data_3WAV # _entry.id 3WAV # _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 3WAV RCSB RCSB096104 WWPDB D_1000096104 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 3WAW . unspecified PDB 3WAX . unspecified PDB 3WAY . unspecified # _pdbx_database_status.entry_id 3WAV _pdbx_database_status.status_code REL _pdbx_database_status.methods_development_category ? _pdbx_database_status.deposit_site PDBJ _pdbx_database_status.process_site PDBJ _pdbx_database_status.recvd_initial_deposition_date 2013-05-09 _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.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Nishimasu, H.' 1 'Ishitani, R.' 2 'Nureki, O.' 3 # _citation.id primary _citation.title ;Screening and X-ray Crystal Structure-based Optimization of Autotaxin (ENPP2) Inhibitors, Using a Newly Developed Fluorescence Probe ; _citation.journal_abbrev 'Acs Chem.Biol.' _citation.journal_volume 8 _citation.page_first 1713 _citation.page_last 1721 _citation.year 2013 _citation.journal_id_ASTM ? _citation.country US _citation.journal_id_ISSN 1554-8929 _citation.journal_id_CSD ? _citation.book_publisher ? _citation.pdbx_database_id_PubMed 23688339 _citation.pdbx_database_id_DOI 10.1021/cb400150c # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Kawaguchi, M.' 1 primary 'Okabe, T.' 2 primary 'Okudaira, S.' 3 primary 'Nishimasu, H.' 4 primary 'Ishitani, R.' 5 primary 'Kojima, H.' 6 primary 'Nureki, O.' 7 primary 'Aoki, J.' 8 primary 'Nagano, T.' 9 # _cell.length_a 61.505 _cell.length_b 94.015 _cell.length_c 75.446 _cell.angle_alpha 90.000 _cell.angle_beta 94.520 _cell.angle_gamma 90.000 _cell.entry_id 3WAV _cell.pdbx_unique_axis ? _cell.Z_PDB 2 _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.space_group_name_H-M 'P 1 21 1' _symmetry.entry_id 3WAV _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.Int_Tables_number 4 _symmetry.cell_setting ? _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 'Ectonucleotide pyrophosphatase/phosphodiesterase family member 2' 95757.430 1 3.1.4.39 ? ? ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 6 ? ? ? ? 3 non-polymer man BETA-D-MANNOSE 180.156 1 ? ? ? ? 4 non-polymer man ALPHA-D-MANNOSE 180.156 3 ? ? ? ? 5 non-polymer syn 'ZINC ION' 65.409 2 ? ? ? ? 6 non-polymer syn 'CALCIUM ION' 40.078 1 ? ? ? ? 7 non-polymer syn 'SODIUM ION' 22.990 1 ? ? ? ? 8 non-polymer syn 'POTASSIUM ION' 39.098 1 ? ? ? ? 9 non-polymer syn 'THIOCYANATE ION' 58.082 2 ? ? ? ? 10 non-polymer syn 1,2-ETHANEDIOL 62.068 18 ? ? ? ? 11 non-polymer syn 'SULFATE ION' 96.063 1 ? ? ? ? 12 non-polymer syn '(5Z)-5-(3,4-dichlorobenzylidene)-2-(4-methylpiperazin-1-yl)-1,3-thiazol-4(5H)-one' 356.270 1 ? ? ? ? 13 water nat water 18.015 423 ? ? ? ? # _entity_name_com.entity_id 1 _entity_name_com.name 'ATX, E-NPP 2, Autotaxin, Extracellular lysophospholipase D, LysoPLD' # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code ;AEWDEGPPTVLSDSPWTNTSGSCKGRCFELQEVGPPDCRCDNLCKSYSSCCHDFDELCLKTARGWECTKDRCGEVRNEEN ACHCSEDCLSRGDCCTNYQVVCKGESHWVDDDCEEIRVPECPAGFVRPPLIIFSVDGFRASYMKKGSKVMPNIEKLRSCG THAPYMRPVYPTKTFPNLYTLATGLYPESHGIVGNSMYDPVFDATFHLRGREKFNHRWWGGQPLWITATKQGVRAGTFFW SVSIPHERRILTILQWLSLPDNERPSVYAFYSEQPDFSGHKYGPFGPEMTNPLREIDKTVGQLMDGLKQLKLHRCVNVIF VGDHGMEDVTCDRTEFLSNYLTNVDDITLVPGTLGRIRPKIPNNLKYDPKAIIANLTCKKPDQHFKPYMKQHLPKRLHYA NNRRIEDLHLLVERRWHVARKPLDVYKKPSGKCFFQGDHGFDNKVNSMQTVFVGYGPTFKYRTKVPPFENIELYNVMCDL LGLKPAPNNGTHGSLNHLLRTNTFRPTLPEEVSRPNYPGIMYLQSDFDLGCTCDDKNKLEELNKRLHTKGSTEERHLLYG RPAVLYRTSYDILYHTDFESGYSEIFLMPLWTSYTISKQAEVSSIPEHLTNCVRPDVRVSPGFSQNCLAYKNDKQMSYGF LFPPYLSSSPEAKYDAFLVTNMVPMYPAFKRVWTYFQRVLVKKYASERNGVNVISGPIFDYNYNGLRDIEDEIKQYVEGS SIPVPTHYYSIITSCLDFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGLDFYR KTSRSYSEILTLKTYLHTYESEISRENLYFQ ; _entity_poly.pdbx_seq_one_letter_code_can ;AEWDEGPPTVLSDSPWTNTSGSCKGRCFELQEVGPPDCRCDNLCKSYSSCCHDFDELCLKTARGWECTKDRCGEVRNEEN ACHCSEDCLSRGDCCTNYQVVCKGESHWVDDDCEEIRVPECPAGFVRPPLIIFSVDGFRASYMKKGSKVMPNIEKLRSCG THAPYMRPVYPTKTFPNLYTLATGLYPESHGIVGNSMYDPVFDATFHLRGREKFNHRWWGGQPLWITATKQGVRAGTFFW SVSIPHERRILTILQWLSLPDNERPSVYAFYSEQPDFSGHKYGPFGPEMTNPLREIDKTVGQLMDGLKQLKLHRCVNVIF VGDHGMEDVTCDRTEFLSNYLTNVDDITLVPGTLGRIRPKIPNNLKYDPKAIIANLTCKKPDQHFKPYMKQHLPKRLHYA NNRRIEDLHLLVERRWHVARKPLDVYKKPSGKCFFQGDHGFDNKVNSMQTVFVGYGPTFKYRTKVPPFENIELYNVMCDL LGLKPAPNNGTHGSLNHLLRTNTFRPTLPEEVSRPNYPGIMYLQSDFDLGCTCDDKNKLEELNKRLHTKGSTEERHLLYG RPAVLYRTSYDILYHTDFESGYSEIFLMPLWTSYTISKQAEVSSIPEHLTNCVRPDVRVSPGFSQNCLAYKNDKQMSYGF LFPPYLSSSPEAKYDAFLVTNMVPMYPAFKRVWTYFQRVLVKKYASERNGVNVISGPIFDYNYNGLRDIEDEIKQYVEGS SIPVPTHYYSIITSCLDFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGLDFYR KTSRSYSEILTLKTYLHTYESEISRENLYFQ ; _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 ALA n 1 2 GLU n 1 3 TRP n 1 4 ASP n 1 5 GLU n 1 6 GLY n 1 7 PRO n 1 8 PRO n 1 9 THR n 1 10 VAL n 1 11 LEU n 1 12 SER n 1 13 ASP n 1 14 SER n 1 15 PRO n 1 16 TRP n 1 17 THR n 1 18 ASN n 1 19 THR n 1 20 SER n 1 21 GLY n 1 22 SER n 1 23 CYS n 1 24 LYS n 1 25 GLY n 1 26 ARG n 1 27 CYS n 1 28 PHE n 1 29 GLU n 1 30 LEU n 1 31 GLN n 1 32 GLU n 1 33 VAL n 1 34 GLY n 1 35 PRO n 1 36 PRO n 1 37 ASP n 1 38 CYS n 1 39 ARG n 1 40 CYS n 1 41 ASP n 1 42 ASN n 1 43 LEU n 1 44 CYS n 1 45 LYS n 1 46 SER n 1 47 TYR n 1 48 SER n 1 49 SER n 1 50 CYS n 1 51 CYS n 1 52 HIS n 1 53 ASP n 1 54 PHE n 1 55 ASP n 1 56 GLU n 1 57 LEU n 1 58 CYS n 1 59 LEU n 1 60 LYS n 1 61 THR n 1 62 ALA n 1 63 ARG n 1 64 GLY n 1 65 TRP n 1 66 GLU n 1 67 CYS n 1 68 THR n 1 69 LYS n 1 70 ASP n 1 71 ARG n 1 72 CYS n 1 73 GLY n 1 74 GLU n 1 75 VAL n 1 76 ARG n 1 77 ASN n 1 78 GLU n 1 79 GLU n 1 80 ASN n 1 81 ALA n 1 82 CYS n 1 83 HIS n 1 84 CYS n 1 85 SER n 1 86 GLU n 1 87 ASP n 1 88 CYS n 1 89 LEU n 1 90 SER n 1 91 ARG n 1 92 GLY n 1 93 ASP n 1 94 CYS n 1 95 CYS n 1 96 THR n 1 97 ASN n 1 98 TYR n 1 99 GLN n 1 100 VAL n 1 101 VAL n 1 102 CYS n 1 103 LYS n 1 104 GLY n 1 105 GLU n 1 106 SER n 1 107 HIS n 1 108 TRP n 1 109 VAL n 1 110 ASP n 1 111 ASP n 1 112 ASP n 1 113 CYS n 1 114 GLU n 1 115 GLU n 1 116 ILE n 1 117 ARG n 1 118 VAL n 1 119 PRO n 1 120 GLU n 1 121 CYS n 1 122 PRO n 1 123 ALA n 1 124 GLY n 1 125 PHE n 1 126 VAL n 1 127 ARG n 1 128 PRO n 1 129 PRO n 1 130 LEU n 1 131 ILE n 1 132 ILE n 1 133 PHE n 1 134 SER n 1 135 VAL n 1 136 ASP n 1 137 GLY n 1 138 PHE n 1 139 ARG n 1 140 ALA n 1 141 SER n 1 142 TYR n 1 143 MET n 1 144 LYS n 1 145 LYS n 1 146 GLY n 1 147 SER n 1 148 LYS n 1 149 VAL n 1 150 MET n 1 151 PRO n 1 152 ASN n 1 153 ILE n 1 154 GLU n 1 155 LYS n 1 156 LEU n 1 157 ARG n 1 158 SER n 1 159 CYS n 1 160 GLY n 1 161 THR n 1 162 HIS n 1 163 ALA n 1 164 PRO n 1 165 TYR n 1 166 MET n 1 167 ARG n 1 168 PRO n 1 169 VAL n 1 170 TYR n 1 171 PRO n 1 172 THR n 1 173 LYS n 1 174 THR n 1 175 PHE n 1 176 PRO n 1 177 ASN n 1 178 LEU n 1 179 TYR n 1 180 THR n 1 181 LEU n 1 182 ALA n 1 183 THR n 1 184 GLY n 1 185 LEU n 1 186 TYR n 1 187 PRO n 1 188 GLU n 1 189 SER n 1 190 HIS n 1 191 GLY n 1 192 ILE n 1 193 VAL n 1 194 GLY n 1 195 ASN n 1 196 SER n 1 197 MET n 1 198 TYR n 1 199 ASP n 1 200 PRO n 1 201 VAL n 1 202 PHE n 1 203 ASP n 1 204 ALA n 1 205 THR n 1 206 PHE n 1 207 HIS n 1 208 LEU n 1 209 ARG n 1 210 GLY n 1 211 ARG n 1 212 GLU n 1 213 LYS n 1 214 PHE n 1 215 ASN n 1 216 HIS n 1 217 ARG n 1 218 TRP n 1 219 TRP n 1 220 GLY n 1 221 GLY n 1 222 GLN n 1 223 PRO n 1 224 LEU n 1 225 TRP n 1 226 ILE n 1 227 THR n 1 228 ALA n 1 229 THR n 1 230 LYS n 1 231 GLN n 1 232 GLY n 1 233 VAL n 1 234 ARG n 1 235 ALA n 1 236 GLY n 1 237 THR n 1 238 PHE n 1 239 PHE n 1 240 TRP n 1 241 SER n 1 242 VAL n 1 243 SER n 1 244 ILE n 1 245 PRO n 1 246 HIS n 1 247 GLU n 1 248 ARG n 1 249 ARG n 1 250 ILE n 1 251 LEU n 1 252 THR n 1 253 ILE n 1 254 LEU n 1 255 GLN n 1 256 TRP n 1 257 LEU n 1 258 SER n 1 259 LEU n 1 260 PRO n 1 261 ASP n 1 262 ASN n 1 263 GLU n 1 264 ARG n 1 265 PRO n 1 266 SER n 1 267 VAL n 1 268 TYR n 1 269 ALA n 1 270 PHE n 1 271 TYR n 1 272 SER n 1 273 GLU n 1 274 GLN n 1 275 PRO n 1 276 ASP n 1 277 PHE n 1 278 SER n 1 279 GLY n 1 280 HIS n 1 281 LYS n 1 282 TYR n 1 283 GLY n 1 284 PRO n 1 285 PHE n 1 286 GLY n 1 287 PRO n 1 288 GLU n 1 289 MET n 1 290 THR n 1 291 ASN n 1 292 PRO n 1 293 LEU n 1 294 ARG n 1 295 GLU n 1 296 ILE n 1 297 ASP n 1 298 LYS n 1 299 THR n 1 300 VAL n 1 301 GLY n 1 302 GLN n 1 303 LEU n 1 304 MET n 1 305 ASP n 1 306 GLY n 1 307 LEU n 1 308 LYS n 1 309 GLN n 1 310 LEU n 1 311 LYS n 1 312 LEU n 1 313 HIS n 1 314 ARG n 1 315 CYS n 1 316 VAL n 1 317 ASN n 1 318 VAL n 1 319 ILE n 1 320 PHE n 1 321 VAL n 1 322 GLY n 1 323 ASP n 1 324 HIS n 1 325 GLY n 1 326 MET n 1 327 GLU n 1 328 ASP n 1 329 VAL n 1 330 THR n 1 331 CYS n 1 332 ASP n 1 333 ARG n 1 334 THR n 1 335 GLU n 1 336 PHE n 1 337 LEU n 1 338 SER n 1 339 ASN n 1 340 TYR n 1 341 LEU n 1 342 THR n 1 343 ASN n 1 344 VAL n 1 345 ASP n 1 346 ASP n 1 347 ILE n 1 348 THR n 1 349 LEU n 1 350 VAL n 1 351 PRO n 1 352 GLY n 1 353 THR n 1 354 LEU n 1 355 GLY n 1 356 ARG n 1 357 ILE n 1 358 ARG n 1 359 PRO n 1 360 LYS n 1 361 ILE n 1 362 PRO n 1 363 ASN n 1 364 ASN n 1 365 LEU n 1 366 LYS n 1 367 TYR n 1 368 ASP n 1 369 PRO n 1 370 LYS n 1 371 ALA n 1 372 ILE n 1 373 ILE n 1 374 ALA n 1 375 ASN n 1 376 LEU n 1 377 THR n 1 378 CYS n 1 379 LYS n 1 380 LYS n 1 381 PRO n 1 382 ASP n 1 383 GLN n 1 384 HIS n 1 385 PHE n 1 386 LYS n 1 387 PRO n 1 388 TYR n 1 389 MET n 1 390 LYS n 1 391 GLN n 1 392 HIS n 1 393 LEU n 1 394 PRO n 1 395 LYS n 1 396 ARG n 1 397 LEU n 1 398 HIS n 1 399 TYR n 1 400 ALA n 1 401 ASN n 1 402 ASN n 1 403 ARG n 1 404 ARG n 1 405 ILE n 1 406 GLU n 1 407 ASP n 1 408 LEU n 1 409 HIS n 1 410 LEU n 1 411 LEU n 1 412 VAL n 1 413 GLU n 1 414 ARG n 1 415 ARG n 1 416 TRP n 1 417 HIS n 1 418 VAL n 1 419 ALA n 1 420 ARG n 1 421 LYS n 1 422 PRO n 1 423 LEU n 1 424 ASP n 1 425 VAL n 1 426 TYR n 1 427 LYS n 1 428 LYS n 1 429 PRO n 1 430 SER n 1 431 GLY n 1 432 LYS n 1 433 CYS n 1 434 PHE n 1 435 PHE n 1 436 GLN n 1 437 GLY n 1 438 ASP n 1 439 HIS n 1 440 GLY n 1 441 PHE n 1 442 ASP n 1 443 ASN n 1 444 LYS n 1 445 VAL n 1 446 ASN n 1 447 SER n 1 448 MET n 1 449 GLN n 1 450 THR n 1 451 VAL n 1 452 PHE n 1 453 VAL n 1 454 GLY n 1 455 TYR n 1 456 GLY n 1 457 PRO n 1 458 THR n 1 459 PHE n 1 460 LYS n 1 461 TYR n 1 462 ARG n 1 463 THR n 1 464 LYS n 1 465 VAL n 1 466 PRO n 1 467 PRO n 1 468 PHE n 1 469 GLU n 1 470 ASN n 1 471 ILE n 1 472 GLU n 1 473 LEU n 1 474 TYR n 1 475 ASN n 1 476 VAL n 1 477 MET n 1 478 CYS n 1 479 ASP n 1 480 LEU n 1 481 LEU n 1 482 GLY n 1 483 LEU n 1 484 LYS n 1 485 PRO n 1 486 ALA n 1 487 PRO n 1 488 ASN n 1 489 ASN n 1 490 GLY n 1 491 THR n 1 492 HIS n 1 493 GLY n 1 494 SER n 1 495 LEU n 1 496 ASN n 1 497 HIS n 1 498 LEU n 1 499 LEU n 1 500 ARG n 1 501 THR n 1 502 ASN n 1 503 THR n 1 504 PHE n 1 505 ARG n 1 506 PRO n 1 507 THR n 1 508 LEU n 1 509 PRO n 1 510 GLU n 1 511 GLU n 1 512 VAL n 1 513 SER n 1 514 ARG n 1 515 PRO n 1 516 ASN n 1 517 TYR n 1 518 PRO n 1 519 GLY n 1 520 ILE n 1 521 MET n 1 522 TYR n 1 523 LEU n 1 524 GLN n 1 525 SER n 1 526 ASP n 1 527 PHE n 1 528 ASP n 1 529 LEU n 1 530 GLY n 1 531 CYS n 1 532 THR n 1 533 CYS n 1 534 ASP n 1 535 ASP n 1 536 LYS n 1 537 ASN n 1 538 LYS n 1 539 LEU n 1 540 GLU n 1 541 GLU n 1 542 LEU n 1 543 ASN n 1 544 LYS n 1 545 ARG n 1 546 LEU n 1 547 HIS n 1 548 THR n 1 549 LYS n 1 550 GLY n 1 551 SER n 1 552 THR n 1 553 GLU n 1 554 GLU n 1 555 ARG n 1 556 HIS n 1 557 LEU n 1 558 LEU n 1 559 TYR n 1 560 GLY n 1 561 ARG n 1 562 PRO n 1 563 ALA n 1 564 VAL n 1 565 LEU n 1 566 TYR n 1 567 ARG n 1 568 THR n 1 569 SER n 1 570 TYR n 1 571 ASP n 1 572 ILE n 1 573 LEU n 1 574 TYR n 1 575 HIS n 1 576 THR n 1 577 ASP n 1 578 PHE n 1 579 GLU n 1 580 SER n 1 581 GLY n 1 582 TYR n 1 583 SER n 1 584 GLU n 1 585 ILE n 1 586 PHE n 1 587 LEU n 1 588 MET n 1 589 PRO n 1 590 LEU n 1 591 TRP n 1 592 THR n 1 593 SER n 1 594 TYR n 1 595 THR n 1 596 ILE n 1 597 SER n 1 598 LYS n 1 599 GLN n 1 600 ALA n 1 601 GLU n 1 602 VAL n 1 603 SER n 1 604 SER n 1 605 ILE n 1 606 PRO n 1 607 GLU n 1 608 HIS n 1 609 LEU n 1 610 THR n 1 611 ASN n 1 612 CYS n 1 613 VAL n 1 614 ARG n 1 615 PRO n 1 616 ASP n 1 617 VAL n 1 618 ARG n 1 619 VAL n 1 620 SER n 1 621 PRO n 1 622 GLY n 1 623 PHE n 1 624 SER n 1 625 GLN n 1 626 ASN n 1 627 CYS n 1 628 LEU n 1 629 ALA n 1 630 TYR n 1 631 LYS n 1 632 ASN n 1 633 ASP n 1 634 LYS n 1 635 GLN n 1 636 MET n 1 637 SER n 1 638 TYR n 1 639 GLY n 1 640 PHE n 1 641 LEU n 1 642 PHE n 1 643 PRO n 1 644 PRO n 1 645 TYR n 1 646 LEU n 1 647 SER n 1 648 SER n 1 649 SER n 1 650 PRO n 1 651 GLU n 1 652 ALA n 1 653 LYS n 1 654 TYR n 1 655 ASP n 1 656 ALA n 1 657 PHE n 1 658 LEU n 1 659 VAL n 1 660 THR n 1 661 ASN n 1 662 MET n 1 663 VAL n 1 664 PRO n 1 665 MET n 1 666 TYR n 1 667 PRO n 1 668 ALA n 1 669 PHE n 1 670 LYS n 1 671 ARG n 1 672 VAL n 1 673 TRP n 1 674 THR n 1 675 TYR n 1 676 PHE n 1 677 GLN n 1 678 ARG n 1 679 VAL n 1 680 LEU n 1 681 VAL n 1 682 LYS n 1 683 LYS n 1 684 TYR n 1 685 ALA n 1 686 SER n 1 687 GLU n 1 688 ARG n 1 689 ASN n 1 690 GLY n 1 691 VAL n 1 692 ASN n 1 693 VAL n 1 694 ILE n 1 695 SER n 1 696 GLY n 1 697 PRO n 1 698 ILE n 1 699 PHE n 1 700 ASP n 1 701 TYR n 1 702 ASN n 1 703 TYR n 1 704 ASN n 1 705 GLY n 1 706 LEU n 1 707 ARG n 1 708 ASP n 1 709 ILE n 1 710 GLU n 1 711 ASP n 1 712 GLU n 1 713 ILE n 1 714 LYS n 1 715 GLN n 1 716 TYR n 1 717 VAL n 1 718 GLU n 1 719 GLY n 1 720 SER n 1 721 SER n 1 722 ILE n 1 723 PRO n 1 724 VAL n 1 725 PRO n 1 726 THR n 1 727 HIS n 1 728 TYR n 1 729 TYR n 1 730 SER n 1 731 ILE n 1 732 ILE n 1 733 THR n 1 734 SER n 1 735 CYS n 1 736 LEU n 1 737 ASP n 1 738 PHE n 1 739 THR n 1 740 GLN n 1 741 PRO n 1 742 ALA n 1 743 ASP n 1 744 LYS n 1 745 CYS n 1 746 ASP n 1 747 GLY n 1 748 PRO n 1 749 LEU n 1 750 SER n 1 751 VAL n 1 752 SER n 1 753 SER n 1 754 PHE n 1 755 ILE n 1 756 LEU n 1 757 PRO n 1 758 HIS n 1 759 ARG n 1 760 PRO n 1 761 ASP n 1 762 ASN n 1 763 ASP n 1 764 GLU n 1 765 SER n 1 766 CYS n 1 767 ASN n 1 768 SER n 1 769 SER n 1 770 GLU n 1 771 ASP n 1 772 GLU n 1 773 SER n 1 774 LYS n 1 775 TRP n 1 776 VAL n 1 777 GLU n 1 778 GLU n 1 779 LEU n 1 780 MET n 1 781 LYS n 1 782 MET n 1 783 HIS n 1 784 THR n 1 785 ALA n 1 786 ARG n 1 787 VAL n 1 788 ARG n 1 789 ASP n 1 790 ILE n 1 791 GLU n 1 792 HIS n 1 793 LEU n 1 794 THR n 1 795 GLY n 1 796 LEU n 1 797 ASP n 1 798 PHE n 1 799 TYR n 1 800 ARG n 1 801 LYS n 1 802 THR n 1 803 SER n 1 804 ARG n 1 805 SER n 1 806 TYR n 1 807 SER n 1 808 GLU n 1 809 ILE n 1 810 LEU n 1 811 THR n 1 812 LEU n 1 813 LYS n 1 814 THR n 1 815 TYR n 1 816 LEU n 1 817 HIS n 1 818 THR n 1 819 TYR n 1 820 GLU n 1 821 SER n 1 822 GLU n 1 823 ILE n 1 824 SER n 1 825 ARG n 1 826 GLU n 1 827 ASN n 1 828 LEU n 1 829 TYR n 1 830 PHE n 1 831 GLN 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 mouse _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene Enpp2 _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Mus musculus' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 10090 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name human _entity_src_gen.pdbx_host_org_scientific_name 'Homo Sapiens' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 9606 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line 'HEK293S GnT1-' _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type plasmid _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pCD-CW _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code ENPP2_MOUSE _struct_ref.pdbx_db_accession Q9R1E6 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;AEWDEGPPTVLSDSPWTNTSGSCKGRCFELQEVGPPDCRCDNLCKSYSSCCHDFDELCLKTARGWECTKDRCGEVRNEEN ACHCSEDCLSRGDCCTNYQVVCKGESHWVDDDCEEIRVPECPAGFVRPPLIIFSVDGFRASYMKKGSKVMPNIEKLRSCG THAPYMRPVYPTKTFPNLYTLATGLYPESHGIVGNSMYDPVFDATFHLRGREKFNHRWWGGQPLWITATKQGVRAGTFFW SVSIPHERRILTILQWLSLPDNERPSVYAFYSEQPDFSGHKYGPFGPEMTNPLREIDKTVGQLMDGLKQLKLHRCVNVIF VGDHGMEDVTCDRTEFLSNYLTNVDDITLVPGTLGRIRPKIPNNLKYDPKAIIANLTCKKPDQHFKPYMKQHLPKRLHYA NNRRIEDLHLLVERRWHVARKPLDVYKKPSGKCFFQGDHGFDNKVNSMQTVFVGYGPTFKYRTKVPPFENIELYNVMCDL LGLKPAPNNGTHGSLNHLLRTNTFRPTLPEEVSRPNYPGIMYLQSDFDLGCTCDDKVEPKNKLEELNKRLHTKGSTEERH LLYGRPAVLYRTSYDILYHTDFESGYSEIFLMPLWTSYTISKQAEVSSIPEHLTNCVRPDVRVSPGFSQNCLAYKNDKQM SYGFLFPPYLSSSPEAKYDAFLVTNMVPMYPAFKRVWTYFQRVLVKKYASERNGVNVISGPIFDYNYNGLRDIEDEIKQY VEGSSIPVPTHYYSIITSCLDFTQPADKCDGPLSVSSFILPHRPDNDESCNSSEDESKWVEELMKMHTARVRDIEHLTGL DFYRKTSRSYSEILTLKTYLHTYESEI ; _struct_ref.pdbx_align_begin 36 _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 3WAV _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 823 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession Q9R1E6 _struct_ref_seq.db_align_beg 36 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 862 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 36 _struct_ref_seq.pdbx_auth_seq_align_end 858 # 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 3WAV ? A ? ? UNP Q9R1E6 LYS 571 'SEE REMARK 999' ? 1 1 3WAV ? A ? ? UNP Q9R1E6 VAL 572 'SEE REMARK 999' ? 2 1 3WAV ? A ? ? UNP Q9R1E6 GLU 573 'SEE REMARK 999' ? 3 1 3WAV ? A ? ? UNP Q9R1E6 PRO 574 'SEE REMARK 999' ? 4 1 3WAV SER A 824 ? UNP Q9R1E6 ? ? 'EXPRESSION TAG' 859 5 1 3WAV ARG A 825 ? UNP Q9R1E6 ? ? 'EXPRESSION TAG' 860 6 1 3WAV GLU A 826 ? UNP Q9R1E6 ? ? 'EXPRESSION TAG' 861 7 1 3WAV ASN A 827 ? UNP Q9R1E6 ? ? 'EXPRESSION TAG' 862 8 1 3WAV LEU A 828 ? UNP Q9R1E6 ? ? 'EXPRESSION TAG' 863 9 1 3WAV TYR A 829 ? UNP Q9R1E6 ? ? 'EXPRESSION TAG' 864 10 1 3WAV PHE A 830 ? UNP Q9R1E6 ? ? 'EXPRESSION TAG' 865 11 1 3WAV GLN A 831 ? UNP Q9R1E6 ? ? 'EXPRESSION TAG' 866 12 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 BMA D-saccharide . BETA-D-MANNOSE ? 'C6 H12 O6' 180.156 CA non-polymer . 'CALCIUM ION' ? 'Ca 2' 40.078 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 DWV non-polymer . '(5Z)-5-(3,4-dichlorobenzylidene)-2-(4-methylpiperazin-1-yl)-1,3-thiazol-4(5H)-one' ? 'C15 H15 Cl2 N3 O S' 356.270 EDO non-polymer . 1,2-ETHANEDIOL 'ETHYLENE GLYCOL' 'C2 H6 O2' 62.068 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 K non-polymer . 'POTASSIUM ION' ? 'K 1' 39.098 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MAN D-saccharide . ALPHA-D-MANNOSE ? 'C6 H12 O6' 180.156 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NA non-polymer . 'SODIUM ION' ? 'Na 1' 22.990 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SCN non-polymer . 'THIOCYANATE ION' ? 'C N S -1' 58.082 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 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 ZN non-polymer . 'ZINC ION' ? 'Zn 2' 65.409 # _exptl.crystals_number 1 _exptl.entry_id 3WAV _exptl.method 'X-RAY DIFFRACTION' # _exptl_crystal.id 1 _exptl_crystal.pdbx_mosaicity ? _exptl_crystal.pdbx_mosaicity_esd ? _exptl_crystal.density_Matthews 2.27 _exptl_crystal.density_diffrn ? _exptl_crystal.density_meas ? _exptl_crystal.density_meas_temp ? _exptl_crystal.density_percent_sol 45.83 _exptl_crystal.size_max ? _exptl_crystal.size_mid ? _exptl_crystal.size_min ? _exptl_crystal.size_rad ? _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, SITTING DROP' _exptl_crystal_grow.pH ? _exptl_crystal_grow.temp 293 _exptl_crystal_grow.pdbx_details '23% PEG3350, 0.15M NaCl, 0.5M KSCN, 0.2mM ZnSO4, 1% polyvinylpyrrolidone, vapor diffusion, sitting drop, temperature 293K' _exptl_crystal_grow.temp_details ? _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 ? _diffrn_detector.pdbx_collection_date 2010-04-21 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.monochromator ? _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.000 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'SPRING-8 BEAMLINE BL41XU' _diffrn_source.pdbx_wavelength_list 1.000 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_site SPring-8 _diffrn_source.pdbx_synchrotron_beamline BL41XU # _reflns.entry_id 3WAV _reflns.B_iso_Wilson_estimate 25.600 _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.d_resolution_high 1.7970 _reflns.d_resolution_low 50 _reflns.number_all ? _reflns.number_obs 77258 _reflns.percent_possible_obs ? _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI ? _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 # _refine.entry_id 3WAV _refine.ls_d_res_high 1.7970 _refine.ls_d_res_low 33.2450 _refine.pdbx_ls_sigma_F 1.430 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.ls_percent_reflns_obs 97.1300 _refine.ls_number_reflns_obs 77235 _refine.ls_number_reflns_all ? _refine.pdbx_ls_cross_valid_method ? _refine.pdbx_R_Free_selection_details ? _refine.details ? _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.1893 _refine.ls_R_factor_R_work 0.1875 _refine.ls_wR_factor_R_work ? _refine.ls_R_factor_R_free 0.2233 _refine.ls_wR_factor_R_free ? _refine.ls_percent_reflns_R_free 5.0300 _refine.ls_number_reflns_R_free 3882 _refine.ls_R_factor_R_free_error ? _refine.B_iso_mean 35.4461 _refine.solvent_model_param_bsol 44.0550 _refine.solvent_model_param_ksol 0.3490 _refine.pdbx_isotropic_thermal_model ? _refine.aniso_B[1][1] 1.6558 _refine.aniso_B[2][2] 1.4574 _refine.aniso_B[3][3] -3.1132 _refine.aniso_B[1][2] 0.0000 _refine.aniso_B[1][3] 1.2289 _refine.aniso_B[2][3] -0.0000 _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.4700 _refine.overall_SU_B ? _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.pdbx_solvent_vdw_probe_radii 1.3000 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 1.1100 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.pdbx_starting_model 3NKM _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.overall_FOM_work_R_set 0.8569 _refine.B_iso_max 87.520 _refine.B_iso_min 11.380 _refine.pdbx_overall_phase_error 22.3700 _refine.occupancy_max 1.000 _refine.occupancy_min 0.500 _refine.pdbx_ls_sigma_I ? _refine.ls_redundancy_reflns_obs ? _refine.ls_R_factor_R_free_error_details ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.overall_FOM_free_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 6426 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 238 _refine_hist.number_atoms_solvent 423 _refine_hist.number_atoms_total 7087 _refine_hist.d_res_high 1.7970 _refine_hist.d_res_low 33.2450 # loop_ _refine_ls_restr.type _refine_ls_restr.number _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function _refine_ls_restr.pdbx_refine_id f_bond_d 6887 0.014 ? ? ? 'X-RAY DIFFRACTION' f_angle_d 9283 1.129 ? ? ? 'X-RAY DIFFRACTION' f_chiral_restr 1000 0.075 ? ? ? 'X-RAY DIFFRACTION' f_plane_restr 1182 0.005 ? ? ? 'X-RAY DIFFRACTION' f_dihedral_angle_d 2578 17.967 ? ? ? 'X-RAY DIFFRACTION' # loop_ _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.percent_reflns_obs _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_all _refine_ls_shell.R_factor_R_work _refine_ls_shell.R_factor_R_free _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.number_reflns_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.pdbx_refine_id _refine_ls_shell.redundancy_reflns_obs 1.7974 1.8193 28 86.0000 2273 . 0.2706 0.3103 . 110 . 2383 . 'X-RAY DIFFRACTION' . 1.8193 1.8423 28 94.0000 2570 . 0.2640 0.3325 . 128 . 2698 . 'X-RAY DIFFRACTION' . 1.8423 1.8666 28 96.0000 2573 . 0.2559 0.3044 . 128 . 2701 . 'X-RAY DIFFRACTION' . 1.8666 1.8921 28 95.0000 2550 . 0.2499 0.2784 . 122 . 2672 . 'X-RAY DIFFRACTION' . 1.8921 1.9192 28 96.0000 2594 . 0.2301 0.2970 . 145 . 2739 . 'X-RAY DIFFRACTION' . 1.9192 1.9478 28 96.0000 2548 . 0.2231 0.2787 . 132 . 2680 . 'X-RAY DIFFRACTION' . 1.9478 1.9782 28 96.0000 2614 . 0.2187 0.2716 . 142 . 2756 . 'X-RAY DIFFRACTION' . 1.9782 2.0107 28 97.0000 2587 . 0.2016 0.2309 . 122 . 2709 . 'X-RAY DIFFRACTION' . 2.0107 2.0453 28 97.0000 2641 . 0.2025 0.2152 . 122 . 2763 . 'X-RAY DIFFRACTION' . 2.0453 2.0825 28 97.0000 2561 . 0.1949 0.2425 . 144 . 2705 . 'X-RAY DIFFRACTION' . 2.0825 2.1226 28 98.0000 2655 . 0.1868 0.2338 . 146 . 2801 . 'X-RAY DIFFRACTION' . 2.1226 2.1659 28 97.0000 2586 . 0.1882 0.2230 . 130 . 2716 . 'X-RAY DIFFRACTION' . 2.1659 2.2130 28 97.0000 2598 . 0.1956 0.2371 . 161 . 2759 . 'X-RAY DIFFRACTION' . 2.2130 2.2644 28 98.0000 2634 . 0.2008 0.2448 . 147 . 2781 . 'X-RAY DIFFRACTION' . 2.2644 2.3211 28 98.0000 2614 . 0.1888 0.2314 . 157 . 2771 . 'X-RAY DIFFRACTION' . 2.3211 2.3838 28 98.0000 2650 . 0.1896 0.2419 . 142 . 2792 . 'X-RAY DIFFRACTION' . 2.3838 2.4539 28 98.0000 2655 . 0.1907 0.2551 . 149 . 2804 . 'X-RAY DIFFRACTION' . 2.4539 2.5331 28 98.0000 2656 . 0.1869 0.2517 . 129 . 2785 . 'X-RAY DIFFRACTION' . 2.5331 2.6236 28 98.0000 2669 . 0.1880 0.2331 . 132 . 2801 . 'X-RAY DIFFRACTION' . 2.6236 2.7286 28 99.0000 2656 . 0.1837 0.2140 . 135 . 2791 . 'X-RAY DIFFRACTION' . 2.7286 2.8527 28 99.0000 2666 . 0.1929 0.2497 . 131 . 2797 . 'X-RAY DIFFRACTION' . 2.8527 3.0030 28 99.0000 2685 . 0.1963 0.2431 . 147 . 2832 . 'X-RAY DIFFRACTION' . 3.0030 3.1910 28 99.0000 2630 . 0.1927 0.2272 . 170 . 2800 . 'X-RAY DIFFRACTION' . 3.1910 3.4372 28 99.0000 2689 . 0.1887 0.2152 . 151 . 2840 . 'X-RAY DIFFRACTION' . 3.4372 3.7826 28 99.0000 2702 . 0.1767 0.2211 . 133 . 2835 . 'X-RAY DIFFRACTION' . 3.7826 4.3290 28 99.0000 2709 . 0.1625 0.1890 . 128 . 2837 . 'X-RAY DIFFRACTION' . 4.3290 5.4502 28 98.0000 2687 . 0.1569 0.2024 . 138 . 2825 . 'X-RAY DIFFRACTION' . 5.4502 33.2504 28 98.0000 2701 . 0.1854 0.1752 . 161 . 2862 . 'X-RAY DIFFRACTION' . # _struct.entry_id 3WAV _struct.title 'Crystal Structure of Autotaxin in Complex with Compound 10' _struct.pdbx_descriptor 'Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (E.C.3.1.4.39)' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3WAV _struct_keywords.text 'HYDROLASE-HYDROLASE INHIBITOR complex' _struct_keywords.pdbx_keywords 'HYDROLASE/HYDROLASE INHIBITOR' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 2 ? D N N 2 ? E N N 2 ? F N N 3 ? G N N 4 ? H N N 4 ? I N N 4 ? J N N 2 ? K N N 2 ? L N N 5 ? M N N 5 ? N N N 6 ? O N N 7 ? P N N 8 ? Q N N 9 ? R N N 9 ? S N N 10 ? T N N 10 ? U N N 10 ? V N N 10 ? W N N 10 ? X N N 10 ? Y N N 10 ? Z N N 10 ? AA N N 10 ? BA N N 10 ? CA N N 10 ? DA N N 10 ? EA N N 10 ? FA N N 10 ? GA N N 10 ? HA N N 10 ? IA N N 10 ? JA N N 10 ? KA N N 11 ? LA N N 12 ? MA N N 13 ? # _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 CYS A 44 ? SER A 48 ? CYS A 79 SER A 83 5 ? 5 HELX_P HELX_P2 2 ASP A 53 ? LEU A 59 ? ASP A 88 LEU A 94 1 ? 7 HELX_P HELX_P3 3 THR A 68 ? CYS A 72 ? THR A 103 CYS A 107 5 ? 5 HELX_P HELX_P4 4 ASP A 87 ? GLY A 92 ? ASP A 122 GLY A 127 1 ? 6 HELX_P HELX_P5 5 ASN A 97 ? LYS A 103 ? ASN A 132 LYS A 138 1 ? 7 HELX_P HELX_P6 6 HIS A 107 ? ASP A 111 ? HIS A 142 ASP A 146 5 ? 5 HELX_P HELX_P7 7 ARG A 139 ? LYS A 144 ? ARG A 174 LYS A 179 5 ? 6 HELX_P HELX_P8 8 LYS A 145 ? MET A 150 ? LYS A 180 MET A 185 1 ? 6 HELX_P HELX_P9 9 MET A 150 ? GLY A 160 ? MET A 185 GLY A 195 1 ? 11 HELX_P HELX_P10 10 LYS A 173 ? GLY A 184 ? LYS A 208 GLY A 219 1 ? 12 HELX_P HELX_P11 11 TYR A 186 ? GLY A 191 ? TYR A 221 GLY A 226 1 ? 6 HELX_P HELX_P12 12 ARG A 211 ? TRP A 219 ? ARG A 246 TRP A 254 5 ? 9 HELX_P HELX_P13 13 PRO A 223 ? GLN A 231 ? PRO A 258 GLN A 266 1 ? 9 HELX_P HELX_P14 14 PRO A 245 ? SER A 258 ? PRO A 280 SER A 293 1 ? 14 HELX_P HELX_P15 15 ASP A 276 ? GLY A 283 ? ASP A 311 GLY A 318 1 ? 8 HELX_P HELX_P16 16 GLY A 286 ? GLU A 288 ? GLY A 321 GLU A 323 5 ? 3 HELX_P HELX_P17 17 MET A 289 ? LEU A 310 ? MET A 324 LEU A 345 1 ? 22 HELX_P HELX_P18 18 SER A 338 ? TYR A 340 ? SER A 373 TYR A 375 5 ? 3 HELX_P HELX_P19 19 ASN A 343 ? ASP A 345 ? ASN A 378 ASP A 380 5 ? 3 HELX_P HELX_P20 20 ASP A 368 ? THR A 377 ? ASP A 403 THR A 412 1 ? 10 HELX_P HELX_P21 21 GLN A 391 ? LEU A 393 ? GLN A 426 LEU A 428 5 ? 3 HELX_P HELX_P22 22 PRO A 394 ? HIS A 398 ? PRO A 429 HIS A 433 5 ? 5 HELX_P HELX_P23 23 LYS A 421 ? VAL A 425 ? LYS A 456 VAL A 460 5 ? 5 HELX_P HELX_P24 24 VAL A 445 ? GLN A 449 ? VAL A 480 GLN A 484 5 ? 5 HELX_P HELX_P25 25 GLU A 472 ? LEU A 481 ? GLU A 507 LEU A 516 1 ? 10 HELX_P HELX_P26 26 LEU A 495 ? LEU A 499 ? LEU A 530 LEU A 534 5 ? 5 HELX_P HELX_P27 27 LEU A 523 ? PHE A 527 ? LEU A 558 PHE A 562 5 ? 5 HELX_P HELX_P28 28 SER A 551 ? LEU A 557 ? SER A 586 LEU A 592 1 ? 7 HELX_P HELX_P29 29 PRO A 606 ? THR A 610 ? PRO A 641 THR A 645 5 ? 5 HELX_P HELX_P30 30 SER A 620 ? SER A 624 ? SER A 655 SER A 659 5 ? 5 HELX_P HELX_P31 31 ASN A 626 ? ASP A 633 ? ASN A 661 ASP A 668 1 ? 8 HELX_P HELX_P32 32 PRO A 643 ? SER A 647 ? PRO A 678 SER A 682 5 ? 5 HELX_P HELX_P33 33 GLU A 651 ? THR A 660 ? GLU A 686 THR A 695 5 ? 10 HELX_P HELX_P34 34 TYR A 666 ? VAL A 679 ? TYR A 701 VAL A 714 1 ? 14 HELX_P HELX_P35 35 VAL A 679 ? ASN A 689 ? VAL A 714 ASN A 724 1 ? 11 HELX_P HELX_P36 36 ILE A 709 ? ILE A 713 ? ILE A 744 ILE A 748 5 ? 5 HELX_P HELX_P37 37 PRO A 741 ? CYS A 745 ? PRO A 776 CYS A 780 5 ? 5 HELX_P HELX_P38 38 ASP A 771 ? LYS A 774 ? ASP A 806 LYS A 809 5 ? 4 HELX_P HELX_P39 39 TRP A 775 ? HIS A 783 ? TRP A 810 HIS A 818 1 ? 9 HELX_P HELX_P40 40 ARG A 786 ? GLY A 795 ? ARG A 821 GLY A 830 1 ? 10 HELX_P HELX_P41 41 SER A 805 ? TYR A 815 ? SER A 840 TYR A 850 1 ? 11 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 23 SG ? ? ? 1_555 A CYS 40 SG ? ? A CYS 58 A CYS 75 1_555 ? ? ? ? ? ? ? 2.026 ? disulf2 disulf ? ? A CYS 27 SG ? ? ? 1_555 A CYS 58 SG ? ? A CYS 62 A CYS 93 1_555 ? ? ? ? ? ? ? 2.034 ? disulf3 disulf ? ? A CYS 38 SG ? ? ? 1_555 A CYS 51 SG ? ? A CYS 73 A CYS 86 1_555 ? ? ? ? ? ? ? 2.034 ? disulf4 disulf ? ? A CYS 44 SG ? ? ? 1_555 A CYS 50 SG ? ? A CYS 79 A CYS 85 1_555 ? ? ? ? ? ? ? 2.029 ? disulf5 disulf ? ? A CYS 67 SG ? ? ? 1_555 A CYS 84 SG ? ? A CYS 102 A CYS 119 1_555 ? ? ? ? ? ? ? 2.037 ? disulf6 disulf ? ? A CYS 72 SG ? ? ? 1_555 A CYS 102 SG ? ? A CYS 107 A CYS 137 1_555 ? ? ? ? ? ? ? 2.037 ? disulf7 disulf ? ? A CYS 82 SG ? ? ? 1_555 A CYS 95 SG ? ? A CYS 117 A CYS 130 1_555 ? ? ? ? ? ? ? 2.037 ? disulf8 disulf ? ? A CYS 88 SG ? ? ? 1_555 A CYS 94 SG ? ? A CYS 123 A CYS 129 1_555 ? ? ? ? ? ? ? 2.033 ? disulf9 disulf ? ? A CYS 113 SG A ? ? 1_555 A CYS 159 SG A ? A CYS 148 A CYS 194 1_555 ? ? ? ? ? ? ? 2.024 ? disulf10 disulf ? ? A CYS 113 SG B ? ? 1_555 A CYS 159 SG B ? A CYS 148 A CYS 194 1_555 ? ? ? ? ? ? ? 2.044 ? disulf11 disulf ? ? A CYS 121 SG ? ? ? 1_555 A CYS 315 SG ? ? A CYS 156 A CYS 350 1_555 ? ? ? ? ? ? ? 2.011 ? disulf12 disulf ? ? A CYS 331 SG ? ? ? 1_555 A CYS 433 SG ? ? A CYS 366 A CYS 468 1_555 ? ? ? ? ? ? ? 2.042 ? disulf13 disulf ? ? A CYS 378 SG ? ? ? 1_555 A CYS 766 SG ? ? A CYS 413 A CYS 801 1_555 ? ? ? ? ? ? ? 2.037 ? disulf14 disulf ? ? A CYS 531 SG ? ? ? 1_555 A CYS 627 SG ? ? A CYS 566 A CYS 662 1_555 ? ? ? ? ? ? ? 2.037 ? disulf15 disulf ? ? A CYS 533 SG ? ? ? 1_555 A CYS 612 SG ? ? A CYS 568 A CYS 647 1_555 ? ? ? ? ? ? ? 2.047 ? disulf16 disulf ? ? A CYS 735 SG ? ? ? 1_555 A CYS 745 SG ? ? A CYS 770 A CYS 780 1_555 ? ? ? ? ? ? ? 2.032 ? covale1 covale ? ? D NAG . O4 ? ? ? 1_555 E NAG . C1 ? ? A NAG 903 A NAG 904 1_555 ? ? ? ? ? ? ? 1.430 ? covale2 covale ? ? A ASN 375 ND2 ? ? ? 1_555 J NAG . C1 ? ? A ASN 410 A NAG 909 1_555 ? ? ? ? ? ? ? 1.434 ? covale3 covale ? ? A ASN 489 ND2 ? ? ? 1_555 D NAG . C1 ? ? A ASN 524 A NAG 903 1_555 ? ? ? ? ? ? ? 1.436 ? covale4 covale ? ? H MAN . O2 ? ? ? 1_555 I MAN . C1 ? ? A MAN 907 A MAN 908 1_555 ? ? ? ? ? ? ? 1.439 ? covale5 covale ? ? G MAN . O3 ? ? ? 1_555 H MAN . C1 ? ? A MAN 906 A MAN 907 1_555 ? ? ? ? ? ? ? 1.441 ? covale6 covale ? ? E NAG . O4 ? ? ? 1_555 F BMA . C1 ? ? A NAG 904 A BMA 905 1_555 ? ? ? ? ? ? ? 1.441 ? covale7 covale ? ? F BMA . O6 ? ? ? 1_555 G MAN . C1 ? ? A BMA 905 A MAN 906 1_555 ? ? ? ? ? ? ? 1.442 ? covale8 covale ? ? J NAG . O4 ? ? ? 1_555 K NAG . C1 ? ? A NAG 909 A NAG 910 1_555 ? ? ? ? ? ? ? 1.443 ? covale9 covale ? ? A ASN 18 ND2 ? ? ? 1_555 B NAG . C1 ? ? A ASN 53 A NAG 901 1_555 ? ? ? ? ? ? ? 1.444 ? covale10 covale ? ? B NAG . O4 ? ? ? 1_555 C NAG . C1 ? ? A NAG 901 A NAG 902 1_555 ? ? ? ? ? ? ? 1.444 ? metalc1 metalc ? ? A ASP 136 OD1 ? ? ? 1_555 L ZN . ZN ? ? A ASP 171 A ZN 911 1_555 ? ? ? ? ? ? ? 1.937 ? metalc2 metalc ? ? A HIS 439 NE2 ? ? ? 1_555 M ZN . ZN ? ? A HIS 474 A ZN 912 1_555 ? ? ? ? ? ? ? 1.946 ? metalc3 metalc ? ? A HIS 280 NE2 ? ? ? 1_555 M ZN . ZN ? ? A HIS 315 A ZN 912 1_555 ? ? ? ? ? ? ? 2.024 ? metalc4 metalc ? ? A THR 174 OG1 ? ? ? 1_555 L ZN . ZN ? ? A THR 209 A ZN 911 1_555 ? ? ? ? ? ? ? 2.076 ? metalc5 metalc ? ? A HIS 324 NE2 ? ? ? 1_555 L ZN . ZN ? ? A HIS 359 A ZN 911 1_555 ? ? ? ? ? ? ? 2.086 ? metalc6 metalc ? ? A ASP 276 OD1 ? ? ? 1_555 M ZN . ZN ? ? A ASP 311 A ZN 912 1_555 ? ? ? ? ? ? ? 2.098 ? metalc7 metalc ? ? A LEU 706 O ? ? ? 1_555 N CA . CA ? ? A LEU 741 A CA 913 1_555 ? ? ? ? ? ? ? 2.320 ? metalc8 metalc ? ? A SER 768 OG ? ? ? 1_555 O NA . NA ? ? A SER 803 A NA 914 1_555 ? ? ? ? ? ? ? 2.328 ? metalc9 metalc ? ? A ASN 702 OD1 ? ? ? 1_555 N CA . CA ? ? A ASN 737 A CA 913 1_555 ? ? ? ? ? ? ? 2.337 ? metalc10 metalc ? ? A ASP 708 OD1 ? ? ? 1_555 N CA . CA ? ? A ASP 743 A CA 913 1_555 ? ? ? ? ? ? ? 2.361 ? metalc11 metalc ? ? A ASP 323 OD2 ? ? ? 1_555 L ZN . ZN ? ? A ASP 358 A ZN 911 1_555 ? ? ? ? ? ? ? 2.381 ? metalc12 metalc ? ? A ASP 700 OD1 ? ? ? 1_555 N CA . CA ? ? A ASP 735 A CA 913 1_555 ? ? ? ? ? ? ? 2.382 ? metalc13 metalc ? ? N CA . CA ? ? ? 1_555 MA HOH . O ? ? A CA 913 A HOH 1045 1_555 ? ? ? ? ? ? ? 2.401 ? metalc14 metalc ? ? A ASN 704 OD1 ? ? ? 1_555 N CA . CA ? ? A ASN 739 A CA 913 1_555 ? ? ? ? ? ? ? 2.441 ? metalc15 metalc ? ? M ZN . ZN ? ? ? 1_555 KA SO4 . O1 ? ? A ZN 912 A SO4 936 1_555 ? ? ? ? ? ? ? 2.467 ? metalc16 metalc ? ? O NA . NA ? ? ? 1_555 MA HOH . O ? ? A NA 914 A HOH 1419 1_555 ? ? ? ? ? ? ? 2.498 ? metalc17 metalc ? ? M ZN . ZN ? ? ? 1_555 KA SO4 . O3 ? ? A ZN 912 A SO4 936 1_555 ? ? ? ? ? ? ? 2.549 ? metalc18 metalc ? ? O NA . NA ? ? ? 1_555 MA HOH . O ? ? A NA 914 A HOH 1418 1_555 ? ? ? ? ? ? ? 2.608 ? metalc19 metalc ? ? A TYR 630 O ? ? ? 1_555 P K . K ? ? A TYR 665 A K 915 1_555 ? ? ? ? ? ? ? 2.659 ? metalc20 metalc ? ? A ASP 276 OD2 ? ? ? 1_555 M ZN . ZN ? ? A ASP 311 A ZN 912 1_555 ? ? ? ? ? ? ? 2.663 ? metalc21 metalc ? ? A ASP 633 O ? ? ? 1_555 P K . K ? ? A ASP 668 A K 915 1_555 ? ? ? ? ? ? ? 2.670 ? metalc22 metalc ? ? A ASN 762 O ? ? ? 1_555 O NA . NA ? ? A ASN 797 A NA 914 1_555 ? ? ? ? ? ? ? 2.671 ? metalc23 metalc ? ? A MET 636 O ? ? ? 1_555 P K . K ? ? A MET 671 A K 915 1_555 ? ? ? ? ? ? ? 2.734 ? metalc24 metalc ? ? O NA . NA ? ? ? 1_555 MA HOH . O ? ? A NA 914 A HOH 1417 1_555 ? ? ? ? ? ? ? 2.780 ? metalc25 metalc ? ? A SER 765 O ? ? ? 1_555 O NA . NA ? ? A SER 800 A NA 914 1_555 ? ? ? ? ? ? ? 2.830 ? metalc26 metalc ? ? P K . K ? ? ? 1_555 MA HOH . O ? ? A K 915 A HOH 1420 1_555 ? ? ? ? ? ? ? 2.996 ? metalc27 metalc ? ? P K . K ? ? ? 1_555 MA HOH . O ? ? A K 915 A HOH 1415 1_555 ? ? ? ? ? ? ? 3.304 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 PRO 35 A . ? PRO 70 A PRO 36 A ? PRO 71 A 1 3.66 2 TYR 170 A . ? TYR 205 A PRO 171 A ? PRO 206 A 1 -4.56 3 GLN 274 A . ? GLN 309 A PRO 275 A ? PRO 310 A 1 7.92 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 6 ? B ? 2 ? C ? 2 ? D ? 2 ? E ? 2 ? F ? 4 ? G ? 2 ? H ? 7 ? I ? 