE C CD2 7543 C CE1 . PHE C 268 ? 0.2513 0.2447 0.3574 -0.0355 -0.1013 -0.0092 576 PHE C CE1 7544 C CE2 . PHE C 268 ? 0.2561 0.2247 0.3353 -0.0346 -0.0979 -0.0199 576 PHE C CE2 7545 C CZ . PHE C 268 ? 0.2435 0.2250 0.3285 -0.0344 -0.1040 -0.0164 576 PHE C CZ 7546 N N . GLU C 269 ? 0.2010 0.1891 0.3780 -0.0515 -0.0692 0.0086 577 GLU C N 7547 C CA . GLU C 269 ? 0.2278 0.2179 0.4163 -0.0521 -0.0583 0.0167 577 GLU C CA 7548 C C . GLU C 269 ? 0.2179 0.2203 0.4056 -0.0460 -0.0526 0.0225 577 GLU C C 7549 O O . GLU C 269 ? 0.2022 0.2175 0.3999 -0.0460 -0.0569 0.0231 577 GLU C O 7550 C CB . GLU C 269 ? 0.2142 0.2093 0.4232 -0.0587 -0.0581 0.0185 577 GLU C CB 7551 C CG . GLU C 269 ? 0.2560 0.2510 0.4728 -0.0589 -0.0458 0.0267 577 GLU C CG 7552 C CD . GLU C 269 ? 0.2767 0.2751 0.5098 -0.0649 -0.0447 0.0281 577 GLU C CD 7553 O OE1 . GLU C 269 ? 0.3058 0.3105 0.5474 -0.0686 -0.0533 0.0235 577 GLU C OE1 7554 O OE2 . GLU C 269 ? 0.2706 0.2653 0.5076 -0.0660 -0.0353 0.0339 577 GLU C OE2 7555 N N . VAL C 270 ? 0.2176 0.2157 0.3933 -0.0408 -0.0435 0.0265 578 VAL C N 7556 C CA . VAL C 270 ? 0.2130 0.2191 0.3826 -0.0345 -0.0388 0.0301 578 VAL C CA 7557 C C . VAL C 270 ? 0.1989 0.2121 0.3805 -0.0344 -0.0289 0.0376 578 VAL C C 7558 O O . VAL C 270 ? 0.1817 0.1886 0.3626 -0.0354 -0.0217 0.0414 578 VAL C O 7559 C CB . VAL C 270 ? 0.2391 0.2369 0.3862 -0.0285 -0.0357 0.0291 578 VAL C CB 7560 C CG1 . VAL C 270 ? 0.2316 0.2366 0.3728 -0.0230 -0.0314 0.0322 578 VAL C CG1 7561 C CG2 . VAL C 270 ? 0.2428 0.2337 0.3767 -0.0279 -0.0438 0.0220 578 VAL C CG2 7562 N N . PHE C 271 ? 0.1676 0.1936 0.3594 -0.0327 -0.0284 0.0397 579 PHE C N 7563 C CA . PHE C 271 ? 0.1487 0.1826 0.3513 -0.0316 -0.0183 0.0462 579 PHE C CA 7564 C C . PHE C 271 ? 0.1697 0.2061 0.3597 -0.0242 -0.0144 0.0470 579 PHE C C 7565 O O . PHE C 271 ? 0.2083 0.2496 0.3975 -0.0214 -0.0203 0.0445 579 PHE C O 7566 C CB . PHE C 271 ? 0.1535 0.2014 0.3820 -0.0355 -0.0203 0.0479 579 PHE C CB 7567 C CG . PHE C 271 ? 0.1672 0.2127 0.4078 -0.0429 -0.0238 0.0467 579 PHE C CG 7568 C CD1 . PHE C 271 ? 0.1765 0.2242 0.4277 -0.0453 -0.0153 0.0515 579 PHE C CD1 7569 C CD2 . PHE C 271 ? 0.1668 0.2066 0.4043 -0.0466 -0.0354 0.0401 579 PHE C CD2 7570 C CE1 . PHE C 271 ? 0.2061 0.2508 0.4662 -0.0517 -0.0184 0.0499 579 PHE C CE1 7571 C CE2 . PHE C 271 ? 0.1854 0.2214 0.4307 -0.0527 -0.0384 0.0379 579 PHE C CE2 7572 C CZ . PHE C 271 ? 0.2091 0.2478 0.4667 -0.0555 -0.0300 0.0430 579 PHE C CZ 7573 N N . CYS C 272 ? 0.1704 0.2028 0.3501 -0.0211 -0.0050 0.0504 580 CYS C N 7574 C CA . CYS C 272 ? 0.1534 0.1880 0.3229 -0.0147 -0.0007 0.0509 580 CYS C CA 7575 C C . CYS C 272 ? 0.1834 0.2268 0.3649 -0.0132 0.0090 0.0556 580 CYS C C 7576 O O . CYS C 272 ? 0.2254 0.2681 0.4107 -0.0153 0.0168 0.0600 580 CYS C O 7577 C CB . CYS C 272 ? 0.1742 0.1985 0.3215 -0.0117 0.0020 0.0503 580 CYS C CB 7578 S SG . CYS C 272 ? 0.2284 0.2444 0.3607 -0.0115 -0.0078 0.0445 580 CYS C SG 7579 N N . TYR C 273 ? 0.1714 0.2225 0.3585 -0.0091 0.0087 0.0549 581 TYR C N 7580 C CA . TYR C 273 ? 0.1695 0.2295 0.3682 -0.0063 0.0184 0.0586 581 TYR C CA 7581 C C . TYR C 273 ? 0.1927 0.2479 0.3741 0.0004 0.0238 0.0573 581 TYR C C 7582 O O . TYR C 273 ? 0.1810 0.2360 0.3586 0.0042 0.0193 0.0544 581 TYR C O 7583 C CB . TYR C 273 ? 0.1667 0.2401 0.3888 -0.0062 0.0142 0.0589 581 TYR C CB 7584 C CG . TYR C 273 ? 0.1739 0.2530 0.4152 -0.0137 0.0084 0.0597 581 TYR C CG 7585 C CD1 . TYR C 273 ? 0.1860 0.2709 0.4425 -0.0172 0.0158 0.0639 581 TYR C CD1 7586 C CD2 . TYR C 273 ? 0.1713 0.2475 0.4111 -0.0171 -0.0045 0.0555 581 TYR C CD2 7587 C CE1 . TYR C 273 ? 0.2024 0.2882 0.4699 -0.0238 0.0098 0.0630 581 TYR C CE1 7588 C CE2 . TYR C 273 ? 0.1681 0.2470 0.4221 -0.0241 -0.0105 0.0548 581 TYR C CE2 7589 C CZ . TYR C 273 ? 0.1883 0.2708 0.4544 -0.0272 -0.0034 0.0582 581 TYR C CZ 7590 O OH . TYR C 273 ? 0.1966 0.2792 0.4728 -0.0338 -0.0095 0.0565 581 TYR C OH 7591 N N . ALA C 274 ? 0.2091 0.2597 0.3794 0.0015 0.0332 0.0596 582 ALA C N 7592 C CA . ALA C 274 ? 0.1955 0.2403 0.3476 0.0070 0.0381 0.0576 582 ALA C CA 7593 C C . ALA C 274 ? 0.2090 0.2614 0.3707 0.0119 0.0468 0.0586 582 ALA C C 7594 O O . ALA C 274 ? 0.2021 0.2622 0.3775 0.0111 0.0549 0.0628 582 ALA C O 7595 C CB . ALA C 274 ? 0.2119 0.2484 0.3457 0.0064 0.0431 0.0593 582 ALA C CB 7596 N N . LEU C 275 ? 0.1743 0.2239 0.3292 0.0172 0.0457 0.0549 583 LEU C N 7597 C CA . LEU C 275 ? 0.1595 0.2143 0.3218 0.0231 0.0543 0.0550 583 LEU C CA 7598 C C . LEU C 275 ? 0.2370 0.2834 0.3784 0.0268 0.0637 0.0532 583 LEU C C 7599 O O . LEU C 275 ? 0.3173 0.3658 0.4608 0.0322 0.0728 0.0526 583 LEU C O 7600 C CB . LEU C 275 ? 0.1707 0.2266 0.3395 0.0274 0.0479 0.0522 583 LEU C CB 7601 C CG . LEU C 275 ? 0.1704 0.2351 0.3582 0.0243 0.0375 0.0538 583 LEU C CG 7602 C CD1 . LEU C 275 ? 0.1410 0.2066 0.3342 0.0295 0.0316 0.0522 583 LEU C CD1 7603 C CD2 . LEU C 275 ? 0.1714 0.2501 0.3838 0.0215 0.0415 0.0582 583 LEU C CD2 7604 N N . SER C 276 ? 0.2139 0.2508 0.3350 0.0241 0.0613 0.0522 584 SER C N 7605 C CA . SER C 276 ? 0.2310 0.2596 0.3301 0.0269 0.0680 0.0501 584 SER C CA 7606 C C . SER C 276 ? 0.2223 0.2497 0.3131 0.0235 0.0722 0.0547 584 SER C C 7607 O O . SER C 276 ? 0.1995 0.2283 0.2968 0.0185 0.0670 0.0579 584 SER C O 7608 C CB . SER C 276 ? 0.2564 0.2744 0.3370 0.0272 0.0602 0.0446 584 SER C CB 7609 O OG . SER C 276 ? 0.3028 0.3184 0.3790 0.0223 0.0515 0.0455 584 SER C OG 7610 N N . PRO C 277 ? 0.2507 0.2744 0.3261 0.0264 0.0817 0.0550 585 PRO C N 7611 C CA . PRO C 277 ? 0.2990 0.3199 0.3628 0.0238 0.0852 0.0599 585 PRO C CA 7612 C C . PRO C 277 ? 0.2797 0.2921 0.3267 0.0213 0.0751 0.0582 585 PRO C C 7613 O O . PRO C 277 ? 0.2746 0.2831 0.3162 0.0219 0.0672 0.0525 585 PRO C O 7614 C CB . PRO C 277 ? 0.3455 0.3638 0.3935 0.0285 0.0971 0.0595 585 PRO C CB 7615 C CG . PRO C 277 ? 0.3374 0.3522 0.3808 0.0333 0.0964 0.0517 585 PRO C CG 7616 C CD . PRO C 277 ? 0.2968 0.3181 0.3640 0.0326 0.0899 0.0508 585 PRO C CD 7617 N N . ASP C 278 ? 0.2637 0.2738 0.3041 0.0188 0.0758 0.0636 586 ASP C N 7618 C CA . ASP C 278 ? 0.2837 0.2872 0.3099 0.0171 0.0672 0.0631 586 ASP C CA 7619 C C . ASP C 278 ? 0.2959 0.2932 0.2986 0.0203 0.0662 0.0582 586 ASP C C 7620 O O . ASP C 278 ? 0.3172 0.3125 0.3060 0.0229 0.0741 0.0594 586 ASP C O 7621 C CB . ASP C 278 ? 0.3365 0.3384 0.3609 0.0148 0.0701 0.0712 586 ASP C CB 7622 C CG . ASP C 278 ? 0.3488 0.3448 0.3623 0.0137 0.0611 0.0716 586 ASP C CG 7623 O OD1 . ASP C 278 ? 0.3339 0.3275 0.3371 0.0149 0.0539 0.0660 586 ASP C OD1 7624 O OD2 . ASP C 278 ? 0.3809 0.3747 0.3972 0.0117 0.0615 0.0780 586 ASP C OD2 7625 N N . ASP C 279 ? 0.2777 0.2721 0.2757 0.0197 0.0567 0.0527 587 ASP C N 7626 C CA . ASP C 279 ? 0.2907 0.2794 0.2684 0.0216 0.0545 0.0472 587 ASP C CA 7627 C C . ASP C 279 ? 0.3211 0.3066 0.2827 0.0207 0.0491 0.0493 587 ASP C C 7628 O O . ASP C 279 ? 0.3243 0.3061 0.2698 0.0214 0.0452 0.0446 587 ASP C O 7629 C CB . ASP C 279 ? 0.2683 0.2552 0.2494 0.0214 0.0483 0.0401 587 ASP C CB 7630 C CG . ASP C 279 ? 0.2764 0.2645 0.2646 0.0181 0.0382 0.0399 587 ASP C CG 7631 O OD1 . ASP C 279 ? 0.2589 0.2487 0.2496 0.0164 0.0355 0.0445 587 ASP C OD1 7632 O OD2 . ASP C 279 ? 0.2518 0.2383 0.2425 0.0176 0.0333 0.0351 587 ASP C OD2 7633 N N . GLY C 280 ? 0.3121 0.2992 0.2791 0.0192 0.0485 0.0562 588 GLY C N 7634 C CA . GLY C 280 ? 0.3257 0.3103 0.2794 0.0193 0.0438 0.0597 588 GLY C CA 7635 C C . GLY C 280 ? 0.2940 0.2791 0.2501 0.0178 0.0328 0.0570 588 GLY C C 7636 O O . GLY C 280 ? 0.3048 0.2890 0.2522 0.0184 0.0282 0.0600 588 GLY C O 7637 N N . THR C 281 ? 0.2366 0.2236 0.2045 0.0161 0.0288 0.0519 589 THR C N 7638 C CA . THR C 281 ? 0.2267 0.2149 0.1967 0.0147 0.0196 0.0492 589 THR C CA 7639 C C . THR C 281 ? 0.2319 0.2214 0.2147 0.0136 0.0169 0.0529 589 THR C C 7640 O O . THR C 281 ? 0.2425 0.2320 0.2360 0.0128 0.0211 0.0562 589 THR C O 7641 C CB . THR C 281 ? 0.2355 0.2240 0.2102 0.0134 0.0167 0.0424 589 THR C CB 7642 O OG1 . THR C 281 ? 0.2226 0.2127 0.2127 0.0128 0.0195 0.0427 589 THR C OG1 7643 C CG2 . THR C 281 ? 0.2694 0.2546 0.2315 0.0145 0.0192 0.0376 589 THR C CG2 7644 N N . ASN C 282 ? 0.2262 0.2170 0.2089 0.0134 0.0099 0.0519 590 ASN C N 7645 C CA . ASN C 282 ? 0.2247 0.2155 0.2179 0.0130 0.0073 0.0543 590 ASN C CA 7646 C C . ASN C 282 ? 0.2137 0.2052 0.2203 0.0109 0.0071 0.0514 590 ASN C C 7647 O O . ASN C 282 ? 0.2324 0.2225 0.2481 0.0101 0.0064 0.0530 590 ASN C O 7648 C CB . ASN C 282 ? 0.2308 0.2238 0.2212 0.0141 0.0006 0.0536 590 ASN C CB 7649 C CG . ASN C 282 ? 0.2948 0.2873 0.2744 0.0168 -0.0004 0.0585 590 ASN C CG 7650 O OD1 . ASN C 282 ? 0.2965 0.2856 0.2701 0.0178 0.0043 0.0632 590 ASN C OD1 7651 N ND2 . ASN C 282 ? 0.2571 0.2534 0.2347 0.0181 -0.0066 0.0579 590 ASN C ND2 7652 N N . PHE C 283 ? 0.1977 0.1908 0.2050 0.0100 0.0071 0.0469 591 PHE C N 7653 C CA . PHE C 283 ? 0.1912 0.1853 0.2100 0.0085 0.0062 0.0446 591 PHE C CA 7654 C C . PHE C 283 ? 0.2011 0.1953 0.2299 0.0077 0.0107 0.0477 591 PHE C C 7655 O O . PHE C 283 ? 0.2020 0.1965 0.2412 0.0061 0.0087 0.0478 591 PHE C O 7656 C CB . PHE C 283 ? 0.1922 0.1868 0.2092 0.0083 0.0058 0.0402 591 PHE C CB 7657 C CG . PHE C 283 ? 0.1970 0.1915 0.2053 0.0079 0.0017 0.0372 591 PHE C CG 7658 C CD1 . PHE C 283 ? 0.1745 0.1708 0.1855 0.0069 -0.0031 0.0361 591 PHE C CD1 7659 C CD2 . PHE C 283 ? 0.2042 0.1970 0.2020 0.0084 0.0028 0.0352 591 PHE C CD2 7660 C CE1 . PHE C 283 ? 0.1841 0.1818 0.1895 0.0059 -0.0065 0.0338 591 PHE C CE1 7661 C CE2 . PHE C 283 ? 0.2229 0.2162 0.2144 0.0071 -0.0017 0.0322 591 PHE C CE2 7662 C CZ . PHE C 283 ? 0.2048 0.2012 0.2012 0.0056 -0.0062 0.0319 591 PHE C CZ 7663 N N . ARG C 284 ? 0.1759 0.1701 0.2014 0.0088 0.0170 0.0500 592 ARG C N 7664 C CA . ARG C 284 ? 0.2112 0.2069 0.2474 0.0078 0.0226 0.0539 592 ARG C CA 7665 C C . ARG C 284 ? 0.1962 0.1889 0.2357 0.0063 0.0223 0.0587 592 ARG C C 7666 O O . ARG C 284 ? 0.2218 0.2150 0.2747 0.0037 0.0224 0.0601 592 ARG C O 7667 C CB . ARG C 284 ? 0.2365 0.2327 0.2661 0.0098 0.0307 0.0557 592 ARG C CB 7668 C CG . ARG C 284 ? 0.2468 0.2460 0.2881 0.0088 0.0384 0.0606 592 ARG C CG 7669 C CD . ARG C 284 ? 0.2324 0.2374 0.2918 0.0076 0.0381 0.0586 592 ARG C CD 7670 N NE . ARG C 284 ? 0.2288 0.2387 0.2995 0.0073 0.0469 0.0628 592 ARG C NE 7671 C CZ . ARG C 284 ? 0.2260 0.2416 0.3049 0.0095 0.0515 0.0613 592 ARG C CZ 7672 N NH1 . ARG C 284 ? 0.1781 0.1934 0.2543 0.0120 0.0476 0.0558 592 ARG C NH1 7673 N NH2 . ARG C 284 ? 0.2440 0.2655 0.3347 0.0092 0.0603 0.0656 592 ARG C NH2 7674 N N . VAL C 285 ? 0.2121 0.2014 0.2395 0.0080 0.0215 0.0611 593 VAL C N 7675 C CA . VAL C 285 ? 0.2039 0.1885 0.2332 0.0076 0.0213 0.0662 593 VAL C CA 7676 C C . VAL C 285 ? 0.1755 0.1585 0.2160 0.0056 0.0159 0.0634 593 VAL C C 7677 O O . VAL C 285 ? 0.1943 0.1740 0.2447 0.0032 0.0171 0.0661 593 VAL C O 7678 C CB . VAL C 285 ? 0.2711 0.2531 0.2859 0.0107 0.0189 0.0686 593 VAL C CB 7679 C CG1 . VAL C 285 ? 0.2687 0.2448 0.2869 0.0111 0.0179 0.0737 593 VAL C CG1 7680 C CG2 . VAL C 285 ? 0.2922 0.2745 0.2934 0.0126 0.0241 0.0717 593 VAL C CG2 7681 N N . LYS C 286 ? 0.1994 0.1844 0.2379 0.0063 0.0101 0.0579 594 LYS C N 7682 C CA . LYS C 286 ? 0.2109 0.1939 0.2562 0.0052 0.0052 0.0547 594 LYS C CA 7683 C C . LYS C 286 ? 0.2171 0.2010 0.2755 0.0017 0.0049 0.0530 594 LYS C C 7684 O O . LYS C 286 ? 0.2016 0.1812 0.2671 -0.0003 0.0030 0.0527 594 LYS C O 7685 C CB . LYS C 286 ? 0.2016 0.1876 0.2415 0.0066 0.0004 0.0496 594 LYS C CB 7686 C CG . LYS C 286 ? 0.2203 0.2042 0.2646 0.0061 -0.0040 0.0460 594 LYS C CG 7687 C CD . LYS C 286 ? 0.2322 0.2198 0.2713 0.0072 -0.0073 0.0418 594 LYS C CD 7688 C CE . LYS C 286 ? 0.2583 0.2434 0.2994 0.0075 -0.0105 0.0384 594 LYS C CE 7689 N NZ . LYS C 286 ? 0.2937 0.2743 0.3340 0.0102 -0.0102 0.0402 594 LYS C NZ 7690 N N . VAL C 287 ? 0.1921 0.1816 0.2539 0.0010 0.0063 0.0515 595 VAL C N 7691 C CA . VAL C 287 ? 0.1814 0.1738 0.2569 -0.0020 0.0050 0.0501 595 VAL C CA 7692 C C . VAL C 287 ? 0.2028 0.1943 0.2892 -0.0049 0.0095 0.0549 595 VAL C C 7693 O O . VAL C 287 ? 0.2178 0.2082 0.3156 -0.0086 0.0066 0.0539 595 VAL C O 7694 C CB . VAL C 287 ? 0.2463 0.2450 0.3240 -0.0010 0.0056 0.0482 595 VAL C CB 7695 C CG1 . VAL C 287 ? 0.2691 0.2726 0.3628 -0.0037 0.0036 0.0475 595 VAL C CG1 7696 C CG2 . VAL C 287 ? 0.2690 0.2674 0.3373 0.0009 0.0009 0.0439 595 VAL C CG2 7697 N N . MET C 288 ? 0.2160 0.2073 0.2983 -0.0038 0.0166 0.0600 596 MET C N 7698 C CA . MET C 288 ? 0.2134 0.2035 0.3055 -0.0068 0.0222 0.0658 596 MET C CA 7699 C C . MET C 288 ? 0.2322 0.2132 0.3255 -0.0087 0.0196 0.0674 596 MET C C 7700 O O . MET C 288 ? 0.2449 0.2237 0.3514 -0.0132 0.0207 0.0697 596 MET C O 7701 C CB . MET C 288 ? 0.2056 0.1965 0.2894 -0.0045 0.0309 0.0714 596 MET C CB 7702 C CG . MET C 288 ? 0.2268 0.2254 0.3104 -0.0024 0.0349 0.0695 596 MET C CG 7703 S SD . MET C 288 ? 0.3219 0.3204 0.3931 0.0006 0.0459 0.0752 596 MET C SD 7704 C CE . MET C 288 ? 0.5334 0.5304 0.6178 -0.0039 0.0527 0.0838 596 MET C CE 7705 N N . ALA C 289 ? 0.2260 0.2016 0.3068 -0.0054 0.0161 0.0661 597 ALA C N 7706 C CA . ALA C 289 ? 0.2307 0.1965 0.3116 -0.0057 0.0141 0.0677 597 ALA C CA 7707 C C . ALA C 289 ? 0.2115 0.1741 0.3002 -0.0083 0.0074 0.0612 597 ALA C C 7708 O O . ALA C 289 ? 0.2544 0.2081 0.3483 -0.0103 0.0065 0.0619 597 ALA C O 7709 C CB . ALA C 289 ? 0.2477 0.2101 0.3137 -0.0004 0.0130 0.0692 597 ALA C CB 7710 N N . GLU C 290 ? 0.1951 0.1637 0.2834 -0.0081 0.0028 0.0550 598 GLU C N 7711 C CA . GLU C 290 ? 0.2097 0.1748 0.3003 -0.0094 -0.0039 0.0484 598 GLU C CA 7712 C C . GLU C 290 ? 0.2277 0.1971 0.3313 -0.0144 -0.0075 0.0452 598 GLU C C 7713 O O . GLU C 290 ? 0.2269 0.1915 0.3338 -0.0168 -0.0129 0.0402 598 GLU C O 7714 C CB . GLU C 290 ? 0.2118 0.1791 0.2906 -0.0052 -0.0074 0.0439 598 GLU C CB 7715 C CG . GLU C 290 ? 0.2421 0.2063 0.3106 -0.0005 -0.0053 0.0467 598 GLU C CG 7716 C CD . GLU C 290 ? 0.2635 0.2305 0.3232 0.0030 -0.0086 0.0423 598 GLU C CD 7717 O OE1 . GLU C 290 ? 0.2521 0.2226 0.3118 0.0019 -0.0118 0.0376 598 GLU C OE1 7718 O OE2 . GLU C 290 ? 0.2627 0.2287 0.3160 0.0069 -0.0079 0.0441 598 GLU C OE2 7719 N N . ALA C 291 ? 0.2059 0.1845 0.3168 -0.0155 -0.0046 0.0477 599 ALA C N 7720 C CA . ALA C 291 ? 0.2129 0.1972 0.3393 -0.0202 -0.0079 0.0459 599 ALA C CA 7721 C C . ALA C 291 ? 0.2566 0.2356 0.3959 -0.0258 -0.0064 0.0485 599 ALA C C 7722 O O . ALA C 291 ? 0.2548 0.2281 0.3923 -0.0255 -0.0001 0.0542 599 ALA C O 7723 C CB . ALA C 291 ? 0.2161 0.2117 0.3488 -0.0192 -0.0039 0.0487 599 ALA C CB 7724 N N . ASN C 292 ? 0.2702 0.2504 0.4222 -0.0310 -0.0126 0.0447 600 ASN C N 7725 C CA . ASN C 292 ? 0.2646 0.2399 0.4315 -0.0377 -0.0114 0.0470 600 ASN C CA 7726 C C . ASN C 292 ? 0.2598 0.2441 0.4404 -0.0398 -0.0029 0.0548 600 ASN C C 7727 O O . ASN C 292 ? 0.2530 0.2326 0.4377 -0.0422 0.0028 0.0596 600 ASN C O 7728 C CB . ASN C 292 ? 0.2755 0.2508 0.4533 -0.0435 -0.0211 0.0403 600 ASN C CB 7729 C CG . ASN C 292 ? 0.3172 0.2828 0.4797 -0.0412 -0.0286 0.0321 600 ASN C CG 7730 O OD1 . ASN C 292 ? 0.2736 0.2443 0.4321 -0.0402 -0.0358 0.0266 600 ASN C OD1 7731 N ND2 . ASN C 292 ? 0.3682 0.3197 0.5216 -0.0397 -0.0266 0.0317 600 ASN C ND2 7732 N N . HIS C 293 ? 0.2188 0.2163 0.4031 -0.0373 -0.0017 0.0553 601 HIS C N 7733 C CA . HIS C 293 ? 0.2447 0.2519 0.4408 -0.0379 0.0076 0.0622 601 HIS C CA 7734 C C . HIS C 293 ? 0.2368 0.2510 0.4221 -0.0309 0.0115 0.0627 601 HIS C C 7735 O O . HIS C 293 ? 0.2126 0.2301 0.3923 -0.0277 0.0052 0.0576 601 HIS C O 7736 C CB . HIS C 293 ? 0.2424 0.2605 0.4598 -0.0426 0.0045 0.0609 601 HIS C CB 7737 C CG . HIS C 293 ? 0.2694 0.2805 0.4930 -0.0486 -0.0014 0.0575 601 HIS C CG 7738 N ND1 . HIS C 293 ? 0.2900 0.2947 0.5161 -0.0517 0.0044 0.0614 601 HIS C ND1 7739 C CD2 . HIS C 293 ? 0.2797 0.2882 0.5063 -0.0521 -0.0126 0.0503 601 HIS C CD2 7740 C CE1 . HIS C 293 ? 0.3030 0.3013 0.5345 -0.0571 -0.0028 0.0566 601 HIS C CE1 7741 N NE2 . HIS C 293 ? 0.2996 0.3000 0.5309 -0.0574 -0.0132 0.0496 601 HIS C NE2 7742 N N . PHE C 294 ? 0.2298 0.2453 0.4112 -0.0285 0.0221 0.0688 602 PHE C N 7743 C CA . PHE C 294 ? 0.2260 0.2473 0.3978 -0.0222 0.0266 0.0689 602 PHE C CA 7744 C C . PHE C 294 ? 0.2023 0.2339 0.3878 -0.0224 0.0369 0.0743 602 PHE C C 7745 O O . PHE C 294 ? 0.2217 0.2513 0.4095 -0.0245 0.0452 0.0806 602 PHE C O 7746 C CB . PHE C 294 ? 0.2483 0.2605 0.3963 -0.0174 0.0295 0.0697 602 PHE C CB 7747 C CG . PHE C 294 ? 0.2265 0.2420 0.3621 -0.0115 0.0309 0.0672 602 PHE C CG 7748 C CD1 . PHE C 294 ? 0.2414 0.2545 0.3665 -0.0090 0.0232 0.0614 602 PHE C CD1 7749 C CD2 . PHE C 294 ? 0.2879 0.3083 0.4220 -0.0086 0.0405 0.0705 602 PHE C CD2 7750 C CE1 . PHE C 294 ? 0.2367 0.2516 0.3513 -0.0043 0.0244 0.0590 602 PHE C CE1 7751 C CE2 . PHE C 294 ? 0.2647 0.2862 0.3870 -0.0034 0.0416 0.0672 602 PHE C CE2 7752 C CZ . PHE C 294 ? 0.2631 0.2816 0.3762 -0.0015 0.0333 0.0615 602 PHE C CZ 7753 N N . ILE C 295 ? 0.1523 0.1947 0.3467 -0.0197 0.0365 0.0721 603 ILE C N 7754 C CA . ILE C 295 ? 0.1930 0.2472 0.4037 -0.0193 0.0462 0.0766 603 ILE C CA 7755 C C . ILE C 295 ? 0.2198 0.2762 0.4183 -0.0115 0.0522 0.0754 603 ILE C C 7756 O O . ILE C 295 ? 0.2029 0.2600 0.3968 -0.0077 0.0459 0.0702 603 ILE C O 7757 C CB . ILE C 295 ? 0.2113 0.2768 0.4452 -0.0219 0.0397 0.0742 603 ILE C CB 7758 C CG1 . ILE C 295 ? 0.2253 0.2862 0.4667 -0.0291 0.0315 0.0727 603 ILE C CG1 7759 C CG2 . ILE C 295 ? 0.2104 0.2862 0.4563 -0.0197 0.0491 0.0774 603 ILE C CG2 7760 C CD1 . ILE C 295 ? 0.2452 0.3012 0.4826 -0.0309 0.0186 0.0669 603 ILE C CD1 7761 N N . ASP C 296 ? 0.2631 0.3195 0.4553 -0.0092 0.0646 0.0800 604 ASP C N 7762 C CA . ASP C 296 ? 0.2891 0.3460 0.4682 -0.0019 0.0711 0.0781 604 ASP C CA 7763 C C . ASP C 296 ? 0.2539 0.3249 0.4544 0.0007 0.0774 0.0790 604 ASP C C 7764 O O . ASP C 296 ? 0.2578 0.3328 0.4636 0.0007 0.0865 0.0827 604 ASP C O 7765 C CB . ASP C 296 ? 0.3233 0.3725 0.4816 0.0001 0.0809 0.0819 604 ASP C CB 7766 C CG . ASP C 296 ? 0.3747 0.4218 0.5154 0.0074 0.0865 0.0785 604 ASP C CG 7767 O OD1 . ASP C 296 ? 0.3566 0.4068 0.5011 0.0110 0.0828 0.0731 604 ASP C OD1 7768 O OD2 . ASP C 296 ? 0.3697 0.4111 0.4918 0.0095 0.0944 0.0810 604 ASP C OD2 7769 N N . LEU C 297 ? 0.2178 0.2932 0.4252 0.0038 0.0701 0.0742 605 LEU C N 7770 C CA . LEU C 297 ? 0.1983 0.2864 0.4255 0.0073 0.0741 0.0745 605 LEU C CA 7771 C C . LEU C 297 ? 0.2126 0.2999 0.4289 0.0154 0.0857 0.0735 605 LEU C C 7772 O O . LEU C 297 ? 0.2294 0.3239 0.4566 0.0194 0.0905 0.0733 605 LEU C O 7773 C CB . LEU C 297 ? 0.1852 0.2787 0.4252 0.0080 0.0616 0.0708 605 LEU C CB 7774 C CG . LEU C 297 ? 0.1855 0.2813 0.4380 0.0006 0.0496 0.0705 605 LEU C CG 7775 C CD1 . LEU C 297 ? 0.1723 0.2735 0.4340 0.0027 0.0380 0.0670 605 LEU C CD1 7776 C CD2 . LEU C 297 ? 0.1807 0.2820 0.4474 -0.0042 0.0536 0.0739 605 LEU C CD2 7777 N N . SER C 298 ? 0.2205 0.2950 0.4092 0.0177 0.0879 0.0713 606 SER C N 7778 C CA . SER C 298 ? 0.2822 0.3532 0.4564 0.0248 0.0985 0.0693 606 SER C CA 7779 C C . SER C 298 ? 0.3392 0.4161 0.5183 0.0252 0.1126 0.0745 606 SER C C 7780 O O . SER C 298 ? 0.3467 0.4236 0.5197 0.0313 0.1220 0.0726 606 SER C O 7781 C CB . SER C 298 ? 0.2839 0.3394 0.4258 0.0261 0.0959 0.0652 606 SER C CB 7782 O OG . SER C 298 ? 0.3159 0.3664 0.4449 0.0223 0.0993 0.0696 606 SER C OG 7783 N N . GLN C 299 ? 0.3349 0.4133 0.5209 0.0184 0.1115 0.0795 607 GLN C N 7784 C CA . GLN C 299 ? 0.3834 0.4650 0.5719 0.0175 0.1215 0.0839 607 GLN C CA 7785 C C . GLN C 299 ? 0.3614 0.4563 0.5775 0.0167 0.1215 0.0848 607 GLN C C 7786 O O . GLN C 299 ? 0.3461 0.4460 0.5687 0.0158 0.1300 0.0886 607 GLN C O 7787 C CB . GLN C 299 ? 0.4354 0.5110 0.6179 0.0108 0.1205 0.0891 607 GLN C CB 7788 C CG . GLN C 299 ? 0.4709 0.5339 0.6273 0.0110 0.1187 0.0890 607 GLN C CG 7789 C CD . GLN C 299 ? 0.5465 0.6038 0.6783 0.0178 0.1278 0.0870 607 GLN C CD 7790 O OE1 . GLN C 299 ? 0.5952 0.6470 0.7125 0.0214 0.1253 0.0826 607 GLN C OE1 7791 N NE2 . GLN C 299 ? 0.5532 0.6115 0.6794 0.0196 0.1384 0.0899 607 GLN C NE2 7792 N N . ILE C 300 ? 0.3334 0.4341 0.5654 0.0169 0.1115 0.0816 608 ILE C N 7793 C CA . ILE C 300 ? 0.3268 0.4405 0.5847 0.0164 0.1095 0.0822 608 ILE C CA 7794 C C . ILE C 300 ? 0.3237 0.4413 0.5863 0.0239 0.1076 0.0778 608 ILE C C 7795 O O . ILE C 300 ? 0.3189 0.4383 0.5895 0.0235 0.0959 0.0752 608 ILE C O 7796 C CB . ILE C 300 ? 0.2502 0.3678 0.5251 0.0082 0.0968 0.0831 608 ILE C CB 7797 C CG1 . ILE C 300 ? 0.3152 0.4254 0.5827 0.0011 0.0975 0.0867 608 ILE C CG1 7798 C CG2 . ILE C 300 ? 0.2263 0.3581 0.5274 0.0069 0.0954 0.0843 608 ILE C CG2 7799 C CD1 . ILE C 300 ? 0.3298 0.4412 0.6112 -0.0069 0.0852 0.0864 608 ILE C CD1 7800 N N . PRO C 301 ? 0.4058 0.5237 0.6622 0.0311 0.1192 0.0767 609 PRO C N 7801 C CA . PRO C 301 ? 0.4230 0.5418 0.6809 0.0395 0.1192 0.0722 609 PRO C CA 7802 C C . PRO C 301 ? 0.3914 0.5228 0.6754 0.0399 0.1117 0.0725 609 PRO C C 7803 O O . PRO C 301 ? 0.3703 0.5007 0.6557 0.0448 0.1053 0.0691 609 PRO C O 7804 C CB . PRO C 301 ? 0.4775 0.5947 0.7250 0.0455 0.1347 0.0717 609 PRO C CB 7805 C CG . PRO C 301 ? 0.4995 0.6103 0.7301 0.0412 0.1413 0.0749 609 PRO C CG 7806 C CD . PRO C 301 ? 0.4653 0.5808 0.7099 0.0319 0.1331 0.0795 609 PRO C CD 7807 N N . CYS C 302 ? 0.3592 0.5022 0.6629 0.0349 0.1123 0.0766 610 CYS C N 7808 C CA . CYS C 302 ? 0.3343 0.4906 0.6631 0.0351 0.1049 0.0770 610 CYS C CA 7809 C C . CYS C 302 ? 0.3151 0.4706 0.6484 0.0303 0.0880 0.0756 610 CYS C C 7810 O O . CYS C 302 ? 0.3143 0.4671 0.6464 0.0224 0.0823 0.0769 610 CYS C O 7811 C CB . CYS C 302 ? 0.3310 0.5003 0.6802 0.0305 0.1102 0.0816 610 CYS C CB 7812 S SG . CYS C 302 ? 0.4144 0.6018 0.7956 0.0302 0.1006 0.0822 610 CYS C SG 7813 N N . ASN C 303 ? 0.2879 0.4451 0.6253 0.0354 0.0799 0.0729 611 ASN C N 7814 C CA . ASN C 303 ? 0.2649 0.4209 0.6038 0.0317 0.0638 0.0714 611 ASN C CA 7815 C C . ASN C 303 ? 0.2519 0.4193 0.6111 0.0241 0.0552 0.0734 611 ASN C C 7816 O O . ASN C 303 ? 0.2383 0.4026 0.5954 0.0182 0.0433 0.0722 611 ASN C O 7817 C CB . ASN C 303 ? 0.2499 0.4042 0.5868 0.0394 0.0575 0.0687 611 ASN C CB 7818 C CG . ASN C 303 ? 0.2792 0.4187 0.5930 0.0449 0.0617 0.0657 611 ASN C CG 7819 O OD1 . ASN C 303 ? 0.2942 0.4241 0.5924 0.0412 0.0611 0.0648 611 ASN C OD1 7820 N ND2 . ASN C 303 ? 0.2661 0.4034 0.5781 0.0538 0.0661 0.0638 611 ASN C ND2 7821 N N . GLY C 304 ? 0.2385 0.4189 0.6171 0.0242 0.0614 0.0762 612 GLY C N 7822 C CA . GLY C 304 ? 0.2294 0.4212 0.6286 0.0166 0.0544 0.0780 612 GLY C CA 7823 C C . GLY C 304 ? 0.2296 0.4160 0.6250 0.0073 0.0558 0.0796 612 GLY C C 7824 O O . GLY C 304 ? 0.2107 0.3972 0.6109 -0.0001 0.0446 0.0786 612 GLY C O 7825 N N . LYS C 305 ? 0.2312 0.4122 0.6168 0.0079 0.0696 0.0819 613 LYS C N 7826 C CA . LYS C 305 ? 0.2430 0.4169 0.6223 0.0000 0.0719 0.0840 613 LYS C CA 7827 C C . LYS C 305 ? 0.2158 0.3756 0.5763 -0.0028 0.0629 0.0811 613 LYS C C 7828 O O . LYS C 305 ? 0.2217 0.3772 0.5826 -0.0106 0.0570 0.0812 613 LYS C O 7829 C CB . LYS C 305 ? 0.2963 0.4669 0.6661 0.0022 0.0888 0.0875 613 LYS C CB 7830 C CG . LYS C 305 ? 0.3757 0.5602 0.7640 0.0044 0.0993 0.0908 613 LYS C CG 7831 C CD . LYS C 305 ? 0.4371 0.6169 0.8124 0.0065 0.1158 0.0940 613 LYS C CD 7832 C CE . LYS C 305 ? 0.4913 0.6850 0.8833 0.0102 0.1274 0.0968 613 LYS C CE 7833 N NZ . LYS C 305 ? 0.5290 0.7176 0.9062 0.0120 0.1436 0.1000 613 LYS C NZ 7834 N N . ALA C 306 ? 0.2164 0.3687 0.5604 0.0036 0.0621 0.0782 614 ALA C N 7835 C CA . ALA C 306 ? 0.1945 0.3348 0.5215 0.0015 0.0538 0.0755 614 ALA C CA 7836 C C . ALA C 306 ? 0.2226 0.3653 0.5578 -0.0030 0.0375 0.0727 614 ALA C C 7837 O O . ALA C 306 ? 0.2357 0.3710 0.5643 -0.0090 0.0304 0.0712 614 ALA C O 7838 C CB . ALA C 306 ? 0.1807 0.3133 0.4898 0.0093 0.0568 0.0731 614 ALA C CB 7839 N N . ALA C 307 ? 0.2318 0.3846 0.5804 0.0002 0.0317 0.0717 615 ALA C N 7840 C CA . ALA C 307 ? 0.2191 0.3752 0.5746 -0.0037 0.0162 0.0691 615 ALA C CA 7841 C C . ALA C 307 ? 0.2197 0.3799 0.5885 -0.0130 0.0124 0.0697 615 ALA C C 7842 O O . ALA C 307 ? 0.2327 0.3885 0.5984 -0.0185 0.0007 0.0666 615 ALA C O 7843 C CB . ALA C 307 ? 0.2121 0.3788 0.5793 0.0022 0.0116 0.0688 615 ALA C CB 7844 N N . ASP C 308 ? 0.2325 0.4005 0.6155 -0.0148 0.0224 0.0735 616 ASP C N 7845 C CA . ASP C 308 ? 0.2153 0.3866 0.6116 -0.0240 0.0201 0.0745 616 ASP C CA 7846 C C . ASP C 308 ? 0.2002 0.3563 0.5806 -0.0296 0.0192 0.0735 616 ASP C C 7847 O O . ASP C 308 ? 0.2240 0.3773 0.6082 -0.0371 0.0106 0.0714 616 ASP C O 7848 C CB . ASP C 308 ? 0.2476 0.4289 0.6600 -0.0246 0.0331 0.0795 616 ASP C CB 7849 C CG . ASP C 308 ? 0.2805 0.4791 0.7141 -0.0208 0.0325 0.0804 616 ASP C CG 7850 O OD1 . ASP C 308 ? 0.2895 0.4969 0.7346 -0.0187 0.0446 0.0843 616 ASP C OD1 7851 O OD2 . ASP C 308 ? 0.2987 0.5022 0.7370 -0.0195 0.0200 0.0774 616 ASP C OD2 7852 N N . ARG C 309 ? 0.1875 0.3336 0.5498 -0.0257 0.0282 0.0749 617 ARG C N 7853 C CA . ARG C 309 ? 0.2165 0.3482 0.5628 -0.0299 0.0286 0.0747 617 ARG C CA 7854 C C . ARG C 309 ? 0.2413 0.3651 0.5779 -0.0321 0.0145 0.0693 617 ARG C C 7855 O O . ARG C 309 ? 0.2494 0.3653 0.5833 -0.0386 0.0093 0.0676 617 ARG C O 7856 C CB . ARG C 309 ? 0.2321 0.3561 0.5603 -0.0243 0.0405 0.0771 617 ARG C CB 7857 C CG . ARG C 309 ? 0.2739 0.3832 0.5845 -0.0276 0.0407 0.0772 617 ARG C CG 7858 C CD . ARG C 309 ? 0.3486 0.4549 0.6658 -0.0349 0.0438 0.0804 617 ARG C CD 7859 N NE . ARG C 309 ? 0.4063 0.4976 0.7059 -0.0372 0.0439 0.0807 617 ARG C NE 7860 C CZ . ARG C 309 ? 0.3920 0.4760 0.6753 -0.0341 0.0541 0.0846 617 ARG C CZ 7861 N NH1 . ARG C 309 ? 0.3699 0.4598 0.6515 -0.0287 0.0653 0.0878 617 ARG C NH1 7862 N NH2 . ARG C 309 ? 0.3992 0.4697 0.6671 -0.0360 0.0529 0.0849 617 ARG C NH2 7863 N N . ILE C 310 ? 0.2213 0.3466 0.5520 -0.0264 0.0088 0.0666 618 ILE C N 7864 C CA . ILE C 310 ? 0.1958 0.3146 0.5164 -0.0277 -0.0046 0.0615 618 ILE C CA 7865 C C . ILE C 310 ? 0.1989 0.3222 0.5318 -0.0342 -0.0163 0.0585 618 ILE C C 7866 O O . ILE C 310 ? 0.2019 0.3163 0.5271 -0.0393 -0.0245 0.0546 618 ILE C O 7867 C CB . ILE C 310 ? 0.1765 0.2974 0.4900 -0.0200 -0.0084 0.0600 618 ILE C CB 7868 C CG1 . ILE C 310 ? 0.1675 0.2817 0.4661 -0.0143 0.0018 0.0617 618 ILE C CG1 7869 C CG2 . ILE C 310 ? 0.1854 0.3014 0.4895 -0.0215 -0.0229 0.0551 618 ILE C CG2 7870 C CD1 . ILE C 310 ? 0.2107 0.3264 0.5032 -0.0061 0.0005 0.0607 618 ILE C CD1 7871 N N . HIS C 311 ? 0.1945 0.3315 0.5462 -0.0339 -0.0170 0.0599 619 HIS C N 7872 C CA . HIS C 311 ? 0.2164 0.3596 0.5812 -0.0401 -0.0282 0.0571 619 HIS C CA 7873 C C . HIS C 311 ? 0.2469 0.3850 0.6171 -0.0490 -0.0266 0.0571 619 HIS C C 7874 O O . HIS C 311 ? 0.2656 0.4003 0.6364 -0.0552 -0.0372 0.0526 619 HIS C O 7875 C CB . HIS C 311 ? 0.1925 0.3532 0.5785 -0.0377 -0.0280 0.0594 619 HIS C CB 7876 C CG . HIS C 311 ? 0.2140 0.3830 0.6158 -0.0446 -0.0388 0.0570 619 HIS C CG 7877 N ND1 . HIS C 311 ? 0.2054 0.3819 0.6266 -0.0511 -0.0346 0.0593 619 HIS C ND1 7878 C CD2 . HIS C 311 ? 0.2203 0.3913 0.6206 -0.0462 -0.0537 0.0523 619 HIS C CD2 7879 C CE1 . HIS C 311 ? 0.2357 0.4189 0.6680 -0.0567 -0.0468 0.0559 619 HIS C CE1 7880 N NE2 . HIS C 311 ? 0.2513 0.4313 0.6706 -0.0537 -0.0586 0.0515 619 HIS C NE2 7881 N N . GLN C 312 ? 0.2825 0.4195 0.6558 -0.0495 -0.0132 0.0621 620 GLN C N 7882 C CA . GLN C 312 ? 0.3358 0.4667 0.7134 -0.0574 -0.0100 0.0632 620 GLN C CA 7883 C C . GLN C 312 ? 0.2921 0.4056 0.6511 -0.0605 -0.0158 0.0591 620 GLN C C 7884 O O . GLN C 312 ? 0.2548 0.3621 0.6169 -0.0680 -0.0202 0.0568 620 GLN C O 7885 C CB . GLN C 312 ? 0.4016 0.5331 0.7811 -0.0558 0.0063 0.0700 620 GLN C CB 7886 C CG . GLN C 312 ? 0.4938 0.6167 0.8744 -0.0632 0.0110 0.0723 620 GLN C CG 7887 C CD . GLN C 312 ? 0.5587 0.6763 0.9296 -0.0600 0.0262 0.0786 620 GLN C CD 7888 O OE1 . GLN C 312 ? 0.6122 0.7394 0.9937 -0.0586 0.0367 0.0836 620 GLN C OE1 7889 N NE2 . GLN C 312 ? 0.5455 0.6480 0.8956 -0.0587 0.0276 0.0782 620 GLN C NE2 7890 N N . ASP C 313 ? 0.2665 0.3721 0.6066 -0.0548 -0.0157 0.0579 621 ASP C N 7891 C CA . ASP C 313 ? 0.2606 0.3504 0.5827 -0.0567 -0.0206 0.0540 621 ASP C CA 7892 C C . ASP C 313 ? 0.2394 0.3270 0.5587 -0.0597 -0.0359 0.0466 621 ASP C C 7893 O O . ASP C 313 ? 0.2587 0.3330 0.5649 -0.0623 -0.0410 0.0423 621 ASP C O 7894 C CB . ASP C 313 ? 0.2517 0.3350 0.5555 -0.0499 -0.0153 0.0553 621 ASP C CB 7895 C CG . ASP C 313 ? 0.3034 0.3836 0.6035 -0.0481 -0.0007 0.0617 621 ASP C CG 7896 O OD1 . ASP C 313 ? 0.3312 0.4083 0.6373 -0.0530 0.0042 0.0645 621 ASP C OD1 7897 O OD2 . ASP C 313 ? 0.3037 0.3839 0.5937 -0.0418 0.0057 0.0638 621 ASP C OD2 7898 N N . GLY C 314 ? 0.2112 0.3115 0.5419 -0.0589 -0.0431 0.0452 622 GLY C N 7899 C CA . GLY C 314 ? 0.1840 0.2835 0.5119 -0.0619 -0.0578 0.0384 622 GLY C CA 7900 C C . GLY C 314 ? 0.1667 0.2596 0.4743 -0.0569 -0.0649 0.0345 622 GLY C C 7901 O O . GLY C 314 ? 0.1823 0.2677 0.4795 -0.0597 -0.0753 0.0282 622 GLY C O 7902 N N . ILE C 315 ? 0.1528 0.2482 0.4543 -0.0494 -0.0590 0.0380 623 ILE C N 7903 C CA . ILE C 315 ? 0.1568 0.2464 0.4392 -0.0443 -0.0644 0.0353 623 ILE C CA 7904 C C . ILE C 315 ? 0.1906 0.2845 0.4700 -0.0438 -0.0780 0.0310 623 ILE C C 7905 O O . ILE C 315 ? 0.1762 0.2827 0.4693 -0.0427 -0.0807 0.0327 623 ILE C O 7906 C CB . ILE C 315 ? 0.1585 0.2521 0.4381 -0.0364 -0.0556 0.0402 623 ILE C CB 7907 C CG1 . ILE C 315 ? 0.1849 0.2742 0.4647 -0.0365 -0.0420 0.0446 623 ILE C CG1 7908 C CG2 . ILE C 315 ? 0.1436 0.2309 0.4036 -0.0315 -0.0610 0.0378 623 ILE C CG2 7909 C CD1 . ILE C 315 ? 0.1973 0.2722 0.4638 -0.0403 -0.0418 0.0423 623 ILE C CD1 7910 N N . HIS C 316 ? 0.1774 0.2611 0.4382 -0.0443 -0.0862 0.0256 624 HIS C N 7911 C CA . HIS C 316 ? 0.1933 0.2794 0.4463 -0.0432 -0.0988 0.0216 624 HIS C CA 7912 C C . HIS C 316 ? 0.2127 0.3000 0.4534 -0.0350 -0.0989 0.0241 624 HIS C C 7913 O O . HIS C 316 ? 0.2106 0.3063 0.4535 -0.0314 -0.1046 0.0253 624 HIS C O 7914 C CB . HIS C 316 ? 0.1788 0.2524 0.4157 -0.0477 -0.1074 0.0139 624 HIS C CB 7915 C CG . HIS C 316 ? 0.1921 0.2625 0.4393 -0.0559 -0.1086 0.0105 624 HIS C CG 7916 N ND1 . HIS C 316 ? 0.2000 0.2587 0.4450 -0.0596 -0.1021 0.0095 624 HIS C ND1 7917 C CD2 . HIS C 316 ? 0.2255 0.3026 0.4852 -0.0613 -0.1157 0.0079 624 HIS C CD2 7918 C CE1 . HIS C 316 ? 0.2117 0.2690 0.4671 -0.0668 -0.1048 0.0066 624 HIS C CE1 7919 N NE2 . HIS C 316 ? 0.2127 0.2815 0.4775 -0.0683 -0.1131 0.0054 624 HIS C NE2 7920 N N . ILE C 317 ? 0.2017 0.2803 0.4293 -0.0320 -0.0928 0.0251 625 ILE C N 7921 C CA . ILE C 317 ? 0.2208 0.2990 0.4363 -0.0245 -0.0918 0.0277 625 ILE C CA 7922 C C . ILE C 317 ? 0.1974 0.2763 0.4173 -0.0208 -0.0792 0.0328 625 ILE C C 7923 O O . ILE C 317 ? 0.1652 0.2373 0.3814 -0.0228 -0.0732 0.0326 625 ILE C O 7924 C CB . ILE C 317 ? 0.2385 0.3054 0.4297 -0.0235 -0.0977 0.0236 625 ILE C CB 7925 C CG1 . ILE C 317 ? 0.2479 0.3133 0.4313 -0.0266 -0.1100 0.0180 625 ILE C CG1 7926 C CG2 . ILE C 317 ? 0.2163 0.2821 0.3951 -0.0160 -0.0955 0.0272 625 ILE C CG2 7927 C CD1 . ILE C 317 ? 0.2736 0.3277 0.4315 -0.0254 -0.1151 0.0137 625 ILE C CD1 7928 N N . LEU C 318 ? 0.1583 0.2451 0.3857 -0.0151 -0.0751 0.0371 626 LEU C N 7929 C CA . LEU C 318 ? 0.1563 0.2435 0.3867 -0.0110 -0.0630 0.0412 626 LEU C CA 7930 C C . LEU C 318 ? 0.1660 0.2477 0.3804 -0.0042 -0.0627 0.0423 626 LEU C C 7931 O O . LEU C 318 ? 0.1791 0.2628 0.3903 -0.0001 -0.0679 0.0430 626 LEU C O 7932 C CB . LEU C 318 ? 0.1442 0.2428 0.3945 -0.0091 -0.0566 0.0449 626 LEU C CB 7933 C CG . LEU C 318 ? 0.1443 0.2436 0.3991 -0.0061 -0.0425 0.0486 626 LEU C CG 7934 C CD1 . LEU C 318 ? 0.1204 0.2156 0.3768 -0.0120 -0.0365 0.0488 626 LEU C CD1 7935 C CD2 . LEU C 318 ? 0.1542 0.2649 0.4267 -0.0027 -0.0369 0.0518 626 LEU C CD2 7936 N N . VAL C 319 ? 0.1444 0.2182 0.3475 -0.0030 -0.0559 0.0425 627 VAL C N 7937 C CA . VAL C 319 ? 0.1747 0.2391 0.3568 0.0020 -0.0551 0.0423 627 VAL C CA 7938 C C . VAL C 319 ? 0.1863 0.2498 0.3684 0.0076 -0.0446 0.0452 627 VAL C C 7939 O O . VAL C 319 ? 0.1728 0.2335 0.3535 0.0069 -0.0350 0.0454 627 VAL C O 7940 C CB . VAL C 319 ? 0.1919 0.2436 0.3522 -0.0008 -0.0547 0.0386 627 VAL C CB 7941 C CG1 . VAL C 319 ? 0.1408 0.1841 0.2814 0.0036 -0.0538 0.0388 627 VAL C CG1 7942 C CG2 . VAL C 319 ? 0.1971 0.2480 0.3556 -0.0057 -0.0648 0.0347 627 VAL C CG2 7943 N N . ASN C 320 ? 0.1820 0.2471 0.3650 0.0133 -0.0469 0.0474 628 ASN C N 7944 C CA . ASN C 320 ? 0.1827 0.2452 0.3650 0.0192 -0.0378 0.0492 628 ASN C CA 7945 C C . ASN C 320 ? 0.1766 0.2250 0.3351 0.0202 -0.0347 0.0475 628 ASN C C 7946 O O . ASN C 320 ? 0.1659 0.2087 0.3133 0.0220 -0.0402 0.0479 628 ASN C O 7947 C CB . ASN C 320 ? 0.1948 0.2630 0.3871 0.0248 -0.0407 0.0518 628 ASN C CB 7948 C CG . ASN C 320 ? 0.1981 0.2643 0.3933 0.0313 -0.0306 0.0532 628 ASN C CG 7949 O OD1 . ASN C 320 ? 0.1971 0.2548 0.3815 0.0321 -0.0230 0.0520 628 ASN C OD1 7950 N ND2 . ASN C 320 ? 0.1857 0.2582 0.3924 0.0356 -0.0303 0.0547 628 ASN C ND2 7951 N N . MET C 321 ? 0.1696 0.2128 0.3205 0.0189 -0.0258 0.0460 629 MET C N 7952 C CA . MET C 321 ? 0.1736 0.2049 0.3040 0.0190 -0.0231 0.0441 629 MET C CA 7953 C C . MET C 321 ? 0.1794 0.2054 0.3061 0.0240 -0.0162 0.0443 629 MET C C 7954 O O . MET C 321 ? 0.2180 0.2345 0.3292 0.0236 -0.0138 0.0425 629 MET C O 7955 C CB . MET C 321 ? 0.1537 0.1816 0.2756 0.0146 -0.0193 0.0420 629 MET C CB 7956 C CG . MET C 321 ? 0.1591 0.1890 0.2821 0.0098 -0.0257 0.0409 629 MET C CG 7957 S SD . MET C 321 ? 0.2085 0.2344 0.3253 0.0056 -0.0206 0.0395 629 MET C SD 7958 C CE . MET C 321 ? 0.2596 0.2758 0.3554 0.0071 -0.0180 0.0379 629 MET C CE 7959 N N . ASN C 322 ? 0.1533 0.1853 0.2949 0.0286 -0.0130 0.0461 630 ASN C N 7960 C CA . ASN C 322 ? 0.1761 0.2017 0.3144 0.0340 -0.0060 0.0455 630 ASN C CA 7961 C C . ASN C 322 ? 0.1918 0.2148 0.3341 0.0397 -0.0097 0.0477 630 ASN C C 7962 O O . ASN C 322 ? 0.1869 0.1985 0.3179 0.0421 -0.0075 0.0466 630 ASN C O 7963 C CB . ASN C 322 ? 0.1797 0.2114 0.3293 0.0366 0.0039 0.0455 630 ASN C CB 7964 C CG . ASN C 322 ? 0.2441 0.2712 0.3811 0.0333 0.0109 0.0430 630 ASN C CG 7965 O OD1 . ASN C 322 ? 0.2322 0.2654 0.3739 0.0294 0.0123 0.0441 630 ASN C OD1 7966 N ND2 . ASN C 322 ? 0.3054 0.3212 0.4261 0.0347 0.0147 0.0399 630 ASN C ND2 7967 N N . GLY C 323 ? 0.1895 0.2230 0.3485 0.0419 -0.0156 0.0510 631 GLY C N 7968 C CA . GLY C 323 ? 0.1955 0.2276 0.3601 0.0485 -0.0182 0.0537 631 GLY C CA 7969 C C . GLY C 323 ? 0.2197 0.2472 0.3876 0.0546 -0.0077 0.0524 631 GLY C C 7970 O O . GLY C 323 ? 0.2181 0.2519 0.3948 0.0553 0.0005 0.0512 631 GLY C O 7971 N N . TYR C 324 ? 0.1774 0.1928 0.3365 0.0589 -0.0071 0.0523 632 TYR C N 7972 C CA . TYR C 324 ? 0.1769 0.1861 0.3378 0.0651 0.0027 0.0500 632 TYR C CA 7973 C C . TYR C 324 ? 0.2034 0.1985 0.3465 0.0629 0.0093 0.0453 632 TYR C C 7974 O O . TYR C 324 ? 0.2399 0.2204 0.3729 0.0654 0.0110 0.0436 632 TYR C O 7975 C CB . TYR C 324 ? 0.2187 0.2226 0.3809 0.0710 0.0002 0.0516 632 TYR C CB 7976 C CG . TYR C 324 ? 0.2461 0.2648 0.4228 0.0721 -0.0069 0.0551 632 TYR C CG 7977 C CD1 . TYR C 324 ? 0.2306 0.2647 0.4252 0.0729 -0.0034 0.0552 632 TYR C CD1 7978 C CD2 . TYR C 324 ? 0.2510 0.2682 0.4231 0.0719 -0.0170 0.0586 632 TYR C CD2 7979 C CE1 . TYR C 324 ? 0.2287 0.2765 0.4373 0.0732 -0.0103 0.0581 632 TYR C CE1 7980 C CE2 . TYR C 324 ? 0.2398 0.2704 0.4243 0.0729 -0.0241 0.0615 632 TYR C CE2 7981 C CZ . TYR C 324 ? 0.2253 0.2712 0.4285 0.0734 -0.0211 0.0610 632 TYR C CZ 7982 O OH . TYR C 324 ? 0.2054 0.2650 0.4220 0.0739 -0.0285 0.0636 632 TYR C OH 7983 N N . THR C 325 ? 0.2162 0.2155 0.3535 0.0571 0.0123 0.0427 633 THR C N 7984 C CA . THR C 325 ? 0.2060 0.1945 0.3244 0.0535 0.0175 0.0376 633 THR C CA 7985 C C . THR C 325 ? 0.2336 0.2275 0.3541 0.0543 0.0273 0.0352 633 THR C C 7986 O O . THR C 325 ? 0.2290 0.2363 0.3659 0.0556 0.0295 0.0380 633 THR C O 7987 C CB . THR C 325 ? 0.2815 0.2685 0.3868 0.0454 0.0113 0.0373 633 THR C CB 7988 O OG1 . THR C 325 ? 0.2909 0.2908 0.4052 0.0420 0.0085 0.0396 633 THR C OG1 7989 C CG2 . THR C 325 ? 0.3054 0.2852 0.4046 0.0442 0.0034 0.0395 633 THR C CG2 7990 N N . LYS C 326 ? 0.2555 0.2390 0.3591 0.0532 0.0328 0.0302 634 LYS C N 7991 C CA . LYS C 326 ? 0.2662 0.2519 0.3669 0.0547 0.0430 0.0277 634 LYS C CA 7992 C C . LYS C 326 ? 0.2391 0.2386 0.3477 0.0508 0.0439 0.0312 634 LYS C C 7993 O O . LYS C 326 ? 0.1909 0.1922 0.2948 0.0445 0.0375 0.0325 634 LYS C O 7994 C CB . LYS C 326 ? 0.3355 0.3077 0.4131 0.0522 0.0454 0.0217 634 LYS C CB 7995 C CG . LYS C 326 ? 0.3986 0.3702 0.4682 0.0546 0.0560 0.0183 634 LYS C CG 7996 C CD . LYS C 326 ? 0.4731 0.4330 0.5188 0.0505 0.0553 0.0128 634 LYS C CD 7997 C CE . LYS C 326 ? 0.5226 0.4822 0.5569 0.0523 0.0649 0.0099 634 LYS C CE 7998 N NZ . LYS C 326 ? 0.5689 0.5226 0.6039 0.0602 0.0744 0.0058 634 LYS C NZ 7999 N N . GLY C 327 ? 0.2621 0.2709 0.3837 0.0546 0.0524 0.0328 635 GLY C N 8000 C CA . GLY C 327 ? 0.2750 0.2960 0.4054 0.0506 0.0546 0.0366 635 GLY C CA 8001 C C . GLY C 327 ? 0.2633 0.2982 0.4173 0.0492 0.0483 0.0416 635 GLY C C 8002 O O . GLY C 327 ? 0.2327 0.2781 0.3978 0.0457 0.0502 0.0450 635 GLY C O 8003 N N . ALA C 328 ? 0.2183 0.2527 0.3795 0.0518 0.0405 0.0423 636 ALA C N 8004 C CA . ALA C 328 ? 0.2072 0.2547 0.3898 0.0508 0.0328 0.0467 636 ALA C CA 8005 C C . ALA C 328 ? 0.1864 0.2497 0.3934 0.0538 0.0398 0.0499 636 ALA C C 8006 O O . ALA C 328 ? 0.1759 0.2396 0.3869 0.0602 0.0503 0.0490 636 ALA C O 8007 C CB . ALA C 328 ? 0.1941 0.2379 0.3791 0.0549 0.0245 0.0475 636 ALA C CB 8008 N N . ARG C 329 ? 0.1601 0.2361 0.3838 0.0488 0.0340 0.0533 637 ARG C N 8009 C CA . ARG C 329 ? 0.1638 0.2532 0.4067 0.0485 0.0369 0.0555 637 ARG C CA 8010 C C . ARG C 329 ? 0.1678 0.2646 0.4220 0.0455 0.0235 0.0570 637 ARG C C 8011 O O . ARG C 329 ? 0.1772 0.2820 0.4411 0.0388 0.0189 0.0584 637 ARG C O 8012 C CB . ARG C 329 ? 0.1788 0.2745 0.4269 0.0433 0.0448 0.0574 637 ARG C CB 8013 C CG . ARG C 329 ? 0.2038 0.2940 0.4407 0.0471 0.0596 0.0563 637 ARG C CG 8014 C CD . ARG C 329 ? 0.1968 0.2906 0.4340 0.0410 0.0664 0.0591 637 ARG C CD 8015 N NE . ARG C 329 ? 0.1885 0.2947 0.4450 0.0381 0.0685 0.0624 637 ARG C NE 8016 C CZ . ARG C 329 ? 0.1966 0.3062 0.4558 0.0331 0.0755 0.0656 637 ARG C CZ 8017 N NH1 . ARG C 329 ? 0.2011 0.3026 0.4437 0.0308 0.0809 0.0662 637 ARG C NH1 8018 N NH2 . ARG C 329 ? 0.2234 0.3440 0.5013 0.0305 0.0769 0.0685 637 ARG C NH2 8019 N N . ASN C 330 ? 0.1808 0.2739 0.4324 0.0504 0.0172 0.0565 638 ASN C N 8020 C CA . ASN C 330 ? 0.1927 0.2913 0.4507 0.0483 0.0040 0.0577 638 ASN C CA 8021 C C . ASN C 330 ? 0.1869 0.3011 0.4670 0.0477 0.0031 0.0598 638 ASN C C 8022 O O . ASN C 330 ? 0.1959 0.3168 0.4829 0.0445 -0.0079 0.0606 638 ASN C O 8023 C CB . ASN C 330 ? 0.2127 0.3019 0.4599 0.0541 -0.0016 0.0574 638 ASN C CB 8024 C CG . ASN C 330 ? 0.2076 0.2817 0.4334 0.0529 -0.0029 0.0556 638 ASN C CG 8025 O OD1 . ASN C 330 ? 0.1946 0.2674 0.4138 0.0467 -0.0077 0.0552 638 ASN C OD1 8026 N ND2 . ASN C 330 ? 0.2185 0.2807 0.4338 0.0588 0.0016 0.0544 638 ASN C ND2 8027 N N . GLU C 331 ? 0.1926 0.3127 0.4832 0.0508 0.0149 0.0605 639 GLU C N 8028 C CA . GLU C 331 ? 0.2247 0.3604 0.5374 0.0493 0.0163 0.0627 639 GLU C CA 8029 C C . GLU C 331 ? 0.2009 0.3429 0.5206 0.0394 0.0102 0.0634 639 GLU C C 8030 O O . GLU C 331 ? 0.2128 0.3669 0.5495 0.0366 0.0045 0.0648 639 GLU C O 8031 C CB . GLU C 331 ? 0.2872 0.4261 0.6059 0.0532 0.0320 0.0632 639 GLU C CB 8032 C CG . GLU C 331 ? 0.3062 0.4415 0.6232 0.0636 0.0382 0.0620 639 GLU C CG 8033 C CD . GLU C 331 ? 0.3564 0.4739 0.6504 0.0674 0.0411 0.0588 639 GLU C CD 8034 O OE1 . GLU C 331 ? 0.4151 0.5263 0.7054 0.0755 0.0438 0.0573 639 GLU C OE1 8035 O OE2 . GLU C 331 ? 0.3294 0.4388 0.6093 0.0625 0.0407 0.0577 639 GLU C OE2 8036 N N . LEU C 332 ? 0.1671 0.3005 0.4736 0.0342 0.0115 0.0624 640 LEU C N 8037 C CA . LEU C 332 ? 0.1842 0.3202 0.4945 0.0248 0.0056 0.0625 640 LEU C CA 8038 C C . LEU C 332 ? 0.1977 0.3354 0.5087 0.0220 -0.0102 0.0611 640 LEU C C 8039 O O . LEU C 332 ? 0.1890 0.3348 0.5125 0.0161 -0.0163 0.0612 640 LEU C O 8040 C CB . LEU C 332 ? 0.1672 0.2919 0.4609 0.0211 0.0089 0.0614 640 LEU C CB 8041 C CG . LEU C 332 ? 0.2031 0.3247 0.4919 0.0231 0.0242 0.0627 640 LEU C CG 8042 C CD1 . LEU C 332 ? 0.1875 0.2983 0.4591 0.0199 0.0252 0.0617 640 LEU C CD1 8043 C CD2 . LEU C 332 ? 0.2225 0.3537 0.5274 0.0193 0.0314 0.0656 640 LEU C CD2 8044 N N . PHE C 333 ? 0.1690 0.2986 0.4655 0.0261 -0.0165 0.0598 641 PHE C N 8045 C CA . PHE C 333 ? 0.1517 0.2816 0.4446 0.0242 -0.0311 0.0586 641 PHE C CA 8046 C C . PHE C 333 ? 0.1451 0.2869 0.4537 0.0280 -0.0360 0.0603 641 PHE C C 8047 O O . PHE C 333 ? 0.1448 0.2926 0.4584 0.0244 -0.0473 0.0597 641 PHE C O 8048 C CB . PHE C 333 ? 0.1531 0.2697 0.4237 0.0271 -0.0355 0.0573 641 PHE C CB 8049 C CG . PHE C 333 ? 0.1595 0.2662 0.4157 0.0225 -0.0339 0.0554 641 PHE C CG 8050 C CD1 . PHE C 333 ? 0.1674 0.2707 0.4153 0.0165 -0.0438 0.0531 641 PHE C CD1 8051 C CD2 . PHE C 333 ? 0.1713 0.2724 0.4222 0.0243 -0.0225 0.0556 641 PHE C CD2 8052 C CE1 . PHE C 333 ? 0.1590 0.2537 0.3947 0.0127 -0.0423 0.0514 641 PHE C CE1 8053 C CE2 . PHE C 333 ? 0.1540 0.2471 0.3926 0.0204 -0.0213 0.0543 641 PHE C CE2 8054 C CZ . PHE C 333 ? 0.1684 0.2586 0.4003 0.0147 -0.0312 0.0523 641 PHE C CZ 8055 N N . ALA C 334 ? 0.1637 0.3089 0.4800 0.0354 -0.0276 0.0622 642 ALA C N 8056 C CA . ALA C 334 ? 0.1405 0.2981 0.4738 0.0401 -0.0310 0.0643 642 ALA C CA 8057 C C . ALA C 334 ? 0.1575 0.3304 0.5126 0.0341 -0.0331 0.0651 642 ALA C C 8058 O O . ALA C 334 ? 0.1660 0.3502 0.5343 0.0350 -0.0414 0.0661 642 ALA C O 8059 C CB . ALA C 334 ? 0.1450 0.3025 0.4826 0.0492 -0.0197 0.0656 642 ALA C CB 8060 N N . LEU C 335 ? 0.1454 0.3185 0.5041 0.0279 -0.0255 0.0648 643 LEU C N 8061 C CA . LEU C 335 ? 0.1639 0.3497 0.5427 0.0211 -0.0265 0.0656 643 LEU C CA 8062 C C . LEU C 335 ? 0.1779 0.3628 0.5538 0.0127 -0.0400 0.0630 643 LEU C C 8063 O O . LEU C 335 ? 0.1815 0.3769 0.5741 0.0068 -0.0438 0.0631 643 LEU C O 8064 C CB . LEU C 335 ? 0.1459 0.3311 0.5287 0.0180 -0.0123 0.0669 643 LEU C CB 8065 C CG . LEU C 335 ? 0.2066 0.3969 0.5976 0.0256 0.0017 0.0693 643 LEU C CG 8066 C CD1 . LEU C 335 ? 0.2365 0.4203 0.6205 0.0238 0.0160 0.0702 643 LEU C CD1 8067 C CD2 . LEU C 335 ? 0.2427 0.4513 0.6602 0.0260 0.0015 0.0717 643 LEU C CD2 8068 N N . ARG C 336 ? 0.1651 0.3371 0.5193 0.0122 -0.0469 0.0605 644 ARG C N 8069 C CA . ARG C 336 ? 0.1950 0.3637 0.5418 0.0052 -0.0597 0.0571 644 ARG C CA 8070 C C . ARG C 336 ? 0.1958 0.3660 0.5515 -0.0045 -0.0590 0.0557 644 ARG C C 8071 O O . ARG C 336 ? 0.1739 0.3528 0.5420 -0.0097 -0.0675 0.0544 644 ARG C O 8072 C CB . ARG C 336 ? 0.2617 0.4396 0.6144 0.0069 -0.0729 0.0569 644 ARG C CB 8073 C CG . ARG C 336 ? 0.3311 0.5040 0.6702 0.0156 -0.0766 0.0581 644 ARG C CG 8074 C CD . ARG C 336 ? 0.4430 0.6273 0.7909 0.0182 -0.0883 0.0590 644 ARG C CD 8075 N NE . ARG C 336 ? 0.5230 0.7036 0.8614 0.0277 -0.0897 0.0615 644 ARG C NE 8076 C CZ . ARG C 336 ? 0.5748 0.7642 0.9190 0.0325 -0.0987 0.0635 644 ARG C CZ 8077 N NH1 . ARG C 336 ? 0.6173 0.8209 0.9774 0.0284 -0.1076 0.0629 644 ARG C NH1 8078 N NH2 . ARG C 336 ? 0.5650 0.7488 0.8993 0.0413 -0.0990 0.0662 644 ARG C NH2 8079 N N . PRO C 337 ? 0.1845 0.3459 0.5335 -0.0071 -0.0492 0.0559 645 PRO C N 8080 C CA . PRO C 337 ? 0.1881 0.3484 0.5435 -0.0162 -0.0481 0.0549 645 PRO C CA 8081 C C . PRO C 337 ? 0.1721 0.3232 0.5146 -0.0223 -0.0600 0.0500 645 PRO C C 8082 O O . PRO C 337 ? 0.1757 0.3257 0.5242 -0.0301 -0.0616 0.0483 645 PRO C O 8083 C CB . PRO C 337 ? 0.1756 0.3278 0.5236 -0.0153 -0.0341 0.0572 645 PRO C CB 8084 C CG . PRO C 337 ? 0.1600 0.3037 0.4895 -0.0082 -0.0331 0.0567 645 PRO C CG 8085 C CD . PRO C 337 ? 0.1752 0.3270 0.5100 -0.0018 -0.0388 0.0572 645 PRO C CD 8086 N N . ALA C 338 ? 0.1415 0.2855 0.4658 -0.0187 -0.0677 0.0476 646 ALA C N 8087 C CA . ALA C 338 ? 0.1603 0.2951 0.4699 -0.0236 -0.0787 0.0424 646 ALA C CA 8088 C C . ALA C 338 ? 0.1867 0.3255 0.4909 -0.0210 -0.0917 0.0404 646 ALA C C 8089 O O . ALA C 338 ? 0.1905 0.3346 0.4955 -0.0137 -0.0914 0.0435 646 ALA C O 8090 C CB . ALA C 338 ? 0.1627 0.2827 0.4510 -0.0224 -0.0750 0.0411 646 ALA C CB 8091 N N . PRO C 339 ? 0.2101 0.3460 0.5083 -0.0266 -0.1031 0.0354 647 PRO C N 8092 C CA . PRO C 339 ? 0.2204 0.3607 0.5127 -0.0245 -0.1159 0.0336 647 PRO C CA 8093 C C . PRO C 339 ? 0.2347 0.3657 0.5028 -0.0181 -0.1184 0.0337 647 PRO C C 8094 O O . PRO C 339 ? 0.2574 0.3932 0.5218 -0.0133 -0.1253 0.0352 647 PRO C O 8095 C CB . PRO C 339 ? 0.2358 0.3733 0.5260 -0.0330 -0.1258 0.0274 647 PRO C CB 8096 C CG . PRO C 339 ? 0.2265 0.3521 0.5121 -0.0380 -0.1186 0.0253 647 PRO C CG 8097 C CD . PRO C 339 ? 0.2315 0.3607 0.5299 -0.0354 -0.1045 0.0311 647 PRO C CD 8098 N N . ILE C 340 ? 0.2089 0.3267 0.4610 -0.0181 -0.1129 0.0326 648 ILE C N 8099 C CA . ILE C 340 ? 0.2270 0.3356 0.4567 -0.0125 -0.1139 0.0331 648 ILE C CA 8100 C C . ILE C 340 ? 0.2113 0.3152 0.4395 -0.0083 -0.1014 0.0367 648 ILE C C 8101 O O . ILE C 340 ? 0.1818 0.2818 0.4133 -0.0118 -0.0940 0.0362 648 ILE C O 8102 C CB . ILE C 340 ? 0.2497 0.3461 0.4577 -0.0163 -0.1203 0.0274 648 ILE C CB 8103 C CG1 . ILE C 340 ? 0.2653 0.3654 0.4727 -0.0207 -0.1328 0.0227 648 ILE C CG1 8104 C CG2 . ILE C 340 ? 0.2521 0.3394 0.4370 -0.0105 -0.1200 0.0286 648 ILE C CG2 8105 C CD1 . ILE C 340 ? 0.2933 0.3812 0.4823 -0.0256 -0.1381 0.0157 648 ILE C CD1 8106 N N . GLN C 341 ? 0.1982 0.3022 0.4214 -0.0009 -0.0990 0.0406 649 GLN C N 8107 C CA . GLN C 341 ? 0.1898 0.2887 0.4102 0.0033 -0.0876 0.0435 649 GLN C CA 8108 C C . GLN C 341 ? 0.1865 0.2753 0.3850 0.0083 -0.0891 0.0443 649 GLN C C 8109 O O . GLN C 341 ? 0.1994 0.2893 0.3925 0.0125 -0.0950 0.0460 649 GLN C O 8110 C CB . GLN C 341 ? 0.1700 0.2787 0.4098 0.0076 -0.0798 0.0475 649 GLN C CB 8111 C CG . GLN C 341 ? 0.1537 0.2731 0.4154 0.0023 -0.0782 0.0472 649 GLN C CG 8112 C CD . GLN C 341 ? 0.1803 0.3091 0.4607 0.0063 -0.0682 0.0511 649 GLN C CD 8113 O OE1 . GLN C 341 ? 0.1813 0.3151 0.4757 0.0025 -0.0614 0.0517 649 GLN C OE1 8114 N NE2 . GLN C 341 ? 0.1663 0.2970 0.4466 0.0142 -0.0669 0.0537 649 GLN C NE2 8115 N N . ALA C 342 ? 0.1725 0.2514 0.3585 0.0078 -0.0837 0.0436 650 ALA C N 8116 C CA . ALA C 342 ? 0.1654 0.2338 0.3296 0.0112 -0.0849 0.0442 650 ALA C CA 8117 C C . ALA C 342 ? 0.1662 0.2285 0.3267 0.0152 -0.0746 0.0466 650 ALA C C 8118 O O . ALA C 342 ? 0.1542 0.2171 0.3221 0.0137 -0.0669 0.0463 650 ALA C O 8119 C CB . ALA C 342 ? 0.1790 0.2400 0.3272 0.0065 -0.0904 0.0400 650 ALA C CB 8120 N N . MET C 343 ? 0.1324 0.1882 0.2806 0.0202 -0.0744 0.0491 651 MET C N 8121 C CA . MET C 343 ? 0.1378 0.1849 0.2785 0.0235 -0.0658 0.0507 651 MET C CA 8122 C C . MET C 343 ? 0.1759 0.2135 0.2980 0.0203 -0.0661 0.0488 651 MET C C 8123 O O . MET C 343 ? 0.2143 0.2490 0.3239 0.0189 -0.0734 0.0482 651 MET C O 8124 C CB . MET C 343 ? 0.1622 0.2046 0.2972 0.0295 -0.0657 0.0542 651 MET C CB 8125 C CG . MET C 343 ? 0.1622 0.2135 0.3144 0.0338 -0.0654 0.0562 651 MET C CG 8126 S SD . MET C 343 ? 0.2278 0.2816 0.3953 0.0367 -0.0528 0.0561 651 MET C SD 8127 C CE . MET C 343 ? 0.2014 0.2388 0.3516 0.0405 -0.0466 0.0569 651 MET C CE 8128 N N . TRP C 344 ? 0.1880 0.2201 0.3049 0.0188 -0.0566 0.0468 652 TRP C N 8129 C CA . TRP C 344 ? 0.1930 0.2164 0.2913 0.0155 -0.0548 0.0439 652 TRP C CA 8130 C C . TRP C 344 ? 0.2085 0.2247 0.2990 0.0160 -0.0454 0.0433 652 TRP C C 8131 O O . TRP C 344 ? 0.1846 0.2026 0.2820 0.0157 -0.0388 0.0424 652 TRP C O 8132 C CB . TRP C 344 ? 0.1852 0.2109 0.2847 0.0103 -0.0567 0.0400 652 TRP C CB 8133 C CG . TRP C 344 ? 0.2064 0.2240 0.2886 0.0078 -0.0542 0.0370 652 TRP C CG 8134 C CD1 . TRP C 344 ? 0.2258 0.2376 0.2915 0.0080 -0.0569 0.0365 652 TRP C CD1 8135 C CD2 . TRP C 344 ? 0.1800 0.1951 0.2608 0.0053 -0.0481 0.0346 652 TRP C CD2 8136 N NE1 . TRP C 344 ? 0.2065 0.2135 0.2623 0.0059 -0.0527 0.0336 652 TRP C NE1 8137 C CE2 . TRP C 344 ? 0.1811 0.1898 0.2458 0.0044 -0.0477 0.0325 652 TRP C CE2 8138 C CE3 . TRP C 344 ? 0.1972 0.2150 0.2886 0.0039 -0.0426 0.0346 652 TRP C CE3 8139 C CZ2 . TRP C 344 ? 0.2288 0.2341 0.2889 0.0027 -0.0429 0.0303 652 TRP C CZ2 8140 C CZ3 . TRP C 344 ? 0.1911 0.2045 0.2761 0.0020 -0.0380 0.0329 652 TRP C CZ3 8141 C CH2 . TRP C 344 ? 0.2162 0.2237 0.2864 0.0016 -0.0385 0.0307 652 TRP C CH2 8142 N N . LEU C 345 ? 0.1880 0.1963 0.2641 0.0167 -0.0451 0.0442 653 LEU C N 8143 C CA . LEU C 345 ? 0.2306 0.2319 0.2958 0.0153 -0.0385 0.0427 653 LEU C CA 8144 C C . LEU C 345 ? 0.2531 0.2504 0.3208 0.0178 -0.0319 0.0432 653 LEU C C 8145 O O . LEU C 345 ? 0.2560 0.2457 0.3142 0.0176 -0.0294 0.0434 653 LEU C O 8146 C CB . LEU C 345 ? 0.2342 0.2368 0.2970 0.0115 -0.0361 0.0392 653 LEU C CB 8147 C CG . LEU C 345 ? 0.2529 0.2500 0.3043 0.0098 -0.0312 0.0377 653 LEU C CG 8148 C CD1 . LEU C 345 ? 0.2733 0.2661 0.3126 0.0092 -0.0336 0.0386 653 LEU C CD1 8149 C CD2 . LEU C 345 ? 0.2173 0.2161 0.2683 0.0072 -0.0292 0.0350 653 LEU C CD2 8150 N N . GLY C 346 ? 0.2133 0.2154 0.2938 0.0199 -0.0287 0.0431 654 GLY C N 8151 C CA . GLY C 346 ? 0.2213 0.2190 0.3021 0.0222 -0.0213 0.0422 654 GLY C CA 8152 C C . GLY C 346 ? 0.2506 0.2432 0.3340 0.0272 -0.0209 0.0444 654 GLY C C 8153 O O . GLY C 346 ? 0.3220 0.3073 0.4014 0.0288 -0.0153 0.0428 654 GLY C O 8154 N N . TYR C 347 ? 0.2079 0.2038 0.2976 0.0299 -0.0272 0.0480 655 TYR C N 8155 C CA . TYR C 347 ? 0.2184 0.2093 0.3122 0.0356 -0.0271 0.0510 655 TYR C CA 8156 C C . TYR C 347 ? 0.2394 0.2252 0.3246 0.0359 -0.0341 0.0551 655 TYR C C 8157 O O . TYR C 347 ? 0.2288 0.2214 0.3167 0.0358 -0.0416 0.0575 655 TYR C O 8158 C CB . TYR C 347 ? 0.2106 0.2117 0.3239 0.0407 -0.0274 0.0528 655 TYR C CB 8159 C CG . TYR C 347 ? 0.1905 0.1864 0.3097 0.0479 -0.0265 0.0559 655 TYR C CG 8160 C CD1 . TYR C 347 ? 0.2040 0.1900 0.3201 0.0508 -0.0182 0.0534 655 TYR C CD1 8161 C CD2 . TYR C 347 ? 0.1848 0.1846 0.3071 0.0504 -0.0332 0.0590 655 TYR C CD2 8162 C CE1 . TYR C 347 ? 0.2353 0.2148 0.3549 0.0573 -0.0168 0.0551 655 TYR C CE1 8163 C CE2 . TYR C 347 ? 0.2065 0.2009 0.3310 0.0565 -0.0318 0.0607 655 TYR C CE2 8164 C CZ . TYR C 347 ? 0.2279 0.2120 0.3514 0.0599 -0.0235 0.0587 655 TYR C CZ 8165 O OH . TYR C 347 ? 0.2659 0.2431 0.3912 0.0663 -0.0221 0.0601 655 TYR C OH 8166 N N . PRO C 348 ? 0.2266 0.1999 0.3010 0.0359 -0.0316 0.0559 656 PRO C N 8167 C CA . PRO C 348 ? 0.2272 0.1942 0.2914 0.0356 -0.0366 0.0606 656 PRO C CA 8168 C C . PRO C 348 ? 0.2615 0.2267 0.3308 0.0418 -0.0398 0.0651 656 PRO C C 8169 O O . PRO C 348 ? 0.2558 0.2095 0.3179 0.0432 -0.0382 0.0676 656 PRO C O 8170 C CB . PRO C 348 ? 0.2386 0.1931 0.2912 0.0322 -0.0311 0.0592 656 PRO C CB 8171 C CG . PRO C 348 ? 0.2627 0.2139 0.3219 0.0344 -0.0244 0.0550 656 PRO C CG 8172 C CD . PRO C 348 ? 0.2238 0.1878 0.2940 0.0354 -0.0237 0.0523 656 PRO C CD 8173 N N . GLY C 349 ? 0.2336 0.2106 0.3145 0.0447 -0.0437 0.0652 657 GLY C N 8174 C CA . GLY C 349 ? 0.2314 0.2092 0.3165 0.0503 -0.0471 0.0686 657 GLY C CA 8175 C C . GLY C 349 ? 0.2397 0.2330 0.3378 0.0516 -0.0528 0.0683 657 GLY C C 8176 O O . GLY C 349 ? 0.2371 0.2396 0.3413 0.0477 -0.0535 0.0653 657 GLY C O 8177 N N . THR C 350 ? 0.2527 0.2487 0.3554 0.0568 -0.0571 0.0716 658 THR C N 8178 C CA . THR C 350 ? 0.2755 0.2869 0.3925 0.0580 -0.0628 0.0714 658 THR C CA 8179 C C . THR C 350 ? 0.2038 0.2227 0.3403 0.0609 -0.0565 0.0693 658 THR C C 8180 O O . THR C 350 ? 0.1937 0.2049 0.3323 0.0652 -0.0493 0.0691 658 THR C O 8181 C CB . THR C 350 ? 0.2531 0.2661 0.3683 0.0629 -0.0704 0.0761 658 THR C CB 8182 O OG1 . THR C 350 ? 0.2829 0.3119 0.4123 0.0629 -0.0769 0.0755 658 THR C OG1 8183 C CG2 . THR C 350 ? 0.2921 0.2971 0.4109 0.0704 -0.0662 0.0791 658 THR C CG2 8184 N N . SER C 351 ? 0.1892 0.2226 0.3397 0.0583 -0.0589 0.0674 659 SER C N 8185 C CA . SER C 351 ? 0.1772 0.2199 0.3474 0.0609 -0.0527 0.0660 659 SER C CA 8186 C C . SER C 351 ? 0.2096 0.2574 0.3909 0.0682 -0.0552 0.0692 659 SER C C 8187 O O . SER C 351 ? 0.2387 0.2903 0.4338 0.0729 -0.0484 0.0687 659 SER C O 8188 C CB . SER C 351 ? 0.2219 0.2783 0.4042 0.0551 -0.0546 0.0637 659 SER C CB 8189 O OG . SER C 351 ? 0.1915 0.2585 0.3804 0.0544 -0.0646 0.0651 659 SER C OG 8190 N N . GLY C 352 ? 0.2094 0.2578 0.3844 0.0695 -0.0647 0.0724 660 GLY C N 8191 C CA . GLY C 352 ? 0.2249 0.2797 0.4107 0.0766 -0.0688 0.0759 660 GLY C CA 8192 C C . GLY C 352 ? 0.2677 0.3416 0.4759 0.0758 -0.0711 0.0749 660 GLY C C 8193 O O . GLY C 352 ? 0.2652 0.3475 0.4860 0.0816 -0.0745 0.0776 660 GLY C O 8194 N N . ALA C 353 ? 0.2417 0.3225 0.4554 0.0685 -0.0694 0.0714 661 ALA C N 8195 C CA . ALA C 353 ? 0.2901 0.3879 0.5265 0.0668 -0.0690 0.0704 661 ALA C CA 8196 C C . ALA C 353 ? 0.2854 0.3940 0.5251 0.0611 -0.0806 0.0699 661 ALA C C 8197 O O . ALA C 353 ? 0.3034 0.4074 0.5299 0.0546 -0.0848 0.0676 661 ALA C O 8198 C CB . ALA C 353 ? 0.3073 0.4055 0.5496 0.0628 -0.0583 0.0672 661 ALA C CB 8199 N N . LEU C 354 ? 0.2876 0.4108 0.5454 0.0635 -0.0856 0.0716 662 LEU C N 8200 C CA . LEU C 354 ? 0.3205 0.4543 0.5821 0.0582 -0.0974 0.0707 662 LEU C CA 8201 C C . LEU C 354 ? 0.2981 0.4367 0.5663 0.0486 -0.0960 0.0665 662 LEU C C 8202 O O . LEU C 354 ? 0.3003 0.4422 0.5649 0.0425 -0.1055 0.0642 662 LEU C O 8203 C CB . LEU C 354 ? 0.3971 0.5464 0.6784 0.0632 -0.1032 0.0736 662 LEU C CB 8204 C CG . LEU C 354 ? 0.4541 0.5991 0.7278 0.0727 -0.1079 0.0782 662 LEU C CG 8205 C CD1 . LEU C 354 ? 0.4786 0.6409 0.7714 0.0767 -0.1162 0.0809 662 LEU C CD1 8206 C CD2 . LEU C 354 ? 0.4739 0.6059 0.7204 0.0714 -0.1150 0.0788 662 LEU C CD2 8207 N N . PHE C 355 ? 0.2738 0.4120 0.5505 0.0473 -0.0843 0.0654 663 PHE C N 8208 C CA . PHE C 355 ? 0.2358 0.3770 0.5183 0.0385 -0.0819 0.0622 663 PHE C CA 8209 C C . PHE C 355 ? 0.2295 0.3572 0.4907 0.0332 -0.0825 0.0592 663 PHE C C 8210 O O . PHE C 355 ? 0.2084 0.3368 0.4717 0.0258 -0.0821 0.0564 663 PHE C O 8211 C CB . PHE C 355 ? 0.2203 0.3673 0.5200 0.0390 -0.0688 0.0627 663 PHE C CB 8212 C CG . PHE C 355 ? 0.2246 0.3611 0.5159 0.0450 -0.0573 0.0635 663 PHE C CG 8213 C CD1 . PHE C 355 ? 0.2359 0.3596 0.5106 0.0423 -0.0522 0.0615 663 PHE C CD1 8214 C CD2 . PHE C 355 ? 0.2329 0.3725 0.5334 0.0535 -0.0516 0.0658 663 PHE C CD2 8215 C CE1 . PHE C 355 ? 0.2296 0.3435 0.4963 0.0476 -0.0421 0.0617 663 PHE C CE1 8216 C CE2 . PHE C 355 ? 0.2166 0.3454 0.5086 0.0590 -0.0411 0.0656 663 PHE C CE2 8217 C CZ . PHE C 355 ? 0.2269 0.3428 0.5018 0.0557 -0.0365 0.0635 663 PHE C CZ 8218 N N . MET C 356 ? 0.2210 0.3361 0.4619 0.0370 -0.0832 0.0600 664 MET C N 8219 C CA . MET C 356 ? 0.2083 0.3115 0.4285 0.0325 -0.0850 0.0574 664 MET C CA 8220 C C . MET C 356 ? 0.2310 0.3332 0.4382 0.0312 -0.0977 0.0569 664 MET C C 8221 O O . MET C 356 ? 0.2536 0.3553 0.4556 0.0369 -0.1022 0.0600 664 MET C O 8222 C CB . MET C 356 ? 0.1808 0.2703 0.3857 0.0366 -0.0774 0.0586 664 MET C CB 8223 C CG . MET C 356 ? 0.1875 0.2764 0.4014 0.0382 -0.0645 0.0585 664 MET C CG 8224 S SD . MET C 356 ? 0.1890 0.2829 0.4128 0.0303 -0.0593 0.0557 664 MET C SD 8225 C CE . MET C 356 ? 0.1237 0.2079 0.3271 0.0240 -0.0663 0.0526 664 MET C CE 8226 N N . ASP C 357 ? 0.2086 0.3099 0.4099 0.0241 -0.1032 0.0528 665 ASP C N 8227 C CA . ASP C 357 ? 0.2391 0.3402 0.4279 0.0224 -0.1153 0.0513 665 ASP C CA 8228 C C . ASP C 357 ? 0.2470 0.3346 0.4089 0.0237 -0.1167 0.0514 665 ASP C C 8229 O O . ASP C 357 ? 0.2267 0.3128 0.3763 0.0270 -0.1236 0.0535 665 ASP C O 8230 C CB . ASP C 357 ? 0.2455 0.3512 0.4398 0.0141 -0.1210 0.0461 665 ASP C CB 8231 C CG . ASP C 357 ? 0.2618 0.3816 0.4831 0.0119 -0.1203 0.0463 665 ASP C CG 8232 O OD1 . ASP C 357 ? 0.2713 0.4016 0.5033 0.0153 -0.1257 0.0488 665 ASP C OD1 8233 O OD2 . ASP C 357 ? 0.2467 0.3673 0.4786 0.0068 -0.1142 0.0444 665 ASP C OD2 8234 N N . TYR C 358 ? 0.2227 0.3009 0.3757 0.0212 -0.1098 0.0496 666 TYR C N 8235 C CA . TYR C 358 ? 0.2269 0.2927 0.3552 0.0212 -0.1104 0.0491 666 TYR C CA 8236 C C . TYR C 358 ? 0.2044 0.2613 0.3277 0.0239 -0.1000 0.0514 666 TYR C C 8237 O O . TYR C 358 ? 0.2033 0.2626 0.3403 0.0239 -0.0922 0.0515 666 TYR C O 8238 C CB . TYR C 358 ? 0.2131 0.2754 0.3328 0.0144 -0.1138 0.0433 666 TYR C CB 8239 C CG . TYR C 358 ? 0.2385 0.3062 0.3571 0.0110 -0.1249 0.0397 666 TYR C CG 8240 C CD1 . TYR C 358 ? 0.2541 0.3191 0.3545 0.0132 -0.1325 0.0404 666 TYR C CD1 8241 C CD2 . TYR C 358 ? 0.2248 0.2998 0.3599 0.0053 -0.1276 0.0357 666 TYR C CD2 8242 C CE1 . TYR C 358 ? 0.2753 0.3451 0.3734 0.0101 -0.1430 0.0365 666 TYR C CE1 8243 C CE2 . TYR C 358 ? 0.2571 0.3364 0.3910 0.0018 -0.1381 0.0317 666 TYR C CE2 8244 C CZ . TYR C 358 ? 0.2793 0.3562 0.3944 0.0043 -0.1460 0.0319 666 TYR C CZ 8245 O OH . TYR C 358 ? 0.2946 0.3759 0.4074 0.0007 -0.1569 0.0275 666 TYR C OH 8246 N N . ILE C 359 ? 0.2153 0.2618 0.3183 0.0259 -0.0996 0.0533 667 ILE C N 8247 C CA . ILE C 359 ? 0.2063 0.2431 0.3014 0.0264 -0.0908 0.0542 667 ILE C CA 8248 C C . ILE C 359 ? 0.2133 0.2426 0.2888 0.0226 -0.0927 0.0517 667 ILE C C 8249 O O . ILE C 359 ? 0.2265 0.2530 0.2866 0.0229 -0.0987 0.0522 667 ILE C O 8250 C CB . ILE C 359 ? 0.2393 0.2692 0.3297 0.0323 -0.0864 0.0593 667 ILE C CB 8251 C CG1 . ILE C 359 ? 0.2634 0.2829 0.3455 0.0316 -0.0777 0.0595 667 ILE C CG1 8252 C CG2 . ILE C 359 ? 0.2438 0.2700 0.3187 0.0349 -0.0929 0.0627 667 ILE C CG2 8253 C CD1 . ILE C 359 ? 0.2927 0.3041 0.3726 0.0365 -0.0724 0.0635 667 ILE C CD1 8254 N N . ILE C 360 ? 0.1999 0.2264 0.2758 0.0193 -0.0876 0.0490 668 ILE C N 8255 C CA . ILE C 360 ? 0.2092 0.2289 0.2674 0.0162 -0.0886 0.0462 668 ILE C CA 8256 C C . ILE C 360 ? 0.2492 0.2591 0.2915 0.0181 -0.0821 0.0494 668 ILE C C 8257 O O . ILE C 360 ? 0.2593 0.2659 0.3051 0.0187 -0.0736 0.0503 668 ILE C O 8258 C CB . ILE C 360 ? 0.1879 0.2080 0.2508 0.0115 -0.0834 0.0405 668 ILE C CB 8259 C CG1 . ILE C 360 ? 0.1807 0.2097 0.2593 0.0086 -0.0907 0.0377 668 ILE C CG1 8260 C CG2 . ILE C 360 ? 0.2300 0.2422 0.2733 0.0091 -0.0811 0.0367 668 ILE C CG2 8261 C CD1 . ILE C 360 ? 0.2050 0.2345 0.2923 0.0042 -0.0854 0.0335 668 ILE C CD1 8262 N N . THR C 361 ? 0.2397 0.2450 0.2644 0.0188 -0.0866 0.0513 669 THR C N 8263 C CA . THR C 361 ? 0.2305 0.2270 0.2412 0.0203 -0.0812 0.0556 669 THR C CA 8264 C C . THR C 361 ? 0.2290 0.2212 0.2180 0.0186 -0.0830 0.0541 669 THR C C 8265 O O . THR C 361 ? 0.2493 0.2436 0.2350 0.0158 -0.0850 0.0480 669 THR C O 8266 C CB . THR C 361 ? 0.2571 0.2523 0.2711 0.0252 -0.0818 0.0616 669 THR C CB 8267 O OG1 . THR C 361 ? 0.2556 0.2408 0.2560 0.0259 -0.0768 0.0663 669 THR C OG1 8268 C CG2 . THR C 361 ? 0.2550 0.2559 0.2675 0.0274 -0.0908 0.0623 669 THR C CG2 8269 N N . ASP C 362 ? 0.2470 0.2326 0.2213 0.0203 -0.0816 0.0597 670 ASP C N 8270 C CA . ASP C 362 ? 0.2514 0.2332 0.2039 0.0192 -0.0823 0.0588 670 ASP C CA 8271 C C . ASP C 362 ? 0.2606 0.2374 0.2000 0.0223 -0.0833 0.0665 670 ASP C C 8272 O O . ASP C 362 ? 0.2737 0.2493 0.2219 0.0252 -0.0818 0.0713 670 ASP C O 8273 C CB . ASP C 362 ? 0.2685 0.2471 0.2150 0.0160 -0.0718 0.0554 670 ASP C CB 8274 C CG . ASP C 362 ? 0.2617 0.2357 0.2117 0.0158 -0.0634 0.0603 670 ASP C CG 8275 O OD1 . ASP C 362 ? 0.2791 0.2473 0.2166 0.0162 -0.0607 0.0660 670 ASP C OD1 8276 O OD2 . ASP C 362 ? 0.2819 0.2575 0.2468 0.0149 -0.0594 0.0584 670 ASP C OD2 8277 N N . GLN C 363 ? 0.2808 0.2545 0.1989 0.0221 -0.0842 0.0667 671 GLN C N 8278 C CA . GLN C 363 ? 0.3654 0.3359 0.2703 0.0253 -0.0846 0.0734 671 GLN C CA 8279 C C . GLN C 363 ? 0.3248 0.2875 0.2286 0.0257 -0.0757 0.0810 671 GLN C C 8280 O O . GLN C 363 ? 0.3048 0.2644 0.2067 0.0293 -0.0759 0.0875 671 GLN C O 8281 C CB . GLN C 363 ? 0.4424 0.4118 0.3236 0.0249 -0.0864 0.0715 671 GLN C CB 8282 C CG . GLN C 363 ? 0.5397 0.5072 0.4063 0.0284 -0.0873 0.0788 671 GLN C CG 8283 C CD . GLN C 363 ? 0.6283 0.5942 0.4698 0.0276 -0.0862 0.0772 671 GLN C CD 8284 O OE1 . GLN C 363 ? 0.6240 0.5910 0.4591 0.0253 -0.0881 0.0688 671 GLN C OE1 8285 N NE2 . GLN C 363 ? 0.6809 0.6436 0.5079 0.0296 -0.0827 0.0853 671 GLN C NE2 8286 N N . GLU C 364 ? 0.2955 0.2548 0.2011 0.0218 -0.0680 0.0801 672 GLU C N 8287 C CA . GLU C 364 ? 0.3158 0.2677 0.2220 0.0207 -0.0595 0.0864 672 GLU C CA 8288 C C . GLU C 364 ? 0.3156 0.2660 0.2411 0.0224 -0.0591 0.0875 672 GLU C C 8289 O O . GLU C 364 ? 0.3373 0.2804 0.2628 0.0243 -0.0561 0.0932 672 GLU C O 8290 C CB . GLU C 364 ? 0.3480 0.3000 0.2532 0.0157 -0.0502 0.0832 672 GLU C CB 8291 C CG . GLU C 364 ? 0.4076 0.3610 0.2943 0.0146 -0.0473 0.0812 672 GLU C CG 8292 C CD . GLU C 364 ? 0.4594 0.4064 0.3261 0.0161 -0.0470 0.0901 672 GLU C CD 8293 O OE1 . GLU C 364 ? 0.4321 0.3731 0.3018 0.0161 -0.0426 0.0972 672 GLU C OE1 8294 O OE2 . GLU C 364 ? 0.4806 0.4288 0.3297 0.0177 -0.0497 0.0885 672 GLU C OE2 8295 N N . THR C 365 ? 0.2897 0.2460 0.2307 0.0219 -0.0615 0.0818 673 THR C N 8296 C CA . THR C 365 ? 0.2658 0.2214 0.2248 0.0239 -0.0603 0.0817 673 THR C CA 8297 C C . THR C 365 ? 0.2642 0.2213 0.2277 0.0296 -0.0660 0.0844 673 THR C C 8298 O O . THR C 365 ? 0.2884 0.2397 0.2580 0.0325 -0.0635 0.0878 673 THR C O 8299 C CB . THR C 365 ? 0.2586 0.2214 0.2322 0.0222 -0.0607 0.0750 673 THR C CB 8300 O OG1 . THR C 365 ? 0.2707 0.2340 0.2409 0.0175 -0.0534 0.0702 673 THR C OG1 8301 C CG2 . THR C 365 ? 0.2554 0.2172 0.2459 0.0246 -0.0583 0.0750 673 THR C CG2 8302 N N . SER C 366 ? 0.2663 0.2311 0.2269 0.0311 -0.0738 0.0825 674 SER C N 8303 C CA . SER C 366 ? 0.2889 0.2580 0.2560 0.0364 -0.0803 0.0847 674 SER C CA 8304 C C . SER C 366 ? 0.3218 0.2932 0.2729 0.0381 -0.0870 0.0869 674 SER C C 8305 O O . SER C 366 ? 0.3284 0.3089 0.2814 0.0377 -0.0946 0.0826 674 SER C O 8306 C CB . SER C 366 ? 0.2958 0.2756 0.2826 0.0366 -0.0843 0.0793 674 SER C CB 8307 O OG . SER C 366 ? 0.2833 0.2619 0.2827 0.0346 -0.0777 0.0765 674 SER C OG 8308 N N . PRO C 367 ? 0.3943 0.3573 0.3292 0.0398 -0.0842 0.0935 675 PRO C N 8309 C CA . PRO C 367 ? 0.4177 0.3829 0.3352 0.0418 -0.0900 0.0962 675 PRO C CA 8310 C C . PRO C 367 ? 0.4288 0.4029 0.3548 0.0464 -0.0998 0.0964 675 PRO C C 8311 O O . PRO C 367 ? 0.3768 0.3516 0.3187 0.0501 -0.1004 0.0983 675 PRO C O 8312 C CB . PRO C 367 ? 0.4509 0.4047 0.3546 0.0438 -0.0837 0.1050 675 PRO C CB 8313 C CG . PRO C 367 ? 0.4519 0.3975 0.3688 0.0435 -0.0766 0.1065 675 PRO C CG 8314 C CD . PRO C 367 ? 0.3928 0.3440 0.3245 0.0393 -0.0753 0.0987 675 PRO C CD 8315 N N . ALA C 368 ? 0.4783 0.4592 0.3936 0.0460 -0.1076 0.0941 676 ALA C N 8316 C CA . ALA C 368 ? 0.5222 0.5135 0.4462 0.0492 -0.1181 0.0933 676 ALA C CA 8317 C C . ALA C 368 ? 0.5426 0.5320 0.4691 0.0564 -0.1197 0.1019 676 ALA C C 8318 O O . ALA C 368 ? 0.5341 0.5320 0.4753 0.0599 -0.1265 0.1019 676 ALA C O 8319 C CB . ALA C 368 ? 0.5382 0.5352 0.4463 0.0471 -0.1259 0.0895 676 ALA C CB 8320 N N . GLU C 369 ? 0.5779 0.5558 0.4904 0.0586 -0.1132 0.1094 677 GLU C N 8321 C CA . GLU C 369 ? 0.6349 0.6077 0.5467 0.0658 -0.1140 0.1183 677 GLU C CA 8322 C C . GLU C 369 ? 0.6348 0.6055 0.5688 0.0690 -0.1116 0.1183 677 GLU C C 8323 O O . GLU C 369 ? 0.6663 0.6370 0.6060 0.0758 -0.1153 0.1234 677 GLU C O 8324 C CB . GLU C 369 ? 0.6826 0.6416 0.5750 0.0664 -0.1060 0.1261 677 GLU C CB 8325 C CG . GLU C 369 ? 0.7268 0.6873 0.5966 0.0628 -0.1055 0.1263 677 GLU C CG 8326 C CD . GLU C 369 ? 0.7288 0.6864 0.5961 0.0555 -0.0976 0.1204 677 GLU C CD 8327 O OE1 . GLU C 369 ? 0.7480 0.6946 0.6135 0.0539 -0.0877 0.1238 677 GLU C OE1 8328 O OE2 . GLU C 369 ? 0.7017 0.6673 0.5688 0.0513 -0.1014 0.1122 677 GLU C OE2 8329 N N . VAL C 370 ? 0.5866 0.5558 0.5327 0.0644 -0.1052 0.1126 678 VAL C N 8330 C CA . VAL C 370 ? 0.5554 0.5225 0.5215 0.0671 -0.1017 0.1120 678 VAL C CA 8331 C C . VAL C 370 ? 0.4847 0.4659 0.4721 0.0658 -0.1057 0.1050 678 VAL C C 8332 O O . VAL C 370 ? 0.4715 0.4521 0.4748 0.0656 -0.1005 0.1022 678 VAL C O 8333 C CB . VAL C 370 ? 0.5515 0.5054 0.5171 0.0636 -0.0907 0.1118 678 VAL C CB 8334 C CG1 . VAL C 370 ? 0.5975 0.5369 0.5442 0.0645 -0.0863 0.1193 678 VAL C CG1 8335 C CG2 . VAL C 370 ? 0.5408 0.4983 0.5068 0.0560 -0.0872 0.1048 678 VAL C CG2 8336 N N . ALA C 371 ? 0.4660 0.4596 0.4532 0.0648 -0.1146 0.1022 679 ALA C N 8337 C CA . ALA C 371 ? 0.4733 0.4807 0.4811 0.0629 -0.1189 0.0960 679 ALA C CA 8338 C C . ALA C 371 ? 0.4703 0.4821 0.4988 0.0691 -0.1189 0.0982 679 ALA C C 8339 O O . ALA C 371 ? 0.4542 0.4741 0.5026 0.0676 -0.1173 0.0936 679 ALA C O 8340 C CB . ALA C 371 ? 0.4925 0.5112 0.4955 0.0609 -0.1295 0.0931 679 ALA C CB 8341 N N . GLU C 372 ? 0.4947 0.5006 0.5183 0.0762 -0.1201 0.1054 680 GLU C N 8342 C CA . GLU C 372 ? 0.5286 0.5374 0.5703 0.0833 -0.1202 0.1080 680 GLU C CA 8343 C C . GLU C 372 ? 0.4804 0.4820 0.5344 0.0833 -0.1098 0.1057 680 GLU C C 8344 O O . GLU C 372 ? 0.4723 0.4789 0.5448 0.0881 -0.1088 0.1055 680 GLU C O 8345 C CB . GLU C 372 ? 0.6051 0.6065 0.6360 0.0913 -0.1237 0.1166 680 GLU C CB 8346 C CG . GLU C 372 ? 0.6852 0.6668 0.6970 0.0915 -0.1163 0.1215 680 GLU C CG 8347 C CD . GLU C 372 ? 0.7875 0.7605 0.7882 0.0997 -0.1196 0.1307 680 GLU C CD 8348 O OE1 . GLU C 372 ? 0.8133 0.7956 0.8237 0.1063 -0.1272 0.1333 680 GLU C OE1 8349 O OE2 . GLU C 372 ? 0.8246 0.7816 0.8073 0.0994 -0.1146 0.1356 680 GLU C OE2 8350 N N . GLN C 373 ? 0.4436 0.4338 0.4872 0.0782 -0.1020 0.1039 681 GLN C N 8351 C CA . GLN C 373 ? 0.4420 0.4253 0.4955 0.0775 -0.0923 0.1010 681 GLN C CA 8352 C C . GLN C 373 ? 0.3593 0.3556 0.4313 0.0740 -0.0909 0.0942 681 GLN C C 8353 O O . GLN C 373 ? 0.3665 0.3611 0.4508 0.0751 -0.0839 0.0917 681 GLN C O 8354 C CB . GLN C 373 ? 0.5077 0.4767 0.5454 0.0723 -0.0852 0.1009 681 GLN C CB 8355 C CG . GLN C 373 ? 0.6330 0.5878 0.6519 0.0744 -0.0848 0.1079 681 GLN C CG 8356 C CD . GLN C 373 ? 0.7090 0.6518 0.7141 0.0680 -0.0775 0.1075 681 GLN C CD 8357 O OE1 . GLN C 373 ? 0.7623 0.6910 0.7549 0.0688 -0.0742 0.1128 681 GLN C OE1 8358 N NE2 . GLN C 373 ? 0.7286 0.6770 0.7363 0.0616 -0.0751 0.1015 681 GLN C NE2 8359 N N . TYR C 374 ? 0.3194 0.3279 0.3924 0.0696 -0.0973 0.0911 682 TYR C N 8360 C CA . TYR C 374 ? 0.2766 0.2963 0.3653 0.0651 -0.0960 0.0849 682 TYR C CA 8361 C C . TYR C 374 ? 0.2988 0.3348 0.4052 0.0672 -0.1031 0.0844 682 TYR C C 8362 O O . TYR C 374 ? 0.3258 0.3668 0.4276 0.0693 -0.1121 0.0871 682 TYR C O 8363 C CB . TYR C 374 ? 0.2622 0.2824 0.3395 0.0573 -0.0977 0.0808 682 TYR C CB 8364 C CG . TYR C 374 ? 0.2717 0.2779 0.3322 0.0543 -0.0910 0.0811 682 TYR C CG 8365 C CD1 . TYR C 374 ? 0.2977 0.2944 0.3380 0.0550 -0.0924 0.0855 682 TYR C CD1 8366 C CD2 . TYR C 374 ? 0.3110 0.3141 0.3761 0.0507 -0.0832 0.0774 682 TYR C CD2 8367 C CE1 . TYR C 374 ? 0.3072 0.2921 0.3338 0.0517 -0.0860 0.0861 682 TYR C CE1 8368 C CE2 . TYR C 374 ? 0.3357 0.3272 0.3868 0.0476 -0.0776 0.0776 682 TYR C CE2 8369 C CZ . TYR C 374 ? 0.3195 0.3022 0.3520 0.0479 -0.0789 0.0820 682 TYR C CZ 8370 O OH . TYR C 374 ? 0.3202 0.2923 0.3403 0.0443 -0.0728 0.0825 682 TYR C OH 8371 N N . SER C 375 ? 0.2714 0.3161 0.3981 0.0666 -0.0989 0.0811 683 SER C N 8372 C CA . SER C 375 ? 0.2728 0.3344 0.4184 0.0671 -0.1051 0.0803 683 SER C CA 8373 C C . SER C 375 ? 0.2503 0.3195 0.3947 0.0589 -0.1108 0.0755 683 SER C C 8374 O O . SER C 375 ? 0.2427 0.3235 0.3940 0.0579 -0.1198 0.0750 683 SER C O 8375 C CB . SER C 375 ? 0.2816 0.3499 0.4498 0.0699 -0.0975 0.0791 683 SER C CB 8376 O OG . SER C 375 ? 0.2708 0.3368 0.4411 0.0644 -0.0893 0.0747 683 SER C OG 8377 N N . GLU C 376 ? 0.2129 0.2750 0.3484 0.0531 -0.1057 0.0719 684 GLU C N 8378 C CA . GLU C 376 ? 0.2559 0.3225 0.3889 0.0453 -0.1102 0.0669 684 GLU C CA 8379 C C . GLU C 376 ? 0.2741 0.3364 0.3856 0.0437 -0.1187 0.0670 684 GLU C C 8380 O O . GLU C 376 ? 0.2796 0.3323 0.3744 0.0474 -0.1184 0.0711 684 GLU C O 8381 C CB . GLU C 376 ? 0.2427 0.3027 0.3730 0.0405 -0.1018 0.0633 684 GLU C CB 8382 C CG . GLU C 376 ? 0.2381 0.3001 0.3853 0.0421 -0.0918 0.0632 684 GLU C CG 8383 C CD . GLU C 376 ? 0.2721 0.3225 0.4120 0.0474 -0.0841 0.0662 684 GLU C CD 8384 O OE1 . GLU C 376 ? 0.2745 0.3158 0.3981 0.0498 -0.0867 0.0692 684 GLU C OE1 8385 O OE2 . GLU C 376 ? 0.2579 0.3077 0.4078 0.0489 -0.0752 0.0654 684 GLU C OE2 8386 N N . LYS C 377 ? 0.2427 0.3114 0.3542 0.0381 -0.1260 0.0625 685 LYS C N 8387 C CA . LYS C 377 ? 0.2752 0.3385 0.3639 0.0357 -0.1326 0.0610 685 LYS C CA 8388 C C . LYS C 377 ? 0.2696 0.3207 0.3427 0.0325 -0.1256 0.0589 685 LYS C C 8389 O O . LYS C 377 ? 0.2331 0.2835 0.3156 0.0294 -0.1190 0.0561 685 LYS C O 8390 C CB . LYS C 377 ? 0.2599 0.3323 0.3530 0.0302 -0.1420 0.0554 685 LYS C CB 8391 C CG . LYS C 377 ? 0.2813 0.3672 0.3897 0.0328 -0.1503 0.0572 685 LYS C CG 8392 C CD . LYS C 377 ? 0.3214 0.4059 0.4159 0.0394 -0.1559 0.0631 685 LYS C CD 8393 C CE . LYS C 377 ? 0.3626 0.4618 0.4737 0.0425 -0.1646 0.0652 685 LYS C CE 8394 N NZ . LYS C 377 ? 0.3839 0.4820 0.4815 0.0497 -0.1705 0.0716 685 LYS C NZ 8395 N N . LEU C 378 ? 0.2632 0.3054 0.3127 0.0334 -0.1269 0.0606 686 LEU C N 8396 C CA . LEU C 378 ? 0.2836 0.3149 0.3175 0.0306 -0.1205 0.0591 686 LEU C CA 8397 C C . LEU C 378 ? 0.3002 0.3320 0.3283 0.0243 -0.1242 0.0517 686 LEU C C 8398 O O . LEU C 378 ? 0.3150 0.3507 0.3369 0.0227 -0.1329 0.0486 686 LEU C O 8399 C CB . LEU C 378 ? 0.3178 0.3396 0.3290 0.0338 -0.1194 0.0642 686 LEU C CB 8400 C CG . LEU C 378 ? 0.3167 0.3351 0.3299 0.0403 -0.1165 0.0719 686 LEU C CG 8401 C CD1 . LEU C 378 ? 0.3301 0.3395 0.3196 0.0426 -0.1164 0.0772 686 LEU C CD1 8402 C CD2 . LEU C 378 ? 0.3117 0.3252 0.3366 0.0410 -0.1066 0.0729 686 LEU C CD2 8403 N N . ALA C 379 ? 0.2575 0.2850 0.2875 0.0210 -0.1177 0.0486 687 ALA C N 8404 C CA . ALA C 379 ? 0.2547 0.2803 0.2786 0.0156 -0.1199 0.0416 687 ALA C CA 8405 C C . ALA C 379 ? 0.2586 0.2738 0.2659 0.0151 -0.1130 0.0417 687 ALA C C 8406 O O . ALA C 379 ? 0.2262 0.2392 0.2412 0.0150 -0.1054 0.0431 687 ALA C O 8407 C CB . ALA C 379 ? 0.2392 0.2715 0.2857 0.0118 -0.1190 0.0378 687 ALA C CB 8408 N N . TYR C 380 ? 0.2704 0.2795 0.2547 0.0149 -0.1155 0.0402 688 TYR C N 8409 C CA . TYR C 380 ? 0.2784 0.2781 0.2451 0.0150 -0.1087 0.0414 688 TYR C CA 8410 C C . TYR C 380 ? 0.2792 0.2759 0.2434 0.0112 -0.1042 0.0339 688 TYR C C 8411 O O . TYR C 380 ? 0.2988 0.2951 0.2574 0.0088 -0.1100 0.0271 688 TYR C O 8412 C CB . TYR C 380 ? 0.2724 0.2672 0.2142 0.0169 -0.1105 0.0434 688 TYR C CB 8413 C CG . TYR C 380 ? 0.2973 0.2920 0.2367 0.0213 -0.1096 0.0520 688 TYR C CG 8414 C CD1 . TYR C 380 ? 0.2867 0.2838 0.2443 0.0237 -0.1064 0.0569 688 TYR C CD1 8415 C CD2 . TYR C 380 ? 0.3003 0.2917 0.2183 0.0234 -0.1113 0.0551 688 TYR C CD2 8416 C CE1 . TYR C 380 ? 0.2680 0.2632 0.2229 0.0282 -0.1056 0.0644 688 TYR C CE1 8417 C CE2 . TYR C 380 ? 0.3377 0.3280 0.2532 0.0277 -0.1104 0.0635 688 TYR C CE2 8418 C CZ . TYR C 380 ? 0.3255 0.3172 0.2596 0.0302 -0.1078 0.0680 688 TYR C CZ 8419 O OH . TYR C 380 ? 0.3506 0.3395 0.2817 0.0350 -0.1069 0.0761 688 TYR C OH 8420 N N . MET C 381 ? 0.2538 0.2478 0.2216 0.0108 -0.0929 0.0346 689 MET C N 8421 C CA . MET C 381 ? 0.2651 0.2548 0.2253 0.0086 -0.0859 0.0288 689 MET C CA 8422 C C . MET C 381 ? 0.2974 0.2814 0.2337 0.0102 -0.0836 0.0300 689 MET C C 8423 O O . MET C 381 ? 0.3063 0.2890 0.2349 0.0125 -0.0844 0.0368 689 MET C O 8424 C CB . MET C 381 ? 0.2332 0.2232 0.2050 0.0080 -0.0756 0.0300 689 MET C CB 8425 C CG . MET C 381 ? 0.2543 0.2494 0.2476 0.0065 -0.0762 0.0287 689 MET C CG 8426 S SD . MET C 381 ? 0.2964 0.2912 0.2936 0.0029 -0.0792 0.0203 689 MET C SD 8427 C CE . MET C 381 ? 0.2356 0.2253 0.2267 0.0027 -0.0681 0.0179 689 MET C CE 8428 N N . PRO C 382 ? 0.2942 0.2744 0.2187 0.0092 -0.0803 0.0237 690 PRO C N 8429 C CA . PRO C 382 ? 0.3255 0.3010 0.2259 0.0110 -0.0784 0.0243 690 PRO C CA 8430 C C . PRO C 382 ? 0.3119 0.2859 0.2074 0.0120 -0.0678 0.0307 690 PRO C C 8431 O O . PRO C 382 ? 0.3032 0.2741 0.1808 0.0135 -0.0665 0.0347 690 PRO C O 8432 C CB . PRO C 382 ? 0.3479 0.3197 0.2400 0.0102 -0.0768 0.0149 690 PRO C CB 8433 C CG . PRO C 382 ? 0.3046 0.2786 0.2170 0.0081 -0.0732 0.0116 690 PRO C CG 8434 C CD . PRO C 382 ? 0.3003 0.2798 0.2320 0.0070 -0.0784 0.0159 690 PRO C CD 8435 N N . HIS C 383 ? 0.2859 0.2620 0.1966 0.0108 -0.0605 0.0318 691 HIS C N 8436 C CA . HIS C 383 ? 0.3208 0.2961 0.2293 0.0107 -0.0512 0.0373 691 HIS C CA 8437 C C . HIS C 383 ? 0.3132 0.2893 0.2360 0.0102 -0.0509 0.0433 691 HIS C C 8438 O O . HIS C 383 ? 0.3672 0.3408 0.2857 0.0116 -0.0537 0.0498 691 HIS C O 8439 C CB . HIS C 383 ? 0.3309 0.3076 0.2417 0.0097 -0.0424 0.0329 691 HIS C CB 8440 C CG . HIS C 383 ? 0.3982 0.3728 0.2932 0.0111 -0.0411 0.0272 691 HIS C CG 8441 N ND1 . HIS C 383 ? 0.4119 0.3856 0.3094 0.0113 -0.0433 0.0190 691 HIS C ND1 8442 C CD2 . HIS C 383 ? 0.4316 0.4038 0.3073 0.0127 -0.0375 0.0284 691 HIS C CD2 8443 C CE1 . HIS C 383 ? 0.4215 0.3919 0.3018 0.0132 -0.0412 0.0146 691 HIS C CE1 8444 N NE2 . HIS C 383 ? 0.4570 0.4270 0.3233 0.0141 -0.0374 0.0202 691 HIS C NE2 8445 N N . THR C 384 ? 0.2781 0.2569 0.2171 0.0088 -0.0475 0.0413 692 THR C N 8446 C CA . THR C 384 ? 0.2418 0.2208 0.1943 0.0089 -0.0479 0.0453 692 THR C CA 8447 C C . THR C 384 ? 0.2361 0.2192 0.2042 0.0087 -0.0514 0.0413 692 THR C C 8448 O O . THR C 384 ? 0.2359 0.2209 0.2062 0.0075 -0.0509 0.0357 692 THR C O 8449 C CB . THR C 384 ? 0.2534 0.2309 0.2096 0.0071 -0.0396 0.0481 692 THR C CB 8450 O OG1 . THR C 384 ? 0.2597 0.2357 0.2273 0.0076 -0.0402 0.0510 692 THR C OG1 8451 C CG2 . THR C 384 ? 0.2416 0.2228 0.2032 0.0053 -0.0343 0.0430 692 THR C CG2 8452 N N . PHE C 385 ? 0.2363 0.2204 0.2155 0.0100 -0.0543 0.0443 693 PHE C N 8453 C CA . PHE C 385 ? 0.2280 0.2167 0.2235 0.0097 -0.0557 0.0415 693 PHE C CA 8454 C C . PHE C 385 ? 0.2176 0.2062 0.2198 0.0083 -0.0479 0.0401 693 PHE C C 8455 O O . PHE C 385 ? 0.1929 0.1846 0.2053 0.0074 -0.0469 0.0372 693 PHE C O 8456 C CB . PHE C 385 ? 0.2319 0.2230 0.2384 0.0124 -0.0604 0.0453 693 PHE C CB 8457 C CG . PHE C 385 ? 0.2239 0.2115 0.2357 0.0140 -0.0552 0.0492 693 PHE C CG 8458 C CD1 . PHE C 385 ? 0.2186 0.2085 0.2440 0.0142 -0.0511 0.0477 693 PHE C CD1 8459 C CD2 . PHE C 385 ? 0.2696 0.2508 0.2721 0.0153 -0.0541 0.0544 693 PHE C CD2 8460 C CE1 . PHE C 385 ? 0.2305 0.2159 0.2593 0.0158 -0.0463 0.0501 693 PHE C CE1 8461 C CE2 . PHE C 385 ? 0.2664 0.2425 0.2738 0.0165 -0.0494 0.0573 693 PHE C CE2 8462 C CZ . PHE C 385 ? 0.2493 0.2272 0.2695 0.0168 -0.0457 0.0546 693 PHE C CZ 8463 N N . PHE C 386 ? 0.1923 0.1771 0.1883 0.0076 -0.0425 0.0424 694 PHE C N 8464 C CA . PHE C 386 ? 0.1948 0.1797 0.1961 0.0060 -0.0363 0.0410 694 PHE C CA 8465 C C . PHE C 386 ? 0.2153 0.2029 0.2149 0.0044 -0.0336 0.0367 694 PHE C C 8466 O O . PHE C 386 ? 0.2301 0.2178 0.2211 0.0044 -0.0343 0.0352 694 PHE C O 8467 C CB . PHE C 386 ? 0.1992 0.1795 0.1969 0.0051 -0.0321 0.0444 694 PHE C CB 8468 C CG . PHE C 386 ? 0.2379 0.2163 0.2443 0.0052 -0.0294 0.0443 694 PHE C CG 8469 C CD1 . PHE C 386 ? 0.2340 0.2131 0.2422 0.0029 -0.0250 0.0417 694 PHE C CD1 8470 C CD2 . PHE C 386 ? 0.2706 0.2470 0.2836 0.0081 -0.0315 0.0463 694 PHE C CD2 8471 C CE1 . PHE C 386 ? 0.2525 0.2293 0.2665 0.0031 -0.0227 0.0407 694 PHE C CE1 8472 C CE2 . PHE C 386 ? 0.2397 0.2138 0.2596 0.0088 -0.0283 0.0453 694 PHE C CE2 8473 C CZ . PHE C 386 ? 0.2373 0.2110 0.2566 0.0061 -0.0238 0.0422 694 PHE C CZ 8474 N N . ILE C 387 ? 0.1916 0.1810 0.1989 0.0037 -0.0305 0.0349 695 ILE C N 8475 C CA . ILE C 387 ? 0.1944 0.1860 0.2016 0.0030 -0.0281 0.0317 695 ILE C CA 8476 C C . ILE C 387 ? 0.1937 0.1863 0.2056 0.0021 -0.0240 0.0318 695 ILE C C 8477 O O . ILE C 387 ? 0.2216 0.2126 0.2371 0.0021 -0.0233 0.0332 695 ILE C O 8478 C CB . ILE C 387 ? 0.2261 0.2188 0.2383 0.0034 -0.0313 0.0289 695 ILE C CB 8479 C CG1 . ILE C 387 ? 0.2357 0.2287 0.2464 0.0033 -0.0292 0.0258 695 ILE C CG1 8480 C CG2 . ILE C 387 ? 0.2136 0.2078 0.2369 0.0035 -0.0314 0.0298 695 ILE C CG2 8481 C CD1 . ILE C 387 ? 0.2018 0.1941 0.2020 0.0040 -0.0280 0.0244 695 ILE C CD1 8482 N N . GLY C 388 ? 0.1882 0.1832 0.1996 0.0017 -0.0216 0.0302 696 GLY C N 8483 C CA . GLY C 388 ? 0.1761 0.1728 0.1909 0.0009 -0.0190 0.0301 696 GLY C CA 8484 C C . GLY C 388 ? 0.1857 0.1851 0.2021 0.0019 -0.0181 0.0285 696 GLY C C 8485 O O . GLY C 388 ? 0.2164 0.2163 0.2304 0.0029 -0.0183 0.0272 696 GLY C O 8486 N N . ASP C 389 ? 0.1306 0.1310 0.1502 0.0020 -0.0170 0.0287 697 ASP C N 8487 C CA . ASP C 389 ? 0.1263 0.1284 0.1475 0.0035 -0.0163 0.0283 697 ASP C CA 8488 C C . ASP C 389 ? 0.1951 0.2020 0.2155 0.0035 -0.0153 0.0285 697 ASP C C 8489 O O . ASP C 389 ? 0.1816 0.1906 0.2038 0.0052 -0.0151 0.0290 697 ASP C O 8490 C CB . ASP C 389 ? 0.1431 0.1438 0.1674 0.0040 -0.0157 0.0294 697 ASP C CB 8491 C CG . ASP C 389 ? 0.2052 0.2050 0.2317 0.0057 -0.0154 0.0298 697 ASP C CG 8492 O OD1 . ASP C 389 ? 0.2390 0.2367 0.2663 0.0063 -0.0165 0.0282 697 ASP C OD1 8493 O OD2 . ASP C 389 ? 0.2164 0.2167 0.2428 0.0066 -0.0143 0.0316 697 ASP C OD2 8494 N N . HIS C 390 ? 0.1636 0.1727 0.1824 0.0016 -0.0148 0.0287 698 HIS C N 8495 C CA . HIS C 390 ? 0.1306 0.1459 0.1511 0.0005 -0.0141 0.0290 698 HIS C CA 8496 C C . HIS C 390 ? 0.1449 0.1656 0.1684 0.0034 -0.0132 0.0289 698 HIS C C 8497 O O . HIS C 390 ? 0.1977 0.2244 0.2247 0.0037 -0.0138 0.0296 698 HIS C O 8498 C CB . HIS C 390 ? 0.1685 0.1847 0.1879 -0.0027 -0.0130 0.0297 698 HIS C CB 8499 C CG . HIS C 390 ? 0.1890 0.1992 0.2063 -0.0052 -0.0137 0.0301 698 HIS C CG 8500 N ND1 . HIS C 390 ? 0.1956 0.1997 0.2107 -0.0039 -0.0144 0.0303 698 HIS C ND1 8501 C CD2 . HIS C 390 ? 0.2101 0.2192 0.2277 -0.0086 -0.0139 0.0300 698 HIS C CD2 8502 C CE1 . HIS C 390 ? 0.1953 0.1947 0.2097 -0.0057 -0.0145 0.0306 698 HIS C CE1 8503 N NE2 . HIS C 390 ? 0.1930 0.1943 0.2082 -0.0087 -0.0141 0.0302 698 HIS C NE2 8504 N N . ALA C 391 ? 0.1605 0.1789 0.1824 0.0058 -0.0122 0.0277 699 ALA C N 8505 C CA . ALA C 391 ? 0.1889 0.2112 0.2136 0.0095 -0.0106 0.0271 699 ALA C CA 8506 C C . ALA C 391 ? 0.2202 0.2413 0.2480 0.0122 -0.0120 0.0279 699 ALA C C 8507 O O . ALA C 391 ? 0.2436 0.2694 0.2756 0.0155 -0.0115 0.0287 699 ALA C O 8508 C CB . ALA C 391 ? 0.1708 0.1891 0.1911 0.0116 -0.0089 0.0246 699 ALA C CB 8509 N N . ASN C 392 ? 0.1988 0.2138 0.2250 0.0112 -0.0136 0.0285 700 ASN C N 8510 C CA . ASN C 392 ? 0.2137 0.2265 0.2416 0.0133 -0.0144 0.0304 700 ASN C CA 8511 C C . ASN C 392 ? 0.2158 0.2325 0.2430 0.0120 -0.0157 0.0326 700 ASN C C 8512 O O . ASN C 392 ? 0.2275 0.2463 0.2557 0.0145 -0.0166 0.0349 700 ASN C O 8513 C CB . ASN C 392 ? 0.2532 0.2578 0.2806 0.0126 -0.0145 0.0301 700 ASN C CB 8514 C CG . ASN C 392 ? 0.3347 0.3364 0.3634 0.0139 -0.0143 0.0333 700 ASN C CG 8515 O OD1 . ASN C 392 ? 0.3659 0.3663 0.3963 0.0172 -0.0141 0.0347 700 ASN C OD1 8516 N ND2 . ASN C 392 ? 0.2962 0.2963 0.3238 0.0118 -0.0139 0.0348 700 ASN C ND2 8517 N N . MET C 393 ? 0.2170 0.2338 0.2417 0.0085 -0.0160 0.0319 701 MET C N 8518 C CA . MET C 393 ? 0.2116 0.2304 0.2336 0.0069 -0.0175 0.0327 701 MET C CA 8519 C C . MET C 393 ? 0.1577 0.1849 0.1819 0.0059 -0.0195 0.0325 701 MET C C 8520 O O . MET C 393 ? 0.1748 0.2054 0.1975 0.0063 -0.0220 0.0336 701 MET C O 8521 C CB . MET C 393 ? 0.1985 0.2129 0.2171 0.0038 -0.0168 0.0312 701 MET C CB 8522 C CG . MET C 393 ? 0.2254 0.2339 0.2430 0.0047 -0.0151 0.0320 701 MET C CG 8523 S SD . MET C 393 ? 0.2197 0.2238 0.2351 0.0024 -0.0139 0.0303 701 MET C SD 8524 C CE . MET C 393 ? 0.2070 0.2118 0.2159 0.0010 -0.0147 0.0290 701 MET C CE 8525 N N . PHE C 394 ? 0.1572 0.1884 0.1851 0.0045 -0.0185 0.0314 702 PHE C N 8526 C CA . PHE C 394 ? 0.1532 0.1939 0.1860 0.0024 -0.0200 0.0314 702 PHE C CA 8527 C C . PHE C 394 ? 0.1329 0.1811 0.1728 0.0051 -0.0180 0.0321 702 PHE C C 8528 O O . PHE C 394 ? 0.1318 0.1850 0.1754 0.0024 -0.0162 0.0317 702 PHE C O 8529 C CB . PHE C 394 ? 0.1572 0.1964 0.1888 -0.0032 -0.0199 0.0300 702 PHE C CB 8530 C CG . PHE C 394 ? 0.2111 0.2413 0.2356 -0.0049 -0.0205 0.0287 702 PHE C CG 8531 C CD1 . PHE C 394 ? 0.2011 0.2306 0.2214 -0.0049 -0.0231 0.0281 702 PHE C CD1 8532 C CD2 . PHE C 394 ? 0.2074 0.2300 0.2292 -0.0060 -0.0183 0.0282 702 PHE C CD2 8533 C CE1 . PHE C 394 ? 0.2088 0.2299 0.2223 -0.0059 -0.0224 0.0265 702 PHE C CE1 8534 C CE2 . PHE C 394 ? 0.2152 0.2302 0.2322 -0.0067 -0.0182 0.0270 702 PHE C CE2 8535 C CZ . PHE C 394 ? 0.2296 0.2437 0.2424 -0.0066 -0.0197 0.0259 702 PHE C CZ 8536 N N . PRO C 395 ? 0.1624 0.2110 0.2042 0.0105 -0.0178 0.0332 703 PRO C N 8537 C CA . PRO C 395 ? 0.1718 0.2265 0.2201 0.0142 -0.0149 0.0332 703 PRO C CA 8538 C C . PRO C 395 ? 0.1684 0.2372 0.2265 0.0137 -0.0161 0.0345 703 PRO C C 8539 O O . PRO C 395 ? 0.1565 0.2328 0.2215 0.0157 -0.0126 0.0344 703 PRO C O 8540 C CB . PRO C 395 ? 0.1546 0.2042 0.2026 0.0202 -0.0150 0.0341 703 PRO C CB 8541 C CG . PRO C 395 ? 0.1567 0.2040 0.2014 0.0196 -0.0190 0.0364 703 PRO C CG 8542 C CD . PRO C 395 ? 0.1387 0.1823 0.1774 0.0138 -0.0197 0.0349 703 PRO C CD 8543 N N . HIS C 396 ? 0.1413 0.2142 0.2000 0.0110 -0.0211 0.0354 704 HIS C N 8544 C CA . HIS C 396 ? 0.1129 0.2005 0.1823 0.0096 -0.0238 0.0365 704 HIS C CA 8545 C C . HIS C 396 ? 0.0976 0.1905 0.1719 0.0033 -0.0212 0.0354 704 HIS C C 8546 O O . HIS C 396 ? 0.1340 0.2405 0.2201 0.0016 -0.0221 0.0363 704 HIS C O 8547 C CB . HIS C 396 ? 0.1371 0.2271 0.2042 0.0080 -0.0309 0.0372 704 HIS C CB 8548 C CG . HIS C 396 ? 0.1803 0.2613 0.2373 0.0020 -0.0326 0.0348 704 HIS C CG 8549 N ND1 . HIS C 396 ? 0.1818 0.2491 0.2283 0.0021 -0.0298 0.0338 704 HIS C ND1 8550 C CD2 . HIS C 396 ? 0.1933 0.2770 0.2495 -0.0041 -0.0369 0.0329 704 HIS C CD2 8551 C CE1 . HIS C 396 ? 0.1669 0.2290 0.2069 -0.0028 -0.0315 0.0315 704 HIS C CE1 8552 N NE2 . HIS C 396 ? 0.1741 0.2448 0.2189 -0.0068 -0.0359 0.0306 704 HIS C NE2 8553 N N . LEU C 397 ? 0.1181 0.2005 0.1842 0.0000 -0.0181 0.0339 705 LEU C N 8554 C CA . LEU C 397 ? 0.1541 0.2386 0.2230 -0.0059 -0.0150 0.0338 705 LEU C CA 8555 C C . LEU C 397 ? 0.1854 0.2709 0.2550 -0.0032 -0.0081 0.0345 705 LEU C C 8556 O O . LEU C 397 ? 0.1665 0.2528 0.2368 -0.0075 -0.0043 0.0353 705 LEU C O 8557 C CB . LEU C 397 ? 0.1638 0.2359 0.2231 -0.0109 -0.0160 0.0324 705 LEU C CB 8558 C CG . LEU C 397 ? 0.1609 0.2300 0.2166 -0.0134 -0.0220 0.0308 705 LEU C CG 8559 C CD1 . LEU C 397 ? 0.1454 0.2017 0.1923 -0.0174 -0.0218 0.0291 705 LEU C CD1 8560 C CD2 . LEU C 397 ? 0.1516 0.2332 0.2172 -0.0174 -0.0263 0.0307 705 LEU C CD2 8561 N N . LYS C 398 ? 0.2281 0.3055 0.1493 -0.0095 0.0053 0.0208 706 LYS C N 8562 C CA . LYS C 398 ? 0.2378 0.2918 0.1353 -0.0215 0.0116 0.0049 706 LYS C CA 8563 C C . LYS C 398 ? 0.2463 0.2626 0.1527 -0.0023 0.0275 -0.0085 706 LYS C C 8564 O O . LYS C 398 ? 0.2906 0.3045 0.1788 -0.0019 0.0380 -0.0181 706 LYS C O 8565 C CB . LYS C 398 ? 0.2930 0.3157 0.1703 -0.0529 0.0037 -0.0045 706 LYS C CB 8566 C CG . LYS C 398 ? 0.3716 0.4429 0.2369 -0.0836 -0.0113 0.0070 706 LYS C CG 8567 C CD . LYS C 398 ? 0.4937 0.5176 0.3365 -0.1221 -0.0201 -0.0036 706 LYS C CD 8568 C CE . LYS C 398 ? 0.5586 0.6391 0.3885 -0.1625 -0.0357 0.0046 706 LYS C CE 8569 N NZ . LYS C 398 ? 0.5575 0.7113 0.4148 -0.1624 -0.0414 0.0332 706 LYS C NZ 8570 N N . LYS C 399 ? 0.2203 0.2164 0.1547 0.0128 0.0292 -0.0078 707 LYS C N 8571 C CA . LYS C 399 ? 0.2579 0.2345 0.2108 0.0304 0.0436 -0.0185 707 LYS C CA 8572 C C . LYS C 399 ? 0.2440 0.2364 0.2301 0.0465 0.0412 -0.0088 707 LYS C C 8573 O O . LYS C 399 ? 0.2027 0.2096 0.1941 0.0475 0.0284 0.0022 707 LYS C O 8574 C CB . LYS C 399 ? 0.3416 0.2735 0.2955 0.0334 0.0467 -0.0334 707 LYS C CB 8575 C CG . LYS C 399 ? 0.4657 0.3684 0.3804 0.0172 0.0498 -0.0510 707 LYS C CG 8576 C CD . LYS C 399 ? 0.5857 0.4295 0.4975 0.0264 0.0528 -0.0677 707 LYS C CD 8577 C CE . LYS C 399 ? 0.6819 0.4839 0.5465 0.0063 0.0525 -0.0898 707 LYS C CE 8578 N NZ . LYS C 399 ? 0.7897 0.5165 0.6460 0.0178 0.0529 -0.1061 707 LYS C NZ 8579 N N . LYS C 400 ? 0.2260 0.2199 0.2326 0.0567 0.0538 -0.0137 708 LYS C N 8580 C CA . LYS C 400 ? 0.1865 0.1926 0.2236 0.0648 0.0484 -0.0085 708 LYS C CA 8581 C C . LYS C 400 ? 0.1943 0.2052 0.2572 0.0653 0.0520 -0.0172 708 LYS C C 8582 O O . LYS C 400 ? 0.2287 0.2372 0.2880 0.0666 0.0654 -0.0254 708 LYS C O 8583 C CB . LYS C 400 ? 0.1941 0.2096 0.2221 0.0641 0.0485 0.0010 708 LYS C CB 8584 C CG . LYS C 400 ? 0.2633 0.2775 0.2848 0.0603 0.0667 0.0033 708 LYS C CG 8585 C CD . LYS C 400 ? 0.2865 0.2953 0.2945 0.0629 0.0633 0.0169 708 LYS C CD 8586 C CE . LYS C 400 ? 0.3874 0.3902 0.3827 0.0557 0.0799 0.0265 708 LYS C CE 8587 N NZ . LYS C 400 ? 0.4212 0.4363 0.3829 0.0522 0.0874 0.0279 708 LYS C NZ 8588 N N . ALA C 401 ? 0.2032 0.2260 0.2871 0.0670 0.0406 -0.0159 709 ALA C N 8589 C CA . ALA C 401 ? 0.1562 0.1974 0.2675 0.0686 0.0476 -0.0191 709 ALA C CA 8590 C C . ALA C 401 ? 0.1433 0.1931 0.2751 0.0617 0.0457 -0.0147 709 ALA C C 8591 O O . ALA C 401 ? 0.1821 0.2205 0.3000 0.0624 0.0341 -0.0119 709 ALA C O 8592 C CB . ALA C 401 ? 0.1608 0.2089 0.2830 0.0811 0.0384 -0.0219 709 ALA C CB 8593 N N . VAL C 402 ? 0.1626 0.2345 0.3314 0.0549 0.0585 -0.0156 710 VAL C N 8594 C CA . VAL C 402 ? 0.1836 0.2616 0.3870 0.0437 0.0570 -0.0150 710 VAL C CA 8595 C C . VAL C 402 ? 0.1552 0.2759 0.4082 0.0382 0.0502 -0.0208 710 VAL C C 8596 O O . VAL C 402 ? 0.1947 0.3402 0.4507 0.0468 0.0532 -0.0214 710 VAL C O 8597 C CB . VAL C 402 ? 0.1952 0.2549 0.3826 0.0247 0.0733 -0.0046 710 VAL C CB 8598 C CG1 . VAL C 402 ? 0.1776 0.2014 0.3129 0.0332 0.0740 0.0034 710 VAL C CG1 8599 C CG2 . VAL C 402 ? 0.1782 0.2731 0.3877 0.0172 0.0987 -0.0019 710 VAL C CG2 8600 N N . ILE C 403 ? 0.1803 0.3003 0.4479 0.0222 0.0348 -0.0245 711 ILE C N 8601 C CA . ILE C 403 ? 0.1783 0.3492 0.4985 0.0098 0.0258 -0.0303 711 ILE C CA 8602 C C . ILE C 403 ? 0.2382 0.4085 0.5737 -0.0265 0.0365 -0.0257 711 ILE C C 8603 O O . ILE C 403 ? 0.2818 0.3964 0.5847 -0.0423 0.0313 -0.0244 711 ILE C O 8604 C CB . ILE C 403 ? 0.2114 0.3832 0.5304 0.0122 -0.0053 -0.0406 711 ILE C CB 8605 C CG1 . ILE C 403 ? 0.2418 0.4119 0.5320 0.0424 -0.0149 -0.0364 711 ILE C CG1 8606 C CG2 . ILE C 403 ? 0.2249 0.4520 0.5968 -0.0101 -0.0181 -0.0475 711 ILE C CG2 8607 C CD1 . ILE C 403 ? 0.2555 0.4339 0.5370 0.0458 -0.0425 -0.0426 711 ILE C CD1 8608 N N . ASP C 404 ? 0.2473 0.4788 0.6315 -0.0388 0.0524 -0.0217 712 ASP C N 8609 C CA . ASP C 404 ? 0.3282 0.5686 0.7326 -0.0809 0.0640 -0.0130 712 ASP C CA 8610 C C . ASP C 404 ? 0.4022 0.6616 0.8386 -0.1109 0.0377 -0.0230 712 ASP C C 8611 O O . ASP C 404 ? 0.4330 0.7601 0.8989 -0.1081 0.0277 -0.0251 712 ASP C O 8612 C CB . ASP C 404 ? 0.3485 0.6482 0.7663 -0.0801 0.0885 -0.0024 712 ASP C CB 8613 C CG . ASP C 404 ? 0.4249 0.7380 0.8551 -0.1264 0.1006 0.0124 712 ASP C CG 8614 O OD1 . ASP C 404 ? 0.4486 0.8353 0.9047 -0.1330 0.1121 0.0201 712 ASP C OD1 8615 O OD2 . ASP C 404 ? 0.4514 0.6981 0.8608 -0.1554 0.0975 0.0187 712 ASP C OD2 8616 N N . PHE C 405 ? 0.4619 0.6481 0.8633 -0.1334 0.0233 -0.0270 713 PHE C N 8617 C CA . PHE C 405 ? 0.5247 0.7119 0.9437 -0.1640 -0.0054 -0.0430 713 PHE C CA 8618 C C . PHE C 405 ? 0.6254 0.8186 1.0593 -0.2170 0.0005 -0.0321 713 PHE C C 8619 O O . PHE C 405 ? 0.6873 0.8520 1.1116 -0.2499 -0.0223 -0.0433 713 PHE C O 8620 C CB . PHE C 405 ? 0.5558 0.6520 0.9129 -0.1529 -0.0269 -0.0581 713 PHE C CB 8621 C CG . PHE C 405 ? 0.6337 0.6339 0.9413 -0.1644 -0.0150 -0.0477 713 PHE C CG 8622 C CD1 . PHE C 405 ? 0.6189 0.5920 0.8931 -0.1373 0.0078 -0.0292 713 PHE C CD1 8623 C CD2 . PHE C 405 ? 0.7141 0.6474 1.0055 -0.2016 -0.0288 -0.0565 713 PHE C CD2 8624 C CE1 . PHE C 405 ? 0.6648 0.5541 0.8931 -0.1428 0.0167 -0.0157 713 PHE C CE1 8625 C CE2 . PHE C 405 ? 0.7641 0.5994 1.0069 -0.2067 -0.0188 -0.0437 713 PHE C CE2 8626 C CZ . PHE C 405 ? 0.7416 0.5587 0.9538 -0.1750 0.0038 -0.0213 713 PHE C CZ 8627 N N . LYS C 406 ? 0.6480 0.8772 1.0938 -0.2246 0.0300 -0.0094 714 LYS C N 8628 C CA . LYS C 406 ? 0.7081 0.9568 1.1654 -0.2751 0.0362 0.0087 714 LYS C CA 8629 C C . LYS C 406 ? 0.6553 1.0233 1.1656 -0.2712 0.0494 0.0240 714 LYS C C 8630 O O . LYS C 406 ? 0.6680 1.0571 1.1823 -0.2781 0.0747 0.0477 714 LYS C O 8631 C CB . LYS C 406 ? 0.7721 0.9428 1.1840 -0.2925 0.0575 0.0307 714 LYS C CB 8632 C CG . LYS C 406 ? 0.8241 0.8684 1.1797 -0.2925 0.0428 0.0225 714 LYS C CG 8633 C CD . LYS C 406 ? 0.8922 0.8611 1.1988 -0.3090 0.0597 0.0516 714 LYS C CD 8634 C CE . LYS C 406 ? 0.9456 0.7854 1.1900 -0.3010 0.0420 0.0446 714 LYS C CE 8635 N NZ . LYS C 406 ? 1.0097 0.7763 1.2080 -0.3112 0.0509 0.0783 714 LYS C NZ 8636 N N . HIS C 410 ? 0.7792 0.9343 1.0981 -0.2941 0.1487 0.1164 718 HIS C N 8637 C CA . HIS C 410 ? 0.7400 0.9022 1.0273 -0.2540 0.1705 0.1183 718 HIS C CA 8638 C C . HIS C 410 ? 0.5911 0.7341 0.8784 -0.2068 0.1612 0.0933 718 HIS C C 8639 O O . HIS C 410 ? 0.5682 0.6955 0.8799 -0.2053 0.1391 0.0746 718 HIS C O 8640 C CB . HIS C 410 ? 0.8596 0.9461 1.0828 -0.2616 0.1784 0.1462 718 HIS C CB 8641 C CG . HIS C 410 ? 0.9799 1.0857 1.1942 -0.3005 0.1902 0.1707 718 HIS C CG 8642 N ND1 . HIS C 410 ? 1.0140 1.1715 1.2112 -0.2987 0.2259 0.1636 718 HIS C ND1 8643 C CD2 . HIS C 410 ? 1.0625 1.1105 1.3437 -0.3088 0.2035 0.1933 718 HIS C CD2 8644 C CE1 . HIS C 410 ? 1.0930 1.2157 1.3434 -0.3060 0.2685 0.1856 718 HIS C CE1 8645 N NE2 . HIS C 410 ? 1.1280 1.1951 1.3993 -0.3308 0.2471 0.1985 718 HIS C NE2 8646 N N . ILE C 411 ? 0.5226 0.6693 0.7792 -0.1712 0.1758 0.0926 719 ILE C N 8647 C CA . ILE C 411 ? 0.4464 0.5780 0.6980 -0.1301 0.1679 0.0727 719 ILE C CA 8648 C C . ILE C 411 ? 0.4224 0.4710 0.6182 -0.1162 0.1633 0.0830 719 ILE C C 8649 O O . ILE C 411 ? 0.4944 0.5209 0.6445 -0.1166 0.1752 0.1030 719 ILE C O 8650 C CB . ILE C 411 ? 0.4356 0.6257 0.6853 -0.0978 0.1803 0.0592 719 ILE C CB 8651 C CG1 . ILE C 411 ? 0.4373 0.7113 0.7386 -0.1024 0.1820 0.0501 719 ILE C CG1 8652 C CG2 . ILE C 411 ? 0.3956 0.5618 0.6321 -0.0604 0.1685 0.0409 719 ILE C CG2 8653 C CD1 . ILE C 411 ? 0.4362 0.7606 0.7303 -0.0702 0.1943 0.0368 719 ILE C CD1 8654 N N . TYR C 412 ? 0.3754 0.3845 0.5619 -0.0976 0.1354 0.0665 720 TYR C N 8655 C CA . TYR C 412 ? 0.3863 0.3267 0.5171 -0.0763 0.1226 0.0722 720 TYR C CA 8656 C C . TYR C 412 ? 0.3436 0.3024 0.4599 -0.0394 0.1144 0.0564 720 TYR C C 8657 O O . TYR C 412 ? 0.2646 0.2588 0.4120 -0.0298 0.1055 0.0370 720 TYR C O 8658 C CB . TYR C 412 ? 0.4175 0.2978 0.5441 -0.0827 0.0979 0.0638 720 TYR C CB 8659 C CG . TYR C 412 ? 0.4966 0.3322 0.6275 -0.1236 0.1002 0.0787 720 TYR C CG 8660 C CD1 . TYR C 412 ? 0.5394 0.3436 0.6419 -0.1400 0.1192 0.1109 720 TYR C CD1 8661 C CD2 . TYR C 412 ? 0.5524 0.3739 0.7116 -0.1489 0.0816 0.0614 720 TYR C CD2 8662 C CE1 . TYR C 412 ? 0.6435 0.4067 0.7400 -0.1781 0.1131 0.1246 720 TYR C CE1 8663 C CE2 . TYR C 412 ? 0.6179 0.3918 0.7769 -0.1922 0.0801 0.0733 720 TYR C CE2 8664 C CZ . TYR C 412 ? 0.6949 0.4407 0.8185 -0.2051 0.0932 0.1056 720 TYR C CZ 8665 O OH . TYR C 412 ? 0.8003 0.5033 0.9165 -0.2466 0.0825 0.1201 720 TYR C OH 8666 N N . ASP C 413 ? 0.2973 0.2330 0.3664 -0.0203 0.1155 0.0667 721 ASP C N 8667 C CA . ASP C 413 ? 0.2561 0.2099 0.3112 0.0067 0.1065 0.0534 721 ASP C CA 8668 C C . ASP C 413 ? 0.3282 0.2528 0.3682 0.0258 0.0831 0.0468 721 ASP C C 8669 O O . ASP C 413 ? 0.2757 0.2170 0.3034 0.0440 0.0748 0.0399 721 ASP C O 8670 C CB . ASP C 413 ? 0.3517 0.3160 0.3671 0.0146 0.1189 0.0643 721 ASP C CB 8671 C CG . ASP C 413 ? 0.3989 0.3256 0.3703 0.0228 0.1138 0.0868 721 ASP C CG 8672 O OD1 . ASP C 413 ? 0.4149 0.2962 0.3849 0.0211 0.1055 0.0954 721 ASP C OD1 8673 O OD2 . ASP C 413 ? 0.4030 0.3440 0.3391 0.0322 0.1171 0.0955 721 ASP C OD2 8674 N N . ASN C 414 ? 0.2799 0.3013 0.2475 -0.0351 0.0456 0.0269 722 ASN C N 8675 C CA . ASN C 414 ? 0.2428 0.2637 0.2089 -0.0439 0.0285 0.0238 722 ASN C CA 8676 C C . ASN C 414 ? 0.2380 0.2791 0.2326 -0.0562 0.0238 0.0266 722 ASN C C 8677 O O . ASN C 414 ? 0.2272 0.2638 0.2159 -0.0638 0.0150 0.0256 722 ASN C O 8678 C CB . ASN C 414 ? 0.2044 0.2015 0.1372 -0.0429 0.0268 0.0219 722 ASN C CB 8679 C CG . ASN C 414 ? 0.2768 0.2685 0.2033 -0.0447 0.0424 0.0277 722 ASN C CG 8680 O OD1 . ASN C 414 ? 0.2571 0.2637 0.2082 -0.0482 0.0549 0.0332 722 ASN C OD1 8681 N ND2 . ASN C 414 ? 0.2844 0.2546 0.1798 -0.0419 0.0419 0.0269 722 ASN C ND2 8682 N N . ARG C 415 ? 0.2080 0.2709 0.2339 -0.0576 0.0289 0.0295 723 ARG C N 8683 C CA . ARG C 415 ? 0.1903 0.2732 0.2452 -0.0684 0.0217 0.0303 723 ARG C CA 8684 C C . ARG C 415 ? 0.1928 0.2900 0.2619 -0.0670 0.0068 0.0278 723 ARG C C 8685 O O . ARG C 415 ? 0.1761 0.2703 0.2430 -0.0686 -0.0061 0.0242 723 ARG C O 8686 C CB . ARG C 415 ? 0.2154 0.3147 0.3010 -0.0717 0.0358 0.0351 723 ARG C CB 8687 C CG . ARG C 415 ? 0.2480 0.3357 0.3311 -0.0770 0.0454 0.0367 723 ARG C CG 8688 C CD . ARG C 415 ? 0.2831 0.3468 0.3285 -0.0729 0.0574 0.0400 723 ARG C CD 8689 N NE . ARG C 415 ? 0.3128 0.3679 0.3615 -0.0744 0.0694 0.0446 723 ARG C NE 8690 C CZ . ARG C 415 ? 0.3375 0.3718 0.3550 -0.0684 0.0802 0.0483 723 ARG C CZ 8691 N NH1 . ARG C 415 ? 0.3175 0.3316 0.2963 -0.0602 0.0826 0.0459 723 ARG C NH1 8692 N NH2 . ARG C 415 ? 0.3444 0.3768 0.3669 -0.0700 0.0864 0.0528 723 ARG C NH2 8693 N N . ILE C 416 ? 0.1564 0.2612 0.2342 -0.0579 0.0101 0.0285 724 ILE C N 8694 C CA . ILE C 416 ? 0.1841 0.2995 0.2718 -0.0537 -0.0020 0.0273 724 ILE C CA 8695 C C . ILE C 416 ? 0.1745 0.2776 0.2468 -0.0425 0.0016 0.0263 724 ILE C C 8696 O O . ILE C 416 ? 0.1980 0.3027 0.2746 -0.0355 0.0137 0.0279 724 ILE C O 8697 C CB . ILE C 416 ? 0.1927 0.3357 0.3167 -0.0539 -0.0030 0.0294 724 ILE C CB 8698 C CG1 . ILE C 416 ? 0.1787 0.3202 0.3112 -0.0602 -0.0068 0.0248 724 ILE C CG1 8699 C CG2 . ILE C 416 ? 0.2133 0.3628 0.3409 -0.0466 -0.0154 0.0284 724 ILE C CG2 8700 C CD1 . ILE C 416 ? 0.1428 0.3036 0.3074 -0.0593 -0.0061 0.0228 724 ILE C CD1 8701 N N . VAL C 417 ? 0.1176 0.2078 0.1736 -0.0406 -0.0084 0.0236 725 VAL C N 8702 C CA . VAL C 417 ? 0.1242 0.1976 0.1638 -0.0317 -0.0066 0.0208 725 VAL C CA 8703 C C . VAL C 417 ? 0.1371 0.2140 0.1847 -0.0263 -0.0146 0.0213 725 VAL C C 8704 O O . VAL C 417 ? 0.1728 0.2548 0.2250 -0.0298 -0.0242 0.0227 725 VAL C O 8705 C CB . VAL C 417 ? 0.1533 0.2033 0.1661 -0.0342 -0.0103 0.0168 725 VAL C CB 8706 C CG1 . VAL C 417 ? 0.1730 0.2049 0.1711 -0.0256 -0.0108 0.0120 725 VAL C CG1 8707 C CG2 . VAL C 417 ? 0.2081 0.2521 0.2091 -0.0382 -0.0018 0.0174 725 VAL C CG2 8708 N N . LEU C 418 ? 0.1540 0.2264 0.2019 -0.0167 -0.0095 0.0204 726 LEU C N 8709 C CA A LEU C 418 ? 0.1505 0.2214 0.2040 -0.0101 -0.0144 0.0212 726 LEU C CA 8710 C CA B LEU C 418 ? 0.1488 0.2194 0.2020 -0.0104 -0.0148 0.0212 726 LEU C CA 8711 C C . LEU C 418 ? 0.1593 0.2058 0.1964 -0.0060 -0.0146 0.0158 726 LEU C C 8712 O O . LEU C 418 ? 0.1762 0.2106 0.1995 -0.0031 -0.0085 0.0114 726 LEU C O 8713 C CB A LEU C 418 ? 0.1587 0.2454 0.2308 -0.0014 -0.0084 0.0248 726 LEU C CB 8714 C CB B LEU C 418 ? 0.1555 0.2435 0.2285 -0.0021 -0.0099 0.0252 726 LEU C CB 8715 C CG A LEU C 418 ? 0.1531 0.2670 0.2487 -0.0032 -0.0089 0.0294 726 LEU C CG 8716 C CG B LEU C 418 ? 0.1427 0.2568 0.2374 -0.0047 -0.0143 0.0297 726 LEU C CG 8717 C CD1 A LEU C 418 ? 0.1191 0.2456 0.2322 0.0074 -0.0020 0.0326 726 LEU C CD1 8718 C CD1 B LEU C 418 ? 0.1165 0.2425 0.2208 -0.0114 -0.0079 0.0300 726 LEU C CD1 8719 C CD2 A LEU C 418 ? 0.1370 0.2598 0.2377 -0.0068 -0.0220 0.0314 726 LEU C CD2 8720 C CD2 B LEU C 418 ? 0.1103 0.2384 0.2227 0.0059 -0.0134 0.0337 726 LEU C CD2 8721 N N . ASN C 419 ? 0.1408 0.1792 0.1796 -0.0049 -0.0214 0.0160 727 ASN C N 8722 C CA . ASN C 419 ? 0.1688 0.1854 0.1999 -0.0014 -0.0231 0.0103 727 ASN C CA 8723 C C . ASN C 419 ? 0.1838 0.2000 0.2291 0.0046 -0.0236 0.0142 727 ASN C C 8724 O O . ASN C 419 ? 0.1892 0.2153 0.2429 0.0038 -0.0265 0.0207 727 ASN C O 8725 C CB . ASN C 419 ? 0.1717 0.1743 0.1924 -0.0087 -0.0312 0.0067 727 ASN C CB 8726 C CG . ASN C 419 ? 0.1890 0.1892 0.1929 -0.0141 -0.0309 0.0036 727 ASN C CG 8727 O OD1 . ASN C 419 ? 0.1871 0.1964 0.1909 -0.0212 -0.0326 0.0073 727 ASN C OD1 8728 N ND2 . ASN C 419 ? 0.2089 0.1943 0.1965 -0.0100 -0.0288 -0.0032 727 ASN C ND2 8729 N N . GLY C 420 ? 0.1783 0.1808 0.2250 0.0114 -0.0207 0.0102 728 GLY C N 8730 C CA . GLY C 420 ? 0.1853 0.1836 0.2459 0.0170 -0.0198 0.0144 728 GLY C CA 8731 C C . GLY C 420 ? 0.2162 0.1971 0.2788 0.0239 -0.0162 0.0085 728 GLY C C 8732 O O . GLY C 420 ? 0.2029 0.1800 0.2562 0.0279 -0.0121 0.0030 728 GLY C O 8733 N N . ILE C 421 ? 0.2294 0.1982 0.3043 0.0258 -0.0169 0.0098 729 ILE C N 8734 C CA . ILE C 421 ? 0.2694 0.2207 0.3506 0.0323 -0.0134 0.0043 729 ILE C CA 8735 C C . ILE C 421 ? 0.2618 0.2215 0.3442 0.0427 -0.0039 0.0077 729 ILE C C 8736 O O . ILE C 421 ? 0.2603 0.2069 0.3378 0.0482 -0.0004 0.0004 729 ILE C O 8737 C CB . ILE C 421 ? 