2 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? parallel A 2 3 ? parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel A 5 6 ? parallel B 1 2 ? parallel C 1 2 ? anti-parallel D 1 2 ? anti-parallel E 1 2 ? parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel G 1 2 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel H 4 5 ? anti-parallel H 5 6 ? anti-parallel H 6 7 ? anti-parallel I 1 2 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 VAL A 267 ? PRO A 275 ? VAL A 302 PRO A 310 A 2 LEU A 130 ? ASP A 136 ? LEU A 165 ASP A 171 A 3 ASN A 317 ? GLY A 322 ? ASN A 352 GLY A 357 A 4 PHE A 452 ? TYR A 455 ? PHE A 487 TYR A 490 A 5 THR A 161 ? HIS A 162 ? THR A 196 HIS A 197 A 6 THR A 463 ? LYS A 464 ? THR A 498 LYS A 499 B 1 MET A 166 ? ARG A 167 ? MET A 201 ARG A 202 B 2 PHE A 468 ? GLU A 469 ? PHE A 503 GLU A 504 C 1 MET A 197 ? ASP A 199 ? MET A 232 ASP A 234 C 2 ALA A 204 ? PHE A 206 ? ALA A 239 PHE A 241 D 1 GLU A 327 ? ASP A 328 ? GLU A 362 ASP A 363 D 2 GLY A 437 ? ASP A 438 ? GLY A 472 ASP A 473 E 1 THR A 334 ? PHE A 336 ? THR A 369 PHE A 371 E 2 HIS A 417 ? ALA A 419 ? HIS A 452 ALA A 454 F 1 ILE A 347 ? VAL A 350 ? ILE A 382 VAL A 385 F 2 LEU A 354 ? PRO A 359 ? LEU A 389 PRO A 394 F 3 LEU A 408 ? VAL A 412 ? LEU A 443 VAL A 447 F 4 PHE A 385 ? MET A 389 ? PHE A 420 MET A 424 G 1 ALA A 563 ? VAL A 564 ? ALA A 598 VAL A 599 G 2 LEU A 796 ? ASP A 797 ? LEU A 831 ASP A 832 H 1 TYR A 570 ? TYR A 574 ? TYR A 605 TYR A 609 H 2 GLU A 579 ? SER A 583 ? GLU A 614 SER A 618 H 3 MET A 588 ? ILE A 596 ? MET A 623 ILE A 631 H 4 VAL A 691 ? ILE A 698 ? VAL A 726 ILE A 733 H 5 HIS A 727 ? CYS A 735 ? HIS A 762 CYS A 770 H 6 LEU A 749 ? PRO A 757 ? LEU A 784 PRO A 792 H 7 THR A 784 ? ALA A 785 ? THR A 819 ALA A 820 I 1 SER A 637 ? PHE A 640 ? SER A 672 PHE A 675 I 2 MET A 662 ? MET A 665 ? MET A 697 MET A 700 # 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 PHE A 270 ? O PHE A 305 N ILE A 132 ? N ILE A 167 A 2 3 N PHE A 133 ? N PHE A 168 O ILE A 319 ? O ILE A 354 A 3 4 N VAL A 318 ? N VAL A 353 O TYR A 455 ? O TYR A 490 A 4 5 O GLY A 454 ? O GLY A 489 N THR A 161 ? N THR A 196 A 5 6 N HIS A 162 ? N HIS A 197 O THR A 463 ? O THR A 498 B 1 2 N ARG A 167 ? N ARG A 202 O PHE A 468 ? O PHE A 503 C 1 2 N MET A 197 ? N MET A 232 O PHE A 206 ? O PHE A 241 D 1 2 N GLU A 327 ? N GLU A 362 O ASP A 438 ? O ASP A 473 E 1 2 N GLU A 335 ? N GLU A 370 O HIS A 417 ? O HIS A 452 F 1 2 N VAL A 350 ? N VAL A 385 O ARG A 356 ? O ARG A 391 F 2 3 N GLY A 355 ? N GLY A 390 O LEU A 410 ? O LEU A 445 F 3 4 O HIS A 409 ? O HIS A 444 N TYR A 388 ? N TYR A 423 G 1 2 N ALA A 563 ? N ALA A 598 O ASP A 797 ? O ASP A 832 H 1 2 N ASP A 571 ? N ASP A 606 O TYR A 582 ? O TYR A 617 H 2 3 N GLU A 579 ? N GLU A 614 O SER A 593 ? O SER A 628 H 3 4 N TYR A 594 ? N TYR A 629 O VAL A 693 ? O VAL A 728 H 4 5 N ASN A 692 ? N ASN A 727 O THR A 733 ? O THR A 768 H 5 6 N ILE A 732 ? N ILE A 767 O SER A 752 ? O SER A 787 H 6 7 N SER A 753 ? N SER A 788 O ALA A 785 ? O ALA A 820 I 1 2 N GLY A 639 ? N GLY A 674 O VAL A 663 ? O VAL A 698 # 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 ? ? ? ? 5 'BINDING SITE FOR RESIDUE ZN A 911' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE ZN A 912' AC3 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE CA A 913' AC4 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE NA A 914' AC5 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE K A 915' AC6 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE SCN A 916' AC7 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE SCN A 917' AC8 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE EDO A 918' AC9 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE EDO A 919' BC1 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE EDO A 920' BC2 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE EDO A 921' BC3 Software ? ? ? ? 2 'BINDING SITE FOR RESIDUE EDO A 922' BC4 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE EDO A 923' BC5 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE EDO A 924' BC6 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE EDO A 925' BC7 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE EDO A 926' BC8 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE EDO A 927' BC9 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE EDO A 928' CC1 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE EDO A 929' CC2 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE EDO A 930' CC3 Software ? ? ? ? 7 'BINDING SITE FOR RESIDUE EDO A 931' CC4 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE EDO A 932' CC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE EDO A 933' CC6 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE EDO A 934' CC7 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE EDO A 935' CC8 Software ? ? ? ? 9 'BINDING SITE FOR RESIDUE SO4 A 936' CC9 Software ? ? ? ? 8 'BINDING SITE FOR RESIDUE DWV A 937' DC1 Software ? ? ? ? 2 'BINDING SITE FOR CHAIN A OF SUGAR BOUND TO ASN A 53 RESIDUES 901 TO 902' DC2 Software ? ? ? ? 6 'BINDING SITE FOR CHAIN A OF SUGAR BOUND TO ASN A 410 RESIDUES 909 TO 910' DC3 Software ? ? ? ? 24 'BINDING SITE FOR CHAIN A OF SUGAR BOUND TO ASN A 524 RESIDUES 903 TO 908' # 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 5 ASP A 136 ? ASP A 171 . ? 1_555 ? 2 AC1 5 THR A 174 ? THR A 209 . ? 1_555 ? 3 AC1 5 ASP A 323 ? ASP A 358 . ? 1_555 ? 4 AC1 5 HIS A 324 ? HIS A 359 . ? 1_555 ? 5 AC1 5 SO4 KA . ? SO4 A 936 . ? 1_555 ? 6 AC2 4 ASP A 276 ? ASP A 311 . ? 1_555 ? 7 AC2 4 HIS A 280 ? HIS A 315 . ? 1_555 ? 8 AC2 4 HIS A 439 ? HIS A 474 . ? 1_555 ? 9 AC2 4 SO4 KA . ? SO4 A 936 . ? 1_555 ? 10 AC3 6 ASP A 700 ? ASP A 735 . ? 1_555 ? 11 AC3 6 ASN A 702 ? ASN A 737 . ? 1_555 ? 12 AC3 6 ASN A 704 ? ASN A 739 . ? 1_555 ? 13 AC3 6 LEU A 706 ? LEU A 741 . ? 1_555 ? 14 AC3 6 ASP A 708 ? ASP A 743 . ? 1_555 ? 15 AC3 6 HOH MA . ? HOH A 1045 . ? 1_555 ? 16 AC4 6 ASN A 762 ? ASN A 797 . ? 1_555 ? 17 AC4 6 SER A 765 ? SER A 800 . ? 1_555 ? 18 AC4 6 SER A 768 ? SER A 803 . ? 1_555 ? 19 AC4 6 HOH MA . ? HOH A 1417 . ? 1_555 ? 20 AC4 6 HOH MA . ? HOH A 1418 . ? 1_555 ? 21 AC4 6 HOH MA . ? HOH A 1419 . ? 1_555 ? 22 AC5 4 TYR A 630 ? TYR A 665 . ? 1_555 ? 23 AC5 4 ASP A 633 ? ASP A 668 . ? 1_555 ? 24 AC5 4 MET A 636 ? MET A 671 . ? 1_555 ? 25 AC5 4 HOH MA . ? HOH A 1420 . ? 1_555 ? 26 AC6 2 MET A 197 ? MET A 232 . ? 1_555 ? 27 AC6 2 ARG A 358 ? ARG A 393 . ? 1_555 ? 28 AC7 4 GLY A 194 ? GLY A 229 . ? 1_555 ? 29 AC7 4 ASN A 195 ? ASN A 230 . ? 1_555 ? 30 AC7 4 ARG A 356 ? ARG A 391 . ? 1_555 ? 31 AC7 4 HOH MA . ? HOH A 1237 . ? 1_555 ? 32 AC8 5 ARG A 788 ? ARG A 823 . ? 1_555 ? 33 AC8 5 GLU A 791 ? GLU A 826 . ? 1_555 ? 34 AC8 5 ASP A 797 ? ASP A 832 . ? 1_555 ? 35 AC8 5 TYR A 806 ? TYR A 841 . ? 1_555 ? 36 AC8 5 LYS A 813 ? LYS A 848 . ? 1_555 ? 37 AC9 8 ILE A 116 ? ILE A 151 . ? 1_555 ? 38 AC9 8 CYS A 159 ? CYS A 194 . ? 1_555 ? 39 AC9 8 TYR A 455 ? TYR A 490 . ? 1_555 ? 40 AC9 8 GLY A 456 ? GLY A 491 . ? 1_555 ? 41 AC9 8 PHE A 459 ? PHE A 494 . ? 1_555 ? 42 AC9 8 LYS A 460 ? LYS A 495 . ? 1_555 ? 43 AC9 8 TYR A 461 ? TYR A 496 . ? 1_555 ? 44 AC9 8 HOH MA . ? HOH A 1022 . ? 1_555 ? 45 BC1 6 PHE A 640 ? PHE A 675 . ? 1_555 ? 46 BC1 6 PRO A 644 ? PRO A 679 . ? 1_555 ? 47 BC1 6 TYR A 645 ? TYR A 680 . ? 1_555 ? 48 BC1 6 TRP A 673 ? TRP A 708 . ? 1_555 ? 49 BC1 6 GLN A 677 ? GLN A 712 . ? 1_555 ? 50 BC1 6 HOH MA . ? HOH A 1088 . ? 1_555 ? 51 BC2 7 TYR A 566 ? TYR A 601 . ? 1_555 ? 52 BC2 7 PHE A 586 ? PHE A 621 . ? 1_555 ? 53 BC2 7 PHE A 699 ? PHE A 734 . ? 1_555 ? 54 BC2 7 ARG A 707 ? ARG A 742 . ? 1_555 ? 55 BC2 7 ASP A 708 ? ASP A 743 . ? 1_555 ? 56 BC2 7 HOH MA . ? HOH A 1004 . ? 1_555 ? 57 BC2 7 HOH MA . ? HOH A 1071 . ? 1_555 ? 58 BC3 2 HIS A 162 ? HIS A 197 . ? 1_555 ? 59 BC3 2 LYS A 464 ? LYS A 499 . ? 1_555 ? 60 BC4 6 TYR A 666 ? TYR A 701 . ? 1_555 ? 61 BC4 6 TYR A 701 ? TYR A 736 . ? 1_555 ? 62 BC4 6 GLN A 715 ? GLN A 750 . ? 1_555 ? 63 BC4 6 VAL A 724 ? VAL A 759 . ? 1_555 ? 64 BC4 6 PRO A 725 ? PRO A 760 . ? 1_555 ? 65 BC4 6 HIS A 758 ? HIS A 793 . ? 1_555 ? 66 BC5 4 LEU A 411 ? LEU A 446 . ? 1_555 ? 67 BC5 4 GLU A 413 ? GLU A 448 . ? 1_555 ? 68 BC5 4 HOH MA . ? HOH A 1037 . ? 1_555 ? 69 BC5 4 HOH MA . ? HOH A 1282 . ? 1_555 ? 70 BC6 6 ILE A 357 ? ILE A 392 . ? 1_555 ? 71 BC6 6 ARG A 358 ? ARG A 393 . ? 1_555 ? 72 BC6 6 TYR A 367 ? TYR A 402 . ? 1_555 ? 73 BC6 6 GLU A 406 ? GLU A 441 . ? 1_555 ? 74 BC6 6 ASP A 407 ? ASP A 442 . ? 1_555 ? 75 BC6 6 LEU A 408 ? LEU A 443 . ? 1_555 ? 76 BC7 6 ILE A 585 ? ILE A 620 . ? 1_555 ? 77 BC7 6 PHE A 586 ? PHE A 621 . ? 1_555 ? 78 BC7 6 GLU A 710 ? GLU A 745 . ? 1_555 ? 79 BC7 6 TYR A 716 ? TYR A 751 . ? 1_555 ? 80 BC7 6 SER A 721 ? SER A 756 . ? 1_555 ? 81 BC7 6 PRO A 723 ? PRO A 758 . ? 1_555 ? 82 BC8 4 SER A 750 ? SER A 785 . ? 1_555 ? 83 BC8 4 VAL A 751 ? VAL A 786 . ? 1_555 ? 84 BC8 4 TYR A 815 ? TYR A 850 . ? 1_555 ? 85 BC8 4 EDO HA . ? EDO A 933 . ? 1_555 ? 86 BC9 4 LEU A 565 ? LEU A 600 . ? 1_555 ? 87 BC9 4 ARG A 707 ? ARG A 742 . ? 1_555 ? 88 BC9 4 GLY A 795 ? GLY A 830 . ? 1_555 ? 89 BC9 4 HOH MA . ? HOH A 1014 . ? 1_555 ? 90 CC1 5 GLY A 232 ? GLY A 267 . ? 1_655 ? 91 CC1 5 ASN A 339 ? ASN A 374 . ? 1_555 ? 92 CC1 5 LYS A 379 ? LYS A 414 . ? 1_555 ? 93 CC1 5 LYS A 380 ? LYS A 415 . ? 1_555 ? 94 CC1 5 HOH MA . ? HOH A 1310 . ? 1_555 ? 95 CC2 6 PHE A 669 ? PHE A 704 . ? 1_555 ? 96 CC2 6 PRO A 757 ? PRO A 792 . ? 1_555 ? 97 CC2 6 ARG A 759 ? ARG A 794 . ? 1_555 ? 98 CC2 6 ASP A 761 ? ASP A 796 . ? 1_555 ? 99 CC2 6 ASN A 762 ? ASN A 797 . ? 1_555 ? 100 CC2 6 HOH MA . ? HOH A 1034 . ? 1_555 ? 101 CC3 7 GLU A 764 ? GLU A 799 . ? 1_555 ? 102 CC3 7 SER A 765 ? SER A 800 . ? 1_555 ? 103 CC3 7 GLU A 778 ? GLU A 813 . ? 1_555 ? 104 CC3 7 HOH MA . ? HOH A 1015 . ? 1_555 ? 105 CC3 7 HOH MA . ? HOH A 1037 . ? 1_555 ? 106 CC3 7 HOH MA . ? HOH A 1116 . ? 1_555 ? 107 CC3 7 HOH MA . ? HOH A 1334 . ? 1_555 ? 108 CC4 8 GLY A 191 ? GLY A 226 . ? 1_555 ? 109 CC4 8 ASN A 402 ? ASN A 437 . ? 1_555 ? 110 CC4 8 ARG A 403 ? ARG A 438 . ? 1_555 ? 111 CC4 8 ARG A 404 ? ARG A 439 . ? 1_555 ? 112 CC4 8 MAN H . ? MAN A 907 . ? 1_555 ? 113 CC4 8 MAN I . ? MAN A 908 . ? 1_555 ? 114 CC4 8 HOH MA . ? HOH A 1069 . ? 1_555 ? 115 CC4 8 HOH MA . ? HOH A 1197 . ? 1_555 ? 116 CC5 5 ARG A 688 ? ARG A 723 . ? 1_555 ? 117 CC5 5 SER A 750 ? SER A 785 . ? 1_555 ? 118 CC5 5 VAL A 751 ? VAL A 786 . ? 1_555 ? 119 CC5 5 HIS A 817 ? HIS A 852 . ? 1_555 ? 120 CC5 5 EDO BA . ? EDO A 927 . ? 1_555 ? 121 CC6 5 HIS A 392 ? HIS A 427 . ? 1_555 ? 122 CC6 5 THR A 726 ? THR A 761 . ? 1_555 ? 123 CC6 5 HIS A 727 ? HIS A 762 . ? 1_555 ? 124 CC6 5 HIS A 758 ? HIS A 793 . ? 1_555 ? 125 CC6 5 HOH MA . ? HOH A 1172 . ? 1_555 ? 126 CC7 3 LYS A 460 ? LYS A 495 . ? 1_555 ? 127 CC7 3 TYR A 461 ? TYR A 496 . ? 1_555 ? 128 CC7 3 ARG A 500 ? ARG A 535 . ? 1_555 ? 129 CC8 9 THR A 174 ? THR A 209 . ? 1_555 ? 130 CC8 9 ASN A 195 ? ASN A 230 . ? 1_555 ? 131 CC8 9 ASP A 276 ? ASP A 311 . ? 1_555 ? 132 CC8 9 HIS A 280 ? HIS A 315 . ? 1_555 ? 133 CC8 9 HIS A 439 ? HIS A 474 . ? 1_555 ? 134 CC8 9 LEU A 542 ? LEU A 577 . ? 1_556 ? 135 CC8 9 LYS A 544 ? LYS A 579 . ? 1_556 ? 136 CC8 9 ZN L . ? ZN A 911 . ? 1_555 ? 137 CC8 9 ZN M . ? ZN A 912 . ? 1_555 ? 138 CC9 8 SER A 134 ? SER A 169 . ? 1_555 ? 139 CC9 8 LEU A 178 ? LEU A 213 . ? 1_555 ? 140 CC9 8 LEU A 208 ? LEU A 243 . ? 1_555 ? 141 CC9 8 PHE A 238 ? PHE A 273 . ? 1_555 ? 142 CC9 8 PHE A 239 ? PHE A 274 . ? 1_555 ? 143 CC9 8 TRP A 240 ? TRP A 275 . ? 1_555 ? 144 CC9 8 TYR A 271 ? TYR A 306 . ? 1_555 ? 145 CC9 8 LYS A 544 ? LYS A 579 . ? 1_556 ? 146 DC1 2 ASN A 18 ? ASN A 53 . ? 1_555 ? 147 DC1 2 SER A 20 ? SER A 55 . ? 1_555 ? 148 DC2 6 LEU A 341 ? LEU A 376 . ? 1_555 ? 149 DC2 6 THR A 342 ? THR A 377 . ? 1_555 ? 150 DC2 6 ASN A 375 ? ASN A 410 . ? 1_555 ? 151 DC2 6 HOH MA . ? HOH A 1214 . ? 1_555 ? 152 DC2 6 HOH MA . ? HOH A 1320 . ? 1_555 ? 153 DC2 6 HOH MA . ? HOH A 1405 . ? 1_555 ? 154 DC3 24 LEU A 185 ? LEU A 220 . ? 1_555 ? 155 DC3 24 GLU A 188 ? GLU A 223 . ? 1_555 ? 156 DC3 24 SER A 189 ? SER A 224 . ? 1_555 ? 157 DC3 24 GLY A 220 ? GLY A 255 . ? 1_555 ? 158 DC3 24 ASN A 401 ? ASN A 436 . ? 1_555 ? 159 DC3 24 ASN A 402 ? ASN A 437 . ? 1_555 ? 160 DC3 24 PRO A 487 ? PRO A 522 . ? 1_555 ? 161 DC3 24 ASN A 489 ? ASN A 524 . ? 1_555 ? 162 DC3 24 LEU A 706 ? LEU A 741 . ? 1_555 ? 163 DC3 24 HIS A 792 ? HIS A 827 . ? 1_555 ? 164 DC3 24 EDO GA . ? EDO A 932 . ? 1_555 ? 165 DC3 24 HOH MA . ? HOH A 1016 . ? 1_555 ? 166 DC3 24 HOH MA . ? HOH A 1030 . ? 1_555 ? 167 DC3 24 HOH MA . ? HOH A 1040 . ? 1_555 ? 168 DC3 24 HOH MA . ? HOH A 1058 . ? 1_555 ? 169 DC3 24 HOH MA . ? HOH A 1069 . ? 1_555 ? 170 DC3 24 HOH MA . ? HOH A 1090 . ? 1_555 ? 171 DC3 24 HOH MA . ? HOH A 1165 . ? 1_555 ? 172 DC3 24 HOH MA . ? HOH A 1179 . ? 1_555 ? 173 DC3 24 HOH MA . ? HOH A 1197 . ? 1_555 ? 174 DC3 24 HOH MA . ? HOH A 1297 . ? 1_555 ? 175 DC3 24 HOH MA . ? HOH A 1302 . ? 1_555 ? 176 DC3 24 HOH MA . ? HOH A 1327 . ? 1_555 ? 177 DC3 24 HOH MA . ? HOH A 1340 . ? 1_555 ? # _atom_sites.entry_id 3WAV _atom_sites.fract_transf_matrix[1][1] 0.016259 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.001284 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.010637 _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] 0.013296 _atom_sites.fract_transf_vector[1] 0.000000 _atom_sites.fract_transf_vector[2] 0.000000 _atom_sites.fract_transf_vector[3] 0.000000 # loop_ _atom_type.symbol C CA CL K N NA O S ZN # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . TRP A 1 16 ? 4.230 57.982 27.571 1.00 77.33 ? 51 TRP A N 1 ATOM 2 C CA . TRP A 1 16 ? 4.138 57.333 28.877 1.00 76.98 ? 51 TRP A CA 1 ATOM 3 C C . TRP A 1 16 ? 3.118 56.195 28.874 1.00 71.69 ? 51 TRP A C 1 ATOM 4 O O . TRP A 1 16 ? 2.074 56.290 28.232 1.00 73.47 ? 51 TRP A O 1 ATOM 5 C CB . TRP A 1 16 ? 3.773 58.353 29.957 1.00 71.34 ? 51 TRP A CB 1 ATOM 6 C CG . TRP A 1 16 ? 3.729 57.767 31.341 1.00 73.38 ? 51 TRP A CG 1 ATOM 7 C CD1 . TRP A 1 16 ? 4.797 57.396 32.108 1.00 75.07 ? 51 TRP A CD1 1 ATOM 8 C CD2 . TRP A 1 16 ? 2.560 57.492 32.123 1.00 66.35 ? 51 TRP A CD2 1 ATOM 9 N NE1 . TRP A 1 16 ? 4.365 56.902 33.316 1.00 72.70 ? 51 TRP A NE1 1 ATOM 10 C CE2 . TRP A 1 16 ? 2.997 56.951 33.351 1.00 69.34 ? 51 TRP A CE2 1 ATOM 11 C CE3 . TRP A 1 16 ? 1.188 57.648 31.904 1.00 70.13 ? 51 TRP A CE3 1 ATOM 12 C CZ2 . TRP A 1 16 ? 2.111 56.567 34.355 1.00 68.38 ? 51 TRP A CZ2 1 ATOM 13 C CZ3 . TRP A 1 16 ? 0.308 57.264 32.903 1.00 68.53 ? 51 TRP A CZ3 1 ATOM 14 C CH2 . TRP A 1 16 ? 0.774 56.731 34.113 1.00 70.84 ? 51 TRP A CH2 1 ATOM 15 N N . THR A 1 17 ? 3.424 55.122 29.597 1.00 71.08 ? 52 THR A N 1 ATOM 16 C CA . THR A 1 17 ? 2.521 53.976 29.687 1.00 69.88 ? 52 THR A CA 1 ATOM 17 C C . THR A 1 17 ? 2.009 53.756 31.113 1.00 70.38 ? 52 THR A C 1 ATOM 18 O O . THR A 1 17 ? 2.792 53.658 32.065 1.00 64.85 ? 52 THR A O 1 ATOM 19 C CB . THR A 1 17 ? 3.187 52.683 29.156 1.00 67.45 ? 52 THR A CB 1 ATOM 20 O OG1 . THR A 1 17 ? 3.370 52.787 27.738 1.00 71.78 ? 52 THR A OG1 1 ATOM 21 C CG2 . THR A 1 17 ? 2.321 51.464 29.458 1.00 59.67 ? 52 THR A CG2 1 ATOM 22 N N . ASN A 1 18 ? 0.687 53.687 31.249 1.00 67.77 ? 53 ASN A N 1 ATOM 23 C CA . ASN A 1 18 ? 0.051 53.445 32.538 1.00 67.60 ? 53 ASN A CA 1 ATOM 24 C C . ASN A 1 18 ? 0.102 51.961 32.898 1.00 64.94 ? 53 ASN A C 1 ATOM 25 O O . ASN A 1 18 ? -0.796 51.195 32.552 1.00 63.04 ? 53 ASN A O 1 ATOM 26 C CB . ASN A 1 18 ? -1.394 53.961 32.517 1.00 66.66 ? 53 ASN A CB 1 ATOM 27 C CG . ASN A 1 18 ? -2.101 53.806 33.856 1.00 67.00 ? 53 ASN A CG 1 ATOM 28 O OD1 . ASN A 1 18 ? -1.510 53.366 34.846 1.00 63.97 ? 53 ASN A OD1 1 ATOM 29 N ND2 . ASN A 1 18 ? -3.382 54.177 33.890 1.00 69.38 ? 53 ASN A ND2 1 ATOM 30 N N . THR A 1 19 ? 1.156 51.576 33.608 1.00 57.79 ? 54 THR A N 1 ATOM 31 C CA . THR A 1 19 ? 1.429 50.181 33.941 1.00 62.03 ? 54 THR A CA 1 ATOM 32 C C . THR A 1 19 ? 0.402 49.555 34.895 1.00 59.23 ? 54 THR A C 1 ATOM 33 O O . THR A 1 19 ? 0.310 48.332 35.011 1.00 57.77 ? 54 THR A O 1 ATOM 34 C CB . THR A 1 19 ? 2.837 50.056 34.563 1.00 62.65 ? 54 THR A CB 1 ATOM 35 O OG1 . THR A 1 19 ? 3.766 50.824 33.789 1.00 73.85 ? 54 THR A OG1 1 ATOM 36 C CG2 . THR A 1 19 ? 3.301 48.610 34.607 1.00 63.75 ? 54 THR A CG2 1 ATOM 37 N N . SER A 1 20 ? -0.378 50.388 35.574 1.00 63.13 ? 55 SER A N 1 ATOM 38 C CA . SER A 1 20 ? -1.297 49.884 36.595 1.00 62.28 ? 55 SER A CA 1 ATOM 39 C C . SER A 1 20 ? -2.504 49.148 36.019 1.00 57.68 ? 55 SER A C 1 ATOM 40 O O . SER A 1 20 ? -3.331 48.626 36.762 1.00 51.39 ? 55 SER A O 1 ATOM 41 C CB . SER A 1 20 ? -1.745 51.009 37.531 1.00 65.12 ? 55 SER A CB 1 ATOM 42 O OG . SER A 1 20 ? -0.659 51.455 38.326 1.00 67.42 ? 55 SER A OG 1 ATOM 43 N N . GLY A 1 21 ? -2.597 49.103 34.693 1.00 60.10 ? 56 GLY A N 1 ATOM 44 C CA . GLY A 1 21 ? -3.622 48.317 34.033 1.00 51.63 ? 56 GLY A CA 1 ATOM 45 C C . GLY A 1 21 ? -3.391 46.834 34.255 1.00 49.62 ? 56 GLY A C 1 ATOM 46 O O . GLY A 1 21 ? -2.413 46.439 34.900 1.00 52.32 ? 56 GLY A O 1 ATOM 47 N N . SER A 1 22 ? -4.287 46.006 33.725 1.00 40.58 ? 57 SER A N 1 ATOM 48 C CA . SER A 1 22 ? -4.167 44.564 33.908 1.00 51.86 ? 57 SER A CA 1 ATOM 49 C C . SER A 1 22 ? -4.226 43.778 32.598 1.00 45.28 ? 57 SER A C 1 ATOM 50 O O . SER A 1 22 ? -4.908 44.177 31.650 1.00 46.67 ? 57 SER A O 1 ATOM 51 C CB . SER A 1 22 ? -5.246 44.042 34.855 1.00 49.41 ? 57 SER A CB 1 ATOM 52 O OG . SER A 1 22 ? -5.122 42.638 35.014 1.00 46.37 ? 57 SER A OG 1 ATOM 53 N N . CYS A 1 23 ? -3.518 42.652 32.578 1.00 45.08 ? 58 CYS A N 1 ATOM 54 C CA . CYS A 1 23 ? -3.492 41.760 31.424 1.00 49.17 ? 58 CYS A CA 1 ATOM 55 C C . CYS A 1 23 ? -4.509 40.631 31.535 1.00 50.00 ? 58 CYS A C 1 ATOM 56 O O . CYS A 1 23 ? -4.477 39.692 30.746 1.00 51.41 ? 58 CYS A O 1 ATOM 57 C CB . CYS A 1 23 ? -2.091 41.163 31.239 1.00 45.38 ? 58 CYS A CB 1 ATOM 58 S SG . CYS A 1 23 ? -0.902 42.300 30.508 1.00 46.05 ? 58 CYS A SG 1 ATOM 59 N N . LYS A 1 24 ? -5.403 40.708 32.517 1.00 52.84 ? 59 LYS A N 1 ATOM 60 C CA . LYS A 1 24 ? -6.431 39.682 32.669 1.00 47.65 ? 59 LYS A CA 1 ATOM 61 C C . LYS A 1 24 ? -7.272 39.593 31.403 1.00 44.56 ? 59 LYS A C 1 ATOM 62 O O . LYS A 1 24 ? -7.819 40.591 30.941 1.00 47.42 ? 59 LYS A O 1 ATOM 63 C CB . LYS A 1 24 ? -7.321 39.969 33.884 1.00 50.77 ? 59 LYS A CB 1 ATOM 64 N N . GLY A 1 25 ? -7.349 38.396 30.832 1.00 50.49 ? 60 GLY A N 1 ATOM 65 C CA . GLY A 1 25 ? -8.087 38.188 29.599 1.00 49.54 ? 60 GLY A CA 1 ATOM 66 C C . GLY A 1 25 ? -7.469 38.898 28.409 1.00 48.78 ? 60 GLY A C 1 ATOM 67 O O . GLY A 1 25 ? -8.149 39.202 27.426 1.00 46.43 ? 60 GLY A O 1 ATOM 68 N N . ARG A 1 26 ? -6.172 39.166 28.496 1.00 47.81 ? 61 ARG A N 1 ATOM 69 C CA . ARG A 1 26 ? -5.485 39.902 27.448 1.00 49.65 ? 61 ARG A CA 1 ATOM 70 C C . ARG A 1 26 ? -4.096 39.348 27.128 1.00 47.31 ? 61 ARG A C 1 ATOM 71 O O . ARG A 1 26 ? -3.386 39.919 26.309 1.00 43.16 ? 61 ARG A O 1 ATOM 72 C CB . ARG A 1 26 ? -5.357 41.377 27.830 1.00 51.67 ? 61 ARG A CB 1 ATOM 73 C CG . ARG A 1 26 ? -6.628 42.189 27.685 1.00 54.20 ? 61 ARG A CG 1 ATOM 74 C CD . ARG A 1 26 ? -6.283 43.627 27.329 1.00 53.77 ? 61 ARG A CD 1 ATOM 75 N NE . ARG A 1 26 ? -5.358 44.215 28.289 1.00 49.16 ? 61 ARG A NE 1 ATOM 76 C CZ . ARG A 1 26 ? -4.478 45.169 28.003 1.00 56.17 ? 61 ARG A CZ 1 ATOM 77 N NH1 . ARG A 1 26 ? -4.380 45.650 26.770 1.00 52.10 ? 61 ARG A NH1 1 ATOM 78 N NH2 . ARG A 1 26 ? -3.685 45.639 28.955 1.00 57.40 ? 61 ARG A NH2 1 ATOM 79 N N . CYS A 1 27 ? -3.708 38.251 27.772 1.00 44.83 ? 62 CYS A N 1 ATOM 80 C CA . CYS A 1 27 ? -2.372 37.692 27.555 1.00 43.78 ? 62 CYS A CA 1 ATOM 81 C C . CYS A 1 27 ? -2.106 37.438 26.075 1.00 44.47 ? 62 CYS A C 1 ATOM 82 O O . CYS A 1 27 ? -2.912 36.796 25.393 1.00 44.03 ? 62 CYS A O 1 ATOM 83 C CB . CYS A 1 27 ? -2.184 36.405 28.352 1.00 48.91 ? 62 CYS A CB 1 ATOM 84 S SG . CYS A 1 27 ? -2.022 36.655 30.131 1.00 49.24 ? 62 CYS A SG 1 ATOM 85 N N . PHE A 1 28 ? -0.986 37.970 25.587 1.00 36.68 ? 63 PHE A N 1 ATOM 86 C CA . PHE A 1 28 ? -0.591 37.838 24.184 1.00 39.07 ? 63 PHE A CA 1 ATOM 87 C C . PHE A 1 28 ? -1.708 38.185 23.208 1.00 40.99 ? 63 PHE A C 1 ATOM 88 O O . PHE A 1 28 ? -1.941 37.485 22.227 1.00 37.21 ? 63 PHE A O 1 ATOM 89 C CB . PHE A 1 28 ? -0.049 36.434 23.914 1.00 36.48 ? 63 PHE A CB 1 ATOM 90 C CG . PHE A 1 28 ? 1.199 36.136 24.667 1.00 38.01 ? 63 PHE A CG 1 ATOM 91 C CD1 . PHE A 1 28 ? 2.415 36.637 24.237 1.00 36.49 ? 63 PHE A CD1 1 ATOM 92 C CD2 . PHE A 1 28 ? 1.158 35.389 25.817 1.00 33.36 ? 63 PHE A CD2 1 ATOM 93 C CE1 . PHE A 1 28 ? 3.565 36.385 24.940 1.00 37.31 ? 63 PHE A CE1 1 ATOM 94 C CE2 . PHE A 1 28 ? 2.309 35.132 26.531 1.00 40.70 ? 63 PHE A CE2 1 ATOM 95 C CZ . PHE A 1 28 ? 3.518 35.628 26.086 1.00 42.02 ? 63 PHE A CZ 1 ATOM 96 N N . GLU A 1 29 ? -2.406 39.275 23.481 1.00 41.71 ? 64 GLU A N 1 ATOM 97 C CA . GLU A 1 29 ? -3.472 39.687 22.597 1.00 37.37 ? 64 GLU A CA 1 ATOM 98 C C . GLU A 1 29 ? -2.872 40.193 21.301 1.00 42.55 ? 64 GLU A C 1 ATOM 99 O O . GLU A 1 29 ? -1.723 40.644 21.267 1.00 38.48 ? 64 GLU A O 1 ATOM 100 C CB . GLU A 1 29 ? -4.307 40.787 23.249 1.00 48.40 ? 64 GLU A CB 1 ATOM 101 C CG . GLU A 1 29 ? -3.545 42.068 23.474 1.00 48.33 ? 64 GLU A CG 1 ATOM 102 C CD . GLU A 1 29 ? -4.336 43.080 24.282 1.00 57.33 ? 64 GLU A CD 1 ATOM 103 O OE1 . GLU A 1 29 ? -5.583 42.991 24.302 1.00 55.81 ? 64 GLU A OE1 1 ATOM 104 O OE2 . GLU A 1 29 ? -3.705 43.964 24.894 1.00 56.56 ? 64 GLU A OE2 1 ATOM 105 N N . LEU A 1 30 ? -3.657 40.114 20.237 1.00 40.75 ? 65 LEU A N 1 ATOM 106 C CA . LEU A 1 30 ? -3.234 40.603 18.934 1.00 49.01 ? 65 LEU A CA 1 ATOM 107 C C . LEU A 1 30 ? -3.718 42.044 18.746 1.00 56.58 ? 65 LEU A C 1 ATOM 108 O O . LEU A 1 30 ? -3.574 42.631 17.675 1.00 60.47 ? 65 LEU A O 1 ATOM 109 C CB . LEU A 1 30 ? -3.783 39.689 17.838 1.00 50.36 ? 65 LEU A CB 1 ATOM 110 C CG . LEU A 1 30 ? -3.432 38.206 18.012 1.00 47.47 ? 65 LEU A CG 1 ATOM 111 C CD1 . LEU A 1 30 ? -4.381 37.318 17.200 1.00 37.53 ? 65 LEU A CD1 1 ATOM 112 C CD2 . LEU A 1 30 ? -1.977 37.959 17.619 1.00 41.05 ? 65 LEU A CD2 1 ATOM 113 N N . GLN A 1 31 ? -4.289 42.598 19.813 1.00 59.89 ? 66 GLN A N 1 ATOM 114 C CA . GLN A 1 31 ? -4.721 43.993 19.858 1.00 63.71 ? 66 GLN A CA 1 ATOM 115 C C . GLN A 1 31 ? -3.580 44.972 19.611 1.00 64.60 ? 66 GLN A C 1 ATOM 116 O O . GLN A 1 31 ? -2.532 44.895 20.257 1.00 60.46 ? 66 GLN A O 1 ATOM 117 C CB . GLN A 1 31 ? -5.333 44.300 21.227 1.00 65.61 ? 66 GLN A CB 1 ATOM 118 C CG . GLN A 1 31 ? -6.766 43.843 21.402 1.00 67.44 ? 66 GLN A CG 1 ATOM 119 C CD . GLN A 1 31 ? -7.758 44.891 20.947 1.00 74.70 ? 66 GLN A CD 1 ATOM 120 O OE1 . GLN A 1 31 ? -7.957 45.907 21.617 1.00 71.53 ? 66 GLN A OE1 1 ATOM 121 N NE2 . GLN A 1 31 ? -8.383 44.655 19.797 1.00 77.07 ? 66 GLN A NE2 1 ATOM 122 N N . GLU A 1 32 ? -3.791 45.898 18.680 1.00 70.41 ? 67 GLU A N 1 ATOM 123 C CA . GLU A 1 32 ? -2.881 47.024 18.510 1.00 68.54 ? 67 GLU A CA 1 ATOM 124 C C . GLU A 1 32 ? -3.138 48.025 19.632 1.00 71.74 ? 67 GLU A C 1 ATOM 125 O O . GLU A 1 32 ? -4.044 48.854 19.541 1.00 75.00 ? 67 GLU A O 1 ATOM 126 C CB . GLU A 1 32 ? -3.089 47.690 17.148 1.00 73.66 ? 67 GLU A CB 1 ATOM 127 N N . VAL A 1 33 ? -2.345 47.931 20.694 1.00 68.53 ? 68 VAL A N 1 ATOM 128 C CA . VAL A 1 33 ? -2.531 48.766 21.876 1.00 67.55 ? 68 VAL A CA 1 ATOM 129 C C . VAL A 1 33 ? -1.401 49.777 22.014 1.00 69.43 ? 68 VAL A C 1 ATOM 130 O O . VAL A 1 33 ? -0.235 49.405 22.140 1.00 67.97 ? 68 VAL A O 1 ATOM 131 C CB . VAL A 1 33 ? -2.614 47.912 23.159 1.00 60.86 ? 68 VAL A CB 1 ATOM 132 C CG1 . VAL A 1 33 ? -2.484 48.785 24.392 1.00 63.93 ? 68 VAL A CG1 1 ATOM 133 C CG2 . VAL A 1 33 ? -3.914 47.120 23.189 1.00 62.19 ? 68 VAL A CG2 1 ATOM 134 N N . GLY A 1 34 ? -1.757 51.058 21.984 1.00 75.20 ? 69 GLY A N 1 ATOM 135 C CA . GLY A 1 34 ? -0.786 52.131 22.093 1.00 74.68 ? 69 GLY A CA 1 ATOM 136 C C . GLY A 1 34 ? -0.993 52.958 23.346 1.00 76.87 ? 69 GLY A C 1 ATOM 137 O O . GLY A 1 34 ? -2.098 52.984 23.892 1.00 75.08 ? 69 GLY A O 1 ATOM 138 N N . PRO A 1 35 ? 0.070 53.643 23.802 1.00 77.97 ? 70 PRO A N 1 ATOM 139 C CA . PRO A 1 35 ? 0.091 54.458 25.025 1.00 79.05 ? 70 PRO A CA 1 ATOM 140 C C . PRO A 1 35 ? -1.063 55.462 25.091 1.00 78.24 ? 70 PRO A C 1 ATOM 141 O O . PRO A 1 35 ? -1.564 55.882 24.045 1.00 79.89 ? 70 PRO A O 1 ATOM 142 C CB . PRO A 1 35 ? 1.444 55.184 24.947 1.00 77.66 ? 70 PRO A CB 1 ATOM 143 C CG . PRO A 1 35 ? 1.891 55.040 23.525 1.00 82.64 ? 70 PRO A CG 1 ATOM 144 C CD . PRO A 1 35 ? 1.349 53.724 23.078 1.00 79.63 ? 70 PRO A CD 1 ATOM 145 N N . PRO A 1 36 ? -1.484 55.844 26.311 1.00 78.47 ? 71 PRO A N 1 ATOM 146 C CA . PRO A 1 36 ? -0.906 55.458 27.609 1.00 76.53 ? 71 PRO A CA 1 ATOM 147 C C . PRO A 1 36 ? -1.291 54.048 28.062 1.00 70.32 ? 71 PRO A C 1 ATOM 148 O O . PRO A 1 36 ? -0.852 53.596 29.125 1.00 66.09 ? 71 PRO A O 1 ATOM 149 C CB . PRO A 1 36 ? -1.511 56.487 28.566 1.00 78.39 ? 71 PRO A CB 1 ATOM 150 C CG . PRO A 1 36 ? -2.845 56.786 27.968 1.00 76.51 ? 71 PRO A CG 1 ATOM 151 C CD . PRO A 1 36 ? -2.642 56.743 26.473 1.00 75.53 ? 71 PRO A CD 1 ATOM 152 N N . ASP A 1 37 ? -2.095 53.368 27.251 1.00 73.12 ? 72 ASP A N 1 ATOM 153 C CA . ASP A 1 37 ? -2.625 52.056 27.597 1.00 71.74 ? 72 ASP A CA 1 ATOM 154 C C . ASP A 1 37 ? -1.546 51.011 27.885 1.00 63.34 ? 72 ASP A C 1 ATOM 155 O O . ASP A 1 37 ? -0.440 51.054 27.348 1.00 60.40 ? 72 ASP A O 1 ATOM 156 C CB . ASP A 1 37 ? -3.567 51.553 26.502 1.00 73.73 ? 72 ASP A CB 1 ATOM 157 C CG . ASP A 1 37 ? -4.630 52.571 26.134 1.00 77.06 ? 72 ASP A CG 1 ATOM 158 O OD1 . ASP A 1 37 ? -4.308 53.777 26.092 1.00 75.76 ? 72 ASP A OD1 1 ATOM 159 O OD2 . ASP A 1 37 ? -5.787 52.167 25.887 1.00 76.37 ? 72 ASP A OD2 1 ATOM 160 N N . CYS A 1 38 ? -1.910 50.075 28.750 1.00 63.32 ? 73 CYS A N 1 ATOM 161 C CA . CYS A 1 38 ? -1.049 49.002 29.217 1.00 59.06 ? 73 CYS A CA 1 ATOM 162 C C . CYS A 1 38 ? -1.013 47.872 28.174 1.00 58.78 ? 73 CYS A C 1 ATOM 163 O O . CYS A 1 38 ? -2.055 47.499 27.635 1.00 54.23 ? 73 CYS A O 1 ATOM 164 C CB . CYS A 1 38 ? -1.647 48.489 30.522 1.00 52.99 ? 73 CYS A CB 1 ATOM 165 S SG . CYS A 1 38 ? -0.524 47.688 31.615 1.00 63.11 ? 73 CYS A SG 1 ATOM 166 N N . ARG A 1 39 ? 0.170 47.328 27.882 1.00 57.37 ? 74 ARG A N 1 ATOM 167 C CA . ARG A 1 39 ? 0.292 46.306 26.829 1.00 51.32 ? 74 ARG A CA 1 ATOM 168 C C . ARG A 1 39 ? 0.508 44.884 27.351 1.00 48.13 ? 74 ARG A C 1 ATOM 169 O O . ARG A 1 39 ? 1.031 44.678 28.446 1.00 45.25 ? 74 ARG A O 1 ATOM 170 C CB . ARG A 1 39 ? 1.405 46.664 25.844 1.00 44.94 ? 74 ARG A CB 1 ATOM 171 C CG . ARG A 1 39 ? 1.058 47.775 24.871 1.00 56.63 ? 74 ARG A CG 1 ATOM 172 C CD . ARG A 1 39 ? 2.274 48.167 24.044 1.00 50.33 ? 74 ARG A CD 1 ATOM 173 N NE . ARG A 1 39 ? 2.768 47.057 23.234 1.00 54.55 ? 74 ARG A NE 1 ATOM 174 C CZ . ARG A 1 39 ? 3.911 47.078 22.555 1.00 55.42 ? 74 ARG A CZ 1 ATOM 175 N NH1 . ARG A 1 39 ? 4.687 48.153 22.591 1.00 55.15 ? 74 ARG A NH1 1 ATOM 176 N NH2 . ARG A 1 39 ? 4.281 46.023 21.840 1.00 53.53 ? 74 ARG A NH2 1 ATOM 177 N N . CYS A 1 40 ? 0.110 43.897 26.556 1.00 45.41 ? 75 CYS A N 1 ATOM 178 C CA . CYS A 1 40 ? 0.219 42.506 26.980 1.00 43.13 ? 75 CYS A CA 1 ATOM 179 C C . CYS A 1 40 ? 0.655 41.586 25.843 1.00 43.08 ? 75 CYS A C 1 ATOM 180 O O . CYS A 1 40 ? 0.446 40.379 25.916 1.00 39.17 ? 75 CYS A O 1 ATOM 181 C CB . CYS A 1 40 ? -1.121 42.011 27.539 1.00 47.65 ? 75 CYS A CB 1 ATOM 182 S SG . CYS A 1 40 ? -1.815 43.040 28.858 1.00 47.27 ? 75 CYS A SG 1 ATOM 183 N N . ASP A 1 41 ? 1.253 42.159 24.801 1.00 42.22 ? 76 ASP A N 1 ATOM 184 C CA . ASP A 1 41 ? 1.630 41.408 23.600 1.00 33.92 ? 76 ASP A CA 1 ATOM 185 C C . ASP A 1 41 ? 3.046 40.864 23.716 1.00 39.83 ? 76 ASP A C 1 ATOM 186 O O . ASP A 1 41 ? 3.785 41.221 24.633 1.00 36.47 ? 76 ASP A O 1 ATOM 187 C CB . ASP A 1 41 ? 1.532 42.309 22.373 1.00 36.06 ? 76 ASP A CB 1 ATOM 188 C CG . ASP A 1 41 ? 2.484 43.483 22.446 1.00 45.18 ? 76 ASP A CG 1 ATOM 189 O OD1 . ASP A 1 41 ? 2.234 44.400 23.253 1.00 45.18 ? 76 ASP A OD1 1 ATOM 190 O OD2 . ASP A 1 41 ? 3.490 43.491 21.704 1.00 47.58 ? 76 ASP A OD2 1 ATOM 191 N N . ASN A 1 42 ? 3.442 40.019 22.769 1.00 35.62 ? 77 ASN A N 1 ATOM 192 C CA . ASN A 1 42 ? 4.736 39.355 22.889 1.00 41.81 ? 77 ASN A CA 1 ATOM 193 C C . ASN A 1 42 ? 5.937 40.289 22.751 1.00 39.22 ? 77 ASN A C 1 ATOM 194 O O . ASN A 1 42 ? 7.081 39.856 22.927 1.00 40.05 ? 77 ASN A O 1 ATOM 195 C CB . ASN A 1 42 ? 4.848 38.136 21.963 1.00 40.10 ? 77 ASN A CB 1 ATOM 196 C CG . ASN A 1 42 ? 4.499 38.459 20.537 1.00 40.10 ? 77 ASN A CG 1 ATOM 197 O OD1 . ASN A 1 42 ? 4.064 39.568 20.242 1.00 46.64 ? 77 ASN A OD1 1 ATOM 198 N ND2 . ASN A 1 42 ? 4.675 37.484 19.634 1.00 39.08 ? 77 ASN A ND2 1 ATOM 199 N N . LEU A 1 43 ? 5.676 41.565 22.470 1.00 35.73 ? 78 LEU A N 1 ATOM 200 C CA . LEU A 1 43 ? 6.742 42.567 22.414 1.00 36.45 ? 78 LEU A CA 1 ATOM 201 C C . LEU A 1 43 ? 6.704 43.608 23.526 1.00 40.54 ? 78 LEU A C 1 ATOM 202 O O . LEU A 1 43 ? 7.497 44.546 23.506 1.00 43.68 ? 78 LEU A O 1 ATOM 203 C CB . LEU A 1 43 ? 6.737 43.317 21.080 1.00 42.65 ? 78 LEU A CB 1 ATOM 204 C CG . LEU A 1 43 ? 7.468 42.685 19.901 1.00 45.28 ? 78 LEU A CG 1 ATOM 205 C CD1 . LEU A 1 43 ? 8.898 42.294 20.274 1.00 40.66 ? 78 LEU A CD1 1 ATOM 206 C CD2 . LEU A 1 43 ? 6.677 41.492 19.417 1.00 48.81 ? 78 LEU A CD2 1 ATOM 207 N N . CYS A 1 44 ? 5.798 43.475 24.487 1.00 41.11 ? 79 CYS A N 1 ATOM 208 C CA . CYS A 1 44 ? 5.662 44.549 25.470 1.00 42.11 ? 79 CYS A CA 1 ATOM 209 C C . CYS A 1 44 ? 6.913 44.709 26.328 1.00 46.88 ? 79 CYS A C 1 ATOM 210 O O . CYS A 1 44 ? 7.296 45.831 26.661 1.00 48.35 ? 79 CYS A O 1 ATOM 211 C CB . CYS A 1 44 ? 4.404 44.390 26.334 1.00 35.61 ? 79 CYS A CB 1 ATOM 212 S SG . CYS A 1 44 ? 4.442 43.037 27.508 1.00 43.12 ? 79 CYS A SG 1 ATOM 213 N N . LYS A 1 45 ? 7.550 43.596 26.694 1.00 39.49 ? 80 LYS A N 1 ATOM 214 C CA . LYS A 1 45 ? 8.760 43.675 27.519 1.00 48.23 ? 80 LYS A CA 1 ATOM 215 C C . LYS A 1 45 ? 9.873 44.449 26.824 1.00 46.89 ? 80 LYS A C 1 ATOM 216 O O . LYS A 1 45 ? 10.656 45.133 27.478 1.00 49.69 ? 80 LYS A O 1 ATOM 217 C CB . LYS A 1 45 ? 9.256 42.286 27.941 1.00 47.06 ? 80 LYS A CB 1 ATOM 218 C CG . LYS A 1 45 ? 8.392 41.609 28.998 1.00 51.15 ? 80 LYS A CG 1 ATOM 219 C CD . LYS A 1 45 ? 9.141 40.492 29.702 1.00 56.07 ? 80 LYS A CD 1 ATOM 220 C CE . LYS A 1 45 ? 9.550 40.888 31.121 1.00 58.49 ? 80 LYS A CE 1 ATOM 221 N NZ . LYS A 1 45 ? 8.472 40.639 32.124 1.00 59.38 ? 80 LYS A NZ 1 ATOM 222 N N . SER A 1 46 ? 9.926 44.339 25.499 1.00 44.55 ? 81 SER A N 1 ATOM 223 C CA . SER A 1 46 ? 10.923 45.039 24.698 1.00 47.68 ? 81 SER A CA 1 ATOM 224 C C . SER A 1 46 ? 10.692 46.549 24.666 1.00 50.48 ? 81 SER A C 1 ATOM 225 O O . SER A 1 46 ? 11.610 47.321 24.389 1.00 47.37 ? 81 SER A O 1 ATOM 226 C CB . SER A 1 46 ? 10.937 44.488 23.269 1.00 46.84 ? 81 SER A CB 1 ATOM 227 O OG . SER A 1 46 ? 11.270 43.111 23.261 1.00 43.86 ? 81 SER A OG 1 ATOM 228 N N . TYR A 1 47 ? 9.463 46.972 24.934 1.00 51.23 ? 82 TYR A N 1 ATOM 229 C CA . TYR A 1 47 ? 9.146 48.397 24.964 1.00 55.11 ? 82 TYR A CA 1 ATOM 230 C C . TYR A 1 47 ? 8.956 48.882 26.398 1.00 57.20 ? 82 TYR A C 1 ATOM 231 O O . TYR A 1 47 ? 8.586 50.036 26.628 1.00 62.71 ? 82 TYR A O 1 ATOM 232 C CB . TYR A 1 47 ? 7.884 48.692 24.153 1.00 53.45 ? 82 TYR A CB 1 ATOM 233 C CG . TYR A 1 47 ? 8.070 48.683 22.653 1.00 52.92 ? 82 TYR A CG 1 ATOM 234 C CD1 . TYR A 1 47 ? 8.042 47.493 21.935 1.00 55.49 ? 82 TYR A CD1 1 ATOM 235 C CD2 . TYR A 1 47 ? 8.249 49.869 21.950 1.00 51.61 ? 82 TYR A CD2 1 ATOM 236 C CE1 . TYR A 1 47 ? 8.203 47.483 20.555 1.00 52.72 ? 82 TYR A CE1 1 ATOM 237 C CE2 . TYR A 1 47 ? 8.409 49.871 20.573 1.00 53.00 ? 82 TYR A CE2 1 ATOM 238 C CZ . TYR A 1 47 ? 8.384 48.678 19.879 1.00 53.88 ? 82 TYR A CZ 1 ATOM 239 O OH . TYR A 1 47 ? 8.544 48.679 18.507 1.00 52.55 ? 82 TYR A OH 1 ATOM 240 N N . SER A 1 48 ? 9.207 47.990 27.354 1.00 56.51 ? 83 SER A N 1 ATOM 241 C CA . SER A 1 48 ? 8.985 48.271 28.773 1.00 63.04 ? 83 SER A CA 1 ATOM 242 C C . SER A 1 48 ? 7.585 48.826 29.053 1.00 68.00 ? 83 SER A C 1 ATOM 243 O O . SER A 1 48 ? 7.418 49.703 29.902 1.00 69.39 ? 83 SER A O 1 ATOM 244 C CB . SER A 1 48 ? 10.051 49.235 29.312 1.00 68.76 ? 83 SER A CB 1 ATOM 245 O OG . SER A 1 48 ? 11.323 48.609 29.397 1.00 69.67 ? 83 SER A OG 1 ATOM 246 N N . SER A 1 49 ? 6.585 48.310 28.343 1.00 62.58 ? 84 SER A N 1 ATOM 247 C CA . SER A 1 49 ? 5.227 48.827 28.462 1.00 55.23 ? 84 SER A CA 1 ATOM 248 C C . SER A 1 49 ? 4.214 47.774 28.905 1.00 50.54 ? 84 SER A C 1 ATOM 249 O O . SER A 1 49 ? 3.009 47.955 28.729 1.00 53.91 ? 84 SER A O 1 ATOM 250 C CB . SER A 1 49 ? 4.784 49.460 27.141 1.00 60.33 ? 84 SER A CB 1 ATOM 251 O OG . SER A 1 49 ? 4.889 48.535 26.072 1.00 62.84 ? 84 SER A OG 1 ATOM 252 N N . CYS A 1 50 ? 4.698 46.680 29.487 1.00 52.13 ? 85 CYS A N 1 ATOM 253 C CA . CYS A 1 50 ? 3.808 45.625 29.956 1.00 50.85 ? 85 CYS A CA 1 ATOM 254 C C . CYS A 1 50 ? 3.031 46.071 31.184 1.00 57.58 ? 85 CYS A C 1 ATOM 255 O O . CYS A 1 50 ? 3.530 46.862 31.984 1.00 56.58 ? 85 CYS A O 1 ATOM 256 C CB . CYS A 1 50 ? 4.595 44.370 30.316 1.00 49.66 ? 85 CYS A CB 1 ATOM 257 S SG . CYS A 1 50 ? 5.630 43.725 29.002 1.00 47.51 ? 85 CYS A SG 1 ATOM 258 N N . CYS A 1 51 ? 1.820 45.548 31.341 1.00 50.93 ? 86 CYS A N 1 ATOM 259 C CA . CYS A 1 51 ? 1.074 45.751 32.569 1.00 51.30 ? 86 CYS A CA 1 ATOM 260 C C . CYS A 1 51 ? 1.834 45.130 33.735 1.00 55.48 ? 86 CYS A C 1 ATOM 261 O O . CYS A 1 51 ? 2.661 44.241 33.538 1.00 47.24 ? 86 CYS A O 1 ATOM 262 C CB . CYS A 1 51 ? -0.329 45.158 32.451 1.00 53.38 ? 86 CYS A CB 1 ATOM 263 S SG . CYS A 1 51 ? -1.320 45.883 31.120 1.00 50.55 ? 86 CYS A SG 1 ATOM 264 N N . HIS A 1 52 ? 1.559 45.601 34.947 1.00 50.02 ? 87 HIS A N 1 ATOM 265 C CA . HIS A 1 52 ? 2.297 45.146 36.117 1.00 51.28 ? 87 HIS A CA 1 ATOM 266 C C . HIS A 1 52 ? 2.137 43.646 36.319 1.00 50.64 ? 87 HIS A C 1 ATOM 267 O O . HIS A 1 52 ? 3.018 42.991 36.874 1.00 55.97 ? 87 HIS A O 1 ATOM 268 C CB . HIS A 1 52 ? 1.844 45.896 37.374 1.00 52.27 ? 87 HIS A CB 1 ATOM 269 C CG . HIS A 1 52 ? 0.473 45.514 37.840 1.00 51.39 ? 87 HIS A CG 1 ATOM 270 N ND1 . HIS A 1 52 ? -0.667 46.147 37.395 1.00 53.26 ? 87 HIS A ND1 1 ATOM 271 C CD2 . HIS A 1 52 ? 0.058 44.555 38.703 1.00 52.40 ? 87 HIS A CD2 1 ATOM 272 C CE1 . HIS A 1 52 ? -1.725 45.597 37.965 1.00 51.41 ? 87 HIS A CE1 1 ATOM 273 N NE2 . HIS A 1 52 ? -1.312 44.626 38.761 1.00 51.78 ? 87 HIS A NE2 1 ATOM 274 N N . ASP A 1 53 ? 1.017 43.103 35.856 1.00 47.33 ? 88 ASP A N 1 ATOM 275 C CA . ASP A 1 53 ? 0.725 41.690 36.070 1.00 52.28 ? 88 ASP A CA 1 ATOM 276 C C . ASP A 1 53 ? 0.953 40.819 34.832 1.00 51.34 ? 88 ASP A C 1 ATOM 277 O O . ASP A 1 53 ? 0.514 39.668 34.789 1.00 52.04 ? 88 ASP A O 1 ATOM 278 C CB . ASP A 1 53 ? -0.706 41.511 36.582 1.00 54.99 ? 88 ASP A CB 1 ATOM 279 C CG . ASP A 1 53 ? -1.740 42.110 35.647 1.00 51.12 ? 88 ASP A CG 1 ATOM 280 O OD1 . ASP A 1 53 ? -1.361 42.612 34.571 1.00 50.66 ? 88 ASP A OD1 1 ATOM 281 O OD2 . ASP A 1 53 ? -2.943 42.074 35.987 1.00 54.54 ? 88 ASP A OD2 1 ATOM 282 N N . PHE A 1 54 ? 1.630 41.370 33.829 1.00 53.55 ? 89 PHE A N 1 ATOM 283 C CA . PHE A 1 54 ? 1.937 40.618 32.615 1.00 45.94 ? 89 PHE A CA 1 ATOM 284 C C . PHE A 1 54 ? 2.738 39.366 32.948 1.00 47.92 ? 