0.2985 0.2380 0.3991 0.0329 -0.0128 0.0083 729 ILE C CB 8738 C CG1 . ILE C 421 ? 0.3315 0.2619 0.4347 0.0230 -0.0218 0.0041 729 ILE C CG1 8739 C CG2 . ILE C 421 ? 0.3545 0.2758 0.4652 0.0398 -0.0082 0.0031 729 ILE C CG2 8740 C CD1 . ILE C 421 ? 0.3944 0.3099 0.4869 0.0189 -0.0307 -0.0106 729 ILE C CD1 8741 N N . ASP C 422 ? 0.1912 0.1722 0.2795 0.0461 -0.0004 0.0183 730 ASP C N 8742 C CA . ASP C 422 ? 0.1947 0.1866 0.2883 0.0567 0.0080 0.0228 730 ASP C CA 8743 C C . ASP C 422 ? 0.1959 0.2083 0.2845 0.0557 0.0097 0.0235 730 ASP C C 8744 O O . ASP C 422 ? 0.1762 0.2054 0.2743 0.0633 0.0152 0.0295 730 ASP C O 8745 C CB . ASP C 422 ? 0.1976 0.1986 0.3046 0.0645 0.0107 0.0344 730 ASP C CB 8746 C CG . ASP C 422 ? 0.2727 0.2527 0.3880 0.0664 0.0126 0.0358 730 ASP C CG 8747 O OD1 . ASP C 422 ? 0.2838 0.2446 0.4023 0.0691 0.0165 0.0293 730 ASP C OD1 8748 O OD2 . ASP C 422 ? 0.3065 0.2875 0.4254 0.0653 0.0106 0.0432 730 ASP C OD2 8749 N N . LEU C 423 ? 0.2225 0.2329 0.2980 0.0467 0.0056 0.0176 731 LEU C N 8750 C CA . LEU C 423 ? 0.2174 0.2453 0.2902 0.0444 0.0089 0.0187 731 LEU C CA 8751 C C . LEU C 423 ? 0.2281 0.2575 0.3019 0.0543 0.0205 0.0183 731 LEU C C 8752 O O . LEU C 423 ? 0.2293 0.2806 0.3153 0.0568 0.0258 0.0241 731 LEU C O 8753 C CB . LEU C 423 ? 0.2162 0.2351 0.2714 0.0349 0.0046 0.0122 731 LEU C CB 8754 C CG . LEU C 423 ? 0.2478 0.2814 0.3004 0.0321 0.0103 0.0139 731 LEU C CG 8755 C CD1 . LEU C 423 ? 0.2088 0.2701 0.2812 0.0287 0.0078 0.0221 731 LEU C CD1 8756 C CD2 . LEU C 423 ? 0.2994 0.3208 0.3318 0.0241 0.0067 0.0083 731 LEU C CD2 8757 N N . LYS C 424 ? 0.2274 0.2331 0.2898 0.0601 0.0242 0.0110 732 LYS C N 8758 C CA . LYS C 424 ? 0.2415 0.2442 0.3008 0.0709 0.0365 0.0100 732 LYS C CA 8759 C C . LYS C 424 ? 0.2313 0.2527 0.3131 0.0800 0.0430 0.0195 732 LYS C C 8760 O O . LYS C 424 ? 0.2295 0.2675 0.3200 0.0854 0.0522 0.0242 732 LYS C O 8761 C CB . LYS C 424 ? 0.3086 0.2791 0.3501 0.0764 0.0373 -0.0008 732 LYS C CB 8762 C CG . LYS C 424 ? 0.4086 0.3716 0.4412 0.0889 0.0511 -0.0026 732 LYS C CG 8763 C CD . LYS C 424 ? 0.5115 0.4400 0.5250 0.0949 0.0497 -0.0151 732 LYS C CD 8764 C CE . LYS C 424 ? 0.6019 0.5209 0.6051 0.1092 0.0646 -0.0164 732 LYS C CE 8765 N NZ . LYS C 424 ? 0.6722 0.5559 0.6575 0.1159 0.0620 -0.0297 732 LYS C NZ 8766 N N . ALA C 425 ? 0.1995 0.2181 0.2919 0.0827 0.0388 0.0229 733 ALA C N 8767 C CA . ALA C 425 ? 0.2396 0.2746 0.3512 0.0929 0.0435 0.0325 733 ALA C CA 8768 C C . ALA C 425 ? 0.1931 0.2611 0.3200 0.0904 0.0398 0.0405 733 ALA C C 8769 O O . ALA C 425 ? 0.1942 0.2812 0.3369 0.0989 0.0456 0.0466 733 ALA C O 8770 C CB . ALA C 425 ? 0.2670 0.2904 0.3843 0.0962 0.0403 0.0357 733 ALA C CB 8771 N N . PHE C 426 ? 0.1589 0.2333 0.2824 0.0790 0.0295 0.0401 734 PHE C N 8772 C CA . PHE C 426 ? 0.1840 0.2874 0.3215 0.0749 0.0239 0.0453 734 PHE C CA 8773 C C . PHE C 426 ? 0.1475 0.2648 0.2930 0.0743 0.0325 0.0448 734 PHE C C 8774 O O . PHE C 426 ? 0.1549 0.2975 0.3228 0.0787 0.0339 0.0505 734 PHE C O 8775 C CB . PHE C 426 ? 0.1977 0.3003 0.3263 0.0622 0.0125 0.0433 734 PHE C CB 8776 C CG . PHE C 426 ? 0.1878 0.3170 0.3295 0.0563 0.0059 0.0462 734 PHE C CG 8777 C CD1 . PHE C 426 ? 0.2033 0.3348 0.3405 0.0446 0.0051 0.0422 734 PHE C CD1 8778 C CD2 . PHE C 426 ? 0.1787 0.3297 0.3377 0.0630 -0.0001 0.0525 734 PHE C CD2 8779 C CE1 . PHE C 426 ? 0.2232 0.3780 0.3757 0.0383 -0.0011 0.0441 734 PHE C CE1 8780 C CE2 . PHE C 426 ? 0.2085 0.3838 0.3823 0.0573 -0.0085 0.0534 734 PHE C CE2 8781 C CZ . PHE C 426 ? 0.1770 0.3540 0.3489 0.0442 -0.0087 0.0490 734 PHE C CZ 8782 N N . LEU C 427 ? 0.1987 0.2989 0.3265 0.0697 0.0386 0.0382 735 LEU C N 8783 C CA . LEU C 427 ? 0.2248 0.3332 0.3568 0.0706 0.0504 0.0387 735 LEU C CA 8784 C C . LEU C 427 ? 0.2669 0.3819 0.4128 0.0846 0.0631 0.0431 735 LEU C C 8785 O O . LEU C 427 ? 0.2113 0.3487 0.3791 0.0869 0.0707 0.0485 735 LEU C O 8786 C CB . LEU C 427 ? 0.2533 0.3360 0.3563 0.0669 0.0553 0.0309 735 LEU C CB 8787 C CG . LEU C 427 ? 0.2487 0.3263 0.3387 0.0535 0.0449 0.0272 735 LEU C CG 8788 C CD1 . LEU C 427 ? 0.2700 0.3185 0.3280 0.0532 0.0479 0.0188 735 LEU C CD1 8789 C CD2 . LEU C 427 ? 0.2814 0.3841 0.3893 0.0450 0.0448 0.0323 735 LEU C CD2 8790 N N . ASP C 428 ? 0.2557 0.3514 0.3920 0.0938 0.0655 0.0409 736 ASP C N 8791 C CA . ASP C 428 ? 0.2813 0.3801 0.4289 0.1083 0.0782 0.0451 736 ASP C CA 8792 C C . ASP C 428 ? 0.2537 0.3841 0.4333 0.1141 0.0750 0.0549 736 ASP C C 8793 O O . ASP C 428 ? 0.2849 0.4207 0.4734 0.1207 0.0827 0.0577 736 ASP C O 8794 C CB . ASP C 428 ? 0.3462 0.4146 0.4764 0.1165 0.0809 0.0398 736 ASP C CB 8795 C CG . ASP C 428 ? 0.4452 0.4821 0.5447 0.1156 0.0857 0.0290 736 ASP C CG 8796 O OD1 . ASP C 428 ? 0.4714 0.5099 0.5617 0.1128 0.0919 0.0277 736 ASP C OD1 8797 O OD2 . ASP C 428 ? 0.5044 0.5139 0.5889 0.1185 0.0831 0.0218 736 ASP C OD2 8798 N N . SER C 429 ? 0.1833 0.3272 0.3702 0.1070 0.0596 0.0571 737 SER C N 8799 C CA . SER C 429 ? 0.2148 0.3788 0.4177 0.1076 0.0502 0.0613 737 SER C CA 8800 C C . SER C 429 ? 0.2410 0.4316 0.4654 0.1007 0.0480 0.0624 737 SER C C 8801 O O . SER C 429 ? 0.2456 0.4541 0.4868 0.1021 0.0407 0.0643 737 SER C O 8802 C CB . SER C 429 ? 0.2280 0.3893 0.4232 0.1046 0.0349 0.0620 737 SER C CB 8803 O OG . SER C 429 ? 0.2076 0.3795 0.4039 0.0933 0.0245 0.0604 737 SER C OG 8804 N N . LEU C 430 ? 0.2439 0.4357 0.4682 0.0934 0.0545 0.0606 738 LEU C N 8805 C CA . LEU C 430 ? 0.2681 0.4818 0.5133 0.0844 0.0531 0.0611 738 LEU C CA 8806 C C . LEU C 430 ? 0.3404 0.5566 0.5963 0.0885 0.0714 0.0633 738 LEU C C 8807 O O . LEU C 430 ? 0.3831 0.5794 0.6214 0.0953 0.0868 0.0629 738 LEU C O 8808 C CB . LEU C 430 ? 0.2584 0.4709 0.4964 0.0721 0.0492 0.0586 738 LEU C CB 8809 C CG . LEU C 430 ? 0.2668 0.4757 0.4928 0.0658 0.0317 0.0566 738 LEU C CG 8810 C CD1 . LEU C 430 ? 0.2747 0.4703 0.4820 0.0524 0.0304 0.0516 738 LEU C CD1 8811 C CD2 . LEU C 430 ? 0.2850 0.5104 0.5238 0.0621 0.0150 0.0553 738 LEU C CD2 8812 N N . PRO C 431 ? 0.3702 0.6088 0.6537 0.0851 0.0696 0.0650 739 PRO C N 8813 C CA . PRO C 431 ? 0.4272 0.6685 0.7229 0.0875 0.0877 0.0682 739 PRO C CA 8814 C C . PRO C 431 ? 0.4547 0.6947 0.7497 0.0767 0.0947 0.0675 739 PRO C C 8815 O O . PRO C 431 ? 0.4553 0.6994 0.7487 0.0658 0.0822 0.0643 739 PRO C O 8816 C CB . PRO C 431 ? 0.4169 0.6845 0.7461 0.0878 0.0802 0.0698 739 PRO C CB 8817 C CG . PRO C 431 ? 0.3955 0.6757 0.7299 0.0794 0.0574 0.0653 739 PRO C CG 8818 C CD . PRO C 431 ? 0.3757 0.6361 0.6793 0.0808 0.0508 0.0635 739 PRO C CD 8819 N N . ASP C 432 ? 0.5186 0.7501 0.8118 0.0803 0.1149 0.0707 740 ASP C N 8820 C CA . ASP C 432 ? 0.5327 0.7617 0.8263 0.0714 0.1244 0.0715 740 ASP C CA 8821 C C . ASP C 432 ? 0.4715 0.6814 0.7343 0.0664 0.1242 0.0678 740 ASP C C 8822 O O . ASP C 432 ? 0.4791 0.6891 0.7429 0.0564 0.1267 0.0679 740 ASP C O 8823 C CB . ASP C 432 ? 0.5792 0.8348 0.9085 0.0592 0.1132 0.0713 740 ASP C CB 8824 C CG . ASP C 432 ? 0.6531 0.9292 1.0152 0.0643 0.1131 0.0743 740 ASP C CG 8825 O OD1 . ASP C 432 ? 0.6810 0.9504 1.0443 0.0739 0.1312 0.0796 740 ASP C OD1 8826 O OD2 . ASP C 432 ? 0.6696 0.9673 1.0544 0.0596 0.0946 0.0711 740 ASP C OD2 8827 N N . VAL C 433 ? 0.4027 0.5955 0.6387 0.0734 0.1213 0.0646 741 VAL C N 8828 C CA . VAL C 433 ? 0.3812 0.5504 0.5821 0.0701 0.1213 0.0596 741 VAL C CA 8829 C C . VAL C 433 ? 0.4048 0.5490 0.5782 0.0776 0.1433 0.0598 741 VAL C C 8830 O O . VAL C 433 ? 0.4187 0.5501 0.5818 0.0912 0.1566 0.0607 741 VAL C O 8831 C CB . VAL C 433 ? 0.3593 0.5072 0.5314 0.0732 0.1071 0.0524 741 VAL C CB 8832 C CG1 . VAL C 433 ? 0.3700 0.4851 0.4987 0.0691 0.1043 0.0442 741 VAL C CG1 8833 C CG2 . VAL C 433 ? 0.3225 0.4896 0.5134 0.0665 0.0862 0.0526 741 VAL C CG2 8834 N N . LYS C 434 ? 0.3968 0.5311 0.5547 0.0693 0.1464 0.0589 742 LYS C N 8835 C CA . LYS C 434 ? 0.4560 0.5646 0.5835 0.0776 0.1676 0.0599 742 LYS C CA 8836 C C . LYS C 434 ? 0.4708 0.5430 0.5447 0.0778 0.1587 0.0499 742 LYS C C 8837 O O . LYS C 434 ? 0.4071 0.4786 0.4745 0.0660 0.1398 0.0448 742 LYS C O 8838 C CB . LYS C 434 ? 0.4971 0.6158 0.6431 0.0683 0.1761 0.0662 742 LYS C CB 8839 C CG . LYS C 434 ? 0.6013 0.6901 0.7127 0.0764 0.1951 0.0681 742 LYS C CG 8840 C CD . LYS C 434 ? 0.6291 0.7262 0.7601 0.0663 0.2016 0.0742 742 LYS C CD 8841 C CE . LYS C 434 ? 0.6877 0.7519 0.7791 0.0750 0.2187 0.0765 742 LYS C CE 8842 N NZ . LYS C 434 ? 0.7029 0.7728 0.8130 0.0659 0.2258 0.0827 742 LYS C NZ 8843 N N . ILE C 435 ? 0.5129 0.5543 0.5486 0.0921 0.1719 0.0468 743 ILE C N 8844 C CA . ILE C 435 ? 0.5303 0.5363 0.5151 0.0940 0.1627 0.0363 743 ILE C CA 8845 C C . ILE C 435 ? 0.5748 0.5629 0.5317 0.0972 0.1781 0.0393 743 ILE C C 8846 O O . ILE C 435 ? 0.5653 0.5428 0.5130 0.1084 0.1978 0.0447 743 ILE C O 8847 C CB . ILE C 435 ? 0.5688 0.5465 0.5223 0.1088 0.1623 0.0276 743 ILE C CB 8848 C CG1 . ILE C 435 ? 0.5168 0.5104 0.4983 0.1073 0.1502 0.0262 743 ILE C CG1 8849 C CG2 . ILE C 435 ? 0.6051 0.5478 0.5102 0.1098 0.1486 0.0151 743 ILE C CG2 8850 C CD1 . ILE C 435 ? 0.4988 0.5016 0.4907 0.0926 0.1254 0.0216 743 ILE C CD1 8851 N N . VAL C 436 ? 0.5861 0.5693 0.5300 0.0860 0.1659 0.0363 744 VAL C N 8852 C CA . VAL C 436 ? 0.6321 0.5962 0.5464 0.0893 0.1793 0.0394 744 VAL C CA 8853 C C . VAL C 436 ? 0.7129 0.6364 0.5678 0.1001 0.1713 0.0280 744 VAL C C 8854 O O . VAL C 436 ? 0.6793 0.5955 0.5233 0.0943 0.1475 0.0174 744 VAL C O 8855 C CB . VAL C 436 ? 0.5841 0.5652 0.5182 0.0719 0.1721 0.0434 744 VAL C CB 8856 C CG1 . VAL C 436 ? 0.6345 0.5924 0.5359 0.0754 0.1828 0.0462 744 VAL C CG1 8857 C CG2 . VAL C 436 ? 0.5302 0.5501 0.5232 0.0619 0.1790 0.0533 744 VAL C CG2 8858 N N . LYS C 437 ? 0.7974 0.6963 0.6229 0.1118 0.1823 0.0299 745 LYS C N 8859 C CA . LYS C 437 ? 0.8782 0.7394 0.6507 0.1219 0.1709 0.0194 745 LYS C CA 8860 C C . LYS C 437 ? 0.9057 0.7524 0.6551 0.1203 0.1701 0.0223 745 LYS C C 8861 O O . LYS C 437 ? 0.8710 0.7355 0.6446 0.1107 0.1786 0.0316 745 LYS C O 8862 C CB . LYS C 437 ? 0.9478 0.7884 0.7006 0.1383 0.1806 0.0193 745 LYS C CB 8863 C CG . LYS C 437 ? 0.9501 0.7983 0.7192 0.1421 0.1794 0.0148 745 LYS C CG 8864 C CD . LYS C 437 ? 0.9972 0.8226 0.7437 0.1581 0.1894 0.0152 745 LYS C CD 8865 C CE . LYS C 437 ? 0.9970 0.8287 0.7600 0.1619 0.1879 0.0107 745 LYS C CE 8866 N NZ . LYS C 437 ? 1.0499 0.8588 0.7899 0.1772 0.1982 0.0115 745 LYS C NZ 8867 N N . MET C 438 ? 0.9803 0.7952 0.6855 0.1300 0.1586 0.0141 746 MET C N 8868 C CA . MET C 438 ? 1.0214 0.8197 0.7019 0.1319 0.1571 0.0166 746 MET C CA 8869 C C . MET C 438 ? 1.0930 0.8579 0.7324 0.1502 0.1603 0.0155 746 MET C C 8870 O O . MET C 438 ? 1.1180 0.8608 0.7245 0.1553 0.1431 0.0072 746 MET C O 8871 C CB . MET C 438 ? 0.9953 0.7918 0.6664 0.1222 0.1326 0.0072 746 MET C CB 8872 C CG . MET C 438 ? 0.9612 0.7859 0.6658 0.1047 0.1320 0.0117 746 MET C CG 8873 S SD . MET C 438 ? 1.3978 1.2199 1.0933 0.0937 0.1023 0.0006 746 MET C SD 8874 C CE . MET C 438 ? 0.7916 0.5844 0.4488 0.1046 0.0956 -0.0011 746 MET C CE 8875 N N . ASN C 455 ? 0.6980 0.5394 0.4504 0.1039 0.0902 -0.0232 763 ASN C N 8876 C CA . ASN C 455 ? 0.6929 0.5642 0.4903 0.0993 0.0999 -0.0142 763 ASN C CA 8877 C C . ASN C 455 ? 0.6453 0.5484 0.4853 0.0805 0.0875 -0.0092 763 ASN C C 8878 O O . ASN C 455 ? 0.6790 0.5804 0.5234 0.0728 0.0674 -0.0164 763 ASN C O 8879 C CB . ASN C 455 ? 0.7750 0.6359 0.5723 0.1088 0.0979 -0.0214 763 ASN C CB 8880 C CG . ASN C 455 ? 0.8697 0.7043 0.6317 0.1289 0.1162 -0.0231 763 ASN C CG 8881 O OD1 . ASN C 455 ? 0.8996 0.7463 0.6772 0.1357 0.1378 -0.0131 763 ASN C OD1 8882 N ND2 . ASN C 455 ? 0.9164 0.7197 0.6388 0.1354 0.1038 -0.0339 763 ASN C ND2 8883 N N . MET C 456 ? 0.4853 0.3940 0.4533 0.1087 0.0610 0.0194 764 MET C N 8884 C CA . MET C 456 ? 0.4494 0.3468 0.4242 0.0999 0.0579 0.0165 764 MET C CA 8885 C C . MET C 456 ? 0.4251 0.3430 0.4248 0.1086 0.0619 0.0072 764 MET C C 8886 O O . MET C 456 ? 0.4339 0.3658 0.4482 0.1141 0.0877 0.0057 764 MET C O 8887 C CB . MET C 456 ? 0.4418 0.3032 0.4064 0.0918 0.0739 0.0230 764 MET C CB 8888 C CG . MET C 456 ? 0.4370 0.2869 0.4115 0.0852 0.0696 0.0109 764 MET C CG 8889 S SD . MET C 456 ? 0.5590 0.3615 0.5365 0.0736 0.0725 0.0094 764 MET C SD 8890 C CE . MET C 456 ? 0.5452 0.3240 0.5353 0.0586 0.0972 0.0245 764 MET C CE 8891 N N . PRO C 457 ? 0.3699 0.2987 0.3808 0.1087 0.0405 0.0028 765 PRO C N 8892 C CA . PRO C 457 ? 0.3502 0.3041 0.3889 0.1192 0.0384 -0.0043 765 PRO C CA 8893 C C . PRO C 457 ? 0.3119 0.2671 0.3527 0.0926 0.0523 -0.0102 765 PRO C C 8894 O O . PRO C 457 ? 0.3070 0.2364 0.3293 0.0842 0.0559 -0.0121 765 PRO C O 8895 C CB . PRO C 457 ? 0.3805 0.3381 0.4214 0.1188 0.0041 0.0033 765 PRO C CB 8896 C CG . PRO C 457 ? 0.3828 0.3266 0.4102 0.1056 -0.0034 0.0113 765 PRO C CG 8897 C CD . PRO C 457 ? 0.3377 0.2632 0.3406 0.1001 0.0190 0.0088 765 PRO C CD 8898 N N . VAL C 458 ? 0.2694 0.2597 0.3374 0.0797 0.0570 -0.0177 766 VAL C N 8899 C CA . VAL C 458 ? 0.3066 0.2977 0.3815 0.0519 0.0655 -0.0241 766 VAL C CA 8900 C C . VAL C 458 ? 0.3079 0.3412 0.4101 0.0402 0.0491 -0.0326 766 VAL C C 8901 O O . VAL C 458 ? 0.3001 0.3722 0.4313 0.0480 0.0418 -0.0356 766 VAL C O 8902 C CB . VAL C 458 ? 0.3407 0.3330 0.4222 0.0362 0.0867 -0.0179 766 VAL C CB 8903 C CG1 . VAL C 458 ? 0.3686 0.3594 0.4650 0.0057 0.0871 -0.0236 766 VAL C CG1 8904 C CG2 . VAL C 458 ? 0.3220 0.2673 0.3760 0.0417 0.0971 -0.0046 766 VAL C CG2 8905 N N . ILE C 459 ? 0.3128 0.3437 0.4082 0.0226 0.0414 -0.0401 767 ILE C N 8906 C CA . ILE C 459 ? 0.3099 0.3796 0.4268 0.0057 0.0243 -0.0461 767 ILE C CA 8907 C C . ILE C 459 ? 0.3480 0.4236 0.4824 -0.0180 0.0371 -0.0565 767 ILE C C 8908 O O . ILE C 459 ? 0.3324 0.3776 0.4544 -0.0293 0.0456 -0.0660 767 ILE C O 8909 C CB . ILE C 459 ? 0.2925 0.3720 0.3881 -0.0053 0.0065 -0.0486 767 ILE C CB 8910 C CG1 . ILE C 459 ? 0.2991 0.3765 0.3797 0.0106 -0.0130 -0.0303 767 ILE C CG1 8911 C CG2 . ILE C 459 ? 0.2668 0.3875 0.3808 -0.0288 -0.0120 -0.0529 767 ILE C CG2 8912 C CD1 . ILE C 459 ? 0.3356 0.4356 0.3882 -0.0059 -0.0271 -0.0276 767 ILE C CD1 8913 N N . PRO C 460 ? 0.4023 0.5176 0.5710 -0.0251 0.0339 -0.0565 768 PRO C N 8914 C CA . PRO C 460 ? 0.4427 0.5696 0.6320 -0.0516 0.0438 -0.0613 768 PRO C CA 8915 C C . PRO C 460 ? 0.4811 0.6056 0.6679 -0.0740 0.0311 -0.0756 768 PRO C C 8916 O O . PRO C 460 ? 0.4773 0.6104 0.6484 -0.0718 0.0149 -0.0807 768 PRO C O 8917 C CB . PRO C 460 ? 0.4382 0.6244 0.6687 -0.0485 0.0400 -0.0612 768 PRO C CB 8918 C CG . PRO C 460 ? 0.4195 0.6181 0.6558 -0.0255 0.0136 -0.0621 768 PRO C CG 8919 C CD . PRO C 460 ? 0.4072 0.5608 0.6039 -0.0078 0.0154 -0.0543 768 PRO C CD 8920 N N . MET C 461 ? 0.5376 0.6559 0.7396 -0.0987 0.0358 -0.0810 769 MET C N 8921 C CA . MET C 461 ? 0.5602 0.6757 0.7620 -0.1190 0.0226 -0.1017 769 MET C CA 8922 C C . MET C 461 ? 0.5700 0.7386 0.7935 -0.1319 0.0063 -0.1035 769 MET C C 8923 O O . MET C 461 ? 0.6276 0.8132 0.8785 -0.1541 0.0034 -0.1058 769 MET C O 8924 C CB . MET C 461 ? 0.6115 0.6911 0.8272 -0.1413 0.0246 -0.1063 769 MET C CB 8925 C CG . MET C 461 ? 0.6536 0.7182 0.8688 -0.1553 0.0078 -0.1386 769 MET C CG 8926 S SD . MET C 461 ? 0.9862 1.0324 1.1660 -0.1316 0.0045 -0.1704 769 MET C SD 8927 C CE . MET C 461 ? 1.1046 1.1542 1.2957 -0.1495 -0.0164 -0.2191 769 MET C CE 8928 N N . ASN C 462 ? 0.5339 0.7272 0.7469 -0.1206 -0.0089 -0.0987 770 ASN C N 8929 C CA . ASN C 462 ? 0.5228 0.7621 0.7566 -0.1336 -0.0335 -0.0957 770 ASN C CA 8930 C C . ASN C 462 ? 0.5160 0.7733 0.7214 -0.1521 -0.0516 -0.1062 770 ASN C C 8931 O O . ASN C 462 ? 0.4964 0.7373 0.6727 -0.1549 -0.0418 -0.1264 770 ASN C O 8932 C CB . ASN C 462 ? 0.5344 0.7936 0.7884 -0.1118 -0.0500 -0.0780 770 ASN C CB 8933 C CG . ASN C 462 ? 0.5560 0.7913 0.7778 -0.0912 -0.0538 -0.0672 770 ASN C CG 8934 O OD1 . ASN C 462 ? 0.5620 0.7804 0.7447 -0.0966 -0.0471 -0.0723 770 ASN C OD1 8935 N ND2 . ASN C 462 ? 0.5598 0.7980 0.8022 -0.0662 -0.0671 -0.0561 770 ASN C ND2 8936 N N . THR C 463 ? 0.5266 0.8242 0.7432 -0.1652 -0.0811 -0.0941 771 THR C N 8937 C CA . THR C 463 ? 0.5406 0.8746 0.7279 -0.1908 -0.1020 -0.0979 771 THR C CA 8938 C C . THR C 463 ? 0.5302 0.8662 0.6723 -0.1851 -0.0996 -0.0954 771 THR C C 8939 O O . THR C 463 ? 0.5361 0.8963 0.6454 -0.1986 -0.0943 -0.1177 771 THR C O 8940 C CB . THR C 463 ? 0.5447 0.8980 0.7479 -0.1967 -0.1378 -0.0701 771 THR C CB 8941 O OG1 . THR C 463 ? 0.5601 0.9204 0.8055 -0.2033 -0.1403 -0.0765 771 THR C OG1 8942 C CG2 . THR C 463 ? 0.5803 0.9493 0.7379 -0.2114 -0.1500 -0.0628 771 THR C CG2 8943 N N . ILE C 464 ? 0.5211 0.8359 0.6640 -0.1627 -0.1040 -0.0710 772 ILE C N 8944 C CA . ILE C 464 ? 0.5350 0.8505 0.6392 -0.1564 -0.1020 -0.0637 772 ILE C CA 8945 C C . ILE C 464 ? 0.5524 0.8466 0.6346 -0.1452 -0.0672 -0.0985 772 ILE C C 8946 O O . ILE C 464 ? 0.5577 0.8867 0.6076 -0.1551 -0.0647 -0.1154 772 ILE C O 8947 C CB . ILE C 464 ? 0.5197 0.8008 0.6357 -0.1283 -0.1105 -0.0364 772 ILE C CB 8948 C CG1 . ILE C 464 ? 0.5511 0.8446 0.7038 -0.1320 -0.1539 -0.0091 772 ILE C CG1 8949 C CG2 . ILE C 464 ? 0.4948 0.7794 0.5719 -0.1259 -0.1120 -0.0246 772 ILE C CG2 8950 C CD1 . ILE C 464 ? 0.5834 0.8841 0.7083 -0.1476 -0.1751 0.0107 772 ILE C CD1 8951 N N . ALA C 465 ? 0.3534 0.5733 0.6537 0.0116 -0.0361 0.0537 773 ALA C N 8952 C CA . ALA C 465 ? 0.3547 0.5676 0.6463 0.0035 -0.0334 0.0501 773 ALA C CA 8953 C C . ALA C 465 ? 0.3488 0.5590 0.6389 -0.0075 -0.0500 0.0463 773 ALA C C 8954 O O . ALA C 465 ? 0.3273 0.5266 0.6001 -0.0131 -0.0531 0.0411 773 ALA C O 8955 C CB . ALA C 465 ? 0.3845 0.6025 0.6902 0.0036 -0.0176 0.0545 773 ALA C CB 8956 N N . GLU C 466 ? 0.3547 0.5735 0.6620 -0.0101 -0.0609 0.0487 774 GLU C N 8957 C CA . GLU C 466 ? 0.3534 0.5675 0.6576 -0.0199 -0.0775 0.0446 774 GLU C CA 8958 C C . GLU C 466 ? 0.3183 0.5191 0.5939 -0.0193 -0.0904 0.0384 774 GLU C C 8959 O O . GLU C 466 ? 0.2774 0.4657 0.5354 -0.0260 -0.0982 0.0326 774 GLU C O 8960 C CB . GLU C 466 ? 0.4076 0.6344 0.7380 -0.0223 -0.0864 0.0491 774 GLU C CB 8961 C CG . GLU C 466 ? 0.4526 0.6913 0.8116 -0.0242 -0.0745 0.0558 774 GLU C CG 8962 C CD . GLU C 466 ? 0.4988 0.7524 0.8873 -0.0250 -0.0819 0.0619 774 GLU C CD 8963 O OE1 . GLU C 466 ? 0.5247 0.7791 0.9108 -0.0242 -0.0972 0.0604 774 GLU C OE1 8964 O OE2 . GLU C 466 ? 0.5032 0.7674 0.9171 -0.0260 -0.0723 0.0685 774 GLU C OE2 8965 N N . ALA C 467 ? 0.3260 0.5281 0.5957 -0.0105 -0.0917 0.0401 775 ALA C N 8966 C CA . ALA C 467 ? 0.3393 0.5283 0.5808 -0.0083 -0.1025 0.0358 775 ALA C CA 8967 C C . ALA C 467 ? 0.3044 0.4796 0.5216 -0.0092 -0.0969 0.0314 775 ALA C C 8968 O O . ALA C 467 ? 0.3063 0.4673 0.4979 -0.0113 -0.1061 0.0265 775 ALA C O 8969 C CB . ALA C 467 ? 0.3248 0.5181 0.5669 0.0020 -0.1027 0.0399 775 ALA C CB 8970 N N . VAL C 468 ? 0.3057 0.4844 0.5296 -0.0070 -0.0812 0.0333 776 VAL C N 8971 C CA . VAL C 468 ? 0.2813 0.4489 0.4856 -0.0081 -0.0753 0.0299 776 VAL C CA 8972 C C . VAL C 468 ? 0.3026 0.4623 0.5001 -0.0183 -0.0795 0.0250 776 VAL C C 8973 O O . VAL C 468 ? 0.2871 0.4295 0.4552 -0.0201 -0.0827 0.0190 776 VAL C O 8974 C CB . VAL C 468 ? 0.2749 0.4438 0.4816 -0.0022 -0.0555 0.0320 776 VAL C CB 8975 C CG1 . VAL C 468 ? 0.2298 0.3814 0.4087 -0.0043 -0.0471 0.0262 776 VAL C CG1 8976 C CG2 . VAL C 468 ? 0.3009 0.4714 0.5068 0.0085 -0.0513 0.0353 776 VAL C CG2 8977 N N . ILE C 469 ? 0.2783 0.4459 0.4963 -0.0236 -0.0764 0.0266 777 ILE C N 8978 C CA . ILE C 469 ? 0.2945 0.4538 0.5079 -0.0332 -0.0802 0.0224 777 ILE C CA 8979 C C . ILE C 469 ? 0.3050 0.4530 0.5022 -0.0375 -0.0980 0.0170 777 ILE C C 8980 O O . ILE C 469 ? 0.3136 0.4472 0.4926 -0.0430 -0.1025 0.0113 777 ILE C O 8981 C CB . ILE C 469 ? 0.3621 0.5319 0.6022 -0.0377 -0.0731 0.0265 777 ILE C CB 8982 C CG1 . ILE C 469 ? 0.3998 0.5781 0.6511 -0.0316 -0.0539 0.0320 777 ILE C CG1 8983 C CG2 . ILE C 469 ? 0.3613 0.5205 0.5957 -0.0473 -0.0759 0.0224 777 ILE C CG2 8984 C CD1 . ILE C 469 ? 0.4164 0.6039 0.6917 -0.0345 -0.0449 0.0373 777 ILE C CD1 8985 N N . GLU C 470 ? 0.3467 0.5000 0.5488 -0.0343 -0.1078 0.0187 778 GLU C N 8986 C CA . GLU C 470 ? 0.3551 0.4964 0.5387 -0.0369 -0.1244 0.0138 778 GLU C CA 8987 C C . GLU C 470 ? 0.2987 0.4217 0.4456 -0.0335 -0.1268 0.0087 778 GLU C C 8988 O O . GLU C 470 ? 0.2985 0.4048 0.4225 -0.0372 -0.1344 0.0026 778 GLU C O 8989 C CB . GLU C 470 ? 0.3971 0.5483 0.5933 -0.0334 -0.1339 0.0174 778 GLU C CB 8990 C CG . GLU C 470 ? 0.4927 0.6308 0.6684 -0.0354 -0.1512 0.0126 778 GLU C CG 8991 C CD . GLU C 470 ? 0.5708 0.7190 0.7594 -0.0319 -0.1614 0.0166 778 GLU C CD 8992 O OE1 . GLU C 470 ? 0.5778 0.7447 0.7983 -0.0308 -0.1567 0.0230 778 GLU C OE1 8993 O OE2 . GLU C 470 ? 0.6103 0.7472 0.7763 -0.0297 -0.1735 0.0138 778 GLU C OE2 8994 N N . MET C 471 ? 0.2553 0.3804 0.3963 -0.0259 -0.1197 0.0116 779 MET C N 8995 C CA . MET C 471 ? 0.2556 0.3640 0.3636 -0.0221 -0.1196 0.0084 779 MET C CA 8996 C C . MET C 471 ? 0.2803 0.3748 0.3714 -0.0274 -0.1141 0.0028 779 MET C C 8997 O O . MET C 471 ? 0.2835 0.3600 0.3455 -0.0277 -0.1196 -0.0023 779 MET C O 8998 C CB . MET C 471 ? 0.2175 0.3294 0.3243 -0.0137 -0.1063 0.0125 779 MET C CB 8999 C CG . MET C 471 ? 0.2192 0.3126 0.2917 -0.0095 -0.0994 0.0096 779 MET C CG 9000 S SD . MET C 471 ? 0.2999 0.3950 0.3717 -0.0007 -0.0841 0.0138 779 MET C SD 9001 C CE . MET C 471 ? 0.2861 0.3901 0.3775 -0.0035 -0.0695 0.0139 779 MET C CE 9002 N N . ILE C 472 ? 0.2639 0.3657 0.3717 -0.0305 -0.1017 0.0041 780 ILE C N 9003 C CA . ILE C 472 ? 0.3154 0.4048 0.4088 -0.0345 -0.0940 -0.0004 780 ILE C CA 9004 C C . ILE C 472 ? 0.3298 0.4093 0.4182 -0.0426 -0.1069 -0.0054 780 ILE C C 9005 O O . ILE C 472 ? 0.3708 0.4318 0.4317 -0.0429 -0.1071 -0.0109 780 ILE C O 9006 C CB . ILE C 472 ? 0.3335 0.4331 0.4467 -0.0357 -0.0789 0.0029 780 ILE C CB 9007 C CG1 . ILE C 472 ? 0.3367 0.4437 0.4533 -0.0273 -0.0674 0.0072 780 ILE C CG1 9008 C CG2 . ILE C 472 ? 0.3599 0.4459 0.4567 -0.0388 -0.0709 -0.0011 780 ILE C CG2 9009 C CD1 . ILE C 472 ? 0.3420 0.4351 0.4306 -0.0220 -0.0599 0.0047 780 ILE C CD1 9010 N N . ASN C 473 ? 0.3679 0.4580 0.4810 -0.0477 -0.1149 -0.0037 781 ASN C N 9011 C CA . ASN C 473 ? 0.4234 0.5018 0.5302 -0.0543 -0.1243 -0.0088 781 ASN C CA 9012 C C . ASN C 473 ? 0.4497 0.5098 0.5241 -0.0513 -0.1360 -0.0144 781 ASN C C 9013 O O . ASN C 473 ? 0.4655 0.5070 0.5186 -0.0541 -0.1395 -0.0205 781 ASN C O 9014 C CB . ASN C 473 ? 0.4453 0.5385 0.5844 -0.0591 -0.1284 -0.0048 781 ASN C CB 9015 C CG . ASN C 473 ? 0.4476 0.5539 0.6144 -0.0627 -0.1153 0.0002 781 ASN C CG 9016 O OD1 . ASN C 473 ? 0.4544 0.5551 0.6142 -0.0638 -0.1054 -0.0008 781 ASN C OD1 9017 N ND2 . ASN C 473 ? 0.4314 0.5546 0.6289 -0.0641 -0.1146 0.0061 781 ASN C ND2 9018 N N . ARG C 474 ? 0.4226 0.4867 0.4922 -0.0449 -0.1409 -0.0119 782 ARG C N 9019 C CA . ARG C 474 ? 0.4078 0.4548 0.4459 -0.0409 -0.1506 -0.0159 782 ARG C CA 9020 C C . ARG C 474 ? 0.4128 0.4433 0.4168 -0.0348 -0.1435 -0.0184 782 ARG C C 9021 O O . ARG C 474 ? 0.4598 0.4729 0.4334 -0.0307 -0.1479 -0.0217 782 ARG C O 9022 C CB . ARG C 474 ? 0.4085 0.4657 0.4544 -0.0361 -0.1585 -0.0116 782 ARG C CB 9023 C CG . ARG C 474 ? 0.4122 0.4837 0.4891 -0.0415 -0.1673 -0.0092 782 ARG C CG 9024 C CD . ARG C 474 ? 0.4615 0.5438 0.5467 -0.0360 -0.1744 -0.0044 782 ARG C CD 9025 N NE . ARG C 474 ? 0.5324 0.5979 0.5830 -0.0301 -0.1819 -0.0071 782 ARG C NE 9026 C CZ . ARG C 474 ? 0.5856 0.6405 0.6234 -0.0315 -0.1960 -0.0104 782 ARG C CZ 9027 N NH1 . ARG C 474 ? 0.6100 0.6695 0.6680 -0.0392 -0.2053 -0.0117 782 ARG C NH1 9028 N NH2 . ARG C 474 ? 0.6043 0.6433 0.6090 -0.0250 -0.2005 -0.0121 782 ARG C NH2 9029 N N . GLY C 475 ? 0.4010 0.4364 0.4099 -0.0341 -0.1318 -0.0163 783 GLY C N 9030 C CA . GLY C 475 ? 0.4118 0.4330 0.3913 -0.0283 -0.1233 -0.0175 783 GLY C CA 9031 C C . GLY C 475 ? 0.4144 0.4352 0.3808 -0.0195 -0.1233 -0.0135 783 GLY C C 9032 O O . GLY C 475 ? 0.4340 0.4394 0.3710 -0.0136 -0.1180 -0.0143 783 GLY C O 9033 N N . GLN C 476 ? 0.3797 0.4172 0.3688 -0.0181 -0.1283 -0.0085 784 GLN C N 9034 C CA . GLN C 476 ? 0.3364 0.3745 0.3166 -0.0096 -0.1277 -0.0036 784 GLN C CA 9035 C C . GLN C 476 ? 0.2848 0.3233 0.2623 -0.0049 -0.1089 -0.0005 784 GLN C C 9036 O O . GLN C 476 ? 0.2785 0.3242 0.2713 -0.0080 -0.0979 -0.0006 784 GLN C O 9037 C CB . GLN C 476 ? 0.3423 0.3991 0.3509 -0.0089 -0.1345 0.0012 784 GLN C CB 9038 C CG . GLN C 476 ? 0.4447 0.5002 0.4542 -0.0119 -0.1476 -0.0012 784 GLN C CG 9039 C CD . GLN C 476 ? 0.5100 0.5866 0.5544 -0.0131 -0.1527 0.0035 784 GLN C CD 9040 O OE1 . GLN C 476 ? 0.6025 0.6804 0.6525 -0.0161 -0.1640 0.0023 784 GLN C OE1 9041 N NE2 . GLN C 476 ? 0.4772 0.5696 0.5448 -0.0102 -0.1440 0.0089 784 GLN C NE2 9042 N N . ILE C 477 ? 0.2722 0.3022 0.2301 0.0024 -0.1057 0.0026 785 ILE C N 9043 C CA . ILE C 477 ? 0.2731 0.3011 0.2270 0.0063 -0.0896 0.0057 785 ILE C CA 9044 C C . ILE C 477 ? 0.2397 0.2829 0.2191 0.0082 -0.0836 0.0101 785 ILE C C 9045 O O . ILE C 477 ? 0.2001 0.2456 0.1866 0.0077 -0.0714 0.0105 785 ILE C O 9046 C CB . ILE C 477 ? 0.3758 0.3892 0.3017 0.0136 -0.0880 0.0087 785 ILE C CB 9047 C CG1 . ILE C 477 ? 0.4626 0.4583 0.3590 0.0137 -0.0929 0.0043 785 ILE C CG1 9048 C CG2 . ILE C 477 ? 0.3712 0.3826 0.2961 0.0165 -0.0722 0.0124 785 ILE C CG2 9049 C CD1 . ILE C 477 ? 0.4872 0.4783 0.3817 0.0088 -0.0854 -0.0007 785 ILE C CD1 9050 N N . GLN C 478 ? 0.2294 0.2817 0.2211 0.0108 -0.0926 0.0135 786 GLN C N 9051 C CA . GLN C 478 ? 0.2203 0.2845 0.2332 0.0145 -0.0868 0.0181 786 GLN C CA 9052 C C . GLN C 478 ? 0.2411 0.3178 0.2720 0.0163 -0.0993 0.0214 786 GLN C C 9053 O O . GLN C 478 ? 0.2631 0.3365 0.2851 0.0158 -0.1134 0.0207 786 GLN C O 9054 C CB . GLN C 478 ? 0.2311 0.2859 0.2296 0.0210 -0.0789 0.0220 786 GLN C CB 9055 C CG . GLN C 478 ? 0.2924 0.3381 0.2717 0.0264 -0.0877 0.0253 786 GLN C CG 9056 C CD . GLN C 478 ? 0.3624 0.3941 0.3212 0.0310 -0.0785 0.0287 786 GLN C CD 9057 O OE1 . GLN C 478 ? 0.4041 0.4347 0.3675 0.0304 -0.0667 0.0292 786 GLN C OE1 9058 N NE2 . GLN C 478 ? 0.4140 0.4345 0.3501 0.0356 -0.0843 0.0316 786 GLN C NE2 9059 N N . ILE C 479 ? 0.2323 0.3229 0.2884 0.0189 -0.0943 0.0249 787 ILE C N 9060 C CA . ILE C 479 ? 0.2420 0.3459 0.3182 0.0225 -0.1041 0.0298 787 ILE C CA 9061 C C . ILE C 479 ? 0.2422 0.3496 0.3277 0.0305 -0.0946 0.0347 787 ILE C C 9062 O O . ILE C 479 ? 0.2494 0.3487 0.3261 0.0321 -0.0818 0.0337 787 ILE C O 9063 C CB . ILE C 479 ? 0.2416 0.3634 0.3488 0.0168 -0.1088 0.0298 787 ILE C CB 9064 C CG1 . ILE C 479 ? 0.2356 0.3642 0.3586 0.0158 -0.0925 0.0296 787 ILE C CG1 9065 C CG2 . ILE C 479 ? 0.2434 0.3603 0.3427 0.0083 -0.1205 0.0246 787 ILE C CG2 9066 C CD1 . ILE C 479 ? 0.2472 0.3936 0.4021 0.0105 -0.0941 0.0311 787 ILE C CD1 9067 N N . THR C 480 ? 0.2213 0.3403 0.3249 0.0357 -0.1018 0.0401 788 THR C N 9068 C CA . THR C 480 ? 0.2213 0.3432 0.3351 0.0443 -0.0932 0.0449 788 THR C CA 9069 C C . THR C 480 ? 0.2196 0.3622 0.3687 0.0459 -0.0919 0.0484 788 THR C C 9070 O O . THR C 480 ? 0.2386 0.3917 0.4012 0.0431 -0.1016 0.0487 788 THR C O 9071 C CB . THR C 480 ? 0.2352 0.3502 0.3371 0.0519 -0.1010 0.0499 788 THR C CB 9072 O OG1 . THR C 480 ? 0.2175 0.3133 0.2869 0.0510 -0.1004 0.0479 788 THR C OG1 9073 C CG2 . THR C 480 ? 0.2702 0.3863 0.3826 0.0610 -0.0917 0.0546 788 THR C CG2 9074 N N . ILE C 481 ? 0.1959 0.3403 0.3544 0.0499 -0.0770 0.0490 789 ILE C N 9075 C CA . ILE C 481 ? 0.1618 0.3242 0.3520 0.0536 -0.0718 0.0531 789 ILE C CA 9076 C C . ILE C 481 ? 0.1642 0.3225 0.3561 0.0647 -0.0608 0.0564 789 ILE C C 9077 O O . ILE C 481 ? 0.1976 0.3415 0.3724 0.0663 -0.0495 0.0529 789 ILE C O 9078 C CB . ILE C 481 ? 0.1751 0.3449 0.3779 0.0476 -0.0625 0.0507 789 ILE C CB 9079 C CG1 . ILE C 481 ? 0.1998 0.3710 0.4001 0.0362 -0.0730 0.0468 789 ILE C CG1 9080 C CG2 . ILE C 481 ? 0.1598 0.3431 0.3882 0.0515 -0.0537 0.0539 789 ILE C CG2 9081 C CD1 . ILE C 481 ? 0.2049 0.3822 0.4171 0.0298 -0.0641 0.0450 789 ILE C CD1 9082 N N . ASN C 482 ? 0.1932 0.3583 0.3982 0.0708 -0.0632 0.0599 790 ASN C N 9083 C CA . ASN C 482 ? 0.2251 0.3843 0.4306 0.0819 -0.0541 0.0628 790 ASN C CA 9084 C C . ASN C 482 ? 0.2138 0.3539 0.3946 0.0859 -0.0537 0.0630 790 ASN C C 9085 O O . ASN C 482 ? 0.2343 0.3639 0.4097 0.0930 -0.0429 0.0631 790 ASN C O 9086 C CB . ASN C 482 ? 0.2085 0.3707 0.4254 0.0855 -0.0373 0.0622 790 ASN C CB 9087 C CG . ASN C 482 ? 0.2239 0.4047 0.4669 0.0829 -0.0358 0.0641 790 ASN C CG 9088 O OD1 . ASN C 482 ? 0.2105 0.4024 0.4663 0.0805 -0.0472 0.0665 790 ASN C OD1 9089 N ND2 . ASN C 482 ? 0.1883 0.3715 0.4383 0.0836 -0.0214 0.0634 790 ASN C ND2 9090 N N . GLY C 483 ? 0.2301 0.3639 0.3942 0.0812 -0.0652 0.0628 791 GLY C N 9091 C CA . GLY C 483 ? 0.2336 0.3463 0.3702 0.0828 -0.0639 0.0620 791 GLY C CA 9092 C C . GLY C 483 ? 0.2041 0.3024 0.3205 0.0759 -0.0554 0.0552 791 GLY C C 9093 O O . GLY C 483 ? 0.2029 0.2846 0.2982 0.0755 -0.0543 0.0547 791 GLY C O 9094 N N . PHE C 484 ? 0.1880 0.2932 0.3122 0.0706 -0.0494 0.0508 792 PHE C N 9095 C CA . PHE C 484 ? 0.1981 0.2913 0.3051 0.0641 -0.0423 0.0446 792 PHE C CA 9096 C C . PHE C 484 ? 0.2445 0.3372 0.3400 0.0550 -0.0497 0.0417 792 PHE C C 9097 O O . PHE C 484 ? 0.2424 0.3473 0.3485 0.0517 -0.0584 0.0424 792 PHE C O 9098 C CB . PHE C 484 ? 0.1816 0.2797 0.2991 0.0638 -0.0314 0.0415 792 PHE C CB 9099 C CG . PHE C 484 ? 0.2151 0.3078 0.3365 0.0733 -0.0218 0.0427 792 PHE C CG 9100 C CD1 . PHE C 484 ? 0.2223 0.2957 0.3256 0.0747 -0.0153 0.0390 792 PHE C CD1 9101 C CD2 . PHE C 484 ? 0.2209 0.3271 0.3647 0.0811 -0.0196 0.0475 792 PHE C CD2 9102 C CE1 . PHE C 484 ? 0.2234 0.2885 0.3274 0.0838 -0.0072 0.0391 792 PHE C CE1 9103 C CE2 . PHE C 484 ? 0.2516 0.3507 0.3969 0.0912 -0.0098 0.0484 792 PHE C CE2 9104 C CZ . PHE C 484 ? 0.2355 0.3126 0.3591 0.0925 -0.0039 0.0436 792 PHE C CZ 9105 N N . SER C 485 ? 0.2117 0.2897 0.2864 0.0513 -0.0462 0.0386 793 SER C N 9106 C CA . SER C 485 ? 0.2153 0.2900 0.2763 0.0439 -0.0508 0.0357 793 SER C CA 9107 C C . SER C 485 ? 0.2111 0.2909 0.2775 0.0373 -0.0459 0.0306 793 SER C C 9108 O O . SER C 485 ? 0.2493 0.3235 0.3129 0.0367 -0.0366 0.0280 793 SER C O 9109 C CB . SER C 485 ? 0.2870 0.3450 0.3261 0.0433 -0.0474 0.0358 793 SER C CB 9110 O OG . SER C 485 ? 0.3647 0.4157 0.4000 0.0500 -0.0483 0.0410 793 SER C OG 9111 N N . ILE C 486 ? 0.2302 0.3194 0.3038 0.0325 -0.0531 0.0295 794 ILE C N 9112 C CA . ILE C 486 ? 0.2348 0.3284 0.3140 0.0259 -0.0491 0.0255 794 ILE C CA 9113 C C . ILE C 486 ? 0.2518 0.3370 0.3132 0.0196 -0.0539 0.0218 794 ILE C C 9114 O O . ILE C 486 ? 0.2506 0.3373 0.3095 0.0176 -0.0650 0.0218 794 ILE C O 9115 C CB . ILE C 486 ? 0.2160 0.3272 0.3213 0.0246 -0.0527 0.0274 794 ILE C CB 9116 C CG1 . ILE C 486 ? 0.2255 0.3461 0.3496 0.0327 -0.0486 0.0323 794 ILE C CG1 9117 C CG2 . ILE C 486 ? 0.2107 0.3253 0.3225 0.0186 -0.0459 0.0244 794 ILE C CG2 9118 C CD1 . ILE C 486 ? 0.2383 0.3519 0.3582 0.0372 -0.0345 0.0312 794 ILE C CD1 9119 N N . SER C 487 ? 0.2190 0.2948 0.2678 0.0169 -0.0460 0.0186 795 SER C N 9120 C CA . SER C 487 ? 0.2049 0.2708 0.2350 0.0126 -0.0481 0.0157 795 SER C CA 9121 C C . SER C 487 ? 0.2092 0.2780 0.2437 0.0060 -0.0474 0.0117 795 SER C C 9122 O O . SER C 487 ? 0.1739 0.2480 0.2199 0.0046 -0.0403 0.0110 795 SER C O 9123 C CB . SER C 487 ? 0.2469 0.3009 0.2623 0.0140 -0.0398 0.0157 795 SER C CB 9124 O OG . SER C 487 ? 0.2858 0.3348 0.2958 0.0195 -0.0403 0.0199 795 SER C OG 9125 N N . ASN C 488 ? 0.2106 0.2739 0.2338 0.0024 -0.0547 0.0091 796 ASN C N 9126 C CA . ASN C 488 ? 0.1993 0.2604 0.2215 -0.0038 -0.0535 0.0051 796 ASN C CA 9127 C C . ASN C 488 ? 0.1694 0.2213 0.1790 -0.0037 -0.0429 0.0037 796 ASN C C 9128 O O . ASN C 488 ? 0.1838 0.2254 0.1757 -0.0011 -0.0414 0.0042 796 ASN C O 9129 C CB . ASN C 488 ? 0.2286 0.2819 0.2372 -0.0067 -0.0647 0.0021 796 ASN C CB 9130 C CG . ASN C 488 ? 0.2042 0.2553 0.2149 -0.0136 -0.0655 -0.0022 796 ASN C CG 9131 O OD1 . ASN C 488 ? 0.2145 0.2648 0.2274 -0.0154 -0.0557 -0.0031 796 ASN C OD1 9132 N ND2 . ASN C 488 ? 0.2467 0.2955 0.2563 -0.0175 -0.0781 -0.0048 796 ASN C ND2 9133 N N . GLY C 489 ? 0.1394 0.1950 0.1584 -0.0061 -0.0356 0.0027 797 GLY C N 9134 C CA . GLY C 489 ? 0.1261 0.1743 0.1357 -0.0062 -0.0270 0.0016 797 GLY C CA 9135 C C . GLY C 489 ? 0.2007 0.2379 0.1933 -0.0079 -0.0271 -0.0007 797 GLY C C 9136 O O . GLY C 489 ? 0.1884 0.2196 0.1733 -0.0068 -0.0205 -0.0003 797 GLY C O 9137 N N . LEU C 490 ? 0.2090 0.2428 0.1958 -0.0104 -0.0347 -0.0030 798 LEU C N 9138 C CA . LEU C 490 ? 0.1819 0.2027 0.1494 -0.0108 -0.0345 -0.0056 798 LEU C CA 9139 C C . LEU C 490 ? 0.2244 0.2363 0.1733 -0.0055 -0.0356 -0.0037 798 LEU C C 9140 O O . LEU C 490 ? 0.2414 0.2414 0.1722 -0.0038 -0.0332 -0.0048 798 LEU C O 9141 C CB . LEU C 490 ? 0.1810 0.1983 0.1472 -0.0156 -0.0430 -0.0097 798 LEU C CB 9142 C CG . LEU C 490 ? 0.1754 0.1977 0.1567 -0.0214 -0.0405 -0.0113 798 LEU C CG 9143 C CD1 . LEU C 490 ? 0.1639 0.1826 0.1466 -0.0270 -0.0511 -0.0149 798 LEU C CD1 9144 C CD2 . LEU C 490 ? 0.1925 0.2078 0.1659 -0.0208 -0.0305 -0.0118 798 LEU C CD2 9145 N N . ALA C 491 ? 0.2175 0.2343 0.1704 -0.0022 -0.0384 -0.0002 799 ALA C N 9146 C CA . ALA C 491 ? 0.2299 0.2379 0.1649 0.0031 -0.0401 0.0025 799 ALA C CA 9147 C C . ALA C 491 ? 0.2610 0.2695 0.1977 0.0073 -0.0323 0.0080 799 ALA C C 9148 O O . ALA C 491 ? 0.2916 0.2958 0.2190 0.0119 -0.0339 0.0119 799 ALA C O 9149 C CB . ALA C 491 ? 0.2435 0.2535 0.1777 0.0040 -0.0528 0.0024 799 ALA C CB 9150 N N . THR C 492 ? 0.2406 0.2531 0.1885 0.0056 -0.0243 0.0085 800 THR C N 9151 C CA . THR C 492 ? 0.2622 0.2749 0.2149 0.0082 -0.0185 0.0132 800 THR C CA 9152 C C . THR C 492 ? 0.2833 0.2864 0.2214 0.0122 -0.0136 0.0180 800 THR C C 9153 O O . THR C 492 ? 0.3130 0.3146 0.2519 0.0153 -0.0121 0.0231 800 THR C O 9154 C CB . THR C 492 ? 0.2771 0.2936 0.2421 0.0054 -0.0125 0.0121 800 THR C CB 9155 O OG1 . THR C 492 ? 0.3550 0.3673 0.3141 0.0037 -0.0079 0.0109 800 THR C OG1 9156 C CG2 . THR C 492 ? 0.2526 0.2776 0.2307 0.0030 -0.0152 0.0087 800 THR C CG2 9157 N N . THR C 493 ? 0.2543 0.2502 0.1790 0.0126 -0.0102 0.0170 801 THR C N 9158 C CA . THR C 493 ? 0.2859 0.2727 0.1965 0.0174 -0.0035 0.0226 801 THR C CA 9159 C C . THR C 493 ? 0.2853 0.2652 0.1795 0.0225 -0.0082 0.0254 801 THR C C 9160 O O . THR C 493 ? 0.3185 0.2922 0.2044 0.0271 -0.0021 0.0322 801 THR C O 9161 C CB . THR C 493 ? 0.3251 0.3045 0.2235 0.0183 0.0026 0.0212 801 THR C CB 9162 O OG1 . THR C 493 ? 0.3417 0.3143 0.2242 0.0183 -0.0046 0.0153 801 THR C OG1 9163 C CG2 . THR C 493 ? 0.2842 0.2700 0.1985 0.0139 0.0069 0.0193 801 THR C CG2 9164 N N . GLN C 494 ? 0.2814 0.2625 0.1719 0.0216 -0.0192 0.0210 802 GLN C N 9165 C CA . GLN C 494 ? 0.3287 0.3033 0.2031 0.0266 -0.0263 0.0232 802 GLN C CA 9166 C C . GLN C 494 ? 0.3364 0.3180 0.2240 0.0281 -0.0289 0.0279 802 GLN C C 9167 O O . GLN C 494 ? 0.3666 0.3426 0.2420 0.0333 -0.0327 0.0321 802 GLN C O 9168 C CB . GLN C 494 ? 0.3263 0.2990 0.1924 0.0246 -0.0392 0.0166 802 GLN C CB 9169 C CG . GLN C 494 ? 0.3429 0.3054 0.1933 0.0234 -0.0378 0.0112 802 GLN C CG 9170 C CD . GLN C 494 ? 0.3672 0.3286 0.2149 0.0194 -0.0518 0.0040 802 GLN C CD 9171 O OE1 . GLN C 494 ? 0.4247 0.3800 0.2584 0.0219 -0.0632 0.0033 802 GLN C OE1 9172 N NE2 . GLN C 494 ? 0.3741 0.3409 0.2359 0.0129 -0.0519 -0.0009 802 GLN C NE2 9173 N N . ILE C 495 ? 0.2847 0.2771 0.1956 0.0243 -0.0268 0.0271 803 ILE C N 9174 C CA . ILE C 495 ? 0.2729 0.2708 0.1970 0.0262 -0.0287 0.0307 803 ILE C CA 9175 C C . ILE C 495 ? 0.2813 0.2756 0.2104 0.0273 -0.0192 0.0365 803 ILE C C 9176 O O . ILE C 495 ? 0.2969 0.2872 0.2239 0.0315 -0.0188 0.0424 803 ILE C O 9177 C CB . ILE C 495 ? 0.2756 0.2858 0.2206 0.0225 -0.0327 0.0262 803 ILE C CB 9178 C CG1 . ILE C 495 ? 0.3052 0.3200 0.2495 0.0207 -0.0431 0.0219 803 ILE C CG1 9179 C CG2 . ILE C 495 ? 0.2745 0.2886 0.2323 0.0255 -0.0331 0.0298 803 ILE C CG2 9180 C CD1 . ILE C 495 ? 0.2933 0.3199 0.2576 0.0160 -0.0442 0.0176 803 ILE C CD1 9181 N N . ASN C 496 ? 0.2716 0.2671 0.2081 0.0235 -0.0122 0.0350 804 ASN C N 9182 C CA . ASN C 496 ? 0.2925 0.2850 0.2366 0.0232 -0.0044 0.0403 804 ASN C CA 9183 C C . ASN C 496 ? 0.2617 0.2548 0.2086 0.0197 0.0020 0.0389 804 ASN C C 9184 O O . ASN C 496 ? 0.2362 0.2349 0.1940 0.0155 0.0010 0.0339 804 ASN C O 9185 C CB . ASN C 496 ? 0.2675 0.2638 0.2284 0.0218 -0.0064 0.0395 804 ASN C CB 9186 C CG . ASN C 496 ? 0.2637 0.2556 0.2340 0.0203 -0.0005 0.0443 804 ASN C CG 9187 O OD1 . ASN C 496 ? 0.2629 0.2513 0.2308 0.0198 0.0058 0.0490 804 ASN C OD1 9188 N ND2 . ASN C 496 ? 0.2465 0.2379 0.2280 0.0197 -0.0027 0.0432 804 ASN C ND2 9189 N N . ASN C 497 ? 0.2707 0.2576 0.2075 0.0221 0.0090 0.0440 805 ASN C N 9190 C CA . ASN C 497 ? 0.2886 0.2764 0.2281 0.0199 0.0155 0.0434 805 ASN C CA 9191 C C . ASN C 497 ? 0.2692 0.2618 0.2296 0.0155 0.0183 0.0449 805 ASN C C 9192 O O . ASN C 497 ? 0.2667 0.2633 0.2340 0.0123 0.0192 0.0415 805 ASN C O 9193 C CB . ASN C 497 ? 0.3621 0.3418 0.2858 0.0250 0.0240 0.0493 805 ASN C CB 9194 C CG . ASN C 497 ? 0.4423 0.4223 0.3650 0.0242 0.0299 0.0474 805 ASN C CG 9195 O OD1 . ASN C 497 ? 0.4770 0.4573 0.3937 0.0226 0.0254 0.0399 805 ASN C OD1 9196 N ND2 . ASN C 497 ? 0.4707 0.4508 0.4012 0.0254 0.0401 0.0548 805 ASN C ND2 9197 N N . LYS C 498 ? 0.2255 0.2167 0.1956 0.0153 0.0187 0.0501 806 LYS C N 9198 C CA . LYS C 498 ? 0.2239 0.2176 0.2133 0.0106 0.0185 0.0508 806 LYS C CA 9199 C C . LYS C 498 ? 0.2212 0.2187 0.2161 0.0074 0.0114 0.0421 806 LYS C C 9200 O O . LYS C 498 ? 0.2393 0.2389 0.2447 0.0036 0.0106 0.0400 806 LYS C O 9201 C CB . LYS C 498 ? 0.2605 0.2493 0.2578 0.0110 0.0192 0.0576 806 LYS C CB 9202 C CG . LYS C 498 ? 0.3652 0.3502 0.3619 0.0135 0.0283 0.0684 806 LYS C CG 9203 C CD . LYS C 498 ? 0.4351 0.4234 0.4515 0.0091 0.0329 0.0733 806 LYS C CD 9204 C CE . LYS C 498 ? 0.4967 0.4819 0.5169 0.0116 0.0434 0.0860 806 LYS C CE 9205 N NZ . LYS C 498 ? 0.5273 0.5179 0.5713 0.0070 0.0478 0.0921 806 LYS C NZ 9206 N N . ALA C 499 ? 0.1953 0.1938 0.1835 0.0094 0.0064 0.0377 807 ALA C N 9207 C CA . ALA C 499 ? 0.2449 0.2473 0.2377 0.0074 0.0017 0.0304 807 ALA C CA 9208 C C . ALA C 499 ? 0.2066 0.2134 0.1963 0.0053 0.0024 0.0257 807 ALA C C 9209 O O . ALA C 499 ? 0.2280 0.2370 0.2229 0.0029 0.0011 0.0214 807 ALA C O 9210 C CB . ALA C 499 ? 0.2456 0.2494 0.2357 0.0106 -0.0029 0.0284 807 ALA C CB 9211 N N . ALA C 500 ? 0.2126 0.2189 0.1920 0.0067 0.0044 0.0266 808 ALA C N 9212 C CA . ALA C 500 ? 0.2461 0.2544 0.2216 0.0049 0.0053 0.0225 808 ALA C CA 9213 C C . ALA C 500 ? 0.2240 0.2329 0.2072 0.0026 0.0095 0.0237 808 ALA C C 9214 O O . ALA C 500 ? 0.2487 0.2599 0.2338 0.0005 0.0089 0.0197 808 ALA C O 9215 C CB . ALA C 500 ? 0.2524 0.2565 0.2125 0.0076 0.0064 0.0231 808 ALA C CB 9216 N N . THR C 501 ? 0.1765 0.1835 0.1653 0.0032 0.0135 0.0300 809 THR C N 9217 C CA . THR C 501 ? 0.1982 0.2071 0.1974 0.0012 0.0168 0.0326 809 THR C CA 9218 C C . THR C 501 ? 0.2086 0.2185 0.2211 -0.0025 0.0119 0.0313 809 THR C C 9219 O O . THR C 501 ? 0.1988 0.2107 0.2213 -0.0047 0.0120 0.0328 809 THR C O 9220 C CB . THR C 501 ? 0.2629 0.2703 0.2653 0.0033 0.0243 0.0415 809 THR C CB 9221 O OG1 . THR C 501 ? 0.2705 0.2757 0.2797 0.0030 0.0232 0.0460 809 THR C OG1 9222 C CG2 . THR C 501 ? 0.3235 0.3266 0.3080 0.0083 0.0297 0.0427 809 THR C CG2 9223 N N . GLY C 502 ? 0.2207 0.2283 0.2330 -0.0025 0.0071 0.0286 810 GLY C N 9224 C CA . GLY C 502 ? 0.2125 0.2173 0.2333 -0.0051 0.0018 0.0265 810 GLY C CA 9225 C C . GLY C 502 ? 0.2125 0.2131 0.2441 -0.0066 0.0011 0.0323 810 GLY C C 9226 O O . GLY C 502 ? 0.2289 0.2250 0.2674 -0.0091 -0.0045 0.0306 810 GLY C O 9227 N N . GLU C 503 ? 0.2040 0.2048 0.2361 -0.0048 0.0065 0.0394 811 GLU C N 9228 C CA . GLU C 503 ? 0.2227 0.2191 0.2664 -0.0064 0.0069 0.0463 811 GLU C CA 9229 C C . GLU C 503 ? 0.2389 0.2280 0.2794 -0.0051 0.0025 0.0443 811 GLU C C 9230 O O . GLU C 503 ? 0.2284 0.2113 0.2792 -0.0075 -0.0002 0.0474 811 GLU C O 9231 C CB . GLU C 503 ? 0.2450 0.2428 0.2886 -0.0038 0.0160 0.0556 811 GLU C CB 9232 C CG . GLU C 503 ? 0.2278 0.2318 0.2799 -0.0046 0.0219 0.0602 811 GLU C CG 9233 C CD . GLU C 503 ? 0.2969 0.3006 0.3469 -0.0006 0.0328 0.0701 811 GLU C CD 9234 O OE1 . GLU C 503 ? 0.3876 0.3919 0.4229 0.0039 0.0386 0.0695 811 GLU C OE1 9235 O OE2 . GLU C 503 ? 0.2764 0.2779 0.3382 -0.0016 0.0358 0.0786 811 GLU C OE2 9236 N N . GLU C 504 ? 0.2138 0.2037 0.2413 -0.0013 0.0016 0.0396 812 GLU C N 9237 C CA . GLU C 504 ? 0.2143 0.1984 0.2386 0.0014 -0.0020 0.0376 812 GLU C CA 9238 C C . GLU C 504 ? 0.2102 0.1970 0.2275 0.0032 -0.0052 0.0293 812 GLU C C 9239 O O . GLU C 504 ? 0.1741 0.1678 0.1866 0.0031 -0.0039 0.0263 812 GLU C O 9240 C CB . GLU C 504 ? 0.2564 0.2397 0.2736 0.0059 0.0011 0.0432 812 GLU C CB 9241 C CG . GLU C 504 ? 0.3008 0.2791 0.3240 0.0054 0.0054 0.0529 812 GLU C CG 9242 C CD . GLU C 504 ? 0.3317 0.3074 0.3441 0.0110 0.0081 0.0585 812 GLU C CD 9243 O OE1 . GLU C 504 ? 0.3703 0.3416 0.3853 0.0117 0.0133 0.0677 812 GLU C OE1 9244 O OE2 . GLU C 504 ? 0.2810 0.2592 0.2830 0.0148 0.0049 0.0544 812 GLU C OE2 9245 N N . VAL C 505 ? 0.2364 0.2171 0.2535 0.0052 -0.0087 0.0259 813 VAL C N 9246 C CA . VAL C 505 ? 0.2406 0.2244 0.2523 0.0083 -0.0097 0.0196 813 VAL C CA 9247 C C . VAL C 505 ? 0.2456 0.2357 0.2538 0.0124 -0.0086 0.0216 813 VAL C C 9248 O O . VAL C 505 ? 0.2435 0.2302 0.2518 0.0149 -0.0088 0.0265 813 VAL C O 9249 C CB . VAL C 505 ? 0.2360 0.2094 0.2471 0.0105 -0.0126 0.0156 813 VAL C CB 9250 C CG1 . VAL C 505 ? 0.2319 0.2090 0.2381 0.0150 -0.0114 0.0104 813 VAL C CG1 9251 C CG2 . VAL C 505 ? 0.2068 0.1720 0.2199 0.0061 -0.0162 0.0132 813 VAL C CG2 9252 N N . PRO C 506 ? 0.2100 0.2091 0.2157 0.0129 -0.0082 0.0184 814 PRO C N 9253 C CA . PRO C 506 ? 0.1957 0.2013 0.1999 0.0162 -0.0095 0.0201 814 PRO C CA 9254 C C . PRO C 506 ? 0.1972 0.2004 0.2048 0.0215 -0.0110 0.0210 814 PRO C C 9255 O O . PRO C 506 ? 0.2253 0.2243 0.2353 0.0232 -0.0102 0.0177 814 PRO C O 9256 C CB . PRO C 506 ? 0.2150 0.2295 0.2200 0.0149 -0.0094 0.0157 814 PRO C CB 9257 C CG . PRO C 506 ? 0.2273 0.2398 0.2308 0.0106 -0.0072 0.0131 814 PRO C CG 9258 C CD . PRO C 506 ? 0.2121 0.2152 0.2171 0.0102 -0.0072 0.0137 814 PRO C CD 9259 N N . ARG C 507 ? 0.1958 0.2004 0.2021 0.0248 -0.0132 0.0255 815 ARG C N 9260 C CA . ARG C 507 ? 0.2048 0.2072 0.2150 0.0308 -0.0147 0.0273 815 ARG C CA 9261 C C . ARG C 507 ? 0.2321 0.2464 0.2475 0.0342 -0.0178 0.0271 815 ARG C C 9262 O O . ARG C 507 ? 0.2481 0.2631 0.2683 0.0400 -0.0195 0.0297 815 ARG C O 9263 C CB . ARG C 507 ? 0.1892 0.1826 0.1959 0.0329 -0.0152 0.0338 815 ARG C CB 9264 C CG . ARG C 507 ? 0.2065 0.1887 0.2135 0.0291 -0.0125 0.0348 815 ARG C CG 9265 C CD . ARG C 507 ? 0.2309 0.2036 0.2365 0.0310 -0.0119 0.0425 815 ARG C CD 9266 N NE . ARG C 507 ? 0.2495 0.2252 0.2473 0.0317 -0.0111 0.0484 815 ARG C NE 9267 C CZ . ARG C 507 ? 0.2802 0.2554 0.2746 0.0279 -0.0073 0.0512 815 ARG C CZ 9268 N NH1 . ARG C 507 ? 0.2356 0.2094 0.2368 0.0224 -0.0050 0.0492 815 ARG C NH1 9269 N NH2 . ARG C 507 ? 0.2880 0.2636 0.2716 0.0302 -0.0059 0.0564 815 ARG C NH2 9270 N N . THR C 508 ? 0.1927 0.2162 0.2086 0.0306 -0.0189 0.0245 816 THR C N 9271 C CA . THR C 508 ? 0.2281 0.2640 0.2529 0.0322 -0.0226 0.0242 816 THR C CA 9272 C C . THR C 508 ? 0.2048 0.2473 0.2375 0.0302 -0.0185 0.0198 816 THR C C 9273 O O . THR C 508 ? 0.2004 0.2373 0.2284 0.0273 -0.0140 0.0166 816 THR C O 9274 C CB . THR C 508 ? 0.2193 0.2596 0.2382 0.0294 -0.0288 0.0251 816 THR C CB 9275 O OG1 . THR C 508 ? 0.2463 0.2860 0.2598 0.0234 -0.0266 0.0213 816 THR C OG1 9276 C CG2 . THR C 508 ? 0.2552 0.2868 0.2615 0.0318 -0.0315 0.0299 816 THR C CG2 9277 N N . ILE C 509 ? 0.1933 0.2480 0.2389 0.0320 -0.0202 0.0205 817 ILE C N 9278 C CA . ILE C 509 ? 0.1920 0.2543 0.2464 0.0300 -0.0156 0.0178 817 ILE C CA 9279 C C . ILE C 509 ? 0.2044 0.2716 0.2576 0.0229 -0.0194 0.0161 817 ILE C C 9280 O O . ILE C 509 ? 0.2443 0.3165 0.2994 0.0214 -0.0271 0.0176 817 ILE C O 9281 C CB . ILE C 509 ? 0.2133 0.2873 0.2857 0.0355 -0.0144 0.0207 817 ILE C CB 9282 C CG1 . ILE C 509 ? 0.2056 0.2715 0.2766 0.0434 -0.0087 0.0213 817 ILE C CG1 9283 C CG2 . ILE C 509 ? 0.1768 0.2610 0.2609 0.0328 -0.0098 0.0197 817 ILE C CG2 9284 C CD1 . ILE C 509 ? 0.2107 0.2868 0.2986 0.0508 -0.0083 0.0256 817 ILE C CD1 9285 N N . ILE C 510 ? 0.1667 0.2309 0.2154 0.0189 -0.0144 0.0128 818 ILE C N 9286 C CA . ILE C 510 ? 0.1709 0.2362 0.2157 0.0124 -0.0172 0.0108 818 ILE C CA 9287 C C . ILE C 510 ? 0.1539 0.2289 0.2119 0.0096 -0.0147 0.0103 818 ILE C C 9288 O O . ILE C 510 ? 0.1487 0.2253 0.2121 0.0121 -0.0072 0.0104 818 ILE C O 9289 C CB . ILE C 510 ? 0.1793 0.2337 0.2095 0.0097 -0.0137 0.0085 818 ILE C CB 9290 C CG1 . ILE C 510 ? 0.1912 0.2368 0.2114 0.0120 -0.0153 0.0104 818 ILE C CG1 9291 C CG2 . ILE C 510 ? 0.2085 0.2624 0.2337 0.0040 -0.0157 0.0064 818 ILE C CG2 9292 C CD1 . ILE C 510 ? 0.2668 0.3033 0.2770 0.0095 -0.0119 0.0095 818 ILE C CD1 9293 N N . VAL C 511 ? 0.1344 0.2145 0.1969 0.0045 -0.0210 0.0099 819 VAL C N 9294 C CA . VAL C 511 ? 0.1357 0.2250 0.2132 0.0006 -0.0195 0.0102 819 VAL C CA 9295 C C . VAL C 511 ? 0.1625 0.2445 0.2297 -0.0053 -0.0181 0.0069 819 VAL C C 9296 O O . VAL C 511 ? 0.1790 0.2533 0.2330 -0.0079 -0.0237 0.0046 819 VAL C O 9297 C CB . VAL C 511 ? 0.1788 0.2788 0.2718 -0.0020 -0.0296 0.0122 819 VAL C CB 9298 C CG1 . VAL C 511 ? 0.2192 0.3298 0.3326 -0.0066 -0.0273 0.0138 819 VAL C CG1 9299 C CG2 . VAL C 511 ? 0.2301 0.3371 0.3329 0.0043 -0.0324 0.0161 819 VAL C CG2 9300 N N . THR C 512 ? 0.1470 0.2305 0.2192 -0.0065 -0.0101 0.0070 820 THR C N 9301 C CA . THR C 512 ? 0.1574 0.2338 0.2208 -0.0113 -0.0079 0.0045 820 THR C CA 9302 C C . THR C 512 ? 0.1490 0.2333 0.2290 -0.0155 -0.0054 0.0064 820 THR C C 9303 O O . THR C 512 ? 0.1215 0.2138 0.2147 -0.0126 0.0016 0.0099 820 THR C O 9304 C CB . THR C 512 ? 0.1375 0.2050 0.1876 -0.0084 -0.0001 0.0033 820 THR C CB 9305 O OG1 . THR C 512 ? 0.1501 0.2119 0.1901 -0.0045 -0.0020 0.0027 820 THR C OG1 9306 C CG2 . THR C 512 ? 0.1733 0.2328 0.2131 -0.0126 0.0010 0.0010 820 THR C CG2 9307 N N . THR C 513 ? 0.1359 0.2175 0.2158 -0.0221 -0.0108 0.0046 821 THR C N 9308 C CA . THR C 513 ? 0.1151 0.2044 0.2143 -0.0273 -0.0098 0.0072 821 THR C CA 9309 C C . THR C 513 ? 0.1511 0.2308 0.2426 -0.0330 -0.0092 0.0048 821 THR C C 9310 O O . THR C 513 ? 0.1518 0.2200 0.2254 -0.0341 -0.0137 0.0006 821 THR C O 9311 C CB . THR C 513 ? 0.2312 0.3307 0.3491 -0.0312 -0.0210 0.0086 821 THR C CB 9312 O OG1 . THR C 513 ? 0.2594 0.3489 0.3652 -0.0363 -0.0322 0.0039 821 THR C OG1 9313 C CG2 . THR C 513 ? 0.1931 0.3003 0.3160 -0.0251 -0.0242 0.0106 821 THR C CG2 9314 N N . ARG C 514 ? 0.1491 0.2331 0.2544 -0.0360 -0.0027 0.0082 822 ARG C N 9315 C CA . ARG C 514 ? 0.1301 0.2048 0.2307 -0.0419 -0.0024 0.0067 822 ARG C CA 9316 C C . ARG C 514 ? 0.1517 0.2213 0.2523 -0.0485 -0.0157 0.0027 822 ARG C C 9317 O O . ARG C 514 ? 0.1800 0.2359 0.2652 -0.0511 -0.0178 -0.0012 822 ARG C O 9318 C CB . ARG C 514 ? 0.1795 0.2607 0.2981 -0.0441 0.0070 0.0124 822 ARG C CB 9319 C CG . ARG C 514 ? 0.1904 0.2684 0.2977 -0.0372 0.0201 0.0146 822 ARG C CG 9320 C CD . ARG C 514 ? 0.1945 0.2757 0.3146 -0.0387 0.0309 0.0208 822 ARG C CD 9321 N NE . ARG C 514 ? 0.2084 0.2817 0.3104 -0.0319 0.0416 0.0218 822 ARG C NE 9322 C CZ . ARG C 514 ? 0.1974 0.2679 0.3001 -0.0314 0.0520 0.0266 822 ARG C CZ 9323 N NH1 . ARG C 514 ? 0.1163 0.1918 0.2394 -0.0379 0.0543 0.0316 822 ARG C NH1 9324 N NH2 . ARG C 514 ? 0.1829 0.2446 0.2656 -0.0245 0.0596 0.0267 822 ARG C NH2 9325 N N . SER C 515 ? 0.1354 0.2149 0.2521 -0.0508 -0.0251 0.0038 823 SER C N 9326 C CA . SER C 515 ? 0.1957 0.2690 0.3109 -0.0570 -0.0400 -0.0004 823 SER C CA 9327 C C . SER C 515 ? 0.2292 0.2871 0.3139 -0.0535 -0.0456 -0.0066 823 SER C C 9328 O O . SER C 515 ? 0.2298 0.2749 0.3026 -0.0575 -0.0548 -0.0115 823 SER C O 9329 C CB . SER C 515 ? 0.1966 0.2848 0.3364 -0.0596 -0.0505 0.0025 823 SER C CB 9330 O OG . SER C 515 ? 0.2323 0.3259 0.3666 -0.0523 -0.0522 0.0030 823 SER C OG 9331 N N . GLN C 516 ? 0.2179 0.2761 0.2899 -0.0459 -0.0398 -0.0062 824 GLN C N 9332 C CA . GLN C 516 ? 0.2071 0.2519 0.2521 -0.0418 -0.0422 -0.0103 824 GLN C CA 9333 C C . GLN C 516 ? 0.2667 0.2966 0.2944 -0.0427 -0.0372 -0.0134 824 GLN C C 9334 O O . GLN C 516 ? 0.3060 0.3228 0.3121 -0.0403 -0.0399 -0.0170 824 GLN C O 9335 C CB . GLN C 516 ? 0.2274 0.2762 0.2665 -0.0343 -0.0354 -0.0079 824 GLN C CB 9336 C CG . GLN C 516 ? 0.1965 0.2548 0.2436 -0.0311 -0.0414 -0.0056 824 GLN C CG 9337 C CD . GLN C 516 ? 0.1959 0.2573 0.2401 -0.0243 -0.0335 -0.0030 824 GLN C CD 9338 O OE1 . GLN C 516 ? 0.1673 0.2275 0.2099 -0.0227 -0.0237 -0.0024 824 GLN C OE1 9339 N NE2 . GLN C 516 ? 0.2269 0.2910 0.2697 -0.0202 -0.0384 -0.0016 824 GLN C NE2 9340 N N . TYR C 517 ? 0.2103 0.2417 0.2468 -0.0450 -0.0290 -0.0115 825 TYR C N 9341 C CA . TYR C 517 ? 0.2149 0.2329 0.2363 -0.0448 -0.0234 -0.0136 825 TYR C CA 9342 C C . TYR C 517 ? 0.2220 0.2350 0.2521 -0.0518 -0.0246 -0.0140 825 TYR C C 9343 O O . TYR C 517 ? 0.1950 0.1976 0.2159 -0.0518 -0.0190 -0.0148 825 TYR C O 9344 C CB . TYR C 517 ? 0.1863 0.2071 0.2049 -0.0396 -0.0119 -0.0106 825 TYR C CB 9345 C CG . TYR C 517 ? 0.1857 0.2096 0.1967 -0.0335 -0.0112 -0.0100 825 TYR C CG 9346 C CD1 . TYR C 517 ? 0.1942 0.2086 0.1872 -0.0300 -0.0119 -0.0121 825 TYR C CD1 9347 C CD2 . TYR C 517 ? 0.1764 0.2120 0.1986 -0.0309 -0.0092 -0.0070 825 TYR C CD2 9348 C CE1 . TYR C 517 ? 0.2190 0.2361 0.2072 -0.0251 -0.0109 -0.0106 825 TYR C CE1 9349 C CE2 . TYR C 517 ? 0.1334 0.1701 0.1491 -0.0258 -0.0089 -0.0065 825 TYR C CE2 9350 C CZ . TYR C 517 ? 0.1841 0.2119 0.1837 -0.0234 -0.0099 -0.0080 825 TYR C CZ 9351 O OH . TYR C 517 ? 0.1730 0.2017 0.1681 -0.0189 -0.0094 -0.0065 825 TYR C OH 9352 N N . GLY C 518 ? 0.1767 0.1972 0.2259 -0.0579 -0.0321 -0.0131 826 GLY C N 9353 C CA . GLY C 518 ? 0.2384 0.2545 0.2995 -0.0658 -0.0346 -0.0130 826 GLY C CA 9354 C C . GLY C 518 ? 0.2492 0.2705 0.3227 -0.0663 -0.0217 -0.0072 826 GLY C C 9355 O O . GLY C 518 ? 0.2493 0.2620 0.3254 -0.0712 -0.0201 -0.0069 826 GLY C O 9356 N N . LEU C 519 ? 0.1978 0.2315 0.2771 -0.0608 -0.0126 -0.0026 827 LEU C N 9357 C CA . LEU C 519 ? 0.2200 0.2578 0.3078 -0.0598 0.0002 0.0032 827 LEU C CA 9358 C C . LEU C 519 ? 0.2227 0.2740 0.3405 -0.0650 0.0018 0.0095 827 LEU C C 9359 O O . LEU C 519 ? 0.1882 0.2517 0.3225 -0.0664 -0.0047 0.0105 827 LEU C O 9360 C CB . LEU C 519 ? 0.1948 0.2371 0.2728 -0.0510 0.0089 0.0049 827 LEU C CB 9361 C CG . LEU C 519 ? 0.2288 0.2599 0.2819 -0.0459 0.0090 0.0007 827 LEU C CG 9362 C CD1 . LEU C 519 ? 0.1880 0.2249 0.2354 -0.0386 0.0131 0.0016 827 LEU C CD1 9363 C CD2 . LEU C 519 ? 0.2320 0.2514 0.2747 -0.0459 0.0150 0.0011 827 LEU C CD2 9364 N N . PRO C 520 ? 0.2582 0.3079 0.3844 -0.0675 0.0109 0.0145 828 PRO C N 9365 C CA . PRO C 520 ? 0.2646 0.3276 0.4223 -0.0728 0.0137 0.0218 828 PRO C CA 9366 C C . PRO C 520 ? 0.2163 0.2963 0.3865 -0.0662 0.0223 0.0276 828 PRO C C 9367 O O . PRO C 520 ? 0.1912 0.2691 0.3450 -0.0577 0.0320 0.0283 828 PRO C O 9368 C CB . PRO C 520 ? 0.2750 0.3295 0.4333 -0.0753 0.0239 0.0265 828 PRO C CB 9369 C CG . PRO C 520 ? 0.2683 0.3110 0.3964 -0.0672 0.0306 0.0237 828 PRO C CG 9370 C CD . PRO C 520 ? 0.2250 0.2617 0.3339 -0.0649 0.0198 0.0150 828 PRO C CD 9371 N N . GLU C 521 ? 0.2342 0.3293 0.4313 -0.0693 0.0178 0.0313 829 GLU C N 9372 C CA . GLU C 521 ? 0.2817 0.3913 0.4889 -0.0615 0.0261 0.0365 829 GLU C CA 9373 C C . GLU C 521 ? 0.2862 0.3967 0.4966 -0.0573 0.0418 0.0438 829 GLU C C 9374 O O . GLU C 521 ? 0.3040 0.4214 0.5153 -0.0488 0.0516 0.0478 829 GLU C O 9375 C CB . GLU C 521 ? 0.3661 0.4885 0.5951 -0.0641 0.0154 0.0373 829 GLU C CB 9376 C CG . GLU C 521 ? 0.4665 0.5858 0.6910 -0.0688 -0.0028 0.0300 829 GLU C CG 9377 C CD . GLU C 521 ? 0.4972 0.6192 0.7100 -0.0622 -0.0049 0.0272 829 GLU C CD 9378 O OE1 . GLU C 521 ? 0.5074 0.6142 0.6918 -0.0612 -0.0105 0.0197 829 GLU C OE1 9379 O OE2 . GLU C 521 ? 0.4904 0.6245 0.7125 -0.0553 -0.0003 0.0310 829 GLU C OE2 9380 N N . ASP C 522 ? 0.2753 0.3771 0.4858 -0.0628 0.0440 0.0455 830 ASP C N 9381 C CA . ASP C 522 ? 0.3001 0.4029 0.5158 -0.0594 0.0574 0.0532 830 ASP C CA 9382 C C . ASP C 522 ? 0.3085 0.3963 0.5031 -0.0575 0.0664 0.0540 830 ASP C C 9383 O O . ASP C 522 ? 0.3704 0.4549 0.5699 -0.0586 0.0734 0.0595 830 ASP C O 9384 C CB . ASP C 522 ? 0.3502 0.4591 0.5921 -0.0674 0.0528 0.0571 830 ASP C CB 9385 C CG . ASP C 522 ? 0.4142 0.5110 0.6543 -0.0777 0.0429 0.0530 830 ASP C CG 9386 O OD1 . ASP C 522 ? 0.3918 0.4770 0.6127 -0.0792 0.0371 0.0462 830 ASP C OD1 9387 O OD2 . ASP C 522 ? 0.4581 0.5560 0.7161 -0.0842 0.0410 0.0566 830 ASP C OD2 9388 N N . ALA C 523 ? 0.2851 0.3637 0.4567 -0.0542 0.0661 0.0489 831 ALA C N 9389 C CA . ALA C 523 ? 0.2876 0.3512 0.4381 -0.0519 0.0730 0.0494 831 ALA C CA 9390 C C . ALA C 523 ? 0.2247 0.2823 0.3498 -0.0433 0.0772 0.0462 831 ALA C C 9391 O O . ALA C 523 ? 0.1874 0.2509 0.3110 -0.0406 0.0735 0.0426 831 ALA C O 9392 C CB . ALA C 523 ? 0.3004 0.3527 0.4501 -0.0612 0.0648 0.0459 831 ALA C CB 9393 N N . ILE C 524 ? 0.1920 0.2371 0.2967 -0.0387 0.0842 0.0478 832 ILE C N 9394 C CA . ILE C 524 ? 0.1574 0.1942 0.2357 -0.0307 0.0866 0.0445 832 ILE C CA 9395 C C . ILE C 524 ? 0.2213 0.2507 0.2882 -0.0340 0.0751 0.0366 832 ILE C C 9396 O O . ILE C 524 ? 0.2095 0.2315 0.2778 -0.0401 0.0709 0.0354 832 ILE C O 9397 C CB . ILE C 524 ? 0.2046 0.2293 0.2637 -0.0248 0.0941 0.0480 832 ILE C CB 9398 C CG1 . ILE C 524 ? 0.2142 0.2434 0.2774 -0.0188 0.1033 0.0538 832 ILE C CG1 9399 C CG2 . ILE C 524 ? 0.1769 0.1910 0.2082 -0.0181 0.0928 0.0438 832 ILE C CG2 9400 C CD1 . ILE C 524 ? 0.2450 0.2778 0.2994 -0.0101 0.1057 0.0519 832 ILE C CD1 9401 N N . VAL C 525 ? 0.1652 0.1954 0.2198 -0.0293 0.0693 0.0308 833 VAL C N 9402 C CA . VAL C 525 ? 0.1318 0.1547 0.1731 -0.0304 0.0591 0.0237 833 VAL C CA 9403 C C . VAL C 525 ? 0.1878 0.2010 0.2060 -0.0235 0.0607 0.0224 833 VAL C C 9404 O O . VAL C 525 ? 0.1906 0.2052 0.2001 -0.0173 0.0621 0.0217 833 VAL C O 9405 C CB . VAL C 525 ? 0.1590 0.1898 0.2051 -0.0310 0.0502 0.0187 833 VAL C CB 9406 C CG1 . VAL C 525 ? 0.2052 0.2282 0.2353 -0.0300 0.0423 0.0126 833 VAL C CG1 9407 C CG2 . VAL C 525 ? 0.1670 0.2059 0.2349 -0.0385 0.0449 0.0191 833 VAL C CG2 9408 N N . TYR C 526 ? 0.1868 0.1895 0.1955 -0.0244 0.0602 0.0224 834 TYR C N 9409 C CA . TYR C 526 ? 0.1424 0.1369 0.1318 -0.0187 0.0586 0.0208 834 TYR C CA 9410 C C . TYR C 526 ? 0.2100 0.2040 0.1969 -0.0200 0.0494 0.0151 834 TYR C C 9411 O O . TYR C 526 ? 0.1965 0.1893 0.1897 -0.0250 0.0458 0.0130 834 TYR C O 9412 C CB . TYR C 526 ? 0.1531 0.1369 0.1346 -0.0180 0.0628 0.0247 834 TYR C CB 9413 C CG . TYR C 526 ? 0.1650 0.1467 0.1454 -0.0155 0.0735 0.0317 834 TYR C CG 9414 C CD1 . TYR C 526 ? 0.1737 0.1516 0.1378 -0.0075 0.0775 0.0337 834 TYR C CD1 9415 C CD2 . TYR C 526 ? 0.2163 0.1986 0.2112 -0.0210 0.0795 0.0366 834 TYR C CD2 9416 C CE1 . TYR C 526 ? 0.2007 0.1755 0.1613 -0.0039 0.0872 0.0400 834 TYR C CE1 9417 C CE2 . TYR C 526 ? 0.2273 0.2084 0.2223 -0.0181 0.0897 0.0439 834 TYR C CE2 9418 C CZ . TYR C 526 ? 0.2245 0.2021 0.2017 -0.0089 0.0923 0.0447 834 TYR C CZ 9419 O OH . TYR C 526 ? 0.2541 0.2297 0.2297 -0.0049 0.0997 0.0502 834 TYR C OH 9420 N N . CYS C 527 ? 0.2296 0.2237 0.2072 -0.0154 0.0457 0.0127 835 CYS C N 9421 C CA . CYS C 527 ? 0.2147 0.2088 0.1910 -0.0161 0.0388 0.0088 835 CYS C CA 9422 C C . CYS C 527 ? 0.2261 0.2144 0.1921 -0.0121 0.0365 0.0090 835 CYS C C 9423 O O . CYS C 527 ? 0.2801 0.2645 0.2378 -0.0083 0.0381 0.0113 835 CYS C O 9424 C CB . CYS C 527 ? 0.2088 0.2106 0.1894 -0.0158 0.0348 0.0060 835 CYS C CB 9425 S SG . CYS C 527 ? 0.2750 0.2772 0.2474 -0.0098 0.0346 0.0059 835 CYS C SG 9426 N N . ASN C 528 ? 0.2100 0.1974 0.1767 -0.0127 0.0328 0.0071 836 ASN C N 9427 C CA . ASN C 528 ? 0.2104 0.1965 0.1729 -0.0090 0.0296 0.0077 836 ASN C CA 9428 C C . ASN C 528 ? 0.1923 0.1812 0.1589 -0.0099 0.0269 0.0057 836 ASN C C 9429 O O . ASN C 528 ? 0.1578 0.1431 0.1245 -0.0116 0.0282 0.0045 836 ASN C O 9430 C CB . ASN C 528 ? 0.2281 0.2069 0.1860 -0.0069 0.0315 0.0107 836 ASN C CB 9431 C CG . ASN C 528 ? 0.3057 0.2852 0.2631 -0.0030 0.0272 0.0123 836 ASN C CG 9432 O OD1 . ASN C 528 ? 0.2627 0.2450 0.2253 -0.0029 0.0259 0.0117 836 ASN C OD1 9433 N ND2 . ASN C 528 ? 0.2785 0.2553 0.2300 0.0002 0.0250 0.0146 836 ASN C ND2 9434 N N . PHE C 529 ? 0.1619 0.1555 0.1304 -0.0084 0.0233 0.0052 837 PHE C N 9435 C CA . PHE C 529 ? 0.1756 0.1720 0.1476 -0.0088 0.0219 0.0043 837 PHE C CA 9436 C C . PHE C 529 ? 0.1813 0.1778 0.1560 -0.0058 0.0214 0.0071 837 PHE C C 9437 O O . PHE C 529 ? 0.1809 0.1807 0.1595 -0.0052 0.0207 0.0078 837 PHE C O 9438 C CB . PHE C 529 ? 0.2074 0.2093 0.1823 -0.0094 0.0190 0.0028 837 PHE C CB 9439 C CG . PHE C 529 ? 0.2239 0.2280 0.1999 -0.0118 0.0198 0.0008 837 PHE C CG 9440 C CD1 . PHE C 529 ? 0.2317 0.2337 0.2081 -0.0147 0.0214 -0.0002 837 PHE C CD1 9441 C CD2 . PHE C 529 ? 0.2505 0.2582 0.2280 -0.0110 0.0188 0.0002 837 PHE C CD2 9442 C CE1 . PHE C 529 ? 0.2130 0.2188 0.1946 -0.0174 0.0213 -0.0011 837 PHE C CE1 9443 C CE2 . PHE C 529 ? 0.2416 0.2531 0.2234 -0.0126 0.0202 -0.0005 837 PHE C CE2 9444 C CZ . PHE C 529 ? 0.2053 0.2169 0.1906 -0.0161 0.0213 -0.0008 837 PHE C CZ 9445 N N . ASN C 530 ? 0.1777 0.1710 0.1513 -0.0038 0.0222 0.0095 838 ASN C N 9446 C CA . ASN C 530 ? 0.1949 0.1898 0.1745 -0.0006 0.0217 0.0133 838 ASN C CA 9447 C C . ASN C 530 ? 0.1908 0.1823 0.1698 0.0014 0.0273 0.0141 838 ASN C C 9448 O O . ASN C 530 ? 0.1832 0.1680 0.1547 0.0002 0.0303 0.0113 838 ASN C O 9449 C CB . ASN C 530 ? 0.1953 0.1882 0.1742 0.0016 0.0194 0.0161 838 ASN C CB 9450 C CG . ASN C 530 ? 0.2632 0.2581 0.2415 0.0013 0.0125 0.0157 838 ASN C CG 9451 O OD1 . ASN C 530 ? 0.3532 0.3529 0.3394 0.0010 0.0077 0.0166 838 ASN C OD1 9452 N ND2 . ASN C 530 ? 0.2770 0.2666 0.2452 0.0016 0.0122 0.0147 838 ASN C ND2 9453 N N . GLN C 531 ? 0.1760 0.1713 0.1630 0.0046 0.0286 0.0182 839 GLN C N 9454 C CA . GLN C 531 ? 0.1528 0.1432 0.1380 0.0087 0.0353 0.0200 839 GLN C CA 9455 C C . GLN C 531 ? 0.2007 0.1835 0.1806 0.0102 0.0369 0.0200 839 GLN C C 9456 O O . GLN C 531 ? 0.1975 0.1821 0.1803 0.0102 0.0331 0.0220 839 GLN C O 9457 C CB . GLN C 531 ? 0.1736 0.1714 0.1725 0.0127 0.0371 0.0264 839 GLN C CB 9458 C CG . GLN C 531 ? 0.1765 0.1811 0.1821 0.0115 0.0367 0.0277 839 GLN C CG 9459 C CD . GLN C 531 ? 0.2035 0.2154 0.2250 0.0155 0.0405 0.0353 839 GLN C CD 9460 O OE1 . GLN C 531 ? 0.2049 0.2135 0.2243 0.0208 0.0493 0.0381 839 GLN C OE1 9461 N NE2 . GLN C 531 ? 0.1682 0.1894 0.2059 0.0133 0.0339 0.0391 839 GLN C NE2 9462 N N . LEU C 532 ? 0.1961 0.1685 0.1664 0.0116 0.0421 0.0178 840 LEU C N 9463 C CA . LEU C 532 ? 0.2152 0.1778 0.1795 0.0123 0.0440 0.0175 840 LEU C CA 9464 C C . LEU C 532 ? 0.2107 0.1744 0.1818 0.0178 0.0454 0.0234 840 LEU C C 9465 O O . LEU C 532 ? 0.2123 0.1697 0.1799 0.0184 0.0455 0.0244 840 LEU C O 9466 C CB . LEU C 532 ? 0.2396 0.1887 0.1919 0.0128 0.0484 0.0134 840 LEU C CB 9467 C CG . LEU C 532 ? 0.2478 0.1949 0.1935 0.0071 0.0452 0.0075 840 LEU C CG 9468 C CD1 . LEU C 532 ? 0.1921 0.1233 0.1242 0.0078 0.0477 0.0030 840 LEU C CD1 9469 C CD2 . LEU C 532 ? 0.2329 0.1832 0.1816 0.0009 0.0409 0.0062 840 LEU C CD2 9470 N N . TYR C 533 ? 0.1811 0.1533 0.1635 0.0220 0.0465 0.0281 841 TYR C N 9471 C CA . TYR C 533 ? 0.2146 0.1897 0.2070 0.0276 0.0472 0.0346 841 TYR C CA 9472 C C . TYR C 533 ? 0.2160 0.1946 0.2110 0.0258 0.0390 0.0364 841 TYR C C 9473 O O . TYR C 533 ? 0.2260 0.2030 0.2241 0.0300 0.0384 0.0408 841 TYR C O 9474 C CB . TYR C 533 ? 0.2353 0.2214 0.2439 0.0319 0.0498 0.0406 841 TYR C CB 9475 C CG . TYR C 533 ? 0.2089 0.2089 0.2325 0.0284 0.0414 0.0432 841 TYR C CG 9476 C CD1 . TYR C 533 ? 0.1994 0.2060 0.2346 0.0291 0.0336 0.0477 841 TYR C CD1 9477 C CD2 . TYR C 533 ? 0.2221 0.2272 0.2476 0.0246 0.0406 0.0413 841 TYR C CD2 9478 C CE1 . TYR C 533 ? 0.1987 0.2155 0.2463 0.0255 0.0244 0.0494 841 TYR C CE1 9479 C CE2 . TYR C 533 ? 0.2233 0.2389 0.2623 0.0211 0.0326 0.0435 841 TYR C CE2 9480 C CZ . TYR C 533 ? 0.2266 0.2475 0.2766 0.0214 0.0242 0.0472 841 TYR C CZ 9481 O OH . TYR C 533 ? 0.2343 0.2633 0.2967 0.0176 0.0146 0.0486 841 TYR C OH 9482 N N . LYS C 534 ? 0.1752 0.1573 0.1673 0.0202 0.0329 0.0330 842 LYS C N 9483 C CA . LYS C 534 ? 0.2109 0.1941 0.2012 0.0192 0.0252 0.0340 842 LYS C CA 9484 C C . LYS C 534 ? 0.2404 0.2126 0.2174 0.0194 0.0275 0.0333 842 LYS C C 9485 O O . LYS C 534 ? 0.2313 0.2017 0.2037 0.0205 0.0226 0.0354 842 LYS C O 9486 C CB . LYS C 534 ? 0.1926 0.1808 0.1819 0.0144 0.0193 0.0304 842 LYS C CB 9487 C CG . LYS C 534 ? 0.1830 0.1815 0.1867 0.0138 0.0164 0.0321 842 LYS C CG 9488 C CD . LYS C 534 ? 0.1890 0.1904 0.1915 0.0098 0.0088 0.0290 842 LYS C CD 9489 C CE . LYS C 534 ? 0.1975 0.2082 0.2163 0.0087 0.0052 0.0316 842 LYS C CE 9490 N NZ . LYS C 534 ? 0.1765 0.1875 0.1928 0.0049 -0.0023 0.0279 842 LYS C NZ 9491 N N . ILE C 535 ? 0.2251 0.1887 0.1952 0.0182 0.0345 0.0305 843 ILE C N 9492 C CA . ILE C 535 ? 0.2163 0.1686 0.1761 0.0175 0.0376 0.0304 843 ILE C CA 9493 C C . ILE C 535 ? 0.2543 0.1994 0.2144 0.0234 0.0408 0.0351 843 ILE C C 9494 O O . ILE C 535 ? 0.2410 0.1866 0.2071 0.0276 0.0441 0.0365 843 ILE C O 9495 C CB . ILE C 535 ? 0.2465 0.1919 0.2007 0.0124 0.0421 0.0251 843 ILE C CB 9496 C CG1 . ILE C 535 ? 0.2372 0.1908 0.1932 0.0074 0.0391 0.0209 843 ILE C CG1 9497 C CG2 . ILE C 535 ? 0.2409 0.1760 0.1879 0.0101 0.0449 0.0258 843 ILE C CG2 9498 C CD1 . ILE C 535 ? 0.2732 0.2218 0.2259 0.0027 0.0414 0.0159 843 ILE C CD1 9499 N N . ASP C 536 ? 0.2363 0.1741 0.1896 0.0247 0.0408 0.0382 844 ASP C N 9500 C CA . ASP C 536 ? 0.2661 0.1948 0.2183 0.0305 0.0443 0.0428 844 ASP C CA 9501 C C . ASP C 536 ? 0.2608 0.1751 0.2022 0.0280 0.0491 0.0428 844 ASP C C 9502 O O . ASP C 536 ? 0.2641 0.1780 0.2009 0.0221 0.0493 0.0400 844 ASP C O 9503 C CB . ASP C 536 ? 0.2642 0.1991 0.2219 0.0365 0.0380 0.0493 844 ASP C CB 9504 C CG . ASP C 536 ? 0.3172 0.2523 0.2660 0.0352 0.0317 0.0506 844 ASP C CG 9505 O OD1 . ASP C 536 ? 0.3118 0.2417 0.2506 0.0306 0.0345 0.0477 844 ASP C OD1 9506 O OD2 . ASP C 536 ? 0.3459 0.2860 0.2976 0.0394 0.0238 0.0548 844 ASP C OD2 9507 N N . PRO C 537 ? 0.2483 0.1507 0.1870 0.0326 0.0535 0.0463 845 PRO C N 9508 C CA . PRO C 537 ? 0.2869 0.1746 0.2170 0.0292 0.0584 0.0465 845 PRO C CA 9509 C C . PRO C 537 ? 0.3185 0.2068 0.2424 0.0269 0.0570 0.0497 845 PRO C C 9510 O O . PRO C 537 ? 0.3340 0.2171 0.2551 0.0207 0.0607 0.0481 845 PRO C O 9511 C CB . PRO C 537 ? 0.3074 0.1830 0.2359 0.0364 0.0621 0.0514 845 PRO C CB 9512 C CG . PRO C 537 ? 0.2930 0.1745 0.2294 0.0417 0.0624 0.0502 845 PRO C CG 9513 C CD . PRO C 537 ? 0.2662 0.1668 0.2108 0.0403 0.0559 0.0494 845 PRO C CD 9514 N N . SER C 538 ? 0.2898 0.1838 0.2113 0.0320 0.0518 0.0544 846 SER C N 9515 C CA A SER C 538 ? 0.3254 0.2174 0.2363 0.0317 0.0511 0.0576 846 SER C CA 9516 C CA B SER C 538 ? 0.3284 0.2208 0.2394 0.0318 0.0508 0.0576 846 SER C CA 9517 C C . SER C 538 ? 0.3058 0.2059 0.2168 0.0254 0.0506 0.0526 846 SER C C 9518 O O . SER C 538 ? 0.3046 0.2004 0.2088 0.0228 0.0551 0.0541 846 SER C O 9519 C CB A SER C 538 ? 0.3497 0.2446 0.2556 0.0390 0.0433 0.0627 846 SER C CB 9520 C CB B SER C 538 ? 0.3494 0.2461 0.2566 0.0389 0.0424 0.0622 846 SER C CB 9521 O OG A SER C 538 ? 0.3537 0.2624 0.2670 0.0389 0.0349 0.0594 846 SER C OG 9522 O OG B SER C 538 ? 0.3570 0.2515 0.2503 0.0395 0.0405 0.0640 846 SER C OG 9523 N N . THR C 539 ? 0.2640 0.1756 0.1832 0.0234 0.0461 0.0474 847 THR C N 9524 C CA . THR C 539 ? 0.2639 0.1833 0.1842 0.0181 0.0454 0.0426 847 THR C CA 9525 C C . THR C 539 ? 0.2426 0.1583 0.1665 0.0113 0.0519 0.0397 847 THR C C 9526 O O . THR C 539 ? 0.2927 0.2094 0.2146 0.0080 0.0549 0.0399 847 THR C O 9527 C CB . THR C 539 ? 0.2713 0.2029 0.2004 0.0177 0.0390 0.0384 847 THR C CB 9528 O OG1 . THR C 539 ? 0.2974 0.2329 0.2252 0.0228 0.0313 0.0414 847 THR C OG1 9529 C CG2 . THR C 539 ? 0.2409 0.1794 0.1711 0.0126 0.0386 0.0336 847 THR C CG2 9530 N N . LEU C 540 ? 0.2482 0.1591 0.1774 0.0095 0.0540 0.0374 848 LEU C N 9531 C CA . LEU C 540 ? 0.2576 0.1638 0.1905 0.0024 0.0577 0.0340 848 LEU C CA 9532 C C . LEU C 540 ? 0.2697 0.1660 0.1999 0.0003 0.0636 0.0391 848 LEU C C 9533 O O . LEU C 540 ? 0.2555 0.1525 0.1911 -0.0061 0.0664 0.0385 848 LEU C O 9534 C CB . LEU C 540 ? 0.2765 0.1755 0.2114 0.0019 0.0578 0.0299 848 LEU C CB 9535 C CG . LEU C 540 ? 0.2983 0.1918 0.2364 -0.0060 0.0585 0.0250 848 LEU C CG 9536 C CD1 . LEU C 540 ? 0.2737 0.1806 0.2176 -0.0106 0.0549 0.0211 848 LEU C CD1 9537 C CD2 . LEU C 540 ? 0.3392 0.2211 0.2737 -0.0049 0.0583 0.0205 848 LEU C CD2 9538 N N . GLN C 541 ? 0.2695 0.1570 0.1927 0.0060 0.0657 0.0450 849 GLN C N 9539 C CA . GLN C 541 ? 0.2921 0.1692 0.2115 0.0049 0.0723 0.0513 849 GLN C CA 9540 C C . GLN C 541 ? 0.3038 0.1879 0.2201 0.0043 0.0747 0.0541 849 GLN C C 9541 O O . GLN C 541 ? 0.3033 0.1850 0.2239 -0.0005 0.0810 0.0569 849 GLN C O 9542 C CB . GLN C 541 ? 0.3601 0.2264 0.2707 0.0125 0.0734 0.0577 849 GLN C CB 9543 C CG . GLN C 541 ? 0.4628 0.3202 0.3697 0.0123 0.0795 0.0641 849 GLN C CG 9544 C CD . GLN C 541 ? 0.5645 0.4129 0.4807 0.0048 0.0840 0.0629 849 GLN C CD 9545 O OE1 . GLN C 541 ? 0.5844 0.4218 0.5018 0.0047 0.0838 0.0610 849 GLN C OE1 9546 N NE2 . GLN C 541 ? 0.5969 0.4494 0.5202 -0.0013 0.0877 0.0641 849 GLN C NE2 9547 N N . MET C 542 ? 0.2843 0.1769 0.1938 0.0092 0.0697 0.0534 850 MET C N 9548 C CA A MET C 542 ? 0.3022 0.1998 0.2053 0.0102 0.0717 0.0550 850 MET C CA 9549 C CA B MET C 542 ? 0.3013 0.1989 0.2044 0.0102 0.0717 0.0550 850 MET C CA 9550 C C . MET C 542 ? 0.2901 0.1966 0.2056 0.0028 0.0743 0.0510 850 MET C C 9551 O O . MET C 542 ? 0.2920 0.2000 0.2096 0.0013 0.0805 0.0539 850 MET C O 9552 C CB A MET C 542 ? 0.2901 0.1940 0.1844 0.0159 0.0633 0.0527 850 MET C CB 9553 C CB B MET C 542 ? 0.2904 0.1940 0.1845 0.0161 0.0633 0.0529 850 MET C CB 9554 C CG A MET C 542 ? 0.2907 0.1864 0.1692 0.0241 0.0604 0.0583 850 MET C CG 9555 C CG B MET C 542 ? 0.2842 0.1868 0.1638 0.0202 0.0650 0.0553 850 MET C CG 9556 S SD A MET C 542 ? 0.5206 0.4192 0.3831 0.0293 0.0538 0.0566 850 MET C SD 9557 S SD B MET C 542 ? 0.4550 0.3574 0.3195 0.0282 0.0526 0.0542 850 MET C SD 9558 C CE A MET C 542 ? 0.3576 0.2705 0.2350 0.0260 0.0434 0.0483 850 MET C CE 9559 C CE B MET C 542 ? 0.3128 0.2183 0.1905 0.0283 0.0453 0.0533 850 MET C CE 9560 N N . TRP C 543 ? 0.2680 0.1817 0.1933 -0.0010 0.0687 0.0441 851 TRP C N 9561 C CA . TRP C 543 ? 0.2541 0.1766 0.1915 -0.0076 0.0690 0.0400 851 TRP C CA 9562 C C . TRP C 543 ? 0.2781 0.1953 0.2263 -0.0146 0.0747 0.0423 851 TRP C C 9563 O O . TRP C 543 ? 0.3090 0.2328 0.2671 -0.0190 0.0783 0.0435 851 TRP C O 9564 C CB . TRP C 543 ? 0.2557 0.1846 0.1984 -0.0092 0.0615 0.0328 851 TRP C CB 9565 C CG . TRP C 543 ? 0.2369 0.1734 0.1740 -0.0043 0.0559 0.0308 851 TRP C CG 9566 C CD1 . TRP C 543 ? 0.2328 0.1704 0.1601 0.0007 0.0556 0.0333 851 TRP C CD1 9567 C CD2 . TRP C 543 ? 0.2424 0.1851 0.1831 -0.0039 0.0496 0.0260 851 TRP C CD2 9568 N NE1 . TRP C 543 ? 0.2356 0.1794 0.1616 0.0033 0.0482 0.0299 851 TRP C NE1 9569 C CE2 . TRP C 543 ? 0.2284 0.1763 0.1638 0.0004 0.0451 0.0260 851 TRP C CE2 9570 C CE3 . TRP C 543 ? 0.2310 0.1739 0.1774 -0.0064 0.0476 0.0218 851 TRP C CE3 9571 C CZ2 . TRP C 543 ? 0.2359 0.1909 0.1755 0.0014 0.0390 0.0228 851 TRP C CZ2 9572 C CZ3 . TRP C 543 ? 0.2734 0.2230 0.2217 -0.0044 0.0428 0.0191 851 TRP C CZ3 9573 C CH2 . TRP C 543 ? 0.2432 0.1995 0.1898 -0.0009 0.0387 0.0200 851 TRP C CH2 9574 N N . ALA C 544 ? 0.2648 0.1700 0.2124 -0.0156 0.0753 0.0433 852 ALA C N 9575 C CA . ALA C 544 ? 0.2776 0.1750 0.2355 -0.0228 0.0796 0.0457 852 ALA C CA 9576 C C . ALA C 544 ? 0.3082 0.2062 0.2677 -0.0219 0.0875 0.0537 852 ALA C C 9577 O O . ALA C 544 ? 0.3050 0.2064 0.2794 -0.0284 0.0900 0.0554 852 ALA C O 9578 C CB . ALA C 544 ? 0.3087 0.1903 0.2626 -0.0225 0.0786 0.0451 852 ALA C CB 9579 N N . ASN C 545 ? 0.2634 0.1599 0.2085 -0.0133 0.0889 0.0575 853 ASN C N 9580 C CA . ASN C 545 ? 0.3289 0.2264 0.2723 -0.0102 0.0949 0.0636 853 ASN C CA 9581 C C . ASN C 545 ? 0.3125 0.2229 0.2626 -0.0111 0.0977 0.0635 853 ASN C C 9582 O O . ASN C 545 ? 0.2909 0.2040 0.2490 -0.0123 0.1039 0.0683 853 ASN C O 9583 C CB . ASN C 545 ? 0.3077 0.1990 0.2314 -0.0003 0.0942 0.0667 853 ASN C CB 9584 C CG . ASN C 545 ? 0.4077 0.2861 0.3269 0.0016 0.0937 0.0693 853 ASN C CG 9585 O OD1 . ASN C 545 ? 0.4216 0.2937 0.3513 -0.0043 0.0954 0.0695 853 ASN C OD1 9586 N ND2 . ASN C 545 ? 0.4114 0.2851 0.3149 0.0100 0.0906 0.0713 853 ASN C ND2 9587 N N . ILE C 546 ? 0.2827 0.2010 0.2300 -0.0100 0.0933 0.0585 854 ILE C N 9588 C CA . ILE C 546 ? 0.2547 0.1850 0.2082 -0.0101 0.0954 0.0577 854 ILE C CA 9589 C C . ILE C 546 ? 0.2538 0.1918 0.2308 -0.0195 0.0967 0.0574 854 ILE C C 9590 O O . ILE C 546 ? 0.2646 0.2093 0.2527 -0.0206 0.1021 0.0613 854 ILE C O 9591 C CB . ILE C 546 ? 0.2544 0.1899 0.1986 -0.0066 0.0896 0.0521 854 ILE C CB 9592 C CG1 . ILE C 546 ? 0.2730 0.2015 0.1949 0.0027 0.0872 0.0529 854 ILE C CG1 9593 C CG2 . ILE C 546 ? 0.2744 0.2220 0.2273 -0.0072 0.0917 0.0507 854 ILE C CG2 9594 C CD1 . ILE C 546 ? 0.2276 0.1578 0.1403 0.0053 0.0791 0.0477 854 ILE C CD1 9595 N N . LEU C 547 ? 0.2185 0.1545 0.2031 -0.0262 0.0914 0.0529 855 LEU C N 9596 C CA . LEU C 547 ? 0.2828 0.2243 0.2894 -0.0360 0.0897 0.0516 855 LEU C CA 9597 C C . LEU C 547 ? 0.2699 0.2088 0.2899 -0.0405 0.0938 0.0575 855 LEU C C 9598 O O . LEU C 547 ? 0.2660 0.2147 0.3056 -0.0461 0.0944 0.0593 855 LEU C O 9599 C CB . LEU C 547 ? 0.2840 0.2189 0.2908 -0.0411 0.0812 0.0443 855 LEU C CB 9600 C CG . LEU C 547 ? 0.2965 0.2390 0.2952 -0.0372 0.0731 0.0366 855 LEU C CG 9601 C CD1 . LEU C 547 ? 0.2991 0.2343 0.2948 -0.0398 0.0643 0.0292 855 LEU C CD1 9602 C CD2 . LEU C 547 ? 0.2555 0.2134 0.2664 -0.0391 0.0720 0.0354 855 LEU C CD2 9603 N N . LYS C 548 ? 0.2762 0.2023 0.2866 -0.0381 0.0963 0.0608 856 LYS C N 9604 C CA . LYS C 548 ? 0.3129 0.2354 0.3348 -0.0420 0.1009 0.0671 856 LYS C CA 9605 C C . LYS C 548 ? 0.3193 0.2511 0.3442 -0.0374 0.1094 0.0737 856 LYS C C 9606 O O . LYS C 548 ? 0.3407 0.2768 0.3835 -0.0425 0.1132 0.0785 856 LYS C O 9607 C CB . LYS C 548 ? 0.3391 0.2449 0.3484 -0.0393 0.1021 0.0694 856 LYS C CB 9608 C CG . LYS C 548 ? 0.3991 0.2928 0.4065 -0.0436 0.0950 0.0634 856 LYS C CG 9609 C CD . LYS C 548 ? 0.5136 0.3920 0.5047 -0.0375 0.0966 0.0655 856 LYS C CD 9610 C CE . LYS C 548 ? 0.5903 0.4564 0.5751 -0.0386 0.0904 0.0588 856 LYS C CE 9611 N NZ . LYS C 548 ? 0.6522 0.5113 0.6513 -0.0492 0.0855 0.0548 856 LYS C NZ 9612 N N . ARG C 549 ? 0.2978 0.2315 0.3050 -0.0277 0.1122 0.0737 857 ARG C N 9613 C CA . ARG C 549 ? 0.2931 0.2322 0.2987 -0.0217 0.1207 0.0792 857 ARG C CA 9614 C C . ARG C 549 ? 0.2613 0.2158 0.2823 -0.0235 0.1216 0.0782 857 ARG C C 9615 O O . ARG C 549 ? 0.2739 0.2337 0.2996 -0.0199 0.1295 0.0833 857 ARG C O 9616 C CB . ARG C 549 ? 0.2876 0.2199 0.2661 -0.0103 0.1222 0.0791 857 ARG C CB 9617 C CG . ARG C 549 ? 0.3321 0.2501 0.2960 -0.0062 0.1241 0.0831 857 ARG C CG 9618 C CD . ARG C 549 ? 0.3746 0.2866 0.3124 0.0050 0.1242 0.0830 857 ARG C CD 9619 N NE . ARG C 549 ? 0.4133 0.3299 0.3482 0.0105 0.1313 0.0857 857 ARG C NE 9620 C CZ . ARG C 549 ? 0.4725 0.3835 0.3848 0.0203 0.1317 0.0851 857 ARG C CZ 9621 N NH1 . ARG C 549 ? 0.4480 0.3502 0.3401 0.0252 0.1245 0.0823 857 ARG C NH1 9622 N NH2 . ARG C 549 ? 0.4872 0.4008 0.3973 0.0255 0.1391 0.0876 857 ARG C NH2 9623 N N . VAL C 550 ? 0.2686 0.2297 0.2972 -0.0285 0.1139 0.0719 858 VAL C N 9624 C CA . VAL C 550 ? 0.2753 0.2514 0.3189 -0.0300 0.1135 0.0705 858 VAL C CA 9625 C C . VAL C 550 ? 0.3122 0.2939 0.3792 -0.0416 0.1061 0.0679 858 VAL C C 9626 O O . VAL C 550 ? 0.2925 0.2758 0.3592 -0.0447 0.0982 0.0614 858 VAL C O 9627 C CB . VAL C 550 ? 0.2595 0.2383 0.2873 -0.0238 0.1098 0.0645 858 VAL C CB 9628 C CG1 . VAL C 550 ? 0.2220 0.2155 0.2639 -0.0236 0.1106 0.0638 858 VAL C CG1 9629 C CG2 . VAL C 550 ? 0.2455 0.2147 0.2466 -0.0131 0.1135 0.0655 858 VAL C CG2 9630 N N . PRO C 551 ? 0.3707 0.3543 0.4575 -0.0482 0.1081 0.0728 859 PRO C N 9631 C CA . PRO C 551 ? 0.4034 0.3887 0.5111 -0.0601 0.0990 0.0701 859 PRO C CA 9632 C C . PRO C 551 ? 0.3807 0.3790 0.5007 -0.0634 0.0912 0.0648 859 PRO C C 9633 O O . PRO C 551 ? 0.3765 0.3713 0.5005 -0.0706 0.0806 0.0586 859 PRO C O 9634 C CB . PRO C 551 ? 0.4347 0.4236 0.5628 -0.0644 0.1043 0.0778 859 PRO C CB 9635 C CG . PRO C 551 ? 0.4290 0.4221 0.5498 -0.0540 0.1170 0.0845 859 PRO C CG 9636 C CD . PRO C 551 ? 0.4294 0.4127 0.5197 -0.0447 0.1187 0.0814 859 PRO C CD 9637 N N . ASN C 552 ? 0.3318 0.3434 0.4563 -0.0576 0.0962 0.0670 860 ASN C N 9638 C CA . ASN C 552 ? 0.3632 0.3878 0.4994 -0.0595 0.0893 0.0627 860 ASN C CA 9639 C C . ASN C 552 ? 0.3605 0.3825 0.4759 -0.0536 0.0871 0.0566 860 ASN C C 9640 O O . ASN C 552 ? 0.3362 0.3654 0.4459 -0.0459 0.0914 0.0569 860 ASN C O 9641 C CB . ASN C 552 ? 0.4650 0.5045 0.6173 -0.0556 0.0960 0.0683 860 ASN C CB 9642 C CG . ASN C 552 ? 0.5094 0.5633 0.6835 -0.0607 0.0870 0.0656 860 ASN C CG 9643 O OD1 . ASN C 552 ? 0.5531 0.6055 0.7351 -0.0695 0.0749 0.0605 860 ASN C OD1 9644 N ND2 . ASN C 552 ? 0.5014 0.5680 0.6845 -0.0547 0.0923 0.0689 860 ASN C ND2 9645 N N . SER C 553 ? 0.2820 0.2926 0.3860 -0.0568 0.0807 0.0511 861 SER C N 9646 C CA . SER C 553 ? 0.2157 0.2229 0.3006 -0.0517 0.0788 0.0455 861 SER C CA 9647 C C . SER C 553 ? 0.2196 0.2161 0.2949 -0.0557 0.0675 0.0373 861 SER C C 9648 O O . SER C 553 ? 0.2267 0.2125 0.3046 -0.0616 0.0650 0.0371 861 SER C O 9649 C CB . SER C 553 ? 0.2174 0.2169 0.2779 -0.0416 0.0866 0.0478 861 SER C CB 9650 O OG . SER C 553 ? 0.2281 0.2127 0.2768 -0.0421 0.0872 0.0486 861 SER C OG 9651 N N . VAL C 554 ? 0.2062 0.2046 0.2684 -0.0513 0.0607 0.0305 862 VAL C N 9652 C CA . VAL C 554 ? 0.1966 0.1851 0.2459 -0.0524 0.0510 0.0228 862 VAL C CA 9653 C C . VAL C 554 ? 0.1977 0.1831 0.2257 -0.0439 0.0513 0.0201 862 VAL C C 9654 O O . VAL C 554 ? 0.1945 0.1866 0.2184 -0.0381 0.0554 0.0220 862 VAL C O 9655 C CB . VAL C 554 ? 0.2170 0.2112 0.2754 -0.0574 0.0397 0.0170 862 VAL C CB 9656 C CG1 . VAL C 554 ? 0.2132 0.2098 0.2947 -0.0670 0.0365 0.0193 862 VAL C CG1 9657 C CG2 . VAL C 554 ? 0.2173 0.2255 0.2780 -0.0529 0.0389 0.0164 862 VAL C CG2 9658 N N . LEU C 555 ? 0.2084 0.1829 0.2235 -0.0429 0.0469 0.0159 863 LEU C N 9659 C CA . LEU C 555 ? 0.2253 0.1981 0.2245 -0.0358 0.0459 0.0136 863 LEU C CA 9660 C C . LEU C 555 ? 0.2545 0.2293 0.2512 -0.0362 0.0378 0.0074 863 LEU C C 9661 O O . LEU C 555 ? 0.2372 0.2053 0.2341 -0.0402 0.0330 0.0038 863 LEU C O 9662 C CB . LEU C 555 ? 0.2131 0.1730 0.2007 -0.0329 0.0484 0.0150 863 LEU C CB 9663 C CG . LEU C 555 ? 0.2566 0.2151 0.2314 -0.0261 0.0463 0.0134 863 LEU C CG 9664 C CD1 . LEU C 555 ? 0.2430 0.2082 0.2133 -0.0209 0.0482 0.0159 863 LEU C CD1 9665 C CD2 . LEU C 555 ? 0.3209 0.2667 0.2876 -0.0236 0.0482 0.0149 863 LEU C CD2 9666 N N . TRP C 556 ? 0.1969 0.1795 0.1901 -0.0319 0.0364 0.0063 864 TRP C N 9667 C CA . TRP C 556 ? 0.1707 0.1563 0.1623 -0.0318 0.0298 0.0017 864 TRP C CA 9668 C C . TRP C 556 ? 0.1922 0.1736 0.1719 -0.0264 0.0295 0.0007 864 TRP C C 9669 O O . TRP C 556 ? 0.1931 0.1780 0.1700 -0.0222 0.0312 0.0027 864 TRP C O 9670 C CB . TRP C 556 ? 0.1700 0.1681 0.1695 -0.0311 0.0288 0.0022 864 TRP C CB 9671 C CG . TRP C 556 ? 0.1780 0.1801 0.1773 -0.0312 0.0221 -0.0015 864 TRP C CG 9672 C CD1 . TRP C 556 ? 0.2050 0.2007 0.1980 -0.0325 0.0168 -0.0052 864 TRP C CD1 9673 C CD2 . TRP C 556 ? 0.1482 0.1601 0.1522 -0.0291 0.0206 -0.0014 864 TRP C CD2 9674 N NE1 . TRP C 556 ? 0.1956 0.1969 0.1888 -0.0314 0.0120 -0.0069 864 TRP C NE1 9675 C CE2 . TRP C 556 ? 0.1892 0.2007 0.1901 -0.0295 0.0141 -0.0046 864 TRP C CE2 9676 C CE3 . TRP C 556 ? 0.2119 0.2311 0.2206 -0.0261 0.0244 0.0011 864 TRP C CE3 9677 C CZ2 . TRP C 556 ? 0.1677 0.1868 0.1717 -0.0274 0.0111 -0.0048 864 TRP C CZ2 9678 C CZ3 . TRP C 556 ? 0.2067 0.2329 0.2186 -0.0239 0.0214 0.0003 864 TRP C CZ3 9679 C CH2 . TRP C 556 ? 0.1615 0.1880 0.1719 -0.0249 0.0147 -0.0024 864 TRP C CH2 9680 N N . LEU C 557 ? 0.2048 0.1778 0.1778 -0.0264 0.0273 -0.0021 865 LEU C N 9681 C CA . LEU C 557 ? 0.2286 0.1983 0.1933 -0.0209 0.0282 -0.0020 865 LEU C CA 9682 C C . LEU C 557 ? 0.2278 0.1966 0.1875 -0.0199 0.0249 -0.0052 865 LEU C C 9683 O O . LEU C 557 ? 0.2382 0.2062 0.1981 -0.0234 0.0206 -0.0084 865 LEU C O 9684 C CB . LEU C 557 ? 0.2206 0.1786 0.1794 -0.0193 0.0317 -0.0009 865 LEU C CB 9685 C CG . LEU C 557 ? 0.2614 0.2172 0.2223 -0.0195 0.0356 0.0031 865 LEU C CG 9686 C CD1 . LEU C 557 ? 0.2482 0.1906 0.2029 -0.0176 0.0386 0.0039 865 LEU C CD1 9687 C CD2 . LEU C 557 ? 0.2750 0.2384 0.2361 -0.0152 0.0364 0.0066 865 LEU C CD2 9688 N N . LEU C 558 ? 0.1892 0.1581 0.1447 -0.0148 0.0267 -0.0038 866 LEU C N 9689 C CA . LEU C 558 ? 0.1660 0.1337 0.1156 -0.0125 0.0255 -0.0054 866 LEU C CA 9690 C C . LEU C 558 ? 0.2177 0.1730 0.1564 -0.0085 0.0292 -0.0062 866 LEU C C 9691 O O . LEU C 558 ? 0.2202 0.1712 0.1588 -0.0058 0.0333 -0.0040 866 LEU C O 9692 C CB . LEU C 558 ? 0.1960 0.1736 0.1510 -0.0094 0.0259 -0.0022 866 LEU C CB 9693 C CG . LEU C 558 ? 0.2194 0.2069 0.1826 -0.0120 0.0227 -0.0019 866 LEU C CG 9694 C CD1 . LEU C 558 ? 0.2327 0.2269 0.2002 -0.0094 0.0220 0.0006 866 LEU C CD1 9695 C CD2 . LEU C 558 ? 0.2104 0.1991 0.1743 -0.0159 0.0188 -0.0050 866 LEU C CD2 9696 N N . ARG C 559 ? 0.2217 0.1704 0.1498 -0.0072 0.0277 -0.0092 867 ARG C N 9697 C CA . ARG C 559 ? 0.2424 0.1781 0.1570 -0.0014 0.0326 -0.0097 867 ARG C CA 9698 C C . ARG C 559 ? 0.2142 0.1574 0.1335 0.0048 0.0388 -0.0040 867 ARG C C 9699 O O . ARG C 559 ? 0.2135 0.1582 0.1283 0.0077 0.0400 -0.0029 867 ARG C O 9700 C CB . ARG C 559 ? 0.2605 0.1843 0.1585 -0.0014 0.0285 -0.0150 867 ARG C CB 9701 C CG . ARG C 559 ? 0.3088 0.2270 0.2064 -0.0090 0.0201 -0.0204 867 ARG C CG 9702 C CD . ARG C 559 ? 0.3633 0.2648 0.2412 -0.0085 0.0146 -0.0265 867 ARG C CD 9703 N NE . ARG C 559 ? 0.3908 0.2886 0.2728 -0.0170 0.0048 -0.0311 867 ARG C NE 9704 C CZ . ARG C 559 ? 0.4281 0.3331 0.3153 -0.0217 -0.0044 -0.0328 867 ARG C CZ 9705 N NH1 . ARG C 559 ? 0.4016 0.3159 0.2877 -0.0184 -0.0047 -0.0307 867 ARG C NH1 9706 N NH2 . ARG C 559 ? 0.4688 0.3715 0.3636 -0.0297 -0.0133 -0.0361 867 ARG C NH2 9707 N N . PHE C 560 ? 0.2285 0.1766 0.1578 0.0068 0.0424 0.0004 868 PHE C N 9708 C CA . PHE C 560 ? 0.2252 0.1843 0.1660 0.0106 0.0458 0.0067 868 PHE C CA 9709 C C . PHE C 560 ? 0.2316 0.1882 0.1762 0.0163 0.0520 0.0110 868 PHE C C 9710 O O . PHE C 560 ? 0.1905 0.1555 0.1479 0.0160 0.0506 0.0150 868 PHE C O 9711 C CB . PHE C 560 ? 0.1833 0.1552 0.1374 0.0059 0.0401 0.0079 868 PHE C CB 9712 C CG . PHE C 560 ? 0.1868 0.1698 0.1518 0.0069 0.0396 0.0123 868 PHE C CG 9713 C CD1 . PHE C 560 ? 0.2253 0.2169 0.1991 0.0032 0.0338 0.0125 868 PHE C CD1 9714 C CD2 . PHE C 560 ? 0.2330 0.2166 0.1993 0.0118 0.0453 0.0165 868 PHE C CD2 9715 C CE1 . PHE C 560 ? 0.2256 0.2254 0.2099 0.0033 0.0322 0.0161 868 PHE C CE1 9716 C CE2 . PHE C 560 ? 0.2331 0.2268 0.2121 0.0118 0.0447 0.0213 868 PHE C CE2 9717 C CZ . PHE C 560 ? 0.2043 0.2057 0.1926 0.0071 0.0374 0.0208 868 PHE C CZ 9718 N N . PRO C 561 ? 0.2481 0.1922 0.1807 0.0221 0.0587 0.0105 869 PRO C N 9719 C CA . PRO C 561 ? 0.2764 0.2078 0.1901 0.0244 0.0606 0.0062 869 PRO C CA 9720 C C . PRO C 561 ? 0.2938 0.2091 0.1920 0.0208 0.0562 -0.0015 869 PRO C C 9721 O O . PRO C 561 ? 0.2731 0.1851 0.1749 0.0181 0.0547 -0.0024 869 PRO C O 9722 C CB . PRO C 561 ? 0.2645 0.1904 0.1743 0.0344 0.0716 0.0110 869 PRO C CB 9723 C CG . PRO C 561 ? 0.2620 0.1898 0.1832 0.0364 0.0739 0.0145 869 PRO C CG 9724 C CD . PRO C 561 ? 0.2419 0.1829 0.1785 0.0285 0.0653 0.0149 869 PRO C CD 9725 N N . ALA C 562 ? 0.2563 0.1608 0.1373 0.0208 0.0536 -0.0067 870 ALA C N 9726 C CA . ALA C 562 ? 0.3052 0.1934 0.1719 0.0165 0.0473 -0.0144 870 ALA C CA 9727 C C . ALA C 562 ? 0.3108 0.1828 0.1697 0.0200 0.0519 -0.0158 870 ALA C C 9728 O O . ALA C 562 ? 0.3186 0.1830 0.1777 0.0140 0.0467 -0.0197 870 ALA C O 9729 C CB . ALA C 562 ? 0.3128 0.1890 0.1585 0.0181 0.0437 -0.0194 870 ALA C CB 9730 N N . VAL C 563 ? 0.3407 0.2076 0.1945 0.0297 0.0623 -0.0119 871 VAL C N 9731 C CA . VAL C 563 ? 0.3663 0.2159 0.2111 0.0346 0.0675 -0.0131 871 VAL C CA 9732 C C . VAL C 563 ? 0.3614 0.2181 0.2238 0.0307 0.0665 -0.0099 871 VAL C C 9733 O O . VAL C 563 ? 0.3684 0.2102 0.2246 0.0329 0.0692 -0.0111 871 VAL C O 9734 C CB . VAL C 563 ? 0.3956 0.2381 0.2314 0.0475 0.0803 -0.0089 871 VAL C CB 9735 C CG1 . VAL C 563 ? 0.3370 0.1700 0.1546 0.0501 0.0781 -0.0115 871 VAL C CG1 9736 C CG2 . VAL C 563 ? 0.4002 0.2663 0.2595 0.0510 0.0865 0.0013 871 VAL C CG2 9737 N N . GLY C 564 ? 0.3568 0.2343 0.2389 0.0252 0.0626 -0.0058 872 GLY C N 9738 C CA . GLY C 564 ? 0.3254 0.2083 0.2207 0.0214 0.0608 -0.0030 872 GLY C CA 9739 C C . GLY C 564 ? 0.3419 0.2191 0.2360 0.0118 0.0533 -0.0080 872 GLY C C 9740 O O . GLY C 564 ? 0.3379 0.2124 0.2374 0.0093 0.0533 -0.0062 872 GLY C O 9741 N N . GLU C 565 ? 0.3318 0.2079 0.2201 0.0066 0.0470 -0.0133 873 GLU C N 9742 C CA . GLU C 565 ? 0.3516 0.2239 0.2423 -0.0030 0.0393 -0.0175 873 GLU C CA 9743 C C . GLU C 565 ? 0.3409 0.1928 0.2243 -0.0049 0.0393 -0.0205 873 GLU C C 9744 O O . GLU C 565 ? 0.3720 0.2256 0.2661 -0.0108 0.0380 -0.0185 873 GLU C O 9745 C CB . GLU C 565 ? 0.3783 0.2512 0.2634 -0.0073 0.0315 -0.0228 873 GLU C CB 9746 C CG . GLU C 565 ? 0.3991 0.2655 0.2869 -0.0170 0.0227 -0.0275 873 GLU C CG 9747 C CD . GLU C 565 ? 0.3937 0.2651 0.2805 -0.0213 0.0135 -0.0313 873 GLU C CD 9748 O OE1 . GLU C 565 ? 0.3925 0.2695 0.2727 -0.0162 0.0145 -0.0309 873 GLU C OE1 9749 O OE2 . GLU C 565 ? 0.3549 0.2250 0.2490 -0.0298 0.0052 -0.0341 873 GLU C OE2 9750 N N . PRO C 566 ? 0.4036 0.2348 0.2679 0.0006 0.0414 -0.0248 874 PRO C N 9751 C CA . PRO C 566 ? 0.4025 0.2120 0.2595 -0.0016 0.0406 -0.0281 874 PRO C CA 9752 C C . PRO C 566 ? 0.4050 0.2149 0.2711 0.0014 0.0478 -0.0217 874 PRO C C 9753 O O . PRO C 566 ? 0.4220 0.2208 0.2905 -0.0038 0.0461 -0.0221 874 PRO C O 9754 C CB . PRO C 566 ? 0.4464 0.2328 0.2779 0.0061 0.0426 -0.0340 874 PRO C CB 9755 C CG . PRO C 566 ? 0.4889 0.2872 0.3183 0.0153 0.0498 -0.0301 874 PRO C CG 9756 C CD . PRO C 566 ? 0.4452 0.2695 0.2925 0.0094 0.0453 -0.0268 874 PRO C CD 9757 N N . ASN C 567 ? 0.3524 0.1747 0.2243 0.0095 0.0551 -0.0152 875 ASN C N 9758 C CA . ASN C 567 ? 0.3478 0.1716 0.2283 0.0128 0.0604 -0.0085 875 ASN C CA 9759 C C . ASN C 567 ? 0.3184 0.1553 0.2143 0.0049 0.0569 -0.0046 875 ASN C C 9760 O O . ASN C 567 ? 0.3323 0.1604 0.2304 0.0027 0.0582 -0.0022 875 ASN C O 9761 C CB . ASN C 567 ? 0.3193 0.1540 0.2045 0.0232 0.0675 -0.0022 875 ASN C CB 9762 C CG . ASN C 567 ? 0.3949 0.2130 0.2650 0.0333 0.0746 -0.0040 875 ASN C CG 9763 O OD1 . ASN C 567 ? 0.4486 0.2433 0.3040 0.0340 0.0753 -0.0089 875 ASN C OD1 9764 N ND2 . ASN C 567 ? 0.3389 0.1681 0.2124 0.0412 0.0801 0.0000 875 ASN C ND2 9765 N N . ILE C 568 ? 0.2763 0.1329 0.1817 0.0014 0.0534 -0.0035 876 ILE C N 9766 C CA . ILE C 568 ? 0.2991 0.1677 0.2168 -0.0054 0.0508 -0.0003 876 ILE C CA 9767 C C . ILE C 568 ? 0.3233 0.1811 0.2422 -0.0143 0.0474 -0.0034 876 ILE C C 9768 O O . ILE C 568 ? 0.3299 0.1870 0.2558 -0.0177 0.0493 0.0009 876 ILE C O 9769 C CB . ILE C 568 ? 0.2914 0.1795 0.2165 -0.0076 0.0471 -0.0004 876 ILE C CB 9770 C CG1 . ILE C 568 ? 0.3458 0.2456 0.2738 -0.0001 0.0496 0.0037 876 ILE C CG1 9771 C CG2 . ILE C 568 ? 0.2890 0.1872 0.2249 -0.0141 0.0454 0.0022 876 ILE C CG2 9772 C CD1 . ILE C 568 ? 0.3869 0.2917 0.3208 0.0030 0.0517 0.0103 876 ILE C CD1 9773 N N . GLN C 569 ? 0.3292 0.1776 0.2413 -0.0181 0.0422 -0.0104 877 GLN C N 9774 C CA . GLN C 569 ? 0.3625 0.2014 0.2789 -0.0278 0.0370 -0.0133 877 GLN C CA 9775 C C . GLN C 569 ? 0.3913 0.2094 0.3032 -0.0279 0.0403 -0.0124 877 GLN C C 9776 O O . GLN C 569 ? 0.4034 0.2187 0.3258 -0.0353 0.0397 -0.0098 877 GLN C O 9777 C CB . GLN C 569 ? 0.4297 0.2624 0.3392 -0.0321 0.0282 -0.0214 877 GLN C CB 9778 C CG . GLN C 569 ? 0.4782 0.3315 0.3965 -0.0348 0.0236 -0.0216 877 GLN C CG 9779 C CD . GLN C 569 ? 0.5345 0.4008 0.4732 -0.0440 0.0207 -0.0184 877 GLN C CD 9780 O OE1 . GLN C 569 ? 0.6004 0.4638 0.5483 -0.0476 0.0242 -0.0141 877 GLN C OE1 9781 N NE2 . GLN C 569 ? 0.5162 0.3966 0.4623 -0.0471 0.0150 -0.0197 877 GLN C NE2 9782 N N . GLN C 570 ? 0.3949 0.1983 0.2921 -0.0193 0.0445 -0.0139 878 GLN C N 9783 C CA . GLN C 570 ? 0.4462 0.2282 0.3379 -0.0180 0.0482 -0.0128 878 GLN C CA 9784 C C . GLN C 570 ? 0.4276 0.2174 0.3306 -0.0169 0.0543 -0.0034 878 GLN C C 9785 O O . GLN C 570 ? 0.4359 0.2145 0.3432 -0.0218 0.0553 -0.0008 878 GLN C O 9786 C CB . GLN C 570 ? 0.4933 0.2586 0.3669 -0.0070 0.0529 -0.0157 878 GLN C CB 9787 C CG . GLN C 570 ? 0.5586 0.2986 0.4249 -0.0051 0.0565 -0.0153 878 GLN C CG 9788 C CD . GLN C 570 ? 0.6463 0.3667 0.5105 -0.0160 0.0487 -0.0216 878 GLN C CD 9789 O OE1 . GLN C 570 ? 0.7164 0.4289 0.5702 -0.0180 0.0411 -0.0300 878 GLN C OE1 9790 N NE2 . GLN C 570 ? 0.6284 0.3480 0.5061 -0.0226 0.0490 -0.0164 878 GLN C NE2 9791 N N . TYR C 571 ? 0.3909 0.1990 0.2980 -0.0103 0.0580 0.0020 879 TYR C N 9792 C CA . TYR C 571 ? 0.3816 0.1968 0.2959 -0.0081 0.0626 0.0108 879 TYR C CA 9793 C C . TYR C 571 ? 0.3735 0.1974 0.2996 -0.0172 0.0614 0.0139 879 TYR C C 9794 O O . TYR C 571 ? 0.3961 0.2151 0.3254 -0.0181 0.0655 0.0203 879 TYR C O 9795 C CB . TYR C 571 ? 0.3530 0.1855 0.2690 0.0003 0.0643 0.0150 879 TYR C CB 9796 C CG . TYR C 571 ? 0.3921 0.2175 0.3008 0.0106 0.0679 0.0151 879 TYR C CG 9797 C CD1 . TYR C 571 ? 0.4591 0.2652 0.3612 0.0153 0.0724 0.0170 879 TYR C CD1 9798 C CD2 . TYR C 571 ? 0.3810 0.2187 0.2905 0.0160 0.0677 0.0143 879 TYR C CD2 9799 C CE1 . TYR C 571 ? 0.5129 0.3129 0.4095 0.0260 0.0771 0.0178 879 TYR C CE1 9800 C CE2 . TYR C 571 ? 0.4134 0.2460 0.3188 0.0260 0.0726 0.0157 879 TYR C CE2 9801 C CZ . TYR C 571 ? 0.4711 0.2852 0.3701 0.0314 0.0775 0.0175 879 TYR C CZ 9802 O OH . TYR C 571 ? 0.5023 0.3120 0.3985 0.0425 0.0836 0.0196 879 TYR C OH 9803 N N . ALA C 572 ? 0.3578 0.1944 0.2904 -0.0232 0.0564 0.0102 880 ALA C N 9804 C CA . ALA C 572 ? 0.3946 0.2402 0.3404 -0.0315 0.0560 0.0133 880 ALA C CA 9805 C C . ALA C 572 ? 0.4187 0.2480 0.3698 -0.0397 0.0555 0.0131 880 ALA C C 9806 O O . ALA C 572 ? 0.4139 0.2443 0.3750 -0.0438 0.0599 0.0199 880 ALA C O 9807 C CB . ALA C 572 ? 0.3708 0.2322 0.3232 -0.0357 0.0503 0.0089 880 ALA C CB 9808 N N . GLN C 573 ? 0.4392 0.2521 0.3830 -0.0419 0.0502 0.0056 881 GLN C N 9809 C CA . GLN C 573 ? 0.5267 0.3209 0.4749 -0.0505 0.0475 0.0041 881 GLN C CA 9810 C C . GLN C 573 ? 0.5347 0.3136 0.4797 -0.0472 0.0551 0.0105 881 GLN C C 9811 O O . GLN C 573 ? 0.5520 0.3254 0.5084 -0.0541 0.0561 0.0149 881 GLN C O 9812 C CB . GLN C 573 ? 0.6071 0.3838 0.5428 -0.0521 0.0389 -0.0066 881 GLN C CB 9813 C CG . GLN C 573 ? 0.7207 0.4752 0.6599 -0.0617 0.0335 -0.0097 881 GLN C CG 9814 C CD . GLN C 573 ? 0.8149 0.5539 0.7393 -0.0619 0.0228 -0.0212 881 GLN C CD 9815 O OE1 . GLN C 573 ? 0.8505 0.5702 0.7621 -0.0574 0.0219 -0.0250 881 GLN C OE1 9816 N NE2 . GLN C 573 ? 0.8327 0.5808 0.7580 -0.0662 0.0147 -0.0265 881 GLN C NE2 9817 N N . ASN C 574 ? 0.5239 0.2986 0.4554 -0.0359 0.0599 0.0118 882 ASN C N 9818 C CA . ASN C 574 ? 0.5512 0.3136 0.4789 -0.0307 0.0670 0.0188 882 ASN C CA 9819 C C . ASN C 574 ? 0.5396 0.3171 0.4780 -0.0313 0.0722 0.0290 882 ASN C C 9820 O O . ASN C 574 ? 0.5391 0.3114 0.4800 -0.0303 0.0756 0.0350 882 ASN C O 9821 C CB . ASN C 574 ? 0.5671 0.3261 0.4811 -0.0177 0.0705 0.0189 882 ASN C CB 9822 C CG . ASN C 574 ? 0.5940 0.3349 0.4945 -0.0143 0.0678 0.0100 882 ASN C CG 9823 O OD1 . ASN C 574 ? 0.5924 0.3228 0.4919 -0.0218 0.0613 0.0028 882 ASN C OD1 9824 N ND2 . ASN C 574 ? 0.6170 0.3562 0.5078 -0.0025 0.0720 0.0106 882 ASN C ND2 9825 N N . MET C 575 ? 0.5125 0.3103 0.4563 -0.0319 0.0722 0.0305 883 MET C N 9826 C CA . MET C 575 ? 0.5377 0.3482 0.4878 -0.0314 0.0777 0.0396 883 MET C CA 9827 C C . MET C 575 ? 0.5419 0.3589 0.5092 -0.0416 0.0774 0.0417 883 MET C C 9828 O O . MET C 575 ? 0.5418 0.3702 0.5149 -0.0408 0.0822 0.0489 883 MET C O 9829 C CB . MET C 575 ? 0.5368 0.3676 0.4842 -0.0259 0.0768 0.0397 883 MET C CB 9830 C CG . MET C 575 ? 0.5535 0.3847 0.4888 -0.0146 0.0768 0.0407 883 MET C CG 9831 S SD . MET C 575 ? 0.5965 0.4507 0.5311 -0.0103 0.0722 0.0381 883 MET C SD 9832 C CE . MET C 575 ? 0.5602 0.4119 0.4861 0.0013 0.0713 0.0398 883 MET C CE 9833 N N . GLY C 576 ? 0.5629 0.3725 0.5381 -0.0506 0.0712 0.0355 884 GLY C N 9834 C CA . GLY C 576 ? 0.5796 0.3956 0.5748 -0.0608 0.0694 0.0382 884 GLY C CA 9835 C C . GLY C 576 ? 0.5695 0.4028 0.5776 -0.0668 0.0657 0.0356 884 GLY C C 9836 O O . GLY C 576 ? 0.5659 0.4092 0.5931 -0.0742 0.0648 0.0394 884 GLY C O 9837 N N . LEU C 577 ? 0.5070 0.3456 0.5054 -0.0632 0.0629 0.0294 885 LEU C N 9838 C CA . LEU C 577 ? 0.4945 0.3516 0.5041 -0.0674 0.0573 0.0259 885 LEU C CA 9839 C C . LEU C 577 ? 0.5228 0.3723 0.5329 -0.0737 0.0453 0.0161 885 LEU C C 9840 O O . LEU C 577 ? 0.5559 0.3931 0.5483 -0.0690 0.0411 0.0090 885 LEU C O 9841 C CB . LEU C 577 ? 0.4534 0.3258 0.4526 -0.0583 0.0581 0.0246 885 LEU C CB 9842 C CG . LEU C 577 ? 0.4597 0.3415 0.4545 -0.0508 0.0671 0.0325 885 LEU C CG 9843 C CD1 . LEU C 577 ? 0.4562 0.3476 0.4389 -0.0427 0.0642 0.0285 885 LEU C CD1 9844 C CD2 . LEU C 577 ? 0.4679 0.3633 0.4791 -0.0549 0.0725 0.0390 885 LEU C CD2 9845 N N . PRO C 578 ? 0.5461 0.4028 0.5765 -0.0839 0.0396 0.0159 886 PRO C N 9846 C CA . PRO C 578 ? 0.5679 0.4185 0.5978 -0.0898 0.0260 0.0061 886 PRO C CA 9847 C C . PRO C 578 ? 0.5534 0.4152 0.5709 -0.0833 0.0214 0.0000 886 PRO C C 9848 O O . PRO C 578 ? 0.4960 0.3747 0.5132 -0.0769 0.0278 0.0039 886 PRO C O 9849 C CB . PRO C 578 ? 0.6123 0.4737 0.6718 -0.1017 0.0217 0.0100 886 PRO C CB 9850 C CG . PRO C 578 ? 0.6097 0.4896 0.6826 -0.0987 0.0344 0.0216 886 PRO C CG 9851 C CD . PRO C 578 ? 0.5767 0.4456 0.6312 -0.0899 0.0450 0.0253 886 PRO C CD 9852 N N . GLN C 579 ? 0.5830 0.4337 0.5892 -0.0847 0.0103 -0.0094 887 GLN C N 9853 C CA . GLN C 579 ? 0.5818 0.4391 0.5732 -0.0780 0.0064 -0.0151 887 GLN C CA 9854 C C . GLN C 579 ? 0.4875 0.3705 0.4943 -0.0789 0.0056 -0.0121 887 GLN C C 9855 O O . GLN C 579 ? 0.4870 0.3802 0.4846 -0.0715 0.0074 -0.0130 887 GLN C O 9856 C CB . GLN C 579 ? 0.6874 0.5264 0.6640 -0.0804 -0.0060 -0.0254 887 GLN C CB 9857 C CG . GLN C 579 ? 0.7746 0.6166 0.7324 -0.0725 -0.0089 -0.0308 887 GLN C CG 9858 C CD . GLN C 579 ? 0.8793 0.6995 0.8174 -0.0735 -0.0204 -0.0408 887 GLN C CD 9859 O OE1 . GLN C 579 ? 0.9233 0.7248 0.8613 -0.0805 -0.0275 -0.0446 887 GLN C OE1 9860 N NE2 . GLN C 579 ? 0.9212 0.7422 0.8413 -0.0663 -0.0225 -0.0450 887 GLN C NE2 9861 N N . ASN C 580 ? 0.4407 0.3341 0.4725 -0.0877 0.0035 -0.0078 888 ASN C N 9862 C CA . ASN C 580 ? 0.4570 0.3739 0.5058 -0.0887 0.0024 -0.0048 888 ASN C CA 9863 C C . ASN C 580 ? 0.3817 0.3152 0.4353 -0.0823 0.0153 0.0032 888 ASN C C 9864 O O . ASN C 580 ? 0.4295 0.3814 0.4959 -0.0818 0.0159 0.0059 888 ASN C O 9865 C CB . ASN C 580 ? 0.5225 0.4454 0.5991 -0.1003 -0.0052 -0.0026 888 ASN C CB 9866 C CG . ASN C 580 ? 0.5724 0.4971 0.6692 -0.1053 0.0046 0.0068 888 ASN C CG 9867 O OD1 . ASN C 580 ? 0.5792 0.4934 0.6652 -0.1013 0.0143 0.0101 888 ASN C OD1 9868 N ND2 . ASN C 580 ? 0.6260 0.5653 0.7495 -0.1122 0.0024 0.0118 888 ASN C ND2 9869 N N . ARG C 581 ? 0.3345 0.2604 0.3769 -0.0768 0.0252 0.0068 889 ARG C N 9870 C CA . ARG C 581 ? 0.3094 0.2477 0.3518 -0.0700 0.0361 0.0136 889 ARG C CA 9871 C C . ARG C 581 ? 0.2907 0.2326 0.3150 -0.0610 0.0356 0.0098 889 ARG C C 9872 O O . ARG C 581 ? 0.2628 0.2151 0.2853 -0.0552 0.0415 0.0134 889 ARG C O 9873 C CB . ARG C 581 ? 0.3172 0.2459 0.3561 -0.0680 0.0462 0.0203 889 ARG C CB 9874 C CG . ARG C 581 ? 0.3354 0.2585 0.3927 -0.0770 0.0486 0.0257 889 ARG C CG 9875 C CD . ARG C 581 ? 0.3353 0.2764 0.4183 -0.0817 0.0522 0.0323 889 ARG C CD 9876 N NE . ARG C 581 ? 0.3007 0.2548 0.3802 -0.0735 0.0625 0.0380 889 ARG C NE 9877 C CZ . ARG C 581 ? 0.3449 0.2980 0.4189 -0.0679 0.0730 0.0457 889 ARG C CZ 9878 N NH1 . ARG C 581 ? 0.3400 0.2812 0.4132 -0.0698 0.0752 0.0493 889 ARG C NH1 9879 N NH2 . ARG C 581 ? 0.3465 0.3097 0.4134 -0.0595 0.0799 0.0489 889 ARG C NH2 9880 N N . ILE C 582 ? 0.3092 0.2415 0.3196 -0.0595 0.0287 0.0026 890 ILE C N 9881 C CA . ILE C 582 ? 0.3220 0.2579 0.3180 -0.0515 0.0284 -0.0001 890 ILE C CA 9882 C C . ILE C 582 ? 0.3133 0.2510 0.3064 -0.0528 0.0192 -0.0065 890 ILE C C 9883 O O . ILE C 582 ? 0.3325 0.2575 0.3200 -0.0563 0.0126 -0.0117 890 ILE C O 9884 C CB . ILE C 582 ? 0.3298 0.2520 0.3090 -0.0453 0.0319 -0.0008 890 ILE C CB 9885 C CG1 . ILE C 582 ? 0.3382 0.2565 0.3186 -0.0436 0.0400 0.0058 890 ILE C CG1 9886 C CG2 . ILE C 582 ? 0.3564 0.2852 0.3258 -0.0375 0.0323 -0.0020 890 ILE C CG2 9887 C CD1 . ILE C 582 ? 0.3761 0.2829 0.3422 -0.0365 0.0433 0.0063 890 ILE C CD1 9888 N N . ILE C 583 ? 0.2536 0.2056 0.2491 -0.0498 0.0185 -0.0062 891 ILE C N 9889 C CA . ILE C 583 ? 0.2564 0.2112 0.2489 -0.0503 0.0101 -0.0111 891 ILE C CA 9890 C C . ILE C 583 ? 0.2487 0.2039 0.2265 -0.0424 0.0117 -0.0125 891 ILE C C 9891 O O . ILE C 583 ? 0.2354 0.1992 0.2143 -0.0379 0.0170 -0.0090 891 ILE C O 9892 C CB . ILE C 583 ? 0.2532 0.2249 0.2635 -0.0535 0.0075 -0.0088 891 ILE C CB 9893 C CG1 . ILE C 583 ? 0.2904 0.2632 0.3196 -0.0620 0.0054 -0.0065 891 ILE C CG1 9894 C CG2 . ILE C 583 ? 0.2392 0.2145 0.2450 -0.0524 -0.0010 -0.0130 891 ILE C CG2 9895 C CD1 . ILE C 583 ? 0.3110 0.3018 0.3618 -0.0647 0.0045 -0.0028 891 ILE C CD1 9896 N N . PHE C 584 ? 0.2319 0.1767 0.1956 -0.0406 0.0071 -0.0174 892 PHE C N 9897 C CA . PHE C 584 ? 0.2809 0.2260 0.2324 -0.0333 0.0097 -0.0176 892 PHE C CA 9898 C C . PHE C 584 ? 0.2810 0.2339 0.2319 -0.0326 0.0040 -0.0192 892 PHE C C 9899 O O . PHE C 584 ? 0.2886 0.2393 0.2399 -0.0368 -0.0041 -0.0226 892 PHE C O 9900 C CB . PHE C 584 ? 0.2600 0.1875 0.1938 -0.0291 0.0116 -0.0205 892 PHE C CB 9901 C CG . PHE C 584 ? 0.2646 0.1874 0.1980 -0.0259 0.0194 -0.0171 892 PHE C CG 9902 C CD1 . PHE C 584 ? 0.2489 0.1764 0.1802 -0.0189 0.0255 -0.0135 892 PHE C CD1 9903 C CD2 . PHE C 584 ? 0.2999 0.2137 0.2364 -0.0300 0.0201 -0.0170 892 PHE C CD2 9904 C CE1 . PHE C 584 ? 0.2840 0.2078 0.2158 -0.0155 0.0313 -0.0099 892 PHE C CE1 9905 C CE2 . PHE C 584 ? 0.2923 0.2011 0.2276 -0.0263 0.0270 -0.0133 892 PHE C CE2 9906 C CZ . PHE C 584 ? 0.2751 0.1893 0.2078 -0.0189 0.0322 -0.0098 892 PHE C CZ 9907 N N . SER C 585 ? 0.2373 0.1988 0.1878 -0.0276 0.0076 -0.0165 893 SER C N 9908 C CA . SER C 585 ? 0.2076 0.1743 0.1552 -0.0257 0.0035 -0.0172 893 SER C CA 9909 C C . SER C 585 ? 0.2153 0.1770 0.1501 -0.0188 0.0081 -0.0161 893 SER C C 9910 O O . SER C 585 ? 0.2189 0.1788 0.1530 -0.0155 0.0147 -0.0136 893 SER C O 9911 C CB . SER C 585 ? 0.1897 0.1723 0.1517 -0.0263 0.0037 -0.0140 893 SER C CB 9912 O OG . SER C 585 ? 0.2473 0.2360 0.2225 -0.0318 -0.0001 -0.0141 893 SER C OG 9913 N N . PRO C 586 ? 0.2388 0.1984 0.1642 -0.0164 0.0048 -0.0173 894 PRO C N 9914 C CA . PRO C 586 ? 0.2406 0.1975 0.1565 -0.0096 0.0107 -0.0146 894 PRO C CA 9915 C C . PRO C 586 ? 0.2384 0.2088 0.1681 -0.0083 0.0146 -0.0094 894 PRO C C 9916 O O . PRO C 586 ? 0.2362 0.2168 0.1782 -0.0117 0.0116 -0.0089 894 PRO C O 9917 C CB . PRO C 586 ? 0.3137 0.2665 0.2176 -0.0080 0.0053 -0.0163 894 PRO C CB 9918 C CG . PRO C 586 ? 0.2904 0.2401 0.1946 -0.0138 -0.0047 -0.0212 894 PRO C CG 9919 C CD . PRO C 586 ? 0.2647 0.2241 0.1883 -0.0196 -0.0046 -0.0204 894 PRO C CD 9920 N N . VAL C 587 ? 0.2231 0.1929 0.1510 -0.0032 0.0213 -0.0055 895 VAL C N 9921 C CA . VAL C 587 ? 0.1999 0.1806 0.1399 -0.0021 0.0234 -0.0006 895 VAL C CA 9922 C C . VAL C 587 ? 0.1884 0.1728 0.1274 -0.0023 0.0194 -0.0004 895 VAL C C 9923 O O . VAL C 587 ? 0.2077 0.1849 0.1336 -0.0003 0.0181 -0.0018 895 VAL C O 9924 C CB . VAL C 587 ? 0.1776 0.1571 0.1180 0.0033 0.0311 0.0045 895 VAL C CB 9925 C CG1 . VAL C 587 ? 0.1370 0.1270 0.0913 0.0035 0.0316 0.0097 895 VAL C CG1 9926 C CG2 . VAL C 587 ? 0.2055 0.1819 0.1482 0.0041 0.0345 0.0048 895 VAL C CG2 9927 N N . ALA C 588 ? 0.1965 0.1906 0.1477 -0.0043 0.0171 0.0011 896 ALA C N 9928 C CA . ALA C 588 ? 0.2064 0.2041 0.1583 -0.0043 0.0131 0.0016 896 ALA C CA 9929 C C . ALA C 588 ? 0.1951 0.1967 0.1534 -0.0019 0.0160 0.0068 896 ALA C C 9930 O O . ALA C 588 ? 