89 PHE A C 1 ATOM 285 O O . PHE A 1 54 ? 2.386 38.262 32.541 1.00 45.59 ? 89 PHE A O 1 ATOM 286 C CB . PHE A 1 54 ? 2.707 41.489 31.620 1.00 50.18 ? 89 PHE A CB 1 ATOM 287 C CG . PHE A 1 54 ? 3.208 40.736 30.412 1.00 47.33 ? 89 PHE A CG 1 ATOM 288 C CD1 . PHE A 1 54 ? 2.334 40.338 29.411 1.00 47.66 ? 89 PHE A CD1 1 ATOM 289 C CD2 . PHE A 1 54 ? 4.554 40.436 30.275 1.00 48.22 ? 89 PHE A CD2 1 ATOM 290 C CE1 . PHE A 1 54 ? 2.797 39.651 28.301 1.00 48.04 ? 89 PHE A CE1 1 ATOM 291 C CE2 . PHE A 1 54 ? 5.021 39.750 29.167 1.00 47.13 ? 89 PHE A CE2 1 ATOM 292 C CZ . PHE A 1 54 ? 4.146 39.355 28.184 1.00 41.48 ? 89 PHE A CZ 1 ATOM 293 N N . ASP A 1 55 ? 3.803 39.541 33.718 1.00 53.10 ? 90 ASP A N 1 ATOM 294 C CA . ASP A 1 55 ? 4.690 38.434 34.035 1.00 52.91 ? 90 ASP A CA 1 ATOM 295 C C . ASP A 1 55 ? 4.015 37.331 34.857 1.00 56.36 ? 90 ASP A C 1 ATOM 296 O O . ASP A 1 55 ? 4.315 36.147 34.681 1.00 59.24 ? 90 ASP A O 1 ATOM 297 C CB . ASP A 1 55 ? 5.944 38.950 34.739 1.00 57.27 ? 90 ASP A CB 1 ATOM 298 C CG . ASP A 1 55 ? 7.168 38.129 34.413 1.00 65.95 ? 90 ASP A CG 1 ATOM 299 O OD1 . ASP A 1 55 ? 7.072 36.880 34.439 1.00 67.33 ? 90 ASP A OD1 1 ATOM 300 O OD2 . ASP A 1 55 ? 8.222 38.736 34.119 1.00 67.38 ? 90 ASP A OD2 1 ATOM 301 N N . GLU A 1 56 ? 3.095 37.709 35.740 1.00 56.18 ? 91 GLU A N 1 ATOM 302 C CA . GLU A 1 56 ? 2.432 36.722 36.590 1.00 57.00 ? 91 GLU A CA 1 ATOM 303 C C . GLU A 1 56 ? 1.227 36.060 35.921 1.00 52.63 ? 91 GLU A C 1 ATOM 304 O O . GLU A 1 56 ? 0.906 34.907 36.210 1.00 52.33 ? 91 GLU A O 1 ATOM 305 C CB . GLU A 1 56 ? 2.049 37.323 37.953 1.00 54.47 ? 91 GLU A CB 1 ATOM 306 C CG . GLU A 1 56 ? 1.317 38.653 37.883 1.00 55.37 ? 91 GLU A CG 1 ATOM 307 C CD . GLU A 1 56 ? 1.003 39.229 39.263 1.00 72.41 ? 91 GLU A CD 1 ATOM 308 O OE1 . GLU A 1 56 ? 1.401 40.388 39.530 1.00 70.75 ? 91 GLU A OE1 1 ATOM 309 O OE2 . GLU A 1 56 ? 0.353 38.529 40.076 1.00 67.47 ? 91 GLU A OE2 1 ATOM 310 N N . LEU A 1 57 ? 0.563 36.784 35.026 1.00 45.93 ? 92 LEU A N 1 ATOM 311 C CA . LEU A 1 57 ? -0.610 36.247 34.340 1.00 52.28 ? 92 LEU A CA 1 ATOM 312 C C . LEU A 1 57 ? -0.299 35.576 33.000 1.00 56.06 ? 92 LEU A C 1 ATOM 313 O O . LEU A 1 57 ? -0.989 34.637 32.595 1.00 54.82 ? 92 LEU A O 1 ATOM 314 C CB . LEU A 1 57 ? -1.652 37.345 34.122 1.00 51.51 ? 92 LEU A CB 1 ATOM 315 C CG . LEU A 1 57 ? -2.565 37.655 35.305 1.00 51.88 ? 92 LEU A CG 1 ATOM 316 C CD1 . LEU A 1 57 ? -3.335 38.939 35.044 1.00 54.63 ? 92 LEU A CD1 1 ATOM 317 C CD2 . LEU A 1 57 ? -3.517 36.491 35.545 1.00 57.73 ? 92 LEU A CD2 1 ATOM 318 N N . CYS A 1 58 ? 0.733 36.057 32.314 1.00 50.79 ? 93 CYS A N 1 ATOM 319 C CA . CYS A 1 58 ? 0.977 35.637 30.940 1.00 45.78 ? 93 CYS A CA 1 ATOM 320 C C . CYS A 1 58 ? 2.239 34.776 30.769 1.00 49.39 ? 93 CYS A C 1 ATOM 321 O O . CYS A 1 58 ? 2.347 34.005 29.808 1.00 44.01 ? 93 CYS A O 1 ATOM 322 C CB . CYS A 1 58 ? 1.022 36.864 30.023 1.00 47.30 ? 93 CYS A CB 1 ATOM 323 S SG . CYS A 1 58 ? -0.450 37.946 30.140 1.00 45.90 ? 93 CYS A SG 1 ATOM 324 N N . LEU A 1 59 ? 3.190 34.902 31.691 1.00 41.95 ? 94 LEU A N 1 ATOM 325 C CA . LEU A 1 59 ? 4.420 34.112 31.614 1.00 46.14 ? 94 LEU A CA 1 ATOM 326 C C . LEU A 1 59 ? 4.484 33.011 32.667 1.00 45.81 ? 94 LEU A C 1 ATOM 327 O O . LEU A 1 59 ? 5.532 32.782 33.274 1.00 48.60 ? 94 LEU A O 1 ATOM 328 C CB . LEU A 1 59 ? 5.649 35.011 31.725 1.00 42.62 ? 94 LEU A CB 1 ATOM 329 C CG . LEU A 1 59 ? 5.739 36.071 30.631 1.00 48.11 ? 94 LEU A CG 1 ATOM 330 C CD1 . LEU A 1 59 ? 6.991 36.917 30.806 1.00 50.41 ? 94 LEU A CD1 1 ATOM 331 C CD2 . LEU A 1 59 ? 5.697 35.423 29.243 1.00 37.92 ? 94 LEU A CD2 1 ATOM 332 N N . LYS A 1 60 ? 3.365 32.321 32.868 1.00 48.27 ? 95 LYS A N 1 ATOM 333 C CA . LYS A 1 60 ? 3.290 31.259 33.871 1.00 50.77 ? 95 LYS A CA 1 ATOM 334 C C . LYS A 1 60 ? 4.272 30.129 33.565 1.00 48.11 ? 95 LYS A C 1 ATOM 335 O O . LYS A 1 60 ? 4.511 29.793 32.404 1.00 43.71 ? 95 LYS A O 1 ATOM 336 C CB . LYS A 1 60 ? 1.859 30.718 33.990 1.00 43.63 ? 95 LYS A CB 1 ATOM 337 C CG . LYS A 1 60 ? 0.840 31.779 34.385 1.00 46.90 ? 95 LYS A CG 1 ATOM 338 C CD . LYS A 1 60 ? -0.581 31.239 34.345 1.00 50.99 ? 95 LYS A CD 1 ATOM 339 C CE . LYS A 1 60 ? -1.597 32.321 34.738 1.00 61.78 ? 95 LYS A CE 1 ATOM 340 N NZ . LYS A 1 60 ? -1.573 32.643 36.205 1.00 57.00 ? 95 LYS A NZ 1 ATOM 341 N N . THR A 1 61 ? 4.840 29.551 34.617 1.00 46.85 ? 96 THR A N 1 ATOM 342 C CA . THR A 1 61 ? 5.883 28.545 34.464 1.00 45.48 ? 96 THR A CA 1 ATOM 343 C C . THR A 1 61 ? 5.647 27.315 35.343 1.00 47.01 ? 96 THR A C 1 ATOM 344 O O . THR A 1 61 ? 6.398 26.339 35.272 1.00 41.62 ? 96 THR A O 1 ATOM 345 C CB . THR A 1 61 ? 7.268 29.134 34.786 1.00 44.77 ? 96 THR A CB 1 ATOM 346 O OG1 . THR A 1 61 ? 8.220 28.070 34.898 1.00 57.61 ? 96 THR A OG1 1 ATOM 347 C CG2 . THR A 1 61 ? 7.233 29.906 36.103 1.00 43.12 ? 96 THR A CG2 1 ATOM 348 N N . ALA A 1 62 ? 4.592 27.371 36.156 1.00 48.68 ? 97 ALA A N 1 ATOM 349 C CA . ALA A 1 62 ? 4.330 26.361 37.180 1.00 43.46 ? 97 ALA A CA 1 ATOM 350 C C . ALA A 1 62 ? 4.192 24.939 36.642 1.00 43.86 ? 97 ALA A C 1 ATOM 351 O O . ALA A 1 62 ? 3.321 24.652 35.819 1.00 42.64 ? 97 ALA A O 1 ATOM 352 C CB . ALA A 1 62 ? 3.097 26.741 37.999 1.00 44.42 ? 97 ALA A CB 1 ATOM 353 N N . ARG A 1 63 ? 5.071 24.066 37.134 1.00 45.88 ? 98 ARG A N 1 ATOM 354 C CA . ARG A 1 63 ? 5.053 22.630 36.858 1.00 46.89 ? 98 ARG A CA 1 ATOM 355 C C . ARG A 1 63 ? 5.579 22.262 35.472 1.00 48.28 ? 98 ARG A C 1 ATOM 356 O O . ARG A 1 63 ? 5.328 21.165 34.973 1.00 44.58 ? 98 ARG A O 1 ATOM 357 C CB . ARG A 1 63 ? 3.669 22.017 37.124 1.00 50.78 ? 98 ARG A CB 1 ATOM 358 C CG . ARG A 1 63 ? 3.112 22.350 38.515 1.00 50.17 ? 98 ARG A CG 1 ATOM 359 C CD . ARG A 1 63 ? 1.882 21.518 38.848 1.00 46.78 ? 98 ARG A CD 1 ATOM 360 N NE . ARG A 1 63 ? 2.206 20.096 38.925 1.00 60.78 ? 98 ARG A NE 1 ATOM 361 C CZ . ARG A 1 63 ? 1.343 19.144 39.272 1.00 63.90 ? 98 ARG A CZ 1 ATOM 362 N NH1 . ARG A 1 63 ? 0.089 19.457 39.581 1.00 63.03 ? 98 ARG A NH1 1 ATOM 363 N NH2 . ARG A 1 63 ? 1.738 17.877 39.311 1.00 59.84 ? 98 ARG A NH2 1 ATOM 364 N N . GLY A 1 64 ? 6.325 23.179 34.868 1.00 43.13 ? 99 GLY A N 1 ATOM 365 C CA . GLY A 1 64 ? 6.985 22.908 33.606 1.00 39.69 ? 99 GLY A CA 1 ATOM 366 C C . GLY A 1 64 ? 6.074 22.909 32.397 1.00 35.20 ? 99 GLY A C 1 ATOM 367 O O . GLY A 1 64 ? 4.984 23.480 32.418 1.00 36.34 ? 99 GLY A O 1 ATOM 368 N N . TRP A 1 65 ? 6.515 22.225 31.346 1.00 34.78 ? 100 TRP A N 1 ATOM 369 C CA . TRP A 1 65 ? 5.889 22.339 30.033 1.00 33.06 ? 100 TRP A CA 1 ATOM 370 C C . TRP A 1 65 ? 5.325 21.025 29.507 1.00 31.13 ? 100 TRP A C 1 ATOM 371 O O . TRP A 1 65 ? 4.856 20.952 28.364 1.00 34.28 ? 100 TRP A O 1 ATOM 372 C CB . TRP A 1 65 ? 6.898 22.897 29.028 1.00 35.61 ? 100 TRP A CB 1 ATOM 373 C CG . TRP A 1 65 ? 7.591 24.130 29.507 1.00 29.75 ? 100 TRP A CG 1 ATOM 374 C CD1 . TRP A 1 65 ? 8.862 24.220 29.972 1.00 30.02 ? 100 TRP A CD1 1 ATOM 375 C CD2 . TRP A 1 65 ? 7.045 25.454 29.568 1.00 31.63 ? 100 TRP A CD2 1 ATOM 376 N NE1 . TRP A 1 65 ? 9.149 25.518 30.323 1.00 34.23 ? 100 TRP A NE1 1 ATOM 377 C CE2 . TRP A 1 65 ? 8.050 26.296 30.078 1.00 28.42 ? 100 TRP A CE2 1 ATOM 378 C CE3 . TRP A 1 65 ? 5.808 26.008 29.231 1.00 30.15 ? 100 TRP A CE3 1 ATOM 379 C CZ2 . TRP A 1 65 ? 7.859 27.667 30.259 1.00 30.67 ? 100 TRP A CZ2 1 ATOM 380 C CZ3 . TRP A 1 65 ? 5.617 27.368 29.411 1.00 30.57 ? 100 TRP A CZ3 1 ATOM 381 C CH2 . TRP A 1 65 ? 6.631 28.180 29.922 1.00 31.73 ? 100 TRP A CH2 1 ATOM 382 N N . GLU A 1 66 ? 5.355 19.987 30.338 1.00 32.60 ? 101 GLU A N 1 ATOM 383 C CA . GLU A 1 66 ? 4.920 18.666 29.895 1.00 35.20 ? 101 GLU A CA 1 ATOM 384 C C . GLU A 1 66 ? 3.975 18.029 30.903 1.00 35.77 ? 101 GLU A C 1 ATOM 385 O O . GLU A 1 66 ? 4.230 18.069 32.105 1.00 38.78 ? 101 GLU A O 1 ATOM 386 C CB . GLU A 1 66 ? 6.125 17.737 29.711 1.00 38.32 ? 101 GLU A CB 1 ATOM 387 C CG . GLU A 1 66 ? 7.196 18.257 28.755 1.00 44.94 ? 101 GLU A CG 1 ATOM 388 C CD . GLU A 1 66 ? 8.504 17.493 28.879 1.00 47.71 ? 101 GLU A CD 1 ATOM 389 O OE1 . GLU A 1 66 ? 8.542 16.477 29.604 1.00 46.10 ? 101 GLU A OE1 1 ATOM 390 O OE2 . GLU A 1 66 ? 9.500 17.916 28.258 1.00 52.22 ? 101 GLU A OE2 1 ATOM 391 N N . CYS A 1 67 ? 2.897 17.433 30.401 1.00 34.63 ? 102 CYS A N 1 ATOM 392 C CA . CYS A 1 67 ? 2.002 16.635 31.229 1.00 40.44 ? 102 CYS A CA 1 ATOM 393 C C . CYS A 1 67 ? 2.744 15.416 31.748 1.00 46.17 ? 102 CYS A C 1 ATOM 394 O O . CYS A 1 67 ? 3.608 14.870 31.060 1.00 38.36 ? 102 CYS A O 1 ATOM 395 C CB . CYS A 1 67 ? 0.793 16.160 30.421 1.00 42.28 ? 102 CYS A CB 1 ATOM 396 S SG . CYS A 1 67 ? -0.474 17.404 30.119 1.00 45.89 ? 102 CYS A SG 1 ATOM 397 N N . THR A 1 68 ? 2.410 15.004 32.967 1.00 45.27 ? 103 THR A N 1 ATOM 398 C CA . THR A 1 68 ? 2.848 13.718 33.494 1.00 50.73 ? 103 THR A CA 1 ATOM 399 C C . THR A 1 68 ? 1.617 12.880 33.820 1.00 52.69 ? 103 THR A C 1 ATOM 400 O O . THR A 1 68 ? 0.504 13.411 33.893 1.00 47.61 ? 103 THR A O 1 ATOM 401 C CB . THR A 1 68 ? 3.728 13.866 34.755 1.00 45.33 ? 103 THR A CB 1 ATOM 402 O OG1 . THR A 1 68 ? 3.063 14.688 35.716 1.00 49.67 ? 103 THR A OG1 1 ATOM 403 C CG2 . THR A 1 68 ? 5.059 14.500 34.408 1.00 46.61 ? 103 THR A CG2 1 ATOM 404 N N . LYS A 1 69 ? 1.812 11.576 34.003 1.00 51.60 ? 104 LYS A N 1 ATOM 405 C CA . LYS A 1 69 ? 0.702 10.666 34.288 1.00 54.96 ? 104 LYS A CA 1 ATOM 406 C C . LYS A 1 69 ? -0.114 11.118 35.500 1.00 53.75 ? 104 LYS A C 1 ATOM 407 O O . LYS A 1 69 ? -1.334 10.980 35.521 1.00 56.52 ? 104 LYS A O 1 ATOM 408 C CB . LYS A 1 69 ? 1.215 9.239 34.502 1.00 60.40 ? 104 LYS A CB 1 ATOM 409 N N . ASP A 1 70 ? 0.563 11.683 36.494 1.00 56.18 ? 105 ASP A N 1 ATOM 410 C CA . ASP A 1 70 ? -0.099 12.113 37.721 1.00 58.27 ? 105 ASP A CA 1 ATOM 411 C C . ASP A 1 70 ? -0.922 13.389 37.544 1.00 60.09 ? 105 ASP A C 1 ATOM 412 O O . ASP A 1 70 ? -1.654 13.790 38.450 1.00 62.06 ? 105 ASP A O 1 ATOM 413 C CB . ASP A 1 70 ? 0.917 12.284 38.857 1.00 60.79 ? 105 ASP A CB 1 ATOM 414 C CG . ASP A 1 70 ? 1.863 13.452 38.633 1.00 62.89 ? 105 ASP A CG 1 ATOM 415 O OD1 . ASP A 1 70 ? 2.844 13.295 37.870 1.00 59.67 ? 105 ASP A OD1 1 ATOM 416 O OD2 . ASP A 1 70 ? 1.635 14.524 39.235 1.00 61.48 ? 105 ASP A OD2 1 ATOM 417 N N . ARG A 1 71 ? -0.813 14.023 36.381 1.00 51.58 ? 106 ARG A N 1 ATOM 418 C CA . ARG A 1 71 ? -1.564 15.246 36.131 1.00 47.73 ? 106 ARG A CA 1 ATOM 419 C C . ARG A 1 71 ? -2.792 14.994 35.272 1.00 48.05 ? 106 ARG A C 1 ATOM 420 O O . ARG A 1 71 ? -3.645 15.866 35.142 1.00 49.38 ? 106 ARG A O 1 ATOM 421 C CB . ARG A 1 71 ? -0.684 16.310 35.471 1.00 49.77 ? 106 ARG A CB 1 ATOM 422 C CG . ARG A 1 71 ? 0.424 16.859 36.353 1.00 50.55 ? 106 ARG A CG 1 ATOM 423 C CD . ARG A 1 71 ? 1.111 18.044 35.675 1.00 49.99 ? 106 ARG A CD 1 ATOM 424 N NE . ARG A 1 71 ? 0.160 19.112 35.388 1.00 49.39 ? 106 ARG A NE 1 ATOM 425 C CZ . ARG A 1 71 ? 0.441 20.216 34.701 1.00 48.98 ? 106 ARG A CZ 1 ATOM 426 N NH1 . ARG A 1 71 ? 1.661 20.418 34.206 1.00 38.34 ? 106 ARG A NH1 1 ATOM 427 N NH2 . ARG A 1 71 ? -0.513 21.119 34.505 1.00 41.24 ? 106 ARG A NH2 1 ATOM 428 N N . CYS A 1 72 ? -2.876 13.801 34.688 1.00 46.43 ? 107 CYS A N 1 ATOM 429 C CA . CYS A 1 72 ? -3.963 13.466 33.776 1.00 50.52 ? 107 CYS A CA 1 ATOM 430 C C . CYS A 1 72 ? -5.322 13.575 34.467 1.00 55.89 ? 107 CYS A C 1 ATOM 431 O O . CYS A 1 72 ? -5.552 12.943 35.496 1.00 53.88 ? 107 CYS A O 1 ATOM 432 C CB . CYS A 1 72 ? -3.778 12.054 33.219 1.00 51.60 ? 107 CYS A CB 1 ATOM 433 S SG . CYS A 1 72 ? -2.341 11.831 32.126 1.00 51.35 ? 107 CYS A SG 1 ATOM 434 N N . GLY A 1 73 ? -6.211 14.386 33.899 1.00 57.35 ? 108 GLY A N 1 ATOM 435 C CA . GLY A 1 73 ? -7.537 14.590 34.456 1.00 57.20 ? 108 GLY A CA 1 ATOM 436 C C . GLY A 1 73 ? -7.547 15.412 35.736 1.00 62.89 ? 108 GLY A C 1 ATOM 437 O O . GLY A 1 73 ? -8.498 15.344 36.521 1.00 59.77 ? 108 GLY A O 1 ATOM 438 N N . GLU A 1 74 ? -6.490 16.191 35.947 1.00 54.01 ? 109 GLU A N 1 ATOM 439 C CA . GLU A 1 74 ? -6.388 17.050 37.122 1.00 56.66 ? 109 GLU A CA 1 ATOM 440 C C . GLU A 1 74 ? -7.499 18.096 37.149 1.00 59.00 ? 109 GLU A C 1 ATOM 441 O O . GLU A 1 74 ? -8.195 18.310 36.155 1.00 58.01 ? 109 GLU A O 1 ATOM 442 C CB . GLU A 1 74 ? -5.033 17.765 37.137 1.00 57.37 ? 109 GLU A CB 1 ATOM 443 C CG . GLU A 1 74 ? -4.869 18.765 35.990 1.00 57.48 ? 109 GLU A CG 1 ATOM 444 C CD . GLU A 1 74 ? -3.447 19.288 35.837 1.00 54.67 ? 109 GLU A CD 1 ATOM 445 O OE1 . GLU A 1 74 ? -2.538 18.804 36.548 1.00 47.67 ? 109 GLU A OE1 1 ATOM 446 O OE2 . GLU A 1 74 ? -3.244 20.186 34.989 1.00 50.55 ? 109 GLU A OE2 1 ATOM 447 N N . VAL A 1 75 ? -7.665 18.746 38.295 1.00 62.86 ? 110 VAL A N 1 ATOM 448 C CA . VAL A 1 75 ? -8.511 19.924 38.358 1.00 58.08 ? 110 VAL A CA 1 ATOM 449 C C . VAL A 1 75 ? -7.720 21.089 37.790 1.00 55.49 ? 110 VAL A C 1 ATOM 450 O O . VAL A 1 75 ? -6.567 21.321 38.172 1.00 49.86 ? 110 VAL A O 1 ATOM 451 C CB . VAL A 1 75 ? -8.962 20.257 39.799 1.00 63.86 ? 110 VAL A CB 1 ATOM 452 C CG1 . VAL A 1 75 ? -9.625 21.635 39.854 1.00 56.82 ? 110 VAL A CG1 1 ATOM 453 C CG2 . VAL A 1 75 ? -9.909 19.188 40.323 1.00 64.80 ? 110 VAL A CG2 1 ATOM 454 N N . ARG A 1 76 ? -8.346 21.806 36.866 1.00 55.35 ? 111 ARG A N 1 ATOM 455 C CA . ARG A 1 76 ? -7.731 22.953 36.221 1.00 59.85 ? 111 ARG A CA 1 ATOM 456 C C . ARG A 1 76 ? -7.256 24.001 37.217 1.00 59.24 ? 111 ARG A C 1 ATOM 457 O O . ARG A 1 76 ? -8.065 24.697 37.833 1.00 64.52 ? 111 ARG A O 1 ATOM 458 C CB . ARG A 1 76 ? -8.713 23.588 35.241 1.00 54.85 ? 111 ARG A CB 1 ATOM 459 C CG . ARG A 1 76 ? -8.248 24.918 34.697 1.00 56.77 ? 111 ARG A CG 1 ATOM 460 C CD . ARG A 1 76 ? -9.171 25.391 33.611 1.00 61.14 ? 111 ARG A CD 1 ATOM 461 N NE . ARG A 1 76 ? -8.420 25.828 32.445 1.00 65.46 ? 111 ARG A NE 1 ATOM 462 C CZ . ARG A 1 76 ? -8.003 25.018 31.478 1.00 57.66 ? 111 ARG A CZ 1 ATOM 463 N NH1 . ARG A 1 76 ? -8.260 23.719 31.526 1.00 60.02 ? 111 ARG A NH1 1 ATOM 464 N NH2 . ARG A 1 76 ? -7.327 25.513 30.461 1.00 62.21 ? 111 ARG A NH2 1 ATOM 465 N N . ASN A 1 77 ? -5.939 24.099 37.379 1.00 58.09 ? 112 ASN A N 1 ATOM 466 C CA . ASN A 1 77 ? -5.336 25.191 38.137 1.00 58.69 ? 112 ASN A CA 1 ATOM 467 C C . ASN A 1 77 ? -4.758 26.220 37.176 1.00 60.76 ? 112 ASN A C 1 ATOM 468 O O . ASN A 1 77 ? -3.813 25.929 36.436 1.00 52.54 ? 112 ASN A O 1 ATOM 469 C CB . ASN A 1 77 ? -4.238 24.678 39.068 1.00 52.06 ? 112 ASN A CB 1 ATOM 470 C CG . ASN A 1 77 ? -3.684 25.767 39.979 1.00 61.95 ? 112 ASN A CG 1 ATOM 471 O OD1 . ASN A 1 77 ? -3.958 26.955 39.796 1.00 65.23 ? 112 ASN A OD1 1 ATOM 472 N ND2 . ASN A 1 77 ? -2.891 25.364 40.965 1.00 66.33 ? 112 ASN A ND2 1 ATOM 473 N N . GLU A 1 78 ? -5.313 27.427 37.209 1.00 57.50 ? 113 GLU A N 1 ATOM 474 C CA . GLU A 1 78 ? -4.890 28.484 36.299 1.00 58.52 ? 113 GLU A CA 1 ATOM 475 C C . GLU A 1 78 ? -3.482 29.006 36.594 1.00 54.84 ? 113 GLU A C 1 ATOM 476 O O . GLU A 1 78 ? -3.004 29.920 35.934 1.00 58.74 ? 113 GLU A O 1 ATOM 477 C CB . GLU A 1 78 ? -5.908 29.633 36.287 1.00 61.48 ? 113 GLU A CB 1 ATOM 478 C CG . GLU A 1 78 ? -7.134 29.379 35.401 1.00 66.11 ? 113 GLU A CG 1 ATOM 479 C CD . GLU A 1 78 ? -6.780 29.180 33.926 1.00 70.73 ? 113 GLU A CD 1 ATOM 480 O OE1 . GLU A 1 78 ? -5.882 29.887 33.412 1.00 70.13 ? 113 GLU A OE1 1 ATOM 481 O OE2 . GLU A 1 78 ? -7.402 28.311 33.277 1.00 69.42 ? 113 GLU A OE2 1 ATOM 482 N N . GLU A 1 79 ? -2.815 28.416 37.577 1.00 52.62 ? 114 GLU A N 1 ATOM 483 C CA . GLU A 1 79 ? -1.465 28.832 37.928 1.00 55.17 ? 114 GLU A CA 1 ATOM 484 C C . GLU A 1 79 ? -0.426 28.103 37.070 1.00 44.67 ? 114 GLU A C 1 ATOM 485 O O . GLU A 1 79 ? 0.699 28.573 36.897 1.00 44.40 ? 114 GLU A O 1 ATOM 486 C CB . GLU A 1 79 ? -1.207 28.576 39.417 1.00 58.59 ? 114 GLU A CB 1 ATOM 487 C CG . GLU A 1 79 ? -0.070 29.402 40.010 1.00 66.90 ? 114 GLU A CG 1 ATOM 488 C CD . GLU A 1 79 ? -0.304 30.898 39.877 1.00 71.35 ? 114 GLU A CD 1 ATOM 489 O OE1 . GLU A 1 79 ? -1.248 31.412 40.516 1.00 68.38 ? 114 GLU A OE1 1 ATOM 490 O OE2 . GLU A 1 79 ? 0.452 31.557 39.128 1.00 73.07 ? 114 GLU A OE2 1 ATOM 491 N N . ASN A 1 80 ? -0.815 26.953 36.531 1.00 45.61 ? 115 ASN A N 1 ATOM 492 C CA . ASN A 1 80 ? 0.097 26.120 35.754 1.00 44.29 ? 115 ASN A CA 1 ATOM 493 C C . ASN A 1 80 ? 0.449 26.706 34.391 1.00 43.76 ? 115 ASN A C 1 ATOM 494 O O . ASN A 1 80 ? -0.355 27.412 33.788 1.00 41.89 ? 115 ASN A O 1 ATOM 495 C CB . ASN A 1 80 ? -0.480 24.723 35.598 1.00 41.81 ? 115 ASN A CB 1 ATOM 496 C CG . ASN A 1 80 ? -0.524 23.980 36.910 1.00 51.54 ? 115 ASN A CG 1 ATOM 497 O OD1 . ASN A 1 80 ? 0.340 24.174 37.765 1.00 47.36 ? 115 ASN A OD1 1 ATOM 498 N ND2 . ASN A 1 80 ? -1.535 23.137 37.086 1.00 46.42 ? 115 ASN A ND2 1 ATOM 499 N N . ALA A 1 81 ? 1.660 26.413 33.924 1.00 41.52 ? 116 ALA A N 1 ATOM 500 C CA . ALA A 1 81 ? 2.147 26.914 32.642 1.00 40.44 ? 116 ALA A CA 1 ATOM 501 C C . ALA A 1 81 ? 1.291 26.375 31.512 1.00 35.78 ? 116 ALA A C 1 ATOM 502 O O . ALA A 1 81 ? 0.880 27.111 30.622 1.00 35.15 ? 116 ALA A O 1 ATOM 503 C CB . ALA A 1 81 ? 3.608 26.528 32.443 1.00 37.15 ? 116 ALA A CB 1 ATOM 504 N N . CYS A 1 82 ? 1.018 25.080 31.555 1.00 35.00 ? 117 CYS A N 1 ATOM 505 C CA . CYS A 1 82 ? 0.099 24.464 30.616 1.00 35.43 ? 117 CYS A CA 1 ATOM 506 C C . CYS A 1 82 ? -0.760 23.450 31.384 1.00 36.20 ? 117 CYS A C 1 ATOM 507 O O . CYS A 1 82 ? -0.532 23.227 32.567 1.00 37.47 ? 117 CYS A O 1 ATOM 508 C CB . CYS A 1 82 ? 0.853 23.826 29.446 1.00 29.63 ? 117 CYS A CB 1 ATOM 509 S SG . CYS A 1 82 ? 2.109 22.610 29.885 1.00 34.54 ? 117 CYS A SG 1 ATOM 510 N N . HIS A 1 83 ? -1.746 22.851 30.730 1.00 37.31 ? 118 HIS A N 1 ATOM 511 C CA . HIS A 1 83 ? -2.737 22.070 31.468 1.00 42.68 ? 118 HIS A CA 1 ATOM 512 C C . HIS A 1 83 ? -2.895 20.636 30.999 1.00 44.75 ? 118 HIS A C 1 ATOM 513 O O . HIS A 1 83 ? -2.606 20.306 29.847 1.00 37.56 ? 118 HIS A O 1 ATOM 514 C CB . HIS A 1 83 ? -4.086 22.795 31.465 1.00 43.01 ? 118 HIS A CB 1 ATOM 515 C CG . HIS A 1 83 ? -4.015 24.168 32.049 1.00 44.82 ? 118 HIS A CG 1 ATOM 516 N ND1 . HIS A 1 83 ? -3.732 25.285 31.293 1.00 46.38 ? 118 HIS A ND1 1 ATOM 517 C CD2 . HIS A 1 83 ? -4.143 24.600 33.324 1.00 44.63 ? 118 HIS A CD2 1 ATOM 518 C CE1 . HIS A 1 83 ? -3.709 26.349 32.075 1.00 44.55 ? 118 HIS A CE1 1 ATOM 519 N NE2 . HIS A 1 83 ? -3.952 25.960 33.312 1.00 44.19 ? 118 HIS A NE2 1 ATOM 520 N N . CYS A 1 84 ? -3.358 19.789 31.915 1.00 40.80 ? 119 CYS A N 1 ATOM 521 C CA . CYS A 1 84 ? -3.598 18.381 31.629 1.00 44.56 ? 119 CYS A CA 1 ATOM 522 C C . CYS A 1 84 ? -4.997 18.012 32.101 1.00 49.33 ? 119 CYS A C 1 ATOM 523 O O . CYS A 1 84 ? -5.321 16.843 32.287 1.00 46.45 ? 119 CYS A O 1 ATOM 524 C CB . CYS A 1 84 ? -2.547 17.513 32.323 1.00 45.09 ? 119 CYS A CB 1 ATOM 525 S SG . CYS A 1 84 ? -0.847 18.058 32.012 1.00 48.52 ? 119 CYS A SG 1 ATOM 526 N N . SER A 1 85 ? -5.816 19.038 32.297 1.00 49.95 ? 120 SER A N 1 ATOM 527 C CA . SER A 1 85 ? -7.198 18.869 32.710 1.00 52.75 ? 120 SER A CA 1 ATOM 528 C C . SER A 1 85 ? -8.038 18.373 31.546 1.00 53.70 ? 120 SER A C 1 ATOM 529 O O . SER A 1 85 ? -7.693 18.588 30.384 1.00 52.18 ? 120 SER A O 1 ATOM 530 C CB . SER A 1 85 ? -7.754 20.198 33.216 1.00 56.31 ? 120 SER A CB 1 ATOM 531 O OG . SER A 1 85 ? -7.557 21.222 32.255 1.00 53.70 ? 120 SER A OG 1 ATOM 532 N N . GLU A 1 86 ? -9.149 17.717 31.860 1.00 54.04 ? 121 GLU A N 1 ATOM 533 C CA . GLU A 1 86 ? -10.026 17.170 30.833 1.00 54.77 ? 121 GLU A CA 1 ATOM 534 C C . GLU A 1 86 ? -10.518 18.228 29.834 1.00 54.47 ? 121 GLU A C 1 ATOM 535 O O . GLU A 1 86 ? -10.743 17.929 28.661 1.00 56.50 ? 121 GLU A O 1 ATOM 536 C CB . GLU A 1 86 ? -11.210 16.453 31.481 1.00 55.95 ? 121 GLU A CB 1 ATOM 537 C CG . GLU A 1 86 ? -12.088 15.716 30.494 1.00 59.12 ? 121 GLU A CG 1 ATOM 538 C CD . GLU A 1 86 ? -11.354 14.587 29.809 1.00 62.54 ? 121 GLU A CD 1 ATOM 539 O OE1 . GLU A 1 86 ? -10.442 14.011 30.440 1.00 60.65 ? 121 GLU A OE1 1 ATOM 540 O OE2 . GLU A 1 86 ? -11.683 14.278 28.641 1.00 62.55 ? 121 GLU A OE2 1 ATOM 541 N N . ASP A 1 87 ? -10.658 19.468 30.290 1.00 55.81 ? 122 ASP A N 1 ATOM 542 C CA . ASP A 1 87 ? -11.229 20.521 29.454 1.00 55.35 ? 122 ASP A CA 1 ATOM 543 C C . ASP A 1 87 ? -10.205 21.254 28.590 1.00 57.47 ? 122 ASP A C 1 ATOM 544 O O . ASP A 1 87 ? -10.578 22.063 27.742 1.00 58.11 ? 122 ASP A O 1 ATOM 545 C CB . ASP A 1 87 ? -11.965 21.542 30.323 1.00 58.40 ? 122 ASP A CB 1 ATOM 546 C CG . ASP A 1 87 ? -11.021 22.419 31.115 1.00 59.18 ? 122 ASP A CG 1 ATOM 547 O OD1 . ASP A 1 87 ? -9.867 22.002 31.346 1.00 60.53 ? 122 ASP A OD1 1 ATOM 548 O OD2 . ASP A 1 87 ? -11.431 23.528 31.512 1.00 61.60 ? 122 ASP A OD2 1 ATOM 549 N N . CYS A 1 88 ? -8.923 20.978 28.817 1.00 57.13 ? 123 CYS A N 1 ATOM 550 C CA . CYS A 1 88 ? -7.848 21.769 28.218 1.00 48.76 ? 123 CYS A CA 1 ATOM 551 C C . CYS A 1 88 ? -7.899 21.780 26.695 1.00 47.94 ? 123 CYS A C 1 ATOM 552 O O . CYS A 1 88 ? -7.539 22.770 26.063 1.00 51.87 ? 123 CYS A O 1 ATOM 553 C CB . CYS A 1 88 ? -6.472 21.296 28.709 1.00 49.65 ? 123 CYS A CB 1 ATOM 554 S SG . CYS A 1 88 ? -5.845 19.763 27.962 1.00 45.77 ? 123 CYS A SG 1 ATOM 555 N N . LEU A 1 89 ? -8.354 20.677 26.116 1.00 57.07 ? 124 LEU A N 1 ATOM 556 C CA . LEU A 1 89 ? -8.384 20.517 24.666 1.00 55.64 ? 124 LEU A CA 1 ATOM 557 C C . LEU A 1 89 ? -9.235 21.568 23.951 1.00 57.37 ? 124 LEU A C 1 ATOM 558 O O . LEU A 1 89 ? -8.771 22.215 23.015 1.00 62.72 ? 124 LEU A O 1 ATOM 559 C CB . LEU A 1 89 ? -8.858 19.110 24.304 1.00 56.94 ? 124 LEU A CB 1 ATOM 560 C CG . LEU A 1 89 ? -8.244 18.532 23.031 1.00 56.41 ? 124 LEU A CG 1 ATOM 561 C CD1 . LEU A 1 89 ? -6.722 18.554 23.118 1.00 49.09 ? 124 LEU A CD1 1 ATOM 562 C CD2 . LEU A 1 89 ? -8.749 17.123 22.801 1.00 60.10 ? 124 LEU A CD2 1 ATOM 563 N N . SER A 1 90 ? -10.478 21.732 24.392 1.00 63.13 ? 125 SER A N 1 ATOM 564 C CA . SER A 1 90 ? -11.368 22.734 23.812 1.00 65.42 ? 125 SER A CA 1 ATOM 565 C C . SER A 1 90 ? -10.950 24.132 24.255 1.00 61.91 ? 125 SER A C 1 ATOM 566 O O . SER A 1 90 ? -11.266 25.127 23.602 1.00 66.91 ? 125 SER A O 1 ATOM 567 C CB . SER A 1 90 ? -12.814 22.469 24.229 1.00 68.92 ? 125 SER A CB 1 ATOM 568 O OG . SER A 1 90 ? -12.945 22.512 25.641 1.00 63.48 ? 125 SER A OG 1 ATOM 569 N N . ARG A 1 91 ? -10.237 24.199 25.374 1.00 60.39 ? 126 ARG A N 1 ATOM 570 C CA . ARG A 1 91 ? -9.755 25.469 25.900 1.00 59.11 ? 126 ARG A CA 1 ATOM 571 C C . ARG A 1 91 ? -8.502 25.931 25.148 1.00 55.04 ? 126 ARG A C 1 ATOM 572 O O . ARG A 1 91 ? -8.141 27.108 25.185 1.00 51.26 ? 126 ARG A O 1 ATOM 573 C CB . ARG A 1 91 ? -9.465 25.335 27.391 1.00 56.87 ? 126 ARG A CB 1 ATOM 574 C CG . ARG A 1 91 ? -9.510 26.638 28.143 1.00 61.06 ? 126 ARG A CG 1 ATOM 575 C CD . ARG A 1 91 ? -10.452 26.513 29.314 1.00 58.86 ? 126 ARG A CD 1 ATOM 576 N NE . ARG A 1 91 ? -10.361 27.655 30.215 1.00 67.66 ? 126 ARG A NE 1 ATOM 577 C CZ . ARG A 1 91 ? -10.966 27.713 31.396 1.00 71.57 ? 126 ARG A CZ 1 ATOM 578 N NH1 . ARG A 1 91 ? -11.705 26.690 31.815 1.00 66.33 ? 126 ARG A NH1 1 ATOM 579 N NH2 . ARG A 1 91 ? -10.831 28.789 32.161 1.00 75.32 ? 126 ARG A NH2 1 ATOM 580 N N . GLY A 1 92 ? -7.849 24.990 24.468 1.00 51.16 ? 127 GLY A N 1 ATOM 581 C CA . GLY A 1 92 ? -6.695 25.289 23.632 1.00 51.42 ? 127 GLY A CA 1 ATOM 582 C C . GLY A 1 92 ? -5.380 25.526 24.365 1.00 49.13 ? 127 GLY A C 1 ATOM 583 O O . GLY A 1 92 ? -4.455 26.116 23.807 1.00 48.07 ? 127 GLY A O 1 ATOM 584 N N . ASP A 1 93 ? -5.283 25.069 25.610 1.00 47.85 ? 128 ASP A N 1 ATOM 585 C CA . ASP A 1 93 ? -4.062 25.280 26.381 1.00 41.93 ? 128 ASP A CA 1 ATOM 586 C C . ASP A 1 93 ? -3.552 24.044 27.108 1.00 37.19 ? 128 ASP A C 1 ATOM 587 O O . ASP A 1 93 ? -3.050 24.146 28.222 1.00 39.35 ? 128 ASP A O 1 ATOM 588 C CB . ASP A 1 93 ? -4.226 26.439 27.366 1.00 48.37 ? 128 ASP A CB 1 ATOM 589 C CG . ASP A 1 93 ? -5.454 26.300 28.248 1.00 52.86 ? 128 ASP A CG 1 ATOM 590 O OD1 . ASP A 1 93 ? -5.970 25.171 28.415 1.00 45.75 ? 128 ASP A OD1 1 ATOM 591 O OD2 . ASP A 1 93 ? -5.900 27.336 28.790 1.00 55.58 ? 128 ASP A OD2 1 ATOM 592 N N . CYS A 1 94 ? -3.686 22.881 26.479 1.00 37.93 ? 129 CYS A N 1 ATOM 593 C CA . CYS A 1 94 ? -3.026 21.679 26.966 1.00 36.30 ? 129 CYS A CA 1 ATOM 594 C C . CYS A 1 94 ? -1.528 21.825 26.764 1.00 40.02 ? 129 CYS A C 1 ATOM 595 O O . CYS A 1 94 ? -1.086 22.518 25.839 1.00 35.94 ? 129 CYS A O 1 ATOM 596 C CB . CYS A 1 94 ? -3.465 20.451 26.168 1.00 38.69 ? 129 CYS A CB 1 ATOM 597 S SG . CYS A 1 94 ? -5.229 20.145 26.063 1.00 47.92 ? 129 CYS A SG 1 ATOM 598 N N . CYS A 1 95 ? -0.750 21.159 27.615 1.00 35.99 ? 130 CYS A N 1 ATOM 599 C CA . CYS A 1 95 ? 0.652 20.895 27.299 1.00 31.26 ? 130 CYS A CA 1 ATOM 600 C C . CYS A 1 95 ? 0.643 20.129 25.991 1.00 34.52 ? 130 CYS A C 1 ATOM 601 O O . CYS A 1 95 ? -0.325 19.431 25.695 1.00 30.40 ? 130 CYS A O 1 ATOM 602 C CB . CYS A 1 95 ? 1.303 20.061 28.396 1.00 37.25 ? 130 CYS A CB 1 ATOM 603 S SG . CYS A 1 95 ? 1.185 20.801 30.040 1.00 35.74 ? 130 CYS A SG 1 ATOM 604 N N . THR A 1 96 ? 1.704 20.252 25.195 1.00 29.35 ? 131 THR A N 1 ATOM 605 C CA . THR A 1 96 ? 1.664 19.700 23.837 1.00 30.43 ? 131 THR A CA 1 ATOM 606 C C . THR A 1 96 ? 1.661 18.172 23.811 1.00 30.93 ? 131 THR A C 1 ATOM 607 O O . THR A 1 96 ? 1.242 17.572 22.817 1.00 30.25 ? 131 THR A O 1 ATOM 608 C CB . THR A 1 96 ? 2.809 20.238 22.950 1.00 22.84 ? 131 THR A CB 1 ATOM 609 O OG1 . THR A 1 96 ? 4.071 19.808 23.479 1.00 29.56 ? 131 THR A OG1 1 ATOM 610 C CG2 . THR A 1 96 ? 2.777 21.756 22.946 1.00 25.15 ? 131 THR A CG2 1 ATOM 611 N N . ASN A 1 97 ? 2.118 17.554 24.902 1.00 31.10 ? 132 ASN A N 1 ATOM 612 C CA . ASN A 1 97 ? 2.177 16.094 24.991 1.00 30.90 ? 132 ASN A CA 1 ATOM 613 C C . ASN A 1 97 ? 0.997 15.491 25.758 1.00 42.12 ? 132 ASN A C 1 ATOM 614 O O . ASN A 1 97 ? 1.010 14.296 26.092 1.00 37.02 ? 132 ASN A O 1 ATOM 615 C CB . ASN A 1 97 ? 3.473 15.654 25.663 1.00 35.18 ? 132 ASN A CB 1 ATOM 616 C CG . ASN A 1 97 ? 3.445 15.862 27.163 1.00 35.88 ? 132 ASN A CG 1 ATOM 617 O OD1 . ASN A 1 97 ? 2.766 16.755 27.665 1.00 37.73 ? 132 ASN A OD1 1 ATOM 618 N ND2 . ASN A 1 97 ? 4.195 15.047 27.883 1.00 36.47 ? 132 ASN A ND2 1 ATOM 619 N N . TYR A 1 98 ? -0.002 16.324 26.048 1.00 38.22 ? 133 TYR A N 1 ATOM 620 C CA . TYR A 1 98 ? -1.184 15.911 26.811 1.00 39.16 ? 133 TYR A CA 1 ATOM 621 C C . TYR A 1 98 ? -1.790 14.586 26.342 1.00 41.59 ? 133 TYR A C 1 ATOM 622 O O . TYR A 1 98 ? -1.918 13.650 27.125 1.00 44.74 ? 133 TYR A O 1 ATOM 623 C CB . TYR A 1 98 ? -2.246 17.019 26.787 1.00 37.97 ? 133 TYR A CB 1 ATOM 624 C CG . TYR A 1 98 ? -3.617 16.577 27.266 1.00 40.10 ? 133 TYR A CG 1 ATOM 625 C CD1 . TYR A 1 98 ? -3.820 16.155 28.576 1.00 41.62 ? 133 TYR A CD1 1 ATOM 626 C CD2 . TYR A 1 98 ? -4.702 16.586 26.406 1.00 40.81 ? 133 TYR A CD2 1 ATOM 627 C CE1 . TYR A 1 98 ? -5.073 15.748 29.006 1.00 51.96 ? 133 TYR A CE1 1 ATOM 628 C CE2 . TYR A 1 98 ? -5.951 16.186 26.822 1.00 45.49 ? 133 TYR A CE2 1 ATOM 629 C CZ . TYR A 1 98 ? -6.135 15.768 28.121 1.00 47.06 ? 133 TYR A CZ 1 ATOM 630 O OH . TYR A 1 98 ? -7.387 15.373 28.520 1.00 49.52 ? 133 TYR A OH 1 ATOM 631 N N . GLN A 1 99 ? -2.141 14.508 25.063 1.00 39.33 ? 134 GLN A N 1 ATOM 632 C CA . GLN A 1 99 ? -2.801 13.327 24.521 1.00 41.86 ? 134 GLN A CA 1 ATOM 633 C C . GLN A 1 99 ? -1.939 12.075 24.528 1.00 46.68 ? 134 GLN A C 1 ATOM 634 O O . GLN A 1 99 ? -2.456 10.969 24.674 1.00 49.71 ? 134 GLN A O 1 ATOM 635 C CB . GLN A 1 99 ? -3.280 13.582 23.100 1.00 40.85 ? 134 GLN A CB 1 ATOM 636 C CG . GLN A 1 99 ? -4.491 14.468 23.009 1.00 42.85 ? 134 GLN A CG 1 ATOM 637 C CD . GLN A 1 99 ? -5.056 14.472 21.611 1.00 51.19 ? 134 GLN A CD 1 ATOM 638 O OE1 . GLN A 1 99 ? -4.312 14.372 20.630 1.00 45.25 ? 134 GLN A OE1 1 ATOM 639 N NE2 . GLN A 1 99 ? -6.378 14.560 21.507 1.00 49.96 ? 134 GLN A NE2 1 ATOM 640 N N . VAL A 1 100 ? -0.635 12.240 24.337 1.00 39.50 ? 135 VAL A N 1 ATOM 641 C CA . VAL A 1 100 ? 0.282 11.110 24.417 1.00 43.39 ? 135 VAL A CA 1 ATOM 642 C C . VAL A 1 100 ? 0.326 10.553 25.841 1.00 46.08 ? 135 VAL A C 1 ATOM 643 O O . VAL A 1 100 ? 0.246 9.346 26.053 1.00 42.68 ? 135 VAL A O 1 ATOM 644 C CB . VAL A 1 100 ? 1.710 11.505 23.979 1.00 36.13 ? 135 VAL A CB 1 ATOM 645 C CG1 . VAL A 1 100 ? 2.657 10.305 24.085 1.00 38.79 ? 135 VAL A CG1 1 ATOM 646 C CG2 . VAL A 1 100 ? 1.698 12.049 22.560 1.00 41.20 ? 135 VAL A CG2 1 ATOM 647 N N . VAL A 1 101 ? 0.448 11.441 26.818 1.00 39.19 ? 136 VAL A N 1 ATOM 648 C CA . VAL A 1 101 ? 0.577 11.019 28.205 1.00 47.99 ? 136 VAL A CA 1 ATOM 649 C C . VAL A 1 101 ? -0.754 10.554 28.803 1.00 51.70 ? 136 VAL A C 1 ATOM 650 O O . VAL A 1 101 ? -0.786 9.604 29.586 1.00 53.90 ? 136 VAL A O 1 ATOM 651 C CB . VAL A 1 101 ? 1.196 12.138 29.073 1.00 47.71 ? 136 VAL A CB 1 ATOM 652 C CG1 . VAL A 1 101 ? 1.091 11.806 30.561 1.00 50.22 ? 136 VAL A CG1 1 ATOM 653 C CG2 . VAL A 1 101 ? 2.649 12.370 28.675 1.00 39.46 ? 136 VAL A CG2 1 ATOM 654 N N . CYS A 1 102 ? -1.847 11.206 28.412 1.00 45.74 ? 137 CYS A N 1 ATOM 655 C CA . CYS A 1 102 ? -3.135 11.014 29.079 1.00 47.20 ? 137 CYS A CA 1 ATOM 656 C C . CYS A 1 102 ? -4.212 10.305 28.249 1.00 52.20 ? 137 CYS A C 1 ATOM 657 O O . CYS A 1 102 ? -5.246 9.909 28.788 1.00 53.53 ? 137 CYS A O 1 ATOM 658 C CB . CYS A 1 102 ? -3.686 12.361 29.552 1.00 49.54 ? 137 CYS A CB 1 ATOM 659 S SG . CYS A 1 102 ? -2.622 13.257 30.699 1.00 49.23 ? 137 CYS A SG 1 ATOM 660 N N . LYS A 1 103 ? -3.986 10.156 26.947 1.00 48.80 ? 138 LYS A N 1 ATOM 661 C CA . LYS A 1 103 ? -5.028 9.639 26.059 1.00 48.10 ? 138 LYS A CA 1 ATOM 662 C C . LYS A 1 103 ? -4.520 8.576 25.090 1.00 47.01 ? 138 LYS A C 1 ATOM 663 O O . LYS A 1 103 ? -5.190 8.255 24.106 1.00 49.42 ? 138 LYS A O 1 ATOM 664 C CB . LYS A 1 103 ? -5.685 10.777 25.268 1.00 45.00 ? 138 LYS A CB 1 ATOM 665 C CG . LYS A 1 103 ? -6.350 11.852 26.114 1.00 51.11 ? 138 LYS A CG 1 ATOM 666 C CD . LYS A 1 103 ? -7.577 11.324 26.856 1.00 50.16 ? 138 LYS A CD 1 ATOM 667 C CE . LYS A 1 103 ? -8.274 12.443 27.612 1.00 52.03 ? 138 LYS A CE 1 ATOM 668 N NZ . LYS A 1 103 ? -9.356 11.954 28.508 1.00 56.82 ? 138 LYS A NZ 1 ATOM 669 N N . GLY A 1 104 ? -3.332 8.044 25.359 1.00 48.50 ? 139 GLY A N 1 ATOM 670 C CA . GLY A 1 104 ? -2.792 6.948 24.573 1.00 46.41 ? 139 GLY A CA 1 ATOM 671 C C . GLY A 1 104 ? -2.397 7.242 23.132 1.00 51.22 ? 139 GLY A C 1 ATOM 672 O O . GLY A 1 104 ? -2.184 6.313 22.352 1.00 45.20 ? 139 GLY A O 1 ATOM 673 N N . GLU A 1 105 ? -2.288 8.516 22.765 1.00 49.21 ? 140 GLU A N 1 ATOM 674 C CA . GLU A 1 105 ? -1.817 8.856 21.420 1.00 46.80 ? 140 GLU A CA 1 ATOM 675 C C . GLU A 1 105 ? -0.297 8.754 21.272 1.00 39.42 ? 140 GLU A C 1 ATOM 676 O O . GLU A 1 105 ? 0.431 8.678 22.255 1.00 41.58 ? 140 GLU A O 1 ATOM 677 C CB . GLU A 1 105 ? -2.305 10.243 20.989 1.00 46.46 ? 140 GLU A CB 1 ATOM 678 C CG . GLU A 1 105 ? -3.577 10.211 20.163 1.00 49.70 ? 140 GLU A CG 1 ATOM 679 C CD . GLU A 1 105 ? -3.351 9.716 18.735 1.00 57.36 ? 140 GLU A CD 1 ATOM 680 O OE1 . GLU A 1 105 ? -2.194 9.392 18.365 1.00 45.68 ? 140 GLU A OE1 1 ATOM 681 O OE2 . GLU A 1 105 ? -4.344 9.655 17.978 1.00 57.40 ? 140 GLU A OE2 1 ATOM 682 N N . SER A 1 106 ? 0.170 8.741 20.028 1.00 38.13 ? 141 SER A N 1 ATOM 683 C CA . SER A 1 106 ? 1.595 8.703 19.742 1.00 37.43 ? 141 SER A CA 1 ATOM 684 C C . SER A 1 106 ? 2.096 10.105 19.421 1.00 40.70 ? 141 SER A C 1 ATOM 685 O O . SER A 1 106 ? 1.333 10.936 18.921 1.00 33.95 ? 141 SER A O 1 ATOM 686 C CB . SER A 1 106 ? 1.858 7.788 18.550 1.00 36.20 ? 141 SER A CB 1 ATOM 687 O OG . SER A 1 106 ? 1.061 8.164 17.432 1.00 38.97 ? 141 SER A OG 1 ATOM 688 N N . HIS A 1 107 ? 3.369 10.367 19.707 1.00 32.29 ? 142 HIS A N 1 ATOM 689 C CA . HIS A 1 107 ? 4.011 11.598 19.228 1.00 37.92 ? 142 HIS A CA 1 ATOM 690 C C . HIS A 1 107 ? 3.958 11.651 17.704 1.00 31.17 ? 142 HIS A C 1 ATOM 691 O O . HIS A 1 107 ? 3.984 10.619 17.041 1.00 32.05 ? 142 HIS A O 1 ATOM 692 C CB . HIS A 1 107 ? 5.472 11.667 19.664 1.00 33.20 ? 142 HIS A CB 1 ATOM 693 C CG . HIS A 1 107 ? 5.668 11.866 21.130 1.00 35.21 ? 142 HIS A CG 1 ATOM 694 N ND1 . HIS A 1 107 ? 5.451 13.077 21.752 1.00 34.34 ? 142 HIS A ND1 1 ATOM 695 C CD2 . HIS A 1 107 ? 6.109 11.022 22.093 1.00 31.50 ? 142 HIS A CD2 1 ATOM 696 C CE1 . HIS A 1 107 ? 5.727 12.963 23.039 1.00 39.03 ? 142 HIS A CE1 1 ATOM 697 N NE2 . HIS A 1 107 ? 6.130 11.727 23.271 1.00 32.96 ? 142 HIS A NE2 1 ATOM 698 N N . TRP A 1 108 ? 3.896 12.860 17.150 1.00 34.20 ? 143 TRP A N 1 ATOM 699 C CA . TRP A 1 108 ? 3.844 13.049 15.705 1.00 32.47 ? 143 TRP A CA 1 ATOM 700 C C . TRP A 1 108 ? 5.024 12.387 15.024 1.00 29.27 ? 143 TRP A C 1 ATOM 701 O O . TRP A 1 108 ? 4.886 11.805 13.936 1.00 31.40 ? 143 TRP A O 1 ATOM 702 C CB . TRP A 1 108 ? 3.825 14.554 15.365 1.00 26.53 ? 143 TRP A CB 1 ATOM 703 C CG . TRP A 1 108 ? 3.993 14.881 13.916 1.00 27.31 ? 143 TRP A CG 1 ATOM 704 C CD1 . TRP A 1 108 ? 3.027 14.911 12.962 1.00 24.39 ? 143 TRP A CD1 1 ATOM 705 C CD2 . TRP A 1 108 ? 5.204 15.289 13.274 1.00 23.02 ? 143 TRP A CD2 1 ATOM 706 N NE1 . TRP A 1 108 ? 3.565 15.296 11.747 1.00 26.11 ? 143 TRP A NE1 1 ATOM 707 C CE2 . TRP A 1 108 ? 4.903 15.528 11.920 1.00 25.72 ? 143 TRP A CE2 1 ATOM 708 C CE3 . TRP A 1 108 ? 6.523 15.451 13.711 1.00 27.90 ? 143 TRP A CE3 1 ATOM 709 C CZ2 . TRP A 1 108 ? 5.868 15.928 11.005 1.00 28.50 ? 143 TRP A CZ2 1 ATOM 710 C CZ3 . TRP A 1 108 ? 7.474 15.859 12.798 1.00 25.33 ? 143 TRP A CZ3 1 ATOM 711 C CH2 . TRP A 1 108 ? 7.146 16.083 11.465 1.00 24.63 ? 143 TRP A CH2 1 ATOM 712 N N . VAL A 1 109 ? 6.182 12.462 15.672 1.00 25.38 ? 144 VAL A N 1 ATOM 713 C CA . VAL A 1 109 ? 7.408 11.972 15.056 1.00 29.15 ? 144 VAL A CA 1 ATOM 714 C C . VAL A 1 109 ? 7.404 10.448 14.880 1.00 34.87 ? 144 VAL A C 1 ATOM 715 O O . VAL A 1 109 ? 8.066 9.923 13.988 1.00 30.83 ? 144 VAL A O 1 ATOM 716 C CB . VAL A 1 109 ? 8.668 12.439 15.816 1.00 29.67 ? 144 VAL A CB 1 ATOM 717 C CG1 . VAL A 1 109 ? 8.771 11.769 17.158 1.00 26.33 ? 144 VAL A CG1 1 ATOM 718 C CG2 . VAL A 1 109 ? 9.927 12.207 14.967 1.00 28.01 ? 144 VAL A CG2 1 ATOM 719 N N . ASP A 1 110 ? 6.626 9.749 15.700 1.00 34.41 ? 145 ASP A N 1 ATOM 720 C CA . ASP A 1 110 ? 6.563 8.286 15.636 1.00 34.35 ? 145 ASP A CA 1 ATOM 721 C C . ASP A 1 110 ? 5.550 7.811 14.600 1.00 41.04 ? 145 ASP A C 1 ATOM 722 O O . ASP A 1 110 ? 5.479 6.618 14.278 1.00 41.66 ? 145 ASP A O 1 ATOM 723 C CB . ASP A 1 110 ? 6.240 7.702 17.016 1.00 32.17 ? 145 ASP A CB 1 ATOM 724 C CG . ASP A 1 110 ? 7.295 8.043 18.058 1.00 35.38 ? 145 ASP A CG 1 ATOM 725 O OD1 . ASP A 1 110 ? 8.505 7.884 17.783 1.00 42.91 ? 145 ASP A OD1 1 ATOM 726 O OD2 . ASP A 1 110 ? 6.920 8.485 19.156 1.00 38.33 ? 145 ASP A OD2 1 ATOM 727 N N . ASP A 1 111 ? 4.767 8.744 14.070 1.00 36.83 ? 146 ASP A N 1 ATOM 728 C CA . ASP A 1 111 ? 3.818 8.413 13.016 1.00 39.53 ? 146 ASP A CA 1 ATOM 729 C C . ASP A 1 111 ? 4.486 8.311 11.665 1.00 40.92 ? 146 ASP A C 1 ATOM 730 O O . ASP A 1 111 ? 5.361 9.108 11.318 1.00 34.22 ? 146 ASP A O 1 ATOM 731 C CB . ASP A 1 111 ? 2.695 9.440 12.937 1.00 33.10 ? 146 ASP A CB 1 ATOM 732 C CG . ASP A 1 111 ? 1.846 9.452 14.177 1.00 41.59 ? 146 ASP A CG 1 ATOM 733 O OD1 . ASP A 1 111 ? 1.923 8.470 14.948 1.00 35.23 ? 146 ASP A OD1 1 ATOM 734 O OD2 . ASP A 1 111 ? 1.100 10.432 14.375 1.00 44.14 ? 146 ASP A OD2 1 ATOM 735 N N . ASP A 1 112 ? 4.050 7.331 10.891 1.00 41.42 ? 147 ASP A N 1 ATOM 736 C CA . ASP A 1 112 ? 4.592 7.139 9.566 1.00 38.66 ? 147 ASP A CA 1 ATOM 737 C C . ASP A 1 112 ? 4.282 8.342 8.708 1.00 41.55 ? 147 ASP A C 1 ATOM 738 O O . ASP A 1 112 ? 3.246 8.990 8.869 1.00 39.31 ? 147 ASP A O 1 ATOM 739 C CB . ASP A 1 112 ? 4.012 5.880 8.926 1.00 49.31 ? 147 ASP A CB 1 ATOM 740 C CG . ASP A 1 112 ? 4.591 4.607 9.518 1.00 50.34 ? 147 ASP A CG 1 ATOM 741 O OD1 . ASP A 1 112 ? 5.616 4.691 10.231 1.00 47.42 ? 147 ASP A OD1 1 ATOM 742 O OD2 . ASP A 1 112 ? 4.029 3.523 9.252 1.00 57.77 ? 147 ASP A OD2 1 ATOM 743 N N . CYS A 1 113 ? 5.195 8.647 7.800 1.00 37.30 ? 148 CYS A N 1 ATOM 744 C CA A CYS A 1 113 ? 4.973 9.731 6.860 0.50 37.20 ? 148 CYS A CA 1 ATOM 745 C CA B CYS A 1 113 ? 4.998 9.722 6.844 0.50 37.21 ? 148 CYS A CA 1 ATOM 746 C C . CYS A 1 113 ? 3.930 9.320 5.837 1.00 42.72 ? 148 CYS A C 1 ATOM 747 O O . CYS A 1 113 ? 3.937 8.195 5.328 1.00 35.59 ? 148 CYS A O 1 ATOM 748 C CB A CYS A 1 113 ? 6.279 10.123 6.174 0.50 37.12 ? 148 CYS A CB 1 ATOM 749 C CB B CYS A 1 113 ? 6.313 10.023 6.125 0.50 37.12 ? 148 CYS A CB 1 ATOM 750 S SG A CYS A 1 113 ? 7.561 10.580 7.350 0.50 43.75 ? 148 CYS A SG 1 ATOM 751 S SG B CYS A 1 113 ? 6.157 11.115 4.714 0.50 35.11 ? 148 CYS A SG 1 ATOM 752 N N . GLU A 1 114 ? 3.022 10.238 5.551 1.00 36.23 ? 149 GLU A N 1 ATOM 753 C CA . GLU A 1 114 ? 1.942 9.971 4.631 1.00 36.77 ? 149 GLU A CA 1 ATOM 754 C C . GLU A 1 114 ? 1.702 11.238 3.839 1.00 39.23 ? 149 GLU A C 1 ATOM 755 O O . GLU A 1 114 ? 1.639 12.332 4.409 1.00 39.83 ? 149 GLU A O 1 ATOM 756 C CB . GLU A 1 114 ? 0.684 9.595 5.414 1.00 43.43 ? 149 GLU A CB 1 ATOM 757 C CG . GLU A 1 114 ? -0.584 9.551 4.577 1.00 46.69 ? 149 GLU A CG 1 ATOM 758 C CD . GLU A 1 114 ? -1.831 9.391 5.428 1.00 57.97 ? 149 GLU A CD 1 ATOM 759 O OE1 . GLU A 1 114 ? -1.703 9.389 6.673 1.00 58.42 ? 149 GLU A OE1 1 ATOM 760 O OE2 . GLU A 1 114 ? -2.939 9.267 4.854 1.00 62.42 ? 149 GLU A OE2 1 ATOM 761 N N . GLU A 1 115 ? 1.563 11.097 2.528 1.00 30.97 ? 150 GLU A N 1 ATOM 762 C CA . GLU A 1 115 ? 1.389 12.258 1.677 1.00 34.32 ? 150 GLU A CA 1 ATOM 763 C C . GLU A 1 115 ? 0.124 13.044 2.031 1.00 42.56 ? 150 GLU A C 1 ATOM 764 O O . GLU A 1 115 ? -0.940 12.474 2.284 1.00 36.06 ? 150 GLU A O 1 ATOM 765 C CB . GLU A 1 115 ? 1.387 11.851 0.207 1.00 37.24 ? 150 GLU A CB 1 ATOM 766 C CG . GLU A 1 115 ? 1.320 13.024 -0.752 1.00 37.21 ? 150 GLU A CG 1 ATOM 767 C CD . GLU A 1 115 ? 1.303 12.584 -2.204 1.00 45.87 ? 150 GLU A CD 1 ATOM 768 O OE1 . GLU A 1 115 ? 1.073 11.382 -2.456 1.00 49.10 ? 150 GLU A OE1 1 ATOM 769 O OE2 . GLU A 1 115 ? 1.516 13.441 -3.090 1.00 40.31 ? 150 GLU A OE2 1 ATOM 770 N N . ILE A 1 116 ? 0.259 14.363 2.079 1.00 35.32 ? 151 ILE A N 1 ATOM 771 C CA . ILE A 1 116 ? -0.881 15.233 2.291 1.00 35.79 ? 151 ILE A CA 1 ATOM 772 C C . ILE A 1 116 ? -1.209 15.867 0.946 1.00 39.48 ? 151 ILE A C 1 ATOM 773 O O . ILE A 1 116 ? -0.586 16.854 0.549 1.00 39.51 ? 151 ILE A O 1 ATOM 774 C CB . ILE A 1 116 ? -0.546 16.332 3.317 1.00 36.50 ? 151 ILE A CB 1 ATOM 775 C CG1 . ILE A 1 116 ? 0.022 15.714 4.592 1.00 35.04 ? 151 ILE A CG1 1 ATOM 776 C CG2 . ILE A 1 116 ? -1.773 17.178 3.628 1.00 33.37 ? 151 ILE A CG2 1 ATOM 777 C CD1 . ILE A 1 116 ? 0.643 16.728 5.539 1.00 37.13 ? 151 ILE A CD1 1 ATOM 778 N N . ARG A 1 117 ? -2.176 15.290 0.236 1.00 38.15 ? 152 ARG A N 1 ATOM 779 C CA . ARG A 1 117 ? -2.497 15.729 -1.118 1.00 41.74 ? 152 ARG A CA 1 ATOM 780 C C . ARG A 1 117 ? -3.414 16.948 -1.184 1.00 39.49 ? 152 ARG A C 1 ATOM 781 O O . ARG A 1 117 ? -3.375 17.703 -2.151 1.00 42.96 ? 152 ARG A O 1 ATOM 782 C CB . ARG A 1 117 ? -3.065 14.573 -1.948 1.00 45.82 ? 152 ARG A CB 1 ATOM 783 C CG . ARG A 1 117 ? -1.987 13.718 -2.591 1.00 51.39 ? 152 ARG A CG 1 ATOM 784 C CD . ARG A 1 117 ? -2.589 12.594 -3.403 1.00 54.84 ? 152 ARG A CD 1 ATOM 785 N NE . ARG A 1 117 ? -3.300 11.655 -2.544 1.00 59.64 ? 152 ARG A NE 1 ATOM 786 C CZ . ARG A 1 117 ? -4.391 10.991 -2.910 1.00 72.41 ? 152 ARG A CZ 1 ATOM 787 N NH1 . ARG A 1 117 ? -4.975 10.152 -2.065 1.00 81.72 ? 152 ARG A NH1 1 ATOM 788 N NH2 . ARG A 1 117 ? -4.901 11.170 -4.122 1.00 71.38 ? 152 ARG A NH2 1 ATOM 789 N N . VAL A 1 118 ? -4.247 17.128 -0.165 1.00 40.84 ? 153 VAL A N 1 ATOM 790 C CA . VAL A 1 118 ? -5.027 18.354 -0.015 1.00 38.61 ? 153 VAL A CA 1 ATOM 791 C C . VAL A 1 118 ? -5.055 18.711 1.459 1.00 33.89 ? 153 VAL A C 1 ATOM 792 O O . VAL A 1 118 ? -4.833 17.851 2.303 1.00 38.14 ? 153 VAL A O 1 ATOM 793 C CB . VAL A 1 118 ? -6.485 18.191 -0.503 1.00 43.62 ? 153 VAL A CB 1 ATOM 794 C CG1 . VAL A 1 118 ? -6.531 17.875 -1.985 1.00 46.35 ? 153 VAL A CG1 1 ATOM 795 C CG2 . VAL A 1 118 ? -7.200 17.132 0.311 1.00 43.15 ? 153 VAL A CG2 1 ATOM 796 N N . PRO A 1 119 ? -5.315 19.987 1.781 1.00 34.36 ? 154 PRO A N 1 ATOM 797 C CA . PRO A 1 119 ? -5.384 20.304 3.203 1.00 31.43 ? 154 PRO A CA 1 ATOM 798 C C . PRO A 1 119 ? -6.535 19.572 3.894 1.00 35.38 ? 154 PRO A C 1 ATOM 799 O O . PRO A 1 119 ? -7.646 19.502 3.364 1.00 36.34 ? 154 PRO A O 1 ATOM 800 C CB . PRO A 1 119 ? -5.626 21.822 3.216 1.00 35.00 ? 154 PRO A CB 1 ATOM 801 C CG . PRO A 1 119 ? -5.163 22.301 1.893 1.00 35.68 ? 154 PRO A CG 1 ATOM 802 C CD . PRO A 1 119 ? -5.466 21.187 0.940 1.00 34.60 ? 154 PRO A CD 1 ATOM 803 N N . GLU A 1 120 ? -6.239 19.013 5.061 1.00 34.81 ? 155 GLU A N 1 ATOM 804 C CA . GLU A 1 120 ? -7.234 18.409 5.929 1.00 34.29 ? 155 GLU A CA 1 ATOM 805 C C . GLU A 1 120 ? -7.364 19.304 7.150 1.00 32.65 ? 155 GLU A C 1 ATOM 806 O O . GLU A 1 120 ? -6.675 19.113 8.158 1.00 30.27 ? 155 GLU A O 1 ATOM 807 C CB . GLU A 1 120 ? -6.802 17.004 6.345 1.00 32.80 ? 155 GLU A CB 1 ATOM 808 C CG . GLU A 1 120 ? -6.648 16.047 5.172 1.00 40.21 ? 155 GLU A CG 1 ATOM 809 C CD . GLU A 1 120 ? -5.900 14.773 5.543 1.00 38.45 ? 155 GLU A CD 1 ATOM 810 O OE1 . GLU A 1 120 ? -5.808 14.461 6.752 1.00 39.09 ? 155 GLU A OE1 1 ATOM 811 O OE2 . GLU A 1 120 ? -5.391 14.096 4.621 1.00 42.51 ? 155 GLU A OE2 1 ATOM 812 N N . CYS A 1 121 ? -8.244 20.296 7.037 1.00 33.58 ? 156 CYS A N 1 ATOM 813 C CA . CYS A 1 121 ? -8.396 21.318 8.055 1.00 33.48 ? 156 CYS A CA 1 ATOM 814 C C . CYS A 1 121 ? -9.756 21.179 8.729 1.00 42.31 ? 156 CYS A C 1 ATOM 815 O O . CYS A 1 121 ? -10.697 20.664 8.125 1.00 38.11 ? 156 CYS A O 1 ATOM 816 C CB . CYS A 1 121 ? -8.253 22.711 7.422 1.00 34.40 ? 156 CYS A CB 1 ATOM 817 S SG . CYS A 1 121 ? -6.576 23.125 6.833 1.00 36.88 ? 156 CYS A SG 1 ATOM 818 N N . PRO A 1 122 ? -9.860 21.625 9.991 1.00 37.57 ? 157 PRO A N 1 ATOM 819 C CA . PRO A 1 122 ? -11.154 21.650 10.675 1.00 39.64 ? 157 PRO A CA 1 ATOM 820 C C . PRO A 1 122 ? -12.110 22.623 9.988 1.00 41.25 ? 157 PRO A C 1 ATOM 821 O O . PRO A 1 122 ? -11.682 23.483 9.221 1.00 38.35 ? 157 PRO A O 1 ATOM 822 C CB . PRO A 1 122 ? -10.802 22.156 12.078 1.00 40.10 ? 157 PRO A CB 1 ATOM 823 C CG . PRO A 1 122 ? -9.355 21.838 12.252 1.00 36.97 ? 157 PRO A CG 1 ATOM 824 C CD . PRO A 1 122 ? -8.756 22.004 10.888 1.00 34.45 ? 157 PRO A CD 1 ATOM 825 N N . ALA A 1 123 ? -13.402 22.472 10.245 1.00 46.12 ? 158 ALA A N 1 ATOM 826 C CA . ALA A 1 123 ? -14.376 23.401 9.691 1.00 48.95 ? 158 ALA A CA 1 ATOM 827 C C . ALA A 1 123 ? -14.085 24.790 10.239 1.00 42.26 ? 158 ALA A C 1 ATOM 828 O O . ALA A 1 123 ? -13.705 24.943 11.402 1.00 41.34 ? 158 ALA A O 1 ATOM 829 C CB . ALA A 1 123 ? -15.786 22.975 10.049 1.00 55.98 ? 158 ALA A CB 1 ATOM 830 N N . GLY A 1 124 ? -14.259 25.800 9.399 1.00 41.51 ? 159 GLY A N 1 ATOM 831 C CA . GLY A 1 124 ? -13.954 27.154 9.806 1.00 41.18 ? 159 GLY A CA 1 ATOM 832 C C . GLY A 1 124 ? -12.623 27.611 9.250 1.00 37.20 ? 159 GLY A C 1 ATOM 833 O O . GLY A 1 124 ? -12.372 28.808 9.165 1.00 39.74 ? 159 GLY A O 1 ATOM 834 N N . PHE A 1 125 ? -11.765 26.663 8.877 1.00 37.39 ? 160 PHE A N 1 ATOM 835 C CA . PHE A 1 125 ? -10.498 27.006 8.231 1.00 35.31 ? 160 PHE A CA 1 ATOM 836 C C . PHE A 1 125 ? -10.711 27.163 6.728 1.00 43.13 ? 160 PHE A C 1 ATOM 837 O O . PHE A 1 125 ? -11.131 26.229 6.050 1.00 49.16 ? 160 PHE A O 1 ATOM 838 C CB . PHE A 1 125 ? -9.424 25.956 8.519 1.00 32.23 ? 160 PHE A CB 1 ATOM 839 C CG . PHE A 1 125 ? -8.802 26.078 9.873 1.00 35.61 ? 160 PHE A CG 1 ATOM 840 C CD1 . PHE A 1 125 ? -9.543 25.838 11.018 1.00 34.36 ? 160 PHE A CD1 1 ATOM 841 C CD2 . PHE A 1 125 ? -7.464 26.407 10.004 1.00 36.29 ? 160 PHE A CD2 1 ATOM 842 C CE1 . PHE A 1 125 ? -8.972 25.944 12.268 1.00 36.47 ? 160 PHE A CE1 1 ATOM 843 C CE2 . PHE A 1 125 ? -6.889 26.521 11.256 1.00 33.82 ? 160 PHE A CE2 1 ATOM 844 C CZ . PHE A 1 125 ? -7.640 26.286 12.387 1.00 34.69 ? 160 PHE A CZ 1 ATOM 845 N N . VAL A 1 126 ? -10.416 28.354 6.216 1.00 39.07 ? 161 VAL A N 1 ATOM 846 C CA . VAL A 1 126 ? -10.692 28.692 4.830 1.00 41.94 ? 161 VAL A CA 1 ATOM 847 C C . VAL A 1 126 ? -9.477 28.400 3.959 1.00 41.76 ? 161 VAL A C 1 ATOM 848 O O . VAL A 1 126 ? -9.592 28.180 2.761 1.00 41.97 ? 161 VAL A O 1 ATOM 849 C CB . VAL A 1 126 ? -11.053 30.181 4.701 1.00 45.94 ? 161 VAL A CB 1 ATOM 850 C CG1 . VAL A 1 126 ? -11.611 30.476 3.319 1.00 54.07 ? 161 VAL A CG1 1 ATOM 851 C CG2 . VAL A 1 126 ? -12.059 30.587 5.791 1.00 44.40 ? 161 VAL A CG2 1 ATOM 852 N N . ARG A 1 127 ? -8.309 28.390 4.585 1.00 37.95 ? 162 ARG A N 1 ATOM 853 C CA . ARG A 1 127 ? -7.050 28.198 3.883 1.00 34.78 ? 162 ARG A CA 1 ATOM 854 C C . ARG A 1 127 ? -6.049 27.596 4.874 1.00 27.36 ? 162 ARG A C 1 ATOM 855 O O . ARG A 1 127 ? -6.211 27.751 6.080 1.00 27.68 ? 162 ARG A O 1 ATOM 856 C CB . ARG A 1 127 ? -6.558 29.546 3.331 1.00 32.70 ? 162 ARG A CB 1 ATOM 857 C CG . ARG A 1 127 ? -5.289 30.090 3.973 1.00 45.08 ? 162 ARG A CG 1 ATOM 858 C CD . ARG A 1 127 ? -5.523 31.431 4.663 1.00 44.56 ? 162 ARG A CD 1 ATOM 859 N NE . ARG A 1 127 ? -6.379 32.316 3.874 1.00 52.70 ? 162 ARG A NE 1 ATOM 860 C CZ . ARG A 1 127 ? -7.030 33.362 4.379 1.00 52.11 ? 162 ARG A CZ 1 ATOM 861 N NH1 . ARG A 1 127 ? -7.800 34.105 3.601 1.00 46.91 ? 162 ARG A NH1 1 ATOM 862 N NH2 . ARG A 1 127 ? -6.921 33.658 5.669 1.00 46.89 ? 162 ARG A NH2 1 ATOM 863 N N . PRO A 1 128 ? -5.031 26.882 4.373 1.00 31.35 ? 163 PRO A N 1 ATOM 864 C CA . PRO A 1 128 ? -4.032 26.327 5.287 1.00 28.77 ? 163 PRO A CA 1 ATOM 865 C C . PRO A 1 128 ? -3.225 27.466 5.915 1.00 23.54 ? 163 PRO A C 1 ATOM 866 O O . PRO A 1 128 ? -2.709 28.295 5.170 1.00 26.54 ? 163 PRO A O 1 ATOM 867 C CB . PRO A 1 128 ? -3.139 25.493 4.360 1.00 31.18 ? 163 PRO A CB 1 ATOM 868 C CG . PRO A 1 128 ? -3.334 26.065 3.007 1.00 36.12 ? 163 PRO A CG 1 ATOM 869 C CD . PRO A 1 128 ? -4.744 26.564 2.963 1.00 29.70 ? 163 PRO A CD 1 ATOM 870 N N . PRO A 1 129 ? -3.164 27.532 7.250 1.00 26.56 ? 164 PRO A N 1 ATOM 871 C CA . PRO A 1 129 ? -2.298 28.536 7.872 1.00 25.59 ? 164 PRO A CA 1 ATOM 872 C C . PRO A 1 129 ? -0.830 28.280 7.519 1.00 31.37 ? 164 PRO A C 1 ATOM 873 O O . PRO A 1 129 ? -0.462 27.147 7.161 1.00 23.71 ? 164 PRO A O 1 ATOM 874 C CB . PRO A 1 129 ? -2.511 28.301 9.361 1.00 24.50 ? 164 PRO A CB 1 ATOM 875 C CG . PRO A 1 129 ? -3.906 27.645 9.456 1.00 24.44 ? 164 PRO A CG 1 ATOM 876 C CD . PRO A 1 129 ? -3.898 26.739 8.257 1.00 25.12 ? 164 PRO A CD 1 ATOM 877 N N . LEU A 1 130 ? -0.014 29.328 7.616 1.00 21.90 ? 165 LEU A N 1 ATOM 878 C CA . LEU A 1 130 ? 1.422 29.220 7.364 1.00 20.48 ? 165 LEU A CA 1 ATOM 879 C C . LEU A 1 130 ? 2.176 29.478 8.659 1.00 22.37 ? 165 LEU A C 1 ATOM 880 O O . LEU A 1 130 ? 1.952 30.484 9.307 1.00 22.53 ? 165 LEU A O 1 ATOM 881 C CB . LEU A 1 130 ? 1.860 30.229 6.306 1.00 23.51 ? 165 LEU A CB 1 ATOM 882 C CG . LEU A 1 130 ? 3.370 30.305 6.120 1.00 19.73 ? 165 LEU A CG 1 ATOM 883 C CD1 . LEU A 1 130 ? 3.935 28.943 5.625 1.00 21.75 ? 165 LEU A CD1 1 ATOM 884 C CD2 . LEU A 1 130 ? 3.751 31.452 5.190 1.00 22.15 ? 165 LEU A CD2 1 ATOM 885 N N . ILE A 1 131 ? 3.052 28.559 9.055 1.00 20.07 ? 166 ILE A N 1 ATOM 886 C CA . ILE A 1 131 ? 3.894 28.794 10.219 1.00 17.31 ? 166 ILE A CA 1 ATOM 887 C C . ILE A 1 131 ? 5.356 28.801 9.783 1.00 24.46 ? 166 ILE A C 1 ATOM 888 O O . ILE A 1 131 ? 5.821 27.839 9.181 1.00 23.94 ? 166 ILE A O 1 ATOM 889 C CB . ILE A 1 131 ? 3.723 27.714 11.281 1.00 17.31 ? 166 ILE A CB 1 ATOM 890 C CG1 . ILE A 1 131 ? 2.281 27.691 11.802 1.00 20.49 ? 166 ILE A CG1 1 ATOM 891 C CG2 . ILE A 1 131 ? 4.678 27.969 12.446 1.00 22.38 ? 166 ILE A CG2 1 ATOM 892 C CD1 . ILE A 1 131 ? 2.048 26.652 12.879 1.00 28.38 ? 166 ILE A CD1 1 ATOM 893 N N . ILE A 1 132 ? 6.060 29.890 10.074 1.00 19.75 ? 167 ILE A N 1 ATOM 894 C CA . ILE A 1 132 ? 7.450 30.024 9.686 1.00 22.74 ? 167 ILE A CA 1 ATOM 895 C C . ILE A 1 132 ? 8.259 29.786 10.941 1.00 22.71 ? 167 ILE A C 1 ATOM 896 O O . ILE A 1 132 ? 8.125 30.507 11.915 1.00 26.32 ? 167 ILE A O 1 ATOM 897 C CB . ILE A 1 132 ? 7.734 31.424 9.169 1.00 20.32 ? 167 ILE A CB 1 ATOM 898 C CG1 . ILE A 1 132 ? 6.807 31.752 7.987 1.00 20.98 ? 167 ILE A CG1 1 ATOM 899 C CG2 . ILE A 1 132 ? 9.214 31.561 8.778 1.00 23.34 ? 167 ILE A CG2 1 ATOM 900 C CD1 . ILE A 1 132 ? 6.584 33.249 7.767 1.00 24.53 ? 167 ILE A CD1 1 ATOM 901 N N . PHE A 1 133 ? 9.082 28.749 10.924 1.00 18.36 ? 168 PHE A N 1 ATOM 902 C CA . PHE A 1 133 ? 9.854 28.379 12.088 1.00 16.66 ? 168 PHE A CA 1 ATOM 903 C C . PHE A 1 133 ? 11.301 28.744 11.738 1.00 19.50 ? 168 PHE A C 1 ATOM 904 O O . PHE A 1 133 ? 11.964 28.011 10.995 1.00 18.04 ? 168 PHE A O 1 ATOM 905 C CB . PHE A 1 133 ? 9.701 26.856 12.329 1.00 19.36 ? 168 PHE A CB 1 ATOM 906 C CG . PHE A 1 133 ? 10.250 26.383 13.650 1.00 20.57 ? 168 PHE A CG 1 ATOM 907 C CD1 . PHE A 1 133 ? 11.623 26.385 13.896 1.00 16.59 ? 168 PHE A CD1 1 ATOM 908 C CD2 . PHE A 1 133 ? 9.404 25.913 14.631 1.00 21.56 ? 168 PHE A CD2 1 ATOM 909 C CE1 . PHE A 1 133 ? 12.133 25.924 15.102 1.00 19.72 ? 168 PHE A CE1 1 ATOM 910 C CE2 . PHE A 1 133 ? 9.896 25.476 15.853 1.00 20.65 ? 168 PHE A CE2 1 ATOM 911 C CZ . PHE A 1 133 ? 11.268 25.471 16.091 1.00 19.69 ? 168 PHE A CZ 1 ATOM 912 N N . SER A 1 134 ? 11.787 29.879 12.249 1.00 20.22 ? 169 SER A N 1 ATOM 913 C CA A SER A 1 134 ? 13.137 30.339 11.926 0.50 19.05 ? 169 SER A CA 1 ATOM 914 C CA B SER A 1 134 ? 13.135 30.349 11.929 0.50 19.06 ? 169 SER A CA 1 ATOM 915 C C . SER A 1 134 ? 14.150 29.969 13.000 1.00 15.71 ? 169 SER A C 1 ATOM 916 O O . SER A 1 134 ? 13.904 30.143 14.199 1.00 18.09 ? 169 SER A O 1 ATOM 917 C CB A SER A 1 134 ? 13.160 31.853 11.732 0.50 21.30 ? 169 SER A CB 1 ATOM 918 C CB B SER A 1 134 ? 13.156 31.871 11.728 0.50 21.29 ? 169 SER A CB 1 ATOM 919 O OG A SER A 1 134 ? 12.708 32.495 12.903 0.50 16.47 ? 169 SER A OG 1 ATOM 920 O OG B SER A 1 134 ? 12.388 32.251 10.596 0.50 26.10 ? 169 SER A OG 1 ATOM 921 N N . VAL A 1 135 ? 15.302 29.473 12.558 1.00 16.89 ? 170 VAL A N 1 ATOM 922 C CA . VAL A 1 135 ? 16.362 29.113 13.476 1.00 15.71 ? 170 VAL A CA 1 ATOM 923 C C . VAL A 1 135 ? 17.623 29.898 13.118 1.00 15.34 ? 170 VAL A C 1 ATOM 924 O O . VAL A 1 135 ? 18.069 29.924 11.973 1.00 22.87 ? 170 VAL A O 1 ATOM 925 C CB . VAL A 1 135 ? 16.662 27.605 13.406 1.00 18.53 ? 170 VAL A CB 1 ATOM 926 C CG1 . VAL A 1 135 ? 15.615 26.813 14.214 1.00 21.06 ? 170 VAL A CG1 1 ATOM 927 C CG2 . VAL A 1 135 ? 16.658 27.151 11.966 1.00 17.73 ? 170 VAL A CG2 1 ATOM 928 N N . ASP A 1 136 ? 18.176 30.552 14.112 1.00 14.82 ? 171 ASP A N 1 ATOM 929 C CA . ASP A 1 136 ? 19.305 31.427 13.893 1.00 15.23 ? 171 ASP A CA 1 ATOM 930 C C . ASP A 1 136 ? 20.591 30.619 13.793 1.00 18.02 ? 171 ASP A C 1 ATOM 931 O O . ASP A 1 136 ? 20.898 29.805 14.667 1.00 19.95 ? 171 ASP A O 1 ATOM 932 C CB . ASP A 1 136 ? 19.398 32.416 15.054 1.00 14.77 ? 171 ASP A CB 1 ATOM 933 C CG . ASP A 1 136 ? 20.247 33.600 14.718 1.00 18.31 ? 171 ASP A CG 1 ATOM 934 O OD1 . ASP A 1 136 ? 21.341 33.404 14.144 1.00 19.30 ? 171 ASP A OD1 1 ATOM 935 O OD2 . ASP A 1 136 ? 19.800 34.733 14.992 1.00 22.86 ? 171 ASP A OD2 1 ATOM 936 N N . GLY A 1 137 ? 21.340 30.849 12.721 1.00 15.01 ? 172 GLY A N 1 ATOM 937 C CA . GLY A 1 137 ? 22.686 30.299 12.607 1.00 17.18 ? 172 GLY A CA 1 ATOM 938 C C . GLY A 1 137 ? 22.730 28.799 12.353 1.00 19.66 ? 172 GLY A C 1 ATOM 939 O O . GLY A 1 137 ? 23.727 28.125 12.649 1.00 19.17 ? 172 GLY A O 1 ATOM 940 N N . PHE A 1 138 ? 21.636 28.280 11.825 1.00 17.51 ? 173 PHE A N 1 ATOM 941 C CA . PHE A 1 138 ? 21.528 26.865 11.469 1.00 17.78 ? 173 PHE A CA 1 ATOM 942 C C . PHE A 1 138 ? 22.211 26.553 10.139 1.00 18.06 ? 173 PHE A C 1 ATOM 943 O O . PHE A 1 138 ? 21.635 26.698 9.061 1.00 20.04 ? 173 PHE A O 1 ATOM 944 C CB . PHE A 1 138 ? 20.060 26.470 11.407 1.00 20.15 ? 173 PHE A CB 1 ATOM 945 C CG . PHE A 1 138 ? 19.805 24.988 11.603 1.00 19.74 ? 173 PHE A CG 1 ATOM 946 C CD1 . PHE A 1 138 ? 20.144 24.074 10.608 1.00 23.91 ? 173 PHE A CD1 1 ATOM 947 C CD2 . PHE A 1 138 ? 19.191 24.521 12.761 1.00 23.61 ? 173 PHE A CD2 1 ATOM 948 C CE1 . PHE A 1 138 ? 19.876 22.705 10.764 1.00 22.61 ? 173 PHE A CE1 1 ATOM 949 C CE2 . PHE A 1 138 ? 18.930 23.149 12.925 1.00 25.51 ? 173 PHE A CE2 1 ATOM 950 C CZ . PHE A 1 138 ? 19.274 22.256 11.919 1.00 22.02 ? 173 PHE A CZ 1 ATOM 951 N N . ARG A 1 139 ? 23.465 26.134 10.228 1.00 20.50 ? 174 ARG A N 1 ATOM 952 C CA . ARG A 1 139 ? 24.250 25.784 9.060 1.00 19.87 ? 174 ARG A CA 1 ATOM 953 C C . ARG A 1 139 ? 23.617 24.601 8.337 1.00 22.54 ? 174 ARG A C 1 ATOM 954 O O . ARG A 1 139 ? 23.133 23.665 8.977 1.00 20.40 ? 174 ARG A O 1 ATOM 955 C CB . ARG A 1 139 ? 25.652 25.403 9.530 1.00 25.45 ? 174 ARG A CB 1 ATOM 956 C CG . ARG A 1 139 ? 26.628 25.248 8.414 1.00 27.15 ? 174 ARG A CG 1 ATOM 957 C CD . ARG A 1 139 ? 27.976 24.912 8.978 1.00 25.54 ? 174 ARG A CD 1 ATOM 958 N NE . ARG A 1 139 ? 28.788 24.284 7.962 1.00 24.33 ? 174 ARG A NE 1 ATOM 959 C CZ . ARG A 1 139 ? 30.108 24.338 7.931 1.00 22.95 ? 174 ARG A CZ 1 ATOM 960 N NH1 . ARG A 1 139 ? 30.762 25.043 8.839 1.00 21.39 ? 174 ARG A NH1 1 ATOM 961 N NH2 . ARG A 1 139 ? 30.755 23.717 6.959 1.00 29.21 ? 174 ARG A NH2 1 ATOM 962 N N . ALA A 1 140 ? 23.609 24.648 7.009 1.00 18.79 ? 175 ALA A N 1 ATOM 963 C CA . ALA A 1 140 ? 22.923 23.633 6.219 1.00 19.71 ? 175 ALA A CA 1 ATOM 964 C C . ALA A 1 140 ? 23.456 22.245 6.554 1.00 22.02 ? 175 ALA A C 1 ATOM 965 O O . ALA A 1 140 ? 22.694 21.286 6.638 1.00 21.47 ? 175 ALA A O 1 ATOM 966 C CB . ALA A 1 140 ? 23.083 23.905 4.747 1.00 20.24 ? 175 ALA A CB 1 ATOM 967 N N . SER A 1 141 ? 24.759 22.153 6.775 1.00 22.05 ? 176 SER A N 1 ATOM 968 C CA . SER A 1 141 ? 25.383 20.854 7.031 1.00 23.17 ? 176 SER A CA 1 ATOM 969 C C . SER A 1 141 ? 24.981 20.219 8.374 1.00 27.97 ? 176 SER A C 1 ATOM 970 O O . SER A 1 141 ? 25.199 19.022 8.577 1.00 27.79 ? 176 SER A O 1 ATOM 971 C CB . SER A 1 141 ? 26.916 20.921 6.846 1.00 23.94 ? 176 SER A CB 1 ATOM 972 O OG . SER A 1 141 ? 27.522 21.800 7.767 1.00 29.94 ? 176 SER A OG 1 ATOM 973 N N . TYR A 1 142 ? 24.367 20.992 9.279 1.00 22.81 ? 177 TYR A N 1 ATOM 974 C CA . TYR A 1 142 ? 23.852 20.393 10.522 1.00 24.88 ? 177 TYR A CA 1 ATOM 975 C C . TYR A 1 142 ? 22.776 19.347 10.251 1.00 26.53 ? 177 TYR A C 1 ATOM 976 O O . TYR A 1 142 ? 22.565 18.446 11.068 1.00 27.13 ? 177 TYR A O 1 ATOM 977 C CB . TYR A 1 142 ? 23.252 21.430 11.458 1.00 20.15 ? 177 TYR A CB 1 ATOM 978 C CG . TYR A 1 142 ? 24.215 22.406 12.058 1.00 22.16 ? 177 TYR A CG 1 ATOM 979 C CD1 . TYR A 1 142 ? 25.596 22.185 12.051 1.00 23.13 ? 177 TYR A CD1 1 ATOM 980 C CD2 . TYR A 1 142 ? 23.738 23.559 12.662 1.00 20.49 ? 177 TYR A CD2 1 ATOM 981 C CE1 . TYR A 1 142 ? 26.469 23.119 12.621 1.00 24.75 ? 177 TYR A CE1 1 ATOM 982 C CE2 . TYR A 1 142 ? 24.588 24.473 13.234 1.00 20.33 ? 177 TYR A CE2 1 ATOM 983 C CZ . TYR A 1 142 ? 25.946 24.259 13.215 1.00 21.57 ? 177 TYR A CZ 1 ATOM 984 O OH . TYR A 1 142 ? 26.749 25.222 13.798 1.00 20.22 ? 177 TYR A OH 1 ATOM 985 N N . MET A 1 143 ? 22.102 19.474 9.111 1.00 25.88 ? 178 MET A N 1 ATOM 986 C CA . MET A 1 143 ? 21.012 18.569 8.765 1.00 29.08 ? 178 MET A CA 1 ATOM 987 C C . MET A 1 143 ? 21.515 17.142 8.645 1.00 30.59 ? 178 MET A C 1 ATOM 988 O O . MET A 1 143 ? 20.763 16.196 8.881 1.00 35.59 ? 178 MET A O 1 ATOM 989 C CB . MET A 1 143 ? 20.322 18.979 7.454 1.00 28.20 ? 178 MET A CB 1 ATOM 990 C CG . MET A 1 143 ? 19.501 20.259 7.522 1.00 27.26 ? 178 MET A CG 1 ATOM 991 S SD . MET A 1 143 ? 18.203 20.182 8.786 1.00 39.71 ? 178 MET A SD 1 ATOM 992 C CE . MET A 1 143 ? 17.431 18.636 8.344 1.00 36.81 ? 178 MET A CE 1 ATOM 993 N N . LYS A 1 144 ? 22.782 16.993 8.267 1.00 28.92 ? 179 LYS A N 1 ATOM 994 C CA . LYS A 1 144 ? 23.415 15.672 8.163 1.00 39.78 ? 179 LYS A CA 1 ATOM 995 C C . LYS A 1 144 ? 23.411 14.886 9.469 1.00 39.61 ? 179 LYS A C 1 ATOM 996 O O . LYS A 1 144 ? 23.503 13.665 9.455 1.00 41.26 ? 179 LYS A O 1 ATOM 997 C CB . LYS A 1 144 ? 24.858 15.794 7.677 1.00 38.05 ? 179 LYS A CB 1 ATOM 998 C CG . LYS A 1 144 ? 25.009 16.204 6.223 1.00 36.91 ? 179 LYS A CG 1 ATOM 999 C CD . LYS A 1 144 ? 26.486 16.207 5.850 1.00 53.36 ? 179 LYS A CD 1 ATOM 1000 C CE . LYS A 1 144 ? 26.798 17.177 4.723 1.00 54.16 ? 179 LYS A CE 1 ATOM 1001 N NZ . LYS A 1 144 ? 28.280 17.322 4.562 1.00 59.58 ? 179 LYS A NZ 1 ATOM 1002 N N . LYS A 1 145 ? 23.321 15.577 10.601 1.00 38.98 ? 180 LYS A N 1 ATOM 1003 C CA . LYS A 1 145 ? 23.269 14.896 11.892 1.00 42.39 ? 180 LYS A CA 1 ATOM 1004 C C . LYS A 1 145 ? 22.013 14.016 12.007 1.00 46.70 ? 180 LYS A C 1 ATOM 1005 O O . LYS A 1 145 ? 21.959 13.071 12.804 1.00 49.18 ? 180 LYS A O 1 ATOM 1006 C CB . LYS A 1 145 ? 23.367 15.905 13.035 1.00 39.15 ? 180 LYS A CB 1 ATOM 1007 C CG . LYS A 1 145 ? 24.697 16.672 13.051 1.00 40.79 ? 180 LYS A CG 1 ATOM 1008 C CD . LYS A 1 145 ? 24.821 17.504 14.317 1.00 45.76 ? 180 LYS A CD 1 ATOM 1009 C CE . LYS A 1 145 ? 25.939 18.546 14.235 1.00 40.41 ? 180 LYS A CE 1 ATOM 1010 N NZ . LYS A 1 145 ? 27.298 17.951 14.240 1.00 38.39 ? 180 LYS A NZ 1 ATOM 1011 N N . GLY A 1 146 ? 21.008 14.326 11.194 1.00 39.85 ? 181 GLY A N 1 ATOM 1012 C CA . GLY A 1 146 ? 19.903 13.410 10.961 1.00 43.58 ? 181 GLY A CA 1 ATOM 1013 C C . GLY A 1 146 ? 19.038 13.109 12.170 1.00 39.99 ? 181 GLY A C 1 ATOM 1014 O O . GLY A 1 146 ? 19.111 13.794 13.189 1.00 40.00 ? 181 GLY A O 1 ATOM 1015 N N . SER A 1 147 ? 18.220 12.065 12.046 1.00 39.68 ? 182 SER A N 1 ATOM 1016 C CA . SER A 1 147 ? 17.225 11.733 13.059 1.00 37.98 ? 182 SER A CA 1 ATOM 1017 C C . SER A 1 147 ? 17.857 11.230 14.342 1.00 42.86 ? 182 SER A C 1 ATOM 1018 O O . SER A 1 147 ? 17.189 11.157 15.379 1.00 45.34 ? 182 SER A O 1 ATOM 1019 C CB . SER A 1 147 ? 16.231 10.700 12.531 1.00 41.20 ? 182 SER A CB 1 ATOM 1020 O OG . SER A 1 147 ? 16.894 9.497 12.179 1.00 48.61 ? 182 SER A OG 1 ATOM 1021 N N . LYS A 1 148 ? 19.139 10.886 14.280 1.00 41.83 ? 183 LYS A N 1 ATOM 1022 C CA . LYS A 1 148 ? 19.860 10.537 15.488 1.00 45.50 ? 183 LYS A CA 1 ATOM 1023 C C . LYS A 1 148 ? 19.784 11.693 16.463 1.00 38.72 ? 183 LYS A C 1 ATOM 1024 O O . LYS A 1 148 ? 19.675 11.498 17.672 1.00 43.02 ? 183 LYS A O 1 ATOM 1025 C CB . LYS A 1 148 ? 21.325 10.219 15.178 1.00 40.83 ? 183 LYS A CB 1 ATOM 1026 C CG . LYS A 1 148 ? 21.581 8.770 14.823 1.00 44.60 ? 183 LYS A CG 1 ATOM 1027 C CD . LYS A 1 148 ? 23.074 8.498 14.692 1.00 43.00 ? 183 LYS A CD 1 ATOM 1028 C CE . LYS A 1 148 ? 23.363 7.006 14.663 1.00 39.51 ? 183 LYS A CE 1 ATOM 1029 N NZ . LYS A 1 148 ? 24.823 6.750 14.834 1.00 45.92 ? 183 LYS A NZ 1 ATOM 1030 N N . VAL A 1 149 ? 19.839 12.908 15.934 1.00 34.02 ? 184 VAL A N 1 ATOM 1031 C CA . VAL A 1 149 ? 19.929 14.076 16.789 1.00 35.66 ? 184 VAL A CA 1 ATOM 1032 C C . VAL A 1 149 ? 18.639 14.884 16.710 1.00 31.70 ? 184 VAL A C 1 ATOM 1033 O O . VAL A 1 149 ? 18.180 15.435 17.714 1.00 29.76 ? 184 VAL A O 1 ATOM 1034 C CB . VAL A 1 149 ? 21.130 14.960 16.377 1.00 36.38 ? 184 VAL A CB 1 ATOM 1035 C CG1 . VAL A 1 149 ? 21.273 16.138 17.313 1.00 30.08 ? 184 VAL A CG1 1 ATOM 1036 C CG2 . VAL A 1 149 ? 22.416 14.128 16.362 1.00 40.01 ? 184 VAL A CG2 1 ATOM 1037 N N . MET A 1 150 ? 18.061 14.936 15.515 1.00 26.01 ? 185 MET A N 1 ATOM 1038 C CA . MET A 1 150 ? 16.890 15.777 15.249 1.00 23.20 ? 185 MET A CA 1 ATOM 1039 C C . MET A 1 150 ? 15.786 15.017 14.538 1.00 26.67 ? 185 MET A C 1 ATOM 1040 O O . MET A 1 150 ? 15.504 15.284 13.377 1.00 24.52 ? 185 MET A O 1 ATOM 1041 C CB . MET A 1 150 ? 17.308 16.980 14.389 1.00 23.86 ? 185 MET A CB 1 ATOM 1042 C CG . MET A 1 150 ? 18.338 17.857 15.074 1.00 24.01 ? 185 MET A CG 1 ATOM 1043 S SD . MET A 1 150 ? 18.828 19.268 14.049 1.00 29.27 ? 185 MET A SD 1 ATOM 1044 C CE . MET A 1 150 ? 19.481 18.401 12.640 1.00 28.27 ? 185 MET A CE 1 ATOM 1045 N N . PRO A 1 151 ? 15.146 14.066 15.236 1.00 25.50 ? 186 PRO A N 1 ATOM 1046 C CA . PRO A 1 151 ? 14.168 13.215 14.547 1.00 27.94 ? 186 PRO A CA 1 ATOM 1047 C C . PRO A 1 151 ? 12.954 13.982 14.007 1.00 21.90 ? 186 PRO A C 1 ATOM 1048 O O . PRO A 1 151 ? 12.457 13.661 12.918 1.00 19.90 ? 186 PRO A O 1 ATOM 1049 C CB . PRO A 1 151 ? 13.759 12.199 15.626 1.00 32.12 ? 186 PRO A CB 1 ATOM 1050 C CG . PRO A 1 151 ? 14.089 12.866 16.939 1.00 27.46 ? 186 PRO A CG 1 ATOM 1051 C CD . PRO A 1 151 ? 15.317 13.702 16.654 1.00 23.35 ? 186 PRO A CD 1 ATOM 1052 N N . ASN A 1 152 ? 12.460 14.973 14.749 1.00 24.47 ? 187 ASN A N 1 ATOM 1053 C CA . ASN A 1 152 ? 11.301 15.718 14.257 1.00 22.88 ? 187 ASN A CA 1 ATOM 1054 C C . ASN A 1 152 ? 11.653 16.504 12.995 1.00 22.11 ? 187 ASN A C 1 ATOM 1055 O O . ASN A 1 152 ? 10.902 16.534 12.025 1.00 23.35 ? 187 ASN A O 1 ATOM 1056 C CB . ASN A 1 152 ? 10.766 16.680 15.316 1.00 25.64 ? 187 ASN A CB 1 ATOM 1057 C CG . ASN A 1 152 ? 9.967 15.981 16.403 1.00 25.58 ? 187 ASN A CG 1 ATOM 1058 O OD1 . ASN A 1 152 ? 8.778 15.714 16.243 1.00 24.50 ? 187 ASN A OD1 1 ATOM 1059 N ND2 . ASN A 1 152 ? 10.614 15.711 17.528 1.00 24.19 ? 187 ASN A ND2 1 ATOM 1060 N N . ILE A 1 153 ? 12.796 17.177 13.030 1.00 19.87 ? 188 ILE A N 1 ATOM 1061 C CA . ILE A 1 153 ? 13.232 17.958 11.876 1.00 20.19 ? 188 ILE A CA 1 ATOM 1062 C C . ILE A 1 153 ? 13.553 17.038 10.700 1.00 22.72 ? 188 ILE A C 1 ATOM 1063 O O . ILE A 1 153 ? 13.232 17.335 9.552 1.00 19.59 ? 188 ILE A O 1 ATOM 1064 C CB . ILE A 1 153 ? 14.444 18.839 12.238 1.00 21.33 ? 188 ILE A CB 1 ATOM 1065 C CG1 . ILE A 1 153 ? 13.994 19.960 13.195 1.00 17.61 ? 188 ILE A CG1 1 ATOM 1066 C CG2 . ILE A 1 153 ? 15.061 19.449 10.988 1.00 23.90 ? 188 ILE A CG2 1 ATOM 1067 C CD1 . ILE A 1 153 ? 15.156 20.634 13.940 1.00 20.53 ? 188 ILE A CD1 1 ATOM 1068 N N . GLU A 1 154 ? 14.178 15.907 10.993 1.00 20.79 ? 189 GLU A N 1 ATOM 1069 C CA . GLU A 1 154 ? 14.437 14.928 9.953 1.00 19.08 ? 189 GLU A CA 1 ATOM 1070 C C . GLU A 1 154 ? 13.151 14.433 9.300 1.00 21.81 ? 189 GLU A C 1 ATOM 1071 O O . GLU A 1 154 ? 13.124 14.202 8.090 1.00 22.46 ? 189 GLU A O 1 ATOM 1072 C CB . GLU A 1 154 ? 15.254 13.742 10.504 1.00 25.86 ? 189 GLU A CB 1 ATOM 1073 C CG . GLU A 1 154 ? 15.482 12.619 9.482 1.00 25.69 ? 189 GLU A CG 1 ATOM 1074 C CD . GLU A 1 154 ? 16.290 13.041 8.242 1.00 31.12 ? 189 GLU A CD 1 ATOM 1075 O OE1 . GLU A 1 154 ? 16.857 14.156 8.199 1.00 28.75 ? 189 GLU A OE1 1 ATOM 1076 O OE2 . GLU A 1 154 ? 16.357 12.234 7.294 1.00 32.46 ? 189 GLU A OE2 1 ATOM 1077 N N . LYS A 1 155 ? 12.088 14.275 10.084 1.00 24.46 ? 190 LYS A N 1 ATOM 1078 C CA . LYS A 1 155 ? 10.802 13.893 9.493 1.00 23.11 ? 190 LYS A CA 1 ATOM 1079 C C . LYS A 1 155 ? 10.251 14.984 8.575 1.00 25.50 ? 190 LYS A C 1 ATOM 1080 O O . LYS A 1 155 ? 9.817 14.696 7.461 1.00 21.00 ? 190 LYS A O 1 ATOM 1081 C CB . LYS A 1 155 ? 9.755 13.511 10.549 1.00 24.70 ? 190 LYS A CB 1 ATOM 1082 C CG . LYS A 1 155 ? 8.437 13.077 9.908 1.00 25.53 ? 190 LYS A CG 1 ATOM 1083 C CD . LYS A 1 155 ? 7.413 12.577 10.934 1.00 28.92 ? 190 LYS A CD 1 ATOM 1084 C CE . LYS A 1 155 ? 6.078 12.306 10.254 1.00 31.95 ? 190 LYS A CE 1 ATOM 1085 N NZ . LYS A 1 155 ? 5.024 11.830 11.199 1.00 33.60 ? 190 LYS A NZ 1 ATOM 1086 N N . LEU A 1 156 ? 10.274 16.240 9.023 1.00 23.29 ? 191 LEU A N 1 ATOM 1087 C CA . LEU A 1 156 ? 9.897 17.332 8.126 1.00 20.09 ? 191 LEU A CA 1 ATOM 1088 C C . LEU A 1 156 ? 10.715 17.317 6.840 1.00 19.82 ? 191 LEU A C 1 ATOM 1089 O O . LEU A 1 156 ? 10.167 17.478 5.753 1.00 21.27 ? 191 LEU A O 1 ATOM 1090 C CB . LEU A 1 156 ? 10.067 18.703 8.805 1.00 20.67 ? 191 LEU A CB 1 ATOM 1091 C CG . LEU A 1 156 ? 9.192 19.032 10.015 1.00 22.04 ? 191 LEU A CG 1 ATOM 1092 C CD1 . LEU A 1 156 ? 9.666 20.332 10.666 1.00 18.39 ? 191 LEU A CD1 1 ATOM 1093 C CD2 . LEU A 1 156 ? 7.720 19.145 9.611 1.00 20.85 ? 191 LEU A CD2 1 ATOM 1094 N N . ARG A 1 157 ? 12.030 17.135 6.971 1.00 21.53 ? 192 ARG A N 1 ATOM 1095 C CA . ARG A 1 157 ? 12.922 17.231 5.827 1.00 20.20 ? 192 ARG A CA 1 ATOM 1096 C C . ARG A 1 157 ? 12.690 16.086 4.839 1.00 23.28 ? 192 ARG A C 1 ATOM 1097 O O . ARG A 1 157 ? 12.532 16.307 3.645 1.00 23.41 ? 192 ARG A O 1 ATOM 1098 C CB . ARG A 1 157 ? 14.388 17.234 6.274 1.00 19.52 ? 192 ARG A CB 1 ATOM 1099 C CG . ARG A 1 157 ? 15.363 17.519 5.141 1.00 20.17 ? 192 ARG A CG 1 ATOM 1100 C CD . ARG A 1 157 ? 16.698 16.831 5.388 1.00 31.95 ? 192 ARG A CD 1 ATOM 1101 N NE . ARG A 1 157 ? 16.552 15.384 5.544 1.00 27.50 ? 192 ARG A NE 1 ATOM 1102 C CZ . ARG A 1 157 ? 16.425 14.526 4.530 1.00 28.98 ? 192 ARG A CZ 1 ATOM 1103 N NH1 . ARG A 1 157 ? 16.405 14.959 3.277 1.00 27.56 ? 192 ARG A NH1 1 ATOM 1104 N NH2 . ARG A 1 157 ? 16.306 13.226 4.772 1.00 29.14 ? 192 ARG A NH2 1 ATOM 1105 N N . SER A 1 158 ? 12.671 14.856 5.343 1.00 23.90 ? 193 SER A N 1 ATOM 1106 C CA . SER A 1 158 ? 12.551 13.711 4.447 1.00 23.32 ? 193 SER A CA 1 ATOM 1107 C C . SER A 1 158 ? 11.153 13.561 3.850 1.00 27.42 ? 193 SER A C 1 ATOM 1108 O O . SER A 1 158 ? 11.013 13.123 2.713 1.00 26.80 ? 193 SER A O 1 ATOM 1109 C CB . SER A 1 158 ? 12.950 12.421 5.162 1.00 28.65 ? 193 SER A CB 1 ATOM 1110 O OG . SER A 1 158 ? 12.110 12.204 6.264 1.00 31.09 ? 193 SER A OG 1 ATOM 1111 N N . CYS A 1 159 ? 10.122 13.949 4.592 1.00 24.99 ? 194 CYS A N 1 ATOM 1112 C CA A CYS A 1 159 ? 8.767 13.746 4.092 0.50 27.03 ? 194 CYS A CA 1 ATOM 1113 C CA B CYS A 1 159 ? 8.736 13.757 4.152 0.50 27.03 ? 194 CYS A CA 1 ATOM 1114 C C . CYS A 1 159 ? 8.213 14.924 3.315 1.00 26.87 ? 194 CYS A C 1 ATOM 1115 O O . CYS A 1 159 ? 7.336 14.758 2.475 1.00 25.98 ? 194 CYS A O 1 ATOM 1116 C CB A CYS A 1 159 ? 7.837 13.337 5.222 0.50 28.21 ? 194 CYS A CB 1 ATOM 1117 C CB B CYS A 1 159 ? 7.828 13.522 5.365 0.50 28.16 ? 194 CYS A CB 1 ATOM 1118 S SG A CYS A 1 159 ? 8.314 11.739 5.872 0.50 38.73 ? 194 CYS A SG 1 ATOM 1119 S SG B CYS A 1 159 ? 6.099 13.138 5.001 0.50 33.24 ? 194 CYS A SG 1 ATOM 1120 N N . GLY A 1 160 ? 8.749 16.110 3.564 1.00 29.39 ? 195 GLY A N 1 ATOM 1121 C CA . GLY A 1 160 ? 8.327 17.282 2.827 1.00 22.95 ? 195 GLY A CA 1 ATOM 1122 C C . GLY A 1 160 ? 9.234 17.610 1.669 1.00 26.12 ? 195 GLY A C 1 ATOM 1123 O O . GLY A 1 160 ? 9.761 16.722 0.986 1.00 24.87 ? 195 GLY A O 1 ATOM 1124 N N . THR A 1 161 ? 9.402 18.910 1.437 1.00 22.68 ? 196 THR A N 1 ATOM 1125 C CA . THR A 1 161 ? 10.226 19.416 0.350 1.00 23.63 ? 196 THR A CA 1 ATOM 1126 C C . THR A 1 161 ? 11.450 20.035 0.984 1.00 24.32 ? 196 THR A C 1 ATOM 1127 O O . THR A 1 161 ? 11.317 20.862 1.886 1.00 25.62 ? 196 THR A O 1 ATOM 1128 C CB . THR A 1 161 ? 9.442 20.490 -0.459 1.00 24.55 ? 196 THR A CB 1 ATOM 1129 O OG1 . THR A 1 161 ? 8.301 19.876 -1.075 1.00 25.76 ? 196 THR A OG1 1 ATOM 1130 C CG2 . THR A 1 161 ? 10.304 21.156 -1.549 1.00 20.38 ? 196 THR A CG2 1 ATOM 1131 N N . HIS A 1 162 ? 12.640 19.639 0.538 1.00 21.21 ? 197 HIS A N 1 ATOM 1132 C CA . HIS A 1 162 ? 13.853 20.263 1.070 1.00 20.60 ? 197 HIS A CA 1 ATOM 1133 C C . HIS A 1 162 ? 14.846 20.657 -0.009 1.00 23.50 ? 197 HIS A C 1 ATOM 1134 O O . HIS A 1 162 ? 14.864 20.067 -1.099 1.00 23.28 ? 197 HIS A O 1 ATOM 1135 C CB . HIS A 1 162 ? 14.523 19.369 2.126 1.00 23.17 ? 197 HIS A CB 1 ATOM 1136 C CG . HIS A 1 162 ? 15.329 18.253 1.541 1.00 24.88 ? 197 HIS A CG 1 ATOM 1137 N ND1 . HIS A 1 162 ? 14.753 17.174 0.902 1.00 25.25 ? 197 HIS A ND1 1 ATOM 1138 C CD2 . HIS A 1 162 ? 16.669 18.053 1.486 1.00 25.99 ? 197 HIS A CD2 1 ATOM 1139 C CE1 . HIS A 1 162 ? 15.704 16.354 0.482 1.00 27.93 ? 197 HIS A CE1 1 ATOM 1140 N NE2 . HIS A 1 162 ? 16.877 16.866 0.822 1.00 27.17 ? 197 HIS A NE2 1 ATOM 1141 N N . ALA A 1 163 ? 15.636 21.691 0.284 1.00 22.76 ? 198 ALA A N 1 ATOM 1142 C CA . ALA A 1 163 ? 16.825 22.028 -0.507 1.00 21.39 ? 198 ALA A CA 1 ATOM 1143 C C . ALA A 1 163 ? 18.032 21.496 0.252 1.00 16.39 ? 198 ALA A C 1 ATOM 1144 O O . ALA A 1 163 ? 17.988 21.398 1.486 1.00 22.16 ? 198 ALA A O 1 ATOM 1145 C CB . ALA A 1 163 ? 16.955 23.562 -0.680 1.00 19.67 ? 198 ALA A CB 1 ATOM 1146 N N . PRO A 1 164 ? 19.116 21.153 -0.465 1.00 15.06 ? 199 PRO A N 1 ATOM 1147 C CA . PRO A 1 164 ? 20.347 20.783 0.245 1.00 21.72 ? 199 PRO A CA 1 ATOM 1148 C C . PRO A 1 164 ? 20.879 21.978 1.057 1.00 21.91 ? 199 PRO A C 1 ATOM 1149 O O . PRO A 1 164 ? 21.536 21.786 2.076 1.00 20.97 ? 199 PRO A O 1 ATOM 1150 C CB . PRO A 1 164 ? 21.303 20.389 -0.882 1.00 24.76 ? 199 PRO A CB 1 ATOM 1151 C CG . PRO A 1 164 ? 20.785 21.085 -2.095 1.00 24.54 ? 199 PRO A CG 1 ATOM 1152 C CD . PRO A 1 164 ? 19.292 21.152 -1.929 1.00 22.07 ? 199 PRO A CD 1 ATOM 1153 N N . TYR A 1 165 ? 20.561 23.188 0.604 1.00 20.16 ? 200 TYR A N 1 ATOM 1154 C CA . TYR A 1 165 ? 20.859 24.393 1.370 1.00 18.67 ? 200 TYR A CA 1 ATOM 1155 C C . TYR A 1 165 ? 20.181 25.574 0.739 1.00 15.58 ? 200 TYR A C 1 ATOM 1156 O O . TYR A 1 165 ? 19.709 25.502 -0.379 1.00 19.27 ? 200 TYR A O 1 ATOM 1157 C CB . TYR A 1 165 ? 22.364 24.661 1.463 1.00 21.97 ? 200 TYR A CB 1 ATOM 1158 C CG . TYR A 1 165 ? 23.092 24.762 0.149 1.00 25.46 ? 200 TYR A CG 1 ATOM 1159 C CD1 . TYR A 1 165 ? 23.583 23.617 -0.470 1.00 29.33 ? 200 TYR A CD1 1 ATOM 1160 C CD2 . TYR A 1 165 ? 23.316 25.987 -0.463 1.00 22.98 ? 200 TYR A CD2 1 ATOM 1161 C CE1 . TYR A 1 165 ? 24.262 23.683 -1.662 1.00 27.83 ? 200 TYR A CE1 1 ATOM 1162 C CE2 . TYR A 1 165 ? 24.015 26.064 -1.665 1.00 27.05 ? 200 TYR A CE2 1 ATOM 1163 C CZ . TYR A 1 165 ? 24.487 24.897 -2.247 1.00 29.55 ? 200 TYR A CZ 1 ATOM 1164 O OH . TYR A 1 165 ? 25.168 24.917 -3.437 1.00 37.92 ? 200 TYR A OH 1 ATOM 1165 N N . MET A 1 166 ? 20.148 26.667 1.488 1.00 17.23 ? 201 MET A N 1 ATOM 1166 C CA . MET A 1 166 ? 19.600 27.918 1.016 1.00 18.48 ? 201 MET A CA 1 ATOM 1167 C C . MET A 1 166 ? 20.680 28.990 1.200 1.00 16.78 ? 201 MET A C 1 ATOM 1168 O O . MET A 1 166 ? 21.345 29.023 2.224 1.00 17.79 ? 201 MET A O 1 ATOM 1169 C CB . MET A 1 166 ? 18.336 28.292 1.795 1.00 15.82 ? 201 MET A CB 1 ATOM 1170 C CG . MET A 1 166 ? 17.680 29.588 1.318 1.00 17.61 ? 201 MET A CG 1 ATOM 1171 S SD . MET A 1 166 ? 16.206 30.009 2.243 1.00 20.03 ? 201 MET A SD 1 ATOM 1172 C CE . MET A 1 166 ? 16.948 30.467 3.813 1.00 15.01 ? 201 MET A CE 1 ATOM 1173 N N . ARG A 1 167 ? 20.860 29.823 0.179 1.00 14.40 ? 202 ARG A N 1 ATOM 1174 C CA . ARG A 1 167 ? 21.857 30.898 0.175 1.00 16.06 ? 202 ARG A CA 1 ATOM 1175 C C . ARG A 1 167 ? 21.288 32.135 0.864 1.00 17.62 ? 202 ARG A C 1 ATOM 1176 O O . ARG A 1 167 ? 20.253 32.645 0.461 1.00 16.08 ? 202 ARG A O 1 ATOM 1177 C CB . ARG A 1 167 ? 22.285 31.242 -1.267 1.00 18.67 ? 202 ARG A CB 1 ATOM 1178 C CG . ARG A 1 167 ? 23.489 32.216 -1.381 1.00 17.25 ? 202 ARG A CG 1 ATOM 1179 C CD . ARG A 1 167 ? 23.979 32.402 -2.857 1.00 19.06 ? 