0.1801 0.1844 0.1468 -0.0019 0.0189 0.0094 896 ALA C O 9931 C CB . ALA C 588 ? 0.2122 0.2167 0.1732 -0.0080 0.0081 -0.0009 896 ALA C CB 9932 N N . PRO C 589 ? 0.1950 0.1965 0.1503 -0.0003 0.0144 0.0086 897 PRO C N 9933 C CA . PRO C 589 ? 0.2097 0.2150 0.1740 0.0007 0.0159 0.0136 897 PRO C CA 9934 C C . PRO C 589 ? 0.2065 0.2175 0.1836 -0.0023 0.0130 0.0123 897 PRO C C 9935 O O . PRO C 589 ? 0.1786 0.1915 0.1562 -0.0043 0.0098 0.0080 897 PRO C O 9936 C CB . PRO C 589 ? 0.2243 0.2286 0.1830 0.0022 0.0124 0.0142 897 PRO C CB 9937 C CG . PRO C 589 ? 0.2479 0.2460 0.1913 0.0034 0.0103 0.0109 897 PRO C CG 9938 C CD . PRO C 589 ? 0.2005 0.1983 0.1448 0.0004 0.0096 0.0062 897 PRO C CD 9939 N N . LYS C 590 ? 0.1690 0.1817 0.1557 -0.0024 0.0140 0.0161 898 LYS C N 9940 C CA . LYS C 590 ? 0.1714 0.1863 0.1670 -0.0047 0.0106 0.0147 898 LYS C CA 9941 C C . LYS C 590 ? 0.1865 0.2021 0.1810 -0.0053 0.0064 0.0104 898 LYS C C 9942 O O . LYS C 590 ? 0.1601 0.1762 0.1542 -0.0062 0.0053 0.0070 898 LYS C O 9943 C CB . LYS C 590 ? 0.1853 0.2004 0.1917 -0.0052 0.0102 0.0196 898 LYS C CB 9944 C CG . LYS C 590 ? 0.2028 0.2174 0.2164 -0.0074 0.0048 0.0177 898 LYS C CG 9945 C CD . LYS C 590 ? 0.2299 0.2460 0.2480 -0.0083 0.0048 0.0185 898 LYS C CD 9946 C CE . LYS C 590 ? 0.2228 0.2364 0.2455 -0.0102 -0.0024 0.0165 898 LYS C CE 9947 N NZ . LYS C 590 ? 0.1746 0.1904 0.2044 -0.0109 -0.0039 0.0189 898 LYS C NZ 9948 N N . GLU C 591 ? 0.1942 0.2096 0.1882 -0.0040 0.0048 0.0112 899 GLU C N 9949 C CA . GLU C 591 ? 0.1455 0.1622 0.1402 -0.0034 0.0019 0.0080 899 GLU C CA 9950 C C . GLU C 591 ? 0.1526 0.1729 0.1447 -0.0041 0.0019 0.0046 899 GLU C C 9951 O O . GLU C 591 ? 0.1620 0.1840 0.1565 -0.0039 0.0018 0.0023 899 GLU C O 9952 C CB . GLU C 591 ? 0.1964 0.2124 0.1915 -0.0012 0.0003 0.0103 899 GLU C CB 9953 C CG . GLU C 591 ? 0.2109 0.2279 0.2088 0.0007 -0.0020 0.0080 899 GLU C CG 9954 C CD . GLU C 591 ? 0.2382 0.2613 0.2361 0.0014 -0.0030 0.0063 899 GLU C CD 9955 O OE1 . GLU C 591 ? 0.2160 0.2406 0.2098 0.0005 -0.0040 0.0069 899 GLU C OE1 9956 O OE2 . GLU C 591 ? 0.2043 0.2303 0.2065 0.0030 -0.0030 0.0045 899 GLU C OE2 9957 N N . GLU C 592 ? 0.1306 0.1511 0.1177 -0.0047 0.0022 0.0046 900 GLU C N 9958 C CA . GLU C 592 ? 0.1534 0.1766 0.1401 -0.0065 0.0010 0.0016 900 GLU C CA 9959 C C . GLU C 592 ? 0.1985 0.2211 0.1862 -0.0084 0.0038 0.0000 900 GLU C C 9960 O O . GLU C 592 ? 0.1478 0.1737 0.1396 -0.0096 0.0041 -0.0015 900 GLU C O 9961 C CB . GLU C 592 ? 0.1698 0.1901 0.1483 -0.0068 -0.0010 0.0012 900 GLU C CB 9962 C CG . GLU C 592 ? 0.1821 0.2037 0.1616 -0.0100 -0.0037 -0.0021 900 GLU C CG 9963 C CD . GLU C 592 ? 0.2115 0.2257 0.1789 -0.0104 -0.0064 -0.0037 900 GLU C CD 9964 O OE1 . GLU C 592 ? 0.1829 0.1920 0.1400 -0.0072 -0.0064 -0.0020 900 GLU C OE1 9965 O OE2 . GLU C 592 ? 0.2029 0.2150 0.1700 -0.0137 -0.0083 -0.0066 900 GLU C OE2 9966 N N . HIS C 593 ? 0.1852 0.2041 0.1702 -0.0082 0.0063 0.0013 901 HIS C N 9967 C CA . HIS C 593 ? 0.1934 0.2109 0.1785 -0.0092 0.0085 0.0006 901 HIS C CA 9968 C C . HIS C 593 ? 0.1927 0.2113 0.1808 -0.0086 0.0082 -0.0003 901 HIS C C 9969 O O . HIS C 593 ? 0.1511 0.1698 0.1385 -0.0092 0.0100 -0.0014 901 HIS C O 9970 C CB . HIS C 593 ? 0.1903 0.2049 0.1747 -0.0083 0.0105 0.0032 901 HIS C CB 9971 C CG . HIS C 593 ? 0.1573 0.1710 0.1439 -0.0083 0.0107 0.0036 901 HIS C CG 9972 N ND1 . HIS C 593 ? 0.1446 0.1565 0.1284 -0.0090 0.0125 0.0024 901 HIS C ND1 9973 C CD2 . HIS C 593 ? 0.1715 0.1850 0.1627 -0.0078 0.0085 0.0054 901 HIS C CD2 9974 C CE1 . HIS C 593 ? 0.1534 0.1640 0.1382 -0.0082 0.0114 0.0035 901 HIS C CE1 9975 N NE2 . HIS C 593 ? 0.1607 0.1724 0.1503 -0.0077 0.0083 0.0050 901 HIS C NE2 9976 N N . VAL C 594 ? 0.1765 0.1943 0.1663 -0.0071 0.0061 0.0003 902 VAL C N 9977 C CA . VAL C 594 ? 0.1674 0.1829 0.1559 -0.0054 0.0056 -0.0013 902 VAL C CA 9978 C C . VAL C 594 ? 0.1930 0.2123 0.1832 -0.0041 0.0076 -0.0025 902 VAL C C 9979 O O . VAL C 594 ? 0.2037 0.2223 0.1918 -0.0030 0.0107 -0.0032 902 VAL C O 9980 C CB . VAL C 594 ? 0.1668 0.1780 0.1563 -0.0042 0.0019 -0.0009 902 VAL C CB 9981 C CG1 . VAL C 594 ? 0.1638 0.1691 0.1476 -0.0016 0.0008 -0.0036 902 VAL C CG1 9982 C CG2 . VAL C 594 ? 0.1713 0.1809 0.1638 -0.0060 -0.0001 0.0015 902 VAL C CG2 9983 N N . ARG C 595 ? 0.1763 0.1998 0.1710 -0.0039 0.0063 -0.0018 903 ARG C N 9984 C CA . ARG C 595 ? 0.1762 0.2055 0.1766 -0.0025 0.0075 -0.0019 903 ARG C CA 9985 C C . ARG C 595 ? 0.1638 0.1977 0.1683 -0.0051 0.0102 -0.0019 903 ARG C C 9986 O O . ARG C 595 ? 0.1462 0.1835 0.1553 -0.0035 0.0141 -0.0012 903 ARG C O 9987 C CB . ARG C 595 ? 0.1563 0.1892 0.1609 -0.0019 0.0039 -0.0007 903 ARG C CB 9988 C CG . ARG C 595 ? 0.1862 0.2271 0.2002 -0.0004 0.0038 0.0001 903 ARG C CG 9989 C CD . ARG C 595 ? 0.1682 0.2110 0.1846 0.0017 -0.0006 0.0017 903 ARG C CD 9990 N NE . ARG C 595 ? 0.1376 0.1767 0.1469 -0.0003 -0.0042 0.0023 903 ARG C NE 9991 C CZ . ARG C 595 ? 0.1527 0.1928 0.1595 -0.0033 -0.0070 0.0017 903 ARG C CZ 9992 N NH1 . ARG C 595 ? 0.1660 0.2116 0.1798 -0.0061 -0.0077 0.0006 903 ARG C NH1 9993 N NH2 . ARG C 595 ? 0.1470 0.1815 0.1441 -0.0034 -0.0088 0.0024 903 ARG C NH2 9994 N N . ARG C 596 ? 0.1870 0.2199 0.1896 -0.0087 0.0089 -0.0021 904 ARG C N 9995 C CA . ARG C 596 ? 0.1887 0.2244 0.1960 -0.0120 0.0104 -0.0021 904 ARG C CA 9996 C C . ARG C 596 ? 0.1717 0.2045 0.1766 -0.0117 0.0160 -0.0015 904 ARG C C 9997 O O . ARG C 596 ? 0.1508 0.1861 0.1616 -0.0140 0.0187 -0.0003 904 ARG C O 9998 C CB . ARG C 596 ? 0.1994 0.2320 0.2032 -0.0155 0.0068 -0.0033 904 ARG C CB 9999 C CG . ARG C 596 ? 0.2261 0.2511 0.2206 -0.0156 0.0087 -0.0037 904 ARG C CG 10000 C CD . ARG C 596 ? 0.2134 0.2333 0.2016 -0.0174 0.0058 -0.0052 904 ARG C CD 10001 N NE . ARG C 596 ? 0.2087 0.2216 0.1887 -0.0160 0.0087 -0.0047 904 ARG C NE 10002 C CZ . ARG C 596 ? 0.2238 0.2296 0.1952 -0.0158 0.0084 -0.0058 904 ARG C CZ 10003 N NH1 . ARG C 596 ? 0.2209 0.2240 0.1882 -0.0174 0.0037 -0.0082 904 ARG C NH1 10004 N NH2 . ARG C 596 ? 0.2021 0.2029 0.1684 -0.0134 0.0123 -0.0045 904 ARG C NH2 10005 N N . GLY C 597 ? 0.1817 0.2087 0.1782 -0.0088 0.0171 -0.0018 905 GLY C N 10006 C CA . GLY C 597 ? 0.1595 0.1824 0.1508 -0.0073 0.0218 -0.0010 905 GLY C CA 10007 C C . GLY C 597 ? 0.1615 0.1879 0.1568 -0.0044 0.0273 0.0005 905 GLY C C 10008 O O . GLY C 597 ? 0.1363 0.1606 0.1290 -0.0034 0.0330 0.0024 905 GLY C O 10009 N N . GLN C 598 ? 0.1666 0.1983 0.1684 -0.0024 0.0264 0.0004 906 GLN C N 10010 C CA . GLN C 598 ? 0.1677 0.2039 0.1757 0.0014 0.0329 0.0026 906 GLN C CA 10011 C C . GLN C 598 ? 0.1851 0.2294 0.2068 -0.0023 0.0372 0.0061 906 GLN C C 10012 O O . GLN C 598 ? 0.1587 0.2068 0.1863 0.0008 0.0451 0.0095 906 GLN C O 10013 C CB . GLN C 598 ? 0.1937 0.2351 0.2089 0.0042 0.0305 0.0024 906 GLN C CB 10014 C CG . GLN C 598 ? 0.1458 0.1781 0.1490 0.0084 0.0276 -0.0003 906 GLN C CG 10015 C CD . GLN C 598 ? 0.1181 0.1547 0.1288 0.0113 0.0255 0.0000 906 GLN C CD 10016 O OE1 . GLN C 598 ? 0.1822 0.2167 0.1916 0.0176 0.0298 0.0003 906 GLN C OE1 10017 N NE2 . GLN C 598 ? 0.1314 0.1728 0.1484 0.0076 0.0191 0.0003 906 GLN C NE2 10018 N N . LEU C 599 ? 0.2005 0.2469 0.2277 -0.0087 0.0322 0.0055 907 LEU C N 10019 C CA . LEU C 599 ? 0.1638 0.2172 0.2063 -0.0137 0.0338 0.0084 907 LEU C CA 10020 C C . LEU C 599 ? 0.1523 0.2002 0.1909 -0.0150 0.0404 0.0108 907 LEU C C 10021 O O . LEU C 599 ? 0.1659 0.2191 0.2184 -0.0182 0.0448 0.0147 907 LEU C O 10022 C CB . LEU C 599 ? 0.1591 0.2138 0.2063 -0.0198 0.0246 0.0061 907 LEU C CB 10023 C CG . LEU C 599 ? 0.1710 0.2306 0.2216 -0.0189 0.0171 0.0044 907 LEU C CG 10024 C CD1 . LEU C 599 ? 0.1939 0.2500 0.2416 -0.0239 0.0083 0.0015 907 LEU C CD1 10025 C CD2 . LEU C 599 ? 0.1271 0.1992 0.1967 -0.0175 0.0183 0.0080 907 LEU C CD2 10026 N N . ALA C 600 ? 0.1330 0.1705 0.1543 -0.0128 0.0407 0.0089 908 ALA C N 10027 C CA . ALA C 600 ? 0.1530 0.1838 0.1681 -0.0131 0.0466 0.0115 908 ALA C CA 10028 C C . ALA C 600 ? 0.2101 0.2401 0.2214 -0.0070 0.0566 0.0155 908 ALA C C 10029 O O . ALA C 600 ? 0.2253 0.2564 0.2331 -0.0015 0.0581 0.0147 908 ALA C O 10030 C CB . ALA C 600 ? 0.1586 0.1793 0.1576 -0.0122 0.0428 0.0088 908 ALA C CB 10031 N N . ASP C 601 ? 0.1832 0.2096 0.1938 -0.0075 0.0640 0.0199 909 ASP C N 10032 C CA . ASP C 601 ? 0.1627 0.1848 0.1638 -0.0004 0.0747 0.0241 909 ASP C CA 10033 C C . ASP C 601 ? 0.2063 0.2142 0.1816 0.0049 0.0730 0.0218 909 ASP C C 10034 O O . ASP C 601 ? 0.2075 0.2089 0.1674 0.0124 0.0760 0.0212 909 ASP C O 10035 C CB . ASP C 601 ? 0.1563 0.1809 0.1690 -0.0028 0.0848 0.0315 909 ASP C CB 10036 C CG . ASP C 601 ? 0.2136 0.2532 0.2547 -0.0076 0.0867 0.0349 909 ASP C CG 10037 O OD1 . ASP C 601 ? 0.2185 0.2622 0.2752 -0.0163 0.0811 0.0348 909 ASP C OD1 10038 O OD2 . ASP C 601 ? 0.2469 0.2935 0.2944 -0.0024 0.0924 0.0373 909 ASP C OD2 10039 N N . VAL C 602 ? 0.2195 0.2220 0.1900 0.0012 0.0676 0.0206 910 VAL C N 10040 C CA . VAL C 602 ? 0.2391 0.2293 0.1887 0.0054 0.0655 0.0199 910 VAL C CA 10041 C C . VAL C 602 ? 0.2322 0.2211 0.1826 0.0012 0.0559 0.0165 910 VAL C C 10042 O O . VAL C 602 ? 0.2598 0.2525 0.2223 -0.0047 0.0549 0.0168 910 VAL C O 10043 C CB . VAL C 602 ? 0.2288 0.2120 0.1718 0.0071 0.0744 0.0262 910 VAL C CB 10044 C CG1 . VAL C 602 ? 0.1899 0.1603 0.1109 0.0118 0.0704 0.0257 910 VAL C CG1 10045 C CG2 . VAL C 602 ? 0.2422 0.2269 0.1859 0.0119 0.0853 0.0308 910 VAL C CG2 10046 N N . CYS C 603 ? 0.2051 0.1882 0.1430 0.0044 0.0488 0.0136 911 CYS C N 10047 C CA . CYS C 603 ? 0.2100 0.1917 0.1488 0.0019 0.0415 0.0120 911 CYS C CA 10048 C C . CYS C 603 ? 0.2099 0.1825 0.1374 0.0045 0.0423 0.0152 911 CYS C C 10049 O O . CYS C 603 ? 0.2633 0.2283 0.1756 0.0099 0.0431 0.0165 911 CYS C O 10050 C CB . CYS C 603 ? 0.2849 0.2672 0.2214 0.0032 0.0327 0.0081 911 CYS C CB 10051 S SG . CYS C 603 ? 0.3297 0.3116 0.2696 0.0014 0.0251 0.0079 911 CYS C SG 10052 N N . LEU C 604 ? 0.2235 0.1957 0.1569 0.0014 0.0420 0.0166 912 LEU C N 10053 C CA . LEU C 604 ? 0.2129 0.1766 0.1368 0.0043 0.0421 0.0201 912 LEU C CA 10054 C C . LEU C 604 ? 0.2451 0.2091 0.1699 0.0052 0.0335 0.0186 912 LEU C C 10055 O O . LEU C 604 ? 0.2542 0.2214 0.1889 0.0023 0.0325 0.0178 912 LEU C O 10056 C CB . LEU C 604 ? 0.2388 0.1998 0.1687 0.0009 0.0487 0.0235 912 LEU C CB 10057 C CG . LEU C 604 ? 0.2619 0.2240 0.1968 -0.0013 0.0577 0.0264 912 LEU C CG 10058 C CD1 . LEU C 604 ? 0.2886 0.2468 0.2316 -0.0060 0.0622 0.0294 912 LEU C CD1 10059 C CD2 . LEU C 604 ? 0.2226 0.1790 0.1428 0.0049 0.0634 0.0304 912 LEU C CD2 10060 N N . ASP C 605 ? 0.2604 0.2205 0.1749 0.0096 0.0271 0.0186 913 ASP C N 10061 C CA . ASP C 605 ? 0.2649 0.2273 0.1842 0.0102 0.0181 0.0180 913 ASP C CA 10062 C C . ASP C 605 ? 0.2321 0.1918 0.1535 0.0117 0.0183 0.0221 913 ASP C C 10063 O O . ASP C 605 ? 0.2771 0.2293 0.1894 0.0140 0.0226 0.0256 913 ASP C O 10064 C CB . ASP C 605 ? 0.2836 0.2414 0.1918 0.0139 0.0093 0.0166 913 ASP C CB 10065 C CG . ASP C 605 ? 0.3248 0.2867 0.2425 0.0135 -0.0011 0.0168 913 ASP C CG 10066 O OD1 . ASP C 605 ? 0.2621 0.2327 0.1955 0.0100 -0.0012 0.0159 913 ASP C OD1 10067 O OD2 . ASP C 605 ? 0.3227 0.2789 0.2325 0.0169 -0.0092 0.0183 913 ASP C OD2 10068 N N . THR C 606 ? 0.2254 0.1813 0.2041 -0.0052 0.0183 0.0384 914 THR C N 10069 C CA . THR C 606 ? 0.2210 0.1726 0.2041 -0.0023 0.0199 0.0410 914 THR C CA 10070 C C . THR C 606 ? 0.2214 0.1761 0.2013 0.0016 0.0180 0.0480 914 THR C C 10071 O O . THR C 606 ? 0.2532 0.2140 0.2301 0.0024 0.0140 0.0473 914 THR C O 10072 C CB . THR C 606 ? 0.2265 0.1774 0.2108 -0.0015 0.0195 0.0350 914 THR C CB 10073 O OG1 . THR C 606 ? 0.2275 0.1848 0.2058 -0.0020 0.0166 0.0329 914 THR C OG1 10074 C CG2 . THR C 606 ? 0.1882 0.1325 0.1749 -0.0040 0.0203 0.0280 914 THR C CG2 10075 N N . PRO C 607 ? 0.2029 0.1530 0.1844 0.0041 0.0204 0.0551 915 PRO C N 10076 C CA . PRO C 607 ? 0.2506 0.2032 0.2272 0.0085 0.0167 0.0624 915 PRO C CA 10077 C C . PRO C 607 ? 0.2580 0.2142 0.2429 0.0117 0.0132 0.0626 915 PRO C C 10078 O O . PRO C 607 ? 0.2431 0.2053 0.2256 0.0141 0.0068 0.0654 915 PRO C O 10079 C CB . PRO C 607 ? 0.2839 0.2286 0.2613 0.0109 0.0214 0.0709 915 PRO C CB 10080 C CG . PRO C 607 ? 0.2890 0.2291 0.2704 0.0064 0.0277 0.0680 915 PRO C CG 10081 C CD . PRO C 607 ? 0.2458 0.1879 0.2335 0.0027 0.0262 0.0576 915 PRO C CD 10082 N N . LEU C 608 ? 0.2565 0.2092 0.2518 0.0119 0.0174 0.0592 916 LEU C N 10083 C CA . LEU C 608 ? 0.2441 0.2000 0.2500 0.0157 0.0167 0.0600 916 LEU C CA 10084 C C . LEU C 608 ? 0.2463 0.2118 0.2524 0.0146 0.0126 0.0568 916 LEU C C 10085 O O . LEU C 608 ? 0.2348 0.2072 0.2483 0.0172 0.0077 0.0605 916 LEU C O 10086 C CB . LEU C 608 ? 0.2050 0.1535 0.2191 0.0164 0.0237 0.0553 916 LEU C CB 10087 C CG . LEU C 608 ? 0.2466 0.1975 0.2734 0.0213 0.0259 0.0562 916 LEU C CG 10088 C CD1 . LEU C 608 ? 0.2316 0.1830 0.2685 0.0265 0.0234 0.0658 916 LEU C CD1 10089 C CD2 . LEU C 608 ? 0.2334 0.1755 0.2629 0.0220 0.0338 0.0488 916 LEU C CD2 10090 N N . CYS C 609 ? 0.2334 0.1993 0.2336 0.0107 0.0144 0.0502 917 CYS C N 10091 C CA . CYS C 609 ? 0.1950 0.1683 0.1949 0.0089 0.0115 0.0477 917 CYS C CA 10092 C C . CYS C 609 ? 0.1926 0.1642 0.1810 0.0048 0.0113 0.0434 917 CYS C C 10093 O O . CYS C 609 ? 0.2024 0.1685 0.1875 0.0034 0.0150 0.0394 917 CYS C O 10094 C CB . CYS C 609 ? 0.1900 0.1644 0.1979 0.0103 0.0170 0.0452 917 CYS C CB 10095 S SG . CYS C 609 ? 0.2668 0.2486 0.2759 0.0077 0.0160 0.0433 917 CYS C SG 10096 N N . ASN C 610 ? 0.1898 0.1656 0.1728 0.0031 0.0062 0.0436 918 ASN C N 10097 C CA . ASN C 610 ? 0.2049 0.1794 0.1791 -0.0001 0.0064 0.0402 918 ASN C CA 10098 C C . ASN C 610 ? 0.2214 0.1968 0.1957 -0.0021 0.0080 0.0357 918 ASN C C 10099 O O . ASN C 610 ? 0.2088 0.1864 0.1885 -0.0011 0.0094 0.0357 918 ASN C O 10100 C CB . ASN C 610 ? 0.2220 0.1994 0.1895 -0.0006 0.0014 0.0407 918 ASN C CB 10101 C CG . ASN C 610 ? 0.2625 0.2385 0.2245 0.0023 -0.0012 0.0458 918 ASN C CG 10102 O OD1 . ASN C 610 ? 0.2783 0.2563 0.2334 0.0032 -0.0069 0.0458 918 ASN C OD1 10103 N ND2 . ASN C 610 ? 0.2260 0.1973 0.1897 0.0042 0.0027 0.0501 918 ASN C ND2 10104 N N . GLY C 611 ? 0.2224 0.1964 0.1913 -0.0045 0.0081 0.0328 919 GLY C N 10105 C CA . GLY C 611 ? 0.2210 0.1964 0.1881 -0.0058 0.0076 0.0300 919 GLY C CA 10106 C C . GLY C 611 ? 0.2157 0.1957 0.1852 -0.0062 0.0045 0.0311 919 GLY C C 10107 O O . GLY C 611 ? 0.1954 0.1765 0.1627 -0.0063 0.0014 0.0316 919 GLY C O 10108 N N . HIS C 612 ? 0.1986 0.1806 0.1724 -0.0062 0.0055 0.0314 920 HIS C N 10109 C CA . HIS C 612 ? 0.1577 0.1434 0.1375 -0.0074 0.0023 0.0318 920 HIS C CA 10110 C C . HIS C 612 ? 0.2060 0.1903 0.1833 -0.0088 0.0031 0.0306 920 HIS C C 10111 O O . HIS C 612 ? 0.2019 0.1852 0.1753 -0.0098 0.0007 0.0283 920 HIS C O 10112 C CB . HIS C 612 ? 0.1727 0.1624 0.1653 -0.0065 0.0034 0.0347 920 HIS C CB 10113 C CG . HIS C 612 ? 0.2055 0.1972 0.2029 -0.0044 0.0015 0.0366 920 HIS C CG 10114 N ND1 . HIS C 612 ? 0.2246 0.2205 0.2364 -0.0027 0.0033 0.0396 920 HIS C ND1 10115 C CD2 . HIS C 612 ? 0.1970 0.1869 0.1877 -0.0032 -0.0014 0.0370 920 HIS C CD2 10116 C CE1 . HIS C 612 ? 0.2364 0.2331 0.2504 -0.0004 0.0004 0.0416 920 HIS C CE1 10117 N NE2 . HIS C 612 ? 0.1980 0.1907 0.1983 -0.0006 -0.0024 0.0403 920 HIS C NE2 10118 N N . THR C 613 ? 0.2270 0.2106 0.2059 -0.0080 0.0072 0.0326 921 THR C N 10119 C CA . THR C 613 ? 0.2051 0.1863 0.1795 -0.0082 0.0080 0.0328 921 THR C CA 10120 C C . THR C 613 ? 0.2119 0.1907 0.1772 -0.0081 0.0058 0.0298 921 THR C C 10121 O O . THR C 613 ? 0.1824 0.1609 0.1471 -0.0088 0.0035 0.0287 921 THR C O 10122 C CB . THR C 613 ? 0.2004 0.1794 0.1722 -0.0061 0.0140 0.0365 921 THR C CB 10123 O OG1 . THR C 613 ? 0.2172 0.1993 0.2021 -0.0063 0.0177 0.0400 921 THR C OG1 10124 C CG2 . THR C 613 ? 0.1998 0.1759 0.1661 -0.0055 0.0140 0.0384 921 THR C CG2 10125 N N . THR C 614 ? 0.1591 0.1364 0.1203 -0.0073 0.0068 0.0285 922 THR C N 10126 C CA . THR C 614 ? 0.1923 0.1675 0.1491 -0.0077 0.0047 0.0255 922 THR C CA 10127 C C . THR C 614 ? 0.2420 0.2191 0.2029 -0.0094 0.0028 0.0245 922 THR C C 10128 O O . THR C 614 ? 0.2699 0.2472 0.2320 -0.0101 0.0012 0.0229 922 THR C O 10129 C CB . THR C 614 ? 0.2193 0.1910 0.1735 -0.0067 0.0065 0.0237 922 THR C CB 10130 O OG1 . THR C 614 ? 0.2012 0.1704 0.1500 -0.0042 0.0102 0.0245 922 THR C OG1 10131 C CG2 . THR C 614 ? 0.2262 0.1952 0.1787 -0.0077 0.0034 0.0197 922 THR C CG2 10132 N N . GLY C 615 ? 0.1762 0.1548 0.1390 -0.0095 0.0032 0.0257 923 GLY C N 10133 C CA . GLY C 615 ? 0.2066 0.1856 0.1691 -0.0100 0.0030 0.0251 923 GLY C CA 10134 C C . GLY C 615 ? 0.2065 0.1862 0.1703 -0.0104 0.0020 0.0236 923 GLY C C 10135 O O . GLY C 615 ? 0.1833 0.1630 0.1486 -0.0105 0.0032 0.0225 923 GLY C O 10136 N N . MET C 616 ? 0.2002 0.1803 0.1661 -0.0105 0.0005 0.0239 924 MET C N 10137 C CA . MET C 616 ? 0.1899 0.1693 0.1589 -0.0106 -0.0002 0.0227 924 MET C CA 10138 C C . MET C 616 ? 0.1872 0.1666 0.1575 -0.0100 -0.0002 0.0234 924 MET C C 10139 O O . MET C 616 ? 0.1948 0.1742 0.1690 -0.0095 -0.0001 0.0222 924 MET C O 10140 C CB . MET C 616 ? 0.2030 0.1820 0.1773 -0.0113 -0.0011 0.0240 924 MET C CB 10141 C CG . MET C 616 ? 0.1709 0.1510 0.1480 -0.0122 -0.0036 0.0227 924 MET C CG 10142 S SD . MET C 616 ? 0.2365 0.2141 0.2086 -0.0122 -0.0069 0.0170 924 MET C SD 10143 C CE . MET C 616 ? 0.1637 0.1378 0.1448 -0.0133 -0.0075 0.0146 924 MET C CE 10144 N N . ASP C 617 ? 0.1602 0.1394 0.1275 -0.0095 -0.0007 0.0249 925 ASP C N 10145 C CA . ASP C 617 ? 0.1619 0.1410 0.1287 -0.0085 -0.0033 0.0251 925 ASP C CA 10146 C C . ASP C 617 ? 0.1594 0.1408 0.1325 -0.0093 -0.0043 0.0227 925 ASP C C 10147 O O . ASP C 617 ? 0.1707 0.1538 0.1501 -0.0085 -0.0067 0.0227 925 ASP C O 10148 C CB . ASP C 617 ? 0.1842 0.1611 0.1425 -0.0075 -0.0041 0.0254 925 ASP C CB 10149 C CG . ASP C 617 ? 0.2304 0.2050 0.1835 -0.0059 -0.0009 0.0291 925 ASP C CG 10150 O OD1 . ASP C 617 ? 0.2038 0.1784 0.1613 -0.0058 0.0004 0.0322 925 ASP C OD1 10151 O OD2 . ASP C 617 ? 0.2068 0.1791 0.1526 -0.0047 0.0013 0.0291 925 ASP C OD2 10152 N N . VAL C 618 ? 0.1530 0.1344 0.1263 -0.0105 -0.0020 0.0215 926 VAL C N 10153 C CA . VAL C 618 ? 0.1808 0.1642 0.1626 -0.0116 -0.0010 0.0204 926 VAL C CA 10154 C C . VAL C 618 ? 0.2173 0.2021 0.2042 -0.0109 0.0031 0.0206 926 VAL C C 10155 O O . VAL C 618 ? 0.1846 0.1723 0.1826 -0.0109 0.0040 0.0203 926 VAL C O 10156 C CB . VAL C 618 ? 0.3452 0.3266 0.3259 -0.0128 0.0016 0.0204 926 VAL C CB 10157 C CG1 . VAL C 618 ? 0.3610 0.3421 0.3424 -0.0127 0.0075 0.0223 926 VAL C CG1 10158 C CG2 . VAL C 618 ? 0.3631 0.3443 0.3514 -0.0145 -0.0016 0.0181 926 VAL C CG2 10159 N N . LEU C 619 ? 0.1757 0.1585 0.1554 -0.0101 0.0053 0.0206 927 LEU C N 10160 C CA . LEU C 619 ? 0.2073 0.1893 0.1878 -0.0087 0.0094 0.0193 927 LEU C CA 10161 C C . LEU C 619 ? 0.2159 0.1987 0.2042 -0.0075 0.0079 0.0184 927 LEU C C 10162 O O . LEU C 619 ? 0.2164 0.1995 0.2108 -0.0059 0.0120 0.0173 927 LEU C O 10163 C CB . LEU C 619 ? 0.1978 0.1763 0.1668 -0.0081 0.0098 0.0179 927 LEU C CB 10164 C CG . LEU C 619 ? 0.2263 0.2038 0.1874 -0.0080 0.0114 0.0199 927 LEU C CG 10165 C CD1 . LEU C 619 ? 0.2294 0.2043 0.1799 -0.0072 0.0084 0.0184 927 LEU C CD1 10166 C CD2 . LEU C 619 ? 0.2342 0.2110 0.1957 -0.0069 0.0187 0.0214 927 LEU C CD2 10167 N N . TRP C 620 ? 0.1601 0.1425 0.1481 -0.0076 0.0030 0.0197 928 TRP C N 10168 C CA . TRP C 620 ? 0.1801 0.1624 0.1756 -0.0059 0.0014 0.0205 928 TRP C CA 10169 C C . TRP C 620 ? 0.1698 0.1566 0.1770 -0.0050 -0.0004 0.0214 928 TRP C C 10170 O O . TRP C 620 ? 0.2144 0.2023 0.2322 -0.0028 0.0001 0.0217 928 TRP C O 10171 C CB . TRP C 620 ? 0.1873 0.1673 0.1791 -0.0057 -0.0022 0.0235 928 TRP C CB 10172 C CG . TRP C 620 ? 0.1837 0.1620 0.1832 -0.0034 -0.0033 0.0255 928 TRP C CG 10173 C CD1 . TRP C 620 ? 0.1709 0.1500 0.1728 -0.0012 -0.0076 0.0298 928 TRP C CD1 10174 C CD2 . TRP C 620 ? 0.1624 0.1371 0.1679 -0.0025 -0.0003 0.0233 928 TRP C CD2 10175 N NE1 . TRP C 620 ? 0.1806 0.1571 0.1914 0.0011 -0.0070 0.0317 928 TRP C NE1 10176 C CE2 . TRP C 620 ? 0.1767 0.1501 0.1907 0.0002 -0.0022 0.0271 928 TRP C CE2 10177 C CE3 . TRP C 620 ? 0.1777 0.1490 0.1809 -0.0033 0.0032 0.0180 928 TRP C CE3 10178 C CZ2 . TRP C 620 ? 0.1757 0.1443 0.1986 0.0018 0.0004 0.0258 928 TRP C CZ2 10179 C CZ3 . TRP C 620 ? 0.1786 0.1447 0.1884 -0.0017 0.0050 0.0152 928 TRP C CZ3 10180 C CH2 . TRP C 620 ? 0.2001 0.1648 0.2209 0.0007 0.0042 0.0191 928 TRP C CH2 10181 N N . ALA C 621 ? 0.1802 0.1698 0.1880 -0.0066 -0.0029 0.0214 929 ALA C N 10182 C CA . ALA C 621 ? 0.1922 0.1869 0.2146 -0.0065 -0.0062 0.0215 929 ALA C CA 10183 C C . ALA C 621 ? 0.2174 0.2151 0.2526 -0.0067 0.0015 0.0207 929 ALA C C 10184 O O . ALA C 621 ? 0.1707 0.1739 0.2239 -0.0068 0.0002 0.0209 929 ALA C O 10185 C CB . ALA C 621 ? 0.2116 0.2068 0.2308 -0.0084 -0.0124 0.0205 929 ALA C CB 10186 N N . GLY C 622 ? 0.2099 0.2039 0.2360 -0.0065 0.0094 0.0199 930 GLY C N 10187 C CA . GLY C 622 ? 0.1857 0.1806 0.2190 -0.0055 0.0191 0.0200 930 GLY C CA 10188 C C . GLY C 622 ? 0.1888 0.1846 0.2245 -0.0079 0.0230 0.0217 930 GLY C C 10189 O O . GLY C 622 ? 0.1993 0.1970 0.2461 -0.0073 0.0317 0.0233 930 GLY C O 10190 N N . THR C 623 ? 0.1774 0.1711 0.2039 -0.0102 0.0179 0.0217 931 THR C N 10191 C CA . THR C 623 ? 0.1843 0.1776 0.2149 -0.0126 0.0206 0.0234 931 THR C CA 10192 C C . THR C 623 ? 0.2057 0.1936 0.2198 -0.0114 0.0274 0.0257 931 THR C C 10193 O O . THR C 623 ? 0.2275 0.2121 0.2258 -0.0108 0.0238 0.0248 931 THR C O 10194 C CB . THR C 623 ? 0.2348 0.2272 0.2632 -0.0149 0.0115 0.0216 931 THR C CB 10195 O OG1 . THR C 623 ? 0.3148 0.3110 0.3513 -0.0149 0.0028 0.0194 931 THR C OG1 10196 C CG2 . THR C 623 ? 0.2364 0.2278 0.2745 -0.0178 0.0136 0.0223 931 THR C CG2 10197 N N . PRO C 624 ? 0.1907 0.1776 0.2092 -0.0109 0.0373 0.0292 932 PRO C N 10198 C CA . PRO C 624 ? 0.2329 0.2140 0.2334 -0.0090 0.0428 0.0326 932 PRO C CA 10199 C C . PRO C 624 ? 0.2580 0.2366 0.2540 -0.0109 0.0372 0.0335 932 PRO C C 10200 O O . PRO C 624 ? 0.2436 0.2236 0.2537 -0.0140 0.0342 0.0330 932 PRO C O 10201 C CB . PRO C 624 ? 0.1907 0.1713 0.2011 -0.0084 0.0554 0.0378 932 PRO C CB 10202 C CG . PRO C 624 ? 0.2221 0.2089 0.2534 -0.0086 0.0578 0.0359 932 PRO C CG 10203 C CD . PRO C 624 ? 0.1899 0.1812 0.2308 -0.0115 0.0443 0.0312 932 PRO C CD 10204 N N . MET C 625 ? 0.2321 0.2067 0.2095 -0.0089 0.0353 0.0344 933 MET C N 10205 C CA . MET C 625 ? 0.2470 0.2194 0.2211 -0.0097 0.0309 0.0358 933 MET C CA 10206 C C . MET C 625 ? 0.2677 0.2350 0.2310 -0.0070 0.0365 0.0421 933 MET C C 10207 O O . MET C 625 ? 0.2731 0.2383 0.2203 -0.0036 0.0378 0.0431 933 MET C O 10208 C CB . MET C 625 ? 0.2456 0.2191 0.2110 -0.0092 0.0227 0.0322 933 MET C CB 10209 C CG . MET C 625 ? 0.2339 0.2054 0.1956 -0.0089 0.0193 0.0338 933 MET C CG 10210 S SD . MET C 625 ? 0.3290 0.3032 0.2888 -0.0092 0.0118 0.0300 933 MET C SD 10211 C CE . MET C 625 ? 0.3193 0.2944 0.2702 -0.0077 0.0099 0.0282 933 MET C CE 10212 N N . VAL C 626 ? 0.2446 0.2090 0.2162 -0.0081 0.0393 0.0462 934 VAL C N 10213 C CA . VAL C 626 ? 0.2516 0.2104 0.2129 -0.0049 0.0444 0.0539 934 VAL C CA 10214 C C . VAL C 626 ? 0.2339 0.1915 0.1882 -0.0035 0.0367 0.0540 934 VAL C C 10215 O O . VAL C 626 ? 0.2107 0.1690 0.1754 -0.0058 0.0326 0.0507 934 VAL C O 10216 C CB . VAL C 626 ? 0.2486 0.2037 0.2255 -0.0066 0.0531 0.0598 934 VAL C CB 10217 C CG1 . VAL C 626 ? 0.2852 0.2333 0.2495 -0.0023 0.0593 0.0698 934 VAL C CG1 10218 C CG2 . VAL C 626 ? 0.2117 0.1697 0.2018 -0.0084 0.0610 0.0598 934 VAL C CG2 10219 N N . THR C 627 ? 0.2390 0.1946 0.1759 0.0007 0.0346 0.0575 935 THR C N 10220 C CA . THR C 627 ? 0.2494 0.2055 0.1838 0.0024 0.0268 0.0580 935 THR C CA 10221 C C . THR C 627 ? 0.2623 0.2135 0.1847 0.0074 0.0276 0.0668 935 THR C C 10222 O O . THR C 627 ? 0.2754 0.2226 0.1841 0.0104 0.0331 0.0717 935 THR C O 10223 C CB . THR C 627 ? 0.2876 0.2489 0.2167 0.0022 0.0180 0.0516 935 THR C CB 10224 O OG1 . THR C 627 ? 0.2780 0.2414 0.2116 0.0032 0.0116 0.0521 935 THR C OG1 10225 C CG2 . THR C 627 ? 0.3114 0.2713 0.2216 0.0054 0.0164 0.0515 935 THR C CG2 10226 N N . MET C 628 ? 0.2906 0.2416 0.2179 0.0090 0.0227 0.0695 936 MET C N 10227 C CA . MET C 628 ? 0.3225 0.2695 0.2391 0.0146 0.0209 0.0784 936 MET C CA 10228 C C . MET C 628 ? 0.3340 0.2866 0.2511 0.0165 0.0092 0.0761 936 MET C C 10229 O O . MET C 628 ? 0.3034 0.2579 0.2361 0.0160 0.0074 0.0755 936 MET C O 10230 C CB . MET C 628 ? 0.3483 0.2890 0.2769 0.0154 0.0276 0.0860 936 MET C CB 10231 C CG . MET C 628 ? 0.3446 0.2799 0.2618 0.0221 0.0268 0.0976 936 MET C CG 10232 S SD . MET C 628 ? 0.3750 0.3011 0.3095 0.0232 0.0353 0.1073 936 MET C SD 10233 C CE . MET C 628 ? 0.3507 0.2812 0.3057 0.0216 0.0284 0.0997 936 MET C CE 10234 N N . PRO C 629 ? 0.3306 0.2856 0.2321 0.0188 0.0013 0.0740 937 PRO C N 10235 C CA . PRO C 629 ? 0.3125 0.2741 0.2198 0.0196 -0.0107 0.0711 937 PRO C CA 10236 C C . PRO C 629 ? 0.3214 0.2824 0.2328 0.0248 -0.0153 0.0797 937 PRO C C 10237 O O . PRO C 629 ? 0.3203 0.2750 0.2181 0.0296 -0.0135 0.0884 937 PRO C O 10238 C CB . PRO C 629 ? 0.3202 0.2826 0.2089 0.0208 -0.0185 0.0663 937 PRO C CB 10239 C CG . PRO C 629 ? 0.3322 0.2863 0.1992 0.0236 -0.0102 0.0704 937 PRO C CG 10240 C CD . PRO C 629 ? 0.3234 0.2750 0.2033 0.0203 0.0032 0.0728 937 PRO C CD 10241 N N . GLY C 630 ? 0.2603 0.2277 0.1913 0.0243 -0.0202 0.0781 938 GLY C N 10242 C CA . GLY C 630 ? 0.2717 0.2398 0.2120 0.0294 -0.0245 0.0860 938 GLY C CA 10243 C C . GLY C 630 ? 0.3126 0.2883 0.2537 0.0322 -0.0396 0.0855 938 GLY C C 10244 O O . GLY C 630 ? 0.3619 0.3376 0.2848 0.0327 -0.0474 0.0825 938 GLY C O 10245 N N . GLU C 631 ? 0.3259 0.3079 0.2894 0.0343 -0.0440 0.0880 939 GLU C N 10246 C CA . GLU C 631 ? 0.4063 0.3971 0.3766 0.0367 -0.0598 0.0877 939 GLU C CA 10247 C C . GLU C 631 ? 0.4167 0.4178 0.4111 0.0318 -0.0621 0.0797 939 GLU C C 10248 O O . GLU C 631 ? 0.4883 0.4958 0.4850 0.0304 -0.0744 0.0750 939 GLU C O 10249 C CB . GLU C 631 ? 0.4629 0.4546 0.4422 0.0441 -0.0658 0.0983 939 GLU C CB 10250 C CG . GLU C 631 ? 0.5246 0.5053 0.4785 0.0496 -0.0638 0.1080 939 GLU C CG 10251 C CD . GLU C 631 ? 0.5829 0.5640 0.5443 0.0579 -0.0714 0.1198 939 GLU C CD 10252 O OE1 . GLU C 631 ? 0.5723 0.5641 0.5528 0.0600 -0.0844 0.1195 939 GLU C OE1 10253 O OE2 . GLU C 631 ? 0.6337 0.6046 0.5842 0.0624 -0.0642 0.1299 939 GLU C OE2 10254 N N . THR C 632 ? 0.3237 0.3252 0.3351 0.0292 -0.0500 0.0781 940 THR C N 10255 C CA . THR C 632 ? 0.2664 0.2764 0.2991 0.0251 -0.0491 0.0722 940 THR C CA 10256 C C . THR C 632 ? 0.2693 0.2782 0.2900 0.0192 -0.0486 0.0640 940 THR C C 10257 O O . THR C 632 ? 0.2615 0.2625 0.2608 0.0178 -0.0435 0.0622 940 THR C O 10258 C CB . THR C 632 ? 0.2597 0.2683 0.3079 0.0248 -0.0349 0.0724 940 THR C CB 10259 O OG1 . THR C 632 ? 0.2481 0.2475 0.2792 0.0219 -0.0246 0.0690 940 THR C OG1 10260 C CG2 . THR C 632 ? 0.2915 0.2995 0.3532 0.0311 -0.0333 0.0800 940 THR C CG2 10261 N N . LEU C 633 ? 0.2301 0.2468 0.2677 0.0158 -0.0529 0.0595 941 LEU C N 10262 C CA . LEU C 633 ? 0.2115 0.2269 0.2422 0.0103 -0.0516 0.0521 941 LEU C CA 10263 C C . LEU C 633 ? 0.2009 0.2091 0.2204 0.0082 -0.0375 0.0506 941 LEU C C 10264 O O . LEU C 633 ? 0.1883 0.1911 0.1899 0.0061 -0.0361 0.0468 941 LEU C O 10265 C CB . LEU C 633 ? 0.2261 0.2505 0.2839 0.0070 -0.0542 0.0495 941 LEU C CB 10266 C CG . LEU C 633 ? 0.2277 0.2520 0.2854 0.0015 -0.0568 0.0424 941 LEU C CG 10267 C CD1 . LEU C 633 ? 0.2149 0.2492 0.3054 -0.0011 -0.0619 0.0419 941 LEU C CD1 10268 C CD2 . LEU C 633 ? 0.2197 0.2379 0.2677 -0.0012 -0.0435 0.0405 941 LEU C CD2 10269 N N . ALA C 634 ? 0.1910 0.1990 0.2216 0.0093 -0.0275 0.0532 942 ALA C N 10270 C CA . ALA C 634 ? 0.2233 0.2251 0.2455 0.0073 -0.0161 0.0506 942 ALA C CA 10271 C C . ALA C 634 ? 0.2364 0.2299 0.2388 0.0078 -0.0137 0.0509 942 ALA C C 10272 O O . ALA C 634 ? 0.1996 0.1887 0.1930 0.0052 -0.0080 0.0476 942 ALA C O 10273 C CB . ALA C 634 ? 0.2123 0.2142 0.2479 0.0094 -0.0066 0.0524 942 ALA C CB 10274 N N . SER C 635 ? 0.2132 0.2049 0.2104 0.0113 -0.0180 0.0558 943 SER C N 10275 C CA . SER C 635 ? 0.2014 0.1851 0.1828 0.0121 -0.0142 0.0581 943 SER C CA 10276 C C . SER C 635 ? 0.2489 0.2309 0.2120 0.0114 -0.0187 0.0565 943 SER C C 10277 O O . SER C 635 ? 0.2860 0.2617 0.2357 0.0124 -0.0145 0.0594 943 SER C O 10278 C CB . SER C 635 ? 0.2271 0.2079 0.2114 0.0172 -0.0147 0.0660 943 SER C CB 10279 O OG . SER C 635 ? 0.2456 0.2302 0.2260 0.0207 -0.0257 0.0698 943 SER C OG 10280 N N . ARG C 636 ? 0.2161 0.2030 0.1793 0.0097 -0.0262 0.0519 944 ARG C N 10281 C CA . ARG C 636 ? 0.2117 0.1958 0.1559 0.0100 -0.0313 0.0491 944 ARG C CA 10282 C C . ARG C 636 ? 0.2289 0.2133 0.1720 0.0056 -0.0299 0.0414 944 ARG C C 10283 O O . ARG C 636 ? 0.2320 0.2129 0.1596 0.0058 -0.0322 0.0377 944 ARG C O 10284 C CB . ARG C 636 ? 0.2372 0.2246 0.1787 0.0130 -0.0449 0.0498 944 ARG C CB 10285 C CG . ARG C 636 ? 0.2606 0.2463 0.1975 0.0189 -0.0478 0.0587 944 ARG C CG 10286 C CD . ARG C 636 ? 0.2904 0.2795 0.2227 0.0224 -0.0640 0.0589 944 ARG C CD 10287 N NE . ARG C 636 ? 0.2868 0.2700 0.1915 0.0236 -0.0692 0.0543 944 ARG C NE 10288 C CZ . ARG C 636 ? 0.3407 0.3153 0.2182 0.0285 -0.0664 0.0595 944 ARG C CZ 10289 N NH1 . ARG C 636 ? 0.3541 0.3252 0.2310 0.0321 -0.0590 0.0700 944 ARG C NH1 10290 N NH2 . ARG C 636 ? 0.3826 0.3512 0.2335 0.0301 -0.0699 0.0544 944 ARG C NH2 10291 N N . VAL C 637 ? 0.2472 0.2349 0.2058 0.0023 -0.0257 0.0393 945 VAL C N 10292 C CA . VAL C 637 ? 0.2479 0.2359 0.2084 -0.0013 -0.0247 0.0334 945 VAL C CA 10293 C C . VAL C 637 ? 0.2462 0.2288 0.1931 -0.0020 -0.0186 0.0314 945 VAL C C 10294 O O . VAL C 637 ? 0.1899 0.1705 0.1301 -0.0028 -0.0205 0.0266 945 VAL C O 10295 C CB . VAL C 637 ? 0.2117 0.2033 0.1890 -0.0036 -0.0199 0.0336 945 VAL C CB 10296 C CG1 . VAL C 637 ? 0.1889 0.1790 0.1661 -0.0067 -0.0171 0.0295 945 VAL C CG1 10297 C CG2 . VAL C 637 ? 0.2183 0.2165 0.2135 -0.0034 -0.0252 0.0351 945 VAL C CG2 10298 N N . ALA C 638 ? 0.2386 0.2185 0.1837 -0.0015 -0.0113 0.0347 946 ALA C N 10299 C CA . ALA C 638 ? 0.2460 0.2222 0.1839 -0.0022 -0.0050 0.0334 946 ALA C CA 10300 C C . ALA C 638 ? 0.2691 0.2414 0.1904 0.0003 -0.0054 0.0333 946 ALA C C 10301 O O . ALA C 638 ? 0.2235 0.1939 0.1397 -0.0002 -0.0024 0.0296 946 ALA C O 10302 C CB . ALA C 638 ? 0.2461 0.2203 0.1884 -0.0025 0.0016 0.0369 946 ALA C CB 10303 N N . ALA C 639 ? 0.2747 0.2452 0.1866 0.0038 -0.0087 0.0375 947 ALA C N 10304 C CA . ALA C 639 ? 0.3017 0.2670 0.1925 0.0074 -0.0091 0.0376 947 ALA C CA 10305 C C . ALA C 639 ? 0.2866 0.2518 0.1712 0.0069 -0.0166 0.0293 947 ALA C C 10306 O O . ALA C 639 ? 0.2764 0.2364 0.1454 0.0088 -0.0138 0.0257 947 ALA C O 10307 C CB . ALA C 639 ? 0.2889 0.2522 0.1695 0.0121 -0.0134 0.0445 947 ALA C CB 10308 N N . SER C 640 ? 0.2645 0.2350 0.1630 0.0045 -0.0253 0.0260 948 SER C N 10309 C CA . SER C 640 ? 0.2803 0.2503 0.1782 0.0030 -0.0331 0.0177 948 SER C CA 10310 C C . SER C 640 ? 0.2523 0.2203 0.1543 0.0004 -0.0261 0.0128 948 SER C C 10311 O O . SER C 640 ? 0.2618 0.2247 0.1534 0.0012 -0.0274 0.0061 948 SER C O 10312 C CB . SER C 640 ? 0.2865 0.2634 0.2047 0.0004 -0.0424 0.0167 948 SER C CB 10313 O OG . SER C 640 ? 0.2850 0.2610 0.2057 -0.0016 -0.0508 0.0084 948 SER C OG 10314 N N . GLN C 641 ? 0.2247 0.1960 0.1412 -0.0021 -0.0192 0.0160 949 GLN C N 10315 C CA . GLN C 641 ? 0.2232 0.1933 0.1449 -0.0039 -0.0132 0.0131 949 GLN C CA 10316 C C . GLN C 641 ? 0.2341 0.1992 0.1418 -0.0011 -0.0058 0.0123 949 GLN C C 10317 O O . GLN C 641 ? 0.2276 0.1893 0.1330 -0.0007 -0.0037 0.0070 949 GLN C O 10318 C CB . GLN C 641 ? 0.2666 0.2407 0.2024 -0.0060 -0.0084 0.0172 949 GLN C CB 10319 C CG . GLN C 641 ? 0.2624 0.2408 0.2117 -0.0081 -0.0123 0.0186 949 GLN C CG 10320 C CD . GLN C 641 ? 0.2582 0.2386 0.2146 -0.0088 -0.0073 0.0224 949 GLN C CD 10321 O OE1 . GLN C 641 ? 0.1971 0.1762 0.1498 -0.0081 -0.0029 0.0241 949 GLN C OE1 10322 N NE2 . GLN C 641 ? 0.2322 0.2152 0.1989 -0.0100 -0.0077 0.0237 949 GLN C NE2 10323 N N . LEU C 642 ? 0.2234 0.1874 0.1233 0.0011 -0.0007 0.0180 950 LEU C N 10324 C CA . LEU C 642 ? 0.2389 0.1985 0.1279 0.0039 0.0089 0.0192 950 LEU C CA 10325 C C . LEU C 642 ? 0.2806 0.2332 0.1469 0.0081 0.0075 0.0146 950 LEU C C 10326 O O . LEU C 642 ? 0.2931 0.2413 0.1516 0.0104 0.0157 0.0121 950 LEU C O 10327 C CB . LEU C 642 ? 0.2624 0.2219 0.1511 0.0050 0.0153 0.0277 950 LEU C CB 10328 C CG . LEU C 642 ? 0.2388 0.2031 0.1486 0.0011 0.0182 0.0301 950 LEU C CG 10329 C CD1 . LEU C 642 ? 0.2450 0.2082 0.1574 0.0016 0.0227 0.0375 950 LEU C CD1 10330 C CD2 . LEU C 642 ? 0.2705 0.2359 0.1895 0.0001 0.0248 0.0277 950 LEU C CD2 10331 N N . THR C 643 ? 0.2780 0.2295 0.1336 0.0094 -0.0030 0.0133 951 THR C N 10332 C CA . THR C 643 ? 0.3099 0.2538 0.1409 0.0136 -0.0073 0.0073 951 THR C CA 10333 C C . THR C 643 ? 0.3341 0.2751 0.1687 0.0120 -0.0098 -0.0035 951 THR C C 10334 O O . THR C 643 ? 0.3581 0.2911 0.1751 0.0157 -0.0051 -0.0092 951 THR C O 10335 C CB . THR C 643 ? 0.3289 0.2732 0.1504 0.0153 -0.0211 0.0079 951 THR C CB 10336 O OG1 . THR C 643 ? 0.3226 0.2678 0.1394 0.0179 -0.0176 0.0187 951 THR C OG1 10337 C CG2 . THR C 643 ? 0.3779 0.3133 0.1709 0.0199 -0.0280 0.0000 951 THR C CG2 10338 N N . CYS C 644 ? 0.3136 0.2602 0.1711 0.0069 -0.0161 -0.0059 952 CYS C N 10339 C CA . CYS C 644 ? 0.3067 0.2503 0.1727 0.0048 -0.0181 -0.0148 952 CYS C CA 10340 C C . CYS C 644 ? 0.3145 0.2562 0.1844 0.0059 -0.0052 -0.0147 952 CYS C C 10341 O O . CYS C 644 ? 0.3266 0.2611 0.1901 0.0078 -0.0026 -0.0224 952 CYS C O 10342 C CB . CYS C 644 ? 0.3041 0.2545 0.1959 -0.0006 -0.0248 -0.0141 952 CYS C CB 10343 S SG . CYS C 644 ? 0.2951 0.2415 0.2026 -0.0035 -0.0253 -0.0221 952 CYS C SG 10344 N N . LEU C 645 ? 0.2570 0.2048 0.1388 0.0047 0.0024 -0.0064 953 LEU C N 10345 C CA . LEU C 645 ? 0.2980 0.2460 0.1877 0.0057 0.0137 -0.0050 953 LEU C CA 10346 C C . LEU C 645 ? 0.3561 0.2971 0.2266 0.0111 0.0236 -0.0067 953 LEU C C 10347 O O . LEU C 645 ? 0.3722 0.3107 0.2470 0.0131 0.0319 -0.0097 953 LEU C O 10348 C CB . LEU C 645 ? 0.2742 0.2298 0.1788 0.0035 0.0178 0.0036 953 LEU C CB 10349 C CG . LEU C 645 ? 0.2807 0.2394 0.2015 0.0033 0.0260 0.0054 953 LEU C CG 10350 C CD1 . LEU C 645 ? 0.2340 0.1939 0.1692 0.0014 0.0216 0.0020 953 LEU C CD1 10351 C CD2 . LEU C 645 ? 0.2198 0.1848 0.1524 0.0010 0.0282 0.0126 953 LEU C CD2 10352 N N . GLY C 646 ? 0.3595 0.2972 0.2089 0.0142 0.0236 -0.0038 954 GLY C N 10353 C CA . GLY C 646 ? 0.3816 0.3113 0.2078 0.0203 0.0341 -0.0040 954 GLY C CA 10354 C C . GLY C 646 ? 0.4110 0.3435 0.2405 0.0215 0.0467 0.0069 954 GLY C C 10355 O O . GLY C 646 ? 0.4870 0.4151 0.3080 0.0259 0.0605 0.0085 954 GLY C O 10356 N N . CYS C 647 ? 0.3720 0.3114 0.2152 0.0178 0.0428 0.0142 955 CYS C N 10357 C CA . CYS C 647 ? 0.3879 0.3295 0.2390 0.0179 0.0537 0.0243 955 CYS C CA 10358 C C . CYS C 647 ? 0.4017 0.3410 0.2386 0.0196 0.0506 0.0317 955 CYS C C 10359 O O . CYS C 647 ? 0.3894 0.3337 0.2417 0.0161 0.0471 0.0368 955 CYS C O 10360 C CB . CYS C 647 ? 0.3796 0.3304 0.2626 0.0121 0.0530 0.0263 955 CYS C CB 10361 S SG . CYS C 647 ? 0.4337 0.3884 0.3379 0.0111 0.0588 0.0215 955 CYS C SG 10362 N N . LEU C 648 ? 0.3836 0.3144 0.1901 0.0257 0.0519 0.0322 956 LEU C N 10363 C CA . LEU C 648 ? 0.4180 0.3457 0.2083 0.0286 0.0478 0.0402 956 LEU C CA 10364 C C . LEU C 648 ? 0.4231 0.3510 0.2238 0.0287 0.0607 0.0526 956 LEU C C 10365 O O . LEU C 648 ? 0.4183 0.3458 0.2181 0.0292 0.0569 0.0604 956 LEU C O 10366 C CB . LEU C 648 ? 0.4653 0.3826 0.2167 0.0363 0.0464 0.0382 956 LEU C CB 10367 C CG . LEU C 648 ? 0.5170 0.4319 0.2553 0.0366 0.0317 0.0249 956 LEU C CG 10368 C CD1 . LEU C 648 ? 0.5733 0.4761 0.2691 0.0450 0.0305 0.0226 956 LEU C CD1 10369 C CD2 . LEU C 648 ? 0.5244 0.4468 0.2783 0.0319 0.0138 0.0229 956 LEU C CD2 10370 N N . GLU C 649 ? 0.3987 0.3271 0.2119 0.0282 0.0759 0.0547 957 GLU C N 10371 C CA . GLU C 649 ? 0.4195 0.3476 0.2460 0.0278 0.0895 0.0664 957 GLU C CA 10372 C C . GLU C 649 ? 0.3577 0.2929 0.2150 0.0210 0.0838 0.0687 957 GLU C C 10373 O O . GLU C 649 ? 0.3582 0.2926 0.2294 0.0198 0.0925 0.0777 957 GLU C O 10374 C CB . GLU C 649 ? 0.4844 0.4127 0.3223 0.0286 0.1070 0.0673 957 GLU C CB 10375 C CG . GLU C 649 ? 0.5235 0.4610 0.3910 0.0229 0.1036 0.0588 957 GLU C CG 10376 C CD . GLU C 649 ? 0.5879 0.5236 0.4417 0.0255 0.0998 0.0478 957 GLU C CD 10377 O OE1 . GLU C 649 ? 0.5767 0.5081 0.4073 0.0274 0.0879 0.0422 957 GLU C OE1 10378 O OE2 . GLU C 649 ? 0.6169 0.5551 0.4853 0.0257 0.1086 0.0447 957 GLU C OE2 10379 N N . LEU C 650 ? 0.3068 0.2482 0.1745 0.0168 0.0697 0.0605 958 LEU C N 10380 C CA . LEU C 650 ? 0.2722 0.2194 0.1656 0.0110 0.0641 0.0607 958 LEU C CA 10381 C C . LEU C 650 ? 0.3144 0.2605 0.2011 0.0116 0.0536 0.0630 958 LEU C C 10382 O O . LEU C 650 ? 0.2862 0.2358 0.1905 0.0078 0.0487 0.0624 958 LEU C O 10383 C CB . LEU C 650 ? 0.2545 0.2088 0.1645 0.0065 0.0572 0.0513 958 LEU C CB 10384 C CG . LEU C 650 ? 0.2995 0.2569 0.2259 0.0051 0.0666 0.0498 958 LEU C CG 10385 C CD1 . LEU C 650 ? 0.2237 0.1867 0.1608 0.0025 0.0589 0.0413 958 LEU C CD1 10386 C CD2 . LEU C 650 ? 0.2766 0.2360 0.2268 0.0017 0.0731 0.0556 958 LEU C CD2 10387 N N . ILE C 651 ? 0.3465 0.2627 0.1981 -0.0083 0.0273 0.0548 959 ILE C N 10388 C CA . ILE C 651 ? 0.3108 0.2261 0.1623 -0.0047 0.0199 0.0587 959 ILE C CA 10389 C C . ILE C 651 ? 0.3500 0.2583 0.1941 -0.0042 0.0222 0.0640 959 ILE C C 10390 O O . ILE C 651 ? 0.3731 0.2773 0.2040 -0.0041 0.0243 0.0654 959 ILE C O 10391 C CB . ILE C 651 ? 0.3085 0.2258 0.1523 -0.0015 0.0123 0.0578 959 ILE C CB 10392 C CG1 . ILE C 651 ? 0.2746 0.1972 0.1245 -0.0021 0.0105 0.0526 959 ILE C CG1 10393 C CG2 . ILE C 651 ? 0.3295 0.2480 0.1762 0.0023 0.0044 0.0621 959 ILE C CG2 10394 C CD1 . ILE C 651 ? 0.2903 0.2136 0.1316 0.0001 0.0034 0.0504 959 ILE C CD1 10395 N N . ALA C 652 ? 0.3091 0.2154 0.1612 -0.0040 0.0220 0.0670 960 ALA C N 10396 C CA . ALA C 652 ? 0.3115 0.2100 0.1578 -0.0039 0.0249 0.0723 960 ALA C CA 10397 C C . ALA C 652 ? 0.3262 0.2234 0.1680 0.0005 0.0177 0.0776 960 ALA C C 10398 O O . ALA C 652 ? 0.3531 0.2551 0.2031 0.0030 0.0113 0.0776 960 ALA C O 10399 C CB . ALA C 652 ? 0.3110 0.2064 0.1675 -0.0064 0.0294 0.0723 960 ALA C CB 10400 N N . LYS C 653 ? 0.3366 0.2277 0.1663 0.0015 0.0189 0.0826 961 LYS C N 10401 C CA . LYS C 653 ? 0.4012 0.2914 0.2262 0.0056 0.0119 0.0884 961 LYS C CA 10402 C C . LYS C 653 ? 0.3942 0.2789 0.2260 0.0066 0.0123 0.0934 961 LYS C C 10403 O O . LYS C 653 ? 0.4153 0.3003 0.2478 0.0102 0.0060 0.0983 961 LYS C O 10404 C CB . LYS C 653 ? 0.4896 0.3762 0.2967 0.0066 0.0120 0.0919 961 LYS C CB 10405 C CG . LYS C 653 ? 0.5941 0.4855 0.3924 0.0066 0.0098 0.0869 961 LYS C CG 10406 C CD . LYS C 653 ? 0.7008 0.5882 0.4797 0.0077 0.0097 0.0903 961 LYS C CD 10407 C CE . LYS C 653 ? 0.7547 0.6448 0.5235 0.0069 0.0098 0.0840 961 LYS C CE 10408 N NZ . LYS C 653 ? 0.7584 0.6473 0.5301 0.0029 0.0192 0.0789 961 LYS C NZ 10409 N N . ASN C 654 ? 0.3949 0.2742 0.2317 0.0034 0.0197 0.0921 962 ASN C N 10410 C CA . ASN C 654 ? 0.3978 0.2700 0.2407 0.0039 0.0211 0.0957 962 ASN C CA 10411 C C . ASN C 654 ? 0.3805 0.2499 0.2318 -0.0004 0.0285 0.0911 962 ASN C C 10412 O O . ASN C 654 ? 0.3843 0.2578 0.2368 -0.0037 0.0322 0.0860 962 ASN C O 10413 C CB . ASN C 654 ? 0.4258 0.2888 0.2578 0.0053 0.0226 0.1033 962 ASN C CB 10414 C CG . ASN C 654 ? 0.4720 0.3302 0.2935 0.0020 0.0304 0.1037 962 ASN C CG 10415 O OD1 . ASN C 654 ? 0.4554 0.3126 0.2815 -0.0022 0.0374 0.0994 962 ASN C OD1 10416 N ND2 . ASN C 654 ? 0.5455 0.4012 0.3528 0.0038 0.0292 0.1089 962 ASN C ND2 10417 N N . ARG C 655 ? 0.3570 0.2193 0.2142 -0.0003 0.0305 0.0927 963 ARG C N 10418 C CA . ARG C 655 ? 0.3711 0.2310 0.2368 -0.0043 0.0365 0.0879 963 ARG C CA 10419 C C . ARG C 655 ? 0.3714 0.2276 0.2334 -0.0093 0.0449 0.0868 963 ARG C C 10420 O O . ARG C 655 ? 0.3629 0.2231 0.2313 -0.0135 0.0485 0.0812 963 ARG C O 10421 C CB . ARG C 655 ? 0.4233 0.2748 0.2946 -0.0028 0.0372 0.0897 963 ARG C CB 10422 C CG . ARG C 655 ? 0.4665 0.3233 0.3454 0.0013 0.0302 0.0889 963 ARG C CG 10423 C CD . ARG C 655 ? 0.5682 0.4157 0.4518 0.0034 0.0315 0.0906 963 ARG C CD 10424 N NE . ARG C 655 ? 0.6903 0.5273 0.5669 0.0049 0.0335 0.0974 963 ARG C NE 10425 C CZ . ARG C 655 ? 0.7918 0.6282 0.6639 0.0094 0.0279 0.1039 963 ARG C CZ 10426 N NH1 . ARG C 655 ? 0.8089 0.6549 0.6835 0.0126 0.0198 0.1041 963 ARG C NH1 10427 N NH2 . ARG C 655 ? 0.8374 0.6636 0.7027 0.0106 0.0302 0.1104 963 ARG C NH2 10428 N N . GLN C 656 ? 0.3865 0.2353 0.2386 -0.0091 0.0479 0.0924 964 GLN C N 10429 C CA . GLN C 656 ? 0.4219 0.2675 0.2703 -0.0137 0.0561 0.0920 964 GLN C CA 10430 C C . GLN C 656 ? 0.3910 0.2462 0.2382 -0.0157 0.0568 0.0873 964 GLN C C 10431 O O . GLN C 656 ? 0.3698 0.2269 0.2224 -0.0204 0.0627 0.0833 964 GLN C O 10432 C CB . GLN C 656 ? 0.4679 0.3045 0.3043 -0.0125 0.0588 0.0996 964 GLN C CB 10433 C CG . GLN C 656 ? 0.5376 0.3702 0.3712 -0.0175 0.0682 0.0997 964 GLN C CG 10434 C CD . GLN C 656 ? 0.5877 0.4163 0.4332 -0.0224 0.0742 0.0962 964 GLN C CD 10435 O OE1 . GLN C 656 ? 0.6007 0.4200 0.4488 -0.0221 0.0755 0.0989 964 GLN C OE1 10436 N NE2 . GLN C 656 ? 0.5930 0.4286 0.4460 -0.0270 0.0777 0.0899 964 GLN C NE2 10437 N N . GLU C 657 ? 0.4075 0.2686 0.2481 -0.0122 0.0508 0.0877 965 GLU C N 10438 C CA . GLU C 657 ? 0.4123 0.2816 0.2514 -0.0136 0.0514 0.0829 965 GLU C CA 10439 C C . GLU C 657 ? 0.3548 0.2318 0.2073 -0.0159 0.0509 0.0762 965 GLU C C 10440 O O . GLU C 657 ? 0.2986 0.1804 0.1541 -0.0192 0.0551 0.0720 965 GLU C O 10441 C CB . GLU C 657 ? 0.4900 0.3632 0.3190 -0.0094 0.0446 0.0842 965 GLU C CB 10442 C CG . GLU C 657 ? 0.5520 0.4318 0.3779 -0.0107 0.0460 0.0791 965 GLU C CG 10443 C CD . GLU C 657 ? 0.5828 0.4635 0.3943 -0.0074 0.0415 0.0805 965 GLU C CD 10444 O OE1 . GLU C 657 ? 0.4936 0.3773 0.3050 -0.0037 0.0330 0.0815 965 GLU C OE1 10445 O OE2 . GLU C 657 ? 0.6618 0.5406 0.4624 -0.0085 0.0464 0.0804 965 GLU C OE2 10446 N N . TYR C 658 ? 0.3163 0.1948 0.1771 -0.0141 0.0458 0.0754 966 TYR C N 10447 C CA . TYR C 658 ? 0.2959 0.1812 0.1687 -0.0160 0.0450 0.0697 966 TYR C CA 10448 C C . TYR C 658 ? 0.2806 0.1639 0.1603 -0.0215 0.0523 0.0669 966 TYR C C 10449 O O . TYR C 658 ? 0.2864 0.1768 0.1728 -0.0247 0.0543 0.0623 966 TYR C O 10450 C CB . TYR C 658 ? 0.2979 0.1833 0.1769 -0.0127 0.0391 0.0703 966 TYR C CB 10451 C CG . TYR C 658 ? 0.2738 0.1657 0.1640 -0.0139 0.0375 0.0652 966 TYR C CG 10452 C CD1 . TYR C 658 ? 0.2594 0.1593 0.1529 -0.0109 0.0312 0.0637 966 TYR C CD1 10453 C CD2 . TYR C 658 ? 0.2936 0.1832 0.1910 -0.0179 0.0422 0.0622 966 TYR C CD2 10454 C CE1 . TYR C 658 ? 0.2687 0.1743 0.1719 -0.0118 0.0299 0.0598 966 TYR C CE1 10455 C CE2 . TYR C 658 ? 0.2805 0.1757 0.1868 -0.0189 0.0406 0.0579 966 TYR C CE2 10456 C CZ . TYR C 658 ? 0.2809 0.1841 0.1898 -0.0157 0.0346 0.0570 966 TYR C CZ 10457 O OH . TYR C 658 ? 0.2438 0.1523 0.1608 -0.0166 0.0334 0.0533 966 TYR C OH 10458 N N . GLU C 659 ? 0.2868 0.1607 0.1656 -0.0228 0.0562 0.0699 967 GLU C N 10459 C CA . GLU C 659 ? 0.3217 0.1931 0.2072 -0.0286 0.0633 0.0674 967 GLU C CA 10460 C C . GLU C 659 ? 0.3189 0.1939 0.2024 -0.0321 0.0690 0.0666 967 GLU C C 10461 O O . GLU C 659 ? 0.3328 0.2139 0.2253 -0.0366 0.0722 0.0621 967 GLU C O 10462 C CB . GLU C 659 ? 0.3723 0.2313 0.2562 -0.0292 0.0668 0.0712 967 GLU C CB 10463 C CG . GLU C 659 ? 0.4253 0.2802 0.3134 -0.0265 0.0628 0.0711 967 GLU C CG 10464 C CD . GLU C 659 ? 0.4631 0.3047 0.3486 -0.0260 0.0661 0.0755 967 GLU C CD 10465 O OE1 . GLU C 659 ? 0.4060 0.2415 0.2884 -0.0292 0.0723 0.0779 967 GLU C OE1 10466 O OE2 . GLU C 659 ? 0.4570 0.2942 0.3440 -0.0224 0.0627 0.0765 967 GLU C OE2 10467 N N . ASP C 660 ? 0.3291 0.2007 0.2009 -0.0298 0.0701 0.0709 968 ASP C N 10468 C CA . ASP C 660 ? 0.3476 0.2215 0.2159 -0.0326 0.0763 0.0706 968 ASP C CA 10469 C C . ASP C 660 ? 0.3620 0.2474 0.2351 -0.0332 0.0752 0.0652 968 ASP C C 10470 O O . ASP C 660 ? 0.3354 0.2255 0.2148 -0.0373 0.0809 0.0624 968 ASP C O 10471 C CB . ASP C 660 ? 0.3750 0.2428 0.2276 -0.0295 0.0772 0.0764 968 ASP C CB 10472 C CG . ASP C 660 ? 0.4618 0.3181 0.3103 -0.0301 0.0811 0.0823 968 ASP C CG 10473 O OD1 . ASP C 660 ? 0.4734 0.3261 0.3314 -0.0341 0.0852 0.0812 968 ASP C OD1 10474 O OD2 . ASP C 660 ? 0.4438 0.2944 0.2794 -0.0266 0.0799 0.0880 968 ASP C OD2 10475 N N . ILE C 661 ? 0.3491 0.2390 0.2199 -0.0291 0.0680 0.0640 969 ILE C N 10476 C CA . ILE C 661 ? 0.3448 0.2448 0.2202 -0.0293 0.0667 0.0591 969 ILE C CA 10477 C C . ILE C 661 ? 0.3148 0.2215 0.2058 -0.0333 0.0678 0.0546 969 ILE C C 10478 O O . ILE C 661 ? 0.2796 0.1931 0.1773 -0.0365 0.0720 0.0514 969 ILE C O 10479 C CB . ILE C 661 ? 0.3397 0.2427 0.2109 -0.0245 0.0583 0.0587 969 ILE C CB 10480 C CG1 . ILE C 661 ? 0.3880 0.2864 0.2432 -0.0209 0.0567 0.0622 969 ILE C CG1 10481 C CG2 . ILE C 661 ? 0.3350 0.2477 0.2135 -0.0251 0.0572 0.0535 969 ILE C CG2 10482 C CD1 . ILE C 661 ? 0.3692 0.2694 0.2204 -0.0161 0.0476 0.0628 969 ILE C CD1 10483 N N . ALA C 662 ? 0.2770 0.1819 0.1739 -0.0332 0.0642 0.0544 970 ALA C N 10484 C CA . ALA C 662 ? 0.2948 0.2054 0.2051 -0.0371 0.0647 0.0502 970 ALA C CA 10485 C C . ALA C 662 ? 0.2666 0.1774 0.1839 -0.0431 0.0720 0.0489 970 ALA C C 10486 O O . ALA C 662 ? 0.2937 0.2134 0.2221 -0.0468 0.0734 0.0449 970 ALA C O 10487 C CB . ALA C 662 ? 0.2394 0.1456 0.1524 -0.0358 0.0605 0.0504 970 ALA C CB 10488 N N . VAL C 663 ? 0.2637 0.1650 0.1751 -0.0441 0.0765 0.0525 971 VAL C N 10489 C CA . VAL C 663 ? 0.2718 0.1727 0.1902 -0.0501 0.0838 0.0518 971 VAL C CA 10490 C C . VAL C 663 ? 0.2852 0.1938 0.2048 -0.0514 0.0884 0.0509 971 VAL C C 10491 O O . VAL C 663 ? 0.2861 0.2020 0.2177 -0.0562 0.0922 0.0479 971 VAL C O 10492 C CB . VAL C 663 ? 0.3482 0.2361 0.2602 -0.0508 0.0880 0.0565 971 VAL C CB 10493 C CG1 . VAL C 663 ? 0.3256 0.2135 0.2444 -0.0570 0.0960 0.0562 971 VAL C CG1 10494 C CG2 . VAL C 663 ? 0.3135 0.1940 0.2276 -0.0506 0.0848 0.0563 971 VAL C CG2 10495 N N . LYS C 664 ? 0.3261 0.2333 0.2336 -0.0471 0.0881 0.0532 972 LYS C N 10496 C CA . LYS C 664 ? 0.3119 0.2256 0.2191 -0.0476 0.0927 0.0519 972 LYS C CA 10497 C C . LYS C 664 ? 0.3132 0.2399 0.2333 -0.0487 0.0907 0.0467 972 LYS C C 10498 O O . LYS C 664 ? 0.3008 0.2352 0.2304 -0.0519 0.0957 0.0445 972 LYS C O 10499 C CB . LYS C 664 ? 0.3123 0.2219 0.2029 -0.0424 0.0913 0.0544 972 LYS C CB 10500 C CG . LYS C 664 ? 0.3219 0.2366 0.2102 -0.0426 0.0970 0.0527 972 LYS C CG 10501 C CD . LYS C 664 ? 0.3451 0.2540 0.2146 -0.0380 0.0961 0.0551 972 LYS C CD 10502 C CE . LYS C 664 ? 0.4083 0.3212 0.2747 -0.0382 0.1027 0.0529 972 LYS C CE 10503 N NZ . LYS C 664 ? 0.4114 0.3189 0.2585 -0.0338 0.1012 0.0541 972 LYS C NZ 10504 N N . LEU C 665 ? 0.2781 0.2076 0.1994 -0.0460 0.0834 0.0450 973 LEU C N 10505 C CA . LEU C 665 ? 0.2680 0.2097 0.2012 -0.0467 0.0810 0.0406 973 LEU C CA 10506 C C . LEU C 665 ? 0.2937 0.2422 0.2432 -0.0523 0.0827 0.0381 973 LEU C C 10507 O O . LEU C 665 ? 0.3108 0.2708 0.2722 -0.0542 0.0838 0.0351 973 LEU C O 10508 C CB . LEU C 665 ? 0.2348 0.1773 0.1656 -0.0427 0.0731 0.0400 973 LEU C CB 10509 C CG . LEU C 665 ? 0.2923 0.2315 0.2097 -0.0376 0.0707 0.0413 973 LEU C CG 10510 C CD1 . LEU C 665 ? 0.2494 0.1873 0.1640 -0.0339 0.0626 0.0419 973 LEU C CD1 10511 C CD2 . LEU C 665 ? 0.3125 0.2600 0.2332 -0.0374 0.0735 0.0382 973 LEU C CD2 10512 N N . GLY C 666 ? 0.2294 0.1709 0.1797 -0.0549 0.0827 0.0391 974 GLY C N 10513 C CA . GLY C 666 ? 0.2487 0.1957 0.2135 -0.0607 0.0837 0.0361 974 GLY C CA 10514 C C . GLY C 666 ? 0.2776 0.2263 0.2494 -0.0657 0.0910 0.0363 974 GLY C C 10515 O O . GLY C 666 ? 0.2778 0.2326 0.2631 -0.0711 0.0916 0.0336 974 GLY C O 10516 N N . THR C 667 ? 0.2601 0.2036 0.2230 -0.0643 0.0965 0.0396 975 THR C N 10517 C CA . THR C 667 ? 0.2746 0.2185 0.2435 -0.0691 0.1042 0.0405 975 THR C CA 10518 C C . THR C 667 ? 0.3234 0.2735 0.2917 -0.0678 0.1096 0.0409 975 THR C C 10519 O O . THR C 667 ? 0.2773 0.2345 0.2570 -0.0718 0.1148 0.0401 975 THR C O 10520 C CB . THR C 667 ? 0.3010 0.2302 0.2601 -0.0700 0.1081 0.0449 975 THR C CB 10521 O OG1 . THR C 667 ? 0.3030 0.2236 0.2443 -0.0642 0.1076 0.0488 975 THR C OG1 10522 C CG2 . THR C 667 ? 0.3052 0.2276 0.2668 -0.0721 0.1043 0.0440 975 THR C CG2 10523 N N . ASP C 668 ? 0.3072 0.2543 0.2622 -0.0622 0.1084 0.0421 976 ASP C N 10524 C CA . ASP C 668 ? 0.2707 0.2227 0.2236 -0.0604 0.1136 0.0417 976 ASP C CA 10525 C C . ASP C 668 ? 0.3006 0.2658 0.2648 -0.0591 0.1097 0.0374 976 ASP C C 10526 O O . ASP C 668 ? 0.2798 0.2447 0.2369 -0.0547 0.1050 0.0364 976 ASP C O 10527 C CB . ASP C 668 ? 0.3374 0.2791 0.2696 -0.0553 0.1137 0.0446 976 ASP C CB 10528 C CG . ASP C 668 ? 0.3419 0.2861 0.2687 -0.0534 0.1200 0.0441 976 ASP C CG 10529 O OD1 . ASP C 668 ? 0.3417 0.2969 0.2815 -0.0548 0.1232 0.0409 976 ASP C OD1 10530 O OD2 . ASP C 668 ? 0.3187 0.2537 0.2278 -0.0503 0.1217 0.0469 976 ASP C OD2 10531 N N . LEU C 669 ? 0.2516 0.2287 0.2341 -0.0631 0.1115 0.0350 977 LEU C N 10532 C CA . LEU C 669 ? 0.2632 0.2537 0.2584 -0.0620 0.1069 0.0315 977 LEU C CA 10533 C C . LEU C 669 ? 0.2259 0.2206 0.2178 -0.0573 0.1090 0.0301 977 LEU C C 10534 O O . LEU C 669 ? 0.2262 0.2274 0.2221 -0.0545 0.1040 0.0278 977 LEU C O 10535 C CB . LEU C 669 ? 0.2990 0.3022 0.3152 -0.0673 0.1073 0.0296 977 LEU C CB 10536 C CG . LEU C 669 ? 0.3301 0.3297 0.3508 -0.0724 0.1045 0.0297 977 LEU C CG 10537 C CD1 . LEU C 669 ? 0.3298 0.3434 0.3716 -0.0777 0.1038 0.0274 977 LEU C CD1 10538 C CD2 . LEU C 669 ? 0.3432 0.3370 0.3566 -0.0702 0.0967 0.0291 977 LEU C CD2 10539 N N . GLU C 670 ? 0.2409 0.2315 0.2253 -0.0565 0.1167 0.0313 978 GLU C N 10540 C CA . GLU C 670 ? 0.2730 0.2651 0.2517 -0.0520 0.1193 0.0294 978 GLU C CA 10541 C C . GLU C 670 ? 0.2836 0.2660 0.2444 -0.0474 0.1141 0.0297 978 GLU C C 10542 O O . GLU C 670 ? 0.2726 0.2581 0.2324 -0.0439 0.1119 0.0270 978 GLU C O 10543 C CB . GLU C 670 ? 0.3256 0.3150 0.2993 -0.0522 0.1293 0.0304 978 GLU C CB 10544 C CG . GLU C 670 ? 0.3682 0.3695 0.3617 -0.0561 0.1347 0.0298 978 GLU C CG 10545 C CD . GLU C 670 ? 0.4254 0.4416 0.4363 -0.0546 0.1322 0.0262 978 GLU C CD 10546 O OE1 . GLU C 670 ? 0.4691 0.4865 0.4767 -0.0503 0.1347 0.0240 978 GLU C OE1 10547 O OE2 . GLU C 670 ? 0.4207 0.4472 0.4485 -0.0577 0.1275 0.0256 978 GLU C OE2 10548 N N . TYR C 671 ? 0.2507 0.2214 0.1979 -0.0476 0.1120 0.0329 979 TYR C N 10549 C CA . TYR C 671 ? 0.2710 0.2330 0.2021 -0.0435 0.1060 0.0337 979 TYR C CA 10550 C C . TYR C 671 ? 0.2533 0.2213 0.1929 -0.0425 0.0979 0.0317 979 TYR C C 10551 O O . TYR C 671 ? 0.2681 0.2360 0.2021 -0.0389 0.0943 0.0300 979 TYR C O 10552 C CB . TYR C 671 ? 0.2920 0.2417 0.2098 -0.0437 0.1050 0.0382 979 TYR C CB 10553 C CG . TYR C 671 ? 0.3219 0.2633 0.2229 -0.0392 0.0985 0.0396 979 TYR C CG 10554 C CD1 . TYR C 671 ? 0.3707 0.3080 0.2568 -0.0356 0.0998 0.0390 979 TYR C CD1 10555 C CD2 . TYR C 671 ? 0.3429 0.2808 0.2434 -0.0384 0.0911 0.0412 979 TYR C CD2 10556 C CE1 . TYR C 671 ? 0.3786 0.3092 0.2500 -0.0317 0.0931 0.0401 979 TYR C CE1 10557 C CE2 . TYR C 671 ? 0.3666 0.2981 0.2534 -0.0341 0.0847 0.0427 979 TYR C CE2 10558 C CZ . TYR C 671 ? 0.3937 0.3219 0.2662 -0.0309 0.0854 0.0422 979 TYR C CZ 10559 O OH . TYR C 671 ? 0.3826 0.3053 0.2421 -0.0269 0.0783 0.0435 979 TYR C OH 10560 N N . LEU C 672 ? 0.2378 0.2109 0.1908 -0.0460 0.0954 0.0317 980 LEU C N 10561 C CA . LEU C 672 ? 0.2297 0.2092 0.1916 -0.0456 0.0880 0.0300 980 LEU C CA 10562 C C . LEU C 672 ? 0.1929 0.1830 0.1636 -0.0434 0.0877 0.0269 980 LEU C C 10563 O O . LEU C 672 ? 0.2251 0.2159 0.1937 -0.0405 0.0826 0.0260 980 LEU C O 10564 C CB . LEU C 672 ? 0.2233 0.2080 0.1992 -0.0504 0.0866 0.0297 980 LEU C CB 10565 C CG . LEU C 672 ? 0.2632 0.2547 0.2481 -0.0503 0.0793 0.0280 980 LEU C CG 10566 C CD1 . LEU C 672 ? 0.2262 0.2084 0.1983 -0.0468 0.0736 0.0296 980 LEU C CD1 10567 C CD2 . LEU C 672 ? 0.2583 0.2548 0.2560 -0.0555 0.0783 0.0270 980 LEU C CD2 10568 N N . LYS C 673 ? 0.2098 0.2080 0.1907 -0.0447 0.0935 0.0253 981 LYS C N 10569 C CA . LYS C 673 ? 0.2365 0.2451 0.2275 -0.0422 0.0939 0.0224 981 LYS C CA 10570 C C . LYS C 673 ? 0.2416 0.2430 0.2182 -0.0375 0.0946 0.0212 981 LYS C C 10571 O O . LYS C 673 ? 0.2318 0.2373 0.2123 -0.0348 0.0912 0.0193 981 LYS C O 10572 C CB . LYS C 673 ? 0.3005 0.3186 0.3050 -0.0440 0.1004 0.0213 981 LYS C CB 10573 C CG . LYS C 673 ? 0.3789 0.4071 0.3941 -0.0406 0.1014 0.0185 981 LYS C CG 10574 C CD . LYS C 673 ? 0.4910 0.5298 0.5215 -0.0422 0.1074 0.0177 981 LYS C CD 10575 C CE . LYS C 673 ? 0.5446 0.5927 0.5902 -0.0472 0.1044 0.0190 981 LYS C CE 10576 N NZ . LYS C 673 ? 0.6184 0.6788 0.6808 -0.0486 0.1094 0.0184 981 LYS C NZ 10577 N N . LYS C 674 ? 0.2501 0.2406 0.2100 -0.0367 0.0991 0.0222 982 LYS C N 10578 C CA . LYS C 674 ? 0.2899 0.2723 0.2333 -0.0326 0.0995 0.0207 982 LYS C CA 10579 C C . LYS C 674 ? 0.2906 0.2681 0.2261 -0.0306 0.0910 0.0213 982 LYS C C 10580 O O . LYS C 674 ? 0.2627 0.2410 0.1969 -0.0278 0.0893 0.0186 982 LYS C O 10581 C CB . LYS C 674 ? 0.3419 0.3132 0.2671 -0.0324 0.1043 0.0226 982 LYS C CB 10582 C CG . LYS C 674 ? 0.4355 0.3974 0.3407 -0.0285 0.1033 0.0210 982 LYS C CG 10583 C CD . LYS C 674 ? 0.5317 0.4833 0.4184 -0.0282 0.1070 0.0236 982 LYS C CD 10584 C CE . LYS C 674 ? 0.6302 0.5727 0.4957 -0.0245 0.1043 0.0219 982 LYS C CE 10585 N NZ . LYS C 674 ? 0.7100 0.6431 0.5568 -0.0240 0.1070 0.0250 982 LYS C NZ 10586 N N . VAL C 675 ? 0.2735 0.2458 0.2044 -0.0319 0.0862 0.0247 983 VAL C N 10587 C CA . VAL C 675 ? 0.2952 0.2632 0.2196 -0.0299 0.0780 0.0259 983 VAL C CA 10588 C C . VAL C 675 ? 0.2874 0.2651 0.2270 -0.0299 0.0737 0.0244 983 VAL C C 10589 O O . VAL C 675 ? 0.2628 0.2391 0.1984 -0.0273 0.0695 0.0236 983 VAL C O 10590 C CB . VAL C 675 ? 0.3231 0.2834 0.2405 -0.0307 0.0743 0.0300 983 VAL C CB 10591 C CG1 . VAL C 675 ? 0.3282 0.2849 0.2405 -0.0281 0.0657 0.0314 983 VAL C CG1 10592 C CG2 . VAL C 675 ? 0.3804 0.3311 0.2821 -0.0301 0.0781 0.0322 983 VAL C CG2 10593 N N . ARG C 676 ? 0.2447 0.2325 0.2017 -0.0329 0.0745 0.0241 984 ARG C N 10594 C CA . ARG C 676 ? 0.2226 0.2211 0.1946 -0.0327 0.0705 0.0228 984 ARG C CA 10595 C C . ARG C 676 ? 0.2716 0.2754 0.2487 -0.0299 0.0731 0.0199 984 ARG C C 10596 O O . ARG C 676 ? 0.2659 0.2733 0.2481 -0.0279 0.0693 0.0194 984 ARG C O 10597 C CB . ARG C 676 ? 0.2337 0.2430 0.2230 -0.0364 0.0704 0.0227 984 ARG C CB 10598 C CG . ARG C 676 ? 0.2180 0.2219 0.2041 -0.0393 0.0673 0.0248 984 ARG C CG 10599 C CD . ARG C 676 ? 0.2084 0.2227 0.2108 -0.0433 0.0670 0.0238 984 ARG C CD 10600 N NE . ARG C 676 ? 0.1854 0.2125 0.2018 -0.0425 0.0627 0.0225 984 ARG C NE 10601 C CZ . ARG C 676 ? 0.1660 0.1942 0.1832 -0.0418 0.0567 0.0229 984 ARG C CZ 10602 N NH1 . ARG C 676 ? 0.1960 0.2129 0.2008 -0.0416 0.0544 0.0244 984 ARG C NH1 10603 N NH2 . ARG C 676 ? 0.1985 0.2394 0.2290 -0.0408 0.0531 0.0220 984 ARG C NH2 10604 N N . GLY C 677 ? 0.2863 0.2903 0.2625 -0.0294 0.0800 0.0180 985 GLY C N 10605 C CA . GLY C 677 ? 0.2940 0.3013 0.2743 -0.0262 0.0836 0.0146 985 GLY C CA 10606 C C . GLY C 677 ? 0.2885 0.2847 0.2513 -0.0232 0.0819 0.0135 985 GLY C C 10607 O O . GLY C 677 ? 0.2515 0.2514 0.2213 -0.0196 0.0773 0.0110 985 GLY C O 10608 N N . LYS C 678 ? 0.2406 0.2246 0.1832 -0.0235 0.0806 0.0152 986 LYS C N 10609 C CA . LYS C 678 ? 0.3162 0.2899 0.2411 -0.0205 0.0754 0.0141 986 LYS C CA 10610 C C . LYS C 678 ? 0.2955 0.2728 0.2283 -0.0185 0.0637 0.0150 986 LYS C C 10611 O O . LYS C 678 ? 0.2682 0.2456 0.2021 -0.0154 0.0584 0.0121 986 LYS C O 10612 C CB . LYS C 678 ? 0.3840 0.3456 0.2876 -0.0211 0.0755 0.0171 986 LYS C CB 10613 C CG . LYS C 678 ? 0.4514 0.4020 0.3336 -0.0183 0.0711 0.0158 986 LYS C CG 10614 C CD . LYS C 678 ? 0.5124 0.4543 0.3778 -0.0181 0.0705 0.0186 986 LYS C CD 10615 C CE . LYS C 678 ? 0.5777 0.5103 0.4223 -0.0152 0.0650 0.0168 986 LYS C CE 10616 N NZ . LYS C 678 ? 0.6321 0.5576 0.4614 -0.0145 0.0634 0.0204 986 LYS C NZ 10617 N N . VAL C 679 ? 0.2453 0.2253 0.1839 -0.0205 0.0602 0.0188 987 VAL C N 10618 C CA . VAL C 679 ? 0.1995 0.1833 0.1459 -0.0187 0.0503 0.0201 987 VAL C CA 10619 C C . VAL C 679 ? 0.2188 0.2142 0.1842 -0.0169 0.0485 0.0177 987 VAL C C 10620 O O . VAL C 679 ? 0.2459 0.2419 0.2140 -0.0138 0.0420 0.0168 987 VAL C O 10621 C CB . VAL C 679 ? 0.2178 0.2020 0.1668 -0.0213 0.0484 0.0239 987 VAL C CB 10622 C CG1 . VAL C 679 ? 0.2623 0.2516 0.2204 -0.0192 0.0395 0.0250 987 VAL C CG1 10623 C CG2 . VAL C 679 ? 0.2556 0.2269 0.1857 -0.0222 0.0495 0.0271 987 VAL C CG2 10624 N N . TRP C 680 ? 0.2307 0.2355 0.2099 -0.0187 0.0542 0.0171 988 TRP C N 10625 C CA . TRP C 680 ? 0.2041 0.2206 0.2023 -0.0166 0.0529 0.0158 988 TRP C CA 10626 C C . TRP C 680 ? 0.2131 0.2269 0.2106 -0.0126 0.0527 0.0123 988 TRP C C 10627 O O . TRP C 680 ? 0.2320 0.2500 0.2394 -0.0098 0.0473 0.0122 988 TRP C O 10628 C CB . TRP C 680 ? 0.2391 0.2658 0.2511 -0.0191 0.0600 0.0156 988 TRP C CB 10629 C CG . TRP C 680 ? 0.2511 0.2914 0.2840 -0.0168 0.0583 0.0154 988 TRP C CG 10630 C CD1 . TRP C 680 ? 0.3065 0.3521 0.3500 -0.0141 0.0634 0.0131 988 TRP C CD1 10631 C CD2 . TRP C 680 ? 0.2371 0.2871 0.2824 -0.0165 0.0512 0.0179 988 TRP C CD2 10632 N NE1 . TRP C 680 ? 0.3060 0.3641 0.3683 -0.0120 0.0595 0.0147 988 TRP C NE1 10633 C CE2 . TRP C 680 ? 0.2773 0.3385 0.3402 -0.0135 0.0519 0.0178 988 TRP C CE2 10634 C CE3 . TRP C 680 ? 0.2643 0.3143 0.3069 -0.0181 0.0448 0.0204 988 TRP C CE3 10635 C CZ2 . TRP C 680 ? 0.2638 0.3363 0.3406 -0.0122 0.0459 0.0205 988 TRP C CZ2 10636 C CZ3 . TRP C 680 ? 0.2373 0.2982 0.2929 -0.0170 0.0392 0.0224 988 TRP C CZ3 10637 C CH2 . TRP C 680 ? 0.2181 0.2903 0.2902 -0.0141 0.0396 0.0227 988 TRP C CH2 10638 N N . LYS C 681 ? 0.2405 0.2465 0.2258 -0.0125 0.0591 0.0092 989 LYS C N 10639 C CA . LYS C 681 ? 0.2552 0.2568 0.2379 -0.0091 0.0596 0.0047 989 LYS C CA 10640 C C . LYS C 681 ? 0.2637 0.2568 0.2348 -0.0076 0.0508 0.0040 989 LYS C C 10641 O O . LYS C 681 ? 0.2605 0.2544 0.2389 -0.0051 0.0463 0.0020 989 LYS C O 10642 C CB . LYS C 681 ? 0.3327 0.3278 0.3036 -0.0095 0.0696 0.0011 989 LYS C CB 10643 C CG . LYS C 681 ? 0.4242 0.4127 0.3896 -0.0062 0.0704 -0.0048 989 LYS C CG 10644 C CD . LYS C 681 ? 0.5545 0.5343 0.5027 -0.0065 0.0800 -0.0086 989 LYS C CD 10645 C CE . LYS C 681 ? 0.6195 0.5909 0.5594 -0.0035 0.0797 -0.0155 989 LYS C CE 10646 N NZ . LYS C 681 ? 0.6298 0.5952 0.5614 -0.0032 0.0677 -0.0159 989 LYS C NZ 10647 N N . GLN C 682 ? 0.2149 0.1999 0.1690 -0.0093 0.0482 0.0061 990 GLN C N 10648 C CA A GLN C 682 ? 0.2378 0.2148 0.1794 -0.0080 0.0399 0.0056 990 GLN C CA 10649 C CA B GLN C 682 ? 0.2350 0.2122 0.1772 -0.0079 0.0400 0.0053 990 GLN C CA 10650 C C . GLN C 682 ? 0.2387 0.2207 0.1922 -0.0068 0.0306 0.0082 990 GLN C C 10651 O O . GLN C 682 ? 0.2505 0.2286 0.2002 -0.0054 0.0236 0.0069 990 GLN C O 10652 C CB A GLN C 682 ? 0.2586 0.2264 0.1798 -0.0096 0.0396 0.0083 990 GLN C CB 10653 C CB B GLN C 682 ? 0.2682 0.2348 0.1876 -0.0092 0.0405 0.0068 990 GLN C CB 10654 C CG A GLN C 682 ? 0.2992 0.2587 0.2026 -0.0101 0.0475 0.0055 990 GLN C CG 10655 C CG B GLN C 682 ? 0.3082 0.2680 0.2132 -0.0094 0.0491 0.0028 990 GLN C CG 10656 C CD A GLN C 682 ? 0.3412 0.2948 0.2357 -0.0081 0.0455 -0.0007 990 GLN C CD 10657 C CD B GLN C 682 ? 0.3484 0.2989 0.2318 -0.0110 0.0524 0.0058 990 GLN C CD 10658 O OE1 A GLN C 682 ? 0.3835 0.3388 0.2838 -0.0071 0.0516 -0.0056 990 GLN C OE1 10659 O OE1 B GLN C 682 ? 0.4283 0.3744 0.3011 -0.0117 0.0617 0.0040 990 GLN C OE1 10660 N NE2 A GLN C 682 ? 0.3446 0.2914 0.2255 -0.0073 0.0369 -0.0009 990 GLN C NE2 10661 N NE2 B GLN C 682 ? 0.3253 0.2725 0.2021 -0.0112 0.0454 0.0106 990 GLN C NE2 10662 N N . ARG C 683 ? 0.1909 0.1820 0.1587 -0.0075 0.0304 0.0118 991 ARG C N 10663 C CA . ARG C 683 ? 0.2720 0.2680 0.2505 -0.0060 0.0226 0.0145 991 ARG C CA 10664 C C . ARG C 683 ? 0.2537 0.2523 0.2435 -0.0036 0.0207 0.0116 991 ARG C C 10665 O O . ARG C 683 ? 0.2815 0.2813 0.2774 -0.0022 0.0142 0.0129 991 ARG C O 10666 C CB . ARG C 683 ? 0.3505 0.3553 0.3404 -0.0072 0.0230 0.0184 991 ARG C CB 10667 C CG . ARG C 683 ? 0.3114 0.3263 0.3174 -0.0068 0.0271 0.0177 991 ARG C CG 10668 C CD . ARG C 683 ? 0.2910 0.3133 0.3032 -0.0095 0.0299 0.0201 991 ARG C CD 10669 N NE . ARG C 683 ? 0.2719 0.3032 0.2978 -0.0090 0.0347 0.0187 991 ARG C NE 10670 C CZ . ARG C 683 ? 0.2823 0.3248 0.3241 -0.0078 0.0327 0.0207 991 ARG C CZ 10671 N NH1 . ARG C 683 ? 0.2520 0.2981 0.2971 -0.0073 0.0265 0.0239 991 ARG C NH1 10672 N NH2 . ARG C 683 ? 0.3054 0.3558 0.3598 -0.0068 0.0372 0.0197 991 ARG C NH2 10673 N N . ILE C 684 ? 0.2380 0.2371 0.2310 -0.0029 0.0271 0.0078 992 ILE C N 10674 C CA . ILE C 684 ? 0.2390 0.2388 0.2425 -0.0004 0.0266 0.0046 992 ILE C CA 10675 C C . ILE C 684 ? 0.2458 0.2345 0.2356 -0.0002 0.0257 -0.0013 992 ILE C C 10676 O O . ILE C 684 ? 0.2660 0.2521 0.2596 0.0008 0.0202 -0.0033 992 ILE C O 10677 C CB . ILE C 684 ? 0.2574 0.2643 0.2746 0.0009 0.0341 0.0036 992 ILE C CB 10678 C CG1 . ILE C 684 ? 0.2944 0.3133 0.3250 0.0004 0.0339 0.0091 992 ILE C CG1 10679 C CG2 . ILE C 684 ? 0.3095 0.3158 0.3382 0.0040 0.0338 0.0007 992 ILE C CG2 10680 C CD1 . ILE C 684 ? 0.2778 0.3013 0.3173 0.0015 0.0262 0.0134 992 ILE C CD1 10681 N N . SER C 685 ? 0.2389 0.2209 0.2123 -0.0014 0.0311 -0.0043 993 SER C N 10682 C CA . SER C 685 ? 0.2921 0.2637 0.2509 -0.0010 0.0315 -0.0109 993 SER C CA 10683 C C . SER C 685 ? 0.2888 0.2528 0.2309 -0.0022 0.0229 -0.0110 993 SER C C 10684 O O . SER C 685 ? 0.2793 0.2356 0.2116 -0.0020 0.0200 -0.0166 993 SER C O 10685 C CB . SER C 685 ? 0.3300 0.2975 0.2776 -0.0014 0.0420 -0.0141 993 SER C CB 10686 O OG . SER C 685 ? 0.3532 0.3191 0.2876 -0.0036 0.0438 -0.0101 993 SER C OG 10687 N N . SER C 686 ? 0.2670 0.2331 0.2060 -0.0032 0.0189 -0.0049 994 SER C N 10688 C CA . SER C 686 ? 0.2376 0.1981 0.1633 -0.0036 0.0102 -0.0037 994 SER C CA 10689 C C . SER C 686 ? 0.2427 0.2073 0.1826 -0.0028 0.0012 -0.0028 994 SER C C 10690 O O . SER C 686 ? 0.2402 0.2116 0.1990 -0.0020 0.0022 -0.0021 994 SER C O 10691 C CB . SER C 686 ? 0.2362 0.1967 0.1542 -0.0045 0.0105 0.0027 994 SER C CB 10692 O OG . SER C 686 ? 0.2668 0.2352 0.2005 -0.0042 0.0069 0.0079 994 SER C OG 10693 N N . PRO C 687 ? 0.2364 0.1973 0.1680 -0.0030 -0.0077 -0.0024 995 PRO C N 10694 C CA . PRO C 687 ? 0.2246 0.1905 0.1718 -0.0026 -0.0156 -0.0009 995 PRO C CA 10695 C C . PRO C 687 ? 0.2482 0.2219 0.2075 -0.0018 -0.0170 0.0067 995 PRO C C 10696 O O . PRO C 687 ? 0.2154 0.1938 0.1887 -0.0012 -0.0222 0.0085 995 PRO C O 10697 C CB . PRO C 687 ? 0.2551 0.2154 0.1894 -0.0031 -0.0248 -0.0027 995 PRO C CB 10698 C CG . PRO C 687 ? 0.2940 0.2453 0.2050 -0.0037 -0.0213 -0.0070 995 PRO C CG 10699 C CD . PRO C 687 ? 0.2978 0.2501 0.2065 -0.0036 -0.0109 -0.0040 995 PRO C CD 10700 N N . LEU C 688 ? 0.2329 0.2075 0.1871 -0.0019 -0.0122 0.0108 996 LEU C N 10701 C CA . LEU C 688 ? 0.2131 0.1929 0.1746 -0.0013 -0.0143 0.0173 996 LEU C CA 10702 C C . LEU C 688 ? 0.2140 0.2026 0.1959 -0.0003 -0.0153 0.0195 996 LEU C C 10703 O O . LEU C 688 ? 0.2237 0.2154 0.2124 0.0007 -0.0202 0.0233 996 LEU C O 10704 C CB . LEU C 688 ? 0.2064 0.1853 0.1608 -0.0022 -0.0079 0.0202 996 LEU C CB 10705 C CG . LEU C 688 ? 0.2008 0.1820 0.1582 -0.0016 -0.0099 0.0260 996 LEU C CG 10706 C CD1 . LEU C 688 ? 0.2087 0.1857 0.1588 -0.0001 -0.0175 0.0283 996 LEU C CD1 10707 C CD2 . LEU C 688 ? 0.1618 0.1406 0.1119 -0.0033 -0.0033 0.0279 996 LEU C CD2 10708 N N . PHE C 689 ? 0.1690 0.1615 0.1605 -0.0003 -0.0102 0.0177 997 PHE C N 10709 C CA . PHE C 689 ? 0.1795 0.1804 0.1891 0.0009 -0.0104 0.0206 997 PHE C CA 10710 C C . PHE C 689 ? 0.1883 0.1891 0.2085 0.0016 -0.0122 0.0176 997 PHE C C 10711 O O . PHE C 689 ? 0.2263 0.2332 0.2615 0.0029 -0.0109 0.0198 997 PHE C O 10712 C CB . PHE C 689 ? 0.1939 0.2007 0.2088 0.0007 -0.0039 0.0221 997 PHE C CB 10713 C CG . PHE C 689 ? 0.1877 0.1951 0.1955 -0.0005 -0.0023 0.0252 997 PHE C CG 10714 C CD1 . PHE C 689 ? 0.1748 0.1872 0.1887 0.0002 -0.0045 0.0297 997 PHE C CD1 10715 C CD2 . PHE C 689 ? 0.1845 0.1865 0.1790 -0.0023 0.0019 0.0235 997 PHE C CD2 10716 C CE1 . PHE C 689 ? 0.1827 0.1942 0.1899 -0.0011 -0.0028 0.0318 997 PHE C CE1 10717 C CE2 . PHE C 689 ? 0.2018 0.2032 0.1905 -0.0038 0.0037 0.0263 997 PHE C CE2 10718 C CZ . PHE C 689 ? 0.1834 0.1892 0.1785 -0.0032 0.0012 0.0301 997 PHE C CZ 10719 N N . ASN C 690 ? 0.1863 0.1799 0.1984 0.0008 -0.0152 0.0125 998 ASN C N 10720 C CA . ASN C 690 ? 0.2178 0.2093 0.2390 0.0009 -0.0165 0.0083 998 ASN C CA 10721 C C . ASN C 690 ? 0.1944 0.1876 0.2254 0.0007 -0.0240 0.0103 998 ASN C C 10722 O O . ASN C 690 ? 0.1700 0.1590 0.1939 -0.0006 -0.0302 0.0078 998 ASN C O 10723 C CB . ASN C 690 ? 0.2123 0.1946 0.2194 -0.0002 -0.0154 0.0005 998 ASN C CB 10724 C CG . ASN C 690 ? 0.2797 0.2588 0.2965 0.0000 -0.0138 -0.0049 998 ASN C CG 10725 O OD1 . ASN C 690 ? 0.2508 0.2309 0.2806 -0.0002 -0.0182 -0.0046 998 ASN C OD1 10726 N ND2 . ASN C 690 ? 0.3522 0.3272 0.3634 0.0005 -0.0068 -0.0098 998 ASN C ND2 10727 N N . THR C 691 ? 0.2025 0.2028 0.2501 0.0020 -0.0234 0.0154 999 THR C N 10728 C CA . THR C 691 ? 0.2048 0.2082 0.2633 0.0018 -0.0293 0.0188 999 THR C CA 10729 C C . THR C 691 ? 0.1846 0.1833 0.2495 0.0002 -0.0336 0.0137 999 THR C C 10730 O O . THR C 691 ? 0.2165 0.2159 0.2853 -0.0011 -0.0402 0.0143 999 THR C O 10731 C CB . THR C 691 ? 0.2201 0.2318 0.2934 0.0038 -0.0267 0.0258 999 THR C CB 10732 O OG1 . THR C 691 ? 0.2453 0.2583 0.3266 0.0050 -0.0213 0.0254 999 THR C OG1 10733 C CG2 . THR C 691 ? 0.2198 0.2356 0.2858 0.0047 -0.0248 0.0303 999 THR C CG2 10734 N N . LYS C 692 ? 0.1459 0.1400 0.2128 0.0000 -0.0298 0.0086 1000 LYS C N 10735 C CA . LYS C 692 ? 0.1938 0.1817 0.2657 -0.0021 -0.0335 0.0025 1000 LYS C CA 10736 C C . LYS C 692 ? 0.1954 0.1767 0.2499 -0.0045 -0.0394 -0.0040 1000 LYS C C 10737 O O . LYS C 692 ? 0.1797 0.1598 0.2378 -0.0068 -0.0468 -0.0063 1000 LYS C O 10738 C CB . LYS C 692 ? 0.2277 0.2109 0.3052 -0.0012 -0.0271 -0.0019 1000 LYS C CB 10739 C CG . LYS C 692 ? 0.2557 0.2314 0.3403 -0.0036 -0.0303 -0.0087 1000 LYS C CG 10740 C CD . LYS C 692 ? 0.2614 0.2415 0.3652 -0.0047 -0.0348 -0.0038 1000 LYS C CD 10741 C CE . LYS C 692 ? 0.3029 0.2752 0.4160 -0.0076 -0.0377 -0.0107 1000 LYS C CE 10742 N NZ . LYS C 692 ? 0.3017 0.2787 0.4357 -0.0089 -0.0409 -0.0050 1000 LYS C NZ 10743 N N . GLN C 693 ? 0.1756 0.1532 0.2114 -0.0040 -0.0362 -0.0066 1001 GLN C N 10744 C CA . GLN C 693 ? 0.2293 0.2008 0.2460 -0.0058 -0.0417 -0.0115 1001 GLN C CA 10745 C C . GLN C 693 ? 0.2212 0.1974 0.2379 -0.0062 -0.0501 -0.0064 1001 GLN C C 10746 O O . GLN C 693 ? 0.2404 0.2142 0.2528 -0.0081 -0.0584 -0.0099 1001 GLN C O 10747 C CB . GLN C 693 ? 0.2689 0.2361 0.2655 -0.0049 -0.0357 -0.0132 1001 GLN C CB 10748 C CG . GLN C 693 ? 0.3421 0.3019 0.3164 -0.0064 -0.0407 -0.0181 1001 GLN C CG 10749 C CD . GLN C 693 ? 0.4165 0.3710 0.3712 -0.0057 -0.0331 -0.0200 1001 GLN C CD 10750 O OE1 . GLN C 693 ? 0.4460 0.4029 0.4056 -0.0043 -0.0241 -0.0183 1001 GLN C OE1 10751 N NE2 . GLN C 693 ? 0.4634 0.4113 0.3962 -0.0066 -0.0368 -0.0232 1001 GLN C NE2 10752 N N . TYR C 694 ? 0.1891 0.1723 0.2112 -0.0042 -0.0478 0.0016 1002 TYR C N 10753 C CA . TYR C 694 ? 0.1939 0.1818 0.2168 -0.0036 -0.0542 0.0070 1002 TYR C CA 10754 C C . TYR C 694 ? 0.2030 0.1948 0.2431 -0.0051 -0.0614 0.0073 1002 TYR C C 10755 O O . TYR C 694 ? 0.2260 0.2183 0.2634 -0.0060 -0.0698 0.0068 1002 TYR C O 10756 C CB . TYR C 694 ? 0.1437 0.1377 0.1711 -0.0012 -0.0493 0.0149 1002 TYR C CB 10757 C CG . TYR C 694 ? 0.1792 0.1767 0.2055 0.0000 -0.0546 0.0204 1002 TYR C CG 10758 C CD1 . TYR C 694 ? 0.2028 0.1967 0.2119 0.0010 -0.0546 0.0219 1002 TYR C CD1 10759 C CD2 . TYR C 694 ? 0.1878 0.1919 0.2311 0.0005 -0.0589 0.0242 1002 TYR C CD2 10760 C CE1 . TYR C 694 ? 0.2015 0.1979 0.2104 0.0027 -0.0592 0.0272 1002 TYR C CE1 10761 C CE2 . TYR C 694 ? 0.2128 0.2203 0.2565 0.0021 -0.0632 0.0292 1002 TYR C CE2 10762 C CZ . TYR C 694 ? 0.2217 0.2252 0.2481 0.0035 -0.0635 0.0307 1002 TYR C CZ 10763 O OH . TYR C 694 ? 0.2510 0.2568 0.2767 0.0052 -0.0623 0.0332 1002 TYR C OH 10764 N N . THR C 695 ? 0.1802 0.1752 0.2388 -0.0051 -0.0580 0.0085 1003 THR C N 10765 C CA . THR C 695 ? 0.2032 0.2020 0.2807 -0.0068 -0.0633 0.0094 1003 THR C CA 10766 C C . THR C 695 ? 0.2043 0.1971 0.2776 -0.0104 -0.0708 0.0009 1003 THR C C 10767 O O . THR C 695 ? 0.2120 0.2082 0.2927 -0.0123 -0.0792 0.0010 1003 THR C O 10768 C CB . THR C 695 ? 0.1820 0.1832 0.2782 -0.0063 -0.0572 0.0120 1003 THR C CB 10769 O OG1 . THR C 695 ? 0.1967 0.2038 0.2949 -0.0031 -0.0511 0.0195 1003 THR C OG1 10770 C CG2 . THR C 695 ? 0.1819 0.1870 0.2989 -0.0084 -0.0620 0.0136 1003 THR C CG2 10771 N N . MET C 696 ? 0.1695 0.1537 0.2309 -0.0114 -0.0679 -0.0067 1004 MET C N 10772 C CA . MET C 696 ? 0.2345 0.2118 0.2894 -0.0150 -0.0748 -0.0161 1004 MET C CA 10773 C C . MET C 696 ? 0.2548 0.2318 0.2924 -0.0157 -0.0837 -0.0173 1004 MET C C 10774 O O . MET C 696 ? 0.2440 0.2204 0.2829 -0.0188 -0.0933 -0.0220 1004 MET C O 10775 C CB . MET C 696 ? 0.2462 0.2135 0.2913 -0.0154 -0.0684 -0.0242 1004 MET C CB 10776 C CG . MET C 696 ? 0.2545 0.2214 0.3191 -0.0148 -0.0613 -0.0236 1004 MET C CG 10777 S SD . MET C 696 ? 0.2968 0.2525 0.3517 -0.0141 -0.0525 -0.0325 1004 MET C SD 10778 C CE . MET C 696 ? 0.2860 0.2313 0.3277 -0.0188 -0.0611 -0.0452 1004 MET C CE 10779 N N . GLU C 697 ? 0.2837 0.2611 0.3054 -0.0128 -0.0808 -0.0129 1005 GLU C N 10780 C CA . GLU C 697 ? 0.3106 0.2879 0.3161 -0.0126 -0.0889 -0.0123 1005 GLU C CA 10781 C C . GLU C 697 ? 0.2849 0.2719 0.3055 -0.0120 -0.0964 -0.0053 1005 GLU C C 10782 O O . GLU C 697 ? 0.2331 0.2216 0.2494 -0.0131 -0.1068 -0.0065 1005 GLU C O 10783 C CB . GLU C 697 ? 0.3519 0.3256 0.3365 -0.0097 -0.0828 -0.0093 1005 GLU C CB 10784 C CG . GLU C 697 ? 0.4229 0.3868 0.3892 -0.0105 -0.0766 -0.0168 1005 GLU C CG 10785 C CD . GLU C 697 ? 0.4970 0.4538 0.4482 -0.0132 -0.0844 -0.0257 1005 GLU C CD 10786 O OE1 . GLU C 697 ? 0.5119 0.4718 0.4623 -0.0142 -0.0955 -0.0250 1005 GLU C OE1 10787 O OE2 . GLU C 697 ? 0.5938 0.5423 0.5340 -0.0142 -0.0795 -0.0336 1005 GLU C OE2 10788 N N . LEU C 698 ? 0.2554 0.2493 0.2937 -0.0100 -0.0911 0.0019 1006 LEU C N 10789 C CA . LEU C 698 ? 0.2684 0.2720 0.3248 -0.0092 -0.0962 0.0085 1006 LEU C CA 10790 C C . LEU C 698 ? 0.2119 0.2174 0.2828 -0.0130 -0.1026 0.0040 1006 LEU C C 10791 O O . LEU C 698 ? 0.2151 0.2247 0.2883 -0.0129 -0.1065 0.0055 1006 LEU C O 10792 C CB . LEU C 698 ? 0.2658 0.2750 0.3372 -0.0067 -0.0871 0.0157 1006 LEU C CB 10793 C CG . LEU C 698 ? 0.2748 0.2901 0.3555 -0.0047 -0.0819 0.0222 1006 LEU C CG 10794 C CD1 . LEU C 698 ? 0.2675 0.2832 0.3347 -0.0024 -0.0837 0.0245 1006 LEU C CD1 10795 C CD2 . LEU C 698 ? 0.2527 0.2701 0.3389 -0.0026 -0.0711 0.0271 1006 LEU C CD2 10796 N N . GLU C 699 ? 0.1788 0.1805 0.2587 -0.0161 -0.1012 -0.0016 1007 GLU C N 10797 C CA . GLU C 699 ? 0.1665 0.1682 0.2601 -0.0203 -0.1067 -0.0068 1007 GLU C CA 10798 C C . GLU C 699 ? 0.2333 0.2313 0.3113 -0.0228 -0.1160 -0.0141 1007 GLU C C 10799 O O . GLU C 699 ? 0.1986 0.2010 0.2855 -0.0245 -0.1207 -0.0144 1007 GLU C O 10800 C CB . GLU C 699 ? 0.2116 0.2075 0.3158 -0.0227 -0.1014 -0.0118 1007 GLU C CB 10801 C CG . GLU C 699 ? 0.2233 0.2246 0.3461 -0.0201 -0.0922 -0.0033 1007 GLU C CG 10802 C CD . GLU C 699 ? 0.2571 0.2519 0.3874 -0.0208 -0.0844 -0.0065 1007 GLU C CD 10803 O OE1 . GLU C 699 ? 0.2613 0.2469 0.3764 -0.0210 -0.0815 -0.0136 1007 GLU C OE1 10804 O OE2 . GLU C 699 ? 0.2384 0.2372 0.3901 -0.0209 -0.0808 -0.0014 1007 GLU C OE2 10805 N N . ARG C 700 ? 0.2765 0.2664 0.3305 -0.0229 -0.1182 -0.0199 1008 ARG C N 10806 C CA . ARG C 700 ? 0.3215 0.3076 0.3566 -0.0246 -0.1259 -0.0262 1008 ARG C CA 10807 C C . ARG C 700 ? 0.2726 0.2675 0.3068 -0.0219 -0.1297 -0.0187 1008 ARG C C 10808 O O . ARG C 700 ? 0.2676 0.2656 0.3018 -0.0238 -0.1367 -0.0214 1008 ARG C O 10809 C CB . ARG C 700 ? 0.3922 0.3675 0.3981 -0.0239 -0.1244 -0.0317 1008 ARG C CB 10810 C CG . ARG C 700 ? 0.5040 0.4743 0.4883 -0.0258 -0.1313 -0.0390 1008 ARG C CG 10811 C CD . ARG C 700 ? 0.6143 0.5750 0.5672 -0.0237 -0.1281 -0.0415 1008 ARG C CD 10812 N NE . ARG C 700 ? 0.7022 0.6562 0.6538 -0.0226 -0.1149 -0.0436 1008 ARG C NE 10813 C CZ . ARG C 700 ? 0.7712 0.7158 0.7179 -0.0249 -0.1106 -0.0536 1008 ARG C CZ 10814 N NH1 . ARG C 700 ? 0.8000 0.7397 0.7411 -0.0291 -0.1195 -0.0636 1008 ARG C NH1 10815 N NH2 . ARG C 700 ? 0.7818 0.7223 0.7298 -0.0230 -0.0976 -0.0538 1008 ARG C NH2 10816 N N . LEU C 701 ? 0.2593 0.2584 0.2938 -0.0174 -0.1245 -0.0095 1009 LEU C N 10817 C CA . LEU C 701 ? 0.2828 0.2890 0.3168 -0.0142 -0.1261 -0.0024 1009 LEU C CA 10818 C C . LEU C 701 ? 0.2669 0.2823 0.3249 -0.0151 -0.1275 0.0005 1009 LEU C C 10819 O O . LEU C 701 ? 0.2775 0.2980 0.3358 -0.0151 -0.1337 0.0010 1009 LEU C O 10820 C CB . LEU C 701 ? 0.2779 0.2848 0.3069 -0.0094 -0.1181 0.0056 1009 LEU C CB 10821 C CG . LEU C 701 ? 0.2727 0.2849 0.2985 -0.0055 -0.1176 0.0125 1009 LEU C CG 10822 C CD1 . LEU C 701 ? 0.2829 0.2931 0.2903 -0.0055 -0.1254 0.0099 1009 LEU C CD1 10823 C CD2 . LEU C 701 ? 0.2690 0.2791 0.2882 -0.0016 -0.1086 0.0185 1009 LEU C CD2 10824 N N . TYR C 702 ? 0.2201 0.2376 0.2977 -0.0157 -0.1216 0.0027 1010 TYR C N 10825 C CA . TYR C 702 ? 0.2241 0.2486 0.3241 -0.0169 -0.1214 0.0054 1010 TYR C CA 10826 C C . TYR C 702 ? 0.2542 0.2795 0.3583 -0.0214 -0.1307 -0.0015 1010 TYR C C 10827 O O . TYR C 702 ? 0.2503 0.2828 0.3642 -0.0217 -0.1347 0.0006 1010 TYR C O 10828 C CB . TYR C 702 ? 0.2226 0.2465 0.3397 -0.0174 -0.1133 0.0075 1010 TYR C CB 10829 C CG . TYR C 702 ? 0.2099 0.2353 0.3274 -0.0132 -0.1031 0.0152 1010 TYR C CG 10830 C CD1 . TYR C 702 ? 0.2048 0.2336 0.3145 -0.0095 -0.1008 0.0205 1010 TYR C CD1 10831 C CD2 . TYR C 702 ? 0.2171 0.2403 0.3426 -0.0131 -0.0955 0.0168 1010 TYR C CD2 10832 C CE1 . TYR C 702 ? 0.1985 0.2278 0.3071 -0.0062 -0.0910 0.0261 1010 TYR C CE1 10833 C CE2 . TYR C 702 ? 0.1974 0.2219 0.3213 -0.0097 -0.0861 0.0231 1010 TYR C CE2 10834 C CZ . TYR C 702 ? 0.2055 0.2327 0.3203 -0.0065 -0.0839 0.0272 1010 TYR C CZ 10835 O OH . TYR C 702 ? 0.2060 0.2339 0.3180 -0.0038 -0.0744 0.0318 1010 TYR C OH 10836 N N . LEU C 703 ? 0.2695 0.2873 0.3660 -0.0251 -0.1338 -0.0102 1011 LEU C N 10837 C CA . LEU C 703 ? 0.2764 0.2935 0.3748 -0.0301 -0.1420 -0.0183 1011 LEU C CA 10838 C C . LEU C 703 ? 0.3060 0.3260 0.3882 -0.0298 -0.1508 -0.0199 1011 LEU C C 10839 O O . LEU C 703 ? 0.3092 0.3342 0.3983 -0.0328 -0.1580 -0.0228 1011 LEU C O 10840 C CB . LEU C 703 ? 0.3160 0.3225 0.4079 -0.0340 -0.1416 -0.0283 1011 LEU C CB 10841 C CG . LEU C 703 ? 0.3505 0.3545 0.4624 -0.0351 -0.1338 -0.0276 1011 LEU C CG 10842 C CD1 . LEU C 703 ? 0.3843 0.3764 0.4874 -0.0381 -0.1321 -0.0377 1011 LEU C CD1 10843 C CD2 . LEU C 703 ? 0.3741 0.3840 0.5100 -0.0378 -0.1350 -0.0261 1011 LEU C CD2 10844 N N . GLN C 704 ? 0.3500 0.3674 0.4110 -0.0261 -0.1500 -0.0175 1012 GLN C N 10845 C CA . GLN C 704 ? 0.3937 0.4145 0.4394 -0.0247 -0.1573 -0.0171 1012 GLN C CA 10846 C C . GLN C 704 ? 0.3413 0.3738 0.4032 -0.0222 -0.1587 -0.0091 1012 GLN C C 10847 O O . GLN C 704 ? 0.3294 0.3683 0.3923 -0.0234 -0.1671 -0.0104 1012 GLN C O 10848 C CB . GLN C 704 ? 0.4758 0.4904 0.4960 -0.0208 -0.1544 -0.0149 1012 GLN C CB 10849 C CG . GLN C 704 ? 0.5760 0.5787 0.5753 -0.0232 -0.1538 -0.0237 1012 GLN C CG 10850 C CD . GLN C 704 ? 0.6650 0.6614 0.6387 -0.0192 -0.1499 -0.0208 1012 GLN C CD 10851 O OE1 . GLN C 704 ? 0.6950 0.6961 0.6642 -0.0151 -0.1497 -0.0131 1012 GLN C OE1 10852 N NE2 . GLN C 704 ? 0.6848 0.6702 0.6420 -0.0204 -0.1459 -0.0271 1012 GLN C NE2 10853 N N . MET C 705 ? 0.3086 0.3439 0.3828 -0.0186 -0.1503 -0.0012 1013 MET C N 10854 C CA . MET C 705 ? 0.3050 0.3504 0.3952 -0.0160 -0.1496 0.0060 1013 MET C CA 10855 C C . MET C 705 ? 0.3077 0.3593 0.4190 -0.0203 -0.1545 0.0033 1013 MET C C 10856 O O . MET C 705 ? 0.3007 0.3610 0.4191 -0.0200 -0.1606 0.0050 1013 MET C O 10857 C CB . MET C 705 ? 0.2897 0.3354 0.3891 -0.0124 -0.1382 0.0132 1013 MET C CB 10858 C CG . MET C 705 ? 0.3085 0.3489 0.3901 -0.0081 -0.1322 0.0166 1013 MET C CG 10859 S SD . MET C 705 ? 0.2785 0.3198 0.3719 -0.0049 -0.1189 0.0236 1013 MET C SD 10860 C CE . MET C 705 ? 0.2542 0.2905 0.3257 -0.0001 -0.1138 0.0270 1013 MET C CE 10861 N N . TRP C 706 ? 0.2985 0.3458 0.4206 -0.0241 -0.1516 -0.0006 1014 TRP C N 10862 C CA . TRP C 706 ? 0.2866 0.3388 0.4300 -0.0284 -0.1548 -0.0028 1014 TRP C CA 10863 C C . TRP C 706 ? 0.3411 0.3955 0.4799 -0.0329 -0.1667 -0.0105 1014 TRP C C 10864 O O . TRP C 706 ? 0.3451 0.4086 0.4980 -0.0344 -0.1721 -0.0095 1014 TRP C O 10865 C CB . TRP C 706 ? 0.2764 0.3225 0.4323 -0.0312 -0.1484 -0.0051 1014 TRP C CB 10866 C CG . TRP C 706 ? 0.3026 0.3530 0.4794 -0.0359 -0.1520 -0.0077 1014 TRP C CG 10867 C CD1 . TRP C 706 ? 0.3233 0.3696 0.5022 -0.0418 -0.1573 -0.0168 1014 TRP C CD1 10868 C CD2 . TRP C 706 ? 0.2802 0.3394 0.4780 -0.0353 -0.1503 -0.0014 1014 TRP C CD2 10869 N NE1 . TRP C 706 ? 0.3379 0.3904 0.5390 -0.0451 -0.1593 -0.0163 1014 TRP C NE1 10870 C CE2 . TRP C 706 ? 0.2998 0.3604 0.5129 -0.0411 -0.1551 -0.0067 1014 TRP C CE2 10871 C CE3 . TRP C 706 ? 0.2778 0.3433 0.4827 -0.0307 -0.1448 0.0078 1014 TRP C CE3 10872 C CZ2 . TRP C 706 ? 0.2807 0.3492 0.5165 -0.0422 -0.1547 -0.0025 1014 TRP C CZ2 10873 C CZ3 . TRP C 706 ? 0.2773 0.3504 0.5040 -0.0317 -0.1442 0.0116 1014 TRP C CZ3 10874 C CH2 . TRP C 706 ? 0.2544 0.3291 0.4966 -0.0374 -0.1493 0.0067 1014 TRP C CH2 10875 N N . GLU C 707 ? 0.3677 0.4140 0.4868 -0.0352 -0.1704 -0.0185 1015 GLU C N 10876 C CA . GLU C 707 ? 0.4042 0.4515 0.5152 -0.0399 -0.1814 -0.0269 1015 GLU C CA 10877 C C . GLU C 707 ? 0.3694 0.4265 0.4746 -0.0371 -0.1889 -0.0228 1015 GLU C C 10878 O O . GLU C 707 ? 0.3693 0.4331 0.4792 -0.0406 -0.1982 -0.0265 1015 GLU C O 10879 C CB . GLU C 707 ? 0.4801 0.5156 0.5666 -0.0420 -0.1823 -0.0359 1015 GLU C CB 10880 C CG . GLU C 707 ? 0.5714 0.5972 0.6646 -0.0457 -0.1766 -0.0422 1015 GLU C CG 10881 C CD . GLU C 707 ? 0.6795 0.6926 0.7472 -0.0463 -0.1749 -0.0500 1015 GLU C CD 10882 O OE1 . GLU C 707 ? 0.7242 0.7360 0.7682 -0.0443 -0.1786 -0.0508 1015 GLU C OE1 10883 O OE2 . GLU C 707 ? 0.7174 0.7216 0.7889 -0.0486 -0.1692 -0.0552 1015 GLU C OE2 10884 N N . HIS C 708 ? 0.3416 0.3996 0.4371 -0.0308 -0.1847 -0.0151 1016 HIS C N 10885 C CA . HIS C 708 ? 0.3602 0.4272 0.4510 -0.0270 -0.1903 -0.0098 1016 HIS C CA 10886 C C . HIS C 708 ? 0.3404 0.4196 0.4575 -0.0267 -0.1917 -0.0047 1016 HIS C C 10887 O O . HIS C 708 ? 0.3707 0.4593 0.4909 -0.0272 -0.2009 -0.0048 1016 HIS C O 10888 C CB . HIS C 708 ? 0.3469 0.4106 0.4231 -0.0203 -0.1835 -0.0026 1016 HIS C CB 10889 C CG . HIS C 708 ? 0.3781 0.4490 0.4459 -0.0157 -0.1888 0.0026 1016 HIS C CG 10890 N ND1 . HIS C 708 ? 0.4139 0.4847 0.4615 -0.0163 -0.1976 -0.0012 1016 HIS C ND1 10891 C CD2 . HIS C 708 ? 0.3932 0.4716 0.4698 -0.0103 -0.1862 0.0113 1016 HIS C CD2 10892 C CE1 . HIS C 708 ? 0.4363 0.5146 0.4813 -0.0112 -0.2005 0.0056 1016 HIS C CE1 10893 N NE2 . HIS C 708 ? 0.4069 0.4898 0.4698 -0.0074 -0.1937 0.0130 1016 HIS C NE2 10894 N N . TYR C 709 ? 0.3112 0.3903 0.4465 -0.0257 -0.1825 0.0000 1017 TYR C N 10895 C CA . TYR C 709 ? 0.3198 0.4092 0.4803 -0.0255 -0.1820 0.0049 1017 TYR C CA 10896 C C . TYR C 709 ? 0.3016 0.3951 0.4781 -0.0324 -0.1891 -0.0014 1017 TYR C C 10897 O O . TYR C 709 ? 0.3014 0.4058 0.4910 -0.0334 -0.1959 -0.0003 1017 TYR C O 10898 C CB . TYR C 709 ? 0.3032 0.3902 0.4764 -0.0229 -0.1692 0.0112 1017 TYR C CB 10899 C CG . TYR C 709 ? 0.3303 0.4263 0.5296 -0.0235 -0.1675 0.0155 1017 TYR C CG 10900 C CD1 . TYR C 709 ? 0.3406 0.4460 0.5468 -0.0192 -0.1679 0.0220 1017 TYR C CD1 10901 C CD2 . TYR C 709 ? 0.3234 0.4181 0.5407 -0.0282 -0.1651 0.0132 1017 TYR C CD2 10902 C CE1 . TYR C 709 ? 0.3478 0.4613 0.5778 -0.0197 -0.1661 0.0259 1017 TYR C CE1 10903 C CE2 . TYR C 709 ? 0.3332 0.4357 0.5740 -0.0288 -0.1631 0.0175 1017 TYR C CE2 10904 C CZ . TYR C 709 ? 0.3431 0.4551 0.5901 -0.0247 -0.1636 0.0237 1017 TYR C CZ 10905 O OH . TYR C 709 ? 0.3583 0.4781 0.6288 -0.0253 -0.1613 0.0280 1017 TYR C OH 10906 N N . ALA C 710 ? 0.2849 0.3695 0.4610 -0.0372 -0.1872 -0.0081 1018 ALA C N 10907 C CA . ALA C 710 ? 0.3298 0.4163 0.5207 -0.0442 -0.1929 -0.0150 1018 ALA C CA 10908 C C . ALA C 710 ? 0.3629 0.4557 0.5459 -0.0476 -0.2065 -0.0211 1018 ALA C C 10909 O O . ALA C 710 ? 0.3804 0.4803 0.5799 -0.0526 -0.2129 -0.0243 1018 ALA C O 10910 C CB . ALA C 710 ? 0.3543 0.4284 0.5417 -0.0482 -0.1884 -0.0219 1018 ALA C CB 10911 N N . ALA C 711 ? 0.3740 0.4644 0.5317 -0.0450 -0.2107 -0.0224 1019 ALA C N 10912 C CA . ALA C 711 ? 0.4147 0.5113 0.5613 -0.0474 -0.2235 -0.0275 1019 ALA C CA 10913 C C . ALA C 711 ? 0.4328 0.5442 0.5899 -0.0436 -0.2289 -0.0200 1019 ALA C C 10914 O O . ALA C 711 ? 0.4883 0.6074 0.6392 -0.0451 -0.2403 -0.0229 1019 ALA C O 10915 C CB . ALA C 711 ? 0.4131 0.5010 0.5273 -0.0457 -0.2253 -0.0314 1019 ALA C CB 10916 N N . GLY C 712 ? 0.4003 0.5157 0.5730 -0.0386 -0.2207 -0.0106 1020 GLY C N 10917 C CA . GLY C 712 ? 0.4042 0.5335 0.5907 -0.0349 -0.2244 -0.0035 1020 GLY C CA 10918 C C . GLY C 712 ? 0.4055 0.5366 0.5759 -0.0270 -0.2236 0.0035 1020 GLY C C 10919 O O . GLY C 712 ? 0.4216 0.5643 0.5991 -0.0236 -0.2288 0.0084 1020 GLY C O 10920 N N . ASN C 713 ? 0.3652 0.4847 0.5145 -0.0240 -0.2169 0.0040 1021 ASN C N 10921 C CA . ASN C 713 ? 0.3671 0.4865 0.4997 -0.0166 -0.2153 0.0104 1021 ASN C CA 10922 C C . ASN C 713 ? 0.3677 0.4853 0.5084 -0.0108 -0.2028 0.0188 1021 ASN C C 10923 O O . ASN C 713 ? 0.3637 0.4749 0.5125 -0.0124 -0.1935 0.0187 1021 ASN C O 10924 C CB . ASN C 713 ? 0.3876 0.4956 0.4902 -0.0166 -0.2156 0.0062 1021 ASN C CB 10925 C CG . ASN C 713 ? 0.4523 0.5608 0.5427 -0.0222 -0.2273 -0.0028 1021 ASN C CG 10926 O OD1 . ASN C 713 ? 0.4803 0.5977 0.5656 -0.0212 -0.2373 -0.0023 1021 ASN C OD1 10927 N ND2 . ASN C 713 ? 0.4645 0.5632 0.5493 -0.0280 -0.2260 -0.0114 1021 ASN C ND2 10928 N N . LYS C 714 ? 0.3698 0.4929 0.5079 -0.0041 -0.2026 0.0260 1022 LYS C N 10929 C CA . LYS C 714 ? 0.3914 0.5109 0.5312 0.0019 -0.1907 0.0332 1022 LYS C CA 10930 C C . LYS C 714 ? 0.3490 0.4556 0.4649 0.0034 -0.1845 0.0324 1022 LYS C C 10931 O O . LYS C 714 ? 0.3427 0.4448 0.4393 0.0016 -0.1905 0.0279 1022 LYS C O 10932 C CB . LYS C 714 ? 0.4512 0.5799 0.5946 0.0088 -0.1929 0.0404 1022 LYS C CB 10933 C CG . LYS C 714 ? 0.4922 0.6347 0.6607 0.0077 -0.1987 0.0419 1022 LYS C CG 10934 C CD . LYS C 714 ? 0.5426 0.6936 0.7149 0.0154 -0.2001 0.0493 1022 LYS C CD 10935 C CE . LYS C 714 ? 0.5857 0.7513 0.7839 0.0143 -0.2063 0.0507 1022 LYS C CE 10936 N NZ . LYS C 714 ? 0.6189 0.7930 0.8219 0.0223 -0.2077 0.0580 1022 LYS C NZ 10937 N N . PRO C 715 ? 0.3521 0.4524 0.4686 0.0066 -0.1724 0.0364 1023 PRO C N 10938 C CA . PRO C 715 ? 0.3344 0.4228 0.4301 0.0076 -0.1660 0.0355 1023 PRO C CA 10939 C C . PRO C 715 ? 0.3557 0.4415 0.4280 0.0113 -0.1705 0.0369 1023 PRO C C 10940 O O . PRO C 715 ? 0.3519 0.4444 0.4243 0.0160 -0.1744 0.0417 1023 PRO C O 10941 C CB . PRO C 715 ? 0.3229 0.4086 0.4254 0.0117 -0.1535 0.0410 1023 PRO C CB 10942 C CG . PRO C 715 ? 0.3171 0.4100 0.4446 0.0096 -0.1520 0.0419 1023 PRO C CG 10943 C CD . PRO C 715 ? 0.3257 0.4293 0.4623 0.0083 -0.1638 0.0410 1023 PRO C CD 10944 N N . ASP C 716 ? 0.3647 0.4406 0.4170 0.0093 -0.1697 0.0330 1024 ASP C N 10945 C CA . ASP C 716 ? 0.3992 0.4706 0.4272 0.0127 -0.1717 0.0348 1024 ASP C CA 10946 C C . ASP C 716 ? 0.3493 0.4081 0.3619 0.0122 -0.1630 0.0334 1024 ASP C C 10947 O O . ASP C 716 ? 0.3407 0.3953 0.3606 0.0085 -0.1582 0.0297 1024 ASP C O 10948 C CB . ASP C 716 ? 0.4583 0.5322 0.4744 0.0093 -0.1839 0.0294 1024 ASP C CB 10949 C CG . ASP C 716 ? 0.5329 0.6077 0.5296 0.0143 -0.1880 0.0340 1024 ASP C CG 10950 O OD1 . ASP C 716 ? 0.5143 0.5845 0.5030 0.0198 -0.1805 0.0404 1024 ASP C OD1 10951 O OD2 . ASP C 716 ? 0.5854 0.6654 0.5749 0.0127 -0.1989 0.0311 1024 ASP C OD2 10952 N N . HIS C 717 ? 0.3105 0.3636 0.3025 0.0160 -0.1607 0.0368 1025 HIS C N 10953 C CA . HIS C 717 ? 0.3574 0.3989 0.3348 0.0157 -0.1521 0.0360 1025 HIS C CA 10954 C C . HIS C 717 ? 0.3766 0.4117 0.3458 0.0094 -0.1546 0.0273 1025 HIS C C 10955 O O . HIS C 717 ? 0.4045 0.4406 0.3651 0.0065 -0.1635 0.0221 1025 HIS C O 10956 C CB . HIS C 717 ? 0.3595 0.3958 0.3149 0.0201 -0.1501 0.0409 1025 HIS C CB 10957 C CG . HIS C 717 ? 0.3585 0.3998 0.3200 0.0268 -0.1477 0.0493 1025 HIS C CG 10958 N ND1 . HIS C 717 ? 0.3499 0.3899 0.3224 0.0300 -0.1380 0.0534 1025 HIS C ND1 10959 C CD2 . HIS C 717 ? 0.3759 0.4229 0.3332 0.0312 -0.1537 0.0541 1025 HIS C CD2 10960 C CE1 . HIS C 717 ? 0.3589 0.4028 0.3337 0.0362 -0.1379 0.0599 1025 HIS C CE1 10961 N NE2 . HIS C 717 ? 0.3679 0.4164 0.3342 0.0372 -0.1474 0.0609 1025 HIS C NE2 10962 N N . MET C 718 ? 0.3970 0.4254 0.3689 0.0076 -0.1468 0.0254 1026 MET C N 10963 C CA . MET C 718 ? 0.4329 0.4536 0.3961 0.0026 -0.1475 0.0172 1026 MET C CA 10964 C C . MET C 718 ? 0.4802 0.4901 0.4217 0.0040 -0.1404 0.0179 1026 MET C C 10965 O O . MET C 718 ? 0.4371 0.4424 0.3821 0.0039 -0.1325 0.0184 1026 MET C O 10966 C CB . MET C 718 ? 0.4024 0.4243 0.3867 -0.0005 -0.1441 0.0147 1026 MET C CB 10967 C CG . MET C 718 ? 0.4406 0.4727 0.4484 -0.0022 -0.1494 0.0145 1026 MET C CG 10968 S SD . MET C 718 ? 0.6378 0.6715 0.6426 -0.0080 -0.1618 0.0052 1026 MET C SD 10969 C CE . MET C 718 ? 0.6030 0.6505 0.6369 -0.0084 -0.1662 0.0083 1026 MET C CE 10970 N N . ILE C 719 ? 0.5394 0.5456 0.4587 0.0053 -0.1431 0.0180 1027 ILE C N 10971 C CA . ILE C 719 ? 0.6139 0.6105 0.5127 0.0072 -0.1354 0.0203 1027 ILE C CA 10972 C C . ILE C 719 ? 0.7230 0.7101 0.5984 0.0039 -0.1362 0.0127 1027 ILE C C 10973 O O . ILE C 719 ? 0.7417 0.7217 0.5963 0.0056 -0.1314 0.0146 1027 ILE C O 10974 C CB . ILE C 719 ? 0.6028 0.6016 0.4937 0.0124 -0.1343 0.0289 1027 ILE C CB 10975 C CG1 . ILE C 719 ? 0.6009 0.6055 0.4846 0.0128 -0.1448 0.0283 1027 ILE C CG1 10976 C CG2 . ILE C 719 ? 0.5709 0.5763 0.4823 0.0162 -0.1299 0.0360 1027 ILE C CG2 10977 C CD1 . ILE C 719 ? 0.6196 0.6269 0.4962 0.0183 -0.1446 0.0373 1027 ILE C CD1 10978 N N . LYS C 720 ? 0.8067 0.7934 0.6859 -0.0006 -0.1414 0.0039 1028 LYS C N 10979 C CA . LYS C 720 ? 0.8893 0.8663 0.7473 -0.0038 -0.1410 -0.0050 1028 LYS C CA 10980 C C . LYS C 720 ? 0.9071 0.8802 0.7753 -0.0080 -0.1398 -0.0132 1028 LYS C C 10981 O O . LYS C 720 ? 0.9251 0.8887 0.7822 -0.0088 -0.1326 -0.0170 1028 LYS C O 10982 C CB . LYS C 720 ? 0.9487 0.9283 0.7939 -0.0053 -0.1504 -0.0094 1028 LYS C CB 10983 C CG . LYS C 720 ? 1.0017 0.9821 0.8291 -0.0013 -0.1507 -0.0025 1028 LYS C CG 10984 C CD . LYS C 720 ? 1.0647 1.0492 0.8806 -0.0029 -0.1612 -0.0068 1028 LYS C CD 10985 C CE . LYS C 720 ? 1.1127 1.0889 0.9124 -0.0076 -0.1615 -0.0188 1028 LYS C CE 10986 N NZ . LYS C 720 ? 1.1535 1.1343 0.9422 -0.0097 -0.1721 -0.0238 1028 LYS C NZ 10987 N N . TYR D 1 ? 0.2560 0.2770 0.1972 0.0054 0.0161 0.0061 13 TYR D N 10988 C CA . TYR D 1 ? 0.2864 0.3045 0.2313 0.0069 0.0096 -0.0003 13 TYR D CA 10989 C C . TYR D 1 ? 0.2927 0.3272 0.2281 0.0192 0.0029 -0.0041 13 TYR D C 10990 O O . TYR D 1 ? 0.3152 0.3737 0.2438 0.0245 0.0070 0.0039 13 TYR D O 10991 C CB . TYR D 1 ? 0.2393 0.2560 0.1955 0.0031 0.0126 0.0044 13 TYR D CB 10992 C CG . TYR D 1 ? 0.2433 0.2634 0.1995 0.0059 0.0113 0.0140 13 TYR D CG 10993 C CD1 . TYR D 1 ? 0.2347 0.2639 0.1908 0.0103 0.0061 0.0163 13 TYR D CD1 10994 C CD2 . TYR D 1 ? 0.2561 0.2665 0.2134 0.0020 0.0100 0.0231 13 TYR D CD2 10995 C CE1 . TYR D 1 ? 0.3119 0.3418 0.2688 0.0091 -0.0004 0.0295 13 TYR D CE1 10996 C CE2 . TYR D 1 ? 0.2820 0.2894 0.2415 -0.0003 -0.0005 0.0373 13 TYR D CE2 10997 C CZ . TYR D 1 ? 0.2975 0.3153 0.2569 0.0024 -0.0057 0.0415 13 TYR D CZ 10998 O OH . TYR D 1 ? 0.3105 0.3232 0.2729 -0.0034 -0.0210 0.0598 13 TYR D OH 10999 N N . PRO D 2 ? 0.2898 0.3160 0.2249 0.0230 -0.0099 -0.0139 14 PRO D N 11000 C CA . PRO D 2 ? 0.3309 0.3715 0.2532 0.0400 -0.0202 -0.0225 14 PRO D CA 11001 C C . PRO D 2 ? 0.3454 0.4092 0.2677 0.0411 -0.0118 -0.0101 14 PRO D C 11002 O O . PRO D 2 ? 0.3741 0.4285 0.3087 0.0320 -0.0099 -0.0031 14 PRO D O 11003 C CB . PRO D 2 ? 0.3401 0.3572 0.2681 0.0377 -0.0402 -0.0310 14 PRO D CB 11004 C CG . PRO D 2 ? 0.3396 0.3360 0.2796 0.0201 -0.0432 -0.0266 14 PRO D CG 11005 C CD . PRO D 2 ? 0.3134 0.3214 0.2603 0.0110 -0.0194 -0.0150 14 PRO D CD 11006 N N . GLY D 3 ? 0.3612 0.4610 0.2701 0.0526 -0.0090 -0.0060 15 GLY D N 11007 C CA . GLY D 3 ? 0.3610 0.4867 0.2699 0.0490 -0.0049 0.0128 15 GLY D CA 11008 C C . GLY D 3 ? 0.3518 0.4839 0.2699 0.0318 0.0026 0.0374 15 GLY D C 11009 O O . GLY D 3 ? 0.3925 0.5426 0.3130 0.0231 -0.0002 0.0598 15 GLY D O 11010 N N . GLY D 4 ? 0.2677 0.3817 0.1913 0.0253 0.0073 0.0349 16 GLY D N 11011 C CA . GLY D 4 ? 0.2594 0.3694 0.1923 0.0093 0.0085 0.0560 16 GLY D CA 11012 C C . GLY D 4 ? 0.3193 0.4347 0.2504 0.0092 0.0148 0.0528 16 GLY D C 11013 O O . GLY D 4 ? 0.3300 0.4755 0.2497 0.0235 0.0178 0.0421 16 GLY D O 11014 N N . SER D 5 ? 0.3096 0.3954 0.2504 -0.0031 0.0138 0.0591 17 SER D N 11015 C CA . SER D 5 ? 0.3277 0.4131 0.2678 -0.0046 0.0189 0.0562 17 SER D CA 11016 C C . SER D 5 ? 0.3245 0.3643 0.2715 -0.0111 0.0175 0.0490 17 SER D C 11017 O O . SER D 5 ? 0.3153 0.3310 0.2692 -0.0153 0.0092 0.0532 17 SER D O 11018 C CB . SER D 5 ? 0.4171 0.5430 0.3604 -0.0141 0.0178 0.0833 17 SER D CB 11019 O OG . SER D 5 ? 0.4693 0.5780 0.4244 -0.0327 0.0042 0.1091 17 SER D OG 11020 N N . THR D 6 ? 0.2470 0.2776 0.1907 -0.0086 0.0228 0.0361 18 THR D N 11021 C CA . THR D 6 ? 0.2483 0.2472 0.1958 -0.0133 0.0228 0.0301 18 THR D CA 11022 C C . THR D 6 ? 0.2696 0.2699 0.2157 -0.0175 0.0247 0.0342 18 THR D C 11023 O O . THR D 6 ? 0.2282 0.2346 0.1683 -0.0124 0.0279 0.0235 18 THR D O 11024 C CB . THR D 6 ? 0.2629 0.2516 0.2092 -0.0104 0.0254 0.0138 18 THR D CB 11025 O OG1 . THR D 6 ? 0.2292 0.2220 0.1797 -0.0071 0.0231 0.0121 18 THR D OG1 11026 C CG2 . THR D 6 ? 0.2155 0.1878 0.1634 -0.0141 0.0273 0.0095 18 THR D CG2 11027 N N . PRO D 7 ? 0.2724 0.2654 0.2249 -0.0265 0.0176 0.0506 19 PRO D N 11028 C CA . PRO D 7 ? 0.2438 0.2380 0.1980 -0.0326 0.0173 0.0577 19 PRO D CA 11029 C C . PRO D 7 ? 0.2231 0.1869 0.1726 -0.0300 0.0206 0.0401 19 PRO D C 11030 O O . PRO D 7 ? 0.2369 0.1787 0.1850 -0.0265 0.0187 0.0300 19 PRO D O 11031 C CB . PRO D 7 ? 0.2626 0.2439 0.2270 -0.0457 0.0000 0.0813 19 PRO D CB 11032 C CG . PRO D 7 ? 0.3181 0.2744 0.2832 -0.0413 -0.0106 0.0766 19 PRO D CG 11033 C CD . PRO D 7 ? 0.2480 0.2294 0.2076 -0.0323 0.0031 0.0658 19 PRO D CD 11034 N N . VAL D 8 ? 0.2181 0.1878 0.1648 -0.0303 0.0247 0.0369 20 VAL D N 11035 C CA . VAL D 8 ? 0.2342 0.1782 0.1758 -0.0305 0.0263 0.0239 20 VAL D CA 11036 C C . VAL D 8 ? 0.2190 0.1593 0.1631 -0.0358 0.0235 0.0312 20 VAL D C 11037 O O . VAL D 8 ? 0.2255 0.1923 0.1766 -0.0396 0.0213 0.0470 20 VAL D O 11038 C CB . VAL D 8 ? 0.2406 0.1874 0.1755 -0.0255 0.0282 0.0094 20 VAL D CB 11039 C CG1 . VAL D 8 ? 0.2672 0.2165 0.2024 -0.0235 0.0281 0.0051 20 VAL D CG1 11040 C CG2 . VAL D 8 ? 0.2306 0.2041 0.1625 -0.0160 0.0262 0.0063 20 VAL D CG2 11041 N N . SER D 9 ? 0.1929 0.2134 0.2030 -0.0521 -0.0509 -0.0792 21 SER D N 11042 C CA . SER D 9 ? 0.1949 0.1807 0.2003 -0.0555 -0.0290 -0.0480 21 SER D CA 11043 C C . SER D 9 ? 0.2345 0.2000 0.2527 -0.0603 -0.0157 -0.0642 21 SER D C 11044 O O . SER D 9 ? 0.2477 0.2094 0.2993 -0.0724 -0.0171 -0.0869 21 SER D O 11045 C CB . SER D 9 ? 0.2278 0.2043 0.2672 -0.0651 -0.0197 -0.0231 21 SER D CB 11046 O OG . SER D 9 ? 0.2724 0.2522 0.2800 -0.0522 -0.0301 -0.0005 21 SER D OG 11047 N N . SER D 10 ? 0.2569 0.2089 0.2467 -0.0490 -0.0021 -0.0507 22 SER D N 11048 C CA . SER D 10 ? 0.3094 0.2429 0.3017 -0.0437 0.0115 -0.0660 22 SER D CA 11049 C C . SER D 10 ? 0.3054 0.2353 0.2986 -0.0352 0.0337 -0.0391 22 SER D C 11050 O O . SER D 10 ? 0.2902 0.2337 0.2747 -0.0350 0.0372 -0.0114 22 SER D O 11051 C CB . SER D 10 ? 0.4107 0.3432 0.3601 -0.0268 0.0013 -0.0988 22 SER D CB 11052 O OG . SER D 10 ? 0.4565 0.4014 0.3540 -0.0097 -0.0019 -0.0885 22 SER D OG 11053 N N . ALA D 11 ? 0.2881 0.1995 0.2930 -0.0278 0.0470 -0.0488 23 ALA D N 11054 C CA . ALA D 11 ? 0.3130 0.2319 0.3329 -0.0164 0.0664 -0.0263 23 ALA D CA 11055 C C . ALA D 11 ? 0.3072 0.2540 0.3017 0.0000 0.0826 -0.0161 23 ALA D C 11056 O O . ALA D 11 ? 0.3551 0.2962 0.3049 0.0134 0.0830 -0.0345 23 ALA D O 11057 C CB . ALA D 11 ? 0.3328 0.2189 0.3605 -0.0047 0.0761 -0.0419 23 ALA D CB 11058 N N . ASN D 12 ? 0.2804 0.2570 0.3036 -0.0001 0.0963 0.0130 24 ASN D N 11059 C CA . ASN D 12 ? 0.3214 0.3304 0.3336 0.0141 0.1223 0.0269 24 ASN D CA 11060 C C . ASN D 12 ? 0.3561 0.3693 0.3670 0.0454 0.1438 0.0141 24 ASN D C 11061 O O . ASN D 12 ? 0.3257 0.3193 0.3551 0.0529 0.1381 0.0021 24 ASN D O 11062 C CB . ASN D 12 ? 0.3076 0.3546 0.3622 -0.0046 0.1282 0.0627 24 ASN D CB 11063 C CG . ASN D 12 ? 0.3020 0.3699 0.4196 -0.0049 0.1235 0.0714 24 ASN D CG 11064 O OD1 . ASN D 12 ? 0.2964 0.3361 0.4177 0.0050 0.1125 0.0549 24 ASN D OD1 11065 N ND2 . ASN D 12 ? 0.3012 0.4082 0.4557 -0.0151 0.1217 0.0900 24 ASN D ND2 11066 N N . MET D 13 ? 0.4018 0.4328 0.3805 0.0686 0.1707 0.0176 25 MET D N 11067 C CA . MET D 13 ? 0.5166 0.5488 0.4800 0.1078 0.1932 0.0054 25 MET D CA 11068 C C . MET D 13 ? 0.5368 0.6195 0.5694 0.1140 0.2076 0.0256 25 MET D C 11069 O O . MET D 13 ? 0.4989 0.6269 0.5873 0.0871 0.2038 0.0523 25 MET D O 11070 C CB . MET D 13 ? 0.6022 0.6420 0.5117 0.1322 0.2158 0.0089 25 MET D CB 11071 C CG . MET D 13 ? 0.7027 0.6980 0.5498 0.1698 0.2116 -0.0233 25 MET D CG 11072 S SD . MET D 13 ? 1.3197 1.2507 1.0848 0.1726 0.1799 -0.0605 25 MET D SD 11073 C CE . MET D 13 ? 1.1149 1.0665 0.8407 0.1807 0.1986 -0.0332 25 MET D CE 11074 N N . MET D 14 ? 0.5987 0.6652 0.6217 0.1451 0.2091 0.0083 26 MET D N 11075 C CA . MET D 14 ? 0.6096 0.7228 0.6884 0.1558 0.2118 0.0213 26 MET D CA 11076 C C . MET D 14 ? 0.6952 0.8084 0.7423 0.1967 0.2255 0.0099 26 MET D C 11077 O O . MET D 14 ? 0.7458 0.8099 0.7242 0.2165 0.2277 -0.0101 26 MET D O 11078 C CB . MET D 14 ? 0.6095 0.6933 0.7157 0.1511 0.1907 0.0154 26 MET D CB 11079 C CG . MET D 14 ? 0.6888 0.6862 0.7378 0.1693 0.1800 -0.0158 26 MET D CG 11080 S SD . MET D 14 ? 0.6651 0.6210 0.7341 0.1664 0.1569 -0.0167 26 MET D SD 11081 C CE . MET D 14 ? 