202 ARG A CD 1 ATOM 1180 N NE . ARG A 1 167 ? 24.195 31.102 -3.481 1.00 18.31 ? 202 ARG A NE 1 ATOM 1181 C CZ . ARG A 1 167 ? 23.515 30.628 -4.524 1.00 23.13 ? 202 ARG A CZ 1 ATOM 1182 N NH1 . ARG A 1 167 ? 22.608 31.371 -5.159 1.00 23.40 ? 202 ARG A NH1 1 ATOM 1183 N NH2 . ARG A 1 167 ? 23.775 29.409 -4.964 1.00 21.76 ? 202 ARG A NH2 1 ATOM 1184 N N . PRO A 1 168 ? 21.973 32.614 1.913 1.00 15.93 ? 203 PRO A N 1 ATOM 1185 C CA . PRO A 1 168 ? 21.578 33.849 2.601 1.00 15.20 ? 203 PRO A CA 1 ATOM 1186 C C . PRO A 1 168 ? 22.029 35.065 1.800 1.00 17.17 ? 203 PRO A C 1 ATOM 1187 O O . PRO A 1 168 ? 22.661 34.892 0.764 1.00 19.10 ? 203 PRO A O 1 ATOM 1188 C CB . PRO A 1 168 ? 22.334 33.751 3.923 1.00 17.57 ? 203 PRO A CB 1 ATOM 1189 C CG . PRO A 1 168 ? 23.605 32.989 3.555 1.00 17.63 ? 203 PRO A CG 1 ATOM 1190 C CD . PRO A 1 168 ? 23.155 31.971 2.529 1.00 14.80 ? 203 PRO A CD 1 ATOM 1191 N N . VAL A 1 169 ? 21.691 36.282 2.243 1.00 15.36 ? 204 VAL A N 1 ATOM 1192 C CA . VAL A 1 169 ? 22.292 37.474 1.632 1.00 14.93 ? 204 VAL A CA 1 ATOM 1193 C C . VAL A 1 169 ? 23.546 37.904 2.376 1.00 16.93 ? 204 VAL A C 1 ATOM 1194 O O . VAL A 1 169 ? 23.737 37.570 3.559 1.00 15.90 ? 204 VAL A O 1 ATOM 1195 C CB . VAL A 1 169 ? 21.352 38.716 1.603 1.00 15.42 ? 204 VAL A CB 1 ATOM 1196 C CG1 . VAL A 1 169 ? 20.280 38.561 0.557 1.00 17.94 ? 204 VAL A CG1 1 ATOM 1197 C CG2 . VAL A 1 169 ? 20.745 38.980 2.980 1.00 15.65 ? 204 VAL A CG2 1 ATOM 1198 N N . TYR A 1 170 ? 24.374 38.679 1.679 1.00 14.33 ? 205 TYR A N 1 ATOM 1199 C CA . TYR A 1 170 ? 25.561 39.270 2.282 1.00 14.87 ? 205 TYR A CA 1 ATOM 1200 C C . TYR A 1 170 ? 25.185 40.644 2.839 1.00 16.92 ? 205 TYR A C 1 ATOM 1201 O O . TYR A 1 170 ? 24.407 41.358 2.208 1.00 17.37 ? 205 TYR A O 1 ATOM 1202 C CB . TYR A 1 170 ? 26.645 39.435 1.230 1.00 17.54 ? 205 TYR A CB 1 ATOM 1203 C CG . TYR A 1 170 ? 27.927 39.991 1.790 1.00 15.67 ? 205 TYR A CG 1 ATOM 1204 C CD1 . TYR A 1 170 ? 28.819 39.178 2.437 1.00 16.21 ? 205 TYR A CD1 1 ATOM 1205 C CD2 . TYR A 1 170 ? 28.239 41.347 1.669 1.00 15.97 ? 205 TYR A CD2 1 ATOM 1206 C CE1 . TYR A 1 170 ? 30.005 39.675 2.970 1.00 17.31 ? 205 TYR A CE1 1 ATOM 1207 C CE2 . TYR A 1 170 ? 29.416 41.854 2.189 1.00 17.61 ? 205 TYR A CE2 1 ATOM 1208 C CZ . TYR A 1 170 ? 30.294 41.013 2.836 1.00 17.25 ? 205 TYR A CZ 1 ATOM 1209 O OH . TYR A 1 170 ? 31.461 41.513 3.354 1.00 16.40 ? 205 TYR A OH 1 ATOM 1210 N N . PRO A 1 171 ? 25.709 41.002 4.032 1.00 19.41 ? 206 PRO A N 1 ATOM 1211 C CA . PRO A 1 171 ? 26.540 40.144 4.893 1.00 19.06 ? 206 PRO A CA 1 ATOM 1212 C C . PRO A 1 171 ? 25.733 39.055 5.554 1.00 15.62 ? 206 PRO A C 1 ATOM 1213 O O . PRO A 1 171 ? 24.547 39.228 5.879 1.00 14.82 ? 206 PRO A O 1 ATOM 1214 C CB . PRO A 1 171 ? 27.053 41.103 5.973 1.00 21.01 ? 206 PRO A CB 1 ATOM 1215 C CG . PRO A 1 171 ? 26.065 42.205 6.005 1.00 24.79 ? 206 PRO A CG 1 ATOM 1216 C CD . PRO A 1 171 ? 25.529 42.348 4.606 1.00 19.56 ? 206 PRO A CD 1 ATOM 1217 N N . THR A 1 172 ? 26.391 37.928 5.802 1.00 15.19 ? 207 THR A N 1 ATOM 1218 C CA . THR A 1 172 ? 25.668 36.772 6.284 1.00 13.63 ? 207 THR A CA 1 ATOM 1219 C C . THR A 1 172 ? 25.496 36.809 7.811 1.00 18.49 ? 207 THR A C 1 ATOM 1220 O O . THR A 1 172 ? 25.969 35.934 8.539 1.00 16.57 ? 207 THR A O 1 ATOM 1221 C CB . THR A 1 172 ? 26.329 35.449 5.795 1.00 13.19 ? 207 THR A CB 1 ATOM 1222 O OG1 . THR A 1 172 ? 27.725 35.483 6.088 1.00 15.14 ? 207 THR A OG1 1 ATOM 1223 C CG2 . THR A 1 172 ? 26.191 35.331 4.255 1.00 18.02 ? 207 THR A CG2 1 ATOM 1224 N N . LYS A 1 173 ? 24.776 37.838 8.256 1.00 16.96 ? 208 LYS A N 1 ATOM 1225 C CA . LYS A 1 173 ? 24.454 38.106 9.644 1.00 16.49 ? 208 LYS A CA 1 ATOM 1226 C C . LYS A 1 173 ? 22.939 38.148 9.827 1.00 18.38 ? 208 LYS A C 1 ATOM 1227 O O . LYS A 1 173 ? 22.178 38.178 8.866 1.00 13.82 ? 208 LYS A O 1 ATOM 1228 C CB . LYS A 1 173 ? 25.049 39.462 10.032 1.00 19.79 ? 208 LYS A CB 1 ATOM 1229 C CG . LYS A 1 173 ? 26.581 39.480 9.980 1.00 23.00 ? 208 LYS A CG 1 ATOM 1230 C CD . LYS A 1 173 ? 27.186 39.323 11.355 1.00 29.42 ? 208 LYS A CD 1 ATOM 1231 C CE . LYS A 1 173 ? 28.719 39.423 11.302 1.00 27.53 ? 208 LYS A CE 1 ATOM 1232 N NZ . LYS A 1 173 ? 29.276 39.959 12.553 1.00 29.80 ? 208 LYS A NZ 1 ATOM 1233 N N . THR A 1 174 ? 22.505 38.167 11.073 1.00 14.68 ? 209 THR A N 1 ATOM 1234 C CA . THR A 1 174 ? 21.093 38.005 11.399 1.00 16.88 ? 209 THR A CA 1 ATOM 1235 C C . THR A 1 174 ? 20.132 39.074 10.914 1.00 15.40 ? 209 THR A C 1 ATOM 1236 O O . THR A 1 174 ? 19.128 38.768 10.255 1.00 16.53 ? 209 THR A O 1 ATOM 1237 C CB . THR A 1 174 ? 20.938 37.946 12.908 1.00 21.35 ? 209 THR A CB 1 ATOM 1238 O OG1 . THR A 1 174 ? 21.842 36.969 13.426 1.00 28.39 ? 209 THR A OG1 1 ATOM 1239 C CG2 . THR A 1 174 ? 19.494 37.602 13.278 1.00 22.35 ? 209 THR A CG2 1 ATOM 1240 N N . PHE A 1 175 ? 20.366 40.321 11.301 1.00 17.33 ? 210 PHE A N 1 ATOM 1241 C CA . PHE A 1 175 ? 19.395 41.359 10.928 1.00 17.43 ? 210 PHE A CA 1 ATOM 1242 C C . PHE A 1 175 ? 19.195 41.506 9.398 1.00 18.48 ? 210 PHE A C 1 ATOM 1243 O O . PHE A 1 175 ? 18.050 41.523 8.914 1.00 18.98 ? 210 PHE A O 1 ATOM 1244 C CB . PHE A 1 175 ? 19.721 42.708 11.592 1.00 18.02 ? 210 PHE A CB 1 ATOM 1245 C CG . PHE A 1 175 ? 19.099 42.883 12.955 1.00 29.28 ? 210 PHE A CG 1 ATOM 1246 C CD1 . PHE A 1 175 ? 19.710 42.367 14.088 1.00 38.60 ? 210 PHE A CD1 1 ATOM 1247 C CD2 . PHE A 1 175 ? 17.924 43.586 13.104 1.00 34.41 ? 210 PHE A CD2 1 ATOM 1248 C CE1 . PHE A 1 175 ? 19.139 42.541 15.342 1.00 46.17 ? 210 PHE A CE1 1 ATOM 1249 C CE2 . PHE A 1 175 ? 17.356 43.766 14.360 1.00 41.04 ? 210 PHE A CE2 1 ATOM 1250 C CZ . PHE A 1 175 ? 17.963 43.241 15.471 1.00 39.81 ? 210 PHE A CZ 1 ATOM 1251 N N . PRO A 1 176 ? 20.288 41.592 8.632 1.00 16.88 ? 211 PRO A N 1 ATOM 1252 C CA . PRO A 1 176 ? 20.079 41.683 7.179 1.00 15.67 ? 211 PRO A CA 1 ATOM 1253 C C . PRO A 1 176 ? 19.322 40.477 6.624 1.00 14.79 ? 211 PRO A C 1 ATOM 1254 O O . PRO A 1 176 ? 18.463 40.631 5.769 1.00 14.16 ? 211 PRO A O 1 ATOM 1255 C CB . PRO A 1 176 ? 21.503 41.725 6.628 1.00 17.65 ? 211 PRO A CB 1 ATOM 1256 C CG . PRO A 1 176 ? 22.285 42.381 7.747 1.00 16.68 ? 211 PRO A CG 1 ATOM 1257 C CD . PRO A 1 176 ? 21.716 41.762 8.981 1.00 14.80 ? 211 PRO A CD 1 ATOM 1258 N N . ASN A 1 177 ? 19.603 39.286 7.134 1.00 13.01 ? 212 ASN A N 1 ATOM 1259 C CA . ASN A 1 177 ? 18.951 38.126 6.574 1.00 12.83 ? 212 ASN A CA 1 ATOM 1260 C C . ASN A 1 177 ? 17.517 37.898 7.004 1.00 15.08 ? 212 ASN A C 1 ATOM 1261 O O . ASN A 1 177 ? 16.693 37.485 6.212 1.00 16.72 ? 212 ASN A O 1 ATOM 1262 C CB . ASN A 1 177 ? 19.814 36.888 6.793 1.00 14.05 ? 212 ASN A CB 1 ATOM 1263 C CG . ASN A 1 177 ? 20.807 36.732 5.707 1.00 15.51 ? 212 ASN A CG 1 ATOM 1264 O OD1 . ASN A 1 177 ? 20.471 36.245 4.635 1.00 15.34 ? 212 ASN A OD1 1 ATOM 1265 N ND2 . ASN A 1 177 ? 22.046 37.171 5.950 1.00 15.89 ? 212 ASN A ND2 1 ATOM 1266 N N . LEU A 1 178 ? 17.210 38.172 8.260 1.00 17.10 ? 213 LEU A N 1 ATOM 1267 C CA . LEU A 1 178 ? 15.834 38.044 8.695 1.00 18.14 ? 213 LEU A CA 1 ATOM 1268 C C . LEU A 1 178 ? 14.961 39.044 7.947 1.00 17.41 ? 213 LEU A C 1 ATOM 1269 O O . LEU A 1 178 ? 13.844 38.717 7.536 1.00 17.81 ? 213 LEU A O 1 ATOM 1270 C CB . LEU A 1 178 ? 15.712 38.238 10.200 1.00 19.41 ? 213 LEU A CB 1 ATOM 1271 C CG . LEU A 1 178 ? 16.287 37.115 11.088 1.00 23.65 ? 213 LEU A CG 1 ATOM 1272 C CD1 . LEU A 1 178 ? 16.066 37.462 12.551 1.00 22.48 ? 213 LEU A CD1 1 ATOM 1273 C CD2 . LEU A 1 178 ? 15.704 35.724 10.767 1.00 26.08 ? 213 LEU A CD2 1 ATOM 1274 N N . TYR A 1 179 ? 15.456 40.259 7.745 1.00 15.62 ? 214 TYR A N 1 ATOM 1275 C CA . TYR A 1 179 ? 14.607 41.228 7.061 1.00 18.14 ? 214 TYR A CA 1 ATOM 1276 C C . TYR A 1 179 ? 14.506 40.948 5.558 1.00 18.40 ? 214 TYR A C 1 ATOM 1277 O O . TYR A 1 179 ? 13.494 41.259 4.915 1.00 17.98 ? 214 TYR A O 1 ATOM 1278 C CB . TYR A 1 179 ? 15.070 42.664 7.318 1.00 16.94 ? 214 TYR A CB 1 ATOM 1279 C CG . TYR A 1 179 ? 13.941 43.667 7.157 1.00 20.53 ? 214 TYR A CG 1 ATOM 1280 C CD1 . TYR A 1 179 ? 12.702 43.441 7.741 1.00 18.79 ? 214 TYR A CD1 1 ATOM 1281 C CD2 . TYR A 1 179 ? 14.121 44.837 6.431 1.00 21.26 ? 214 TYR A CD2 1 ATOM 1282 C CE1 . TYR A 1 179 ? 11.653 44.370 7.600 1.00 20.24 ? 214 TYR A CE1 1 ATOM 1283 C CE2 . TYR A 1 179 ? 13.084 45.756 6.269 1.00 19.91 ? 214 TYR A CE2 1 ATOM 1284 C CZ . TYR A 1 179 ? 11.858 45.512 6.866 1.00 19.17 ? 214 TYR A CZ 1 ATOM 1285 O OH . TYR A 1 179 ? 10.820 46.417 6.726 1.00 21.17 ? 214 TYR A OH 1 ATOM 1286 N N . THR A 1 180 ? 15.551 40.348 5.000 1.00 16.24 ? 215 THR A N 1 ATOM 1287 C CA . THR A 1 180 ? 15.510 39.896 3.615 1.00 17.18 ? 215 THR A CA 1 ATOM 1288 C C . THR A 1 180 ? 14.447 38.801 3.455 1.00 19.14 ? 215 THR A C 1 ATOM 1289 O O . THR A 1 180 ? 13.662 38.829 2.491 1.00 18.26 ? 215 THR A O 1 ATOM 1290 C CB . THR A 1 180 ? 16.899 39.418 3.137 1.00 16.16 ? 215 THR A CB 1 ATOM 1291 O OG1 . THR A 1 180 ? 17.668 40.563 2.753 1.00 14.98 ? 215 THR A OG1 1 ATOM 1292 C CG2 . THR A 1 180 ? 16.790 38.468 1.929 1.00 18.66 ? 215 THR A CG2 1 ATOM 1293 N N . LEU A 1 181 ? 14.425 37.847 4.385 1.00 17.23 ? 216 LEU A N 1 ATOM 1294 C CA . LEU A 1 181 ? 13.399 36.796 4.361 1.00 18.77 ? 216 LEU A CA 1 ATOM 1295 C C . LEU A 1 181 ? 11.997 37.399 4.384 1.00 23.41 ? 216 LEU A C 1 ATOM 1296 O O . LEU A 1 181 ? 11.107 36.945 3.671 1.00 20.79 ? 216 LEU A O 1 ATOM 1297 C CB . LEU A 1 181 ? 13.553 35.834 5.541 1.00 17.53 ? 216 LEU A CB 1 ATOM 1298 C CG . LEU A 1 181 ? 14.717 34.844 5.483 1.00 25.66 ? 216 LEU A CG 1 ATOM 1299 C CD1 . LEU A 1 181 ? 15.018 34.260 6.865 1.00 29.63 ? 216 LEU A CD1 1 ATOM 1300 C CD2 . LEU A 1 181 ? 14.431 33.720 4.469 1.00 28.68 ? 216 LEU A CD2 1 ATOM 1301 N N . ALA A 1 182 ? 11.816 38.430 5.211 1.00 18.66 ? 217 ALA A N 1 ATOM 1302 C CA . ALA A 1 182 ? 10.501 39.047 5.396 1.00 22.84 ? 217 ALA A CA 1 ATOM 1303 C C . ALA A 1 182 ? 10.072 39.904 4.217 1.00 19.25 ? 217 ALA A C 1 ATOM 1304 O O . ALA A 1 182 ? 8.872 40.134 4.039 1.00 20.42 ? 217 ALA A O 1 ATOM 1305 C CB . ALA A 1 182 ? 10.474 39.888 6.674 1.00 16.89 ? 217 ALA A CB 1 ATOM 1306 N N . THR A 1 183 ? 11.026 40.387 3.424 1.00 18.98 ? 218 THR A N 1 ATOM 1307 C CA . THR A 1 183 ? 10.712 41.374 2.375 1.00 18.20 ? 218 THR A CA 1 ATOM 1308 C C . THR A 1 183 ? 10.974 40.962 0.927 1.00 18.59 ? 218 THR A C 1 ATOM 1309 O O . THR A 1 183 ? 10.499 41.615 0.002 1.00 19.37 ? 218 THR A O 1 ATOM 1310 C CB . THR A 1 183 ? 11.499 42.691 2.589 1.00 16.59 ? 218 THR A CB 1 ATOM 1311 O OG1 . THR A 1 183 ? 12.901 42.430 2.449 1.00 19.83 ? 218 THR A OG1 1 ATOM 1312 C CG2 . THR A 1 183 ? 11.219 43.279 3.965 1.00 18.94 ? 218 THR A CG2 1 ATOM 1313 N N . GLY A 1 184 ? 11.779 39.929 0.715 1.00 17.14 ? 219 GLY A N 1 ATOM 1314 C CA . GLY A 1 184 ? 12.237 39.603 -0.632 1.00 17.29 ? 219 GLY A CA 1 ATOM 1315 C C . GLY A 1 184 ? 13.261 40.567 -1.209 1.00 19.28 ? 219 GLY A C 1 ATOM 1316 O O . GLY A 1 184 ? 13.554 40.519 -2.408 1.00 17.59 ? 219 GLY A O 1 ATOM 1317 N N . LEU A 1 185 ? 13.821 41.441 -0.370 1.00 16.82 ? 220 LEU A N 1 ATOM 1318 C CA . LEU A 1 185 ? 14.699 42.489 -0.879 1.00 16.27 ? 220 LEU A CA 1 ATOM 1319 C C . LEU A 1 185 ? 16.172 42.265 -0.508 1.00 15.45 ? 220 LEU A C 1 ATOM 1320 O O . LEU A 1 185 ? 16.463 41.689 0.537 1.00 16.41 ? 220 LEU A O 1 ATOM 1321 C CB . LEU A 1 185 ? 14.265 43.847 -0.331 1.00 16.32 ? 220 LEU A CB 1 ATOM 1322 C CG . LEU A 1 185 ? 12.910 44.345 -0.830 1.00 19.39 ? 220 LEU A CG 1 ATOM 1323 C CD1 . LEU A 1 185 ? 12.514 45.577 -0.052 1.00 24.01 ? 220 LEU A CD1 1 ATOM 1324 C CD2 . LEU A 1 185 ? 13.060 44.664 -2.294 1.00 18.60 ? 220 LEU A CD2 1 ATOM 1325 N N . TYR A 1 186 ? 17.085 42.713 -1.369 1.00 16.89 ? 221 TYR A N 1 ATOM 1326 C CA . TYR A 1 186 ? 18.482 42.865 -0.953 1.00 20.02 ? 221 TYR A CA 1 ATOM 1327 C C . TYR A 1 186 ? 18.572 43.897 0.177 1.00 18.53 ? 221 TYR A C 1 ATOM 1328 O O . TYR A 1 186 ? 17.808 44.873 0.209 1.00 19.32 ? 221 TYR A O 1 ATOM 1329 C CB . TYR A 1 186 ? 19.364 43.320 -2.113 1.00 14.91 ? 221 TYR A CB 1 ATOM 1330 C CG . TYR A 1 186 ? 19.377 42.365 -3.277 1.00 18.95 ? 221 TYR A CG 1 ATOM 1331 C CD1 . TYR A 1 186 ? 19.837 41.057 -3.126 1.00 19.25 ? 221 TYR A CD1 1 ATOM 1332 C CD2 . TYR A 1 186 ? 18.949 42.773 -4.528 1.00 16.05 ? 221 TYR A CD2 1 ATOM 1333 C CE1 . TYR A 1 186 ? 19.861 40.186 -4.195 1.00 18.85 ? 221 TYR A CE1 1 ATOM 1334 C CE2 . TYR A 1 186 ? 18.964 41.910 -5.613 1.00 19.20 ? 221 TYR A CE2 1 ATOM 1335 C CZ . TYR A 1 186 ? 19.416 40.616 -5.438 1.00 18.15 ? 221 TYR A CZ 1 ATOM 1336 O OH . TYR A 1 186 ? 19.410 39.758 -6.505 1.00 17.56 ? 221 TYR A OH 1 ATOM 1337 N N . PRO A 1 187 ? 19.533 43.703 1.096 1.00 16.57 ? 222 PRO A N 1 ATOM 1338 C CA . PRO A 1 187 ? 19.781 44.666 2.161 1.00 15.21 ? 222 PRO A CA 1 ATOM 1339 C C . PRO A 1 187 ? 19.989 46.092 1.635 1.00 15.51 ? 222 PRO A C 1 ATOM 1340 O O . PRO A 1 187 ? 19.526 47.013 2.316 1.00 19.61 ? 222 PRO A O 1 ATOM 1341 C CB . PRO A 1 187 ? 21.064 44.141 2.812 1.00 16.57 ? 222 PRO A CB 1 ATOM 1342 C CG . PRO A 1 187 ? 20.923 42.633 2.654 1.00 18.42 ? 222 PRO A CG 1 ATOM 1343 C CD . PRO A 1 187 ? 20.281 42.450 1.286 1.00 12.80 ? 222 PRO A CD 1 ATOM 1344 N N . GLU A 1 188 ? 20.621 46.265 0.474 1.00 16.86 ? 223 GLU A N 1 ATOM 1345 C CA . GLU A 1 188 ? 20.868 47.619 -0.036 1.00 16.49 ? 223 GLU A CA 1 ATOM 1346 C C . GLU A 1 188 ? 19.533 48.295 -0.333 1.00 22.31 ? 223 GLU A C 1 ATOM 1347 O O . GLU A 1 188 ? 19.443 49.525 -0.340 1.00 19.34 ? 223 GLU A O 1 ATOM 1348 C CB . GLU A 1 188 ? 21.748 47.621 -1.286 1.00 15.62 ? 223 GLU A CB 1 ATOM 1349 C CG . GLU A 1 188 ? 21.101 46.931 -2.491 1.00 17.64 ? 223 GLU A CG 1 ATOM 1350 C CD . GLU A 1 188 ? 21.958 46.966 -3.734 1.00 18.29 ? 223 GLU A CD 1 ATOM 1351 O OE1 . GLU A 1 188 ? 23.077 47.523 -3.696 1.00 20.59 ? 223 GLU A OE1 1 ATOM 1352 O OE2 . GLU A 1 188 ? 21.506 46.422 -4.760 1.00 23.12 ? 223 GLU A OE2 1 ATOM 1353 N N . SER A 1 189 ? 18.508 47.479 -0.576 1.00 18.73 ? 224 SER A N 1 ATOM 1354 C CA . SER A 1 189 ? 17.162 47.974 -0.805 1.00 16.59 ? 224 SER A CA 1 ATOM 1355 C C . SER A 1 189 ? 16.320 48.098 0.461 1.00 22.84 ? 224 SER A C 1 ATOM 1356 O O . SER A 1 189 ? 15.708 49.138 0.700 1.00 22.81 ? 224 SER A O 1 ATOM 1357 C CB . SER A 1 189 ? 16.446 47.130 -1.873 1.00 20.31 ? 224 SER A CB 1 ATOM 1358 O OG . SER A 1 189 ? 16.981 47.398 -3.158 1.00 20.55 ? 224 SER A OG 1 ATOM 1359 N N . HIS A 1 190 ? 16.285 47.071 1.300 1.00 19.72 ? 225 HIS A N 1 ATOM 1360 C CA . HIS A 1 190 ? 15.488 47.203 2.510 1.00 18.80 ? 225 HIS A CA 1 ATOM 1361 C C . HIS A 1 190 ? 16.098 48.116 3.590 1.00 20.65 ? 225 HIS A C 1 ATOM 1362 O O . HIS A 1 190 ? 15.384 48.597 4.475 1.00 23.91 ? 225 HIS A O 1 ATOM 1363 C CB . HIS A 1 190 ? 14.984 45.847 3.048 1.00 18.62 ? 225 HIS A CB 1 ATOM 1364 C CG . HIS A 1 190 ? 16.050 44.911 3.523 1.00 20.37 ? 225 HIS A CG 1 ATOM 1365 N ND1 . HIS A 1 190 ? 16.982 45.265 4.475 1.00 18.35 ? 225 HIS A ND1 1 ATOM 1366 C CD2 . HIS A 1 190 ? 16.269 43.600 3.249 1.00 18.80 ? 225 HIS A CD2 1 ATOM 1367 C CE1 . HIS A 1 190 ? 17.752 44.219 4.742 1.00 20.60 ? 225 HIS A CE1 1 ATOM 1368 N NE2 . HIS A 1 190 ? 17.343 43.198 4.008 1.00 18.16 ? 225 HIS A NE2 1 ATOM 1369 N N . GLY A 1 191 ? 17.418 48.307 3.519 1.00 18.38 ? 226 GLY A N 1 ATOM 1370 C CA . GLY A 1 191 ? 18.141 49.264 4.342 1.00 19.00 ? 226 GLY A CA 1 ATOM 1371 C C . GLY A 1 191 ? 18.844 48.697 5.576 1.00 19.04 ? 226 GLY A C 1 ATOM 1372 O O . GLY A 1 191 ? 19.596 49.403 6.251 1.00 18.39 ? 226 GLY A O 1 ATOM 1373 N N . ILE A 1 192 ? 18.575 47.436 5.901 1.00 18.00 ? 227 ILE A N 1 ATOM 1374 C CA . ILE A 1 192 ? 19.215 46.823 7.050 1.00 14.49 ? 227 ILE A CA 1 ATOM 1375 C C . ILE A 1 192 ? 20.486 46.175 6.499 1.00 16.06 ? 227 ILE A C 1 ATOM 1376 O O . ILE A 1 192 ? 20.528 44.975 6.217 1.00 18.18 ? 227 ILE A O 1 ATOM 1377 C CB . ILE A 1 192 ? 18.270 45.838 7.762 1.00 15.00 ? 227 ILE A CB 1 ATOM 1378 C CG1 . ILE A 1 192 ? 16.939 46.524 8.075 1.00 19.74 ? 227 ILE A CG1 1 ATOM 1379 C CG2 . ILE A 1 192 ? 18.879 45.326 9.048 1.00 18.06 ? 227 ILE A CG2 1 ATOM 1380 C CD1 . ILE A 1 192 ? 17.085 47.767 8.979 1.00 18.27 ? 227 ILE A CD1 1 ATOM 1381 N N . VAL A 1 193 ? 21.513 46.994 6.296 1.00 14.74 ? 228 VAL A N 1 ATOM 1382 C CA . VAL A 1 193 ? 22.720 46.527 5.611 1.00 14.60 ? 228 VAL A CA 1 ATOM 1383 C C . VAL A 1 193 ? 23.736 45.890 6.553 1.00 16.07 ? 228 VAL A C 1 ATOM 1384 O O . VAL A 1 193 ? 24.751 45.373 6.093 1.00 14.85 ? 228 VAL A O 1 ATOM 1385 C CB . VAL A 1 193 ? 23.419 47.654 4.799 1.00 19.38 ? 228 VAL A CB 1 ATOM 1386 C CG1 . VAL A 1 193 ? 22.396 48.335 3.833 1.00 17.05 ? 228 VAL A CG1 1 ATOM 1387 C CG2 . VAL A 1 193 ? 24.059 48.652 5.764 1.00 17.25 ? 228 VAL A CG2 1 ATOM 1388 N N . GLY A 1 194 ? 23.471 45.938 7.855 1.00 16.94 ? 229 GLY A N 1 ATOM 1389 C CA . GLY A 1 194 ? 24.266 45.194 8.826 1.00 18.56 ? 229 GLY A CA 1 ATOM 1390 C C . GLY A 1 194 ? 23.542 45.074 10.159 1.00 23.04 ? 229 GLY A C 1 ATOM 1391 O O . GLY A 1 194 ? 22.524 45.735 10.356 1.00 22.42 ? 229 GLY A O 1 ATOM 1392 N N . ASN A 1 195 ? 24.040 44.236 11.068 1.00 17.31 ? 230 ASN A N 1 ATOM 1393 C CA . ASN A 1 195 ? 23.552 44.238 12.451 1.00 16.54 ? 230 ASN A CA 1 ATOM 1394 C C . ASN A 1 195 ? 23.866 45.582 13.126 1.00 21.88 ? 230 ASN A C 1 ATOM 1395 O O . ASN A 1 195 ? 23.178 46.017 14.047 1.00 22.40 ? 230 ASN A O 1 ATOM 1396 C CB . ASN A 1 195 ? 24.188 43.124 13.291 1.00 19.68 ? 230 ASN A CB 1 ATOM 1397 C CG . ASN A 1 195 ? 23.710 41.738 12.914 1.00 20.60 ? 230 ASN A CG 1 ATOM 1398 O OD1 . ASN A 1 195 ? 22.729 41.579 12.195 1.00 23.28 ? 230 ASN A OD1 1 ATOM 1399 N ND2 . ASN A 1 195 ? 24.390 40.720 13.432 1.00 20.98 ? 230 ASN A ND2 1 ATOM 1400 N N . SER A 1 196 ? 24.925 46.222 12.669 1.00 20.76 ? 231 SER A N 1 ATOM 1401 C CA . SER A 1 196 ? 25.248 47.570 13.112 1.00 24.61 ? 231 SER A CA 1 ATOM 1402 C C . SER A 1 196 ? 25.416 48.447 11.892 1.00 21.37 ? 231 SER A C 1 ATOM 1403 O O . SER A 1 196 ? 25.949 48.001 10.879 1.00 21.11 ? 231 SER A O 1 ATOM 1404 C CB . SER A 1 196 ? 26.533 47.543 13.919 1.00 30.03 ? 231 SER A CB 1 ATOM 1405 O OG . SER A 1 196 ? 26.268 47.074 15.232 1.00 37.86 ? 231 SER A OG 1 ATOM 1406 N N . MET A 1 197 ? 24.927 49.682 11.947 1.00 19.70 ? 232 MET A N 1 ATOM 1407 C CA . MET A 1 197 ? 25.177 50.592 10.827 1.00 16.86 ? 232 MET A CA 1 ATOM 1408 C C . MET A 1 197 ? 25.128 52.058 11.220 1.00 20.03 ? 232 MET A C 1 ATOM 1409 O O . MET A 1 197 ? 24.513 52.421 12.217 1.00 22.93 ? 232 MET A O 1 ATOM 1410 C CB . MET A 1 197 ? 24.211 50.346 9.638 1.00 26.85 ? 232 MET A CB 1 ATOM 1411 C CG . MET A 1 197 ? 23.001 49.487 9.928 1.00 26.15 ? 232 MET A CG 1 ATOM 1412 S SD . MET A 1 197 ? 21.726 49.514 8.641 1.00 22.96 ? 232 MET A SD 1 ATOM 1413 C CE . MET A 1 197 ? 20.299 49.281 9.725 1.00 19.35 ? 232 MET A CE 1 ATOM 1414 N N . TYR A 1 198 ? 25.763 52.894 10.405 1.00 19.54 ? 233 TYR A N 1 ATOM 1415 C CA . TYR A 1 198 ? 25.697 54.332 10.623 1.00 21.61 ? 233 TYR A CA 1 ATOM 1416 C C . TYR A 1 198 ? 25.013 54.969 9.439 1.00 17.81 ? 233 TYR A C 1 ATOM 1417 O O . TYR A 1 198 ? 25.392 54.721 8.298 1.00 23.89 ? 233 TYR A O 1 ATOM 1418 C CB . TYR A 1 198 ? 27.099 54.916 10.808 1.00 20.24 ? 233 TYR A CB 1 ATOM 1419 C CG . TYR A 1 198 ? 27.113 56.433 10.876 1.00 23.82 ? 233 TYR A CG 1 ATOM 1420 C CD1 . TYR A 1 198 ? 26.689 57.102 12.015 1.00 28.84 ? 233 TYR A CD1 1 ATOM 1421 C CD2 . TYR A 1 198 ? 27.551 57.187 9.790 1.00 28.25 ? 233 TYR A CD2 1 ATOM 1422 C CE1 . TYR A 1 198 ? 26.696 58.494 12.077 1.00 28.05 ? 233 TYR A CE1 1 ATOM 1423 C CE2 . TYR A 1 198 ? 27.569 58.573 9.840 1.00 33.39 ? 233 TYR A CE2 1 ATOM 1424 C CZ . TYR A 1 198 ? 27.148 59.216 10.983 1.00 33.68 ? 233 TYR A CZ 1 ATOM 1425 O OH . TYR A 1 198 ? 27.165 60.591 11.015 1.00 33.91 ? 233 TYR A OH 1 ATOM 1426 N N . ASP A 1 199 ? 23.975 55.758 9.693 1.00 20.54 ? 234 ASP A N 1 ATOM 1427 C CA . ASP A 1 199 ? 23.336 56.497 8.612 1.00 21.03 ? 234 ASP A CA 1 ATOM 1428 C C . ASP A 1 199 ? 23.790 57.954 8.674 1.00 26.26 ? 234 ASP A C 1 ATOM 1429 O O . ASP A 1 199 ? 23.497 58.647 9.644 1.00 30.18 ? 234 ASP A O 1 ATOM 1430 C CB . ASP A 1 199 ? 21.810 56.421 8.722 1.00 22.21 ? 234 ASP A CB 1 ATOM 1431 C CG . ASP A 1 199 ? 21.113 57.007 7.498 1.00 27.05 ? 234 ASP A CG 1 ATOM 1432 O OD1 . ASP A 1 199 ? 21.354 58.195 7.177 1.00 29.35 ? 234 ASP A OD1 1 ATOM 1433 O OD2 . ASP A 1 199 ? 20.351 56.273 6.831 1.00 26.13 ? 234 ASP A OD2 1 ATOM 1434 N N . PRO A 1 200 ? 24.485 58.418 7.633 1.00 25.02 ? 235 PRO A N 1 ATOM 1435 C CA . PRO A 1 200 ? 25.087 59.761 7.632 1.00 29.96 ? 235 PRO A CA 1 ATOM 1436 C C . PRO A 1 200 ? 24.062 60.891 7.573 1.00 30.54 ? 235 PRO A C 1 ATOM 1437 O O . PRO A 1 200 ? 24.350 61.984 8.070 1.00 33.48 ? 235 PRO A O 1 ATOM 1438 C CB . PRO A 1 200 ? 25.949 59.757 6.371 1.00 27.35 ? 235 PRO A CB 1 ATOM 1439 C CG . PRO A 1 200 ? 25.277 58.772 5.466 1.00 36.87 ? 235 PRO A CG 1 ATOM 1440 C CD . PRO A 1 200 ? 24.715 57.704 6.367 1.00 25.44 ? 235 PRO A CD 1 ATOM 1441 N N . VAL A 1 201 ? 22.897 60.635 6.979 1.00 31.54 ? 236 VAL A N 1 ATOM 1442 C CA . VAL A 1 201 ? 21.794 61.600 6.965 1.00 32.48 ? 236 VAL A CA 1 ATOM 1443 C C . VAL A 1 201 ? 21.079 61.699 8.319 1.00 33.59 ? 236 VAL A C 1 ATOM 1444 O O . VAL A 1 201 ? 20.777 62.801 8.782 1.00 35.79 ? 236 VAL A O 1 ATOM 1445 C CB . VAL A 1 201 ? 20.774 61.283 5.847 1.00 28.98 ? 236 VAL A CB 1 ATOM 1446 C CG1 . VAL A 1 201 ? 19.571 62.216 5.923 1.00 31.23 ? 236 VAL A CG1 1 ATOM 1447 C CG2 . VAL A 1 201 ? 21.433 61.352 4.495 1.00 29.62 ? 236 VAL A CG2 1 ATOM 1448 N N . PHE A 1 202 ? 20.811 60.561 8.959 1.00 28.97 ? 237 PHE A N 1 ATOM 1449 C CA . PHE A 1 202 ? 20.294 60.555 10.326 1.00 32.05 ? 237 PHE A CA 1 ATOM 1450 C C . PHE A 1 202 ? 21.348 61.032 11.320 1.00 34.27 ? 237 PHE A C 1 ATOM 1451 O O . PHE A 1 202 ? 21.006 61.551 12.384 1.00 29.07 ? 237 PHE A O 1 ATOM 1452 C CB . PHE A 1 202 ? 19.888 59.143 10.782 1.00 31.65 ? 237 PHE A CB 1 ATOM 1453 C CG . PHE A 1 202 ? 18.802 58.510 9.970 1.00 30.77 ? 237 PHE A CG 1 ATOM 1454 C CD1 . PHE A 1 202 ? 18.011 59.257 9.110 1.00 26.77 ? 237 PHE A CD1 1 ATOM 1455 C CD2 . PHE A 1 202 ? 18.579 57.144 10.066 1.00 27.19 ? 237 PHE A CD2 1 ATOM 1456 C CE1 . PHE A 1 202 ? 17.001 58.656 8.360 1.00 28.14 ? 237 PHE A CE1 1 ATOM 1457 C CE2 . PHE A 1 202 ? 17.575 56.534 9.328 1.00 26.04 ? 237 PHE A CE2 1 ATOM 1458 C CZ . PHE A 1 202 ? 16.786 57.292 8.462 1.00 27.61 ? 237 PHE A CZ 1 ATOM 1459 N N . ASP A 1 203 ? 22.622 60.831 10.973 1.00 30.95 ? 238 ASP A N 1 ATOM 1460 C CA . ASP A 1 203 ? 23.728 60.909 11.930 1.00 29.73 ? 238 ASP A CA 1 ATOM 1461 C C . ASP A 1 203 ? 23.331 60.118 13.165 1.00 34.27 ? 238 ASP A C 1 ATOM 1462 O O . ASP A 1 203 ? 23.255 60.628 14.284 1.00 32.02 ? 238 ASP A O 1 ATOM 1463 C CB . ASP A 1 203 ? 24.084 62.364 12.264 1.00 37.66 ? 238 ASP A CB 1 ATOM 1464 C CG . ASP A 1 203 ? 25.286 62.481 13.193 1.00 42.46 ? 238 ASP A CG 1 ATOM 1465 O OD1 . ASP A 1 203 ? 26.213 61.645 13.109 1.00 39.69 ? 238 ASP A OD1 1 ATOM 1466 O OD2 . ASP A 1 203 ? 25.299 63.422 14.017 1.00 44.72 ? 238 ASP A OD2 1 ATOM 1467 N N . ALA A 1 204 ? 23.027 58.851 12.940 1.00 28.31 ? 239 ALA A N 1 ATOM 1468 C CA . ALA A 1 204 ? 22.576 58.007 14.012 1.00 25.44 ? 239 ALA A CA 1 ATOM 1469 C C . ALA A 1 204 ? 23.102 56.623 13.719 1.00 26.84 ? 239 ALA A C 1 ATOM 1470 O O . ALA A 1 204 ? 23.374 56.281 12.557 1.00 23.68 ? 239 ALA A O 1 ATOM 1471 C CB . ALA A 1 204 ? 21.066 58.005 14.090 1.00 29.63 ? 239 ALA A CB 1 ATOM 1472 N N . THR A 1 205 ? 23.247 55.847 14.783 1.00 28.10 ? 240 THR A N 1 ATOM 1473 C CA . THR A 1 205 ? 23.812 54.517 14.704 1.00 30.20 ? 240 THR A CA 1 ATOM 1474 C C . THR A 1 205 ? 22.823 53.457 15.179 1.00 26.33 ? 240 THR A C 1 ATOM 1475 O O . THR A 1 205 ? 22.230 53.554 16.254 1.00 32.76 ? 240 THR A O 1 ATOM 1476 C CB . THR A 1 205 ? 25.117 54.429 15.525 1.00 30.60 ? 240 THR A CB 1 ATOM 1477 O OG1 . THR A 1 205 ? 26.049 55.403 15.033 1.00 32.77 ? 240 THR A OG1 1 ATOM 1478 C CG2 . THR A 1 205 ? 25.723 53.059 15.396 1.00 38.07 ? 240 THR A CG2 1 ATOM 1479 N N . PHE A 1 206 ? 22.668 52.438 14.351 1.00 24.89 ? 241 PHE A N 1 ATOM 1480 C CA . PHE A 1 206 ? 21.790 51.298 14.590 1.00 23.79 ? 241 PHE A CA 1 ATOM 1481 C C . PHE A 1 206 ? 22.664 50.196 15.176 1.00 26.85 ? 241 PHE A C 1 ATOM 1482 O O . PHE A 1 206 ? 23.745 49.910 14.655 1.00 28.03 ? 241 PHE A O 1 ATOM 1483 C CB . PHE A 1 206 ? 21.228 50.894 13.216 1.00 20.66 ? 241 PHE A CB 1 ATOM 1484 C CG . PHE A 1 206 ? 20.280 49.712 13.212 1.00 22.75 ? 241 PHE A CG 1 ATOM 1485 C CD1 . PHE A 1 206 ? 20.762 48.407 13.289 1.00 27.54 ? 241 PHE A CD1 1 ATOM 1486 C CD2 . PHE A 1 206 ? 18.929 49.898 13.003 1.00 25.25 ? 241 PHE A CD2 1 ATOM 1487 C CE1 . PHE A 1 206 ? 19.915 47.328 13.235 1.00 26.45 ? 241 PHE A CE1 1 ATOM 1488 C CE2 . PHE A 1 206 ? 18.065 48.803 12.925 1.00 24.36 ? 241 PHE A CE2 1 ATOM 1489 C CZ . PHE A 1 206 ? 18.564 47.518 13.050 1.00 25.43 ? 241 PHE A CZ 1 ATOM 1490 N N . HIS A 1 207 ? 22.213 49.588 16.265 1.00 30.84 ? 242 HIS A N 1 ATOM 1491 C CA . HIS A 1 207 ? 22.928 48.484 16.904 1.00 36.33 ? 242 HIS A CA 1 ATOM 1492 C C . HIS A 1 207 ? 21.994 47.319 17.217 1.00 36.58 ? 242 HIS A C 1 ATOM 1493 O O . HIS A 1 207 ? 20.816 47.524 17.479 1.00 34.34 ? 242 HIS A O 1 ATOM 1494 C CB . HIS A 1 207 ? 23.531 48.935 18.226 1.00 39.05 ? 242 HIS A CB 1 ATOM 1495 C CG . HIS A 1 207 ? 24.765 49.765 18.091 1.00 46.65 ? 242 HIS A CG 1 ATOM 1496 N ND1 . HIS A 1 207 ? 25.882 49.333 17.407 1.00 47.05 ? 242 HIS A ND1 1 ATOM 1497 C CD2 . HIS A 1 207 ? 25.076 50.986 18.591 1.00 44.87 ? 242 HIS A CD2 1 ATOM 1498 C CE1 . HIS A 1 207 ? 26.820 50.262 17.476 1.00 48.91 ? 242 HIS A CE1 1 ATOM 1499 N NE2 . HIS A 1 207 ? 26.358 51.274 18.189 1.00 46.38 ? 242 HIS A NE2 1 ATOM 1500 N N . LEU A 1 208 ? 22.542 46.105 17.202 1.00 38.09 ? 243 LEU A N 1 ATOM 1501 C CA . LEU A 1 208 ? 21.850 44.907 17.678 1.00 43.87 ? 243 LEU A CA 1 ATOM 1502 C C . LEU A 1 208 ? 21.123 45.184 18.975 1.00 45.38 ? 243 LEU A C 1 ATOM 1503 O O . LEU A 1 208 ? 19.922 44.932 19.095 1.00 48.58 ? 243 LEU A O 1 ATOM 1504 C CB . LEU A 1 208 ? 22.865 43.805 17.965 1.00 47.56 ? 243 LEU A CB 1 ATOM 1505 C CG . LEU A 1 208 ? 23.264 42.807 16.886 1.00 48.24 ? 243 LEU A CG 1 ATOM 1506 C CD1 . LEU A 1 208 ? 24.549 42.109 17.321 1.00 48.35 ? 243 LEU A CD1 1 ATOM 1507 C CD2 . LEU A 1 208 ? 22.154 41.795 16.669 1.00 44.53 ? 243 LEU A CD2 1 ATOM 1508 N N . ARG A 1 209 ? 21.876 45.686 19.953 1.00 46.53 ? 244 ARG A N 1 ATOM 1509 C CA . ARG A 1 209 ? 21.340 46.027 21.265 1.00 49.62 ? 244 ARG A CA 1 ATOM 1510 C C . ARG A 1 209 ? 21.099 47.528 21.354 1.00 50.47 ? 244 ARG A C 1 ATOM 1511 O O . ARG A 1 209 ? 21.857 48.315 20.790 1.00 52.27 ? 244 ARG A O 1 ATOM 1512 C CB . ARG A 1 209 ? 22.309 45.585 22.369 1.00 56.82 ? 244 ARG A CB 1 ATOM 1513 N N . GLY A 1 210 ? 20.046 47.928 22.057 1.00 47.66 ? 245 GLY A N 1 ATOM 1514 C CA . GLY A 1 210 ? 19.723 49.338 22.169 1.00 49.58 ? 245 GLY A CA 1 ATOM 1515 C C . GLY A 1 210 ? 18.359 49.678 21.603 1.00 41.79 ? 245 GLY A C 1 ATOM 1516 O O . GLY A 1 210 ? 17.629 48.804 21.131 1.00 48.37 ? 245 GLY A O 1 ATOM 1517 N N . ARG A 1 211 ? 18.014 50.958 21.643 1.00 42.66 ? 246 ARG A N 1 ATOM 1518 C CA . ARG A 1 211 ? 16.657 51.384 21.322 1.00 43.78 ? 246 ARG A CA 1 ATOM 1519 C C . ARG A 1 211 ? 16.514 51.906 19.900 1.00 42.08 ? 246 ARG A C 1 ATOM 1520 O O . ARG A 1 211 ? 15.413 51.890 19.344 1.00 40.39 ? 246 ARG A O 1 ATOM 1521 C CB . ARG A 1 211 ? 16.188 52.462 22.307 1.00 43.80 ? 246 ARG A CB 1 ATOM 1522 N N . GLU A 1 212 ? 17.615 52.386 19.326 1.00 37.41 ? 247 GLU A N 1 ATOM 1523 C CA . GLU A 1 212 ? 17.567 53.040 18.017 1.00 41.33 ? 247 GLU A CA 1 ATOM 1524 C C . GLU A 1 212 ? 16.923 52.167 16.933 1.00 34.94 ? 247 GLU A C 1 ATOM 1525 O O . GLU A 1 212 ? 16.177 52.666 16.087 1.00 37.63 ? 247 GLU A O 1 ATOM 1526 C CB . GLU A 1 212 ? 18.968 53.483 17.577 1.00 36.68 ? 247 GLU A CB 1 ATOM 1527 C CG . GLU A 1 212 ? 19.009 54.183 16.222 1.00 33.82 ? 247 GLU A CG 1 ATOM 1528 C CD . GLU A 1 212 ? 18.120 55.413 16.154 1.00 39.06 ? 247 GLU A CD 1 ATOM 1529 O OE1 . GLU A 1 212 ? 17.639 55.744 15.046 1.00 34.52 ? 247 GLU A OE1 1 ATOM 1530 O OE2 . GLU A 1 212 ? 17.916 56.068 17.200 1.00 49.67 ? 247 GLU A OE2 1 ATOM 1531 N N . LYS A 1 213 ? 17.211 50.868 16.977 1.00 37.08 ? 248 LYS A N 1 ATOM 1532 C CA . LYS A 1 213 ? 16.684 49.911 16.000 1.00 32.01 ? 248 LYS A CA 1 ATOM 1533 C C . LYS A 1 213 ? 15.151 49.827 16.006 1.00 35.95 ? 248 LYS A C 1 ATOM 1534 O O . LYS A 1 213 ? 14.544 49.368 15.037 1.00 30.91 ? 248 LYS A O 1 ATOM 1535 C CB . LYS A 1 213 ? 17.272 48.522 16.261 1.00 33.46 ? 248 LYS A CB 1 ATOM 1536 C CG . LYS A 1 213 ? 16.907 47.923 17.621 1.00 33.66 ? 248 LYS A CG 1 ATOM 1537 C CD . LYS A 1 213 ? 17.264 46.447 17.660 1.00 31.30 ? 248 LYS A CD 1 ATOM 1538 C CE . LYS A 1 213 ? 16.852 45.784 18.979 1.00 48.75 ? 248 LYS A CE 1 ATOM 1539 N NZ . LYS A 1 213 ? 17.710 46.195 20.129 1.00 46.41 ? 248 LYS A NZ 1 ATOM 1540 N N . PHE A 1 214 ? 14.530 50.255 17.101 1.00 35.55 ? 249 PHE A N 1 ATOM 1541 C CA . PHE A 1 214 ? 13.071 50.260 17.190 1.00 35.93 ? 249 PHE A CA 1 ATOM 1542 C C . PHE A 1 214 ? 12.433 51.403 16.399 1.00 36.04 ? 249 PHE A C 1 ATOM 1543 O O . PHE A 1 214 ? 11.223 51.399 16.171 1.00 41.41 ? 249 PHE A O 1 ATOM 1544 C CB . PHE A 1 214 ? 12.616 50.296 18.657 1.00 37.52 ? 249 PHE A CB 1 ATOM 1545 C CG . PHE A 1 214 ? 12.933 49.038 19.416 1.00 36.70 ? 249 PHE A CG 1 ATOM 1546 C CD1 . PHE A 1 214 ? 12.107 47.928 19.318 1.00 40.63 ? 249 PHE A CD1 1 ATOM 1547 C CD2 . PHE A 1 214 ? 14.064 48.961 20.214 1.00 39.32 ? 249 PHE A CD2 1 ATOM 1548 C CE1 . PHE A 1 214 ? 12.398 46.765 20.007 1.00 43.38 ? 249 PHE A CE1 1 ATOM 1549 C CE2 . PHE A 1 214 ? 14.365 47.804 20.901 1.00 45.55 ? 249 PHE A CE2 1 ATOM 1550 C CZ . PHE A 1 214 ? 13.527 46.700 20.800 1.00 43.25 ? 249 PHE A CZ 1 ATOM 1551 N N . ASN A 1 215 ? 13.238 52.376 15.977 1.00 31.77 ? 250 ASN A N 1 ATOM 1552 C CA . ASN A 1 215 ? 12.727 53.474 15.156 1.00 31.34 ? 250 ASN A CA 1 ATOM 1553 C C . ASN A 1 215 ? 12.429 52.987 13.732 1.00 37.25 ? 250 ASN A C 1 ATOM 1554 O O . ASN A 1 215 ? 13.270 52.365 13.087 1.00 27.83 ? 250 ASN A O 1 ATOM 1555 C CB . ASN A 1 215 ? 13.718 54.643 15.144 1.00 34.13 ? 250 ASN A CB 1 ATOM 1556 C CG . ASN A 1 215 ? 13.129 55.930 14.543 1.00 41.06 ? 250 ASN A CG 1 ATOM 1557 O OD1 . ASN A 1 215 ? 12.336 55.905 13.599 1.00 41.59 ? 250 ASN A OD1 1 ATOM 1558 N ND2 . ASN A 1 215 ? 13.532 57.064 15.098 1.00 43.47 ? 250 ASN A ND2 1 ATOM 1559 N N . HIS A 1 216 ? 11.230 53.279 13.241 1.00 38.16 ? 251 HIS A N 1 ATOM 1560 C CA . HIS A 1 216 ? 10.798 52.734 11.961 1.00 38.09 ? 251 HIS A CA 1 ATOM 1561 C C . HIS A 1 216 ? 11.556 53.308 10.768 1.00 33.35 ? 251 HIS A C 1 ATOM 1562 O O . HIS A 1 216 ? 11.522 52.737 9.672 1.00 28.06 ? 251 HIS A O 1 ATOM 1563 C CB . HIS A 1 216 ? 9.291 52.917 11.770 1.00 43.35 ? 251 HIS A CB 1 ATOM 1564 C CG . HIS A 1 216 ? 8.461 52.028 12.642 1.00 51.05 ? 251 HIS A CG 1 ATOM 1565 N ND1 . HIS A 1 216 ? 7.100 51.879 12.474 1.00 57.73 ? 251 HIS A ND1 1 ATOM 1566 C CD2 . HIS A 1 216 ? 8.798 51.246 13.695 1.00 48.92 ? 251 HIS A CD2 1 ATOM 1567 C CE1 . HIS A 1 216 ? 6.635 51.044 13.386 1.00 56.09 ? 251 HIS A CE1 1 ATOM 1568 N NE2 . HIS A 1 216 ? 7.645 50.645 14.139 1.00 55.21 ? 251 HIS A NE2 1 ATOM 1569 N N . ARG A 1 217 ? 12.262 54.415 10.983 1.00 31.71 ? 252 ARG A N 1 ATOM 1570 C CA . ARG A 1 217 ? 12.972 55.084 9.896 1.00 29.27 ? 252 ARG A CA 1 ATOM 1571 C C . ARG A 1 217 ? 14.047 54.211 9.248 1.00 24.75 ? 252 ARG A C 1 ATOM 1572 O O . ARG A 1 217 ? 14.463 54.471 8.126 1.00 30.45 ? 252 ARG A O 1 ATOM 1573 C CB . ARG A 1 217 ? 13.598 56.405 10.375 1.00 31.65 ? 252 ARG A CB 1 ATOM 1574 C CG . ARG A 1 217 ? 14.715 56.247 11.403 1.00 33.60 ? 252 ARG A CG 1 ATOM 1575 C CD . ARG A 1 217 ? 15.344 57.605 11.754 1.00 32.85 ? 252 ARG A CD 1 ATOM 1576 N NE . ARG A 1 217 ? 16.183 57.522 12.950 1.00 36.34 ? 252 ARG A NE 1 ATOM 1577 C CZ . ARG A 1 217 ? 16.934 58.519 13.413 1.00 36.23 ? 252 ARG A CZ 1 ATOM 1578 N NH1 . ARG A 1 217 ? 16.950 59.691 12.782 1.00 30.46 ? 252 ARG A NH1 1 ATOM 1579 N NH2 . ARG A 1 217 ? 17.665 58.343 14.511 1.00 37.67 ? 252 ARG A NH2 1 ATOM 1580 N N . TRP A 1 218 ? 14.487 53.172 9.946 1.00 26.32 ? 253 TRP A N 1 ATOM 1581 C CA . TRP A 1 218 ? 15.540 52.302 9.400 1.00 26.92 ? 253 TRP A CA 1 ATOM 1582 C C . TRP A 1 218 ? 15.013 51.285 8.400 1.00 22.34 ? 253 TRP A C 1 ATOM 1583 O O . TRP A 1 218 ? 15.747 50.822 7.518 1.00 18.70 ? 253 TRP A O 1 ATOM 1584 C CB . TRP A 1 218 ? 16.249 51.557 10.532 1.00 21.80 ? 253 TRP A CB 1 ATOM 1585 C CG . TRP A 1 218 ? 17.003 52.471 11.450 1.00 27.04 ? 253 TRP A CG 1 ATOM 1586 C CD1 . TRP A 1 218 ? 16.551 53.012 12.611 1.00 30.42 ? 253 TRP A CD1 1 ATOM 1587 C CD2 . TRP A 1 218 ? 18.348 52.947 11.281 1.00 23.22 ? 253 TRP A CD2 1 ATOM 1588 N NE1 . TRP A 1 218 ? 17.529 53.801 13.178 1.00 27.52 ? 253 TRP A NE1 1 ATOM 1589 C CE2 . TRP A 1 218 ? 18.642 53.772 12.384 1.00 25.16 ? 253 TRP A CE2 1 ATOM 1590 C CE3 . TRP A 1 218 ? 19.330 52.754 10.307 1.00 20.07 ? 253 TRP A CE3 1 ATOM 1591 C CZ2 . TRP A 1 218 ? 19.877 54.406 12.540 1.00 24.26 ? 253 TRP A CZ2 1 ATOM 1592 C CZ3 . TRP A 1 218 ? 20.566 53.379 10.469 1.00 24.98 ? 253 TRP A CZ3 1 ATOM 1593 C CH2 . TRP A 1 218 ? 20.823 54.194 11.578 1.00 23.24 ? 253 TRP A CH2 1 ATOM 1594 N N . TRP A 1 219 ? 13.737 50.935 8.550 1.00 24.46 ? 254 TRP A N 1 ATOM 1595 C CA . TRP A 1 219 ? 13.190 49.734 7.920 1.00 23.71 ? 254 TRP A CA 1 ATOM 1596 C C . TRP A 1 219 ? 12.360 50.024 6.675 1.00 26.29 ? 254 TRP A C 1 ATOM 1597 O O . TRP A 1 219 ? 11.245 50.543 6.769 1.00 26.05 ? 254 TRP A O 1 ATOM 1598 C CB . TRP A 1 219 ? 12.340 48.977 8.938 1.00 21.04 ? 254 TRP A CB 1 ATOM 1599 C CG . TRP A 1 219 ? 13.044 48.706 10.231 1.00 24.03 ? 254 TRP A CG 1 ATOM 1600 C CD1 . TRP A 1 219 ? 13.197 49.570 11.291 1.00 22.21 ? 254 TRP A CD1 1 ATOM 1601 C CD2 . TRP A 1 219 ? 13.702 47.493 10.605 1.00 20.87 ? 254 TRP A CD2 1 ATOM 1602 N NE1 . TRP A 1 219 ? 13.911 48.962 12.291 1.00 24.21 ? 254 TRP A NE1 1 ATOM 1603 C CE2 . TRP A 1 219 ? 14.230 47.686 11.900 1.00 24.48 ? 254 TRP A CE2 1 ATOM 1604 C CE3 . TRP A 1 219 ? 13.892 46.257 9.970 1.00 22.67 ? 254 TRP A CE3 1 ATOM 1605 C CZ2 . TRP A 1 219 ? 14.934 46.689 12.575 1.00 27.82 ? 254 TRP A CZ2 1 ATOM 1606 C CZ3 . TRP A 1 219 ? 14.586 45.258 10.647 1.00 25.77 ? 254 TRP A CZ3 1 ATOM 1607 C CH2 . TRP A 1 219 ? 15.106 45.484 11.936 1.00 22.13 ? 254 TRP A CH2 1 ATOM 1608 N N . GLY A 1 220 ? 12.897 49.677 5.512 1.00 19.12 ? 255 GLY A N 1 ATOM 1609 C CA . GLY A 1 220 ? 12.231 49.931 4.248 1.00 23.94 ? 255 GLY A CA 1 ATOM 1610 C C . GLY A 1 220 ? 11.561 48.699 3.666 1.00 23.10 ? 255 GLY A C 1 ATOM 1611 O O . GLY A 1 220 ? 11.484 47.652 4.309 1.00 23.11 ? 255 GLY A O 1 ATOM 1612 N N . GLY A 1 221 ? 11.078 48.834 2.439 1.00 21.28 ? 256 GLY A N 1 ATOM 1613 C CA . GLY A 1 221 ? 10.352 47.775 1.771 1.00 25.61 ? 256 GLY A CA 1 ATOM 1614 C C . GLY A 1 221 ? 9.063 47.454 2.505 1.00 24.33 ? 256 GLY A C 1 ATOM 1615 O O . GLY A 1 221 ? 8.581 48.243 3.329 1.00 25.67 ? 256 GLY A O 1 ATOM 1616 N N . GLN A 1 222 ? 8.507 46.282 2.236 1.00 20.53 ? 257 GLN A N 1 ATOM 1617 C CA . GLN A 1 222 ? 7.244 45.907 2.860 1.00 18.99 ? 257 GLN A CA 1 ATOM 1618 C C . GLN A 1 222 ? 7.275 44.447 3.331 1.00 21.98 ? 