0.6249 0.4760 0.6221 0.1658 0.1436 -0.0501 26 MET D CE # 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 1 309 ? ? ? A . n A 1 2 PRO 2 310 ? ? ? A . n A 1 3 GLY 3 311 ? ? ? A . n A 1 4 SER 4 312 ? ? ? A . n A 1 5 CYS 5 313 ? ? ? A . n A 1 6 PRO 6 314 314 PRO PRO A . n A 1 7 THR 7 315 315 THR THR A . n A 1 8 HIS 8 316 316 HIS HIS A . n A 1 9 ALA 9 317 317 ALA ALA A . n A 1 10 ASP 10 318 318 ASP ASP A . n A 1 11 SER 11 319 319 SER SER A . n A 1 12 LEU 12 320 320 LEU LEU A . n A 1 13 ASN 13 321 321 ASN ASN A . n A 1 14 ASN 14 322 322 ASN ASN A . n A 1 15 LEU 15 323 323 LEU LEU A . n A 1 16 ALA 16 324 324 ALA ALA A . n A 1 17 ASN 17 325 325 ASN ASN A . n A 1 18 ILE 18 326 326 ILE ILE A . n A 1 19 LYS 19 327 327 LYS LYS A . n A 1 20 ARG 20 328 328 ARG ARG A . n A 1 21 GLU 21 329 329 GLU GLU A . n A 1 22 GLN 22 330 330 GLN GLN A . n A 1 23 GLY 23 331 331 GLY GLY A . n A 1 24 ASN 24 332 332 ASN ASN A . n A 1 25 ILE 25 333 333 ILE ILE A . n A 1 26 GLU 26 334 334 GLU GLU A . n A 1 27 GLU 27 335 335 GLU GLU A . n A 1 28 ALA 28 336 336 ALA ALA A . n A 1 29 VAL 29 337 337 VAL VAL A . n A 1 30 ARG 30 338 338 ARG ARG A . n A 1 31 LEU 31 339 339 LEU LEU A . n A 1 32 TYR 32 340 340 TYR TYR A . n A 1 33 ARG 33 341 341 ARG ARG A . n A 1 34 LYS 34 342 342 LYS LYS A . n A 1 35 ALA 35 343 343 ALA ALA A . n A 1 36 LEU 36 344 344 LEU LEU A . n A 1 37 GLU 37 345 345 GLU GLU A . n A 1 38 VAL 38 346 346 VAL VAL A . n A 1 39 PHE 39 347 347 PHE PHE A . n A 1 40 PRO 40 348 348 PRO PRO A . n A 1 41 GLU 41 349 349 GLU GLU A . n A 1 42 PHE 42 350 350 PHE PHE A . n A 1 43 ALA 43 351 351 ALA ALA A . n A 1 44 ALA 44 352 352 ALA ALA A . n A 1 45 ALA 45 353 353 ALA ALA A . n A 1 46 HIS 46 354 354 HIS HIS A . n A 1 47 SER 47 355 355 SER SER A . n A 1 48 ASN 48 356 356 ASN ASN A . n A 1 49 LEU 49 357 357 LEU LEU A . n A 1 50 ALA 50 358 358 ALA ALA A . n A 1 51 SER 51 359 359 SER SER A . n A 1 52 VAL 52 360 360 VAL VAL A . n A 1 53 LEU 53 361 361 LEU LEU A . n A 1 54 GLN 54 362 362 GLN GLN A . n A 1 55 GLN 55 363 363 GLN GLN A . n A 1 56 GLN 56 364 364 GLN GLN A . n A 1 57 GLY 57 365 365 GLY GLY A . n A 1 58 LYS 58 366 366 LYS LYS A . n A 1 59 LEU 59 367 367 LEU LEU A . n A 1 60 GLN 60 368 368 GLN GLN A . n A 1 61 GLU 61 369 369 GLU GLU A . n A 1 62 ALA 62 370 370 ALA ALA A . n A 1 63 LEU 63 371 371 LEU LEU A . n A 1 64 MET 64 372 372 MET MET A . n A 1 65 HIS 65 373 373 HIS HIS A . n A 1 66 TYR 66 374 374 TYR TYR A . n A 1 67 LYS 67 375 375 LYS LYS A . n A 1 68 GLU 68 376 376 GLU GLU A . n A 1 69 ALA 69 377 377 ALA ALA A . n A 1 70 ILE 70 378 378 ILE ILE A . n A 1 71 ARG 71 379 379 ARG ARG A . n A 1 72 ILE 72 380 380 ILE ILE A . n A 1 73 SER 73 381 381 SER SER A . n A 1 74 PRO 74 382 382 PRO PRO A . n A 1 75 THR 75 383 383 THR THR A . n A 1 76 PHE 76 384 384 PHE PHE A . n A 1 77 ALA 77 385 385 ALA ALA A . n A 1 78 ASP 78 386 386 ASP ASP A . n A 1 79 ALA 79 387 387 ALA ALA A . n A 1 80 TYR 80 388 388 TYR TYR A . n A 1 81 SER 81 389 389 SER SER A . n A 1 82 ASN 82 390 390 ASN ASN A . n A 1 83 MET 83 391 391 MET MET A . n A 1 84 GLY 84 392 392 GLY GLY A . n A 1 85 ASN 85 393 393 ASN ASN A . n A 1 86 THR 86 394 394 THR THR A . n A 1 87 LEU 87 395 395 LEU LEU A . n A 1 88 LYS 88 396 396 LYS LYS A . n A 1 89 GLU 89 397 397 GLU GLU A . n A 1 90 MET 90 398 398 MET MET A . n A 1 91 GLN 91 399 399 GLN GLN A . n A 1 92 ASP 92 400 400 ASP ASP A . n A 1 93 VAL 93 401 401 VAL VAL A . n A 1 94 GLN 94 402 402 GLN GLN A . n A 1 95 GLY 95 403 403 GLY GLY A . n A 1 96 ALA 96 404 404 ALA ALA A . n A 1 97 LEU 97 405 405 LEU LEU A . n A 1 98 GLN 98 406 406 GLN GLN A . n A 1 99 CYS 99 407 407 CYS CYS A . n A 1 100 TYR 100 408 408 TYR TYR A . n A 1 101 THR 101 409 409 THR THR A . n A 1 102 ARG 102 410 410 ARG ARG A . n A 1 103 ALA 103 411 411 ALA ALA A . n A 1 104 ILE 104 412 412 ILE ILE A . n A 1 105 GLN 105 413 413 GLN GLN A . n A 1 106 ILE 106 414 414 ILE ILE A . n A 1 107 ASN 107 415 415 ASN ASN A . n A 1 108 PRO 108 416 416 PRO PRO A . n A 1 109 ALA 109 417 417 ALA ALA A . n A 1 110 PHE 110 418 418 PHE PHE A . n A 1 111 ALA 111 419 419 ALA ALA A . n A 1 112 ASP 112 420 420 ASP ASP A . n A 1 113 ALA 113 421 421 ALA ALA A . n A 1 114 HIS 114 422 422 HIS HIS A . n A 1 115 SER 115 423 423 SER SER A . n A 1 116 ASN 116 424 424 ASN ASN A . n A 1 117 LEU 117 425 425 LEU LEU A . n A 1 118 ALA 118 426 426 ALA ALA A . n A 1 119 SER 119 427 427 SER SER A . n A 1 120 ILE 120 428 428 ILE ILE A . n A 1 121 HIS 121 429 429 HIS HIS A . n A 1 122 LYS 122 430 430 LYS LYS A . n A 1 123 ASP 123 431 431 ASP ASP A . n A 1 124 SER 124 432 432 SER SER A . n A 1 125 GLY 125 433 433 GLY GLY A . n A 1 126 ASN 126 434 434 ASN ASN A . n A 1 127 ILE 127 435 435 ILE ILE A . n A 1 128 PRO 128 436 436 PRO PRO A . n A 1 129 GLU 129 437 437 GLU GLU A . n A 1 130 ALA 130 438 438 ALA ALA A . n A 1 131 ILE 131 439 439 ILE ILE A . n A 1 132 ALA 132 440 440 ALA ALA A . n A 1 133 SER 133 441 441 SER SER A . n A 1 134 TYR 134 442 442 TYR TYR A . n A 1 135 ARG 135 443 443 ARG ARG A . n A 1 136 THR 136 444 444 THR THR A . n A 1 137 ALA 137 445 445 ALA ALA A . n A 1 138 LEU 138 446 446 LEU LEU A . n A 1 139 LYS 139 447 447 LYS LYS A . n A 1 140 LEU 140 448 448 LEU LEU A . n A 1 141 LYS 141 449 449 LYS LYS A . n A 1 142 PRO 142 450 450 PRO PRO A . n A 1 143 ASP 143 451 451 ASP ASP A . n A 1 144 PHE 144 452 452 PHE PHE A . n A 1 145 PRO 145 453 453 PRO PRO A . n A 1 146 ASP 146 454 454 ASP ASP A . n A 1 147 ALA 147 455 455 ALA ALA A . n A 1 148 TYR 148 456 456 TYR TYR A . n A 1 149 CYS 149 457 457 CYS CYS A . n A 1 150 ASN 150 458 458 ASN ASN A . n A 1 151 LEU 151 459 459 LEU LEU A . n A 1 152 ALA 152 460 460 ALA ALA A . n A 1 153 HIS 153 461 461 HIS HIS A . n A 1 154 CYS 154 462 462 CYS CYS A . n A 1 155 LEU 155 463 463 LEU LEU A . n A 1 156 GLN 156 464 464 GLN GLN A . n A 1 157 ILE 157 465 465 ILE ILE A . n A 1 158 VAL 158 466 466 VAL VAL A . n A 1 159 CYS 159 467 467 CYS CYS A . n A 1 160 ASP 160 468 468 ASP ASP A . n A 1 161 TRP 161 469 469 TRP TRP A . n A 1 162 THR 162 470 470 THR THR A . n A 1 163 ASP 163 471 471 ASP ASP A . n A 1 164 TYR 164 472 472 TYR TYR A . n A 1 165 ASP 165 473 473 ASP ASP A . n A 1 166 GLU 166 474 474 GLU GLU A . n A 1 167 ARG 167 475 475 ARG ARG A . n A 1 168 MET 168 476 476 MET MET A . n A 1 169 LYS 169 477 477 LYS LYS A . n A 1 170 LYS 170 478 478 LYS LYS A . n A 1 171 LEU 171 479 479 LEU LEU A . n A 1 172 VAL 172 480 480 VAL VAL A . n A 1 173 SER 173 481 481 SER SER A . n A 1 174 ILE 174 482 482 ILE ILE A . n A 1 175 VAL 175 483 483 VAL VAL A . n A 1 176 ALA 176 484 484 ALA ALA A . n A 1 177 ASP 177 485 485 ASP ASP A . n A 1 178 GLN 178 486 486 GLN GLN A . n A 1 179 LEU 179 487 487 LEU LEU A . n A 1 180 GLU 180 488 488 GLU GLU A . n A 1 181 LYS 181 489 489 LYS LYS A . n A 1 182 ASN 182 490 490 ASN ASN A . n A 1 183 ARG 183 491 491 ARG ARG A . n A 1 184 LEU 184 492 492 LEU LEU A . n A 1 185 PRO 185 493 493 PRO PRO A . n A 1 186 SER 186 494 494 SER SER A . n A 1 187 VAL 187 495 495 VAL VAL A . n A 1 188 HIS 188 496 496 HIS HIS A . n A 1 189 PRO 189 497 497 PRO PRO A . n A 1 190 HIS 190 498 498 HIS HIS A . n A 1 191 HIS 191 499 499 HIS HIS A . n A 1 192 SER 192 500 500 SER SER A . n A 1 193 MET 193 501 501 MET MET A . n A 1 194 LEU 194 502 502 LEU LEU A . n A 1 195 TYR 195 503 503 TYR TYR A . n A 1 196 PRO 196 504 504 PRO PRO A . n A 1 197 LEU 197 505 505 LEU LEU A . n A 1 198 SER 198 506 506 SER SER A . n A 1 199 HIS 199 507 507 HIS HIS A . n A 1 200 GLY 200 508 508 GLY GLY A . n A 1 201 PHE 201 509 509 PHE PHE A . n A 1 202 ARG 202 510 510 ARG ARG A . n A 1 203 LYS 203 511 511 LYS LYS A . n A 1 204 ALA 204 512 512 ALA ALA A . n A 1 205 ILE 205 513 513 ILE ILE A . n A 1 206 ALA 206 514 514 ALA ALA A . n A 1 207 GLU 207 515 515 GLU GLU A . n A 1 208 ARG 208 516 516 ARG ARG A . n A 1 209 HIS 209 517 517 HIS HIS A . n A 1 210 GLY 210 518 518 GLY GLY A . n A 1 211 ASN 211 519 519 ASN ASN A . n A 1 212 LEU 212 520 520 LEU LEU A . n A 1 213 CYS 213 521 521 CYS CYS A . n A 1 214 LEU 214 522 522 LEU LEU A . n A 1 215 ASP 215 523 523 ASP ASP A . n A 1 216 LYS 216 524 524 LYS LYS A . n A 1 217 ILE 217 525 525 ILE ILE A . n A 1 218 ASN 218 526 526 ASN ASN A . n A 1 219 VAL 219 527 527 VAL VAL A . n A 1 220 LEU 220 528 528 LEU LEU A . n A 1 221 HIS 221 529 529 HIS HIS A . n A 1 222 LYS 222 530 530 LYS LYS A . n A 1 223 PRO 223 531 531 PRO PRO A . n A 1 224 PRO 224 532 532 PRO PRO A . n A 1 225 TYR 225 533 533 TYR TYR A . n A 1 226 GLU 226 534 534 GLU GLU A . n A 1 227 HIS 227 535 535 HIS HIS A . n A 1 228 PRO 228 536 536 PRO PRO A . n A 1 229 LYS 229 537 537 LYS LYS A . n A 1 230 ASP 230 538 538 ASP ASP A . n A 1 231 LEU 231 539 539 LEU LEU A . n A 1 232 LYS 232 540 540 LYS LYS A . n A 1 233 LEU 233 541 541 LEU LEU A . n A 1 234 SER 234 542 542 SER SER A . n A 1 235 ASP 235 543 543 ASP ASP A . n A 1 236 GLY 236 544 544 GLY GLY A . n A 1 237 ARG 237 545 545 ARG ARG A . n A 1 238 LEU 238 546 546 LEU LEU A . n A 1 239 ARG 239 547 547 ARG ARG A . n A 1 240 VAL 240 548 548 VAL VAL A . n A 1 241 GLY 241 549 549 GLY GLY A . n A 1 242 TYR 242 550 550 TYR TYR A . n A 1 243 VAL 243 551 551 VAL VAL A . n A 1 244 SER 244 552 552 SER SER A . n A 1 245 SER 245 553 553 SER SER A . n A 1 246 ASP 246 554 554 ASP ASP A . n A 1 247 PHE 247 555 555 PHE PHE A . n A 1 248 GLY 248 556 556 GLY GLY A . n A 1 249 ASN 249 557 557 ASN ASN A . n A 1 250 HIS 250 558 558 HIS HIS A . n A 1 251 PRO 251 559 559 PRO PRO A . n A 1 252 THR 252 560 560 THR THR A . n A 1 253 SER 253 561 561 SER SER A . n A 1 254 HIS 254 562 562 HIS HIS A . n A 1 255 LEU 255 563 563 LEU LEU A . n A 1 256 MET 256 564 564 MET MET A . n A 1 257 GLN 257 565 565 GLN GLN A . n A 1 258 SER 258 566 566 SER SER A . n A 1 259 ILE 259 567 567 ILE ILE A . n A 1 260 PRO 260 568 568 PRO PRO A . n A 1 261 GLY 261 569 569 GLY GLY A . n A 1 262 MET 262 570 570 MET MET A . n A 1 263 HIS 263 571 571 HIS HIS A . n A 1 264 ASN 264 572 572 ASN ASN A . n A 1 265 PRO 265 573 573 PRO PRO A . n A 1 266 ASP 266 574 574 ASP ASP A . n A 1 267 LYS 267 575 575 LYS LYS A . n A 1 268 PHE 268 576 576 PHE PHE A . n A 1 269 GLU 269 577 577 GLU GLU A . n A 1 270 VAL 270 578 578 VAL VAL A . n A 1 271 PHE 271 579 579 PHE PHE A . n A 1 272 CYS 272 580 580 CYS CYS A . n A 1 273 TYR 273 581 581 TYR TYR A . n A 1 274 ALA 274 582 582 ALA ALA A . n A 1 275 LEU 275 583 583 LEU LEU A . n A 1 276 SER 276 584 584 SER SER A . n A 1 277 PRO 277 585 585 PRO PRO A . n A 1 278 ASP 278 586 586 ASP ASP A . n A 1 279 ASP 279 587 587 ASP ASP A . n A 1 280 GLY 280 588 588 GLY GLY A . n A 1 281 THR 281 589 589 THR THR A . n A 1 282 ASN 282 590 590 ASN ASN A . n A 1 283 PHE 283 591 591 PHE PHE A . n A 1 284 ARG 284 592 592 ARG ARG A . n A 1 285 VAL 285 593 593 VAL VAL A . n A 1 286 LYS 286 594 594 LYS LYS A . n A 1 287 VAL 287 595 595 VAL VAL A . n A 1 288 MET 288 596 596 MET MET A . n A 1 289 ALA 289 597 597 ALA ALA A . n A 1 290 GLU 290 598 598 GLU GLU A . n A 1 291 ALA 291 599 599 ALA ALA A . n A 1 292 ASN 292 600 600 ASN ASN A . n A 1 293 HIS 293 601 601 HIS HIS A . n A 1 294 PHE 294 602 602 PHE PHE A . n A 1 295 ILE 295 603 603 ILE ILE A . n A 1 296 ASP 296 604 604 ASP ASP A . n A 1 297 LEU 297 605 605 LEU LEU A . n A 1 298 SER 298 606 606 SER SER A . n A 1 299 GLN 299 607 607 GLN GLN A . n A 1 300 ILE 300 608 608 ILE ILE A . n A 1 301 PRO 301 609 609 PRO PRO A . n A 1 302 CYS 302 610 610 CYS CYS A . n A 1 303 ASN 303 611 611 ASN ASN A . n A 1 304 GLY 304 612 612 GLY GLY A . n A 1 305 LYS 305 613 613 LYS LYS A . n A 1 306 ALA 306 614 614 ALA ALA A . n A 1 307 ALA 307 615 615 ALA ALA A . n A 1 308 ASP 308 616 616 ASP ASP A . n A 1 309 ARG 309 617 617 ARG ARG A . n A 1 310 ILE 310 618 618 ILE ILE A . n A 1 311 HIS 311 619 619 HIS HIS A . n A 1 312 GLN 312 620 620 GLN GLN A . n A 1 313 ASP 313 621 621 ASP ASP A . n A 1 314 GLY 314 622 622 GLY GLY A . n A 1 315 ILE 315 623 623 ILE ILE A . n A 1 316 HIS 316 624 624 HIS HIS A . n A 1 317 ILE 317 625 625 ILE ILE A . n A 1 318 LEU 318 626 626 LEU LEU A . n A 1 319 VAL 319 627 627 VAL VAL A . n A 1 320 ASN 320 628 628 ASN ASN A . n A 1 321 MET 321 629 629 MET MET A . n A 1 322 ASN 322 630 630 ASN ASN A . n A 1 323 GLY 323 631 631 GLY GLY A . n A 1 324 TYR 324 632 632 TYR TYR A . n A 1 325 THR 325 633 633 THR THR A . n A 1 326 LYS 326 634 634 LYS LYS A . n A 1 327 GLY 327 635 635 GLY GLY A . n A 1 328 ALA 328 636 636 ALA ALA A . n A 1 329 ARG 329 637 637 ARG ARG A . n A 1 330 ASN 330 638 638 ASN ASN A . n A 1 331 GLU 331 639 639 GLU GLU A . n A 1 332 LEU 332 640 640 LEU LEU A . n A 1 333 PHE 333 641 641 PHE PHE A . n A 1 334 ALA 334 642 642 ALA ALA A . n A 1 335 LEU 335 643 643 LEU LEU A . n A 1 336 ARG 336 644 644 ARG ARG A . n A 1 337 PRO 337 645 645 PRO PRO A . n A 1 338 ALA 338 646 646 ALA ALA A . n A 1 339 PRO 339 647 647 PRO PRO A . n A 1 340 ILE 340 648 648 ILE ILE A . n A 1 341 GLN 341 649 649 GLN GLN A . n A 1 342 ALA 342 650 650 ALA ALA A . n A 1 343 MET 343 651 651 MET MET A . n A 1 344 TRP 344 652 652 TRP TRP A . n A 1 345 LEU 345 653 653 LEU LEU A . n A 1 346 GLY 346 654 654 GLY GLY A . n A 1 347 TYR 347 655 655 TYR TYR A . n A 1 348 PRO 348 656 656 PRO PRO A . n A 1 349 GLY 349 657 657 GLY GLY A . n A 1 350 THR 350 658 658 THR THR A . n A 1 351 SER 351 659 659 SER SER A . n A 1 352 GLY 352 660 660 GLY GLY A . n A 1 353 ALA 353 661 661 ALA ALA A . n A 1 354 LEU 354 662 662 LEU LEU A . n A 1 355 PHE 355 663 663 PHE PHE A . n A 1 356 MET 356 664 664 MET MET A . n A 1 357 ASP 357 665 665 ASP ASP A . n A 1 358 TYR 358 666 666 TYR TYR A . n A 1 359 ILE 359 667 667 ILE ILE A . n A 1 360 ILE 360 668 668 ILE ILE A . n A 1 361 THR 361 669 669 THR THR A . n A 1 362 ASP 362 670 670 ASP ASP A . n A 1 363 GLN 363 671 671 GLN GLN A . n A 1 364 GLU 364 672 672 GLU GLU A . n A 1 365 THR 365 673 673 THR THR A . n A 1 366 SER 366 674 674 SER SER A . n A 1 367 PRO 367 675 675 PRO PRO A . n A 1 368 ALA 368 676 676 ALA ALA A . n A 1 369 GLU 369 677 677 GLU GLU A . n A 1 370 VAL 370 678 678 VAL VAL A . n A 1 371 ALA 371 679 679 ALA ALA A . n A 1 372 GLU 372 680 680 GLU GLU A . n A 1 373 GLN 373 681 681 GLN GLN A . n A 1 374 TYR 374 682 682 TYR TYR A . n A 1 375 SER 375 683 683 SER SER A . n A 1 376 GLU 376 684 684 GLU GLU A . n A 1 377 LYS 377 685 685 LYS LYS A . n A 1 378 LEU 378 686 686 LEU LEU A . n A 1 379 ALA 379 687 687 ALA ALA A . n A 1 380 TYR 380 688 688 TYR TYR A . n A 1 381 MET 381 689 689 MET MET A . n A 1 382 PRO 382 690 690 PRO PRO A . n A 1 383 HIS 383 691 691 HIS HIS A . n A 1 384 THR 384 692 692 THR THR A . n A 1 385 PHE 385 693 693 PHE PHE A . n A 1 386 PHE 386 694 694 PHE PHE A . n A 1 387 ILE 387 695 695 ILE ILE A . n A 1 388 GLY 388 696 696 GLY GLY A . n A 1 389 ASP 389 697 697 ASP ASP A . n A 1 390 HIS 390 698 698 HIS HIS A . n A 1 391 ALA 391 699 699 ALA ALA A . n A 1 392 ASN 392 700 700 ASN ASN A . n A 1 393 MET 393 701 701 MET MET A . n A 1 394 PHE 394 702 702 PHE PHE A . n A 1 395 PRO 395 703 703 PRO PRO A . n A 1 396 HIS 396 704 704 HIS HIS A . n A 1 397 LEU 397 705 705 LEU LEU A . n A 1 398 LYS 398 706 706 LYS LYS A . n A 1 399 LYS 399 707 707 LYS LYS A . n A 1 400 LYS 400 708 708 LYS LYS A . n A 1 401 ALA 401 709 709 ALA ALA A . n A 1 402 VAL 402 710 710 VAL VAL A . n A 1 403 ILE 403 711 711 ILE ILE A . n A 1 404 ASP 404 712 712 ASP ASP A . n A 1 405 PHE 405 713 713 PHE PHE A . n A 1 406 LYS 406 714 714 LYS LYS A . n A 1 407 SER 407 715 ? ? ? A . n A 1 408 ASN 408 716 ? ? ? A . n A 1 409 GLY 409 717 ? ? ? A . n A 1 410 HIS 410 718 718 HIS HIS A . n A 1 411 ILE 411 719 719 ILE ILE A . n A 1 412 TYR 412 720 720 TYR TYR A . n A 1 413 ASP 413 721 721 ASP ASP A . n A 1 414 ASN 414 722 722 ASN ASN A . n A 1 415 ARG 415 723 723 ARG ARG A . n A 1 416 ILE 416 724 724 ILE ILE A . n A 1 417 VAL 417 725 725 VAL VAL A . n A 1 418 LEU 418 726 726 LEU LEU A . n A 1 419 ASN 419 727 727 ASN ASN A . n A 1 420 GLY 420 728 728 GLY GLY A . n A 1 421 ILE 421 729 729 ILE ILE A . n A 1 422 ASP 422 730 730 ASP ASP A . n A 1 423 LEU 423 731 731 LEU LEU A . n A 1 424 LYS 424 732 732 LYS LYS A . n A 1 425 ALA 425 733 733 ALA ALA A . n A 1 426 PHE 426 734 734 PHE PHE A . n A 1 427 LEU 427 735 735 LEU LEU A . n A 1 428 ASP 428 736 736 ASP ASP A . n A 1 429 SER 429 737 737 SER SER A . n A 1 430 LEU 430 738 738 LEU LEU A . n A 1 431 PRO 431 739 739 PRO PRO A . n A 1 432 ASP 432 740 740 ASP ASP A . n A 1 433 VAL 433 741 741 VAL VAL A . n A 1 434 LYS 434 742 742 LYS LYS A . n A 1 435 ILE 435 743 743 ILE ILE A . n A 1 436 VAL 436 744 744 VAL VAL A . n A 1 437 LYS 437 745 745 LYS LYS A . n A 1 438 MET 438 746 ? ? ? A . n A 1 439 LYS 439 747 ? ? ? A . n A 1 440 CYS 440 748 ? ? ? A . n A 1 441 PRO 441 749 ? ? ? A . n A 1 442 ASP 442 750 ? ? ? A . n A 1 443 GLY 443 751 ? ? ? A . n A 1 444 GLY 444 752 ? ? ? A . n A 1 445 ASP 445 753 ? ? ? A . n A 1 446 ASN 446 754 ? ? ? A . n A 1 447 ALA 447 755 ? ? ? A . n A 1 448 ASP 448 756 ? ? ? A . n A 1 449 SER 449 757 ? ? ? A . n A 1 450 SER 450 758 ? ? ? A . n A 1 451 ASN 451 759 ? ? ? A . n A 1 452 THR 452 760 ? ? ? A . n A 1 453 ALA 453 761 ? ? ? A . n A 1 454 LEU 454 762 ? ? ? A . n A 1 455 ASN 455 763 763 ASN ASN A . n A 1 456 MET 456 764 764 MET MET A . n A 1 457 PRO 457 765 765 PRO PRO A . n A 1 458 VAL 458 766 766 VAL VAL A . n A 1 459 ILE 459 767 767 ILE ILE A . n A 1 460 PRO 460 768 768 PRO PRO A . n A 1 461 MET 461 769 769 MET MET A . n A 1 462 ASN 462 770 770 ASN ASN A . n A 1 463 THR 463 771 771 THR THR A . n A 1 464 ILE 464 772 772 ILE ILE A . n A 1 465 ALA 465 773 773 ALA ALA A . n A 1 466 GLU 466 774 774 GLU GLU A . n A 1 467 ALA 467 775 775 ALA ALA A . n A 1 468 VAL 468 776 776 VAL VAL A . n A 1 469 ILE 469 777 777 ILE ILE A . n A 1 470 GLU 470 778 778 GLU GLU A . n A 1 471 MET 471 779 779 MET MET A . n A 1 472 ILE 472 780 780 ILE ILE A . n A 1 473 ASN 473 781 781 ASN ASN A . n A 1 474 ARG 474 782 782 ARG ARG A . n A 1 475 GLY 475 783 783 GLY GLY A . n A 1 476 GLN 476 784 784 GLN GLN A . n A 1 477 ILE 477 785 785 ILE ILE A . n A 1 478 GLN 478 786 786 GLN GLN A . n A 1 479 ILE 479 787 787 ILE ILE A . n A 1 480 THR 480 788 788 THR THR A . n A 1 481 ILE 481 789 789 ILE ILE A . n A 1 482 ASN 482 790 790 ASN ASN A . n A 1 483 GLY 483 791 791 GLY GLY A . n A 1 484 PHE 484 792 792 PHE PHE A . n A 1 485 SER 485 793 793 SER SER A . n A 1 486 ILE 486 794 794 ILE ILE A . n A 1 487 SER 487 795 795 SER SER A . n A 1 488 ASN 488 796 796 ASN ASN A . n A 1 489 GLY 489 797 797 GLY GLY A . n A 1 490 LEU 490 798 798 LEU LEU A . n A 1 491 ALA 491 799 799 ALA ALA A . n A 1 492 THR 492 800 800 THR THR A . n A 1 493 THR 493 801 801 THR THR A . n A 1 494 GLN 494 802 802 GLN GLN A . n A 1 495 ILE 495 803 803 ILE ILE A . n A 1 496 ASN 496 804 804 ASN ASN A . n A 1 497 ASN 497 805 805 ASN ASN A . n A 1 498 LYS 498 806 806 LYS LYS A . n A 1 499 ALA 499 807 807 ALA ALA A . n A 1 500 ALA 500 808 808 ALA ALA A . n A 1 501 THR 501 809 809 THR THR A . n A 1 502 GLY 502 810 810 GLY GLY A . n A 1 503 GLU 503 811 811 GLU GLU A . n A 1 504 GLU 504 812 812 GLU GLU A . n A 1 505 VAL 505 813 813 VAL VAL A . n A 1 506 PRO 506 814 814 PRO PRO A . n A 1 507 ARG 507 815 815 ARG ARG A . n A 1 508 THR 508 816 816 THR THR A . n A 1 509 ILE 509 817 817 ILE ILE A . n A 1 510 ILE 510 818 818 ILE ILE A . n A 1 511 VAL 511 819 819 VAL VAL A . n A 1 512 THR 512 820 820 THR THR A . n A 1 513 THR 513 821 821 THR THR A . n A 1 514 ARG 514 822 822 ARG ARG A . n A 1 515 SER 515 823 823 SER SER A . n A 1 516 GLN 516 824 824 GLN GLN A . n A 1 517 TYR 517 825 825 TYR TYR A . n A 1 518 GLY 518 826 826 GLY GLY A . n A 1 519 LEU 519 827 827 LEU LEU A . n A 1 520 PRO 520 828 828 PRO PRO A . n A 1 521 GLU 521 829 829 GLU GLU A . n A 1 522 ASP 522 830 830 ASP ASP A . n A 1 523 ALA 523 831 831 ALA ALA A . n A 1 524 ILE 524 832 832 ILE ILE A . n A 1 525 VAL 525 833 833 VAL VAL A . n A 1 526 TYR 526 834 834 TYR TYR A . n A 1 527 CYS 527 835 835 CYS CYS A . n A 1 528 ASN 528 836 836 ASN ASN A . n A 1 529 PHE 529 837 837 PHE PHE A . n A 1 530 ASN 530 838 838 ASN ASN A . n A 1 531 GLN 531 839 839 GLN GLN A . n A 1 532 LEU 532 840 840 LEU LEU A . n A 1 533 TYR 533 841 841 TYR TYR A . n A 1 534 LYS 534 842 842 LYS LYS A . n A 1 535 ILE 535 843 843 ILE ILE A . n A 1 536 ASP 536 844 844 ASP ASP A . n A 1 537 PRO 537 845 845 PRO PRO A . n A 1 538 SER 538 846 846 SER SER A . n A 1 539 THR 539 847 847 THR THR A . n A 1 540 LEU 540 848 848 LEU LEU A . n A 1 541 GLN 541 849 849 GLN GLN A . n A 1 542 MET 542 850 850 MET MET A . n A 1 543 TRP 543 851 851 TRP TRP A . n A 1 544 ALA 544 852 852 ALA ALA A . n A 1 545 ASN 545 853 853 ASN ASN A . n A 1 546 ILE 546 854 854 ILE ILE A . n A 1 547 LEU 547 855 855 LEU LEU A . n A 1 548 LYS 548 856 856 LYS LYS A . n A 1 549 ARG 549 857 857 ARG ARG A . n A 1 550 VAL 550 858 858 VAL VAL A . n A 1 551 PRO 551 859 859 PRO PRO A . n A 1 552 ASN 552 860 860 ASN ASN A . n A 1 553 SER 553 861 861 SER SER A . n A 1 554 VAL 554 862 862 VAL VAL A . n A 1 555 LEU 555 863 863 LEU LEU A . n A 1 556 TRP 556 864 864 TRP TRP A . n A 1 557 LEU 557 865 865 LEU LEU A . n A 1 558 LEU 558 866 866 LEU LEU A . n A 1 559 ARG 559 867 867 ARG ARG A . n A 1 560 PHE 560 868 868 PHE PHE A . n A 1 561 PRO 561 869 869 PRO PRO A . n A 1 562 ALA 562 870 870 ALA ALA A . n A 1 563 VAL 563 871 871 VAL VAL A . n A 1 564 GLY 564 872 872 GLY GLY A . n A 1 565 GLU 565 873 873 GLU GLU A . n A 1 566 PRO 566 874 874 PRO PRO A . n A 1 567 ASN 567 875 875 ASN ASN A . n A 1 568 ILE 568 876 876 ILE ILE A . n A 1 569 GLN 569 877 877 GLN GLN A . n A 1 570 GLN 570 878 878 GLN GLN A . n A 1 571 TYR 571 879 879 TYR TYR A . n A 1 572 ALA 572 880 880 ALA ALA A . n A 1 573 GLN 573 881 881 GLN GLN A . n A 1 574 ASN 574 882 882 ASN ASN A . n A 1 575 MET 575 883 883 MET MET A . n A 1 576 GLY 576 884 884 GLY GLY A . n A 1 577 LEU 577 885 885 LEU LEU A . n A 1 578 PRO 578 886 886 PRO PRO A . n A 1 579 GLN 579 887 887 GLN GLN A . n A 1 580 ASN 580 888 888 ASN ASN A . n A 1 581 ARG 581 889 889 ARG ARG A . n A 1 582 ILE 582 890 890 ILE ILE A . n A 1 583 ILE 583 891 891 ILE ILE A . n A 1 584 PHE 584 892 892 PHE PHE A . n A 1 585 SER 585 893 893 SER SER A . n A 1 586 PRO 586 894 894 PRO PRO A . n A 1 587 VAL 587 895 895 VAL VAL A . n A 1 588 ALA 588 896 896 ALA ALA A . n A 1 589 PRO 589 897 897 PRO PRO A . n A 1 590 LYS 590 898 898 LYS LYS A . n A 1 591 GLU 591 899 899 GLU GLU A . n A 1 592 GLU 592 900 900 GLU GLU A . n A 1 593 HIS 593 901 901 HIS HIS A . n A 1 594 VAL 594 902 902 VAL VAL A . n A 1 595 ARG 595 903 903 ARG ARG A . n A 1 596 ARG 596 904 904 ARG ARG A . n A 1 597 GLY 597 905 905 GLY GLY A . n A 1 598 GLN 598 906 906 GLN GLN A . n A 1 599 LEU 599 907 907 LEU LEU A . n A 1 600 ALA 600 908 908 ALA ALA A . n A 1 601 ASP 601 909 909 ASP ASP A . n A 1 602 VAL 602 910 910 VAL VAL A . n A 1 603 CYS 603 911 911 CYS CYS A . n A 1 604 LEU 604 912 912 LEU LEU A . n A 1 605 ASP 605 913 913 ASP ASP A . n A 1 606 THR 606 914 914 THR THR A . n A 1 607 PRO 607 915 915 PRO PRO A . n A 1 608 LEU 608 916 916 LEU LEU A . n A 1 609 CYS 609 917 917 CYS CYS A . n A 1 610 ASN 610 918 918 ASN ASN A . n A 1 611 GLY 611 919 919 GLY GLY A . n A 1 612 HIS 612 920 920 HIS HIS A . n A 1 613 THR 613 921 921 THR THR A . n A 1 614 THR 614 922 922 THR THR A . n A 1 615 GLY 615 923 923 GLY GLY A . n A 1 616 MET 616 924 924 MET MET A . n A 1 617 ASP 617 925 925 ASP ASP A . n A 1 618 VAL 618 926 926 VAL VAL A . n A 1 619 LEU 619 927 927 LEU LEU A . n A 1 620 TRP 620 928 928 TRP TRP A . n A 1 621 ALA 621 929 929 ALA ALA A . n A 1 622 GLY 622 930 930 GLY GLY A . n A 1 623 THR 623 931 931 THR THR A . n A 1 624 PRO 624 932 932 PRO PRO A . n A 1 625 MET 625 933 933 MET MET A . n A 1 626 VAL 626 934 934 VAL VAL A . n A 1 627 THR 627 935 935 THR THR A . n A 1 628 MET 628 936 936 MET MET A . n A 1 629 PRO 629 937 937 PRO PRO A . n A 1 630 GLY 630 938 938 GLY GLY A . n A 1 631 GLU 631 939 939 GLU GLU A . n A 1 632 THR 632 940 940 THR THR A . n A 1 633 LEU 633 941 941 LEU LEU A . n A 1 634 ALA 634 942 942 ALA ALA A . n A 1 635 SER 635 943 943 SER SER A . n A 1 636 ARG 636 944 944 ARG ARG A . n A 1 637 VAL 637 945 945 VAL VAL A . n A 1 638 ALA 638 946 946 ALA ALA A . n A 1 639 ALA 639 947 947 ALA ALA A . n A 1 640 SER 640 948 948 SER SER A . n A 1 641 GLN 641 949 949 GLN GLN A . n A 1 642 LEU 642 950 950 LEU LEU A . n A 1 643 THR 643 951 951 THR THR A . n A 1 644 CYS 644 952 952 CYS CYS A . n A 1 645 LEU 645 953 953 LEU LEU A . n A 1 646 GLY 646 954 954 GLY GLY A . n A 1 647 CYS 647 955 955 CYS CYS A . n A 1 648 LEU 648 956 956 LEU LEU A . n A 1 649 GLU 649 957 957 GLU GLU A . n A 1 650 LEU 650 958 958 LEU LEU A . n A 1 651 ILE 651 959 959 ILE ILE A . n A 1 652 ALA 652 960 960 ALA ALA A . n A 1 653 LYS 653 961 961 LYS LYS A . n A 1 654 ASN 654 962 962 ASN ASN A . n A 1 655 ARG 655 963 963 ARG ARG A . n A 1 656 GLN 656 964 964 GLN GLN A . n A 1 657 GLU 657 965 965 GLU GLU A . n A 1 658 TYR 658 966 966 TYR TYR A . n A 1 659 GLU 659 967 967 GLU GLU A . n A 1 660 ASP 660 968 968 ASP ASP A . n A 1 661 ILE 661 969 969 ILE ILE A . n A 1 662 ALA 662 970 970 ALA ALA A . n A 1 663 VAL 663 971 971 VAL VAL A . n A 1 664 LYS 664 972 972 LYS LYS A . n A 1 665 LEU 665 973 973 LEU LEU A . n A 1 666 GLY 666 974 974 GLY GLY A . n A 1 667 THR 667 975 975 THR THR A . n A 1 668 ASP 668 976 976 ASP ASP A . n A 1 669 LEU 669 977 977 LEU LEU A . n A 1 670 GLU 670 978 978 GLU GLU A . n A 1 671 TYR 671 979 979 TYR TYR A . n A 1 672 LEU 672 980 980 LEU LEU A . n A 1 673 LYS 673 981 981 LYS LYS A . n A 1 674 LYS 674 982 982 LYS LYS A . n A 1 675 VAL 675 983 983 VAL VAL A . n A 1 676 ARG 676 984 984 ARG ARG A . n A 1 677 GLY 677 985 985 GLY GLY A . n A 1 678 LYS 678 986 986 LYS LYS A . n A 1 679 VAL 679 987 987 VAL VAL A . n A 1 680 TRP 680 988 988 TRP TRP A . n A 1 681 LYS 681 989 989 LYS LYS A . n A 1 682 GLN 682 990 990 GLN GLN A . n A 1 683 ARG 683 991 991 ARG ARG A . n A 1 684 ILE 684 992 992 ILE ILE A . n A 1 685 SER 685 993 993 SER SER A . n A 1 686 SER 686 994 994 SER SER A . n A 1 687 PRO 687 995 995 PRO PRO A . n A 1 688 LEU 688 996 996 LEU LEU A . n A 1 689 PHE 689 997 997 PHE PHE A . n A 1 690 ASN 690 998 998 ASN ASN A . n A 1 691 THR 691 999 999 THR THR A . n A 1 692 LYS 692 1000 1000 LYS LYS A . n A 1 693 GLN 693 1001 1001 GLN GLN A . n A 1 694 TYR 694 1002 1002 TYR TYR A . n A 1 695 THR 695 1003 1003 THR THR A . n A 1 696 MET 696 1004 1004 MET MET A . n A 1 697 GLU 697 1005 1005 GLU GLU A . n A 1 698 LEU 698 1006 1006 LEU LEU A . n A 1 699 GLU 699 1007 1007 GLU GLU A . n A 1 700 ARG 700 1008 1008 ARG ARG A . n A 1 701 LEU 701 1009 1009 LEU LEU A . n A 1 702 TYR 702 1010 1010 TYR TYR A . n A 1 703 LEU 703 1011 1011 LEU LEU A . n A 1 704 GLN 704 1012 1012 GLN GLN A . n A 1 705 MET 705 1013 1013 MET MET A . n A 1 706 TRP 706 1014 1014 TRP TRP A . n A 1 707 GLU 707 1015 1015 GLU GLU A . n A 1 708 HIS 708 1016 1016 HIS HIS A . n A 1 709 TYR 709 1017 1017 TYR TYR A . n A 1 710 ALA 710 1018 1018 ALA ALA A . n A 1 711 ALA 711 1019 1019 ALA ALA A . n A 1 712 GLY 712 1020 1020 GLY GLY A . n A 1 713 ASN 713 1021 1021 ASN ASN A . n A 1 714 LYS 714 1022 1022 LYS LYS A . n A 1 715 PRO 715 1023 1023 PRO PRO A . n A 1 716 ASP 716 1024 1024 ASP ASP A . n A 1 717 HIS 717 1025 1025 HIS HIS A . n A 1 718 MET 718 1026 1026 MET MET A . n A 1 719 ILE 719 1027 1027 ILE ILE A . n A 1 720 LYS 720 1028 1028 LYS LYS A . n A 1 721 PRO 721 1029 ? ? ? A . n A 1 722 VAL 722 1030 ? ? ? A . n A 1 723 GLU 723 1031 ? ? ? A . n B 2 1 TYR 1 13 13 TYR TYR B . n B 2 2 PRO 2 14 14 PRO PRO B . n B 2 3 GLY 3 15 15 GLY GLY B . n B 2 4 GLY 4 16 16 GLY GLY B . n B 2 5 SER 5 17 17 SER SER B . n B 2 6 THR 6 18 18 THR THR B . n B 2 7 PRO 7 19 19 PRO PRO B . n B 2 8 VAL 8 20 20 VAL VAL B . n B 2 9 SER 9 21 21 SER SER B . n B 2 10 SER 10 22 22 SER SER B . n B 2 11 ALA 11 23 23 ALA ALA B . n B 2 12 ASN 12 24 24 ASN ASN B . n B 2 13 MET 13 25 25 MET MET B . n B 2 14 MET 14 26 26 MET MET B . n C 1 1 GLY 1 309 ? ? ? C . n C 1 2 PRO 2 310 ? ? ? C . n C 1 3 GLY 3 311 ? ? ? C . n C 1 4 SER 4 312 ? ? ? C . n C 1 5 CYS 5 313 ? ? ? C . n C 1 6 PRO 6 314 ? ? ? C . n C 1 7 THR 7 315 ? ? ? C . n C 1 8 HIS 8 316 ? ? ? C . n C 1 9 ALA 9 317 ? ? ? C . n C 1 10 ASP 10 318 ? ? ? C . n C 1 11 SER 11 319 ? ? ? C . n C 1 12 LEU 12 320 ? ? ? C . n C 1 13 ASN 13 321 ? ? ? C . n C 1 14 ASN 14 322 ? ? ? C . n C 1 15 LEU 15 323 ? ? ? C . n C 1 16 ALA 16 324 ? ? ? C . n C 1 17 ASN 17 325 ? ? ? C . n C 1 18 ILE 18 326 ? ? ? C . n C 1 19 LYS 19 327 ? ? ? C . n C 1 20 ARG 20 328 ? ? ? C . n C 1 21 GLU 21 329 ? ? ? C . n C 1 22 GLN 22 330 ? ? ? C . n C 1 23 GLY 23 331 ? ? ? C . n C 1 24 ASN 24 332 ? ? ? C . n C 1 25 ILE 25 333 ? ? ? C . n C 1 26 GLU 26 334 ? ? ? C . n C 1 27 GLU 27 335 ? ? ? C . n C 1 28 ALA 28 336 336 ALA ALA C . n C 1 29 VAL 29 337 337 VAL VAL C . n C 1 30 ARG 30 338 338 ARG ARG C . n C 1 31 LEU 31 339 339 LEU LEU C . n C 1 32 TYR 32 340 340 TYR TYR C . n C 1 33 ARG 33 341 341 ARG ARG C . n C 1 34 LYS 34 342 342 LYS LYS C . n C 1 35 ALA 35 343 343 ALA ALA C . n C 1 36 LEU 36 344 344 LEU LEU C . n C 1 37 GLU 37 345 345 GLU GLU C . n C 1 38 VAL 38 346 346 VAL VAL C . n C 1 39 PHE 39 347 347 PHE PHE C . n C 1 40 PRO 40 348 348 PRO PRO C . n C 1 41 GLU 41 349 349 GLU GLU C . n C 1 42 PHE 42 350 350 PHE PHE C . n C 1 43 ALA 43 351 351 ALA ALA C . n C 1 44 ALA 44 352 352 ALA ALA C . n C 1 45 ALA 45 353 353 ALA ALA C . n C 1 46 HIS 46 354 354 HIS HIS C . n C 1 47 SER 47 355 355 SER SER C . n C 1 48 ASN 48 356 356 ASN ASN C . n C 1 49 LEU 49 357 357 LEU LEU C . n C 1 50 ALA 50 358 358 ALA ALA C . n C 1 51 SER 51 359 359 SER SER C . n C 1 52 VAL 52 360 360 VAL VAL C . n C 1 53 LEU 53 361 361 LEU LEU C . n C 1 54 GLN 54 362 362 GLN GLN C . n C 1 55 GLN 55 363 363 GLN GLN C . n C 1 56 GLN 56 364 364 GLN GLN C . n C 1 57 GLY 57 365 365 GLY GLY C . n C 1 58 LYS 58 366 366 LYS LYS C . n C 1 59 LEU 59 367 367 LEU LEU C . n C 1 60 GLN 60 368 368 GLN GLN C . n C 1 61 GLU 61 369 369 GLU GLU C . n C 1 62 ALA 62 370 370 ALA ALA C . n C 1 63 LEU 63 371 371 LEU LEU C . n C 1 64 MET 64 372 372 MET MET C . n C 1 65 HIS 65 373 373 HIS HIS C . n C 1 66 TYR 66 374 374 TYR TYR C . n C 1 67 LYS 67 375 375 LYS LYS C . n C 1 68 GLU 68 376 376 GLU GLU C . n C 1 69 ALA 69 377 377 ALA ALA C . n C 1 70 ILE 70 378 378 ILE ILE C . n C 1 71 ARG 71 379 379 ARG ARG C . n C 1 72 ILE 72 380 380 ILE ILE C . n C 1 73 SER 73 381 381 SER SER C . n C 1 74 PRO 74 382 382 PRO PRO C . n C 1 75 THR 75 383 383 THR THR C . n C 1 76 PHE 76 384 384 PHE PHE C . n C 1 77 ALA 77 385 385 ALA ALA C . n C 1 78 ASP 78 386 386 ASP ASP C . n C 1 79 ALA 79 387 387 ALA ALA C . n C 1 80 TYR 80 388 388 TYR TYR C . n C 1 81 SER 81 389 389 SER SER C . n C 1 82 ASN 82 390 390 ASN ASN C . n C 1 83 MET 83 391 391 MET MET C . n C 1 84 GLY 84 392 392 GLY GLY C . n C 1 85 ASN 85 393 393 ASN ASN C . n C 1 86 THR 86 394 394 THR THR C . n C 1 87 LEU 87 395 395 LEU LEU C . n C 1 88 LYS 88 396 396 LYS LYS C . n C 1 89 GLU 89 397 397 GLU GLU C . n C 1 90 MET 90 398 398 MET MET C . n C 1 91 GLN 91 399 399 GLN GLN C . n C 1 92 ASP 92 400 400 ASP ASP C . n C 1 93 VAL 93 401 401 VAL VAL C . n C 1 94 GLN 94 402 402 GLN GLN C . n C 1 95 GLY 95 403 403 GLY GLY C . n C 1 96 ALA 96 404 404 ALA ALA C . n C 1 97 LEU 97 405 405 LEU LEU C . n C 1 98 GLN 98 406 406 GLN GLN C . n C 1 99 CYS 99 407 407 CYS CYS C . n C 1 100 TYR 100 408 408 TYR TYR C . n C 1 101 THR 101 409 409 THR THR C . n C 1 102 ARG 102 410 410 ARG ARG C . n C 1 103 ALA 103 411 411 ALA ALA C . n C 1 104 ILE 104 412 412 ILE ILE C . n C 1 105 GLN 105 413 413 GLN GLN C . n C 1 106 ILE 106 414 414 ILE ILE C . n C 1 107 ASN 107 415 415 ASN ASN C . n C 1 108 PRO 108 416 416 PRO PRO C . n C 1 109 ALA 109 417 417 ALA ALA C . n C 1 110 PHE 110 418 418 PHE PHE C . n C 1 111 ALA 111 419 419 ALA ALA C . n C 1 112 ASP 112 420 420 ASP ASP C . n C 1 113 ALA 113 421 421 ALA ALA C . n C 1 114 HIS 114 422 422 HIS HIS C . n C 1 115 SER 115 423 423 SER SER C . n C 1 116 ASN 116 424 424 ASN ASN C . n C 1 117 LEU 117 425 425 LEU LEU C . n C 1 118 ALA 118 426 426 ALA ALA C . n C 1 119 SER 119 427 427 SER SER C . n C 1 120 ILE 120 428 428 ILE ILE C . n C 1 121 HIS 121 429 429 HIS HIS C . n C 1 122 LYS 122 430 430 LYS LYS C . n C 1 123 ASP 123 431 431 ASP ASP C . n C 1 124 SER 124 432 432 SER SER C . n C 1 125 GLY 125 433 433 GLY GLY C . n C 1 126 ASN 126 434 434 ASN ASN C . n C 1 127 ILE 127 435 435 ILE ILE C . n C 1 128 PRO 128 436 436 PRO PRO C . n C 1 129 GLU 129 437 437 GLU GLU C . n C 1 130 ALA 130 438 438 ALA ALA C . n C 1 131 ILE 131 439 439 ILE ILE C . n C 1 132 ALA 132 440 440 ALA ALA C . n C 1 133 SER 133 441 441 SER SER C . n C 1 134 TYR 134 442 442 TYR TYR C . n C 1 135 ARG 135 443 443 ARG ARG C . n C 1 136 THR 136 444 444 THR THR C . n C 1 137 ALA 137 445 445 ALA ALA C . n C 1 138 LEU 138 446 446 LEU LEU C . n C 1 139 LYS 139 447 447 LYS LYS C . n C 1 140 LEU 140 448 448 LEU LEU C . n C 1 141 LYS 141 449 449 LYS LYS C . n C 1 142 PRO 142 450 450 PRO PRO C . n C 1 143 ASP 143 451 451 ASP ASP C . n C 1 144 PHE 144 452 452 PHE PHE C . n C 1 145 PRO 145 453 453 PRO PRO C . n C 1 146 ASP 146 454 454 ASP ASP C . n C 1 147 ALA 147 455 455 ALA ALA C . n C 1 148 TYR 148 456 456 TYR TYR C . n C 1 149 CYS 149 457 457 CYS CYS C . n C 1 150 ASN 150 458 458 ASN ASN C . n C 1 151 LEU 151 459 459 LEU LEU C . n C 1 152 ALA 152 460 460 ALA ALA C . n C 1 153 HIS 153 461 461 HIS HIS C . n C 1 154 CYS 154 462 462 CYS CYS C . n C 1 155 LEU 155 463 463 LEU LEU C . n C 1 156 GLN 156 464 464 GLN GLN C . n C 1 157 ILE 157 465 465 ILE ILE C . n C 1 158 VAL 158 466 466 VAL VAL C . n C 1 159 CYS 159 467 467 CYS CYS C . n C 1 160 ASP 160 468 468 ASP ASP C . n C 1 161 TRP 161 469 469 TRP TRP C . n C 1 162 THR 162 470 470 THR THR C . n C 1 163 ASP 163 471 471 ASP ASP C . n C 1 164 TYR 164 472 472 TYR TYR C . n C 1 165 ASP 165 473 473 ASP ASP C . n C 1 166 GLU 166 474 474 GLU GLU C . n C 1 167 ARG 167 475 475 ARG ARG C . n C 1 168 MET 168 476 476 MET MET C . n C 1 169 LYS 169 477 477 LYS LYS C . n C 1 170 LYS 170 478 478 LYS LYS C . n C 1 171 LEU 171 479 479 LEU LEU C . n C 1 172 VAL 172 480 480 VAL VAL C . n C 1 173 SER 173 481 481 SER SER C . n C 1 174 ILE 174 482 482 ILE ILE C . n C 1 175 VAL 175 483 483 VAL VAL C . n C 1 176 ALA 176 484 484 ALA ALA C . n C 1 177 ASP 177 485 485 ASP ASP C . n C 1 178 GLN 178 486 486 GLN GLN C . n C 1 179 LEU 179 487 487 LEU LEU C . n C 1 180 GLU 180 488 488 GLU GLU C . n C 1 181 LYS 181 489 489 LYS LYS C . n C 1 182 ASN 182 490 490 ASN ASN C . n C 1 183 ARG 183 491 491 ARG ARG C . n C 1 184 LEU 184 492 492 LEU LEU C . n C 1 185 PRO 185 493 493 PRO PRO C . n C 1 186 SER 186 494 494 SER SER C . n C 1 187 VAL 187 495 495 VAL VAL C . n C 1 188 HIS 188 496 496 HIS HIS C . n C 1 189 PRO 189 497 497 PRO PRO C . n C 1 190 HIS 190 498 498 HIS HIS C . n C 1 191 HIS 191 499 499 HIS HIS C . n C 1 192 SER 192 500 500 SER SER C . n C 1 193 MET 193 501 501 MET MET C . n C 1 194 LEU 194 502 502 LEU LEU C . n C 1 195 TYR 195 503 503 TYR TYR C . n C 1 196 PRO 196 504 504 PRO PRO C . n C 1 197 LEU 197 505 505 LEU LEU C . n C 1 198 SER 198 506 506 SER SER C . n C 1 199 HIS 199 507 507 HIS HIS C . n C 1 200 GLY 200 508 508 GLY GLY C . n C 1 201 PHE 201 509 509 PHE PHE C . n C 1 202 ARG 202 510 510 ARG ARG C . n C 1 203 LYS 203 511 511 LYS LYS C . n C 1 204 ALA 204 512 512 ALA ALA C . n C 1 205 ILE 205 513 513 ILE ILE C . n C 1 206 ALA 206 514 514 ALA ALA C . n C 1 207 GLU 207 515 515 GLU GLU C . n C 1 208 ARG 208 516 516 ARG ARG C . n C 1 209 HIS 209 517 517 HIS HIS C . n C 1 210 GLY 210 518 518 GLY GLY C . n C 1 211 ASN 211 519 519 ASN ASN C . n C 1 212 LEU 212 520 520 LEU LEU C . n C 1 213 CYS 213 521 521 CYS CYS C . n C 1 214 LEU 214 522 522 LEU LEU C . n C 1 215 ASP 215 523 523 ASP ASP C . n C 1 216 LYS 216 524 524 LYS LYS C . n C 1 217 ILE 217 525 525 ILE ILE C . n C 1 218 ASN 218 526 526 ASN ASN C . n C 1 219 VAL 219 527 527 VAL VAL C . n C 1 220 LEU 220 528 528 LEU LEU C . n C 1 221 HIS 221 529 529 HIS HIS C . n C 1 222 LYS 222 530 530 LYS LYS C . n C 1 223 PRO 223 531 531 PRO PRO C . n C 1 224 PRO 224 532 532 PRO PRO C . n C 1 225 TYR 225 533 533 TYR TYR C . n C 1 226 GLU 226 534 534 GLU GLU C . n C 1 227 HIS 227 535 535 HIS HIS C . n C 1 228 PRO 228 536 536 PRO PRO C . n C 1 229 LYS 229 537 537 LYS LYS C . n C 1 230 ASP 230 538 538 ASP ASP C . n C 1 231 LEU 231 539 539 LEU LEU C . n C 1 232 LYS 232 540 540 LYS LYS C . n C 1 233 LEU 233 541 541 LEU LEU C . n C 1 234 SER 234 542 542 SER SER C . n C 1 235 ASP 235 543 543 ASP ASP C . n C 1 236 GLY 236 544 544 GLY GLY C . n C 1 237 ARG 237 545 545 ARG ARG C . n C 1 238 LEU 238 546 546 LEU LEU C . n C 1 239 ARG 239 547 547 ARG ARG C . n C 1 240 VAL 240 548 548 VAL VAL C . n C 1 241 GLY 241 549 549 GLY GLY C . n C 1 242 TYR 242 550 550 TYR TYR C . n C 1 243 VAL 243 551 551 VAL VAL C . n C 1 244 SER 244 552 552 SER SER C . n C 1 245 SER 245 553 553 SER SER C . n C 1 246 ASP 246 554 554 ASP ASP C . n C 1 247 PHE 247 555 555 PHE PHE C . n C 1 248 GLY 248 556 556 GLY GLY C . n C 1 249 ASN 249 557 557 ASN ASN C . n C 1 250 HIS 250 558 558 HIS HIS C . n C 1 251 PRO 251 559 559 PRO PRO C . n C 1 252 THR 252 560 560 THR THR C . n C 1 253 SER 253 561 561 SER SER C . n C 1 254 HIS 254 562 562 HIS HIS C . n C 1 255 LEU 255 563 563 LEU LEU C . n C 1 256 MET 256 564 564 MET MET C . n C 1 257 GLN 257 565 565 GLN GLN C . n C 1 258 SER 258 566 566 SER SER C . n C 1 259 ILE 259 567 567 ILE ILE C . n C 1 260 PRO 260 568 568 PRO PRO C . n C 1 261 GLY 261 569 569 GLY GLY C . n C 1 262 MET 262 570 570 MET MET C . n C 1 263 HIS 263 571 571 HIS HIS C . n C 1 264 ASN 264 572 572 ASN ASN C . n C 1 265 PRO 265 573 573 PRO PRO C . n C 1 266 ASP 266 574 574 ASP ASP C . n C 1 267 LYS 267 575 575 LYS LYS C . n C 1 268 PHE 268 576 576 PHE PHE C . n C 1 269 GLU 269 577 577 GLU GLU C . n C 1 270 VAL 270 578 578 VAL VAL C . n C 1 271 PHE 271 579 579 PHE PHE C . n C 1 272 CYS 272 580 580 CYS CYS C . n C 1 273 TYR 273 581 581 TYR TYR C . n C 1 274 ALA 274 582 582 ALA ALA C . n C 1 275 LEU 275 583 583 LEU LEU C . n C 1 276 SER 276 584 584 SER SER C . n C 1 277 PRO 277 585 585 PRO PRO C . n C 1 278 ASP 278 586 586 ASP ASP C . n C 1 279 ASP 279 587 587 ASP ASP C . n C 1 280 GLY 280 588 588 GLY GLY C . n C 1 281 THR 281 589 589 THR THR C . n C 1 282 ASN 282 590 590 ASN ASN C . n C 1 283 PHE 283 591 591 PHE PHE C . n C 1 284 ARG 284 592 592 ARG ARG C . n C 1 285 VAL 285 593 593 VAL VAL C . n C 1 286 LYS 286 594 594 LYS LYS C . n C 1 287 VAL 287 595 595 VAL VAL C . n C 1 288 MET 288 596 596 MET MET C . n C 1 289 ALA 289 597 597 ALA ALA C . n C 1 290 GLU 290 598 598 GLU GLU C . n C 1 291 ALA 291 599 599 ALA ALA C . n C 1 292 ASN 292 600 600 ASN ASN C . n C 1 293 HIS 293 601 601 HIS HIS C . n C 1 294 PHE 294 602 602 PHE PHE C . n C 1 295 ILE 295 603 603 ILE ILE C . n C 1 296 ASP 296 604 604 ASP ASP C . n C 1 297 LEU 297 605 605 LEU LEU C . n C 1 298 SER 298 606 606 SER SER C . n C 1 299 GLN 299 607 607 GLN GLN C . n C 1 300 ILE 300 608 608 ILE ILE C . n C 1 301 PRO 301 609 609 PRO PRO C . n C 1 302 CYS 302 610 610 CYS CYS C . n C 1 303 ASN 303 611 611 ASN ASN C . n C 1 304 GLY 304 612 612 GLY GLY C . n C 1 305 LYS 305 613 613 LYS LYS C . n C 1 306 ALA 306 614 614 ALA ALA C . n C 1 307 ALA 307 615 615 ALA ALA C . n C 1 308 ASP 308 616 616 ASP ASP C . n C 1 309 ARG 309 617 617 ARG ARG C . n C 1 310 ILE 310 618 618 ILE ILE C . n C 1 311 HIS 311 619 619 HIS HIS C . n C 1 312 GLN 312 620 620 GLN GLN C . n C 1 313 ASP 313 621 621 ASP ASP C . n C 1 314 GLY 314 622 622 GLY GLY C . n C 1 315 ILE 315 623 623 ILE ILE C . n C 1 316 HIS 316 624 624 HIS HIS C . n C 1 317 ILE 317 625 625 ILE ILE C . n C 1 318 LEU 318 626 626 LEU LEU C . n C 1 319 VAL 319 627 627 VAL VAL C . n C 1 320 ASN 320 628 628 ASN ASN C . n C 1 321 MET 321 629 629 MET MET C . n C 1 322 ASN 322 630 630 ASN ASN C . n C 1 323 GLY 323 631 631 GLY GLY C . n C 1 324 TYR 324 632 632 TYR TYR C . n C 1 325 THR 325 633 633 THR THR C . n C 1 326 LYS 326 634 634 LYS LYS C . n C 1 327 GLY 327 635 635 GLY GLY C . n C 1 328 ALA 328 636 636 ALA ALA C . n C 1 329 ARG 329 637 637 ARG ARG C . n C 1 330 ASN 330 638 638 ASN ASN C . n C 1 331 GLU 331 639 639 GLU GLU C . n C 1 332 LEU 332 640 640 LEU LEU C . n C 1 333 PHE 333 641 641 PHE PHE C . n C 1 334 ALA 334 642 642 ALA ALA C . n C 1 335 LEU 335 643 643 LEU LEU C . n C 1 336 ARG 336 644 644 ARG ARG C . n C 1 337 PRO 337 645 645 PRO PRO C . n C 1 338 ALA 338 646 646 ALA ALA C . n C 1 339 PRO 339 647 647 PRO PRO C . n C 1 340 ILE 340 648 648 ILE ILE C . n C 1 341 GLN 341 649 649 GLN GLN C . n C 1 342 ALA 342 650 650 ALA ALA C . n C 1 343 MET 343 651 651 MET MET C . n C 1 344 TRP 344 652 652 TRP TRP C . n C 1 345 LEU 345 653 653 LEU LEU C . n C 1 346 GLY 346 654 654 GLY GLY C . n C 1 347 TYR 347 655 655 TYR TYR C . n C 1 348 PRO 348 656 656 PRO PRO C . n C 1 349 GLY 349 657 657 GLY GLY C . n C 1 350 THR 350 658 658 THR THR C . n C 1 351 SER 351 659 659 SER SER C . n C 1 352 GLY 352 660 660 GLY GLY C . n C 1 353 ALA 353 661 661 ALA ALA C . n C 1 354 LEU 354 662 662 LEU LEU C . n C 1 355 PHE 355 663 663 PHE PHE C . n C 1 356 MET 356 664 664 MET MET C . n C 1 357 ASP 357 665 665 ASP ASP C . n C 1 358 TYR 358 666 666 TYR TYR C . n C 1 359 ILE 359 667 667 ILE ILE C . n C 1 360 ILE 360 668 668 ILE ILE C . n C 1 361 THR 361 669 669 THR THR C . n C 1 362 ASP 362 670 670 ASP ASP C . n C 1 363 GLN 363 671 671 GLN GLN C . n C 1 364 GLU 364 672 672 GLU GLU C . n C 1 365 THR 365 673 673 THR THR C . n C 1 366 SER 366 674 674 SER SER C . n C 1 367 PRO 367 675 675 PRO PRO C . n C 1 368 ALA 368 676 676 ALA ALA C . n C 1 369 GLU 369 677 677 GLU GLU C . n C 1 370 VAL 370 678 678 VAL VAL C . n C 1 371 ALA 371 679 679 ALA ALA C . n C 1 372 GLU 372 680 680 GLU GLU C . n C 1 373 GLN 373 681 681 GLN GLN C . n C 1 374 TYR 374 682 682 TYR TYR C . n C 1 375 SER 375 683 683 SER SER C . n C 1 376 GLU 376 684 684 GLU GLU C . n C 1 377 LYS 377 685 685 LYS LYS C . n C 1 378 LEU 378 686 686 LEU LEU C . n C 1 379 ALA 379 687 687 ALA ALA C . n C 1 380 TYR 380 688 688 TYR TYR C . n C 1 381 MET 381 689 689 MET MET C . n C 1 382 PRO 382 690 690 PRO PRO C . n C 1 383 HIS 383 691 691 HIS HIS C . n C 1 384 THR 384 692 692 THR THR C . n C 1 385 PHE 385 693 693 PHE PHE C . n C 1 386 PHE 386 694 694 PHE PHE C . n C 1 387 ILE 387 695 695 ILE ILE C . n C 1 388 GLY 388 696 696 GLY GLY C . n C 1 389 ASP 389 697 697 ASP ASP C . n C 1 390 HIS 390 698 698 HIS HIS C . n C 1 391 ALA 391 699 699 ALA ALA C . n C 1 392 ASN 392 700 700 ASN ASN C . n C 1 393 MET 393 701 701 MET MET C . n C 1 394 PHE 394 702 702 PHE PHE C . n C 1 395 PRO 395 703 703 PRO PRO C . n C 1 396 HIS 396 704 704 HIS HIS C . n C 1 397 LEU 397 705 705 LEU LEU C . n C 1 398 LYS 398 706 706 LYS LYS C . n C 1 399 LYS 399 707 707 LYS LYS C . n C 1 400 LYS 400 708 708 LYS LYS C . n C 1 401 ALA 401 709 709 ALA ALA C . n C 1 402 VAL 402 710 710 VAL VAL C . n C 1 403 ILE 403 711 711 ILE ILE C . n C 1 404 ASP 404 712 712 ASP ASP C . n C 1 405 PHE 405 713 713 PHE PHE C . n C 1 406 LYS 406 714 714 LYS LYS C . n C 1 407 SER 407 715 ? ? ? C . n C 1 408 ASN 408 716 ? ? ? C . n C 1 409 GLY 409 717 ? ? ? C . n C 1 410 HIS 410 718 718 HIS HIS C . n C 1 411 ILE 411 719 719 ILE ILE C . n C 1 412 TYR 412 720 720 TYR TYR C . n C 1 413 ASP 413 721 721 ASP ASP C . n C 1 414 ASN 414 722 722 ASN ASN C . n C 1 415 ARG 415 723 723 ARG ARG C . n C 1 416 ILE 416 724 724 ILE ILE C . n C 1 417 VAL 417 725 725 VAL VAL C . n C 1 418 LEU 418 726 726 LEU LEU C . n C 1 419 ASN 419 727 727 ASN ASN C . n C 1 420 GLY 420 728 728 GLY GLY C . n C 1 421 ILE 421 729 729 ILE ILE C . n C 1 422 ASP 422 730 730 ASP ASP C . n C 1 423 LEU 423 731 731 LEU LEU C . n C 1 424 LYS 424 732 732 LYS LYS C . n C 1 425 ALA 425 733 733 ALA ALA C . n C 1 426 PHE 426 734 734 PHE PHE C . n C 1 427 LEU 427 735 735 LEU LEU C . n C 1 428 ASP 428 736 736 ASP ASP C . n C 1 429 SER 429 737 737 SER SER C . n C 1 430 LEU 430 738 738 LEU LEU C . n C 1 431 PRO 431 739 739 PRO PRO C . n C 1 432 ASP 432 740 740 ASP ASP C . n C 1 433 VAL 433 741 741 VAL VAL C . n C 1 434 LYS 434 742 742 LYS LYS C . n C 1 435 ILE 435 743 743 ILE ILE C . n C 1 436 VAL 436 744 744 VAL VAL C . n C 1 437 LYS 437 745 745 LYS LYS C . n C 1 438 MET 438 746 746 MET MET C . n C 1 439 LYS 439 747 ? ? ? C . n C 1 440 CYS 440 748 ? ? ? C . n C 1 441 PRO 441 749 ? ? ? C . n C 1 442 ASP 442 750 ? ? ? C . n C 1 443 GLY 443 751 ? ? ? C . n C 1 444 GLY 444 752 ? ? ? C . n C 1 445 ASP 445 753 ? ? ? C . n C 1 446 ASN 446 754 ? ? ? C . n C 1 447 ALA 447 755 ? ? ? C . n C 1 448 ASP 448 756 ? ? ? C . n C 1 449 SER 449 757 ? ? ? C . n C 1 450 SER 450 758 ? ? ? C . n C 1 451 ASN 451 759 ? ? ? C . n C 1 452 THR 452 760 ? ? ? C . n C 1 453 ALA 453 761 ? ? ? C . n C 1 454 LEU 454 762 ? ? ? C . n C 1 455 ASN 455 763 763 ASN ASN C . n C 1 456 MET 456 764 764 MET MET C . n C 1 457 PRO 457 765 765 PRO PRO C . n C 1 458 VAL 458 766 766 VAL VAL C . n C 1 459 ILE 459 767 767 ILE ILE C . n C 1 460 PRO 460 768 768 PRO PRO C . n C 1 461 MET 461 769 769 MET MET C . n C 1 462 ASN 462 770 770 ASN ASN C . n C 1 463 THR 463 771 771 THR THR C . n C 1 464 ILE 464 772 772 ILE ILE C . n C 1 465 ALA 465 773 773 ALA ALA C . n C 1 466 GLU 466 774 774 GLU GLU C . n C 1 467 ALA 467 775 775 ALA ALA C . n C 1 468 VAL 468 776 776 VAL VAL C . n C 1 469 ILE 469 777 777 ILE ILE C . n C 1 470 GLU 470 778 778 GLU GLU C . n C 1 471 MET 471 779 779 MET MET C . n C 1 472 ILE 472 780 780 ILE ILE C . n C 1 473 ASN 473 781 781 ASN ASN C . n C 1 474 ARG 474 782 782 ARG ARG C . n C 1 475 GLY 475 783 783 GLY GLY C . n C 1 476 GLN 476 784 784 GLN GLN C . n C 1 477 ILE 477 785 785 ILE ILE C . n C 1 478 GLN 478 786 786 GLN GLN C . n C 1 479 ILE 479 787 787 ILE ILE C . n C 1 480 THR 480 788 788 THR THR C . n C 1 481 ILE 481 789 789 ILE ILE C . n C 1 482 ASN 482 790 790 ASN ASN C . n C 1 483 GLY 483 791 791 GLY GLY C . n C 1 484 PHE 484 792 792 PHE PHE C . n C 1 485 SER 485 793 793 SER SER C . n C 1 486 ILE 486 794 794 ILE ILE C . n C 1 487 SER 487 795 795 SER SER C . n C 1 488 ASN 488 796 796 ASN ASN C . n C 1 489 GLY 489 797 797 GLY GLY C . n C 1 490 LEU 490 798 798 LEU LEU C . n C 1 491 ALA 491 799 799 ALA ALA C . n C 1 492 THR 492 800 800 THR THR C . n C 1 493 THR 493 801 801 THR THR C . n C 1 494 GLN 494 802 802 GLN GLN C . n C 1 495 ILE 495 803 803 ILE ILE C . n C 1 496 ASN 496 804 804 ASN ASN C . n C 1 497 ASN 497 805 805 ASN ASN C . n C 1 498 LYS 498 806 806 LYS LYS C . n C 1 499 ALA 499 807 807 ALA ALA C . n C 1 500 ALA 500 808 808 ALA ALA C . n C 1 501 THR 501 809 809 THR THR C . n C 1 502 GLY 502 810 810 GLY GLY C . n C 1 503 GLU 503 811 811 GLU GLU C . n C 1 504 GLU 504 812 812 GLU GLU C . n C 1 505 VAL 505 813 813 VAL VAL C . n C 1 506 PRO 506 814 814 PRO PRO C . n C 1 507 ARG 507 815 815 ARG ARG C . n C 1 508 THR 508 816 816 THR THR C . n C 1 509 ILE 509 817 817 ILE ILE C . n C 1 510 ILE 510 818 818 ILE ILE C . n C 1 511 VAL 511 819 819 VAL VAL C . n C 1 512 THR 512 820 820 THR THR C . n C 1 513 THR 513 821 821 THR THR C . n C 1 514 ARG 514 822 822 ARG ARG C . n C 1 515 SER 515 823 823 SER SER C . n C 1 516 GLN 516 824 824 GLN GLN C . n C 1 517 TYR 517 825 825 TYR TYR C . n C 1 518 GLY 518 826 826 GLY GLY C . n C 1 519 LEU 519 827 827 LEU LEU C . n C 1 520 PRO 520 828 828 PRO PRO C . n C 1 521 GLU 521 829 829 GLU GLU C . n C 1 522 ASP 522 830 830 ASP ASP C . n C 1 523 ALA 523 831 831 ALA ALA C . n C 1 524 ILE 524 832 832 ILE ILE C . n C 1 525 VAL 525 833 833 VAL VAL C . n C 1 526 TYR 526 834 834 TYR TYR C . n C 1 527 CYS 527 835 835 CYS CYS C . n C 1 528 ASN 528 836 836 ASN ASN C . n C 1 529 PHE 529 837 837 PHE PHE C . n C 1 530 ASN 530 838 838 ASN ASN C . n C 1 531 GLN 531 839 839 GLN GLN C . n C 1 532 LEU 532 840 840 LEU LEU C . n C 1 533 TYR 533 841 841 TYR TYR C . n C 1 534 LYS 534 842 842 LYS LYS C . n C 1 535 ILE 535 843 843 ILE ILE C . n C 1 536 ASP 536 844 844 ASP ASP C . n C 1 537 PRO 537 845 845 PRO PRO C . n C 1 538 SER 538 846 846 SER SER C . n C 1 539 THR 539 847 847 THR THR C . n C 1 540 LEU 540 848 848 LEU LEU C . n C 1 541 GLN 541 849 849 GLN GLN C . n C 1 542 MET 542 850 850 MET MET C . n C 1 543 TRP 543 851 851 TRP TRP C . n C 1 544 ALA 544 852 852 ALA ALA C . n C 1 545 ASN 545 853 853 ASN ASN C . n C 1 546 ILE 546 854 854 ILE ILE C . n C 1 547 LEU 547 855 855 LEU LEU C . n C 1 548 LYS 548 856 856 LYS LYS C . n C 1 549 ARG 549 857 857 ARG ARG C . n C 1 550 VAL 550 858 858 VAL VAL C . n C 1 551 PRO 551 859 859 PRO PRO C . n C 1 552 ASN 552 860 860 ASN ASN C . n C 1 553 SER 553 861 861 SER SER C . n C 1 554 VAL 554 862 862 VAL VAL C . n C 1 555 LEU 555 863 863 LEU LEU C . n C 1 556 TRP 556 864 864 TRP TRP C . n C 1 557 LEU 557 865 865 LEU LEU C . n C 1 558 LEU 558 866 866 LEU LEU C . n C 1 559 ARG 559 867 867 ARG ARG C . n C 1 560 PHE 560 868 868 PHE PHE C . n C 1 561 PRO 561 869 869 PRO PRO C . n C 1 562 ALA 562 870 870 ALA ALA C . n C 1 563 VAL 563 871 871 VAL VAL C . n C 1 564 GLY 564 872 872 GLY GLY C . n C 1 565 GLU 565 873 873 GLU GLU C . n C 1 566 PRO 566 874 874 PRO PRO C . n C 1 567 ASN 567 875 875 ASN ASN C . n C 1 568 ILE 568 876 876 ILE ILE C . n C 1 569 GLN 569 877 877 GLN GLN C . n C 1 570 GLN 570 878 878 GLN GLN C . n C 1 571 TYR 571 879 879 TYR TYR C . n C 1 572 ALA 572 880 880 ALA ALA C . n C 1 573 GLN 573 881 881 GLN GLN C . n C 1 574 ASN 574 882 882 ASN ASN C . n C 1 575 MET 575 883 883 MET MET C . n C 1 576 GLY 576 884 884 GLY GLY C . n C 1 577 LEU 577 885 885 LEU LEU C . n C 1 578 PRO 578 886 886 PRO PRO C . n C 1 579 GLN 579 887 887 GLN GLN C . n C 1 580 ASN 580 888 888 ASN ASN C . n C 1 581 ARG 581 889 889 ARG ARG C . n C 1 582 ILE 582 890 890 ILE ILE C . n C 1 583 ILE 583 891 891 ILE ILE C . n C 1 584 PHE 584 892 892 PHE PHE C . n C 1 585 SER 585 893 893 SER SER C . n C 1 586 PRO 586 894 894 PRO PRO C . n C 1 587 VAL 587 895 895 VAL VAL C . n C 1 588 ALA 588 896 896 ALA ALA C . n C 1 589 PRO 589 897 897 PRO PRO C . n C 1 590 LYS 590 898 898 LYS LYS C . n C 1 591 GLU 591 899 899 GLU GLU C . n C 1 592 GLU 592 900 900 GLU GLU C . n C 1 593 HIS 593 901 901 HIS HIS C . n C 1 594 VAL 594 902 902 VAL VAL C . n C 1 595 ARG 595 903 903 ARG ARG C . n C 1 596 ARG 596 904 904 ARG ARG C . n C 1 597 GLY 597 905 905 GLY GLY C . n C 1 598 GLN 598 906 906 GLN GLN C . n C 1 599 LEU 599 907 907 LEU LEU C . n C 1 600 ALA 600 908 908 ALA ALA C . n C 1 601 ASP 601 909 909 ASP ASP C . n C 1 602 VAL 602 910 910 VAL VAL C . n C 1 603 CYS 603 911 911 CYS CYS C . n C 1 604 LEU 604 912 912 LEU LEU C . n C 1 605 ASP 605 913 913 ASP ASP C . n C 1 606 THR 606 914 914 THR THR C . n C 1 607 PRO 607 915 915 PRO PRO C . n C 1 608 LEU 608 916 916 LEU LEU C . n C 1 609 CYS 609 917 917 CYS CYS C . n C 1 610 ASN 610 918 918 ASN ASN C . n C 1 611 GLY 611 919 919 GLY GLY C . n C 1 612 HIS 612 920 920 HIS HIS C . n C 1 613 THR 613 921 921 THR THR C . n C 1 614 THR 614 922 922 THR THR C . n C 1 615 GLY 615 923 923 GLY GLY C . n C 1 616 MET 616 924 924 MET MET C . n C 1 617 ASP 617 925 925 ASP ASP C . n C 1 618 VAL 618 926 926 VAL VAL C . n C 1 619 LEU 619 927 927 LEU LEU C . n C 1 620 TRP 620 928 928 TRP TRP C . n C 1 621 ALA 621 929 929 ALA ALA C . n C 1 622 GLY 622 930 930 GLY GLY C . n C 1 623 THR 623 931 931 THR THR C . n C 1 624 PRO 624 932 932 PRO PRO C . n C 1 625 MET 625 933 933 MET MET C . n C 1 626 VAL 626 934 934 VAL VAL C . n C 1 627 THR 627 935 935 THR THR C . n C 1 628 MET 628 936 936 MET MET C . n C 1 629 PRO 629 937 937 PRO PRO C . n C 1 630 GLY 630 938 938 GLY GLY C . n C 1 631 GLU 631 939 939 GLU GLU C . n C 1 632 THR 632 940 940 THR THR C . n C 1 633 LEU 633 941 941 LEU LEU C . n C 1 634 ALA 634 942 942 ALA ALA C . n C 1 635 SER 635 943 943 SER SER C . n C 1 636 ARG 636 944 944 ARG ARG C . n C 1 637 VAL 637 945 945 VAL VAL C . n C 1 638 ALA 638 946 946 ALA ALA C . n C 1 639 ALA 639 947 947 ALA ALA C . n C 1 640 SER 640 948 948 SER SER C . n C 1 641 GLN 641 949 949 GLN GLN C . n C 1 642 LEU 642 950 950 LEU LEU C . n C 1 643 THR 643 951 951 THR THR C . n C 1 644 CYS 644 952 952 CYS CYS C . n C 1 645 LEU 645 953 953 LEU LEU C . n C 1 646 GLY 646 954 954 GLY GLY C . n C 1 647 CYS 647 955 955 CYS CYS C . n C 1 648 LEU 648 956 956 LEU LEU C . n C 1 649 GLU 649 957 957 GLU GLU C . n C 1 650 LEU 650 958 958 LEU LEU C . n C 1 651 ILE 651 959 959 ILE ILE C . n C 1 652 ALA 652 960 960 ALA ALA C . n C 1 653 LYS 653 961 961 LYS LYS C . n C 1 654 ASN 654 962 962 ASN ASN C . n C 1 655 ARG 655 963 963 ARG ARG C . n C 1 656 GLN 656 964 964 GLN GLN C . n C 1 657 GLU 657 965 965 GLU GLU C . n C 1 658 TYR 658 966 966 TYR TYR C . n C 1 659 GLU 659 967 967 GLU GLU C . n C 1 660 ASP 660 968 968 ASP ASP C . n C 1 661 ILE 661 969 969 ILE ILE C . n C 1 662 ALA 662 970 970 ALA ALA C . n C 1 663 VAL 663 971 971 VAL VAL C . n C 1 664 LYS 664 972 972 LYS LYS C . n C 1 665 LEU 665 973 973 LEU LEU C . n C 1 666 GLY 666 974 974 GLY GLY C . n C 1 667 THR 667 975 975 THR THR C . n C 1 668 ASP 668 976 976 ASP ASP C . n C 1 669 LEU 669 977 977 LEU LEU C . n C 1 670 GLU 670 978 978 GLU GLU C . n C 1 671 TYR 671 979 979 TYR TYR C . n C 1 672 LEU 672 980 980 LEU LEU C . n C 1 673 LYS 673 981 981 LYS LYS C . n C 1 674 LYS 674 982 982 LYS LYS C . n C 1 675 VAL 675 983 983 VAL VAL C . n C 1 676 ARG 676 984 984 ARG ARG C . n C 1 677 GLY 677 985 985 GLY GLY C . n C 1 678 LYS 678 986 986 LYS LYS C . n C 1 679 VAL 679 987 987 VAL VAL C . n C 1 680 TRP 680 988 988 TRP TRP C . n C 1 681 LYS 681 989 989 LYS LYS C . n C 1 682 GLN 682 990 990 GLN GLN C . n C 1 683 ARG 683 991 991 ARG ARG C . n C 1 684 ILE 684 992 992 ILE ILE C . n C 1 685 SER 685 993 993 SER SER C . n C 1 686 SER 686 994 994 SER SER C . n C 1 687 PRO 687 995 995 PRO PRO C . n C 1 688 LEU 688 996 996 LEU LEU C . n C 1 689 PHE 689 997 997 PHE PHE C . n C 1 690 ASN 690 998 998 ASN ASN C . n C 1 691 THR 691 999 999 THR THR C . n C 1 692 LYS 692 1000 1000 LYS LYS C . n C 1 693 GLN 693 1001 1001 GLN GLN C . n C 1 694 TYR 694 1002 1002 TYR TYR C . n C 1 695 THR 695 1003 1003 THR THR C . n C 1 696 MET 696 1004 1004 MET MET C . n C 1 697 GLU 697 1005 1005 GLU GLU C . n C 1 698 LEU 698 1006 1006 LEU LEU C . n C 1 699 GLU 699 1007 1007 GLU GLU C . n C 1 700 ARG 700 1008 1008 ARG ARG C . n C 1 701 LEU 701 1009 1009 LEU LEU C . n C 1 702 TYR 702 1010 1010 TYR TYR C . n C 1 703 LEU 703 1011 1011 LEU LEU C . n C 1 704 GLN 704 1012 1012 GLN GLN C . n C 1 705 MET 705 1013 1013 MET MET C . n C 1 706 TRP 706 1014 1014 TRP TRP C . n C 1 707 GLU 707 1015 1015 GLU GLU C . n C 1 708 HIS 708 1016 1016 HIS HIS C . n C 1 709 TYR 709 1017 1017 TYR TYR C . n C 1 710 ALA 710 1018 1018 ALA ALA C . n C 1 711 ALA 711 1019 1019 ALA ALA C . n C 1 712 GLY 712 1020 1020 GLY GLY C . n C 1 713 ASN 713 1021 1021 ASN ASN C . n C 1 714 LYS 714 1022 1022 LYS LYS C . n C 1 715 PRO 715 1023 1023 PRO PRO C . n C 1 716 ASP 716 1024 1024 ASP ASP C . n C 1 717 HIS 717 1025 1025 HIS HIS C . n C 1 718 MET 718 1026 1026 MET MET C . n C 1 719 ILE 719 1027 1027 ILE ILE C . n C 1 720 LYS 720 1028 1028 LYS LYS C . n C 1 721 PRO 721 1029 ? ? ? C . n C 1 722 VAL 722 1030 ? ? ? C . n C 1 723 GLU 723 1031 ? ? ? C . n D 2 1 TYR 1 13 13 TYR TYR D . n D 2 2 PRO 2 14 14 PRO PRO D . n D 2 3 GLY 3 15 15 GLY GLY D . n D 2 4 GLY 4 16 16 GLY GLY D . n D 2 5 SER 5 17 17 SER SER D . n D 2 6 THR 6 18 18 THR THR D . n D 2 7 PRO 7 19 19 PRO PRO D . n D 2 8 VAL 8 20 20 VAL VAL D . n D 2 9 SER 9 21 21 SER SER D . n D 2 10 SER 10 22 22 SER SER D . n D 2 11 ALA 11 23 23 ALA ALA D . n D 2 12 ASN 12 24 24 ASN ASN D . n D 2 13 MET 13 25 25 MET MET D . n D 2 14 MET 14 26 26 MET MET D . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code E 3 UDP 1 1101 1212 UDP UDP A . F 4 SO4 1 1102 5 SO4 SO4 A . G 5 0YT 1 101 1331 0YT NSG B . H 4 SO4 1 102 1 SO4 SO4 B . I 3 UDP 1 1101 1212 UDP UDP C . J 5 0YT 1 101 1331 0YT NSG D . K 4 SO4 1 102 3 SO4 SO4 D . L 6 HOH 1 1201 1 HOH HOH A . L 6 HOH 2 1202 2 HOH HOH A . L 6 HOH 3 1203 3 HOH HOH A . L 6 HOH 4 1204 4 HOH HOH A . L 6 HOH 5 1205 6 HOH HOH A . L 6 HOH 6 1206 7 HOH HOH A . L 6 HOH 7 1207 8 HOH HOH A . L 6 HOH 8 1208 10 HOH HOH A . L 6 HOH 9 1209 12 HOH HOH A . L 6 HOH 10 1210 13 HOH HOH A . L 6 HOH 11 1211 14 HOH HOH A . L 6 HOH 12 1212 15 HOH HOH A . L 6 HOH 13 1213 17 HOH HOH A . L 6 HOH 14 1214 21 HOH HOH A . L 6 HOH 15 1215 24 HOH HOH A . L 6 HOH 16 1216 25 HOH HOH A . L 6 HOH 17 1217 28 HOH HOH A . L 6 HOH 18 1218 30 HOH HOH A . L 6 HOH 19 1219 31 HOH HOH A . L 6 HOH 20 1220 33 HOH HOH A . L 6 HOH 21 1221 36 HOH HOH A . L 6 HOH 22 1222 39 HOH HOH A . L 6 HOH 23 1223 44 HOH HOH A . L 6 HOH 24 1224 45 HOH HOH A . L 6 HOH 25 1225 46 HOH HOH A . L 6 HOH 26 1226 47 HOH HOH A . L 6 HOH 27 1227 55 HOH HOH A . L 6 HOH 28 1228 57 HOH HOH A . L 6 HOH 29 1229 59 HOH HOH A . L 6 HOH 30 1230 63 HOH HOH A . L 6 HOH 31 1231 64 HOH HOH A . L 6 HOH 32 1232 66 HOH HOH A . L 6 HOH 33 1233 68 HOH HOH A . L 6 HOH 34 1234 70 HOH HOH A . L 6 HOH 35 1235 71 HOH HOH A . L 6 HOH 36 1236 72 HOH HOH A . L 6 HOH 37 1237 73 HOH HOH A . L 6 HOH 38 1238 81 HOH HOH A . L 6 HOH 39 1239 82 HOH HOH A . L 6 HOH 40 1240 83 HOH HOH A . L 6 HOH 41 1241 84 HOH HOH A . L 6 HOH 42 1242 86 HOH HOH A . L 6 HOH 43 1243 87 HOH HOH A . L 6 HOH 44 1244 89 HOH HOH A . L 6 HOH 45 1245 90 HOH HOH A . L 6 HOH 46 1246 92 HOH HOH A . L 6 HOH 47 1247 93 HOH HOH A . L 6 HOH 48 1248 99 HOH HOH A . L 6 HOH 49 1249 104 HOH HOH A . L 6 HOH 50 1250 108 HOH HOH A . L 6 HOH 51 1251 110 HOH HOH A . L 6 HOH 52 1252 112 HOH HOH A . L 6 HOH 53 1253 113 HOH HOH A . L 6 HOH 54 1254 114 HOH HOH A . L 6 HOH 55 1255 115 HOH HOH A . L 6 HOH 56 1256 116 HOH HOH A . L 6 HOH 57 1257 119 HOH HOH A . L 6 HOH 58 1258 120 HOH HOH A . L 6 HOH 59 1259 121 HOH HOH A . L 6 HOH 60 1260 122 HOH HOH A . L 6 HOH 61 1261 123 HOH HOH A . L 6 HOH 62 1262 124 HOH HOH A . L 6 HOH 63 1263 125 HOH HOH A . L 6 HOH 64 1264 126 HOH HOH A . L 6 HOH 65 1265 127 HOH HOH A . L 6 HOH 66 1266 129 HOH HOH A . L 6 HOH 67 1267 130 HOH HOH A . L 6 HOH 68 1268 134 HOH HOH A . L 6 HOH 69 1269 135 HOH HOH A . L 6 HOH 70 1270 138 HOH HOH A . L 6 HOH 71 1271 140 HOH HOH A . L 6 HOH 72 1272 143 HOH HOH A . L 6 HOH 73 1273 145 HOH HOH A . L 6 HOH 74 1274 146 HOH HOH A . L 6 HOH 75 1275 150 HOH HOH A . L 6 HOH 76 1276 152 HOH HOH A . L 6 HOH 77 1277 153 HOH HOH A . L 6 HOH 78 1278 156 HOH HOH A . L 6 HOH 79 1279 157 HOH HOH A . L 6 HOH 80 1280 159 HOH HOH A . L 6 HOH 81 1281 161 HOH HOH A . L 6 HOH 82 1282 163 HOH HOH A . L 6 HOH 83 1283 167 HOH HOH A . L 6 HOH 84 1284 169 HOH HOH A . L 6 HOH 85 1285 170 HOH HOH A . L 6 HOH 86 1286 173 HOH HOH A . L 6 HOH 87 1287 175 HOH HOH A . L 6 HOH 88 1288 176 HOH HOH A . L 6 HOH 89 1289 178 HOH HOH A . L 6 HOH 90 1290 179 HOH HOH A . L 6 HOH 91 1291 183 HOH HOH A . L 6 HOH 92 1292 185 HOH HOH A . L 6 HOH 93 1293 187 HOH HOH A . L 6 HOH 94 1294 189 HOH HOH A . L 6 HOH 95 1295 191 HOH HOH A . L 6 HOH 96 1296 192 HOH HOH A . L 6 HOH 97 1297 195 HOH HOH A . L 6 HOH 98 1298 198 HOH HOH A . L 6 HOH 99 1299 200 HOH HOH A . L 6 HOH 100 1300 201 HOH HOH A . L 6 HOH 101 1301 202 HOH HOH A . L 6 HOH 102 1302 203 HOH HOH A . L 6 HOH 103 1303 204 HOH HOH A . L 6 HOH 104 1304 206 HOH HOH A . L 6 HOH 105 1305 217 HOH HOH A . L 6 HOH 106 1306 218 HOH HOH A . L 6 HOH 107 1307 222 HOH HOH A . L 6 HOH 108 1308 225 HOH HOH A . L 6 HOH 109 1309 227 HOH HOH A . L 6 HOH 110 1310 228 HOH HOH A . L 6 HOH 111 1311 229 HOH HOH A . L 6 HOH 112 1312 234 HOH HOH A . L 6 HOH 113 1313 237 HOH HOH A . L 6 HOH 114 1314 244 HOH HOH A . L 6 HOH 115 1315 250 HOH HOH A . L 6 HOH 116 1316 253 HOH HOH A . L 6 HOH 117 1317 256 HOH HOH A . L 6 HOH 118 1318 257 HOH HOH A . L 6 HOH 119 1319 258 HOH HOH A . L 6 HOH 120 1320 259 HOH HOH A . L 6 HOH 121 1321 260 HOH HOH A . L 6 HOH 122 1322 261 HOH HOH A . L 6 HOH 123 1323 262 HOH HOH A . L 6 HOH 124 1324 263 HOH HOH A . L 6 HOH 125 1325 264 HOH HOH A . L 6 HOH 126 1326 265 HOH HOH A . L 6 HOH 127 1327 267 HOH HOH A . L 6 HOH 128 1328 269 HOH HOH A . L 6 HOH 129 1329 273 HOH HOH A . L 6 HOH 130 1330 282 HOH HOH A . L 6 HOH 131 1331 283 HOH HOH A . L 6 HOH 132 1332 287 HOH HOH A . L 6 HOH 133 1333 289 HOH HOH A . L 6 HOH 134 1334 291 HOH HOH A . L 6 HOH 135 1335 295 HOH HOH A . L 6 HOH 136 1336 296 HOH HOH A . L 6 HOH 137 1337 298 HOH HOH A . L 6 HOH 138 1338 300 HOH HOH A . L 6 HOH 139 1339 301 HOH HOH A . L 6 HOH 140 1340 304 HOH HOH A . L 6 HOH 141 1341 306 HOH HOH A . L 6 HOH 142 1342 307 HOH HOH A . L 6 HOH 143 1343 308 HOH HOH A . L 6 HOH 144 1344 309 HOH HOH A . L 6 HOH 145 1345 310 HOH HOH A . L 6 HOH 146 1346 311 HOH HOH A . L 6 HOH 147 1347 313 HOH HOH A . L 6 HOH 148 1348 314 HOH HOH A . L 6 HOH 149 1349 315 HOH HOH A . L 6 HOH 150 1350 317 HOH HOH A . L 6 HOH 151 1351 318 HOH HOH A . L 6 HOH 152 1352 320 HOH HOH A . L 6 HOH 153 1353 323 HOH HOH A . L 6 HOH 154 1354 325 HOH HOH A . L 6 HOH 155 1355 328 HOH HOH A . L 6 HOH 156 1356 331 HOH HOH A . L 6 HOH 157 1357 334 HOH HOH A . L 6 HOH 158 1358 337 HOH HOH A . L 6 HOH 159 1359 339 HOH HOH A . L 6 HOH 160 1360 340 HOH HOH A . L 6 HOH 161 1361 344 HOH HOH A . L 6 HOH 162 1362 345 HOH HOH A . L 6 HOH 163 1363 346 HOH HOH A . L 6 HOH 164 1364 348 HOH HOH A . L 6 HOH 165 1365 350 HOH HOH A . L 6 HOH 166 1366 351 HOH HOH A . L 6 HOH 167 1367 353 HOH HOH A . L 6 HOH 168 1368 354 HOH HOH A . L 6 HOH 169 1369 356 HOH HOH A . L 6 HOH 170 1370 357 HOH HOH A . L 6 HOH 171 1371 359 HOH HOH A . L 6 HOH 172 1372 360 HOH HOH A . L 6 HOH 173 1373 365 HOH HOH A . L 6 HOH 174 1374 366 HOH HOH A . L 6 HOH 175 1375 367 HOH HOH A . L 6 HOH 176 1376 369 HOH HOH A . L 6 HOH 177 1377 372 HOH HOH A . L 6 HOH 178 1378 373 HOH HOH A . L 6 HOH 179 1379 374 HOH HOH A . L 6 HOH 180 1380 375 HOH HOH A . L 6 HOH 181 1381 376 HOH HOH A . L 6 HOH 182 1382 377 HOH HOH A . L 6 HOH 183 1383 378 HOH HOH A . L 6 HOH 184 1384 379 HOH HOH A . L 6 HOH 185 1385 385 HOH HOH A . L 6 HOH 186 1386 386 HOH HOH A . L 6 HOH 187 1387 389 HOH HOH A . L 6 HOH 188 1388 392 HOH HOH A . L 6 HOH 189 1389 393 HOH HOH A . L 6 HOH 190 1390 394 HOH HOH A . L 6 HOH 191 1391 395 HOH HOH A . L 6 HOH 192 1392 399 HOH HOH A . L 6 HOH 193 1393 400 HOH HOH A . L 6 HOH 194 1394 404 HOH HOH A . L 6 HOH 195 1395 405 HOH HOH A . L 6 HOH 196 1396 406 HOH HOH A . L 6 HOH 197 1397 407 HOH HOH A . L 6 HOH 198 1398 408 HOH HOH A . L 6 HOH 199 1399 409 HOH HOH A . L 6 HOH 200 1400 411 HOH HOH A . L 6 HOH 201 1401 415 HOH HOH A . L 6 HOH 202 1402 416 HOH HOH A . L 6 HOH 203 1403 418 HOH HOH A . L 6 HOH 204 1404 421 HOH HOH A . L 6 HOH 205 1405 422 HOH HOH A . L 6 HOH 206 1406 424 HOH HOH A . L 6 HOH 207 1407 425 HOH HOH A . L 6 HOH 208 1408 429 HOH HOH A . L 6 HOH 209 1409 432 HOH HOH A . L 6 HOH 210 1410 433 HOH HOH A . L 6 HOH 211 1411 435 HOH HOH A . L 6 HOH 212 1412 439 HOH HOH A . L 6 HOH 213 1413 443 HOH HOH A . L 6 HOH 214 1414 448 HOH HOH A . L 6 HOH 215 1415 450 HOH HOH A . L 6 HOH 216 1416 451 HOH HOH A . L 6 HOH 217 1417 452 HOH HOH A . L 6 HOH 218 1418 453 HOH HOH A . L 6 HOH 219 1419 454 HOH HOH A . L 6 HOH 220 1420 455 HOH HOH A . L 6 HOH 221 1421 456 HOH HOH A . L 6 HOH 222 1422 457 HOH HOH A . L 6 HOH 223 1423 458 HOH HOH A . L 6 HOH 224 1424 459 HOH HOH A . L 6 HOH 225 1425 461 HOH HOH A . L 6 HOH 226 1426 462 HOH HOH A . L 6 HOH 227 1427 465 HOH HOH A . L 6 HOH 228 1428 468 HOH HOH A . L 6 HOH 229 1429 469 HOH HOH A . L 6 HOH 230 1430 470 HOH HOH A . L 6 HOH 231 1431 472 HOH HOH A . L 6 HOH 232 1432 475 HOH HOH A . L 6 HOH 233 1433 476 HOH HOH A . L 6 HOH 234 1434 477 HOH HOH A . L 6 HOH 235 1435 478 HOH HOH A . L 6 HOH 236 1436 480 HOH HOH A . L 6 HOH 237 1437 481 HOH HOH A . L 6 HOH 238 1438 483 HOH HOH A . L 6 HOH 239 1439 484 HOH HOH A . L 6 HOH 240 1440 485 HOH HOH A . L 6 HOH 241 1441 486 HOH HOH A . L 6 HOH 242 1442 488 HOH HOH A . L 6 HOH 243 1443 490 HOH HOH A . L 6 HOH 244 1444 497 HOH HOH A . L 6 HOH 245 1445 500 HOH HOH A . L 6 HOH 246 1446 501 HOH HOH A . L 6 HOH 247 1447 503 HOH HOH A . L 6 HOH 248 1448 504 HOH HOH A . L 6 HOH 249 1449 509 HOH HOH A . L 6 HOH 250 1450 511 HOH HOH A . L 6 HOH 251 1451 513 HOH HOH A . L 6 HOH 252 1452 517 HOH HOH A . L 6 HOH 253 1453 518 HOH HOH A . L 6 HOH 254 1454 519 HOH HOH A . L 6 HOH 255 1455 521 HOH HOH A . L 6 HOH 256 1456 524 HOH HOH A . L 6 HOH 257 1457 525 HOH HOH A . L 6 HOH 258 1458 528 HOH HOH A . L 6 HOH 259 1459 529 HOH HOH A . L 6 HOH 260 1460 532 HOH HOH A . L 6 HOH 261 1461 535 HOH HOH A . L 6 HOH 262 1462 539 HOH HOH A . L 6 HOH 263 1463 542 HOH HOH A . L 6 HOH 264 1464 543 HOH HOH A . L 6 HOH 265 1465 544 HOH HOH A . L 6 HOH 266 1466 546 HOH HOH A . L 6 HOH 267 1467 548 HOH HOH A . L 6 HOH 268 1468 552 HOH HOH A . L 6 HOH 269 1469 553 HOH HOH A . L 6 HOH 270 1470 554 HOH HOH A . L 6 HOH 271 1471 557 HOH HOH A . L 6 HOH 272 1472 558 HOH HOH A . L 6 HOH 273 1473 560 HOH HOH A . L 6 HOH 274 1474 561 HOH HOH A . L 6 HOH 275 1475 568 HOH HOH A . L 6 HOH 276 1476 569 HOH HOH A . L 6 HOH 277 1477 571 HOH HOH A . L 6 HOH 278 1478 575 HOH HOH A . L 6 HOH 279 1479 578 HOH HOH A . L 6 HOH 280 1480 580 HOH HOH A . L 6 HOH 281 1481 583 HOH HOH A . L 6 HOH 282 1482 584 HOH HOH A . L 6 HOH 283 1483 589 HOH HOH A . L 6 HOH 284 1484 590 HOH HOH A . L 6 HOH 285 1485 591 HOH HOH A . L 6 HOH 286 1486 593 HOH HOH A . L 6 HOH 287 1487 594 HOH HOH A . L 6 HOH 288 1488 595 HOH HOH A . L 6 HOH 289 1489 596 HOH HOH A . L 6 HOH 290 1490 597 HOH HOH A . L 6 HOH 291 1491 598 HOH HOH A . L 6 HOH 292 1492 600 HOH HOH A . L 6 HOH 293 1493 604 HOH HOH A . L 6 HOH 294 1494 605 HOH HOH A . L 6 HOH 295 1495 610 HOH HOH A . L 6 HOH 296 1496 615 HOH HOH A . L 6 HOH 297 1497 616 HOH HOH A . L 6 HOH 298 1498 619 HOH HOH A . L 6 HOH 299 1499 620 HOH HOH A . L 6 HOH 300 1500 621 HOH HOH A . L 6 HOH 301 1501 625 HOH HOH A . L 6 HOH 302 1502 626 HOH HOH A . L 6 HOH 303 1503 627 HOH HOH A . L 6 HOH 304 1504 628 HOH HOH A . L 6 HOH 305 1505 630 HOH HOH A . L 6 HOH 306 1506 631 HOH HOH A . L 6 HOH 307 1507 632 HOH HOH A . L 6 HOH 308 1508 634 HOH HOH A . L 6 HOH 309 1509 636 HOH HOH A . L 6 HOH 310 1510 640 HOH HOH A . L 6 HOH 311 1511 641 HOH HOH A . L 6 HOH 312 1512 642 HOH HOH A . L 6 HOH 313 1513 644 HOH HOH A . L 6 HOH 314 1514 647 HOH HOH A . L 6 HOH 315 1515 648 HOH HOH A . L 6 HOH 316 1516 649 HOH HOH A . L 6 HOH 317 1517 651 HOH HOH A . L 6 HOH 318 1518 652 HOH HOH A . L 6 HOH 319 1519 653 HOH HOH A . L 6 HOH 320 1520 654 HOH HOH A . L 6 HOH 321 1521 661 HOH HOH A . L 6 HOH 322 1522 665 HOH HOH A . L 6 HOH 323 1523 667 HOH HOH A . L 6 HOH 324 1524 669 HOH HOH A . L 6 HOH 325 1525 672 HOH HOH A . L 6 HOH 326 1526 673 HOH HOH A . L 6 HOH 327 1527 674 HOH HOH A . L 6 HOH 328 1528 677 HOH HOH A . L 6 HOH 329 1529 678 HOH HOH A . L 6 HOH 330 1530 679 HOH HOH A . L 6 HOH 331 1531 681 HOH HOH A . L 6 HOH 332 1532 682 HOH HOH A . L 6 HOH 333 1533 684 HOH HOH A . L 6 HOH 334 1534 685 HOH HOH A . L 6 HOH 335 1535 686 HOH HOH A . L 6 HOH 336 1536 687 HOH HOH A . L 6 HOH 337 1537 691 HOH HOH A . L 6 HOH 338 1538 692 HOH HOH A . L 6 HOH 339 1539 693 HOH HOH A . L 6 HOH 340 1540 694 HOH HOH A . L 6 HOH 341 1541 696 HOH HOH A . L 6 HOH 342 1542 697 HOH HOH A . L 6 HOH 343 1543 698 HOH HOH A . L 6 HOH 344 1544 700 HOH HOH A . L 6 HOH 345 1545 703 HOH HOH A . L 6 HOH 346 1546 706 HOH HOH A . L 6 HOH 347 1547 707 HOH HOH A . L 6 HOH 348 1548 710 HOH HOH A . L 6 HOH 349 1549 711 HOH HOH A . L 6 HOH 350 1550 712 HOH HOH A . L 6 HOH 351 1551 714 HOH HOH A . L 6 HOH 352 1552 715 HOH HOH A . L 6 HOH 353 1553 718 HOH HOH A . L 6 HOH 354 1554 720 HOH HOH A . L 6 HOH 355 1555 721 HOH HOH A . L 6 HOH 356 1556 723 HOH HOH A . L 6 HOH 357 1557 726 HOH HOH A . L 6 HOH 358 1558 727 HOH HOH A . L 6 HOH 359 1559 729 HOH HOH A . L 6 HOH 360 1560 732 HOH HOH A . L 6 HOH 361 1561 734 HOH HOH A . L 6 HOH 362 1562 735 HOH HOH A . L 6 HOH 363 1563 736 HOH HOH A . L 6 HOH 364 1564 738 HOH HOH A . L 6 HOH 365 1565 741 HOH HOH A . L 6 HOH 366 1566 744 HOH HOH A . L 6 HOH 367 1567 746 HOH HOH A . L 6 HOH 368 1568 748 HOH HOH A . L 6 HOH 369 1569 749 HOH HOH A . L 6 HOH 370 1570 750 HOH HOH A . L 6 HOH 371 1571 754 HOH HOH A . L 6 HOH 372 1572 757 HOH HOH A . L 6 HOH 373 1573 758 HOH HOH A . L 6 HOH 374 1574 761 HOH HOH A . L 6 HOH 375 1575 762 HOH HOH A . L 6 HOH 376 1576 764 HOH HOH A . L 6 HOH 377 1577 765 HOH HOH A . L 6 HOH 378 1578 766 HOH HOH A . L 6 HOH 379 1579 767 HOH HOH A . L 6 HOH 380 1580 768 HOH HOH A . L 6 HOH 381 1581 773 HOH HOH A . L 6 HOH 382 1582 775 HOH HOH A . L 6 HOH 383 1583 777 HOH HOH A . L 6 HOH 384 1584 778 HOH HOH A . L 6 HOH 385 1585 779 HOH HOH A . L 6 HOH 386 1586 780 HOH HOH A . L 6 HOH 387 1587 784 HOH HOH A . L 6 HOH 388 1588 785 HOH HOH A . L 6 HOH 389 1589 786 HOH HOH A . L 6 HOH 390 1590 788 HOH HOH A . L 6 HOH 391 1591 789 HOH HOH A . L 6 HOH 392 1592 791 HOH HOH A . L 6 HOH 393 1593 793 HOH HOH A . L 6 HOH 394 1594 794 HOH HOH A . L 6 HOH 395 1595 795 HOH HOH A . L 6 HOH 396 1596 797 HOH HOH A . L 6 HOH 397 1597 798 HOH HOH A . L 6 HOH 398 1598 799 HOH HOH A . L 6 HOH 399 1599 800 HOH HOH A . L 6 HOH 400 1600 804 HOH HOH A . L 6 HOH 401 1601 805 HOH HOH A . L 6 HOH 402 1602 807 HOH HOH A . L 6 HOH 403 1603 808 HOH HOH A . L 6 HOH 404 1604 809 HOH HOH A . L 6 HOH 405 1605 810 HOH HOH A . L 6 HOH 406 1606 812 HOH HOH A . L 6 HOH 407 1607 818 HOH HOH A . L 6 HOH 408 1608 820 HOH HOH A . L 6 HOH 409 1609 821 HOH HOH A . L 6 HOH 410 1610 825 HOH HOH A . L 6 HOH 411 1611 826 HOH HOH A . L 6 HOH 412 1612 827 HOH HOH A . L 6 HOH 413 1613 830 HOH HOH A . L 6 HOH 414 1614 831 HOH HOH A . L 6 HOH 415 1615 832 HOH HOH A . L 6 HOH 416 1616 833 HOH HOH A . L 6 HOH 417 1617 834 HOH HOH A . L 6 HOH 418 1618 835 HOH HOH A . L 6 HOH 419 1619 836 HOH HOH A . M 6 HOH 1 201 56 HOH HOH B . M 6 HOH 2 202 69 HOH HOH B . M 6 HOH 3 203 166 HOH HOH B . M 6 HOH 4 204 180 HOH HOH B . M 6 HOH 5 205 463 HOH HOH B . M 6 HOH 6 206 549 HOH HOH B . M 6 HOH 7 207 607 HOH HOH B . M 6 HOH 8 208 796 HOH HOH B . N 6 HOH 1 1201 5 HOH HOH C . N 6 HOH 2 1202 9 HOH HOH C . N 6 HOH 3 1203 11 HOH HOH C . N 6 HOH 4 1204 16 HOH HOH C . N 6 HOH 5 1205 18 HOH HOH C . N 6 HOH 6 1206 19 HOH HOH C . N 6 HOH 7 1207 20 HOH HOH C . N 6 HOH 8 1208 22 HOH HOH C . N 6 HOH 9 1209 23 HOH HOH C . N 6 HOH 10 1210 26 HOH HOH C . N 6 HOH 11 1211 27 HOH HOH C . N 6 HOH 12 1212 29 HOH HOH C . N 6 HOH 13 1213 32 HOH HOH C . N 6 HOH 14 1214 34 HOH HOH C . N 6 HOH 15 1215 35 HOH HOH C . N 6 HOH 16 1216 37 HOH HOH C . N 6 HOH 17 1217 38 HOH HOH C . N 6 HOH 18 1218 40 HOH HOH C . N 6 HOH 19 1219 41 HOH HOH C . N 6 HOH 20 1220 42 HOH HOH C . N 6 HOH 21 1221 43 HOH HOH C . N 6 HOH 22 1222 48 HOH HOH C . N 6 HOH 23 1223 49 HOH HOH C . N 6 HOH 24 1224 50 HOH HOH C . N 6 HOH 25 1225 51 HOH HOH C . N 6 HOH 26 1226 52 HOH HOH C . N 6 HOH 27 1227 53 HOH HOH C . N 6 HOH 28 1228 54 HOH HOH C . N 6 HOH 29 1229 58 HOH HOH C . N 6 HOH 30 1230 60 HOH HOH C . N 6 HOH 31 1231 61 HOH HOH C . N 6 HOH 32 1232 62 HOH HOH C . N 6 HOH 33 1233 65 HOH HOH C . N 6 HOH 34 1234 67 HOH HOH C . N 6 HOH 35 1235 74 HOH HOH C . N 6 HOH 36 1236 75 HOH HOH C . N 6 HOH 37 1237 76 HOH HOH C . N 6 HOH 38 1238 77 HOH HOH C . N 6 HOH 39 1239 78 HOH HOH C . N 6 HOH 40 1240 79 HOH HOH C . N 6 HOH 41 1241 80 HOH HOH C . N 6 HOH 42 1242 88 HOH HOH C . N 6 HOH 43 1243 91 HOH HOH C . N 6 HOH 44 1244 94 HOH HOH C . N 6 HOH 45 1245 95 HOH HOH C . N 6 HOH 46 1246 97 HOH HOH C . N 6 HOH 47 1247 98 HOH HOH C . N 6 HOH 48 1248 100 HOH HOH C . N 6 HOH 49 1249 101 HOH HOH C . N 6 HOH 50 1250 102 HOH HOH C . N 6 HOH 51 1251 103 HOH HOH C . N 6 HOH 52 1252 105 HOH HOH C . N 6 HOH 53 1253 106 HOH HOH C . N 6 HOH 54 1254 107 HOH HOH C . N 6 HOH 55 1255 109 HOH HOH C . N 6 HOH 56 1256 111 HOH HOH C . N 6 HOH 57 1257 117 HOH HOH C . N 6 HOH 58 1258 118 HOH HOH C . N 6 HOH 59 1259 128 HOH HOH C . N 6 HOH 60 1260 131 HOH HOH C . N 6 HOH 61 1261 132 HOH HOH C . N 6 HOH 62 1262 133 HOH HOH C . N 6 HOH 63 1263 136 HOH HOH C . N 6 HOH 64 1264 137 HOH HOH C . N 6 HOH 65 1265 139 HOH HOH C . N 6 HOH 66 1266 141 HOH HOH C . N 6 HOH 67 1267 142 HOH HOH C . N 6 HOH 68 1268 144 HOH HOH C . N 6 HOH 69 1269 147 HOH HOH C . N 6 HOH 70 1270 148 HOH HOH C . N 6 HOH 71 1271 149 HOH HOH C . N 6 HOH 72 1272 151 HOH HOH C . N 6 HOH 73 1273 154 HOH HOH C . N 6 HOH 74 1274 155 HOH HOH C . N 6 HOH 75 1275 158 HOH HOH C . N 6 HOH 76 1276 160 HOH HOH C . N 6 HOH 77 1277 164 HOH HOH C . N 6 HOH 78 1278 165 HOH HOH C . N 6 HOH 79 1279 168 HOH HOH C . N 6 HOH 80 1280 171 HOH HOH C . N 6 HOH 81 1281 172 HOH HOH C . N 6 HOH 82 1282 174 HOH HOH C . N 6 HOH 83 1283 177 HOH HOH C . N 6 HOH 84 1284 181 HOH HOH C . N 6 HOH 85 1285 182 HOH HOH C . N 6 HOH 86 1286 184 HOH HOH C . N 6 HOH 87 1287 186 HOH HOH C . N 6 HOH 88 1288 188 HOH HOH C . N 6 HOH 89 1289 190 HOH HOH C . N 6 HOH 90 1290 193 HOH HOH C . N 6 HOH 91 1291 194 HOH HOH C . N 6 HOH 92 1292 196 HOH HOH C . N 6 HOH 93 1293 197 HOH HOH C . N 6 HOH 94 1294 199 HOH HOH C . N 6 HOH 95 1295 205 HOH HOH C . N 6 HOH 96 1296 207 HOH HOH C . N 6 HOH 97 1297 208 HOH HOH C . N 6 HOH 98 1298 209 HOH HOH C . N 6 HOH 99 1299 210 HOH HOH C . N 6 HOH 100 1300 211 HOH HOH C . N 6 HOH 101 1301 212 HOH HOH C . N 6 HOH 102 1302 213 HOH HOH C . N 6 HOH 103 1303 215 HOH HOH C . N 6 HOH 104 1304 216 HOH HOH C . N 6 HOH 105 1305 219 HOH HOH C . N 6 HOH 106 1306 220 HOH HOH C . N 6 HOH 107 1307 221 HOH HOH C . N 6 HOH 108 1308 223 HOH HOH C . N 6 HOH 109 1309 224 HOH HOH C . N 6 HOH 110 1310 226 HOH HOH C . N 6 HOH 111 1311 230 HOH HOH C . N 6 HOH 112 1312 231 HOH HOH C . N 6 HOH 113 1313 232 HOH HOH C . N 6 HOH 114 1314 233 HOH HOH C . N 6 HOH 115 1315 235 HOH HOH C . N 6 HOH 116 1316 239 HOH HOH C . N 6 HOH 117 1317 240 HOH HOH C . N 6 HOH 118 1318 241 HOH HOH C . N 6 HOH 119 1319 242 HOH HOH C . N 6 HOH 120 1320 243 HOH HOH C . N 6 HOH 121 1321 245 HOH HOH C . N 6 HOH 122 1322 246 HOH HOH C . N 6 HOH 123 1323 247 HOH HOH C . N 6 HOH 124 1324 248 HOH HOH C . N 6 HOH 125 1325 249 HOH HOH C . N 6 HOH 126 1326 251 HOH HOH C . N 6 HOH 127 1327 252 HOH HOH C . N 6 HOH 128 1328 254 HOH HOH C . N 6 HOH 129 1329 255 HOH HOH C . N 6 HOH 130 1330 266 HOH HOH C . N 6 HOH 131 1331 268 HOH HOH C . N 6 HOH 132 1332 270 HOH HOH C . N 6 HOH 133 1333 271 HOH HOH C . N 6 HOH 134 1334 272 HOH HOH C . N 6 HOH 135 1335 274 HOH HOH C . N 6 HOH 136 1336 275 HOH HOH C . N 6 HOH 137 1337 276 HOH HOH C . N 6 HOH 138 1338 277 HOH HOH C . N 6 HOH 139 1339 278 HOH HOH C . N 6 HOH 140 1340 279 HOH HOH C . N 6 HOH 141 1341 280 HOH HOH C . N 6 HOH 142 1342 281 HOH HOH C . N 6 HOH 143 1343 284 HOH HOH C . N 6 HOH 144 1344 285 HOH HOH C . N 6 HOH 145 1345 286 HOH HOH C . N 6 HOH 146 1346 288 HOH HOH C . N 6 HOH 147 1347 290 HOH HOH C . N 6 HOH 148 1348 292 HOH HOH C . N 6 HOH 149 1349 293 HOH HOH C . N 6 HOH 150 1350 294 HOH HOH C . N 6 HOH 151 1351 297 HOH HOH C . N 6 HOH 152 1352 299 HOH HOH C . N 6 HOH 153 1353 302 HOH HOH C . N 6 HOH 154 1354 303 HOH HOH C . N 6 HOH 155 1355 305 HOH HOH C . N 6 HOH 156 1356 312 HOH HOH C . N 6 HOH 157 1357 316 HOH HOH C . N 6 HOH 158 1358 319 HOH HOH C . N 6 HOH 159 1359 321 HOH HOH C . N 6 HOH 160 1360 322 HOH HOH C . N 6 HOH 161 1361 324 HOH HOH C . N 6 HOH 162 1362 326 HOH HOH C . N 6 HOH 163 1363 327 HOH HOH C . N 6 HOH 164 1364 329 HOH HOH C . N 6 HOH 165 1365 330 HOH HOH C . N 6 HOH 166 1366 332 HOH HOH C . N 6 HOH 167 1367 333 HOH HOH C . N 6 HOH 168 1368 335 HOH HOH C . N 6 HOH 169 1369 336 HOH HOH C . N 6 HOH 170 1370 338 HOH HOH C . N 6 HOH 171 1371 341 HOH HOH C . N 6 HOH 172 1372 342 HOH HOH C . N 6 HOH 173 1373 343 HOH HOH C . N 6 HOH 174 1374 347 HOH HOH C . N 6 HOH 175 1375 349 HOH HOH C . N 6 HOH 176 1376 352 HOH HOH C . N 6 HOH 177 1377 355 HOH HOH C . N 6 HOH 178 1378 358 HOH HOH C . N 6 HOH 179 1379 361 HOH HOH C . N 6 HOH 180 1380 362 HOH HOH C . N 6 HOH 181 1381 363 HOH HOH C . N 6 HOH 182 1382 364 HOH HOH C . N 6 HOH 183 1383 368 HOH HOH C . N 6 HOH 184 1384 370 HOH HOH C . N 6 HOH 185 1385 371 HOH HOH C . N 6 HOH 186 1386 380 HOH HOH C . N 6 HOH 187 1387 381 HOH HOH C . N 6 HOH 188 1388 382 HOH HOH C . N 6 HOH 189 1389 383 HOH HOH C . N 6 HOH 190 1390 387 HOH HOH C . N 6 HOH 191 1391 388 HOH HOH C . N 6 HOH 192 1392 390 HOH HOH C . N 6 HOH 193 1393 391 HOH HOH C . N 6 HOH 194 1394 396 HOH HOH C . N 6 HOH 195 1395 397 HOH HOH C . N 6 HOH 196 1396 398 HOH HOH C . N 6 HOH 197 1397 401 HOH HOH C . N 6 HOH 198 1398 402 HOH HOH C . N 6 HOH 199 1399 403 HOH HOH C . N 6 HOH 200 1400 410 HOH HOH C . N 6 HOH 201 1401 412 HOH HOH C . N 6 HOH 202 1402 413 HOH HOH C . N 6 HOH 203 1403 414 HOH HOH C . N 6 HOH 204 1404 417 HOH HOH C . N 6 HOH 205 1405 419 HOH HOH C . N 6 HOH 206 1406 423 HOH HOH C . N 6 HOH 207 1407 426 HOH HOH C . N 6 HOH 208 1408 427 HOH HOH C . N 6 HOH 209 1409 428 HOH HOH C . N 6 HOH 210 1410 430 HOH HOH C . N 6 HOH 211 1411 434 HOH HOH C . N 6 HOH 212 1412 436 HOH HOH C . N 6 HOH 213 1413 437 HOH HOH C . N 6 HOH 214 1414 438 HOH HOH C . N 6 HOH 215 1415 440 HOH HOH C . N 6 HOH 216 1416 441 HOH HOH C . N 6 HOH 217 1417 442 HOH HOH C . N 6 HOH 218 1418 444 HOH HOH C . N 6 HOH 219 1419 445 HOH HOH C . N 6 HOH 220 1420 446 HOH HOH C . N 6 HOH 221 1421 447 HOH HOH C . N 6 HOH 222 1422 449 HOH HOH C . N 6 HOH 223 1423 460 HOH HOH C . N 6 HOH 224 1424 464 HOH HOH C . N 6 HOH 225 1425 466 HOH HOH C . N 6 HOH 226 1426 467 HOH HOH C . N 6 HOH 227 1427 471 HOH HOH C . N 6 HOH 228 1428 473 HOH HOH C . N 6 HOH 229 1429 474 HOH HOH C . N 6 HOH 230 1430 479 HOH HOH C . N 6 HOH 231 1431 482 HOH HOH C . N 6 HOH 232 1432 487 HOH HOH C . N 6 HOH 233 1433 489 HOH HOH C . N 6 HOH 234 1434 491 HOH HOH C . N 6 HOH 235 1435 492 HOH HOH C . N 6 HOH 236 1436 493 HOH HOH C . N 6 HOH 237 1437 494 HOH HOH C . N 6 HOH 238 1438 495 HOH HOH C . N 6 HOH 239 1439 496 HOH HOH C . N 6 HOH 240 1440 498 HOH HOH C . N 6 HOH 241 1441 499 HOH HOH C . N 6 HOH 242 1442 502 HOH HOH C . N 6 HOH 243 1443 505 HOH HOH C . N 6 HOH 244 1444 506 HOH HOH C . N 6 HOH 245 1445 507 HOH HOH C . N 6 HOH 246 1446 508 HOH HOH C . N 6 HOH 247 1447 510 HOH HOH C . N 6 HOH 248 1448 512 HOH HOH C . N 6 HOH 249 1449 514 HOH HOH C . N 6 HOH 250 1450 515 HOH HOH C . N 6 HOH 251 1451 516 HOH HOH C . N 6 HOH 252 1452 520 HOH HOH C . N 6 HOH 253 1453 522 HOH HOH C . N 6 HOH 254 1454 523 HOH HOH C . N 6 HOH 255 1455 526 HOH HOH C . N 6 HOH 256 1456 527 HOH HOH C . N 6 HOH 257 1457 530 HOH HOH C . N 6 HOH 258 1458 531 HOH HOH C . N 6 HOH 259 1459 533 HOH HOH C . N 6 HOH 260 1460 534 HOH HOH C . N 6 HOH 261 1461 536 HOH HOH C . N 6 HOH 262 1462 537 HOH HOH C . N 6 HOH 263 1463 538 HOH HOH C . N 6 HOH 264 1464 540 HOH HOH C . N 6 HOH 265 1465 541 HOH HOH C . N 6 HOH 266 1466 545 HOH HOH C . N 6 HOH 267 1467 547 HOH HOH C . N 6 HOH 268 1468 550 HOH HOH C . N 6 HOH 269 1469 551 HOH HOH C . N 6 HOH 270 1470 555 HOH HOH C . N 6 HOH 271 1471 556 HOH HOH C . N 6 HOH 272 1472 559 HOH HOH C . N 6 HOH 273 1473 562 HOH HOH C . N 6 HOH 274 1474 563 HOH HOH C . N 6 HOH 275 1475 564 HOH HOH C . N 6 HOH 276 1476 565 HOH HOH C . N 6 HOH 277 1477 566 HOH HOH C . N 6 HOH 278 1478 567 HOH HOH C . N 6 HOH 279 1479 570 HOH HOH C . N 6 HOH 280 1480 572 HOH HOH C . N 6 HOH 281 1481 573 HOH HOH C . N 6 HOH 282 1482 574 HOH HOH C . N 6 HOH 283 1483 576 HOH HOH C . N 6 HOH 284 1484 577 HOH HOH C . N 6 HOH 285 1485 579 HOH HOH C . N 6 HOH 286 1486 581 HOH HOH C . N 6 HOH 287 1487 582 HOH HOH C . N 6 HOH 288 1488 585 HOH HOH C . N 6 HOH 289 1489 586 HOH HOH C . N 6 HOH 290 1490 587 HOH HOH C . N 6 HOH 291 1491 588 HOH HOH C . N 6 HOH 292 1492 592 HOH HOH C . N 6 HOH 293 1493 599 HOH HOH C . N 6 HOH 294 1494 601 HOH HOH C . N 6 HOH 295 1495 602 HOH HOH C . N 6 HOH 296 1496 603 HOH HOH C . N 6 HOH 297 1497 606 HOH HOH C . N 6 HOH 298 1498 608 HOH HOH C . N 6 HOH 299 1499 609 HOH HOH C . N 6 HOH 300 1500 611 HOH HOH C . N 6 HOH 301 1501 612 HOH HOH C . N 6 HOH 302 1502 613 HOH HOH C . N 6 HOH 303 1503 614 HOH HOH C . N 6 HOH 304 1504 617 HOH HOH C . N 6 HOH 305 1505 618 HOH HOH C . N 6 HOH 306 1506 622 HOH HOH C . N 6 HOH 307 1507 623 HOH HOH C . N 6 HOH 308 1508 624 HOH HOH C . N 6 HOH 309 1509 629 HOH HOH C . N 6 HOH 310 1510 633 HOH HOH C . N 6 HOH 311 1511 635 HOH HOH C . N 6 HOH 312 1512 637 HOH HOH C . N 6 HOH 313 1513 638 HOH HOH C . N 6 HOH 314 1514 639 HOH HOH C . N 6 HOH 315 1515 643 HOH HOH C . N 6 HOH 316 1516 645 HOH HOH C . N 6 HOH 317 1517 646 HOH HOH C . N 6 HOH 318 1518 650 HOH HOH C . N 6 HOH 319 1519 655 HOH HOH C . N 6 HOH 320 1520 656 HOH HOH C . N 6 HOH 321 1521 657 HOH HOH C . N 6 HOH 322 1522 658 HOH HOH C . N 6 HOH 323 1523 659 HOH HOH C . N 6 HOH 324 1524 660 HOH HOH C . N 6 HOH 325 1525 662 HOH HOH C . N 6 HOH 326 1526 663 HOH HOH C . N 6 HOH 327 1527 664 HOH HOH C . N 6 HOH 328 1528 666 HOH HOH C . N 6 HOH 329 1529 668 HOH HOH C . N 6 HOH 330 1530 670 HOH HOH C . N 6 HOH 331 1531 671 HOH HOH C . N 6 HOH 332 1532 675 HOH HOH C . N 6 HOH 333 1533 676 HOH HOH C . N 6 HOH 334 1534 680 HOH HOH C . N 6 HOH 335 1535 683 HOH HOH C . N 6 HOH 336 1536 688 HOH HOH C . N 6 HOH 337 1537 689 HOH HOH C . N 6 HOH 338 1538 695 HOH HOH C . N 6 HOH 339 1539 699 HOH HOH C . N 6 HOH 340 1540 701 HOH HOH C . N 6 HOH 341 1541 702 HOH HOH C . N 6 HOH 342 1542 704 HOH HOH C . N 6 HOH 343 1543 705 HOH HOH C . N 6 HOH 344 1544 708 HOH HOH C . N 6 HOH 345 1545 709 HOH HOH C . N 6 HOH 346 1546 713 HOH HOH C . N 6 HOH 347 1547 716 HOH HOH C . N 6 HOH 348 1548 717 HOH HOH C . N 6 HOH 349 1549 719 HOH HOH C . N 6 HOH 350 1550 722 HOH HOH C . N 6 HOH 351 1551 724 HOH HOH C . N 6 HOH 352 1552 725 HOH HOH C . N 6 HOH 353 1553 728 HOH HOH C . N 6 HOH 354 1554 730 HOH HOH C . N 6 HOH 355 1555 731 HOH HOH C . N 6 HOH 356 1556 733 HOH HOH C . N 6 HOH 357 1557 737 HOH HOH C . N 6 HOH 358 1558 739 HOH HOH C . N 6 HOH 359 1559 740 HOH HOH C . N 6 HOH 360 1560 742 HOH HOH C . N 6 HOH 361 1561 743 HOH HOH C . N 6 HOH 362 1562 745 HOH HOH C . N 6 HOH 363 1563 747 HOH HOH C . N 6 HOH 364 1564 751 HOH HOH C . N 6 HOH 365 1565 753 HOH HOH C . N 6 HOH 366 1566 755 HOH HOH C . N 6 HOH 367 1567 756 HOH HOH C . N 6 HOH 368 1568 759 HOH HOH C . N 6 HOH 369 1569 760 HOH HOH C . N 6 HOH 370 1570 763 HOH HOH C . N 6 HOH 371 1571 769 HOH HOH C . N 6 HOH 372 1572 770 HOH HOH C . N 6 HOH 373 1573 771 HOH HOH C . N 6 HOH 374 1574 772 HOH HOH C . N 6 HOH 375 1575 774 HOH HOH C . N 6 HOH 376 1576 781 HOH HOH C . N 6 HOH 377 1577 782 HOH HOH C . N 6 HOH 378 1578 783 HOH HOH C . N 6 HOH 379 1579 787 HOH HOH C . N 6 HOH 380 1580 790 HOH HOH C . N 6 HOH 381 1581 792 HOH HOH C . N 6 HOH 382 1582 801 HOH HOH C . N 6 HOH 383 1583 802 HOH HOH C . N 6 HOH 384 1584 803 HOH HOH C . N 6 HOH 385 1585 806 HOH HOH C . N 6 HOH 386 1586 811 HOH HOH C . N 6 HOH 387 1587 813 HOH HOH C . N 6 HOH 388 1588 814 HOH HOH C . N 6 HOH 389 1589 815 HOH HOH C . N 6 HOH 390 1590 816 HOH HOH C . N 6 HOH 391 1591 817 HOH HOH C . N 6 HOH 392 1592 819 HOH HOH C . N 6 HOH 393 1593 822 HOH HOH C . N 6 HOH 394 1594 823 HOH HOH C . N 6 HOH 395 1595 824 HOH HOH C . N 6 HOH 396 1596 828 HOH HOH C . N 6 HOH 397 1597 829 HOH HOH C . O 6 HOH 1 201 85 HOH HOH D . O 6 HOH 2 202 96 HOH HOH D . O 6 HOH 3 203 162 HOH HOH D . O 6 HOH 4 204 214 HOH HOH D . O 6 HOH 5 205 236 HOH HOH D . O 6 HOH 6 206 238 HOH HOH D . O 6 HOH 7 207 384 HOH HOH D . O 6 HOH 8 208 420 HOH HOH D . O 6 HOH 9 209 431 HOH HOH D . O 6 HOH 10 210 690 HOH HOH D . O 6 HOH 11 211 752 HOH HOH D . O 6 HOH 12 212 776 HOH HOH D . # loop_ _pdbx_struct_mod_residue.id _pdbx_struct_mod_residue.label_asym_id _pdbx_struct_mod_residue.label_comp_id _pdbx_struct_mod_residue.label_seq_id _pdbx_struct_mod_residue.auth_asym_id _pdbx_struct_mod_residue.auth_comp_id _pdbx_struct_mod_residue.auth_seq_id _pdbx_struct_mod_residue.PDB_ins_code _pdbx_struct_mod_residue.parent_comp_id _pdbx_struct_mod_residue.details 1 D SER 9 D SER 21 ? SER 'GLYCOSYLATION SITE' 2 B SER 9 B SER 21 ? SER 'GLYCOSYLATION SITE' # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_and_software_defined_assembly PISA dimeric 2 2 author_and_software_defined_assembly PISA dimeric 2 3 software_defined_assembly PISA tetrameric 4 4 software_defined_assembly PISA tetrameric 4 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,B,E,F,G,H,L,M 2 1 C,D,I,J,K,N,O 3 1,2 A,B,E,F,G,H,L,M 4 1,2 C,D,I,J,K,N,O # 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)' 1510 ? 1 MORE -13 ? 1 'SSA (A^2)' 29160 ? 2 'ABSA (A^2)' 1540 ? 2 MORE -13 ? 2 'SSA (A^2)' 28420 ? 3 'ABSA (A^2)' 7750 ? 3 MORE -42 ? 3 'SSA (A^2)' 53600 ? 4 'ABSA (A^2)' 7770 ? 4 MORE -43 ? 4 'SSA (A^2)' 52150 ? # loop_ _pdbx_struct_oper_list.id _pdbx_struct_oper_list.type _pdbx_struct_oper_list.name _pdbx_struct_oper_list.symmetry_operation _pdbx_struct_oper_list.matrix[1][1] _pdbx_struct_oper_list.matrix[1][2] _pdbx_struct_oper_list.matrix[1][3] _pdbx_struct_oper_list.vector[1] _pdbx_struct_oper_list.matrix[2][1] _pdbx_struct_oper_list.matrix[2][2] _pdbx_struct_oper_list.matrix[2][3] _pdbx_struct_oper_list.vector[2] _pdbx_struct_oper_list.matrix[3][1] _pdbx_struct_oper_list.matrix[3][2] _pdbx_struct_oper_list.matrix[3][3] _pdbx_struct_oper_list.vector[3] 1 'identity operation' 1_555 x,y,z 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 2 'crystal symmetry operation' 2_555 -x,y,-z -1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 -1.0000000000 0.0000000000 # _pdbx_struct_special_symmetry.id 1 _pdbx_struct_special_symmetry.PDB_model_num 1 _pdbx_struct_special_symmetry.auth_asym_id A _pdbx_struct_special_symmetry.auth_comp_id HOH _pdbx_struct_special_symmetry.auth_seq_id 1606 _pdbx_struct_special_symmetry.PDB_ins_code ? _pdbx_struct_special_symmetry.label_asym_id L _pdbx_struct_special_symmetry.label_comp_id HOH _pdbx_struct_special_symmetry.label_seq_id . # 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 2012-10-31 2 'Structure model' 1 1 2012-12-12 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Database references' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[3][3] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] 'X-RAY DIFFRACTION' 1 ? refined -13.0830 35.5304 -36.4377 0.4300 0.6161 0.5865 0.0148 -0.2581 0.3342 3.3603 3.9361 3.7380 -2.5259 2.6741 -1.0214 -0.0704 0.1885 0.2918 0.0156 0.2325 0.4070 -0.3314 -0.3108 -0.3045 'X-RAY DIFFRACTION' 2 ? refined -2.6227 35.8219 -22.9230 0.1409 0.3629 0.2110 0.0557 -0.0103 -0.0044 1.5694 3.4151 3.6717 0.6035 0.6312 0.5572 0.0409 0.0684 -0.1125 0.4774 -0.0262 0.2165 -0.3968 -0.0963 -0.1553 'X-RAY DIFFRACTION' 3 ? refined -11.8305 47.7037 -3.7111 0.1903 0.1542 0.1933 0.0480 0.0645 0.0529 2.6907 0.4311 4.4078 0.5511 -3.0357 -0.4824 0.1452 0.0107 -0.1272 0.0667 0.3013 0.0215 -0.0292 -0.0901 -0.0019 'X-RAY DIFFRACTION' 4 ? refined -28.0865 42.3473 -6.4877 0.2767 0.1915 0.1450 0.0760 -0.0147 0.0510 4.3074 4.0657 1.9411 0.6686 1.7717 -0.1154 0.0447 0.0926 -0.1369 0.2891 0.0718 0.2465 -0.4976 -0.0427 -0.1559 'X-RAY DIFFRACTION' 5 ? refined -25.6879 16.3350 -3.5037 0.2556 0.1474 0.0932 0.0473 -0.0585 -0.0058 0.8582 1.5207 1.2848 -0.1203 0.0321 -0.2593 0.0769 -0.0482 -0.0199 0.2326 0.0073 0.1352 -0.5100 0.1303 -0.0805 'X-RAY DIFFRACTION' 6 ? refined -19.3690 23.2957 38.5321 0.3259 0.1845 0.1943 0.0329 0.0265 -0.0448 8.4915 2.7121 5.4797 -1.4402 -2.1400 -2.7438 -0.1667 -0.4153 0.2340 -1.0250 0.8964 0.2919 1.1892 -0.5828 -0.1622 'X-RAY DIFFRACTION' 7 ? refined -18.8414 17.6929 38.7880 0.3142 0.2465 0.1836 0.0258 0.0775 0.0324 0.7916 1.6993 1.0471 -0.2059 -0.6010 -0.8086 -0.1104 0.1632 -0.0249 -0.3380 -0.1670 0.4695 0.7443 -0.0115 -0.1030 'X-RAY DIFFRACTION' 8 ? refined -11.2514 20.9019 45.8431 0.5945 0.6004 0.2739 -0.1844 -0.0297 -0.2746 3.7209 0.6695 5.8092 0.9442 4.5566 0.8410 -0.3300 0.3734 0.0909 -0.2873 0.4676 -0.4397 0.2618 -0.6157 0.3563 'X-RAY DIFFRACTION' 9 ? refined -15.1059 32.9854 24.3370 0.0934 0.1124 0.1104 -0.0081 0.0205 -0.0260 0.9790 1.8360 0.8119 -0.6443 -0.0239 -0.3408 0.0186 0.0450 -0.0376 -0.1402 0.1682 -0.1198 0.1930 -0.1392 0.0112 'X-RAY DIFFRACTION' 10 ? refined -32.5589 27.8476 20.6564 0.0746 0.1280 0.1756 0.0167 0.0218 -0.0145 0.4046 1.3579 1.4523 -0.3562 -0.1315 0.5739 0.0652 -0.0257 -0.0329 -0.0346 0.1068 0.2765 0.0656 -0.0596 -0.1675 'X-RAY DIFFRACTION' 11 ? refined -40.9807 12.7551 -3.3595 0.1484 0.3194 0.2004 -0.0402 -0.4236 -0.0438 1.9438 0.6358 1.6036 -1.0689 1.5634 -0.6918 -0.0566 0.0669 -0.1420 0.2935 -0.0662 1.0020 -0.4935 0.0024 -0.7220 'X-RAY DIFFRACTION' 12 ? refined -8.2523 27.7226 11.3862 0.1516 0.2172 0.2023 0.0145 0.0288 -0.0226 7.2295 0.4389 4.5673 -0.8062 5.7099 -0.7405 0.1851 -0.1385 -0.0789 0.3311 0.1049 -0.0952 0.0790 0.1594 0.4709 'X-RAY DIFFRACTION' 13 ? refined -17.1930 32.0677 -4.2427 0.3523 0.2936 0.2712 0.0111 0.0826 0.0676 6.4776 4.6815 4.8761 -2.6800 3.8545 -4.6317 0.1344 -0.4611 0.3676 0.9724 0.7054 -0.8745 -0.5578 -0.5812 0.8729 'X-RAY DIFFRACTION' 14 ? refined 37.6539 -21.7944 1.1276 0.4662 1.3663 0.9202 0.1519 -0.1599 -0.1988 4.9594 2.5283 1.4755 -0.7301 -0.6887 -1.4005 -0.3959 0.1961 0.2239 0.0799 -0.0293 -0.8122 0.2992 -0.1634 0.3039 'X-RAY DIFFRACTION' 15 ? refined 21.1009 -24.7473 0.3376 0.2217 0.4957 0.1704 -0.0390 0.0217 0.0632 3.7307 4.0988 1.7345 -0.1313 -0.9951 -0.0033 0.0407 -0.1583 0.0527 -0.4271 -0.0505 -0.4629 0.1461 -0.2363 0.9350 'X-RAY DIFFRACTION' 16 ? refined 8.0123 -36.2726 7.6866 0.1750 0.1560 0.1394 0.0613 0.0426 0.0304 1.9535 1.0070 5.4935 0.9823 -2.1221 -0.8072 -0.1483 0.0742 0.0483 0.0396 -0.0835 -0.0321 -0.0735 0.3110 0.0492 'X-RAY DIFFRACTION' 17 ? refined 6.1516 -32.7319 25.3482 0.1653 0.1675 0.1972 0.0564 0.0212 0.0607 3.0631 2.1194 3.0561 0.1697 2.0515 0.6646 -0.1087 0.0057 0.0988 -0.0965 -0.0639 -0.3624 0.2304 0.1461 0.1953 'X-RAY DIFFRACTION' 18 ? refined 6.4357 -5.1907 24.9553 0.0922 0.1486 0.2651 0.0047 -0.0369 0.0438 1.1416 1.3652 1.0464 -0.1263 -0.0671 -0.1473 -0.0053 -0.0452 0.0176 -0.0668 0.0647 -0.4612 0.0640 0.0076 0.2510 'X-RAY DIFFRACTION' 19 ? refined -36.1125 -13.3705 24.5421 0.1874 0.2359 0.3743 -0.0067 0.0935 0.0118 6.0159 3.4572 8.7129 -0.1466 0.5026 -0.6530 0.1177 -0.1159 0.0010 -0.4172 -0.5113 1.0038 0.3348 0.6902 -0.8801 'X-RAY DIFFRACTION' 20 ? refined -36.1494 -5.2230 22.8465 0.1747 0.2442 0.2366 0.0358 0.0509 0.0238 1.2896 2.8119 0.8855 -1.2539 -0.4231 -0.1554 -0.0564 0.1696 -0.0875 -0.0772 0.1399 0.4848 0.4903 -0.1763 -0.4350 'X-RAY DIFFRACTION' 21 ? refined -41.8937 -9.1331 19.8555 0.2774 0.3690 0.4041 -0.0264 0.0191 -0.0619 9.0241 2.2719 4.8917 2.2366 5.8302 0.9739 -0.4946 0.2390 0.1762 0.5631 -0.3664 0.6918 -0.0958 0.4602 -0.5804 'X-RAY DIFFRACTION' 22 ? refined -22.9414 -21.7597 17.5474 0.1072 0.1208 0.1046 -0.0274 0.0102 -0.0060 0.8984 2.1061 1.0138 -0.5464 0.0480 -0.5721 -0.0248 0.0196 -0.0073 0.0308 -0.1156 0.2479 -0.0976 0.1449 -0.1401 'X-RAY DIFFRACTION' 23 ? refined -12.0326 -18.3888 32.6106 0.1803 0.1539 0.1172 -0.0035 0.0030 0.0328 1.7704 2.5211 0.7257 -0.5332 -0.1881 -0.1872 -0.0784 0.0285 0.0458 -0.2017 -0.0592 -0.0184 0.2559 0.0328 0.0410 'X-RAY DIFFRACTION' 24 ? refined -10.1718 -10.9952 37.4503 0.1900 0.1406 0.0782 0.0016 -0.0312 0.0280 1.0040 1.1319 0.6931 -0.0706 -0.2447 -0.1118 -0.0273 -0.0332 0.0236 -0.2578 0.0860 -0.0731 0.4160 0.0787 0.0432 'X-RAY DIFFRACTION' 25 ? refined -10.4618 -16.5899 9.4186 0.2233 0.2555 0.1656 -0.0014 0.0207 0.0270 5.6835 1.3400 5.5878 -1.1750 5.6194 -1.0471 0.0484 -0.1942 0.1399 0.6661 0.2145 0.0720 -0.0968 -0.0695 0.3179 'X-RAY DIFFRACTION' 26 ? refined 6.1995 -20.8790 16.4374 0.2910 0.2468 0.2834 0.0248 0.1063 -0.0165 2.5432 7.4948 8.4056 -4.3367 0.3027 0.3935 0.2371 -0.5502 0.2235 1.0026 -0.5420 -0.4384 -0.9815 0.6081 0.6374 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.selection_details _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection 'X-RAY DIFFRACTION' 1 1 A 314 A 339 '( CHAIN A AND RESID 314:339 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 2 2 A 340 A 410 '( CHAIN A AND RESID 340:410 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 3 3 A 411 A 474 '( CHAIN A AND RESID 411:474 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 4 4 A 475 A 515 '( CHAIN A AND RESID 475:515 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 5 5 A 516 A 705 '( CHAIN A AND RESID 516:705 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 6 6 A 706 A 718 '( CHAIN A AND RESID 706:718 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 7 7 A 719 A 766 '( CHAIN A AND RESID 719:766 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 8 8 A 767 A 772 '( CHAIN A AND RESID 767:772 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 9 9 A 773 A 917 '( CHAIN A AND RESID 773:917 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 10 10 A 918 A 1004 '( CHAIN A AND RESID 918:1004 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 11 11 A 1005 A 1028 '( CHAIN A AND RESID 1005:1028 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 12 12 B 13 B 20 '( CHAIN B AND RESID 13:20 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 13 13 B 21 B 26 '( CHAIN B AND RESID 21:26 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 14 14 C 336 C 348 '( CHAIN C AND RESID 336:348 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 15 15 C 349 C 408 '( CHAIN C AND RESID 349:408 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 16 16 C 409 C 460 '( CHAIN C AND RESID 409:460 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 17 17 C 461 C 515 '( CHAIN C AND RESID 461:515 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 18 18 C 516 C 705 '( CHAIN C AND RESID 516:705 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 19 19 C 706 C 721 '( CHAIN C AND RESID 706:721 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 20 20 C 722 C 763 '( CHAIN C AND RESID 722:763 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 21 21 C 764 C 772 '( CHAIN C AND RESID 764:772 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 22 22 C 773 C 913 '( CHAIN C AND RESID 773:913 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 23 23 C 914 C 958 '( CHAIN C AND RESID 914:958 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 24 24 C 959 C 1028 '( CHAIN C AND RESID 959:1028 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 25 25 D 13 D 20 '( CHAIN D AND RESID 13:20 )' ? ? ? ? ? 'X-RAY DIFFRACTION' 26 26 D 21 D 26 '( CHAIN D AND RESID 21:26 )' ? ? ? ? ? # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal CBASS 'data collection' . ? 1 PHENIX 'model building' '(phenix.refine: 1.7.2_869)' ? 2 PHENIX refinement '(phenix.refine: 1.7.2_869)' ? 3 iMOSFLM 'data reduction' . ? 4 SCALA 'data scaling' . ? 5 PHENIX phasing 1.7.2_869 ? 6 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 O C HOH 1315 ? ? O C HOH 1592 ? ? 2.05 2 1 O C HOH 1385 ? ? O C HOH 1595 ? ? 2.13 3 1 OG D SER 21 ? ? S5 D 0YT 101 ? ? 2.14 4 1 O C HOH 1461 ? ? O C HOH 1511 ? ? 2.16 5 1 O C HOH 1521 ? ? O C HOH 1530 ? ? 2.18 # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 GLU A 349 ? ? -91.55 51.96 2 1 PHE A 452 ? ? -150.60 79.27 3 1 PRO A 504 ? ? -75.64 47.40 4 1 LEU A 653 ? ? 80.46 -49.55 5 1 THR A 669 ? ? -144.64 -152.59 6 1 HIS A 691 ? ? -116.19 -88.52 7 1 ASN A 722 ? ? -149.43 27.44 8 1 ASN A 770 ? ? -111.02 -163.50 9 1 HIS A 920 ? ? -109.77 -85.97 10 1 CYS A 955 ? ? -117.39 67.85 11 1 MET A 1026 ? ? -109.89 79.22 12 1 GLU C 349 ? ? -101.20 49.93 13 1 PHE C 452 ? ? -154.10 80.00 14 1 PRO C 504 ? ? -76.92 48.25 15 1 LEU C 653 ? ? 80.59 -45.40 16 1 THR C 669 ? ? -146.75 -153.88 17 1 HIS C 691 ? ? -116.42 -85.92 18 1 ASN C 722 ? ? -148.34 27.78 19 1 ASN C 770 ? ? -108.95 -164.42 20 1 HIS C 920 ? ? -110.55 -82.60 21 1 CYS C 955 ? ? -118.50 67.90 22 1 MET C 1026 ? ? -109.89 79.18 # 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 309 ? A GLY 1 2 1 Y 1 A PRO 310 ? A PRO 2 3 1 Y 1 A GLY 311 ? A GLY 3 4 1 Y 1 A SER 312 ? A SER 4 5 1 Y 1 A CYS 313 ? A CYS 5 6 1 Y 1 A SER 715 ? A SER 407 7 1 Y 1 A ASN 716 ? A ASN 408 8 1 Y 1 A GLY 717 ? A GLY 409 9 1 Y 1 A MET 746 ? A MET 438 10 1 Y 1 A LYS 747 ? A LYS 439 11 1 Y 1 A CYS 748 ? A CYS 440 12 1 Y 1 A PRO 749 ? A PRO 441 13 1 Y 1 A ASP 750 ? A ASP 442 14 1 Y 1 A GLY 751 ? A GLY 443 15 1 Y 1 A GLY 752 ? A GLY 444 16 1 Y 1 A ASP 753 ? A ASP 445 17 1 Y 1 A ASN 754 ? A ASN 446 18 1 Y 1 A ALA 755 ? A ALA 447 19 1 Y 1 A ASP 756 ? A ASP 448 20 1 Y 1 A SER 757 ? A SER 449 21 1 Y 1 A SER 758 ? A SER 450 22 1 Y 1 A ASN 759 ? A ASN 451 23 1 Y 1 A THR 760 ? A THR 452 24 1 Y 1 A ALA 761 ? A ALA 453 25 1 Y 1 A LEU 762 ? A LEU 454 26 1 Y 1 A PRO 1029 ? A PRO 721 27 1 Y 1 A VAL 1030 ? A VAL 722 28 1 Y 1 A GLU 1031 ? A GLU 723 29 1 Y 1 C GLY 309 ? C GLY 1 30 1 Y 1 C PRO 310 ? C PRO 2 31 1 Y 1 C GLY 311 ? C GLY 3 32 1 Y 1 C SER 312 ? C SER 4 33 1 Y 1 C CYS 313 ? C CYS 5 34 1 Y 1 C PRO 314 ? C PRO 6 35 1 Y 1 C THR 315 ? C THR 7 36 1 Y 1 C HIS 316 ? C HIS 8 37 1 Y 1 C ALA 317 ? C ALA 9 38 1 Y 1 C ASP 318 ? C ASP 10 39 1 Y 1 C SER 319 ? C SER 11 40 1 Y 1 C LEU 320 ? C LEU 12 41 1 Y 1 C ASN 321 ? C ASN 13 42 1 Y 1 C ASN 322 ? C ASN 14 43 1 Y 1 C LEU 323 ? C LEU 15 44 1 Y 1 C ALA 324 ? C ALA 16 45 1 Y 1 C ASN 325 ? C ASN 17 46 1 Y 1 C ILE 326 ? C ILE 18 47 1 Y 1 C LYS 327 ? C LYS 19 48 1 Y 1 C ARG 328 ? C ARG 20 49 1 Y 1 C GLU 329 ? C GLU 21 50 1 Y 1 C GLN 330 ? C GLN 22 51 1 Y 1 C GLY 331 ? C GLY 23 52 1 Y 1 C ASN 332 ? C ASN 24 53 1 Y 1 C ILE 333 ? C ILE 25 54 1 Y 1 C GLU 334 ? C GLU 26 55 1 Y 1 C GLU 335 ? C GLU 27 56 1 Y 1 C SER 715 ? C SER 407 57 1 Y 1 C ASN 716 ? C ASN 408 58 1 Y 1 C GLY 717 ? C GLY 409 59 1 Y 1 C LYS 747 ? C LYS 439 60 1 Y 1 C CYS 748 ? C CYS 440 61 1 Y 1 C PRO 749 ? C PRO 441 62 1 Y 1 C ASP 750 ? C ASP 442 63 1 Y 1 C GLY 751 ? C GLY 443 64 1 Y 1 C GLY 752 ? C GLY 444 65 1 Y 1 C ASP 753 ? C ASP 445 66 1 Y 1 C ASN 754 ? C ASN 446 67 1 Y 1 C ALA 755 ? C ALA 447 68 1 Y 1 C ASP 756 ? C ASP 448 69 1 Y 1 C SER 757 ? C SER 449 70 1 Y 1 C SER 758 ? C SER 450 71 1 Y 1 C ASN 759 ? C ASN 451 72 1 Y 1 C THR 760 ? C THR 452 73 1 Y 1 C ALA 761 ? C ALA 453 74 1 Y 1 C LEU 762 ? C LEU 454 75 1 Y 1 C PRO 1029 ? C PRO 721 76 1 Y 1 C VAL 1030 ? C VAL 722 77 1 Y 1 C GLU 1031 ? C GLU 723 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 3 "URIDINE-5'-DIPHOSPHATE" UDP 4 'SULFATE ION' SO4 5 '2-(acetylamino)-2-deoxy-5-thio-beta-D-glucopyranose' 0YT 6 water HOH #