257 GLN A C 1 ATOM 1619 O O . GLN A 1 222 ? 7.132 43.529 2.526 1.00 21.57 ? 257 GLN A O 1 ATOM 1620 C CB . GLN A 1 222 ? 6.091 46.126 1.879 1.00 23.56 ? 257 GLN A CB 1 ATOM 1621 C CG . GLN A 1 222 ? 4.718 45.819 2.478 1.00 25.97 ? 257 GLN A CG 1 ATOM 1622 C CD . GLN A 1 222 ? 3.602 45.921 1.443 1.00 30.34 ? 257 GLN A CD 1 ATOM 1623 O OE1 . GLN A 1 222 ? 3.189 44.921 0.852 1.00 25.27 ? 257 GLN A OE1 1 ATOM 1624 N NE2 . GLN A 1 222 ? 3.124 47.139 1.207 1.00 27.90 ? 257 GLN A NE2 1 ATOM 1625 N N . PRO A 1 223 ? 7.435 44.239 4.648 1.00 20.02 ? 258 PRO A N 1 ATOM 1626 C CA . PRO A 1 223 ? 7.586 42.879 5.163 1.00 20.93 ? 258 PRO A CA 1 ATOM 1627 C C . PRO A 1 223 ? 6.285 42.090 5.098 1.00 25.08 ? 258 PRO A C 1 ATOM 1628 O O . PRO A 1 223 ? 5.199 42.675 4.952 1.00 20.52 ? 258 PRO A O 1 ATOM 1629 C CB . PRO A 1 223 ? 8.015 43.097 6.613 1.00 22.21 ? 258 PRO A CB 1 ATOM 1630 C CG . PRO A 1 223 ? 7.452 44.468 6.980 1.00 18.43 ? 258 PRO A CG 1 ATOM 1631 C CD . PRO A 1 223 ? 7.587 45.260 5.701 1.00 18.40 ? 258 PRO A CD 1 ATOM 1632 N N . LEU A 1 224 ? 6.402 40.773 5.223 1.00 21.46 ? 259 LEU A N 1 ATOM 1633 C CA . LEU A 1 224 ? 5.277 39.878 5.006 1.00 22.37 ? 259 LEU A CA 1 ATOM 1634 C C . LEU A 1 224 ? 4.063 40.227 5.846 1.00 24.27 ? 259 LEU A C 1 ATOM 1635 O O . LEU A 1 224 ? 2.925 40.164 5.355 1.00 25.03 ? 259 LEU A O 1 ATOM 1636 C CB . LEU A 1 224 ? 5.700 38.427 5.237 1.00 22.08 ? 259 LEU A CB 1 ATOM 1637 C CG . LEU A 1 224 ? 4.646 37.363 4.924 1.00 21.53 ? 259 LEU A CG 1 ATOM 1638 C CD1 . LEU A 1 224 ? 4.262 37.389 3.422 1.00 21.34 ? 259 LEU A CD1 1 ATOM 1639 C CD2 . LEU A 1 224 ? 5.161 35.983 5.332 1.00 19.10 ? 259 LEU A CD2 1 ATOM 1640 N N . TRP A 1 225 ? 4.280 40.583 7.111 1.00 21.13 ? 260 TRP A N 1 ATOM 1641 C CA . TRP A 1 225 ? 3.154 40.816 8.019 1.00 22.27 ? 260 TRP A CA 1 ATOM 1642 C C . TRP A 1 225 ? 2.358 42.053 7.596 1.00 28.22 ? 260 TRP A C 1 ATOM 1643 O O . TRP A 1 225 ? 1.136 42.119 7.775 1.00 24.87 ? 260 TRP A O 1 ATOM 1644 C CB . TRP A 1 225 ? 3.606 40.921 9.491 1.00 23.43 ? 260 TRP A CB 1 ATOM 1645 C CG . TRP A 1 225 ? 4.705 41.930 9.768 1.00 24.92 ? 260 TRP A CG 1 ATOM 1646 C CD1 . TRP A 1 225 ? 4.549 43.244 10.141 1.00 24.54 ? 260 TRP A CD1 1 ATOM 1647 C CD2 . TRP A 1 225 ? 6.127 41.691 9.738 1.00 24.93 ? 260 TRP A CD2 1 ATOM 1648 N NE1 . TRP A 1 225 ? 5.790 43.833 10.324 1.00 26.50 ? 260 TRP A NE1 1 ATOM 1649 C CE2 . TRP A 1 225 ? 6.767 42.904 10.080 1.00 22.41 ? 260 TRP A CE2 1 ATOM 1650 C CE3 . TRP A 1 225 ? 6.915 40.576 9.431 1.00 25.54 ? 260 TRP A CE3 1 ATOM 1651 C CZ2 . TRP A 1 225 ? 8.158 43.026 10.135 1.00 23.70 ? 260 TRP A CZ2 1 ATOM 1652 C CZ3 . TRP A 1 225 ? 8.290 40.698 9.486 1.00 24.99 ? 260 TRP A CZ3 1 ATOM 1653 C CH2 . TRP A 1 225 ? 8.898 41.916 9.837 1.00 26.97 ? 260 TRP A CH2 1 ATOM 1654 N N . ILE A 1 226 ? 3.053 43.028 7.025 1.00 23.19 ? 261 ILE A N 1 ATOM 1655 C CA . ILE A 1 226 ? 2.393 44.214 6.512 1.00 25.51 ? 261 ILE A CA 1 ATOM 1656 C C . ILE A 1 226 ? 1.655 43.906 5.217 1.00 27.08 ? 261 ILE A C 1 ATOM 1657 O O . ILE A 1 226 ? 0.505 44.308 5.039 1.00 25.93 ? 261 ILE A O 1 ATOM 1658 C CB . ILE A 1 226 ? 3.376 45.367 6.304 1.00 25.58 ? 261 ILE A CB 1 ATOM 1659 C CG1 . ILE A 1 226 ? 3.998 45.768 7.641 1.00 30.89 ? 261 ILE A CG1 1 ATOM 1660 C CG2 . ILE A 1 226 ? 2.679 46.550 5.628 1.00 26.80 ? 261 ILE A CG2 1 ATOM 1661 C CD1 . ILE A 1 226 ? 2.999 46.131 8.706 1.00 33.11 ? 261 ILE A CD1 1 ATOM 1662 N N . THR A 1 227 ? 2.306 43.175 4.320 1.00 23.60 ? 262 THR A N 1 ATOM 1663 C CA . THR A 1 227 ? 1.670 42.759 3.084 1.00 25.32 ? 262 THR A CA 1 ATOM 1664 C C . THR A 1 227 ? 0.391 41.962 3.372 1.00 32.72 ? 262 THR A C 1 ATOM 1665 O O . THR A 1 227 ? -0.645 42.154 2.728 1.00 25.45 ? 262 THR A O 1 ATOM 1666 C CB . THR A 1 227 ? 2.601 41.845 2.295 1.00 27.43 ? 262 THR A CB 1 ATOM 1667 O OG1 . THR A 1 227 ? 3.822 42.541 2.026 1.00 27.27 ? 262 THR A OG1 1 ATOM 1668 C CG2 . THR A 1 227 ? 1.957 41.432 0.973 1.00 23.20 ? 262 THR A CG2 1 ATOM 1669 N N . ALA A 1 228 ? 0.475 41.060 4.341 1.00 22.87 ? 263 ALA A N 1 ATOM 1670 C CA . ALA A 1 228 ? -0.688 40.286 4.745 1.00 22.95 ? 263 ALA A CA 1 ATOM 1671 C C . ALA A 1 228 ? -1.783 41.217 5.266 1.00 27.24 ? 263 ALA A C 1 ATOM 1672 O O . ALA A 1 228 ? -2.934 41.176 4.805 1.00 28.06 ? 263 ALA A O 1 ATOM 1673 C CB . ALA A 1 228 ? -0.294 39.264 5.820 1.00 25.42 ? 263 ALA A CB 1 ATOM 1674 N N . THR A 1 229 ? -1.425 42.069 6.216 1.00 23.44 ? 264 THR A N 1 ATOM 1675 C CA . THR A 1 229 ? -2.429 42.925 6.840 1.00 28.52 ? 264 THR A CA 1 ATOM 1676 C C . THR A 1 229 ? -3.092 43.834 5.810 1.00 34.60 ? 264 THR A C 1 ATOM 1677 O O . THR A 1 229 ? -4.311 43.978 5.802 1.00 31.01 ? 264 THR A O 1 ATOM 1678 C CB . THR A 1 229 ? -1.839 43.767 7.985 1.00 31.79 ? 264 THR A CB 1 ATOM 1679 O OG1 . THR A 1 229 ? -1.217 42.898 8.936 1.00 31.75 ? 264 THR A OG1 1 ATOM 1680 C CG2 . THR A 1 229 ? -2.942 44.547 8.684 1.00 36.92 ? 264 THR A CG2 1 ATOM 1681 N N . LYS A 1 230 ? -2.293 44.423 4.925 1.00 27.76 ? 265 LYS A N 1 ATOM 1682 C CA . LYS A 1 230 ? -2.838 45.355 3.945 1.00 32.36 ? 265 LYS A CA 1 ATOM 1683 C C . LYS A 1 230 ? -3.805 44.667 2.999 1.00 33.34 ? 265 LYS A C 1 ATOM 1684 O O . LYS A 1 230 ? -4.686 45.304 2.421 1.00 32.77 ? 265 LYS A O 1 ATOM 1685 C CB . LYS A 1 230 ? -1.727 46.072 3.170 1.00 31.13 ? 265 LYS A CB 1 ATOM 1686 C CG . LYS A 1 230 ? -1.229 47.333 3.858 1.00 34.67 ? 265 LYS A CG 1 ATOM 1687 C CD . LYS A 1 230 ? -0.146 48.025 3.042 1.00 48.00 ? 265 LYS A CD 1 ATOM 1688 C CE . LYS A 1 230 ? -0.344 49.542 3.025 1.00 49.35 ? 265 LYS A CE 1 ATOM 1689 N NZ . LYS A 1 230 ? -0.311 50.142 4.389 1.00 49.27 ? 265 LYS A NZ 1 ATOM 1690 N N . GLN A 1 231 ? -3.647 43.360 2.845 1.00 29.23 ? 266 GLN A N 1 ATOM 1691 C CA . GLN A 1 231 ? -4.524 42.603 1.968 1.00 27.57 ? 266 GLN A CA 1 ATOM 1692 C C . GLN A 1 231 ? -5.556 41.762 2.728 1.00 27.81 ? 266 GLN A C 1 ATOM 1693 O O . GLN A 1 231 ? -6.148 40.843 2.165 1.00 29.15 ? 266 GLN A O 1 ATOM 1694 C CB . GLN A 1 231 ? -3.707 41.752 0.996 1.00 30.73 ? 266 GLN A CB 1 ATOM 1695 C CG . GLN A 1 231 ? -2.906 42.612 0.007 1.00 29.62 ? 266 GLN A CG 1 ATOM 1696 C CD . GLN A 1 231 ? -1.945 41.799 -0.829 1.00 29.26 ? 266 GLN A CD 1 ATOM 1697 O OE1 . GLN A 1 231 ? -2.296 40.734 -1.337 1.00 29.71 ? 266 GLN A OE1 1 ATOM 1698 N NE2 . GLN A 1 231 ? -0.712 42.298 -0.975 1.00 28.77 ? 266 GLN A NE2 1 ATOM 1699 N N . GLY A 1 232 ? -5.769 42.097 3.999 1.00 31.00 ? 267 GLY A N 1 ATOM 1700 C CA . GLY A 1 232 ? -6.837 41.503 4.791 1.00 32.27 ? 267 GLY A CA 1 ATOM 1701 C C . GLY A 1 232 ? -6.562 40.101 5.306 1.00 34.31 ? 267 GLY A C 1 ATOM 1702 O O . GLY A 1 232 ? -7.491 39.328 5.560 1.00 32.17 ? 267 GLY A O 1 ATOM 1703 N N . VAL A 1 233 ? -5.283 39.755 5.444 1.00 29.57 ? 268 VAL A N 1 ATOM 1704 C CA . VAL A 1 233 ? -4.918 38.484 6.058 1.00 29.60 ? 268 VAL A CA 1 ATOM 1705 C C . VAL A 1 233 ? -4.269 38.745 7.410 1.00 31.25 ? 268 VAL A C 1 ATOM 1706 O O . VAL A 1 233 ? -3.325 39.520 7.528 1.00 27.91 ? 268 VAL A O 1 ATOM 1707 C CB . VAL A 1 233 ? -3.956 37.672 5.180 1.00 27.69 ? 268 VAL A CB 1 ATOM 1708 C CG1 . VAL A 1 233 ? -3.518 36.409 5.910 1.00 24.25 ? 268 VAL A CG1 1 ATOM 1709 C CG2 . VAL A 1 233 ? -4.611 37.330 3.862 1.00 29.02 ? 268 VAL A CG2 1 ATOM 1710 N N . ARG A 1 234 ? -4.790 38.102 8.439 1.00 26.56 ? 269 ARG A N 1 ATOM 1711 C CA . ARG A 1 234 ? -4.332 38.369 9.792 1.00 24.37 ? 269 ARG A CA 1 ATOM 1712 C C . ARG A 1 234 ? -2.993 37.674 10.090 1.00 29.72 ? 269 ARG A C 1 ATOM 1713 O O . ARG A 1 234 ? -2.853 36.465 9.898 1.00 26.70 ? 269 ARG A O 1 ATOM 1714 C CB . ARG A 1 234 ? -5.406 37.923 10.775 1.00 32.49 ? 269 ARG A CB 1 ATOM 1715 C CG . ARG A 1 234 ? -5.034 38.108 12.210 1.00 31.24 ? 269 ARG A CG 1 ATOM 1716 C CD . ARG A 1 234 ? -5.126 39.557 12.603 1.00 46.80 ? 269 ARG A CD 1 ATOM 1717 N NE . ARG A 1 234 ? -5.867 39.709 13.852 1.00 58.22 ? 269 ARG A NE 1 ATOM 1718 C CZ . ARG A 1 234 ? -5.586 40.623 14.773 1.00 58.88 ? 269 ARG A CZ 1 ATOM 1719 N NH1 . ARG A 1 234 ? -4.573 41.464 14.586 1.00 63.45 ? 269 ARG A NH1 1 ATOM 1720 N NH2 . ARG A 1 234 ? -6.314 40.694 15.881 1.00 56.26 ? 269 ARG A NH2 1 ATOM 1721 N N . ALA A 1 235 ? -2.007 38.441 10.551 1.00 25.15 ? 270 ALA A N 1 ATOM 1722 C CA . ALA A 1 235 ? -0.737 37.845 10.970 1.00 27.51 ? 270 ALA A CA 1 ATOM 1723 C C . ALA A 1 235 ? -0.641 37.750 12.492 1.00 29.15 ? 270 ALA A C 1 ATOM 1724 O O . ALA A 1 235 ? -1.056 38.660 13.191 1.00 34.64 ? 270 ALA A O 1 ATOM 1725 C CB . ALA A 1 235 ? 0.416 38.671 10.438 1.00 26.51 ? 270 ALA A CB 1 ATOM 1726 N N . GLY A 1 236 ? -0.086 36.651 12.999 1.00 22.72 ? 271 GLY A N 1 ATOM 1727 C CA . GLY A 1 236 ? 0.339 36.582 14.381 1.00 26.81 ? 271 GLY A CA 1 ATOM 1728 C C . GLY A 1 236 ? 1.528 37.517 14.531 1.00 36.99 ? 271 GLY A C 1 ATOM 1729 O O . GLY A 1 236 ? 2.153 37.896 13.538 1.00 34.88 ? 271 GLY A O 1 ATOM 1730 N N . THR A 1 237 ? 1.846 37.914 15.756 1.00 36.57 ? 272 THR A N 1 ATOM 1731 C CA . THR A 1 237 ? 2.991 38.789 15.940 1.00 36.31 ? 272 THR A CA 1 ATOM 1732 C C . THR A 1 237 ? 4.238 37.952 15.746 1.00 38.12 ? 272 THR A C 1 ATOM 1733 O O . THR A 1 237 ? 4.415 36.948 16.430 1.00 35.73 ? 272 THR A O 1 ATOM 1734 C CB . THR A 1 237 ? 3.003 39.455 17.325 1.00 44.16 ? 272 THR A CB 1 ATOM 1735 O OG1 . THR A 1 237 ? 1.669 39.838 17.693 1.00 43.25 ? 272 THR A OG1 1 ATOM 1736 C CG2 . THR A 1 237 ? 3.902 40.697 17.301 1.00 43.69 ? 272 THR A CG2 1 ATOM 1737 N N . PHE A 1 238 ? 5.075 38.364 14.794 1.00 35.34 ? 273 PHE A N 1 ATOM 1738 C CA . PHE A 1 238 ? 6.251 37.612 14.379 1.00 37.16 ? 273 PHE A CA 1 ATOM 1739 C C . PHE A 1 238 ? 7.334 37.614 15.444 1.00 40.23 ? 273 PHE A C 1 ATOM 1740 O O . PHE A 1 238 ? 7.987 36.598 15.669 1.00 34.49 ? 273 PHE A O 1 ATOM 1741 C CB . PHE A 1 238 ? 6.837 38.204 13.091 1.00 37.57 ? 273 PHE A CB 1 ATOM 1742 C CG . PHE A 1 238 ? 6.244 37.640 11.819 1.00 32.10 ? 273 PHE A CG 1 ATOM 1743 C CD1 . PHE A 1 238 ? 4.874 37.508 11.669 1.00 35.14 ? 273 PHE A CD1 1 ATOM 1744 C CD2 . PHE A 1 238 ? 7.065 37.274 10.766 1.00 33.31 ? 273 PHE A CD2 1 ATOM 1745 C CE1 . PHE A 1 238 ? 4.334 36.995 10.490 1.00 30.45 ? 273 PHE A CE1 1 ATOM 1746 C CE2 . PHE A 1 238 ? 6.539 36.768 9.597 1.00 31.01 ? 273 PHE A CE2 1 ATOM 1747 C CZ . PHE A 1 238 ? 5.168 36.632 9.458 1.00 31.68 ? 273 PHE A CZ 1 ATOM 1748 N N . PHE A 1 239 ? 7.522 38.760 16.091 1.00 37.16 ? 274 PHE A N 1 ATOM 1749 C CA . PHE A 1 239 ? 8.640 38.949 17.007 1.00 36.01 ? 274 PHE A CA 1 ATOM 1750 C C . PHE A 1 239 ? 8.324 38.492 18.408 1.00 33.64 ? 274 PHE A C 1 ATOM 1751 O O . PHE A 1 239 ? 7.180 38.561 18.842 1.00 32.81 ? 274 PHE A O 1 ATOM 1752 C CB . PHE A 1 239 ? 9.067 40.410 17.011 1.00 34.65 ? 274 PHE A CB 1 ATOM 1753 C CG . PHE A 1 239 ? 9.492 40.900 15.668 1.00 45.67 ? 274 PHE A CG 1 ATOM 1754 C CD1 . PHE A 1 239 ? 10.786 40.665 15.209 1.00 49.13 ? 274 PHE A CD1 1 ATOM 1755 C CD2 . PHE A 1 239 ? 8.598 41.568 14.845 1.00 47.99 ? 274 PHE A CD2 1 ATOM 1756 C CE1 . PHE A 1 239 ? 11.187 41.103 13.957 1.00 51.51 ? 274 PHE A CE1 1 ATOM 1757 C CE2 . PHE A 1 239 ? 8.992 42.011 13.589 1.00 51.65 ? 274 PHE A CE2 1 ATOM 1758 C CZ . PHE A 1 239 ? 10.292 41.778 13.149 1.00 54.20 ? 274 PHE A CZ 1 ATOM 1759 N N . TRP A 1 240 ? 9.341 38.027 19.125 1.00 30.61 ? 275 TRP A N 1 ATOM 1760 C CA . TRP A 1 240 ? 9.139 37.648 20.513 1.00 27.35 ? 275 TRP A CA 1 ATOM 1761 C C . TRP A 1 240 ? 10.204 38.269 21.393 1.00 30.45 ? 275 TRP A C 1 ATOM 1762 O O . TRP A 1 240 ? 11.382 38.185 21.071 1.00 29.29 ? 275 TRP A O 1 ATOM 1763 C CB . TRP A 1 240 ? 9.217 36.133 20.667 1.00 29.73 ? 275 TRP A CB 1 ATOM 1764 C CG . TRP A 1 240 ? 8.299 35.406 19.768 1.00 31.15 ? 275 TRP A CG 1 ATOM 1765 C CD1 . TRP A 1 240 ? 8.531 35.054 18.476 1.00 27.28 ? 275 TRP A CD1 1 ATOM 1766 C CD2 . TRP A 1 240 ? 6.987 34.934 20.091 1.00 29.97 ? 275 TRP A CD2 1 ATOM 1767 N NE1 . TRP A 1 240 ? 7.444 34.382 17.973 1.00 26.31 ? 275 TRP A NE1 1 ATOM 1768 C CE2 . TRP A 1 240 ? 6.481 34.302 18.946 1.00 25.39 ? 275 TRP A CE2 1 ATOM 1769 C CE3 . TRP A 1 240 ? 6.200 34.974 21.241 1.00 26.41 ? 275 TRP A CE3 1 ATOM 1770 C CZ2 . TRP A 1 240 ? 5.213 33.713 18.916 1.00 24.17 ? 275 TRP A CZ2 1 ATOM 1771 C CZ3 . TRP A 1 240 ? 4.937 34.395 21.211 1.00 25.53 ? 275 TRP A CZ3 1 ATOM 1772 C CH2 . TRP A 1 240 ? 4.457 33.778 20.056 1.00 27.66 ? 275 TRP A CH2 1 ATOM 1773 N N . SER A 1 241 ? 9.793 38.873 22.505 1.00 32.43 ? 276 SER A N 1 ATOM 1774 C CA . SER A 1 241 ? 10.758 39.403 23.468 1.00 33.26 ? 276 SER A CA 1 ATOM 1775 C C . SER A 1 241 ? 11.633 38.248 23.924 1.00 36.11 ? 276 SER A C 1 ATOM 1776 O O . SER A 1 241 ? 11.134 37.136 24.151 1.00 26.61 ? 276 SER A O 1 ATOM 1777 C CB . SER A 1 241 ? 10.059 40.059 24.666 1.00 37.93 ? 276 SER A CB 1 ATOM 1778 O OG . SER A 1 241 ? 9.435 41.279 24.286 1.00 43.77 ? 276 SER A OG 1 ATOM 1779 N N . VAL A 1 242 ? 12.932 38.503 24.047 1.00 32.22 ? 277 VAL A N 1 ATOM 1780 C CA . VAL A 1 242 ? 13.896 37.426 24.248 1.00 32.13 ? 277 VAL A CA 1 ATOM 1781 C C . VAL A 1 242 ? 13.637 36.633 25.522 1.00 36.23 ? 277 VAL A C 1 ATOM 1782 O O . VAL A 1 242 ? 14.010 35.465 25.616 1.00 32.38 ? 277 VAL A O 1 ATOM 1783 C CB . VAL A 1 242 ? 15.360 37.941 24.215 1.00 39.76 ? 277 VAL A CB 1 ATOM 1784 C CG1 . VAL A 1 242 ? 15.708 38.476 22.820 1.00 47.11 ? 277 VAL A CG1 1 ATOM 1785 C CG2 . VAL A 1 242 ? 15.582 39.015 25.268 1.00 45.64 ? 277 VAL A CG2 1 ATOM 1786 N N . SER A 1 243 ? 12.966 37.265 26.478 1.00 32.88 ? 278 SER A N 1 ATOM 1787 C CA . SER A 1 243 ? 12.717 36.656 27.776 1.00 38.77 ? 278 SER A CA 1 ATOM 1788 C C . SER A 1 243 ? 11.632 35.581 27.724 1.00 41.45 ? 278 SER A C 1 ATOM 1789 O O . SER A 1 243 ? 11.571 34.718 28.604 1.00 45.01 ? 278 SER A O 1 ATOM 1790 C CB . SER A 1 243 ? 12.353 37.728 28.808 1.00 45.14 ? 278 SER A CB 1 ATOM 1791 O OG . SER A 1 243 ? 11.117 38.343 28.486 1.00 48.11 ? 278 SER A OG 1 ATOM 1792 N N . ILE A 1 244 ? 10.776 35.625 26.704 1.00 30.13 ? 279 ILE A N 1 ATOM 1793 C CA . ILE A 1 244 ? 9.724 34.616 26.577 1.00 31.51 ? 279 ILE A CA 1 ATOM 1794 C C . ILE A 1 244 ? 10.336 33.281 26.158 1.00 27.69 ? 279 ILE A C 1 ATOM 1795 O O . ILE A 1 244 ? 10.928 33.178 25.090 1.00 27.20 ? 279 ILE A O 1 ATOM 1796 C CB . ILE A 1 244 ? 8.654 35.042 25.568 1.00 33.56 ? 279 ILE A CB 1 ATOM 1797 C CG1 . ILE A 1 244 ? 8.102 36.421 25.951 1.00 35.14 ? 279 ILE A CG1 1 ATOM 1798 C CG2 . ILE A 1 244 ? 7.544 33.991 25.486 1.00 31.06 ? 279 ILE A CG2 1 ATOM 1799 C CD1 . ILE A 1 244 ? 7.224 37.043 24.898 1.00 35.51 ? 279 ILE A CD1 1 ATOM 1800 N N . PRO A 1 245 ? 10.204 32.251 27.009 1.00 32.20 ? 280 PRO A N 1 ATOM 1801 C CA . PRO A 1 245 ? 10.833 30.976 26.645 1.00 28.03 ? 280 PRO A CA 1 ATOM 1802 C C . PRO A 1 245 ? 10.181 30.329 25.414 1.00 26.82 ? 280 PRO A C 1 ATOM 1803 O O . PRO A 1 245 ? 9.006 30.576 25.134 1.00 22.59 ? 280 PRO A O 1 ATOM 1804 C CB . PRO A 1 245 ? 10.648 30.115 27.905 1.00 29.73 ? 280 PRO A CB 1 ATOM 1805 C CG . PRO A 1 245 ? 9.540 30.768 28.684 1.00 34.03 ? 280 PRO A CG 1 ATOM 1806 C CD . PRO A 1 245 ? 9.574 32.223 28.347 1.00 29.36 ? 280 PRO A CD 1 ATOM 1807 N N . HIS A 1 246 ? 10.933 29.498 24.700 1.00 24.35 ? 281 HIS A N 1 ATOM 1808 C CA . HIS A 1 246 ? 10.435 28.900 23.459 1.00 28.43 ? 281 HIS A CA 1 ATOM 1809 C C . HIS A 1 246 ? 9.154 28.108 23.670 1.00 25.10 ? 281 HIS A C 1 ATOM 1810 O O . HIS A 1 246 ? 8.282 28.086 22.802 1.00 22.10 ? 281 HIS A O 1 ATOM 1811 C CB . HIS A 1 246 ? 11.501 28.014 22.795 1.00 24.01 ? 281 HIS A CB 1 ATOM 1812 C CG . HIS A 1 246 ? 12.723 28.767 22.374 1.00 27.20 ? 281 HIS A CG 1 ATOM 1813 N ND1 . HIS A 1 246 ? 13.854 28.145 21.893 1.00 27.75 ? 281 HIS A ND1 1 ATOM 1814 C CD2 . HIS A 1 246 ? 12.989 30.096 22.365 1.00 25.91 ? 281 HIS A CD2 1 ATOM 1815 C CE1 . HIS A 1 246 ? 14.765 29.058 21.605 1.00 29.47 ? 281 HIS A CE1 1 ATOM 1816 N NE2 . HIS A 1 246 ? 14.264 30.250 21.879 1.00 27.84 ? 281 HIS A NE2 1 ATOM 1817 N N . GLU A 1 247 ? 9.047 27.465 24.825 1.00 23.92 ? 282 GLU A N 1 ATOM 1818 C CA . GLU A 1 247 ? 7.864 26.656 25.122 1.00 24.10 ? 282 GLU A CA 1 ATOM 1819 C C . GLU A 1 247 ? 6.605 27.529 25.164 1.00 23.87 ? 282 GLU A C 1 ATOM 1820 O O . GLU A 1 247 ? 5.536 27.129 24.700 1.00 25.48 ? 282 GLU A O 1 ATOM 1821 C CB . GLU A 1 247 ? 8.047 25.933 26.451 1.00 30.46 ? 282 GLU A CB 1 ATOM 1822 C CG . GLU A 1 247 ? 9.127 24.857 26.446 1.00 28.62 ? 282 GLU A CG 1 ATOM 1823 C CD . GLU A 1 247 ? 10.508 25.369 26.840 1.00 31.08 ? 282 GLU A CD 1 ATOM 1824 O OE1 . GLU A 1 247 ? 10.756 26.600 26.851 1.00 26.72 ? 282 GLU A OE1 1 ATOM 1825 O OE2 . GLU A 1 247 ? 11.353 24.514 27.159 1.00 32.45 ? 282 GLU A OE2 1 ATOM 1826 N N . ARG A 1 248 ? 6.745 28.721 25.729 1.00 26.64 ? 283 ARG A N 1 ATOM 1827 C CA . ARG A 1 248 ? 5.666 29.706 25.756 1.00 27.65 ? 283 ARG A CA 1 ATOM 1828 C C . ARG A 1 248 ? 5.353 30.257 24.353 1.00 28.84 ? 283 ARG A C 1 ATOM 1829 O O . ARG A 1 248 ? 4.195 30.516 24.042 1.00 26.71 ? 283 ARG A O 1 ATOM 1830 C CB . ARG A 1 248 ? 5.993 30.831 26.742 1.00 28.88 ? 283 ARG A CB 1 ATOM 1831 C CG . ARG A 1 248 ? 4.942 31.933 26.865 1.00 31.92 ? 283 ARG A CG 1 ATOM 1832 C CD . ARG A 1 248 ? 3.563 31.382 27.268 1.00 34.79 ? 283 ARG A CD 1 ATOM 1833 N NE . ARG A 1 248 ? 3.535 30.754 28.592 1.00 30.16 ? 283 ARG A NE 1 ATOM 1834 C CZ . ARG A 1 248 ? 2.553 29.954 29.002 1.00 36.12 ? 283 ARG A CZ 1 ATOM 1835 N NH1 . ARG A 1 248 ? 1.537 29.697 28.187 1.00 32.24 ? 283 ARG A NH1 1 ATOM 1836 N NH2 . ARG A 1 248 ? 2.579 29.405 30.218 1.00 36.02 ? 283 ARG A NH2 1 ATOM 1837 N N . ARG A 1 249 ? 6.365 30.428 23.499 1.00 26.98 ? 284 ARG A N 1 ATOM 1838 C CA . ARG A 1 249 ? 6.099 30.890 22.137 1.00 22.77 ? 284 ARG A CA 1 ATOM 1839 C C . ARG A 1 249 ? 5.263 29.853 21.406 1.00 23.72 ? 284 ARG A C 1 ATOM 1840 O O . ARG A 1 249 ? 4.273 30.174 20.744 1.00 22.43 ? 284 ARG A O 1 ATOM 1841 C CB . ARG A 1 249 ? 7.405 31.168 21.356 1.00 22.37 ? 284 ARG A CB 1 ATOM 1842 C CG . ARG A 1 249 ? 8.319 32.154 22.072 1.00 25.52 ? 284 ARG A CG 1 ATOM 1843 C CD . ARG A 1 249 ? 9.658 32.360 21.348 1.00 25.74 ? 284 ARG A CD 1 ATOM 1844 N NE . ARG A 1 249 ? 10.601 32.998 22.255 1.00 26.73 ? 284 ARG A NE 1 ATOM 1845 C CZ . ARG A 1 249 ? 11.748 33.556 21.893 1.00 25.34 ? 284 ARG A CZ 1 ATOM 1846 N NH1 . ARG A 1 249 ? 12.133 33.558 20.625 1.00 27.38 ? 284 ARG A NH1 1 ATOM 1847 N NH2 . ARG A 1 249 ? 12.520 34.104 22.817 1.00 28.82 ? 284 ARG A NH2 1 ATOM 1848 N N . ILE A 1 250 ? 5.662 28.594 21.539 1.00 22.62 ? 285 ILE A N 1 ATOM 1849 C CA . ILE A 1 250 ? 4.906 27.513 20.946 1.00 23.95 ? 285 ILE A CA 1 ATOM 1850 C C . ILE A 1 250 ? 3.482 27.450 21.493 1.00 20.83 ? 285 ILE A C 1 ATOM 1851 O O . ILE A 1 250 ? 2.535 27.375 20.719 1.00 21.39 ? 285 ILE A O 1 ATOM 1852 C CB . ILE A 1 250 ? 5.617 26.167 21.145 1.00 20.41 ? 285 ILE A CB 1 ATOM 1853 C CG1 . ILE A 1 250 ? 6.966 26.189 20.418 1.00 24.30 ? 285 ILE A CG1 1 ATOM 1854 C CG2 . ILE A 1 250 ? 4.753 25.019 20.637 1.00 22.85 ? 285 ILE A CG2 1 ATOM 1855 C CD1 . ILE A 1 250 ? 6.875 26.450 18.942 1.00 22.01 ? 285 ILE A CD1 1 ATOM 1856 N N . LEU A 1 251 ? 3.328 27.490 22.814 1.00 21.74 ? 286 LEU A N 1 ATOM 1857 C CA . LEU A 1 251 ? 1.993 27.427 23.405 1.00 27.19 ? 286 LEU A CA 1 ATOM 1858 C C . LEU A 1 251 ? 1.107 28.594 22.935 1.00 24.56 ? 286 LEU A C 1 ATOM 1859 O O . LEU A 1 251 ? -0.088 28.430 22.705 1.00 28.27 ? 286 LEU A O 1 ATOM 1860 C CB . LEU A 1 251 ? 2.075 27.374 24.930 1.00 24.79 ? 286 LEU A CB 1 ATOM 1861 C CG . LEU A 1 251 ? 2.562 26.042 25.515 1.00 25.46 ? 286 LEU A CG 1 ATOM 1862 C CD1 . LEU A 1 251 ? 2.805 26.179 27.003 1.00 28.25 ? 286 LEU A CD1 1 ATOM 1863 C CD2 . LEU A 1 251 ? 1.549 24.934 25.264 1.00 29.87 ? 286 LEU A CD2 1 ATOM 1864 N N . THR A 1 252 ? 1.713 29.759 22.769 1.00 25.49 ? 287 THR A N 1 ATOM 1865 C CA . THR A 1 252 ? 0.997 30.928 22.282 1.00 21.49 ? 287 THR A CA 1 ATOM 1866 C C . THR A 1 252 ? 0.528 30.760 20.833 1.00 24.89 ? 287 THR A C 1 ATOM 1867 O O . THR A 1 252 ? -0.615 31.088 20.513 1.00 24.91 ? 287 THR A O 1 ATOM 1868 C CB . THR A 1 252 ? 1.857 32.193 22.449 1.00 21.51 ? 287 THR A CB 1 ATOM 1869 O OG1 . THR A 1 252 ? 2.136 32.392 23.843 1.00 29.63 ? 287 THR A OG1 1 ATOM 1870 C CG2 . THR A 1 252 ? 1.149 33.410 21.895 1.00 24.73 ? 287 THR A CG2 1 ATOM 1871 N N . ILE A 1 253 ? 1.398 30.254 19.957 1.00 22.51 ? 288 ILE A N 1 ATOM 1872 C CA . ILE A 1 253 ? 1.003 29.980 18.572 1.00 20.92 ? 288 ILE A CA 1 ATOM 1873 C C . ILE A 1 253 ? -0.185 29.019 18.572 1.00 24.83 ? 288 ILE A C 1 ATOM 1874 O O . ILE A 1 253 ? -1.170 29.242 17.888 1.00 22.68 ? 288 ILE A O 1 ATOM 1875 C CB . ILE A 1 253 ? 2.187 29.452 17.703 1.00 19.77 ? 288 ILE A CB 1 ATOM 1876 C CG1 . ILE A 1 253 ? 3.188 30.578 17.437 1.00 24.28 ? 288 ILE A CG1 1 ATOM 1877 C CG2 . ILE A 1 253 ? 1.704 28.932 16.358 1.00 21.50 ? 288 ILE A CG2 1 ATOM 1878 C CD1 . ILE A 1 253 ? 4.611 30.081 17.105 1.00 25.03 ? 288 ILE A CD1 1 ATOM 1879 N N . LEU A 1 254 ? -0.105 27.972 19.384 1.00 22.61 ? 289 LEU A N 1 ATOM 1880 C CA . LEU A 1 254 ? -1.165 26.975 19.430 1.00 22.40 ? 289 LEU A CA 1 ATOM 1881 C C . LEU A 1 254 ? -2.482 27.560 19.939 1.00 26.77 ? 289 LEU A C 1 ATOM 1882 O O . LEU A 1 254 ? -3.549 27.247 19.407 1.00 28.53 ? 289 LEU A O 1 ATOM 1883 C CB . LEU A 1 254 ? -0.736 25.771 20.266 1.00 23.66 ? 289 LEU A CB 1 ATOM 1884 C CG . LEU A 1 254 ? 0.434 24.985 19.654 1.00 21.53 ? 289 LEU A CG 1 ATOM 1885 C CD1 . LEU A 1 254 ? 1.028 24.014 20.680 1.00 22.23 ? 289 LEU A CD1 1 ATOM 1886 C CD2 . LEU A 1 254 ? 0.050 24.250 18.374 1.00 25.60 ? 289 LEU A CD2 1 ATOM 1887 N N . GLN A 1 255 ? -2.393 28.424 20.945 1.00 24.21 ? 290 GLN A N 1 ATOM 1888 C CA . GLN A 1 255 ? -3.561 29.130 21.466 1.00 31.46 ? 290 GLN A CA 1 ATOM 1889 C C . GLN A 1 255 ? -4.186 30.013 20.388 1.00 28.89 ? 290 GLN A C 1 ATOM 1890 O O . GLN A 1 255 ? -5.406 30.005 20.195 1.00 29.31 ? 290 GLN A O 1 ATOM 1891 C CB . GLN A 1 255 ? -3.161 29.979 22.670 1.00 31.61 ? 290 GLN A CB 1 ATOM 1892 C CG . GLN A 1 255 ? -4.310 30.663 23.374 1.00 40.27 ? 290 GLN A CG 1 ATOM 1893 C CD . GLN A 1 255 ? -5.044 29.730 24.324 1.00 52.48 ? 290 GLN A CD 1 ATOM 1894 O OE1 . GLN A 1 255 ? -4.729 29.666 25.516 1.00 60.08 ? 290 GLN A OE1 1 ATOM 1895 N NE2 . GLN A 1 255 ? -6.028 29.005 23.803 1.00 47.55 ? 290 GLN A NE2 1 ATOM 1896 N N . TRP A 1 256 ? -3.352 30.775 19.686 1.00 22.91 ? 291 TRP A N 1 ATOM 1897 C CA . TRP A 1 256 ? -3.838 31.614 18.594 1.00 27.00 ? 291 TRP A CA 1 ATOM 1898 C C . TRP A 1 256 ? -4.565 30.803 17.539 1.00 28.87 ? 291 TRP A C 1 ATOM 1899 O O . TRP A 1 256 ? -5.561 31.260 17.002 1.00 30.63 ? 291 TRP A O 1 ATOM 1900 C CB . TRP A 1 256 ? -2.699 32.387 17.937 1.00 24.48 ? 291 TRP A CB 1 ATOM 1901 C CG . TRP A 1 256 ? -2.173 33.531 18.758 1.00 24.01 ? 291 TRP A CG 1 ATOM 1902 C CD1 . TRP A 1 256 ? -2.812 34.185 19.779 1.00 26.94 ? 291 TRP A CD1 1 ATOM 1903 C CD2 . TRP A 1 256 ? -0.896 34.165 18.613 1.00 24.36 ? 291 TRP A CD2 1 ATOM 1904 N NE1 . TRP A 1 256 ? -2.015 35.201 20.262 1.00 30.59 ? 291 TRP A NE1 1 ATOM 1905 C CE2 . TRP A 1 256 ? -0.829 35.202 19.569 1.00 28.04 ? 291 TRP A CE2 1 ATOM 1906 C CE3 . TRP A 1 256 ? 0.197 33.959 17.759 1.00 30.32 ? 291 TRP A CE3 1 ATOM 1907 C CZ2 . TRP A 1 256 ? 0.296 36.024 19.705 1.00 32.07 ? 291 TRP A CZ2 1 ATOM 1908 C CZ3 . TRP A 1 256 ? 1.313 34.780 17.890 1.00 24.08 ? 291 TRP A CZ3 1 ATOM 1909 C CH2 . TRP A 1 256 ? 1.352 35.799 18.857 1.00 27.78 ? 291 TRP A CH2 1 ATOM 1910 N N . LEU A 1 257 ? -4.062 29.602 17.241 1.00 26.61 ? 292 LEU A N 1 ATOM 1911 C CA . LEU A 1 257 ? -4.711 28.717 16.271 1.00 26.73 ? 292 LEU A CA 1 ATOM 1912 C C . LEU A 1 257 ? -6.048 28.155 16.747 1.00 25.15 ? 292 LEU A C 1 ATOM 1913 O O . LEU A 1 257 ? -6.834 27.673 15.934 1.00 29.46 ? 292 LEU A O 1 ATOM 1914 C CB . LEU A 1 257 ? -3.794 27.552 15.905 1.00 26.43 ? 292 LEU A CB 1 ATOM 1915 C CG . LEU A 1 257 ? -2.702 27.856 14.881 1.00 25.66 ? 292 LEU A CG 1 ATOM 1916 C CD1 . LEU A 1 257 ? -1.605 26.796 14.959 1.00 28.28 ? 292 LEU A CD1 1 ATOM 1917 C CD2 . LEU A 1 257 ? -3.309 27.921 13.475 1.00 29.13 ? 292 LEU A CD2 1 ATOM 1918 N N . SER A 1 258 ? -6.279 28.196 18.059 1.00 28.92 ? 293 SER A N 1 ATOM 1919 C CA . SER A 1 258 ? -7.538 27.737 18.651 1.00 32.48 ? 293 SER A CA 1 ATOM 1920 C C . SER A 1 258 ? -8.559 28.861 18.775 1.00 31.89 ? 293 SER A C 1 ATOM 1921 O O . SER A 1 258 ? -9.666 28.638 19.266 1.00 29.34 ? 293 SER A O 1 ATOM 1922 C CB . SER A 1 258 ? -7.304 27.160 20.050 1.00 33.67 ? 293 SER A CB 1 ATOM 1923 O OG . SER A 1 258 ? -6.398 26.082 20.022 1.00 39.24 ? 293 SER A OG 1 ATOM 1924 N N . LEU A 1 259 ? -8.184 30.066 18.356 1.00 27.32 ? 294 LEU A N 1 ATOM 1925 C CA . LEU A 1 259 ? -9.054 31.238 18.482 1.00 26.62 ? 294 LEU A CA 1 ATOM 1926 C C . LEU A 1 259 ? -10.308 31.081 17.627 1.00 28.82 ? 294 LEU A C 1 ATOM 1927 O O . LEU A 1 259 ? -10.344 30.243 16.722 1.00 28.05 ? 294 LEU A O 1 ATOM 1928 C CB . LEU A 1 259 ? -8.311 32.502 18.063 1.00 27.23 ? 294 LEU A CB 1 ATOM 1929 C CG . LEU A 1 259 ? -7.322 33.111 19.060 1.00 27.51 ? 294 LEU A CG 1 ATOM 1930 C CD1 . LEU A 1 259 ? -6.478 34.166 18.357 1.00 27.28 ? 294 LEU A CD1 1 ATOM 1931 C CD2 . LEU A 1 259 ? -8.065 33.724 20.259 1.00 33.04 ? 294 LEU A CD2 1 ATOM 1932 N N . PRO A 1 260 ? -11.346 31.879 17.924 1.00 28.99 ? 295 PRO A N 1 ATOM 1933 C CA . PRO A 1 260 ? -12.554 31.886 17.089 1.00 30.04 ? 295 PRO A CA 1 ATOM 1934 C C . PRO A 1 260 ? -12.218 32.196 15.637 1.00 28.27 ? 295 PRO A C 1 ATOM 1935 O O . PRO A 1 260 ? -11.258 32.931 15.376 1.00 28.91 ? 295 PRO A O 1 ATOM 1936 C CB . PRO A 1 260 ? -13.381 33.027 17.688 1.00 30.96 ? 295 PRO A CB 1 ATOM 1937 C CG . PRO A 1 260 ? -12.985 33.045 19.131 1.00 36.11 ? 295 PRO A CG 1 ATOM 1938 C CD . PRO A 1 260 ? -11.501 32.717 19.126 1.00 29.70 ? 295 PRO A CD 1 ATOM 1939 N N . ASP A 1 261 ? -12.992 31.641 14.710 1.00 29.37 ? 296 ASP A N 1 ATOM 1940 C CA . ASP A 1 261 ? -12.783 31.871 13.282 1.00 29.34 ? 296 ASP A CA 1 ATOM 1941 C C . ASP A 1 261 ? -12.539 33.349 12.927 1.00 33.20 ? 296 ASP A C 1 ATOM 1942 O O . ASP A 1 261 ? -11.775 33.640 12.012 1.00 31.82 ? 296 ASP A O 1 ATOM 1943 C CB . ASP A 1 261 ? -13.992 31.374 12.473 1.00 33.37 ? 296 ASP A CB 1 ATOM 1944 C CG . ASP A 1 261 ? -14.088 29.851 12.398 1.00 39.16 ? 296 ASP A CG 1 ATOM 1945 O OD1 . ASP A 1 261 ? -13.072 29.145 12.587 1.00 34.44 ? 296 ASP A OD1 1 ATOM 1946 O OD2 . ASP A 1 261 ? -15.201 29.358 12.119 1.00 41.78 ? 296 ASP A OD2 1 ATOM 1947 N N . ASN A 1 262 ? -13.182 34.277 13.643 1.00 27.97 ? 297 ASN A N 1 ATOM 1948 C CA . ASN A 1 262 ? -13.061 35.701 13.296 1.00 25.03 ? 297 ASN A CA 1 ATOM 1949 C C . ASN A 1 262 ? -11.880 36.416 13.957 1.00 32.33 ? 297 ASN A C 1 ATOM 1950 O O . ASN A 1 262 ? -11.709 37.621 13.786 1.00 31.46 ? 297 ASN A O 1 ATOM 1951 C CB . ASN A 1 262 ? -14.371 36.467 13.562 1.00 28.10 ? 297 ASN A CB 1 ATOM 1952 C CG . ASN A 1 262 ? -14.681 36.613 15.045 1.00 31.41 ? 297 ASN A CG 1 ATOM 1953 O OD1 . ASN A 1 262 ? -14.098 35.924 15.894 1.00 29.22 ? 297 ASN A OD1 1 ATOM 1954 N ND2 . ASN A 1 262 ? -15.615 37.512 15.366 1.00 26.28 ? 297 ASN A ND2 1 ATOM 1955 N N . GLU A 1 263 ? -11.064 35.676 14.700 1.00 27.87 ? 298 GLU A N 1 ATOM 1956 C CA . GLU A 1 263 ? -9.854 36.259 15.281 1.00 30.56 ? 298 GLU A CA 1 ATOM 1957 C C . GLU A 1 263 ? -8.572 35.532 14.839 1.00 28.11 ? 298 GLU A C 1 ATOM 1958 O O . GLU A 1 263 ? -7.476 36.107 14.885 1.00 29.50 ? 298 GLU A O 1 ATOM 1959 C CB . GLU A 1 263 ? -9.931 36.262 16.808 1.00 32.60 ? 298 GLU A CB 1 ATOM 1960 C CG . GLU A 1 263 ? -11.123 37.032 17.401 1.00 32.50 ? 298 GLU A CG 1 ATOM 1961 C CD . GLU A 1 263 ? -11.280 36.752 18.883 1.00 42.54 ? 298 GLU A CD 1 ATOM 1962 O OE1 . GLU A 1 263 ? -10.431 36.021 19.433 1.00 46.14 ? 298 GLU A OE1 1 ATOM 1963 O OE2 . GLU A 1 263 ? -12.245 37.252 19.503 1.00 49.99 ? 298 GLU A OE2 1 ATOM 1964 N N . ARG A 1 264 ? -8.708 34.276 14.426 1.00 23.41 ? 299 ARG A N 1 ATOM 1965 C CA . ARG A 1 264 ? -7.528 33.423 14.206 1.00 27.25 ? 299 ARG A CA 1 ATOM 1966 C C . ARG A 1 264 ? -6.621 33.931 13.090 1.00 24.64 ? 299 ARG A C 1 ATOM 1967 O O . ARG A 1 264 ? -7.092 34.205 11.985 1.00 24.03 ? 299 ARG A O 1 ATOM 1968 C CB . ARG A 1 264 ? -7.965 31.995 13.891 1.00 29.42 ? 299 ARG A CB 1 ATOM 1969 C CG . ARG A 1 264 ? -6.835 31.000 13.760 1.00 31.92 ? 299 ARG A CG 1 ATOM 1970 C CD . ARG A 1 264 ? -7.352 29.635 13.332 1.00 27.04 ? 299 ARG A CD 1 ATOM 1971 N NE . ARG A 1 264 ? -8.220 29.722 12.165 1.00 34.34 ? 299 ARG A NE 1 ATOM 1972 C CZ . ARG A 1 264 ? -9.536 29.519 12.194 1.00 34.26 ? 299 ARG A CZ 1 ATOM 1973 N NH1 . ARG A 1 264 ? -10.139 29.205 13.336 1.00 33.64 ? 299 ARG A NH1 1 ATOM 1974 N NH2 . ARG A 1 264 ? -10.241 29.628 11.082 1.00 34.69 ? 299 ARG A NH2 1 ATOM 1975 N N . PRO A 1 265 ? -5.306 34.061 13.363 1.00 25.07 ? 300 PRO A N 1 ATOM 1976 C CA . PRO A 1 265 ? -4.427 34.473 12.255 1.00 28.75 ? 300 PRO A CA 1 ATOM 1977 C C . PRO A 1 265 ? -4.171 33.385 11.220 1.00 25.56 ? 300 PRO A C 1 ATOM 1978 O O . PRO A 1 265 ? -4.388 32.189 11.461 1.00 26.10 ? 300 PRO A O 1 ATOM 1979 C CB . PRO A 1 265 ? -3.107 34.837 12.950 1.00 22.28 ? 300 PRO A CB 1 ATOM 1980 C CG . PRO A 1 265 ? -3.479 35.086 14.360 1.00 25.53 ? 300 PRO A CG 1 ATOM 1981 C CD . PRO A 1 265 ? -4.630 34.161 14.664 1.00 26.86 ? 300 PRO A CD 1 ATOM 1982 N N . SER A 1 266 ? -3.711 33.808 10.052 1.00 21.55 ? 301 SER A N 1 ATOM 1983 C CA . SER A 1 266 ? -3.372 32.866 8.998 1.00 24.36 ? 301 SER A CA 1 ATOM 1984 C C . SER A 1 266 ? -1.870 32.600 8.895 1.00 25.61 ? 301 SER A C 1 ATOM 1985 O O . SER A 1 266 ? -1.459 31.598 8.301 1.00 23.65 ? 301 SER A O 1 ATOM 1986 C CB . SER A 1 266 ? -3.864 33.379 7.652 1.00 31.24 ? 301 SER A CB 1 ATOM 1987 O OG . SER A 1 266 ? -5.274 33.304 7.572 1.00 36.10 ? 301 SER A OG 1 ATOM 1988 N N . VAL A 1 267 ? -1.059 33.513 9.431 1.00 24.63 ? 302 VAL A N 1 ATOM 1989 C CA . VAL A 1 267 ? 0.406 33.359 9.345 1.00 21.75 ? 302 VAL A CA 1 ATOM 1990 C C . VAL A 1 267 ? 1.051 33.608 10.693 1.00 24.76 ? 302 VAL A C 1 ATOM 1991 O O . VAL A 1 267 ? 0.630 34.492 11.445 1.00 22.81 ? 302 VAL A O 1 ATOM 1992 C CB . VAL A 1 267 ? 1.019 34.254 8.233 1.00 24.92 ? 302 VAL A CB 1 ATOM 1993 C CG1 . VAL A 1 267 ? 0.749 35.726 8.521 1.00 21.80 ? 302 VAL A CG1 1 ATOM 1994 C CG2 . VAL A 1 267 ? 2.540 34.001 8.043 1.00 21.67 ? 302 VAL A CG2 1 ATOM 1995 N N . TYR A 1 268 ? 2.065 32.806 11.004 1.00 16.67 ? 303 TYR A N 1 ATOM 1996 C CA . TYR A 1 268 ? 2.656 32.762 12.334 1.00 17.20 ? 303 TYR A CA 1 ATOM 1997 C C . TYR A 1 268 ? 4.152 32.627 12.140 1.00 21.31 ? 303 TYR A C 1 ATOM 1998 O O . TYR A 1 268 ? 4.606 32.054 11.142 1.00 19.86 ? 303 TYR A O 1 ATOM 1999 C CB . TYR A 1 268 ? 2.187 31.529 13.111 1.00 19.23 ? 303 TYR A CB 1 ATOM 2000 C CG . TYR A 1 268 ? 0.695 31.469 13.321 1.00 21.58 ? 303 TYR A CG 1 ATOM 2001 C CD1 . TYR A 1 268 ? -0.148 31.006 12.321 1.00 21.06 ? 303 TYR A CD1 1 ATOM 2002 C CD2 . TYR A 1 268 ? 0.138 31.899 14.508 1.00 23.95 ? 303 TYR A CD2 1 ATOM 2003 C CE1 . TYR A 1 268 ? -1.532 30.975 12.504 1.00 23.00 ? 303 TYR A CE1 1 ATOM 2004 C CE2 . TYR A 1 268 ? -1.227 31.861 14.712 1.00 25.31 ? 303 TYR A CE2 1 ATOM 2005 C CZ . TYR A 1 268 ? -2.055 31.391 13.714 1.00 27.39 ? 303 TYR A CZ 1 ATOM 2006 O OH . TYR A 1 268 ? -3.411 31.363 13.929 1.00 25.40 ? 303 TYR A OH 1 ATOM 2007 N N . ALA A 1 269 ? 4.906 33.172 13.087 1.00 21.08 ? 304 ALA A N 1 ATOM 2008 C CA . ALA A 1 269 ? 6.354 33.046 13.066 1.00 19.27 ? 304 ALA A CA 1 ATOM 2009 C C . ALA A 1 269 ? 6.847 32.640 14.433 1.00 21.15 ? 304 ALA A C 1 ATOM 2010 O O . ALA A 1 269 ? 6.440 33.193 15.462 1.00 19.24 ? 304 ALA A O 1 ATOM 2011 C CB . ALA A 1 269 ? 7.013 34.347 12.649 1.00 25.48 ? 304 ALA A CB 1 ATOM 2012 N N . PHE A 1 270 ? 7.733 31.653 14.433 1.00 22.73 ? 305 PHE A N 1 ATOM 2013 C CA . PHE A 1 270 ? 8.488 31.319 15.610 1.00 18.17 ? 305 PHE A CA 1 ATOM 2014 C C . PHE A 1 270 ? 9.947 31.633 15.291 1.00 19.30 ? 305 PHE A C 1 ATOM 2015 O O . PHE A 1 270 ? 10.385 31.492 14.148 1.00 22.03 ? 305 PHE A O 1 ATOM 2016 C CB . PHE A 1 270 ? 8.322 29.837 15.971 1.00 21.33 ? 305 PHE A CB 1 ATOM 2017 C CG . PHE A 1 270 ? 9.298 29.362 17.015 1.00 22.92 ? 305 PHE A CG 1 ATOM 2018 C CD1 . PHE A 1 270 ? 10.566 28.903 16.643 1.00 24.15 ? 305 PHE A CD1 1 ATOM 2019 C CD2 . PHE A 1 270 ? 8.959 29.372 18.373 1.00 20.48 ? 305 PHE A CD2 1 ATOM 2020 C CE1 . PHE A 1 270 ? 11.478 28.487 17.605 1.00 21.23 ? 305 PHE A CE1 1 ATOM 2021 C CE2 . PHE A 1 270 ? 9.854 28.940 19.322 1.00 24.62 ? 305 PHE A CE2 1 ATOM 2022 C CZ . PHE A 1 270 ? 11.123 28.497 18.934 1.00 21.50 ? 305 PHE A CZ 1 ATOM 2023 N N . TYR A 1 271 ? 10.685 32.074 16.295 1.00 18.43 ? 306 TYR A N 1 ATOM 2024 C CA . TYR A 1 271 ? 12.112 32.320 16.129 1.00 19.08 ? 306 TYR A CA 1 ATOM 2025 C C . TYR A 1 271 ? 12.907 31.717 17.277 1.00 20.54 ? 306 TYR A C 1 ATOM 2026 O O . TYR A 1 271 ? 12.513 31.821 18.436 1.00 20.41 ? 306 TYR A O 1 ATOM 2027 C CB . TYR A 1 271 ? 12.378 33.828 16.042 1.00 21.93 ? 306 TYR A CB 1 ATOM 2028 C CG . TYR A 1 271 ? 13.839 34.213 16.202 1.00 22.16 ? 306 TYR A CG 1 ATOM 2029 C CD1 . TYR A 1 271 ? 14.730 34.127 15.131 1.00 23.13 ? 306 TYR A CD1 1 ATOM 2030 C CD2 . TYR A 1 271 ? 14.322 34.675 17.424 1.00 27.36 ? 306 TYR A CD2 1 ATOM 2031 C CE1 . TYR A 1 271 ? 16.082 34.470 15.281 1.00 21.33 ? 306 TYR A CE1 1 ATOM 2032 C CE2 . TYR A 1 271 ? 15.661 35.023 17.587 1.00 24.92 ? 306 TYR A CE2 1 ATOM 2033 C CZ . TYR A 1 271 ? 16.534 34.922 16.516 1.00 26.63 ? 306 TYR A CZ 1 ATOM 2034 O OH . TYR A 1 271 ? 17.856 35.276 16.695 1.00 25.70 ? 306 TYR A OH 1 ATOM 2035 N N . SER A 1 272 ? 14.041 31.105 16.953 1.00 18.74 ? 307 SER A N 1 ATOM 2036 C CA . SER A 1 272 ? 14.953 30.614 17.984 1.00 21.53 ? 307 SER A CA 1 ATOM 2037 C C . SER A 1 272 ? 16.328 31.211 17.769 1.00 16.84 ? 307 SER A C 1 ATOM 2038 O O . SER A 1 272 ? 16.803 31.210 16.644 1.00 18.35 ? 307 SER A O 1 ATOM 2039 C CB . SER A 1 272 ? 15.073 29.091 17.902 1.00 22.65 ? 307 SER A CB 1 ATOM 2040 O OG . SER A 1 272 ? 16.152 28.667 18.705 1.00 22.62 ? 307 SER A OG 1 ATOM 2041 N N . GLU A 1 273 ? 16.955 31.689 18.843 1.00 20.24 ? 308 GLU A N 1 ATOM 2042 C CA . GLU A 1 273 ? 18.312 32.253 18.805 1.00 19.14 ? 308 GLU A CA 1 ATOM 2043 C C . GLU A 1 273 ? 19.381 31.174 18.687 1.00 22.54 ? 308 GLU A C 1 ATOM 2044 O O . GLU A 1 273 ? 20.552 31.481 18.439 1.00 19.31 ? 308 GLU A O 1 ATOM 2045 C CB . GLU A 1 273 ? 18.591 33.071 20.070 1.00 24.53 ? 308 GLU A CB 1 ATOM 2046 N N . GLN A 1 274 ? 18.975 29.922 18.876 1.00 19.46 ? 309 GLN A N 1 ATOM 2047 C CA . GLN A 1 274 ? 19.859 28.776 18.682 1.00 22.24 ? 309 GLN A CA 1 ATOM 2048 C C . GLN A 1 274 ? 19.635 28.183 17.293 1.00 21.70 ? 309 GLN A C 1 ATOM 2049 O O . GLN A 1 274 ? 18.538 28.267 16.754 1.00 21.54 ? 309 GLN A O 1 ATOM 2050 C CB . GLN A 1 274 ? 19.610 27.717 19.770 1.00 21.35 ? 309 GLN A CB 1 ATOM 2051 C CG . GLN A 1 274 ? 20.138 28.087 21.145 1.00 26.84 ? 309 GLN A CG 1 ATOM 2052 C CD . GLN A 1 274 ? 21.651 27.895 21.261 1.00 27.54 ? 309 GLN A CD 1 ATOM 2053 O OE1 . GLN A 1 274 ? 22.394 28.118 20.299 1.00 21.84 ? 309 GLN A OE1 1 ATOM 2054 N NE2 . GLN A 1 274 ? 22.110 27.470 22.444 1.00 25.25 ? 309 GLN A NE2 1 ATOM 2055 N N . PRO A 1 275 ? 20.647 27.514 16.729 1.00 18.33 ? 310 PRO A N 1 ATOM 2056 C CA . PRO A 1 275 ? 21.916 27.136 17.349 1.00 18.94 ? 310 PRO A CA 1 ATOM 2057 C C . PRO A 1 275 ? 23.035 28.174 17.185 1.00 19.13 ? 310 PRO A C 1 ATOM 2058 O O . PRO A 1 275 ? 24.202 27.851 17.423 1.00 19.38 ? 310 PRO A O 1 ATOM 2059 C CB . PRO A 1 275 ? 22.249 25.827 16.634 1.00 16.03 ? 310 PRO A CB 1 ATOM 2060 C CG . PRO A 1 275 ? 21.764 26.088 15.223 1.00 18.95 ? 310 PRO A CG 1 ATOM 2061 C CD . PRO A 1 275 ? 20.494 26.898 15.392 1.00 19.97 ? 310 PRO A CD 1 ATOM 2062 N N . ASP A 1 276 ? 22.677 29.415 16.848 1.00 19.63 ? 311 ASP A N 1 ATOM 2063 C CA . ASP A 1 276 ? 23.656 30.483 16.672 1.00 22.13 ? 311 ASP A CA 1 ATOM 2064 C C . ASP A 1 276 ? 24.519 30.722 17.897 1.00 22.28 ? 311 ASP A C 1 ATOM 2065 O O . ASP A 1 276 ? 25.755 30.795 17.784 1.00 20.11 ? 311 ASP A O 1 ATOM 2066 C CB . ASP A 1 276 ? 22.949 31.787 16.288 1.00 21.17 ? 311 ASP A CB 1 ATOM 2067 C CG . ASP A 1 276 ? 23.917 32.956 16.103 1.00 23.67 ? 311 ASP A CG 1 ATOM 2068 O OD1 . ASP A 1 276 ? 24.501 33.086 15.018 1.00 20.40 ? 311 ASP A OD1 1 ATOM 2069 O OD2 . ASP A 1 276 ? 24.070 33.748 17.049 1.00 24.55 ? 311 ASP A OD2 1 ATOM 2070 N N . PHE A 1 277 ? 23.885 30.889 19.057 1.00 21.72 ? 312 PHE A N 1 ATOM 2071 C CA . PHE A 1 277 ? 24.654 31.170 20.271 1.00 26.48 ? 312 PHE A CA 1 ATOM 2072 C C . PHE A 1 277 ? 25.688 30.085 20.571 1.00 26.99 ? 312 PHE A C 1 ATOM 2073 O O . PHE A 1 277 ? 26.865 30.382 20.829 1.00 24.27 ? 312 PHE A O 1 ATOM 2074 C CB . PHE A 1 277 ? 23.783 31.372 21.513 1.00 30.64 ? 312 PHE A CB 1 ATOM 2075 C CG . PHE A 1 277 ? 24.601 31.560 22.763 1.00 36.70 ? 312 PHE A CG 1 ATOM 2076 C CD1 . PHE A 1 277 ? 25.104 32.807 23.086 1.00 46.10 ? 312 PHE A CD1 1 ATOM 2077 C CD2 . PHE A 1 277 ? 24.937 30.476 23.565 1.00 36.20 ? 312 PHE A CD2 1 ATOM 2078 C CE1 . PHE A 1 277 ? 25.889 32.986 24.211 1.00 48.86 ? 312 PHE A CE1 1 ATOM 2079 C CE2 . PHE A 1 277 ? 25.728 30.646 24.688 1.00 42.18 ? 312 PHE A CE2 1 ATOM 2080 C CZ . PHE A 1 277 ? 26.200 31.909 25.013 1.00 49.47 ? 312 PHE A CZ 1 ATOM 2081 N N . SER A 1 278 ? 25.250 28.830 20.565 1.00 20.52 ? 313 SER A N 1 ATOM 2082 C CA . SER A 1 278 ? 26.188 27.738 20.757 1.00 24.10 ? 313 SER A CA 1 ATOM 2083 C C . SER A 1 278 ? 27.252 27.614 19.654 1.00 26.66 ? 313 SER A C 1 ATOM 2084 O O . SER A 1 278 ? 28.397 27.272 19.937 1.00 26.36 ? 313 SER A O 1 ATOM 2085 C CB . SER A 1 278 ? 25.439 26.424 20.995 1.00 26.44 ? 313 SER A CB 1 ATOM 2086 O OG . SER A 1 278 ? 24.855 26.464 22.294 1.00 27.90 ? 313 SER A OG 1 ATOM 2087 N N . GLY A 1 279 ? 26.892 27.927 18.411 1.00 21.12 ? 314 GLY A N 1 ATOM 2088 C CA . GLY A 1 279 ? 27.880 27.972 17.346 1.00 21.44 ? 314 GLY A CA 1 ATOM 2089 C C . GLY A 1 279 ? 29.004 28.970 17.610 1.00 20.02 ? 314 GLY A C 1 ATOM 2090 O O . GLY A 1 279 ? 30.167 28.660 17.380 1.00 23.06 ? 314 GLY A O 1 ATOM 2091 N N . HIS A 1 280 ? 28.667 30.168 18.078 1.00 19.28 ? 315 HIS A N 1 ATOM 2092 C CA . HIS A 1 280 ? 29.678 31.166 18.424 1.00 21.42 ? 315 HIS A CA 1 ATOM 2093 C C . HIS A 1 280 ? 30.590 30.672 19.537 1.00 24.19 ? 315 HIS A C 1 ATOM 2094 O O . HIS A 1 280 ? 31.803 30.851 19.472 1.00 22.69 ? 315 HIS A O 1 ATOM 2095 C CB . HIS A 1 280 ? 29.033 32.468 18.877 1.00 24.58 ? 315 HIS A CB 1 ATOM 2096 C CG . HIS A 1 280 ? 28.482 33.277 17.750 1.00 22.93 ? 315 HIS A CG 1 ATOM 2097 N ND1 . HIS A 1 280 ? 29.285 33.816 16.765 1.00 22.09 ? 315 HIS A ND1 1 ATOM 2098 C CD2 . HIS A 1 280 ? 27.212 33.626 17.437 1.00 20.27 ? 315 HIS A CD2 1 ATOM 2099 C CE1 . HIS A 1 280 ? 28.533 34.473 15.900 1.00 22.89 ? 315 HIS A CE1 1 ATOM 2100 N NE2 . HIS A 1 280 ? 27.271 34.370 16.282 1.00 21.03 ? 315 HIS A NE2 1 ATOM 2101 N N . LYS A 1 281 ? 29.991 30.071 20.559 1.00 22.54 ? 316 LYS A N 1 ATOM 2102 C CA . LYS A 1 281 ? 30.754 29.586 21.712 1.00 25.54 ? 316 LYS A CA 1 ATOM 2103 C C . LYS A 1 281 ? 31.685 28.433 21.371 1.00 28.01 ? 316 LYS A C 1 ATOM 2104 O O . LYS A 1 281 ? 32.852 28.433 21.783 1.00 29.68 ? 316 LYS A O 1 ATOM 2105 C CB . LYS A 1 281 ? 29.815 29.135 22.834 1.00 26.32 ? 316 LYS A CB 1 ATOM 2106 C CG . LYS A 1 281 ? 30.551 28.672 24.089 1.00 36.04 ? 316 LYS A CG 1 ATOM 2107 C CD . LYS A 1 281 ? 29.642 28.679 25.318 1.00 45.31 ? 316 LYS A CD 1 ATOM 2108 C CE . LYS A 1 281 ? 30.403 28.289 26.584 1.00 51.87 ? 316 LYS A CE 1 ATOM 2109 N NZ . LYS A 1 281 ? 31.582 29.162 26.825 1.00 57.58 ? 316 LYS A NZ 1 ATOM 2110 N N . TYR A 1 282 ? 31.163 27.454 20.633 1.00 26.51 ? 317 TYR A N 1 ATOM 2111 C CA . TYR A 1 282 ? 31.831 26.161 20.479 1.00 28.64 ? 317 TYR A CA 1 ATOM 2112 C C . TYR A 1 282 ? 32.279 25.838 19.060 1.00 29.28 ? 317 TYR A C 1 ATOM 2113 O O . TYR A 1 282 ? 32.958 24.833 18.843 1.00 28.93 ? 317 TYR A O 1 ATOM 2114 C CB . TYR A 1 282 ? 30.927 25.018 20.968 1.00 31.69 ? 317 TYR A CB 1 ATOM 2115 C CG . TYR A 1 282 ? 30.512 25.117 22.418 1.00 34.24 ? 317 TYR A CG 1 ATOM 2116 C CD1 . TYR A 1 282 ? 31.433 24.926 23.436 1.00 43.46 ? 317 TYR A CD1 1 ATOM 2117 C CD2 . TYR A 1 282 ? 29.195 25.387 22.769 1.00 37.91 ? 317 TYR A CD2 1 ATOM 2118 C CE1 . TYR A 1 282 ? 31.060 25.009 24.764 1.00 40.27 ? 317 TYR A CE1 1 ATOM 2119 C CE2 . TYR A 1 282 ? 28.810 25.466 24.095 1.00 40.71 ? 317 TYR A CE2 1 ATOM 2120 C CZ . TYR A 1 282 ? 29.749 25.277 25.088 1.00 50.30 ? 317 TYR A CZ 1 ATOM 2121 O OH . TYR A 1 282 ? 29.388 25.355 26.418 1.00 57.31 ? 317 TYR A OH 1 ATOM 2122 N N . GLY A 1 283 ? 31.895 26.670 18.097 1.00 23.82 ? 318 GLY A N 1 ATOM 2123 C CA . GLY A 1 283 ? 32.202 26.396 16.706 1.00 18.81 ? 318 GLY A CA 1 ATOM 2124 C C . GLY A 1 283 ? 31.252 25.377 16.127 1.00 22.90 ? 318 GLY A C 1 ATOM 2125 O O . GLY A 1 283 ? 30.601 24.638 16.869 1.00 26.37 ? 318 GLY A O 1 ATOM 2126 N N . PRO A 1 284 ? 31.170 25.311 14.792 1.00 20.05 ? 319 PRO A N 1 ATOM 2127 C CA . PRO A 1 284 ? 30.128 24.499 14.161 1.00 19.78 ? 319 PRO A CA 1 ATOM 2128 C C . PRO A 1 284 ? 30.331 23.005 14.313 1.00 31.95 ? 319 PRO A C 1 ATOM 2129 O O . PRO A 1 284 ? 29.348 22.257 14.256 1.00 31.27 ? 319 PRO A O 1 ATOM 2130 C CB . PRO A 1 284 ? 30.249 24.858 12.673 1.00 22.49 ? 319 PRO A CB 1 ATOM 2131 C CG . PRO A 1 284 ? 31.619 25.463 12.538 1.00 19.10 ? 319 PRO A CG 1 ATOM 2132 C CD . PRO A 1 284 ? 31.857 26.171 13.812 1.00 20.25 ? 319 PRO A CD 1 ATOM 2133 N N . PHE A 1 285 ? 31.572 22.566 14.467 1.00 30.08 ? 320 PHE A N 1 ATOM 2134 C CA . PHE A 1 285 ? 31.822 21.123 14.523 1.00 33.04 ? 320 PHE A CA 1 ATOM 2135 C C . PHE A 1 285 ? 32.153 20.655 15.935 1.00 35.46 ? 320 PHE A C 1 ATOM 2136 O O . PHE A 1 285 ? 32.688 19.569 16.133 1.00 41.13 ? 320 PHE A O 1 ATOM 2137 C CB . PHE A 1 285 ? 32.891 20.723 13.510 1.00 39.07 ? 320 PHE A CB 1 ATOM 2138 C CG . PHE A 1 285 ? 32.502 21.018 12.084 1.00 47.49 ? 320 PHE A CG 1 ATOM 2139 C CD1 . PHE A 1 285 ? 31.174 20.918 11.680 1.00 52.11 ? 320 PHE A CD1 1 ATOM 2140 C CD2 . PHE A 1 285 ? 33.452 21.420 11.156 1.00 43.31 ? 320 PHE A CD2 1 ATOM 2141 C CE1 . PHE A 1 285 ? 30.805 21.197 10.362 1.00 46.14 ? 320 PHE A CE1 1 ATOM 2142 C CE2 . PHE A 1 285 ? 33.095 21.700 9.847 1.00 46.76 ? 320 PHE A CE2 1 ATOM 2143 C CZ . PHE A 1 285 ? 31.772 21.584 9.445 1.00 46.92 ? 320 PHE A CZ 1 ATOM 2144 N N . GLY A 1 286 ? 31.815 21.492 16.909 1.00 26.23 ? 321 GLY A N 1 ATOM 2145 C CA . GLY A 1 286 ? 32.024 21.184 18.311 1.00 35.39 ? 321 GLY A CA 1 ATOM 2146 C C . GLY A 1 286 ? 31.013 20.164 18.802 1.00 40.78 ? 321 GLY A C 1 ATOM 2147 O O . GLY A 1 286 ? 29.858 20.173 18.377 1.00 36.05 ? 321 GLY A O 1 ATOM 2148 N N . PRO A 1 287 ? 31.445 19.264 19.700 1.00 37.82 ? 322 PRO A N 1 ATOM 2149 C CA . PRO A 1 287 ? 30.524 18.249 20.228 1.00 36.40 ? 322 PRO A CA 1 ATOM 2150 C C . PRO A 1 287 ? 29.435 18.895 21.063 1.00 32.17 ? 322 PRO A C 1 ATOM 2151 O O . PRO A 1 287 ? 28.378 18.310 21.264 1.00 39.38 ? 322 PRO A O 1 ATOM 2152 C CB . PRO A 1 287 ? 31.430 17.357 21.093 1.00 40.03 ? 322 PRO A CB 1 ATOM 2153 C CG . PRO A 1 287 ? 32.632 18.200 21.401 1.00 42.61 ? 322 PRO A CG 1 ATOM 2154 C CD . PRO A 1 287 ? 32.817 19.108 20.211 1.00 38.42 ? 322 PRO A CD 1 ATOM 2155 N N . GLU A 1 288 ? 29.682 20.110 21.528 1.00 34.70 ? 323 GLU A N 1 ATOM 2156 C CA . GLU A 1 288 ? 28.688 20.807 22.320 1.00 36.66 ? 323 GLU A CA 1 ATOM 2157 C C . GLU A 1 288 ? 27.484 21.231 21.479 1.00 32.91 ? 323 GLU A C 1 ATOM 2158 O O . GLU A 1 288 ? 26.471 21.642 22.035 1.00 36.19 ? 323 GLU A O 1 ATOM 2159 C CB . GLU A 1 288 ? 29.296 22.015 23.032 1.00 38.32 ? 323 GLU A CB 1 ATOM 2160 C CG . GLU A 1 288 ? 30.430 21.683 23.982 1.00 42.36 ? 323 GLU A CG 1 ATOM 2161 C CD . GLU A 1 288 ? 31.784 21.667 23.292 1.00 47.78 ? 323 GLU A CD 1 ATOM 2162 O OE1 . GLU A 1 288 ? 31.829 21.467 22.054 1.00 38.10 ? 323 GLU A OE1 1 ATOM 2163 O OE2 . GLU A 1 288 ? 32.804 21.870 23.989 1.00 51.16 ? 323 GLU A OE2 1 ATOM 2164 N N . MET A 1 289 ? 27.597 21.112 20.157 1.00 35.64 ? 324 MET A N 1 ATOM 2165 C CA . MET A 1 289 ? 26.529 21.527 19.242 1.00 30.96 ? 324 MET A CA 1 ATOM 2166 C C . MET A 1 289 ? 25.347 20.573 19.254 1.00 30.81 ? 324 MET A C 1 ATOM 2167 O O . MET A 1 289 ? 24.240 20.940 18.853 1.00 28.78 ? 324 MET A O 1 ATOM 2168 C CB . MET A 1 289 ? 27.046 21.670 17.804 1.00 28.87 ? 324 MET A CB 1 ATOM 2169 C CG . MET A 1 289 ? 27.944 22.892 17.589 1.00 27.59 ? 324 MET A CG 1 ATOM 2170 S SD . MET A 1 289 ? 27.241 24.425 18.233 1.00 28.62 ? 324 MET A SD 1 ATOM 2171 C CE . MET A 1 289 ? 25.847 24.637 17.115 1.00 25.60 ? 324 MET A CE 1 ATOM 2172 N N . THR A 1 290 ? 25.577 19.341 19.694 1.00 33.41 ? 325 THR A N 1 ATOM 2173 C CA . THR A 1 290 ? 24.504 18.351 19.721 1.00 34.87 ? 325 THR A CA 1 ATOM 2174 C C . THR A 1 290 ? 23.370 18.787 20.644 1.00 26.20 ? 325 THR A C 1 ATOM 2175 O O . THR A 1 290 ? 22.210 18.652 20.297 1.00 27.95 ? 325 THR A O 1 ATOM 2176 C CB . THR A 1 290 ? 25.010 16.964 20.178 1.00 40.38 ? 325 THR A CB 1 ATOM 2177 O OG1 . THR A 1 290 ? 26.069 16.533 19.319 1.00 36.92 ? 325 THR A OG1 1 ATOM 2178 C CG2 . THR A 1 290 ? 23.891 15.951 20.110 1.00 42.79 ? 325 THR A CG2 1 ATOM 2179 N N . ASN A 1 291 ? 23.714 19.309 21.818 1.00 31.02 ? 326 ASN A N 1 ATOM 2180 C CA . ASN A 1 291 ? 22.708 19.689 22.795 1.00 31.31 ? 326 ASN A CA 1 ATOM 2181 C C . ASN A 1 291 ? 21.729 20.757 22.278 1.00 33.62 ? 326 ASN A C 1 ATOM 2182 O O . ASN A 1 291 ? 20.525 20.554 22.357 1.00 24.97 ? 326 ASN A O 1 ATOM 2183 C CB . ASN A 1 291 ? 23.355 20.081 24.136 1.00 39.47 ? 326 ASN A CB 1 ATOM 2184 C CG . ASN A 1 291 ? 22.336 20.256 25.256 1.00 52.53 ? 326 ASN A CG 1 ATOM 2185 O OD1 . ASN A 1 291 ? 21.916 19.278 25.893 1.00 56.35 ? 326 ASN A OD1 1 ATOM 2186 N ND2 . ASN A 1 291 ? 21.941 21.506 25.511 1.00 48.94 ? 326 ASN A ND2 1 ATOM 2187 N N . PRO A 1 292 ? 22.226 21.887 21.721 1.00 29.92 ? 327 PRO A N 1 ATOM 2188 C CA . PRO A 1 292 ? 21.225 22.833 21.201 1.00 27.99 ? 327 PRO A CA 1 ATOM 2189 C C . PRO A 1 292 ? 20.442 22.321 20.009 1.00 21.27 ? 327 PRO A C 1 ATOM 2190 O O . PRO A 1 292 ? 19.295 22.707 19.852 1.00 23.91 ? 327 PRO A O 1 ATOM 2191 C CB . PRO A 1 292 ? 22.060 24.063 20.796 1.00 27.32 ? 327 PRO A CB 1 ATOM 2192 C CG . PRO A 1 292 ? 23.452 23.572 20.710 1.00 32.87 ? 327 PRO A CG 1 ATOM 2193 C CD . PRO A 1 292 ? 23.567 22.495 21.746 1.00 32.46 ? 327 PRO A CD 1 ATOM 2194 N N . LEU A 1 293 ? 21.042 21.489 19.168 1.00 23.23 ? 328 LEU A N 1 ATOM 2195 C CA . LEU A 1 293 ? 20.289 20.896 18.072 1.00 25.31 ? 328 LEU A CA 1 ATOM 2196 C C . LEU A 1 293 ? 19.175 19.993 18.619 1.00 25.89 ? 328 LEU A C 1 ATOM 2197 O O . LEU A 1 293 ? 18.065 20.007 18.113 1.00 21.89 ? 328 LEU A O 1 ATOM 2198 C CB . LEU A 1 293 ? 21.208 20.130 17.130 1.00 26.73 ? 328 LEU A CB 1 ATOM 2199 C CG . LEU A 1 293 ? 22.191 21.040 16.383 1.00 27.01 ? 328 LEU A CG 1 ATOM 2200 C CD1 . LEU A 1 293 ? 23.038 20.209 15.478 1.00 30.02 ? 328 LEU A CD1 1 ATOM 2201 C CD2 . LEU A 1 293 ? 21.432 22.080 15.573 1.00 24.05 ? 328 LEU A CD2 1 ATOM 2202 N N . ARG A 1 294 ? 19.465 19.232 19.675 1.00 26.17 ? 329 ARG A N 1 ATOM 2203 C CA . ARG A 1 294 ? 18.423 18.418 20.299 1.00 28.43 ? 329 ARG A CA 1 ATOM 2204 C C . ARG A 1 294 ? 17.297 19.268 20.852 1.00 24.37 ? 329 ARG A C 1 ATOM 2205 O O . ARG A 1 294 ? 16.128 18.898 20.761 1.00 25.49 ? 329 ARG A O 1 ATOM 2206 C CB . ARG A 1 294 ? 18.984 17.596 21.445 1.00 28.24 ? 329 ARG A CB 1 ATOM 2207 C CG . ARG A 1 294 ? 19.918 16.504 21.055 1.00 29.00 ? 329 ARG A CG 1 ATOM 2208 C CD . ARG A 1 294 ? 20.332 15.737 22.306 1.00 39.92 ? 329 ARG A CD 1 ATOM 2209 N NE . ARG A 1 294 ? 21.349 14.734 22.009 1.00 39.80 ? 329 ARG A NE 1 ATOM 2210 C CZ . ARG A 1 294 ? 21.080 13.541 21.494 1.00 36.03 ? 329 ARG A CZ 1 ATOM 2211 N NH1 . ARG A 1 294 ? 22.074 12.694 21.258 1.00 44.53 ? 329 ARG A NH1 1 ATOM 2212 N NH2 . ARG A 1 294 ? 19.819 13.195 21.227 1.00 38.84 ? 329 ARG A NH2 1 ATOM 2213 N N . GLU A 1 295 ? 17.649 20.388 21.473 1.00 23.28 ? 330 GLU A N 1 ATOM 2214 C CA . GLU A 1 295 ? 16.637 21.253 22.078 1.00 28.83 ? 330 GLU A CA 1 ATOM 2215 C C . GLU A 1 295 ? 15.698 21.865 21.032 1.00 23.93 ? 330 GLU A C 1 ATOM 2216 O O . GLU A 1 295 ? 14.493 21.969 21.249 1.00 24.26 ? 330 GLU A O 1 ATOM 2217 C CB . GLU A 1 295 ? 17.292 22.360 22.902 1.00 27.42 ? 330 GLU A CB 1 ATOM 2218 C CG . GLU A 1 295 ? 18.139 21.850 24.054 1.00 35.98 ? 330 GLU A CG 1 ATOM 2219 C CD . GLU A 1 295 ? 18.408 22.936 25.079 1.00 54.48 ? 330 GLU A CD 1 ATOM 2220 O OE1 . GLU A 1 295 ? 18.148 24.117 24.758 1.00 57.18 ? 330 GLU A OE1 1 ATOM 2221 O OE2 . GLU A 1 295 ? 18.866 22.615 26.201 1.00 60.84 ? 330 GLU A OE2 1 ATOM 2222 N N . ILE A 1 296 ? 16.256 22.264 19.893 1.00 26.59 ? 331 ILE A N 1 ATOM 2223 C CA . ILE A 1 296 ? 15.445 22.820 18.806 1.00 21.48 ? 331 ILE A CA 1 ATOM 2224 C C . ILE A 1 296 ? 14.483 21.783 18.280 1.00 26.05 ? 331 ILE A C 1 ATOM 2225 O O . ILE A 1 296 ? 13.295 22.053 18.031 1.00 20.85 ? 331 ILE A O 1 ATOM 2226 C CB . ILE A 1 296 ? 16.330 23.294 17.642 1.00 23.89 ? 331 ILE A CB 1 ATOM 2227 C CG1 . ILE A 1 296 ? 17.093 24.557 18.041 1.00 28.79 ? 331 ILE A CG1 1 ATOM 2228 C CG2 . ILE A 1 296 ? 15.487 23.576 16.393 1.00 26.49 ? 331 ILE A CG2 1 ATOM 2229 C CD1 . ILE A 1 296 ? 18.218 24.883 17.069 1.00 26.70 ? 331 ILE A CD1 1 ATOM 2230 N N . ASP A 1 297 ? 15.010 20.578 18.103 1.00 25.43 ? 332 ASP A N 1 ATOM 2231 C CA . ASP A 1 297 ? 14.186 19.494 17.631 1.00 22.32 ? 332 ASP A CA 1 ATOM 2232 C C . ASP A 1 297 ? 13.027 19.234 18.581 1.00 19.85 ? 332 ASP A C 1 ATOM 2233 O O . ASP A 1 297 ? 11.905 18.986 18.142 1.00 23.26 ? 332 ASP A O 1 ATOM 2234 C CB . ASP A 1 297 ? 15.006 18.226 17.443 1.00 22.67 ? 332 ASP A CB 1 ATOM 2235 C CG . ASP A 1 297 ? 14.230 17.184 16.690 1.00 25.51 ? 332 ASP A CG 1 ATOM 2236 O OD1 . ASP A 1 297 ? 14.104 17.348 15.459 1.00 25.29 ? 332 ASP A OD1 1 ATOM 2237 O OD2 . ASP A 1 297 ? 13.703 16.244 17.332 1.00 25.07 ? 332 ASP A OD2 1 ATOM 2238 N N . LYS A 1 298 ? 13.308 19.301 19.881 1.00 22.02 ? 333 LYS A N 1 ATOM 2239 C CA . LYS A 1 298 ? 12.279 19.131 20.905 1.00 25.52 ? 333 LYS A CA 1 ATOM 2240 C C . LYS A 1 298 ? 11.171 20.182 20.783 1.00 26.52 ? 333 LYS A C 1 ATOM 2241 O O . LYS A 1 298 ? 9.996 19.868 20.935 1.00 25.07 ? 333 LYS A O 1 ATOM 2242 C CB . LYS A 1 298 ? 12.901 19.176 22.297 1.00 27.91 ? 333 LYS A CB 1 ATOM 2243 C CG . LYS A 1 298 ? 11.913 18.918 23.421 1.00 35.27 ? 333 LYS A CG 1 ATOM 2244 C CD . LYS A 1 298 ? 12.621 18.848 24.767 1.00 41.29 ? 333 LYS A CD 1 ATOM 2245 C CE . LYS A 1 298 ? 11.631 18.626 25.911 1.00 50.69 ? 333 LYS A CE 1 ATOM 2246 N NZ . LYS A 1 298 ? 12.258 18.772 27.268 1.00 56.39 ? 333 LYS A NZ 1 ATOM 2247 N N . THR A 1 299 ? 11.557 21.423 20.490 1.00 26.14 ? 334 THR A N 1 ATOM 2248 C CA . THR A 1 299 ? 10.602 22.494 20.213 1.00 24.23 ? 334 THR A CA 1 ATOM 2249 C C . THR A 1 299 ? 9.761 22.207 18.966 1.00 22.38 ? 334 THR A C 1 ATOM 2250 O O . THR A 1 299 ? 8.543 22.382 18.973 1.00 23.42 ? 334 THR A O 1 ATOM 2251 C CB . THR A 1 299 ? 11.327 23.846 20.048 1.00 23.48 ? 334 THR A CB 1 ATOM 2252 O OG1 . THR A 1 299 ? 12.112 24.103 21.206 1.00 24.66 ? 334 THR A OG1 1 ATOM 2253 C CG2 . THR A 1 299 ? 10.314 24.982 19.865 1.00 24.20 ? 334 THR A CG2 1 ATOM 2254 N N . VAL A 1 300 ? 10.402 21.766 17.890 1.00 19.79 ? 335 VAL A N 1 ATOM 2255 C CA . VAL A 1 300 ? 9.671 21.396 16.683 1.00 22.28 ? 335 VAL A CA 1 ATOM 2256 C C . VAL A 1 300 ? 8.649 20.299 17.007 1.00 23.59 ? 335 VAL A C 1 ATOM 2257 O O . VAL A 1 300 ? 7.504 20.333 16.549 1.00 22.24 ? 335 VAL A O 1 ATOM 2258 C CB . VAL A 1 300 ? 10.635 20.942 15.561 1.00 18.08 ? 335 VAL A CB 1 ATOM 2259 C CG1 . VAL A 1 300 ? 9.866 20.295 14.428 1.00 20.83 ? 335 VAL A CG1 1 ATOM 2260 C CG2 . VAL A 1 300 ? 11.479 22.127 15.063 1.00 21.39 ? 335 VAL A CG2 1 ATOM 2261 N N . GLY A 1 301 ? 9.064 19.357 17.844 1.00 26.22 ? 336 GLY A N 1 ATOM 2262 C CA . GLY A 1 301 ? 8.204 18.263 18.255 1.00 25.17 ? 336 GLY A CA 1 ATOM 2263 C C . GLY A 1 301 ? 7.025 18.736 19.078 1.00 26.76 ? 336 GLY A C 1 ATOM 2264 O O . GLY A 1 301 ? 5.905 18.228 18.938 1.00 27.56 ? 336 GLY A O 1 ATOM 2265 N N . GLN A 1 302 ? 7.266 19.722 19.935 1.00 22.74 ? 337 GLN A N 1 ATOM 2266 C CA . GLN A 1 302 ? 6.171 20.299 20.710 1.00 25.08 ? 337 GLN A CA 1 ATOM 2267 C C . GLN A 1 302 ? 5.162 20.945 19.778 1.00 25.21 ? 337 GLN A C 1 ATOM 2268 O O . GLN A 1 302 ? 3.939 20.826 19.967 1.00 24.77 ? 337 GLN A O 1 ATOM 2269 C CB . GLN A 1 302 ? 6.704 21.303 21.727 1.00 24.25 ? 337 GLN A CB 1 ATOM 2270 C CG . GLN A 1 302 ? 7.387 20.630 22.923 1.00 28.37 ? 337 GLN A CG 1 ATOM 2271 C CD . GLN A 1 302 ? 8.161 21.613 23.768 1.00 32.75 ? 337 GLN A CD 1 ATOM 2272 O OE1 . GLN A 1 302 ? 8.126 22.819 23.520 1.00 34.49 ? 337 GLN A OE1 1 ATOM 2273 N NE2 . GLN A 1 302 ? 8.870 21.106 24.772 1.00 36.98 ? 337 GLN A NE2 1 ATOM 2274 N N . LEU A 1 303 ? 5.672 21.618 18.753 1.00 25.43 ? 338 LEU A N 1 ATOM 2275 C CA . LEU A 1 303 ? 4.789 22.253 17.782 1.00 22.23 ? 338 LEU A CA 1 ATOM 2276 C C . LEU A 1 303 ? 3.998 21.206 17.008 1.00 24.53 ? 338 LEU A C 1 ATOM 2277 O O . LEU A 1 303 ? 2.794 21.350 16.845 1.00 23.85 ? 338 LEU A O 1 ATOM 2278 C CB . LEU A 1 303 ? 5.580 23.133 16.805 1.00 19.57 ? 338 LEU A CB 1 ATOM 2279 C CG . LEU A 1 303 ? 4.757 23.742 15.668 1.00 20.99 ? 338 LEU A CG 1 ATOM 2280 C CD1 . LEU A 1 303 ? 3.657 24.675 16.196 1.00 25.19 ? 338 LEU A CD1 1 ATOM 2281 C CD2 . LEU A 1 303 ? 5.681 24.500 14.732 1.00 24.16 ? 338 LEU A CD2 1 ATOM 2282 N N . MET A 1 304 ? 4.665 20.150 16.542 1.00 21.06 ? 339 MET A N 1 ATOM 2283 C CA . MET A 1 304 ? 3.964 19.144 15.749 1.00 25.82 ? 339 MET A CA 1 ATOM 2284 C C . MET A 1 304 ? 2.976 18.345 16.611 1.00 26.09 ? 339 MET A C 1 ATOM 2285 O O . MET A 1 304 ? 1.850 18.099 16.187 1.00 25.99 ? 339 MET A O 1 ATOM 2286 C CB . MET A 1 304 ? 4.921 18.232 14.973 1.00 26.13 ? 339 MET A CB 1 ATOM 2287 C CG . MET A 1 304 ? 5.827 18.972 13.985 1.00 26.21 ? 339 MET A CG 1 ATOM 2288 S SD . MET A 1 304 ? 4.981 20.139 12.881 1.00 25.60 ? 339 MET A SD 1 ATOM 2289 C CE . MET A 1 304 ? 4.030 19.023 11.846 1.00 28.31 ? 339 MET A CE 1 ATOM 2290 N N . ASP A 1 305 ? 3.390 17.983 17.822 1.00 26.90 ? 340 ASP A N 1 ATOM 2291 C CA . ASP A 1 305 ? 2.490 17.312 18.760 1.00 25.91 ? 340 ASP A CA 1 ATOM 2292 C C . ASP A 1 305 ? 1.268 18.175 19.042 1.00 29.41 ? 340 ASP A C 1 ATOM 2293 O O . ASP A 1 305 ? 0.136 17.700 18.979 1.00 32.78 ? 340 ASP A O 1 ATOM 2294 C CB . ASP A 1 305 ? 3.208 17.010 20.059 1.00 26.65 ? 340 ASP A CB 1 ATOM 2295 C CG . ASP A 1 305 ? 4.148 15.822 19.938 1.00 33.01 ? 340 ASP A CG 1 ATOM 2296 O OD1 . ASP A 1 305 ? 4.102 15.151 18.890 1.00 35.58 ? 340 ASP A OD1 1 ATOM 2297 O OD2 . ASP A 1 305 ? 4.904 15.556 20.895 1.00 33.70 ? 340 ASP A OD2 1 ATOM 2298 N N . GLY A 1 306 ? 1.508 19.446 19.350 1.00 29.76 ? 341 GLY A N 1 ATOM 2299 C CA . GLY A 1 306 ? 0.439 20.415 19.536 1.00 27.88 ? 341 GLY A CA 1 ATOM 2300 C C . GLY A 1 306 ? -0.500 20.534 18.352 1.00 30.04 ? 341 GLY A C 1 ATOM 2301 O O . GLY A 1 306 ? -1.727 20.560 18.525 1.00 29.75 ? 341 GLY A O 1 ATOM 2302 N N . LEU A 1 307 ? 0.057 20.596 17.144 1.00 25.46 ? 342 LEU A N 1 ATOM 2303 C CA . LEU A 1 307 ? -0.776 20.696 15.945 1.00 25.06 ? 342 LEU A CA 1 ATOM 2304 C C . LEU A 1 307 ? -1.631 19.442 15.774 1.00 31.35 ? 342 LEU A C 1 ATOM 2305 O O . LEU A 1 307 ? -2.789 19.513 15.341 1.00 29.73 ? 342 LEU A O 1 ATOM 2306 C CB . LEU A 1 307 ? 0.075 20.924 14.688 1.00 25.37 ? 342 LEU A CB 1 ATOM 2307 C CG . LEU A 1 307 ? 0.771 22.290 14.569 1.00 25.36 ? 342 LEU A CG 1 ATOM 2308 C CD1 . LEU A 1 307 ? 1.788 22.333 13.416 1.00 26.70 ? 342 LEU A CD1 1 ATOM 2309 C CD2 . LEU A 1 307 ? -0.261 23.405 14.425 1.00 21.45 ? 342 LEU A CD2 1 ATOM 2310 N N . LYS A 1 308 ? -1.047 18.295 16.106 1.00 28.55 ? 343 LYS A N 1 ATOM 2311 C CA . LYS A 1 308 ? -1.755 17.024 16.002 1.00 31.10 ? 343 LYS A CA 1 ATOM 2312 C C . LYS A 1 308 ? -2.945 17.030 16.962 1.00 33.37 ? 343 LYS A C 1 ATOM 2313 O O . LYS A 1 308 ? -4.038 16.594 16.602 1.00 34.87 ? 343 LYS A O 1 ATOM 2314 C CB . LYS A 1 308 ? -0.816 15.850 16.286 1.00 31.95 ? 343 LYS A CB 1 ATOM 2315 C CG . LYS A 1 308 ? -1.474 14.486 16.122 1.00 36.90 ? 343 LYS A CG 1 ATOM 2316 C CD . LYS A 1 308 ? -0.496 13.345 16.389 1.00 35.68 ? 343 LYS A CD 1 ATOM 2317 C CE . LYS A 1 308 ? -1.203 11.990 16.266 1.00 35.04 ? 343 LYS A CE 1 ATOM 2318 N NZ . LYS A 1 308 ? -0.304 10.853 16.639 1.00 38.64 ? 343 LYS A NZ 1 ATOM 2319 N N . GLN A 1 309 ? -2.733 17.570 18.162 1.00 32.29 ? 344 GLN A N 1 ATOM 2320 C CA . GLN A 1 309 ? -3.789 17.675 19.176 1.00 41.38 ? 344 GLN A CA 1 ATOM 2321 C C . GLN A 1 309 ? -4.927 18.571 18.723 1.00 37.52 ? 344 GLN A C 1 ATOM 2322 O O . GLN A 1 309 ? -6.057 18.418 19.178 1.00 44.41 ? 344 GLN A O 1 ATOM 2323 C CB . GLN A 1 309 ? -3.248 18.233 20.500 1.00 37.72 ? 344 GLN A CB 1 ATOM 2324 C CG . GLN A 1 309 ? -2.311 17.326 21.239 1.00 40.54 ? 344 GLN A CG 1 ATOM 2325 C CD . GLN A 1 309 ? -2.176 17.710 22.701 1.00 45.48 ? 344 GLN A CD 1 ATOM 2326 O OE1 . GLN A 1 309 ? -1.944 16.852 23.556 1.00 43.93 ? 344 GLN A OE1 1 ATOM 2327 N NE2 . GLN A 1 309 ? -2.313 19.005 22.998 1.00 42.07 ? 344 GLN A NE2 1 ATOM 2328 N N . LEU A 1 310 ? -4.618 19.524 17.854 1.00 30.47 ? 345 LEU A N 1 ATOM 2329 C CA . LEU A 1 310 ? -5.613 20.449 17.334 1.00 32.41 ? 345 LEU A CA 1 ATOM 2330 C C . LEU A 1 310 ? -6.179 19.965 16.006 1.00 35.34 ? 345 LEU A C 1 ATOM 2331 O O . LEU A 1 310 ? -6.974 20.673 15.371 1.00 31.75 ? 345 LEU A O 1 ATOM 2332 C CB . LEU A 1 310 ? -4.986 21.824 17.126 1.00 32.74 ? 345 LEU A CB 1 ATOM 2333 C CG . LEU A 1 310 ? -4.867 22.839 18.263 1.00 37.80 ? 345 LEU A CG 1 ATOM 2334 C CD1 . LEU A 1 310 ? -4.679 22.196 19.619 1.00 41.31 ? 345 LEU A CD1 1 ATOM 2335 C CD2 . LEU A 1 310 ? -3.713 23.776 17.948 1.00 33.70 ? 345 LEU A CD2 1 ATOM 2336 N N . LYS A 1 311 ? -5.755 18.772 15.586 1.00 31.26 ? 346 LYS A N 1 ATOM 2337 C CA . LYS A 1 311 ? -6.139 18.213 14.290 1.00 32.97 ? 346 LYS A CA 1 ATOM 2338 C C . LYS A 1 311 ? -5.684 19.082 13.113 1.00 33.47 ? 346 LYS A C 1 ATOM 2339 O O . LYS A 1 311 ? -6.376 19.184 12.091 1.00 30.75 ? 346 LYS A O 1 ATOM 2340 C CB . LYS A 1 311 ? -7.650 17.948 14.239 1.00 36.71 ? 346 LYS A CB 1 ATOM 2341 C CG . LYS A 1 311 ? -8.142 17.105 15.403 1.00 42.04 ? 346 LYS A CG 1 ATOM 2342 C CD . LYS A 1 311 ? -9.656 17.175 15.541 1.00 49.34 ? 346 LYS A CD 1 ATOM 2343 C CE . LYS A 1 311 ? -10.137 16.364 16.743 1.00 60.35 ? 346 LYS A CE 1 ATOM 2344 N NZ . LYS A 1 311 ? -9.813 14.914 16.596 1.00 61.53 ? 346 LYS A NZ 1 ATOM 2345 N N . LEU A 1 312 ? -4.498 19.674 13.254 1.00 32.06 ? 347 LEU A N 1 ATOM 2346 C CA . LEU A 1 312 ? -3.985 20.641 12.280 1.00 31.07 ? 347 LEU A CA 1 ATOM 2347 C C . LEU A 1 312 ? -2.720 20.155 11.580 1.00 30.38 ? 347 LEU A C 1 ATOM 2348 O O . LEU A 1 312 ? -2.207 20.826 10.700 1.00 29.85 ? 347 LEU A O 1 ATOM 2349 C CB . LEU A 1 312 ? -3.703 21.981 12.967 1.00 32.70 ? 347 LEU A CB 1 ATOM 2350 C CG . LEU A 1 312 ? -4.940 22.756 13.430 1.00 32.38 ? 347 LEU A CG 1 ATOM 2351 C CD1 . LEU A 1 312 ? -4.567 23.978 14.272 1.00 31.76 ? 347 LEU A CD1 1 ATOM 2352 C CD2 . LEU A 1 312 ? -5.732 23.182 12.223 1.00 28.95 ? 347 LEU A CD2 1 ATOM 2353 N N . HIS A 1 313 ? -2.240 18.973 11.945 1.00 29.65 ? 348 HIS A N 1 ATOM 2354 C CA . HIS A 1 313 ? -0.949 18.498 11.440 1.00 28.02 ? 348 HIS A CA 1 ATOM 2355 C C . HIS A 1 313 ? -0.946 18.145 9.950 1.00 29.36 ? 348 HIS A C 1 ATOM 2356 O O . HIS A 1 313 ? 0.112 17.901 9.377 1.00 27.80 ? 348 HIS A O 1 ATOM 2357 C CB . HIS A 1 313 ? -0.433 17.335 12.280 1.00 31.49 ? 348 HIS A CB 1 ATOM 2358 C CG . HIS A 1 313 ? -1.335 16.146 12.272 1.00 34.71 ? 348 HIS A CG 1 ATOM 2359 N ND1 . HIS A 1 313 ? -2.646 16.209 12.690 1.00 35.64 ? 348 HIS A ND1 1 ATOM 2360 C CD2 . HIS A 1 313 ? -1.117 14.862 11.898 1.00 36.57 ? 348 HIS A CD2 1 ATOM 2361 C CE1 . HIS A 1 313 ? -3.199 15.014 12.570 1.00 42.80 ? 348 HIS A CE1 1 ATOM 2362 N NE2 . HIS A 1 313 ? -2.293 14.180 12.093 1.00 31.23 ? 348 HIS A NE2 1 ATOM 2363 N N . ARG A 1 314 ? -2.126 18.140 9.326 1.00 26.08 ? 349 ARG A N 1 ATOM 2364 C CA . ARG A 1 314 ? -2.252 17.853 7.902 1.00 32.70 ? 349 ARG A CA 1 ATOM 2365 C C . ARG A 1 314 ? -2.998 18.993 7.232 1.00 27.39 ? 349 ARG A C 1 ATOM 2366 O O . ARG A 1 314 ? -3.513 18.877 6.112 1.00 26.90 ? 349 ARG A O 1 ATOM 2367 C CB . ARG A 1 314 ? -2.932 16.493 7.687 1.00 33.53 ? 349 ARG A CB 1 ATOM 2368 C CG . ARG A 1 314 ? -2.086 15.341 8.247 1.00 32.06 ? 349 ARG A CG 1 ATOM 2369 C CD . ARG A 1 314 ? -2.784 13.978 8.161 1.00 39.16 ? 349 ARG A CD 1 ATOM 2370 N NE . ARG A 1 314 ? -3.213 13.676 6.801 1.00 40.91 ? 349 ARG A NE 1 ATOM 2371 C CZ . ARG A 1 314 ? -2.429 13.148 5.869 1.00 37.16 ? 349 ARG A CZ 1 ATOM 2372 N NH1 . ARG A 1 314 ? -1.160 12.857 6.143 1.00 37.35 ? 349 ARG A NH1 1 ATOM 2373 N NH2 . ARG A 1 314 ? -2.916 12.915 4.661 1.00 41.53 ? 349 ARG A NH2 1 ATOM 2374 N N . CYS A 1 315 ? -2.978 20.120 7.933 1.00 30.19 ? 350 CYS A N 1 ATOM 2375 C CA . CYS A 1 315 ? -3.661 21.337 7.534 1.00 30.06 ? 350 CYS A CA 1 ATOM 2376 C C . CYS A 1 315 ? -2.657 22.489 7.312 1.00 30.55 ? 350 CYS A C 1 ATOM 2377 O O . CYS A 1 315 ? -2.701 23.163 6.286 1.00 35.96 ? 350 CYS A O 1 ATOM 2378 C CB . CYS A 1 315 ? -4.669 21.696 8.632 1.00 30.92 ? 350 CYS A CB 1 ATOM 2379 S SG . CYS A 1 315 ? -5.444 23.313 8.485 1.00 37.13 ? 350 CYS A SG 1 ATOM 2380 N N . VAL A 1 316 ? -1.740 22.683 8.259 1.00 31.91 ? 351 VAL A N 1 ATOM 2381 C CA . VAL A 1 316 ? -0.788 23.804 8.236 1.00 28.50 ? 351 VAL A CA 1 ATOM 2382 C C . VAL A 1 316 ? 0.389 23.567 7.280 1.00 28.31 ? 351 VAL A C 1 ATOM 2383 O O . VAL A 1 316 ? 0.868 22.442 7.133 1.00 27.13 ? 351 VAL A O 1 ATOM 2384 C CB . VAL A 1 316 ? -0.222 24.057 9.655 1.00 28.22 ? 351 VAL A CB 1 ATOM 2385 C CG1 . VAL A 1 316 ? 0.805 25.195 9.666 1.00 30.24 ? 351 VAL A CG1 1 ATOM 2386 C CG2 . VAL A 1 316 ? -1.349 24.362 10.639 1.00 28.03 ? 351 VAL A CG2 1 ATOM 2387 N N . ASN A 1 317 ? 0.848 24.623 6.617 1.00 24.41 ? 352 ASN A N 1 ATOM 2388 C CA . ASN A 1 317 ? 2.144 24.571 5.955 1.00 23.91 ? 352 ASN A CA 1 ATOM 2389 C C . ASN A 1 317 ? 3.205 25.085 6.917 1.00 27.98 ? 352 ASN A C 1 ATOM 2390 O O . ASN A 1 317 ? 3.064 26.168 7.477 1.00 23.54 ? 352 ASN A O 1 ATOM 2391 C CB . ASN A 1 317 ? 2.141 25.410 4.681 1.00 24.63 ? 352 ASN A CB 1 ATOM 2392 C CG . ASN A 1 317 ? 1.258 24.816 3.595 1.00 28.70 ? 352 ASN A CG 1 ATOM 2393 O OD1 . ASN A 1 317 ? 1.423 23.654 3.213 1.00 26.47 ? 352 ASN A OD1 1 ATOM 2394 N ND2 . ASN A 1 317 ? 0.290 25.597 3.120 1.00 26.20 ? 352 ASN A ND2 1 ATOM 2395 N N . VAL A 1 318 ? 4.266 24.305 7.101 1.00 20.93 ? 353 VAL A N 1 ATOM 2396 C CA . VAL A 1 318 ? 5.389 24.686 7.945 1.00 19.63 ? 353 VAL A CA 1 ATOM 2397 C C . VAL A 1 318 ? 6.640 24.967 7.104 1.00 22.56 ? 353 VAL A C 1 ATOM 2398 O O . VAL A 1 318 ? 7.014 24.158 6.243 1.00 21.37 ? 353 VAL A O 1 ATOM 2399 C CB . VAL A 1 318 ? 5.725 23.568 8.951 1.00 22.72 ? 353 VAL A CB 1 ATOM 2400 C CG1 . VAL A 1 318 ? 6.907 23.975 9.847 1.00 20.50 ? 353 VAL A CG1 1 ATOM 2401 C CG2 . VAL A 1 318 ? 4.514 23.218 9.784 1.00 24.57 ? 353 VAL A CG2 1 ATOM 2402 N N . ILE A 1 319 ? 7.270 26.119 7.333 1.00 20.87 ? 354 ILE A N 1 ATOM 2403 C CA . ILE A 1 319 ? 8.562 26.413 6.713 1.00 17.99 ? 354 ILE A CA 1 ATOM 2404 C C . ILE A 1 319 ? 9.609 26.423 7.818 1.00 20.98 ? 354 ILE A C 1 ATOM 2405 O O . ILE A 1 319 ? 9.466 27.118 8.809 1.00 21.56 ? 354 ILE A O 1 ATOM 2406 C CB . ILE A 1 319 ? 8.563 27.759 5.953 1.00 19.86 ? 354 ILE A CB 1 ATOM 2407 C CG1 . ILE A 1 319 ? 7.708 27.658 4.696 1.00 21.78 ? 354 ILE A CG1 1 ATOM 2408 C CG2 . ILE A 1 319 ? 9.987 28.173 5.566 1.00 20.55 ? 354 ILE A CG2 1 ATOM 2409 C CD1 . ILE A 1 319 ? 7.537 28.972 3.979 1.00 18.98 ? 354 ILE A CD1 1 ATOM 2410 N N . PHE A 1 320 ? 10.620 25.575 7.673 1.00 19.54 ? 355 PHE A N 1 ATOM 2411 C CA . PHE A 1 320 ? 11.715 25.510 8.615 1.00 17.78 ? 355 PHE A CA 1 ATOM 2412 C C . PHE A 1 320 ? 12.917 26.118 7.927 1.00 18.77 ? 355 PHE A C 1 ATOM 2413 O O . PHE A 1 320 ? 13.414 25.582 6.924 1.00 19.31 ? 355 PHE A O 1 ATOM 2414 C CB . PHE A 1 320 ? 11.969 24.054 9.022 1.00 19.68 ? 355 PHE A CB 1 ATOM 2415 C CG . PHE A 1 320 ? 13.043 23.887 10.048 1.00 16.31 ? 355 PHE A CG 1 ATOM 2416 C CD1 . PHE A 1 320 ? 12.759 23.982 11.395 1.00 17.73 ? 355 PHE A CD1 1 ATOM 2417 C CD2 . PHE A 1 320 ? 14.342 23.611 9.657 1.00 19.73 ? 355 PHE A CD2 1 ATOM 2418 C CE1 . PHE A 1 320 ? 13.748 23.804 12.346 1.00 24.14 ? 355 PHE A CE1 1 ATOM 2419 C CE2 . PHE A 1 320 ? 15.342 23.431 10.597 1.00 18.16 ? 355 PHE A CE2 1 ATOM 2420 C CZ . PHE A 1 320 ? 15.055 23.530 11.930 1.00 22.04 ? 355 PHE A CZ 1 ATOM 2421 N N . VAL A 1 321 ? 13.372 27.260 8.435 1.00 18.45 ? 356 VAL A N 1 ATOM 2422 C CA . VAL A 1 321 ? 14.297 28.055 7.660 1.00 15.09 ? 356 VAL A CA 1 ATOM 2423 C C . VAL A 1 321 ? 15.338 28.735 8.546 1.00 17.35 ? 356 VAL A C 1 ATOM 2424 O O . VAL A 1 321 ? 15.043 29.126 9.666 1.00 18.55 ? 356 VAL A O 1 ATOM 2425 C CB . VAL A 1 321 ? 13.498 29.090 6.831 1.00 20.23 ? 356 VAL A CB 1 ATOM 2426 C CG1 . VAL A 1 321 ? 12.843 30.140 7.743 1.00 18.63 ? 356 VAL A CG1 1 ATOM 2427 C CG2 . VAL A 1 321 ? 14.350 29.729 5.811 1.00 20.33 ? 356 VAL A CG2 1 ATOM 2428 N N . GLY A 1 322 ? 16.574 28.832 8.066 1.00 18.21 ? 357 GLY A N 1 ATOM 2429 C CA . GLY A 1 322 ? 17.598 29.522 8.826 1.00 17.03 ? 357 GLY A CA 1 ATOM 2430 C C . GLY A 1 322 ? 17.949 30.870 8.222 1.00 15.59 ? 357 GLY A C 1 ATOM 2431 O O . GLY A 1 322 ? 17.541 31.192 7.108 1.00 18.24 ? 357 GLY A O 1 ATOM 2432 N N . ASP A 1 323 ? 18.727 31.660 8.943 1.00 18.95 ? 358 ASP A N 1 ATOM 2433 C CA . ASP A 1 323 ? 19.133 32.959 8.405 1.00 18.73 ? 358 ASP A CA 1 ATOM 2434 C C . ASP A 1 323 ? 20.562 32.987 7.834 1.00 18.06 ? 358 ASP A C 1 ATOM 2435 O O . ASP A 1 323 ? 20.871 33.832 6.978 1.00 19.16 ? 358 ASP A O 1 ATOM 2436 C CB . ASP A 1 323 ? 18.913 34.064 9.448 1.00 19.73 ? 358 ASP A CB 1 ATOM 2437 C CG . ASP A 1 323 ? 19.757 33.876 10.695 1.00 20.40 ? 358 ASP A CG 1 ATOM 2438 O OD1 . ASP A 1 323 ? 20.209 32.739 10.953 1.00 18.97 ? 358 ASP A OD1 1 ATOM 2439 O OD2 . ASP A 1 323 ? 19.989 34.863 11.435 1.00 26.98 ? 358 ASP A OD2 1 ATOM 2440 N N . HIS A 1 324 ? 21.426 32.079 8.312 1.00 15.81 ? 359 HIS A N 1 ATOM 2441 C CA . HIS A 1 324 ? 22.801 31.960 7.832 1.00 16.48 ? 359 HIS A CA 1 ATOM 2442 C C . HIS A 1 324 ? 23.447 30.794 8.544 1.00 14.32 ? 359 HIS A C 1 ATOM 2443 O O . HIS A 1 324 ? 22.908 30.284 9.509 1.00 14.54 ? 359 HIS A O 1 ATOM 2444 C CB . HIS A 1 324 ? 23.610 33.208 8.190 1.00 15.05 ? 359 HIS A CB 1 ATOM 2445 C CG . HIS A 1 324 ? 23.573 33.535 9.644 1.00 16.40 ? 359 HIS A CG 1 ATOM 2446 N ND1 . HIS A 1 324 ? 24.300 32.836 10.586 1.00 13.51 ? 359 HIS A ND1 1 ATOM 2447 C CD2 . HIS A 1 324 ? 22.875 34.476 10.322 1.00 14.35 ? 359 HIS A CD2 1 ATOM 2448 C CE1 . HIS A 1 324 ? 24.042 33.330 11.787 1.00 18.47 ? 359 HIS A CE1 1 ATOM 2449 N NE2 . HIS A 1 324 ? 23.198 34.334 11.648 1.00 15.21 ? 359 HIS A NE2 1 ATOM 2450 N N . GLY A 1 325 ? 24.645 30.440 8.119 1.00 17.30 ? 360 GLY A N 1 ATOM 2451 C CA . GLY A 1 325 ? 25.382 29.384 8.783 1.00 17.98 ? 360 GLY A CA 1 ATOM 2452 C C . GLY A 1 325 ? 26.386 29.832 9.825 1.00 16.55 ? 360 GLY A C 1 ATOM 2453 O O . GLY A 1 325 ? 26.182 30.815 10.543 1.00 18.30 ? 360 GLY A O 1 ATOM 2454 N N . MET A 1 326 ? 27.474 29.072 9.922 1.00 16.44 ? 361 MET A N 1 ATOM 2455 C CA . MET A 1 326 ? 28.464 29.246 10.980 1.00 14.78 ? 361 MET A CA 1 ATOM 2456 C C . MET A 1 326 ? 29.780 28.630 10.525 1.00 17.28 ? 361 MET A C 1 ATOM 2457 O O . MET A 1 326 ? 29.805 27.525 9.986 1.00 17.29 ? 361 MET A O 1 ATOM 2458 C CB . MET A 1 326 ? 28.000 28.556 12.275 1.00 16.06 ? 361 MET A CB 1 ATOM 2459 C CG . MET A 1 326 ? 28.867 28.842 13.526 1.00 16.39 ? 361 MET A CG 1 ATOM 2460 S SD . MET A 1 326 ? 28.849 30.554 14.115 1.00 19.06 ? 361 MET A SD 1 ATOM 2461 C CE . MET A 1 326 ? 27.115 30.738 14.566 1.00 14.45 ? 361 MET A CE 1 ATOM 2462 N N . GLU A 1 327 ? 30.866 29.359 10.753 1.00 20.63 ? 362 GLU A N 1 ATOM 2463 C CA . GLU A 1 327 ? 32.202 28.938 10.341 1.00 17.79 ? 362 GLU A CA 1 ATOM 2464 C C . GLU A 1 327 ? 33.084 28.836 11.581 1.00 18.18 ? 362 GLU A C 1 ATOM 2465 O O . GLU A 1 327 ? 32.803 29.461 12.593 1.00 17.00 ? 362 GLU A O 1 ATOM 2466 C CB . GLU A 1 327 ? 32.771 29.977 9.346 1.00 17.43 ? 362 GLU A CB 1 ATOM 2467 C CG . GLU A 1 327 ? 34.204 29.739 8.819 1.00 17.95 ? 362 GLU A CG 1 ATOM 2468 C CD . GLU A 1 327 ? 34.359 28.429 8.070 1.00 21.07 ? 362 GLU A CD 1 ATOM 2469 O OE1 . GLU A 1 327 ? 34.556 27.411 8.748 1.00 19.35 ? 362 GLU A OE1 1 ATOM 2470 O OE2 . GLU A 1 327 ? 34.269 28.417 6.819 1.00 20.23 ? 362 GLU A OE2 1 ATOM 2471 N N . ASP A 1 328 ? 34.144 28.030 11.502 1.00 18.82 ? 363 ASP A N 1 ATOM 2472 C CA . ASP A 1 328 ? 35.198 28.028 12.516 1.00 21.05 ? 363 ASP A CA 1 ATOM 2473 C C . ASP A 1 328 ? 35.995 29.342 12.463 1.00 18.37 ? 363 ASP A C 1 ATOM 2474 O O . ASP A 1 328 ? 36.651 29.635 11.470 1.00 18.93 ? 363 ASP A O 1 ATOM 2475 C CB . ASP A 1 328 ? 36.150 26.861 12.247 1.00 23.93 ? 363 ASP A CB 1 ATOM 2476 C CG . ASP A 1 328 ? 35.565 25.535 12.672 1.00 29.58 ? 363 ASP A CG 1 ATOM 2477 O OD1 . ASP A 1 328 ? 35.235 25.397 13.872 1.00 30.31 ? 363 ASP A OD1 1 ATOM 2478 O OD2 . ASP A 1 328 ? 35.413 24.645 11.805 1.00 31.87 ? 363 ASP A OD2 1 ATOM 2479 N N . VAL A 1 329 ? 35.912 30.133 13.519 1.00 17.99 ? 364 VAL A N 1 ATOM 2480 C CA . VAL A 1 329 ? 36.634 31.397 13.596 1.00 19.39 ? 364 VAL A CA 1 ATOM 2481 C C . VAL A 1 329 ? 37.106 31.553 15.044 1.00 23.49 ? 364 VAL A C 1 ATOM 2482 O O . VAL A 1 329 ? 36.310 31.437 15.966 1.00 26.37 ? 364 VAL A O 1 ATOM 2483 C CB . VAL A 1 329 ? 35.737 32.606 13.228 1.00 17.66 ? 364 VAL A CB 1 ATOM 2484 C CG1 . VAL A 1 329 ? 36.582 33.880 13.116 1.00 20.59 ? 364 VAL A CG1 1 ATOM 2485 C CG2 . VAL A 1 329 ? 34.957 32.366 11.939 1.00 19.50 ? 364 VAL A CG2 1 ATOM 2486 N N . THR A 1 330 ? 38.404 31.789 15.247 1.00 23.11 ? 365 THR A N 1 ATOM 2487 C CA . THR A 1 330 ? 38.945 31.984 16.588 1.00 25.11 ? 365 THR A CA 1 ATOM 2488 C C . THR A 1 330 ? 39.843 33.208 16.653 1.00 26.50 ? 365 THR A C 1 ATOM 2489 O O . THR A 1 330 ? 40.239 33.760 15.617 1.00 23.51 ? 365 THR A O 1 ATOM 2490 C CB . THR A 1 330 ? 39.748 30.762 17.069 1.00 31.64 ? 365 THR A CB 1 ATOM 2491 O OG1 . THR A 1 330 ? 40.785 30.468 16.124 1.00 35.25 ? 365 THR A OG1 1 ATOM 2492 C CG2 . THR A 1 330 ? 38.854 29.555 17.209 1.00 34.88 ? 365 THR A CG2 1 ATOM 2493 N N . CYS A 1 331 ? 40.177 33.602 17.880 1.00 25.74 ? 366 CYS A N 1 ATOM 2494 C CA . CYS A 1 331 ? 41.020 34.760 18.171 1.00 31.52 ? 366 CYS A CA 1 ATOM 2495 C C . CYS A 1 331 ? 42.337 34.719 17.413 1.00 28.99 ? 366 CYS A C 1 ATOM 2496 O O . CYS A 1 331 ? 42.811 35.750 16.928 1.00 28.48 ? 366 CYS A O 1 ATOM 2497 C CB . CYS A 1 331 ? 41.324 34.830 19.686 1.00 34.20 ? 366 CYS A CB 1 ATOM 2498 S SG . CYS A 1 331 ? 39.879 35.084 20.716 1.00 53.58 ? 366 CYS A SG 1 ATOM 2499 N N . ASP A 1 332 ? 42.912 33.522 17.309 1.00 25.95 ? 367 ASP A N 1 ATOM 2500 C CA . ASP A 1 332 ? 44.215 33.313 16.668 1.00 27.87 ? 367 ASP A CA 1 ATOM 2501 C C . ASP A 1 332 ? 44.225 33.699 15.200 1.00 29.94 ? 367 ASP A C 1 ATOM 2502 O O . ASP A 1 332 ? 45.294 33.820 14.597 1.00 25.85 ? 367 ASP A O 1 ATOM 2503 C CB . ASP A 1 332 ? 44.607 31.842 16.730 1.00 31.28 ? 367 ASP A CB 1 ATOM 2504 C CG . ASP A 1 332 ? 44.956 31.380 18.124 1.00 39.96 ? 367 ASP A CG 1 ATOM 2505 O OD1 . ASP A 1 332 ? 45.072 32.229 19.039 1.00 35.82 ? 367 ASP A OD1 1 ATOM 2506 O OD2 . ASP A 1 332 ? 45.132 30.152 18.285 1.00 41.92 ? 367 ASP A OD2 1 ATOM 2507 N N . ARG A 1 333 ? 43.042 33.833 14.603 1.00 26.00 ? 368 ARG A N 1 ATOM 2508 C CA . ARG A 1 333 ? 42.962 34.177 13.187 1.00 22.46 ? 368 ARG A CA 1 ATOM 2509 C C . ARG A 1 333 ? 42.349 35.549 12.988 1.00 20.57 ? 368 ARG A C 1 ATOM 2510 O O . ARG A 1 333 ? 41.319 35.701 12.336 1.00 21.18 ? 368 ARG A O 1 ATOM 2511 C CB . ARG A 1 333 ? 42.231 33.100 12.383 1.00 19.50 ? 368 ARG A CB 1 ATOM 2512 C CG . ARG A 1 333 ? 43.029 31.787 12.336 1.00 18.29 ? 368 ARG A CG 1 ATOM 2513 C CD . ARG A 1 333 ? 42.423 30.737 11.380 1.00 26.12 ? 368 ARG A CD 1 ATOM 2514 N NE . ARG A 1 333 ? 41.025 30.432 11.680 1.00 22.70 ? 368 ARG A NE 1 ATOM 2515 C CZ . ARG A 1 333 ? 40.619 29.458 12.488 1.00 29.57 ? 368 ARG A CZ 1 ATOM 2516 N NH1 . ARG A 1 333 ? 41.512 28.679 13.104 1.00 25.50 ? 368 ARG A NH1 1 ATOM 2517 N NH2 . ARG A 1 333 ? 39.316 29.261 12.679 1.00 24.48 ? 368 ARG A NH2 1 ATOM 2518 N N . THR A 1 334 ? 43.032 36.547 13.524 1.00 19.53 ? 369 THR A N 1 ATOM 2519 C CA . THR A 1 334 ? 42.598 37.921 13.382 1.00 19.00 ? 369 THR A CA 1 ATOM 2520 C C . THR A 1 334 ? 43.657 38.760 12.669 1.00 21.58 ? 369 THR A C 1 ATOM 2521 O O . THR A 1 334 ? 44.797 38.847 13.136 1.00 25.28 ? 369 THR A O 1 ATOM 2522 C CB . THR A 1 334 ? 42.315 38.532 14.771 1.00 23.46 ? 369 THR A CB 1 ATOM 2523 O OG1 . THR A 1 334 ? 41.365 37.710 15.480 1.00 22.76 ? 369 THR A OG1 1 ATOM 2524 C CG2 . THR A 1 334 ? 41.782 39.961 14.641 1.00 23.85 ? 369 THR A CG2 1 ATOM 2525 N N . GLU A 1 335 ? 43.273 39.390 11.558 1.00 19.00 ? 370 GLU A N 1 ATOM 2526 C CA . GLU A 1 335 ? 44.111 40.405 10.918 1.00 18.22 ? 370 GLU A CA 1 ATOM 2527 C C . GLU A 1 335 ? 43.911 41.753 11.608 1.00 21.99 ? 370 GLU A C 1 ATOM 2528 O O . GLU A 1 335 ? 42.793 42.105 11.961 1.00 22.30 ? 370 GLU A O 1 ATOM 2529 C CB . GLU A 1 335 ? 43.755 40.556 9.433 1.00 17.02 ? 370 GLU A CB 1 ATOM 2530 C CG . GLU A 1 335 ? 44.171 39.405 8.529 1.00 19.70 ? 370 GLU A CG 1 ATOM 2531 C CD . GLU A 1 335 ? 45.514 39.639 7.846 1.00 23.88 ? 370 GLU A CD 1 ATOM 2532 O OE1 . GLU A 1 335 ? 46.219 40.605 8.207 1.00 23.42 ? 370 GLU A OE1 1 ATOM 2533 O OE2 . GLU A 1 335 ? 45.853 38.871 6.923 1.00 22.20 ? 370 GLU A OE2 1 ATOM 2534 N N . PHE A 1 336 ? 44.988 42.517 11.795 1.00 21.72 ? 371 PHE A N 1 ATOM 2535 C CA . PHE A 1 336 ? 44.875 43.831 12.444 1.00 21.44 ? 371 PHE A CA 1 ATOM 2536 C C . PHE A 1 336 ? 45.244 44.949 11.465 1.00 22.39 ? 371 PHE A C 1 ATOM 2537 O O . PHE A 1 336 ? 46.313 44.928 10.888 1.00 25.24 ? 371 PHE A O 1 ATOM 2538 C CB . PHE A 1 336 ? 45.776 43.912 13.701 1.00 22.51 ? 371 PHE A CB 1 ATOM 2539 C CG . PHE A 1 336 ? 45.377 42.953 14.796 1.00 27.37 ? 371 PHE A CG 1 ATOM 2540 C CD1 . PHE A 1 336 ? 44.226 43.167 15.526 1.00 24.92 ? 371 PHE A CD1 1 ATOM 2541 C CD2 . PHE A 1 336 ? 46.139 41.833 15.071 1.00 26.98 ? 371 PHE A CD2 1 ATOM 2542 C CE1 . PHE A 1 336 ? 43.836 42.292 16.516 1.00 32.09 ? 371 PHE A CE1 1 ATOM 2543 C CE2 . PHE A 1 336 ? 45.754 40.941 16.070 1.00 26.50 ? 371 PHE A CE2 1 ATOM 2544 C CZ . PHE A 1 336 ? 44.602 41.177 16.792 1.00 33.78 ? 371 PHE A CZ 1 ATOM 2545 N N . LEU A 1 337 ? 44.366 45.928 11.293 1.00 20.61 ? 372 LEU A N 1 ATOM 2546 C CA . LEU A 1 337 ? 44.642 47.027 10.368 1.00 20.36 ? 372 LEU A CA 1 ATOM 2547 C C . LEU A 1 337 ? 45.861 47.832 10.804 1.00 22.87 ? 372 LEU A C 1 ATOM 2548 O O . LEU A 1 337 ? 46.512 48.467 9.981 1.00 22.32 ? 372 LEU A O 1 ATOM 2549 C CB . LEU A 1 337 ? 43.452 47.966 10.275 1.00 19.83 ? 372 LEU A CB 1 ATOM 2550 C CG . LEU A 1 337 ? 42.187 47.313 9.694 1.00 23.68 ? 372 LEU A CG 1 ATOM 2551 C CD1 . LEU A 1 337 ? 41.101 48.339 9.550 1.00 24.97 ? 372 LEU A CD1 1 ATOM 2552 C CD2 . LEU A 1 337 ? 42.511 46.654 8.379 1.00 21.55 ? 372 LEU A CD2 1 ATOM 2553 N N . SER A 1 338 ? 46.138 47.822 12.107 1.00 22.98 ? 373 SER A N 1 ATOM 2554 C CA . SER A 1 338 ? 47.297 48.519 12.646 1.00 26.63 ? 373 SER A CA 1 ATOM 2555 C C . SER A 1 338 ? 48.610 47.946 12.111 1.00 27.28 ? 373 SER A C 1 ATOM 2556 O O . SER A 1 338 ? 49.652 48.588 12.218 1.00 29.39 ? 373 SER A O 1 ATOM 2557 C CB . SER A 1 338 ? 47.276 48.499 14.181 1.00 21.60 ? 373 SER A CB 1 ATOM 2558 O OG . SER A 1 338 ? 47.202 47.167 14.671 1.00 25.33 ? 373 SER A OG 1 ATOM 2559 N N . ASN A 1 339 ? 48.569 46.741 11.547 1.00 25.18 ? 374 ASN A N 1 ATOM 2560 C CA . ASN A 1 339 ? 49.729 46.216 10.834 1.00 23.39 ? 374 ASN A CA 1 ATOM 2561 C C . ASN A 1 339 ? 49.928 46.854 9.474 1.00 28.11 ? 374 ASN A C 1 ATOM 2562 O O . ASN A 1 339 ? 50.969 46.677 8.872 1.00 23.40 ? 374 ASN A O 1 ATOM 2563 C CB . ASN A 1 339 ? 49.633 44.708 10.643 1.00 23.42 ? 374 ASN A CB 1 ATOM 2564 C CG . ASN A 1 339 ? 49.822 43.947 11.943 1.00 32.19 ? 374 ASN A CG 1 ATOM 2565 O OD1 . ASN A 1 339 ? 50.431 44.459 12.886 1.00 31.68 ? 374 ASN A OD1 1 ATOM 2566 N ND2 . ASN A 1 339 ? 49.292 42.730 12.005 1.00 27.49 ? 374 ASN A ND2 1 ATOM 2567 N N . TYR A 1 340 ? 48.918 47.568 8.977 1.00 23.33 ? 375 TYR A N 1 ATOM 2568 C CA . TYR A 1 340 ? 48.941 48.086 7.604 1.00 21.95 ? 375 TYR A CA 1 ATOM 2569 C C . TYR A 1 340 ? 48.860 49.602 7.592 1.00 25.02 ? 375 TYR A C 1 ATOM 2570 O O . TYR A 1 340 ? 49.362 50.249 6.677 1.00 27.04 ? 375 TYR A O 1 ATOM 2571 C CB . TYR A 1 340 ? 47.743 47.569 6.812 1.00 22.34 ? 375 TYR A CB 1 ATOM 2572 C CG . TYR A 1 340 ? 47.650 46.054 6.668 1.00 21.26 ? 375 TYR A CG 1 ATOM 2573 C CD1 . TYR A 1 340 ? 47.243 45.256 7.732 1.00 18.30 ? 375 TYR A CD1 1 ATOM 2574 C CD2 . TYR A 1 340 ? 47.915 45.447 5.454 1.00 20.97 ? 375 TYR A CD2 1 ATOM 2575 C CE1 . TYR A 1 340 ? 47.148 43.857 7.588 1.00 20.57 ? 375 TYR A CE1 1 ATOM 2576 C CE2 . TYR A 1 340 ? 47.823 44.078 5.294 1.00 18.91 ? 375 TYR A CE2 1 ATOM 2577 C CZ . TYR A 1 340 ? 47.441 43.292 6.356 1.00 19.65 ? 375 TYR A CZ 1 ATOM 2578 O OH . TYR A 1 340 ? 47.358 41.932 6.151 1.00 22.91 ? 375 TYR A OH 1 ATOM 2579 N N . LEU A 1 341 ? 48.193 50.162 8.597 1.00 23.78 ? 376 LEU A N 1 ATOM 2580 C CA . LEU A 1 341 ? 47.887 51.584 8.599 1.00 28.01 ? 376 LEU A CA 1 ATOM 2581 C C . LEU A 1 341 ? 48.530 52.210 9.811 1.00 28.42 ? 376 LEU A C 1 ATOM 2582 O O . LEU A 1 341 ? 48.645 51.578 10.854 1.00 22.91 ? 376 LEU A O 1 ATOM 2583 C CB . LEU A 1 341 ? 46.375 51.827 8.657 1.00 23.02 ? 376 LEU A CB 1 ATOM 2584 C CG . LEU A 1 341 ? 45.544 51.098 7.609 1.00 20.55 ? 376 LEU A CG 1 ATOM 2585 C CD1 . LEU A 1 341 ? 44.045 51.257 7.951 1.00 25.87 ? 376 LEU A CD1 1 ATOM 2586 C CD2 . LEU A 1 341 ? 45.877 51.614 6.216 1.00 21.72 ? 376 LEU A CD2 1 ATOM 2587 N N . THR A 1 342 ? 48.931 53.467 9.673 1.00 29.71 ? 377 THR A N 1 ATOM 2588 C CA . THR A 1 342 ? 49.695 54.126 10.714 1.00 29.58 ? 377 THR A CA 1 ATOM 2589 C C . THR A 1 342 ? 48.842 54.605 11.876 1.00 36.15 ? 377 THR A C 1 ATOM 2590 O O . THR A 1 342 ? 49.236 54.481 13.037 1.00 46.21 ? 377 THR A O 1 ATOM 2591 C CB . THR A 1 342 ? 50.482 55.312 10.107 1.00 38.97 ? 377 THR A CB 1 ATOM 2592 O OG1 . THR A 1 342 ? 51.501 54.794 9.245 1.00 40.10 ? 377 THR A OG1 1 ATOM 2593 C CG2 . THR A 1 342 ? 51.133 56.155 11.193 1.00 42.01 ? 377 THR A CG2 1 ATOM 2594 N N . ASN A 1 343 ? 47.667 55.136 11.569 1.00 34.81 ? 378 ASN A N 1 ATOM 2595 C CA . ASN A 1 343 ? 46.839 55.772 12.588 1.00 35.63 ? 378 ASN A CA 1 ATOM 2596 C C . ASN A 1 343 ? 45.410 55.233 12.648 1.00 33.59 ? 378 ASN A C 1 ATOM 2597 O O . ASN A 1 343 ? 44.464 55.929 12.289 1.00 33.54 ? 378 ASN A O 1 ATOM 2598 C CB . ASN A 1 343 ? 46.795 57.282 12.347 1.00 38.16 ? 378 ASN A CB 1 ATOM 2599 C CG . ASN A 1 343 ? 47.949 58.012 13.008 1.00 49.04 ? 378 ASN A CG 1 ATOM 2600 O OD1 . ASN A 1 343 ? 48.243 57.794 14.186 1.00 57.12 ? 378 ASN A OD1 1 ATOM 2601 N ND2 . ASN A 1 343 ? 48.613 58.878 12.252 1.00 46.34 ? 378 ASN A ND2 1 ATOM 2602 N N . VAL A 1 344 ? 45.250 54.006 13.120 1.00 30.37 ? 379 VAL A N 1 ATOM 2603 C CA . VAL A 1 344 ? 43.929 53.378 13.124 1.00 28.48 ? 379 VAL A CA 1 ATOM 2604 C C . VAL A 1 344 ? 42.959 53.991 14.133 1.00 33.10 ? 379 VAL A C 1 ATOM 2605 O O . VAL A 1 344 ? 41.741 53.802 14.038 1.00 28.11 ? 379 VAL A O 1 ATOM 2606 C CB . VAL A 1 344 ? 44.027 51.871 13.348 1.00 28.49 ? 379 VAL A CB 1 ATOM 2607 C CG1 . VAL A 1 344 ? 44.830 51.250 12.221 1.00 27.32 ? 379 VAL A CG1 1 ATOM 2608 C CG2 . VAL A 1 344 ? 44.657 51.582 14.707 1.00 30.02 ? 379 VAL A CG2 1 ATOM 2609 N N . ASP A 1 345 ? 43.483 54.746 15.087 1.00 34.19 ? 380 ASP A N 1 ATOM 2610 C CA . ASP A 1 345 ? 42.613 55.435 16.029 1.00 34.54 ? 380 ASP A CA 1 ATOM 2611 C C . ASP A 1 345 ? 41.749 56.519 15.369 1.00 28.12 ? 380 ASP A C 1 ATOM 2612 O O . ASP A 1 345 ? 40.788 56.998 15.978 1.00 34.16 ? 380 ASP A O 1 ATOM 2613 C CB . ASP A 1 345 ? 43.415 56.018 17.200 1.00 37.64 ? 380 ASP A CB 1 ATOM 2614 C CG . ASP A 1 345 ? 43.839 54.954 18.207 1.00 47.06 ? 380 ASP A CG 1 ATOM 2615 O OD1 . ASP A 1 345 ? 43.412 53.782 18.074 1.00 40.63 ? 380 ASP A OD1 1 ATOM 2616 O OD2 . ASP A 1 345 ? 44.598 55.294 19.141 1.00 49.49 ? 380 ASP A OD2 1 ATOM 2617 N N . ASP A 1 346 ? 42.089 56.891 14.137 1.00 31.76 ? 381 ASP A N 1 ATOM 2618 C CA . ASP A 1 346 ? 41.321 57.878 13.377 1.00 30.71 ? 381 ASP A CA 1 ATOM 2619 C C . ASP A 1 346 ? 40.220 57.281 12.469 1.00 26.28 ? 381 ASP A C 1 ATOM 2620 O O . ASP A 1 346 ? 39.478 58.016 11.809 1.00 23.86 ? 381 ASP A O 1 ATOM 2621 C CB . ASP A 1 346 ? 42.256 58.751 12.539 1.00 34.21 ? 381 ASP A CB 1 ATOM 2622 C CG . ASP A 1 346 ? 43.177 59.609 13.392 1.00 32.75 ? 381 ASP A CG 1 ATOM 2623 O OD1 . ASP A 1 346 ? 42.769 60.014 14.499 1.00 33.90 ? 381 ASP A OD1 1 ATOM 2624 O OD2 . ASP A 1 346 ? 44.308 59.880 12.946 1.00 43.36 ? 381 ASP A OD2 1 ATOM 2625 N N . ILE A 1 347 ? 40.113 55.961 12.423 1.00 25.12 ? 382 ILE A N 1 ATOM 2626 C CA . ILE A 1 347 ? 39.013 55.349 11.673 1.00 27.14 ? 382 ILE A CA 1 ATOM 2627 C C . ILE A 1 347 ? 38.119 54.526 12.576 1.00 22.98 ? 382 ILE A C 1 ATOM 2628 O O . ILE A 1 347 ? 38.547 54.030 13.625 1.00 26.03 ? 382 ILE A O 1 ATOM 2629 C CB . ILE A 1 347 ? 39.482 54.439 10.523 1.00 21.47 ? 382 ILE A CB 1 ATOM 2630 C CG1 . ILE A 1 347 ? 40.354 53.306 11.060 1.00 25.44 ? 382 ILE A CG1 1 ATOM 2631 C CG2 . ILE A 1 347 ? 40.196 55.254 9.456 1.00 31.37 ? 382 ILE A CG2 1 ATOM 2632 C CD1 . ILE A 1 347 ? 40.634 52.183 10.055 1.00 25.31 ? 382 ILE A CD1 1 ATOM 2633 N N . THR A 1 348 ? 36.865 54.422 12.165 1.00 21.22 ? 383 THR A N 1 ATOM 2634 C CA . THR A 1 348 ? 35.921 53.509 12.781 1.00 21.87 ? 383 THR A CA 1 ATOM 2635 C C . THR A 1 348 ? 35.804 52.309 11.858 1.00 20.99 ? 383 THR A C 1 ATOM 2636 O O . THR A 1 348 ? 35.680 52.470 10.640 1.00 23.22 ? 383 THR A O 1 ATOM 2637 C CB . THR A 1 348 ? 34.565 54.187 12.965 1.00 27.83 ? 383 THR A CB 1 ATOM 2638 O OG1 . THR A 1 348 ? 34.656 55.087 14.080 1.00 24.82 ? 383 THR A OG1 1 ATOM 2639 C CG2 . THR A 1 348 ? 33.480 53.146 13.246 1.00 25.62 ? 383 THR A CG2 1 ATOM 2640 N N . LEU A 1 349 ? 35.906 51.112 12.422 1.00 19.57 ? 384 LEU A N 1 ATOM 2641 C CA . LEU A 1 349 ? 35.827 49.899 11.618 1.00 16.39 ? 384 LEU A CA 1 ATOM 2642 C C . LEU A 1 349 ? 34.668 49.063 12.113 1.00 18.09 ? 384 LEU A C 1 ATOM 2643 O O . LEU A 1 349 ? 34.597 48.729 13.287 1.00 21.90 ? 384 LEU A O 1 ATOM 2644 C CB . LEU A 1 349 ? 37.112 49.063 11.717 1.00 19.41 ? 384 LEU A CB 1 ATOM 2645 C CG . LEU A 1 349 ? 37.002 47.637 11.163 1.00 18.85 ? 384 LEU A CG 1 ATOM 2646 C CD1 . LEU A 1 349 ? 36.964 47.605 9.623 1.00 16.51 ? 384 LEU A CD1 1 ATOM 2647 C CD2 . LEU A 1 349 ? 38.132 46.777 11.688 1.00 19.71 ? 384 LEU A CD2 1 ATOM 2648 N N . VAL A 1 350 ? 33.749 48.758 11.212 1.00 18.50 ? 385 VAL A N 1 ATOM 2649 C CA . VAL A 1 350 ? 32.771 47.719 11.471 1.00 20.10 ? 385 VAL A CA 1 ATOM 2650 C C . VAL A 1 350 ? 33.549 46.418 11.255 1.00 14.23 ? 385 VAL A C 1 ATOM 2651 O O . VAL A 1 350 ? 33.963 46.147 10.150 1.00 17.38 ? 385 VAL A O 1 ATOM 2652 C CB . VAL A 1 350 ? 31.607 47.822 10.472 1.00 19.22 ? 385 VAL A CB 1 ATOM 2653 C CG1 . VAL A 1 350 ? 30.548 46.914 10.865 1.00 21.54 ? 385 VAL A CG1 1 ATOM 2654 C CG2 . VAL A 1 350 ? 31.016 49.203 10.471 1.00 23.27 ? 385 VAL A CG2 1 ATOM 2655 N N . PRO A 1 351 ? 33.798 45.645 12.324 1.00 18.94 ? 386 PRO A N 1 ATOM 2656 C CA . PRO A 1 351 ? 34.822 44.601 12.243 1.00 16.22 ? 386 PRO A CA 1 ATOM 2657 C C . PRO A 1 351 ? 34.299 43.168 12.151 1.00 19.19 ? 386 PRO A C 1 ATOM 2658 O O . PRO A 1 351 ? 33.097 42.920 12.114 1.00 20.13 ? 386 PRO A O 1 ATOM 2659 C CB . PRO A 1 351 ? 35.529 44.753 13.603 1.00 16.59 ? 386 PRO A CB 1 ATOM 2660 C CG . PRO A 1 351 ? 34.353 44.992 14.530 1.00 22.05 ? 386 PRO A CG 1 ATOM 2661 C CD . PRO A 1 351 ? 33.375 45.866 13.720 1.00 20.11 ? 386 PRO A CD 1 ATOM 2662 N N . GLY A 1 352 ? 35.238 42.235 12.115 1.00 18.26 ? 387 GLY A N 1 ATOM 2663 C CA . GLY A 1 352 ? 34.940 40.818 12.270 1.00 19.54 ? 387 GLY A CA 1 ATOM 2664 C C . GLY A 1 352 ? 35.042 40.052 10.966 1.00 17.61 ? 387 GLY A C 1 ATOM 2665 O O . GLY A 1 352 ? 36.092 40.004 10.342 1.00 15.77 ? 387 GLY A O 1 ATOM 2666 N N . THR A 1 353 ? 33.927 39.457 10.549 1.00 15.84 ? 388 THR A N 1 ATOM 2667 C CA . THR A 1 353 ? 33.904 38.633 9.353 1.00 19.45 ? 388 THR A CA 1 ATOM 2668 C C . THR A 1 353 ? 33.660 39.453 8.080 1.00 16.93 ? 388 THR A C 1 ATOM 2669 O O . THR A 1 353 ? 33.550 38.891 6.995 1.00 16.81 ? 388 THR A O 1 ATOM 2670 C CB . THR A 1 353 ? 32.815 37.565 9.478 1.00 18.22 ? 388 THR A CB 1 ATOM 2671 O OG1 . THR A 1 353 ? 31.576 38.219 9.785 1.00 17.73 ? 388 THR A OG1 1 ATOM 2672 C CG2 . THR A 1 353 ? 33.186 36.567 10.604 1.00 17.12 ? 388 THR A CG2 1 ATOM 2673 N N . LEU A 1 354 ? 33.554 40.773 8.245 1.00 15.74 ? 389 LEU A N 1 ATOM 2674 C CA . LEU A 1 354 ? 33.531 41.733 7.150 1.00 16.24 ? 389 LEU A CA 1 ATOM 2675 C C . LEU A 1 354 ? 34.156 43.015 7.695 1.00 17.15 ? 389 LEU A C 1 ATOM 2676 O O . LEU A 1 354 ? 34.322 43.169 8.911 1.00 18.29 ? 389 LEU A O 1 ATOM 2677 C CB . LEU A 1 354 ? 32.090 42.026 6.656 1.00 17.80 ? 389 LEU A CB 1 ATOM 2678 C CG . LEU A 1 354 ? 31.090 42.596 7.662 1.00 24.24 ? 389 LEU A CG 1 ATOM 2679 C CD1 . LEU A 1 354 ? 29.931 43.248 6.947 1.00 25.67 ? 389 LEU A CD1 1 ATOM 2680 C CD2 . LEU A 1 354 ? 30.573 41.488 8.561 1.00 26.31 ? 389 LEU A CD2 1 ATOM 2681 N N . GLY A 1 355 ? 34.515 43.930 6.805 1.00 16.63 ? 390 GLY A N 1 ATOM 2682 C CA . GLY A 1 355 ? 35.028 45.214 7.258 1.00 16.25 ? 390 GLY A CA 1 ATOM 2683 C C . GLY A 1 355 ? 34.325 46.352 6.553 1.00 14.42 ? 390 GLY A C 1 ATOM 2684 O O . GLY A 1 355 ? 34.140 46.302 5.329 1.00 17.47 ? 390 GLY A O 1 ATOM 2685 N N . ARG A 1 356 ? 33.900 47.359 7.312 1.00 16.20 ? 391 ARG A N 1 ATOM 2686 C CA . ARG A 1 356 ? 33.395 48.594 6.712 1.00 15.21 ? 391 ARG A CA 1 ATOM 2687 C C . ARG A 1 356 ? 34.138 49.709 7.433 1.00 15.24 ? 391 ARG A C 1 ATOM 2688 O O . ARG A 1 356 ? 34.198 49.714 8.647 1.00 17.93 ? 391 ARG A O 1 ATOM 2689 C CB . ARG A 1 356 ? 31.862 48.728 6.891 1.00 17.12 ? 391 ARG A CB 1 ATOM 2690 C CG . ARG A 1 356 ? 31.084 47.493 6.396 1.00 17.08 ? 391 ARG A CG 1 ATOM 2691 C CD . ARG A 1 356 ? 29.710 47.861 5.821 1.00 22.24 ? 391 ARG A CD 1 ATOM 2692 N NE . ARG A 1 356 ? 28.878 48.539 6.812 1.00 20.30 ? 391 ARG A NE 1 ATOM 2693 C CZ . ARG A 1 356 ? 28.150 47.918 7.735 1.00 21.21 ? 391 ARG A CZ 1 ATOM 2694 N NH1 . ARG A 1 356 ? 28.141 46.590 7.801 1.00 21.09 ? 391 ARG A NH1 1 ATOM 2695 N NH2 . ARG A 1 356 ? 27.433 48.632 8.596 1.00 21.17 ? 391 ARG A NH2 1 ATOM 2696 N N . ILE A 1 357 ? 34.745 50.618 6.677 1.00 18.48 ? 392 ILE A N 1 ATOM 2697 C CA . ILE A 1 357 ? 35.600 51.639 7.271 1.00 17.87 ? 392 ILE A CA 1 ATOM 2698 C C . ILE A 1 357 ? 35.070 53.030 6.933 1.00 17.62 ? 392 ILE A C 1 ATOM 2699 O O . ILE A 1 357 ? 34.690 53.290 5.791 1.00 18.71 ? 392 ILE A O 1 ATOM 2700 C CB . ILE A 1 357 ? 37.038 51.531 6.717 1.00 19.38 ? 392 ILE A CB 1 ATOM 2701 C CG1 . ILE A 1 357 ? 37.699 50.229 7.184 1.00 19.26 ? 392 ILE A CG1 1 ATOM 2702 C CG2 . ILE A 1 357 ? 37.890 52.758 7.144 1.00 19.47 ? 392 ILE A CG2 1 ATOM 2703 C CD1 . ILE A 1 357 ? 38.995 49.889 6.431 1.00 21.65 ? 392 ILE A CD1 1 ATOM 2704 N N . ARG A 1 358 ? 35.068 53.910 7.927 1.00 17.14 ? 393 ARG A N 1 ATOM 2705 C CA . ARG A 1 358 ? 34.775 55.320 7.705 1.00 19.33 ? 393 ARG A CA 1 ATOM 2706 C C . ARG A 1 358 ? 35.638 56.081 8.704 1.00 19.54 ? 393 ARG A C 1 ATOM 2707 O O . ARG A 1 358 ? 36.204 55.478 9.609 1.00 22.35 ? 393 ARG A O 1 ATOM 2708 C CB . ARG A 1 358 ? 33.278 55.602 7.914 1.00 18.98 ? 393 ARG A CB 1 ATOM 2709 C CG . ARG A 1 358 ? 32.754 55.216 9.299 1.00 21.86 ? 393 ARG A CG 1 ATOM 2710 C CD . ARG A 1 358 ? 31.222 55.377 9.391 1.00 19.90 ? 393 ARG A CD 1 ATOM 2711 N NE . ARG A 1 358 ? 30.759 55.334 10.772 1.00 24.12 ? 393 ARG A NE 1 ATOM 2712 C CZ . ARG A 1 358 ? 30.340 54.247 11.399 1.00 25.71 ? 393 ARG A CZ 1 ATOM 2713 N NH1 . ARG A 1 358 ? 30.290 53.060 10.780 1.00 22.01 ? 393 ARG A NH1 1 ATOM 2714 N NH2 . ARG A 1 358 ? 29.954 54.364 12.658 1.00 32.39 ? 393 ARG A NH2 1 ATOM 2715 N N . PRO A 1 359 ? 35.770 57.405 8.534 1.00 24.47 ? 394 PRO A N 1 ATOM 2716 C CA . PRO A 1 359 ? 36.509 58.152 9.559 1.00 25.92 ? 394 PRO A CA 1 ATOM 2717 C C . PRO A 1 359 ? 35.767 58.195 10.883 1.00 24.39 ? 394 PRO A C 1 ATOM 2718 O O . PRO A 1 359 ? 34.535 58.272 10.901 1.00 26.15 ? 394 PRO A O 1 ATOM 2719 C CB . PRO A 1 359 ? 36.602 59.560 8.963 1.00 26.37 ? 394 PRO A CB 1 ATOM 2720 C CG . PRO A 1 359 ? 35.372 59.669 8.116 1.00 27.37 ? 394 PRO A CG 1 ATOM 2721 C CD . PRO A 1 359 ? 35.232 58.287 7.486 1.00 22.21 ? 394 PRO A CD 1 ATOM 2722 N N . LYS A 1 360 ? 36.517 58.152 11.978 1.00 23.61 ? 395 LYS A N 1 ATOM 2723 C CA . LYS A 1 360 ? 35.937 58.190 13.311 1.00 26.17 ? 395 LYS A CA 1 ATOM 2724 C C . LYS A 1 360 ? 35.085 59.429 13.520 1.00 29.27 ? 395 LYS A C 1 ATOM 2725 O O . LYS A 1 360 ? 34.024 59.371 14.145 1.00 26.37 ? 395 LYS A O 1 ATOM 2726 C CB . LYS A 1 360 ? 37.039 58.140 14.366 1.00 26.13 ? 395 LYS A CB 1 ATOM 2727 C CG . LYS A 1 360 ? 36.536 58.265 15.798 1.00 30.67 ? 395 LYS A CG 1 ATOM 2728 C CD . LYS A 1 360 ? 37.693 58.178 16.782 1.00 33.00 ? 395 LYS A CD 1 ATOM 2729 C CE . LYS A 1 360 ? 37.273 58.602 18.180 1.00 38.41 ? 395 LYS A CE 1 ATOM 2730 N NZ . LYS A 1 360 ? 38.348 58.314 19.183 1.00 36.27 ? 395 LYS A NZ 1 ATOM 2731 N N . ILE A 1 361 ? 35.575 60.558 13.023 1.00 27.44 ? 396 ILE A N 1 ATOM 2732 C CA . ILE A 1 361 ? 34.799 61.785 13.041 1.00 31.41 ? 396 ILE A CA 1 ATOM 2733 C C . ILE A 1 361 ? 34.105 61.856 11.695 1.00 31.47 ? 396 ILE A C 1 ATOM 2734 O O . ILE A 1 361 ? 34.769 61.828 10.657 1.00 32.33 ? 396 ILE A O 1 ATOM 2735 C CB . ILE A 1 361 ? 35.709 63.023 13.217 1.00 32.00 ? 396 ILE A CB 1 ATOM 2736 C CG1 . ILE A 1 361 ? 36.378 62.989 14.588 1.00 32.74 ? 396 ILE A CG1 1 ATOM 2737 C CG2 . ILE A 1 361 ? 34.893 64.314 13.016 1.00 33.09 ? 396 ILE A CG2 1 ATOM 2738 C CD1 . ILE A 1 361 ? 37.442 64.072 14.782 1.00 37.10 ? 396 ILE A CD1 1 ATOM 2739 N N . PRO A 1 362 ? 32.764 61.879 11.695 1.00 28.73 ? 397 PRO A N 1 ATOM 2740 C CA . PRO A 1 362 ? 32.066 61.816 10.415 1.00 30.47 ? 397 PRO A CA 1 ATOM 2741 C C . PRO A 1 362 ? 32.514 62.966 9.531 1.00 39.23 ? 397 PRO A C 1 ATOM 2742 O O . PRO A 1 362 ? 32.733 64.065 10.041 1.00 38.54 ? 397 PRO A O 1 ATOM 2743 C CB . PRO A 1 362 ? 30.596 61.981 10.813 1.00 35.73 ? 397 PRO A CB 1 ATOM 2744 C CG . PRO A 1 362 ? 30.526 61.456 12.200 1.00 36.37 ? 397 PRO A CG 1 ATOM 2745 C CD . PRO A 1 362 ? 31.833 61.857 12.838 1.00 37.33 ? 397 PRO A CD 1 ATOM 2746 N N . ASN A 1 363 ? 32.701 62.690 8.244 1.00 32.90 ? 398 ASN A N 1 ATOM 2747 C CA . ASN A 1 363 ? 33.115 63.705 7.280 1.00 45.11 ? 398 ASN A CA 1 ATOM 2748 C C . ASN A 1 363 ? 34.471 64.357 7.570 1.00 41.50 ? 398 ASN A C 1 ATOM 2749 O O . ASN A 1 363 ? 34.736 65.457 7.085 1.00 40.79 ? 398 ASN A O 1 ATOM 2750 C CB . ASN A 1 363 ? 32.040 64.790 7.158 1.00 46.94 ? 398 ASN A CB 1 ATOM 2751 C CG . ASN A 1 363 ? 30.679 64.224 6.802 1.00 52.42 ? 398 ASN A CG 1 ATOM 2752 O OD1 . ASN A 1 363 ? 30.560 63.367 5.923 1.00 47.87 ? 398 ASN A OD1 1 ATOM 2753 N ND2 . ASN A 1 363 ? 29.641 64.701 7.487 1.00 55.37 ? 398 ASN A ND2 1 ATOM 2754 N N . ASN A 1 364 ? 35.310 63.690 8.361 1.00 41.07 ? 399 ASN A N 1 ATOM 2755 C CA . ASN A 1 364 ? 36.653 64.190 8.658 1.00 34.10 ? 399 ASN A CA 1 ATOM 2756 C C . ASN A 1 364 ? 37.375 64.469 7.356 1.00 35.60 ? 399 ASN A C 1 ATOM 2757 O O . ASN A 1 364 ? 37.554 63.569 6.528 1.00 37.44 ? 399 ASN A O 1 ATOM 2758 C CB . ASN A 1 364 ? 37.451 63.178 9.474 1.00 33.91 ? 399 ASN A CB 1 ATOM 2759 C CG . ASN A 1 364 ? 38.800 63.721 9.946 1.00 40.58 ? 399 ASN A CG 1 ATOM 2760 O OD1 . ASN A 1 364 ? 39.414 64.574 9.301 1.00 38.89 ? 399 ASN A OD1 1 ATOM 2761 N ND2 . ASN A 1 364 ? 39.269 63.212 11.078 1.00 40.31 ? 399 ASN A ND2 1 ATOM 2762 N N . LEU A 1 365 ? 37.795 65.719 7.182 1.00 37.64 ? 400 LEU A N 1 ATOM 2763 C CA . LEU A 1 365 ? 38.371 66.152 5.905 1.00 45.22 ? 400 LEU A CA 1 ATOM 2764 C C . LEU A 1 365 ? 39.726 65.511 5.592 1.00 37.38 ? 400 LEU A C 1 ATOM 2765 O O . LEU A 1 365 ? 40.100 65.411 4.426 1.00 39.79 ? 400 LEU A O 1 ATOM 2766 C CB . LEU A 1 365 ? 38.477 67.682 5.835 1.00 46.46 ? 400 LEU A CB 1 ATOM 2767 C CG . LEU A 1 365 ? 37.193 68.488 5.601 1.00 44.78 ? 400 LEU A CG 1 ATOM 2768 C CD1 . LEU A 1 365 ? 36.279 67.783 4.606 1.00 46.94 ? 400 LEU A CD1 1 ATOM 2769 C CD2 . LEU A 1 365 ? 36.472 68.776 6.901 1.00 52.62 ? 400 LEU A CD2 1 ATOM 2770 N N . LYS A 1 366 ? 40.447 65.084 6.628 1.00 35.91 ? 401 LYS A N 1 ATOM 2771 C CA . LYS A 1 366 ? 41.774 64.479 6.457 1.00 37.77 ? 401 LYS A CA 1 ATOM 2772 C C . LYS A 1 366 ? 41.716 62.992 6.080 1.00 34.94 ? 401 LYS A C 1 ATOM 2773 O O . LYS A 1 366 ? 42.745 62.367 5.814 1.00 31.96 ? 401 LYS A O 1 ATOM 2774 C CB . LYS A 1 366 ? 42.604 64.634 7.730 1.00 41.53 ? 401 LYS A CB 1 ATOM 2775 C CG . LYS A 1 366 ? 42.913 66.072 8.109 1.00 40.68 ? 401 LYS A CG 1 ATOM 2776 C CD . LYS A 1 366 ? 44.226 66.158 8.867 1.00 43.25 ? 401 LYS A CD 1 ATOM 2777 C CE . LYS A 1 366 ? 44.307 65.121 9.972 1.00 49.74 ? 401 LYS A CE 1 ATOM 2778 N NZ . LYS A 1 366 ? 45.646 65.133 10.622 1.00 55.16 ? 401 LYS A NZ 1 ATOM 2779 N N . TYR A 1 367 ? 40.511 62.438 6.085 1.00 33.01 ? 402 TYR A N 1 ATOM 2780 C CA . TYR A 1 367 ? 40.301 61.044 5.724 1.00 31.49 ? 402 TYR A CA 1 ATOM 2781 C C . TYR A 1 367 ? 40.792 60.809 4.296 1.00 31.30 ? 402 TYR A C 1 ATOM 2782 O O . TYR A 1 367 ? 40.347 61.470 3.366 1.00 30.21 ? 402 TYR A O 1 ATOM 2783 C CB . TYR A 1 367 ? 38.812 60.712 5.861 1.00 27.11 ? 402 TYR A CB 1 ATOM 2784 C CG . TYR A 1 367 ? 38.452 59.294 5.509 1.00 28.63 ? 402 TYR A CG 1 ATOM 2785 C CD1 . TYR A 1 367 ? 39.007 58.230 6.207 1.00 30.91 ? 402 TYR A CD1 1 ATOM 2786 C CD2 . TYR A 1 367 ? 37.535 59.018 4.495 1.00 30.72 ? 402 TYR A CD2 1 ATOM 2787 C CE1 . TYR A 1 367 ? 38.674 56.927 5.903 1.00 26.15 ? 402 TYR A CE1 1 ATOM 2788 C CE2 . TYR A 1 367 ? 37.190 57.715 4.181 1.00 30.23 ? 402 TYR A CE2 1 ATOM 2789 C CZ . TYR A 1 367 ? 37.763 56.674 4.897 1.00 27.96 ? 402 TYR A CZ 1 ATOM 2790 O OH . TYR A 1 367 ? 37.441 55.374 4.593 1.00 32.51 ? 402 TYR A OH 1 ATOM 2791 N N . ASP A 1 368 ? 41.709 59.857 4.134 1.00 32.66 ? 403 ASP A N 1 ATOM 2792 C CA . ASP A 1 368 ? 42.389 59.615 2.864 1.00 23.78 ? 403 ASP A CA 1 ATOM 2793 C C . ASP A 1 368 ? 42.166 58.180 2.347 1.00 26.59 ? 403 ASP A C 1 ATOM 2794 O O . ASP A 1 368 ? 43.078 57.353 2.412 1.00 27.00 ? 403 ASP A O 1 ATOM 2795 C CB . ASP A 1 368 ? 43.889 59.874 3.048 1.00 24.09 ? 403 ASP A CB 1 ATOM 2796 C CG . ASP A 1 368 ? 44.654 59.952 1.725 1.00 26.50 ? 403 ASP A CG 1 ATOM 2797 O OD1 . ASP A 1 368 ? 44.125 59.526 0.680 1.00 27.20 ? 403 ASP A OD1 1 ATOM 2798 O OD2 . ASP A 1 368 ? 45.810 60.434 1.744 1.00 29.42 ? 403 ASP A OD2 1 ATOM 2799 N N . PRO A 1 369 ? 40.972 57.898 1.797 1.00 29.48 ? 404 PRO A N 1 ATOM 2800 C CA . PRO A 1 369 ? 40.590 56.545 1.367 1.00 30.41 ? 404 PRO A CA 1 ATOM 2801 C C . PRO A 1 369 ? 41.526 55.905 0.336 1.00 29.55 ? 404 PRO A C 1 ATOM 2802 O O . PRO A 1 369 ? 41.816 54.709 0.462 1.00 25.38 ? 404 PRO A O 1 ATOM 2803 C CB . PRO A 1 369 ? 39.179 56.743 0.772 1.00 34.65 ? 404 PRO A CB 1 ATOM 2804 C CG . PRO A 1 369 ? 39.082 58.195 0.473 1.00 30.49 ? 404 PRO A CG 1 ATOM 2805 C CD . PRO A 1 369 ? 39.887 58.866 1.551 1.00 31.90 ? 404 PRO A CD 1 ATOM 2806 N N . LYS A 1 370 ? 42.006 56.655 -0.652 1.00 23.95 ? 405 LYS A N 1 ATOM 2807 C CA . LYS A 1 370 ? 42.926 56.061 -1.619 1.00 25.44 ? 405 LYS A CA 1 ATOM 2808 C C . LYS A 1 370 ? 44.229 55.595 -0.965 1.00 24.01 ? 405 LYS A C 1 ATOM 2809 O O . LYS A 1 370 ? 44.762 54.553 -1.321 1.00 23.37 ? 405 LYS A O 1 ATOM 2810 C CB . LYS A 1 370 ? 43.190 56.993 -2.812 1.00 25.95 ? 405 LYS A CB 1 ATOM 2811 C CG . LYS A 1 370 ? 42.000 57.112 -3.749 1.00 30.10 ? 405 LYS A CG 1 ATOM 2812 C CD . LYS A 1 370 ? 42.348 57.900 -5.024 1.00 36.65 ? 405 LYS A CD 1 ATOM 2813 C CE . LYS A 1 370 ? 41.116 58.083 -5.922 1.00 44.13 ? 405 LYS A CE 1 ATOM 2814 N NZ . LYS A 1 370 ? 41.433 58.693 -7.255 1.00 41.30 ? 405 LYS A NZ 1 ATOM 2815 N N . ALA A 1 371 ? 44.735 56.352 0.001 1.00 25.42 ? 406 ALA A N 1 ATOM 2816 C CA . ALA A 1 371 ? 45.983 55.964 0.649 1.00 26.68 ? 406 ALA A CA 1 ATOM 2817 C C . ALA A 1 371 ? 45.743 54.766 1.563 1.00 22.02 ? 406 ALA A C 1 ATOM 2818 O O . ALA A 1 371 ? 46.562 53.852 1.630 1.00 22.17 ? 406 ALA A O 1 ATOM 2819 C CB . ALA A 1 371 ? 46.581 57.131 1.433 1.00 23.15 ? 406 ALA A CB 1 ATOM 2820 N N . ILE A 1 372 ? 44.608 54.776 2.254 1.00 24.99 ? 407 ILE A N 1 ATOM 2821 C CA . ILE A 1 372 ? 44.213 53.618 3.042 1.00 22.74 ? 407 ILE A CA 1 ATOM 2822 C C . ILE A 1 372 ? 44.122 52.375 2.166 1.00 19.66 ? 407 ILE A C 1 ATOM 2823 O O . ILE A 1 372 ? 44.758 51.368 2.476 1.00 21.00 ? 407 ILE A O 1 ATOM 2824 C CB . ILE A 1 372 ? 42.893 53.839 3.801 1.00 23.60 ? 407 ILE A CB 1 ATOM 2825 C CG1 . ILE A 1 372 ? 43.117 54.870 4.909 1.00 22.68 ? 407 ILE A CG1 1 ATOM 2826 C CG2 . ILE A 1 372 ? 42.388 52.495 4.373 1.00 19.17 ? 407 ILE A CG2 1 ATOM 2827 C CD1 . ILE A 1 372 ? 41.824 55.360 5.594 1.00 27.88 ? 407 ILE A CD1 1 ATOM 2828 N N . ILE A 1 373 ? 43.365 52.437 1.068 1.00 18.69 ? 408 ILE A N 1 ATOM 2829 C CA . ILE A 1 373 ? 43.223 51.265 0.217 1.00 23.23 ? 408 ILE A CA 1 ATOM 2830 C C . ILE A 1 373 ? 44.576 50.830 -0.300 1.00 27.45 ? 408 ILE A C 1 ATOM 2831 O O . ILE A 1 373 ? 44.861 49.635 -0.375 1.00 21.93 ? 408 ILE A O 1 ATOM 2832 C CB . ILE A 1 373 ? 42.309 51.521 -0.987 1.00 27.17 ? 408 ILE A CB 1 ATOM 2833 C CG1 . ILE A 1 373 ? 40.888 51.805 -0.523 1.00 27.44 ? 408 ILE A CG1 1 ATOM 2834 C CG2 . ILE A 1 373 ? 42.286 50.314 -1.903 1.00 31.78 ? 408 ILE A CG2 1 ATOM 2835 C CD1 . ILE A 1 373 ? 40.048 52.452 -1.628 1.00 35.62 ? 408 ILE A CD1 1 ATOM 2836 N N . ALA A 1 374 ? 45.417 51.802 -0.653 1.00 20.94 ? 409 ALA A N 1 ATOM 2837 C CA . ALA A 1 374 ? 46.754 51.459 -1.139 1.00 25.30 ? 409 ALA A CA 1 ATOM 2838 C C . ALA A 1 374 ? 47.516 50.636 -0.097 1.00 17.82 ? 409 ALA A C 1 ATOM 2839 O O . ALA A 1 374 ? 48.100 49.614 -0.422 1.00 21.41 ? 409 ALA A O 1 ATOM 2840 C CB . ALA A 1 374 ? 47.538 52.718 -1.538 1.00 25.92 ? 409 ALA A CB 1 ATOM 2841 N N . ASN A 1 375 ? 47.501 51.069 1.155 1.00 22.43 ? 410 ASN A N 1 ATOM 2842 C CA . ASN A 1 375 ? 48.173 50.312 2.209 1.00 22.36 ? 410 ASN A CA 1 ATOM 2843 C C . ASN A 1 375 ? 47.546 48.947 2.540 1.00 24.36 ? 410 ASN A C 1 ATOM 2844 O O . ASN A 1 375 ? 48.163 48.139 3.229 1.00 23.60 ? 410 ASN A O 1 ATOM 2845 C CB . ASN A 1 375 ? 48.265 51.145 3.480 1.00 19.73 ? 410 ASN A CB 1 ATOM 2846 C CG . ASN A 1 375 ? 49.465 52.065 3.471 1.00 27.85 ? 410 ASN A CG 1 ATOM 2847 O OD1 . ASN A 1 375 ? 49.888 52.530 2.414 1.00 26.62 ? 410 ASN A OD1 1 ATOM 2848 N ND2 . ASN A 1 375 ? 50.026 52.308 4.647 1.00 28.70 ? 410 ASN A ND2 1 ATOM 2849 N N . LEU A 1 376 ? 46.336 48.699 2.040 1.00 21.99 ? 411 LEU A N 1 ATOM 2850 C CA . LEU A 1 376 ? 45.603 47.460 2.329 1.00 22.29 ? 411 LEU A CA 1 ATOM 2851 C C . LEU A 1 376 ? 45.611 46.485 1.158 1.00 25.77 ? 411 LEU A C 1 ATOM 2852 O O . LEU A 1 376 ? 45.024 45.410 1.236 1.00 21.68 ? 411 LEU A O 1 ATOM 2853 C CB . LEU A 1 376 ? 44.151 47.781 2.697 1.00 19.63 ? 411 LEU A CB 1 ATOM 2854 C CG . LEU A 1 376 ? 43.919 48.566 3.982 1.00 21.27 ? 411 LEU A CG 1 ATOM 2855 C CD1 . LEU A 1 376 ? 42.428 48.784 4.219 1.00 22.35 ? 411 LEU A CD1 1 ATOM 2856 C CD2 . LEU A 1 376 ? 44.560 47.825 5.159 1.00 21.04 ? 411 LEU A CD2 1 ATOM 2857 N N . THR A 1 377 ? 46.285 46.860 0.077 1.00 20.30 ? 412 THR A N 1 ATOM 2858 C CA . THR A 1 377 ? 46.221 46.107 -1.165 1.00 20.05 ? 412 THR A CA 1 ATOM 2859 C C . THR A 1 377 ? 47.444 45.235 -1.357 1.00 26.13 ? 412 THR A C 1 ATOM 2860 O O . THR A 1 377 ? 48.547 45.747 -1.556 1.00 23.93 ? 412 THR A O 1 ATOM 2861 C CB . THR A 1 377 ? 46.087 47.060 -2.362 1.00 22.07 ? 412 THR A CB 1 ATOM 2862 O OG1 . THR A 1 377 ? 44.843 47.762 -2.257 1.00 23.15 ? 412 THR A OG1 1 ATOM 2863 C CG2 . THR A 1 377 ? 46.127 46.284 -3.673 1.00 25.24 ? 412 THR A CG2 1 ATOM 2864 N N . CYS A 1 378 ? 47.236 43.921 -1.291 1.00 19.24 ? 413 CYS A N 1 ATOM 2865 C CA . CYS A 1 378 ? 48.291 42.925 -1.525 1.00 21.37 ? 413 CYS A CA 1 ATOM 2866 C C . CYS A 1 378 ? 49.599 43.205 -0.796 1.00 26.94 ? 413 CYS A C 1 ATOM 2867 O O . CYS A 1 378 ? 50.678 43.178 -1.412 1.00 25.29 ? 413 CYS A O 1 ATOM 2868 C CB . CYS A 1 378 ? 48.547 42.775 -3.025 1.00 26.26 ? 413 CYS A CB 1 ATOM 2869 S SG . CYS A 1 378 ? 47.037 42.437 -3.935 1.00 27.80 ? 413 CYS A SG 1 ATOM 2870 N N . LYS A 1 379 ? 49.505 43.458 0.510 1.00 22.05 ? 414 LYS A N 1 ATOM 2871 C CA . LYS A 1 379 ? 50.685 43.854 1.266 1.00 24.64 ? 414 LYS A CA 1 ATOM 2872 C C . LYS A 1 379 ? 51.300 42.694 2.051 1.00 29.15 ? 414 LYS A C 1 ATOM 2873 O O . LYS A 1 379 ? 52.442 42.775 2.482 1.00 27.60 ? 414 LYS A O 1 ATOM 2874 C CB . LYS A 1 379 ? 50.372 45.056 2.151 1.00 24.59 ? 414 LYS A CB 1 ATOM 2875 C CG . LYS A 1 379 ? 50.164 46.340 1.341 1.00 25.84 ? 414 LYS A CG 1 ATOM 2876 C CD . LYS A 1 379 ? 51.437 46.713 0.589 1.00 32.50 ? 414 LYS A CD 1 ATOM 2877 C CE . LYS A 1 379 ? 51.283 47.977 -0.264 1.00 39.21 ? 414 LYS A CE 1 ATOM 2878 N NZ . LYS A 1 379 ? 50.904 47.673 -1.683 1.00 39.24 ? 414 LYS A NZ 1 ATOM 2879 N N . LYS A 1 380 ? 50.548 41.608 2.213 1.00 24.11 ? 415 LYS A N 1 ATOM 2880 C CA . LYS A 1 380 ? 51.102 40.364 2.754 1.00 25.93 ? 415 LYS A CA 1 ATOM 2881 C C . LYS A 1 380 ? 50.751 39.241 1.803 1.00 28.36 ? 415 LYS A C 1 ATOM 2882 O O . LYS A 1 380 ? 49.660 39.223 1.247 1.00 29.60 ? 415 LYS A O 1 ATOM 2883 C CB . LYS A 1 380 ? 50.529 40.057 4.141 1.00 23.34 ? 415 LYS A CB 1 ATOM 2884 C CG . LYS A 1 380 ? 50.729 41.165 5.148 1.00 28.78 ? 415 LYS A CG 1 ATOM 2885 C CD . LYS A 1 380 ? 50.172 40.742 6.516 1.00 32.40 ? 415 LYS A CD 1 ATOM 2886 C CE . LYS A 1 380 ? 50.888 39.516 7.066 1.00 40.54 ? 415 LYS A CE 1 ATOM 2887 N NZ . LYS A 1 380 ? 50.157 38.976 8.246 1.00 43.09 ? 415 LYS A NZ 1 ATOM 2888 N N . PRO A 1 381 ? 51.674 38.292 1.601 1.00 28.52 ? 416 PRO A N 1 ATOM 2889 C CA . PRO A 1 381 ? 51.384 37.190 0.677 1.00 27.70 ? 416 PRO A CA 1 ATOM 2890 C C . PRO A 1 381 ? 50.228 36.302 1.149 1.00 31.64 ? 416 PRO A C 1 ATOM 2891 O O . PRO A 1 381 ? 49.551 35.699 0.319 1.00 31.66 ? 416 PRO A O 1 ATOM 2892 C CB . PRO A 1 381 ? 52.699 36.401 0.649 1.00 34.89 ? 416 PRO A CB 1 ATOM 2893 C CG . PRO A 1 381 ? 53.357 36.735 1.923 1.00 39.14 ? 416 PRO A CG 1 ATOM 2894 C CD . PRO A 1 381 ? 53.007 38.164 2.209 1.00 35.19 ? 416 PRO A CD 1 ATOM 2895 N N . ASP A 1 382 ? 50.003 36.221 2.453 1.00 24.05 ? 417 ASP A N 1 ATOM 2896 C CA . ASP A 1 382 ? 48.917 35.383 2.936 1.00 35.66 ? 417 ASP A CA 1 ATOM 2897 C C . ASP A 1 382 ? 47.783 36.238 3.482 1.00 32.02 ? 417 ASP A C 1 ATOM 2898 O O . ASP A 1 382 ? 47.083 35.828 4.384 1.00 29.43 ? 417 ASP A O 1 ATOM 2899 C CB . ASP A 1 382 ? 49.425 34.389 3.990 1.00 35.86 ? 417 ASP A CB 1 ATOM 2900 C CG . ASP A 1 382 ? 50.289 35.050 5.063 1.00 39.57 ? 417 ASP A CG 1 ATOM 2901 O OD1 . ASP A 1 382 ? 50.750 36.196 4.860 1.00 39.24 ? 417 ASP A OD1 1 ATOM 2902 O OD2 . ASP A 1 382 ? 50.516 34.416 6.116 1.00 42.08 ? 417 ASP A OD2 1 ATOM 2903 N N . GLN A 1 383 ? 47.615 37.435 2.924 1.00 27.62 ? 418 GLN A N 1 ATOM 2904 C CA . GLN A 1 383 ? 46.648 38.389 3.437 1.00 23.50 ? 418 GLN A CA 1 ATOM 2905 C C . GLN A 1 383 ? 45.221 37.831 3.477 1.00 22.69 ? 418 GLN A C 1 ATOM 2906 O O . GLN A 1 383 ? 44.716 37.322 2.469 1.00 20.83 ? 418 GLN A O 1 ATOM 2907 C CB . GLN A 1 383 ? 46.684 39.632 2.564 1.00 21.44 ? 418 GLN A CB 1 ATOM 2908 C CG . GLN A 1 383 ? 46.018 40.808 3.164 1.00 20.19 ? 418 GLN A CG 1 ATOM 2909 C CD . GLN A 1 383 ? 46.278 42.035 2.346 1.00 26.97 ? 418 GLN A CD 1 ATOM 2910 O OE1 . GLN A 1 383 ? 47.423 42.331 2.030 1.00 20.90 ? 418 GLN A OE1 1 ATOM 2911 N NE2 . GLN A 1 383 ? 45.220 42.742 1.971 1.00 19.39 ? 418 GLN A NE2 1 ATOM 2912 N N . HIS A 1 384 ? 44.573 37.935 4.637 1.00 19.36 ? 419 HIS A N 1 ATOM 2913 C CA . HIS A 1 384 ? 43.288 37.245 4.848 1.00 20.25 ? 419 HIS A CA 1 ATOM 2914 C C . HIS A 1 384 ? 42.059 38.137 4.733 1.00 20.89 ? 419 HIS A C 1 ATOM 2915 O O . HIS A 1 384 ? 41.012 37.850 5.321 1.00 19.73 ? 419 HIS A O 1 ATOM 2916 C CB . HIS A 1 384 ? 43.304 36.523 6.198 1.00 18.40 ? 419 HIS A CB 1 ATOM 2917 C CG . HIS A 1 384 ? 44.405 35.514 6.299 1.00 21.72 ? 419 HIS A CG 1 ATOM 2918 N ND1 . HIS A 1 384 ? 44.403 34.345 5.572 1.00 21.66 ? 419 HIS A ND1 1 ATOM 2919 C CD2 . HIS A 1 384 ? 45.565 35.520 6.996 1.00 26.48 ? 419 HIS A CD2 1 ATOM 2920 C CE1 . HIS A 1 384 ? 45.499 33.659 5.839 1.00 21.76 ? 419 HIS A CE1 1 ATOM 2921 N NE2 . HIS A 1 384 ? 46.216 34.343 6.707 1.00 24.07 ? 419 HIS A NE2 1 ATOM 2922 N N . PHE A 1 385 ? 42.202 39.214 3.974 1.00 20.62 ? 420 PHE A N 1 ATOM 2923 C CA . PHE A 1 385 ? 41.074 40.042 3.562 1.00 19.83 ? 420 PHE A CA 1 ATOM 2924 C C . PHE A 1 385 ? 41.481 40.779 2.288 1.00 19.85 ? 420 PHE A C 1 ATOM 2925 O O . PHE A 1 385 ? 42.665 40.853 1.951 1.00 19.45 ? 420 PHE A O 1 ATOM 2926 C CB . PHE A 1 385 ? 40.712 41.068 4.634 1.00 19.38 ? 420 PHE A CB 1 ATOM 2927 C CG . PHE A 1 385 ? 41.815 42.041 4.927 1.00 21.96 ? 420 PHE A CG 1 ATOM 2928 C CD1 . PHE A 1 385 ? 42.836 41.699 5.812 1.00 21.96 ? 420 PHE A CD1 1 ATOM 2929 C CD2 . PHE A 1 385 ? 41.848 43.293 4.319 1.00 22.83 ? 420 PHE A CD2 1 ATOM 2930 C CE1 . PHE A 1 385 ? 43.877 42.582 6.087 1.00 20.39 ? 420 PHE A CE1 1 ATOM 2931 C CE2 . PHE A 1 385 ? 42.890 44.180 4.588 1.00 25.20 ? 420 PHE A CE2 1 ATOM 2932 C CZ . PHE A 1 385 ? 43.907 43.822 5.489 1.00 22.71 ? 420 PHE A CZ 1 ATOM 2933 N N . LYS A 1 386 ? 40.506 41.352 1.596 1.00 15.87 ? 421 LYS A N 1 ATOM 2934 C CA . LYS A 1 386 ? 40.826 42.167 0.423 1.00 16.00 ? 421 LYS A CA 1 ATOM 2935 C C . LYS A 1 386 ? 39.996 43.441 0.417 1.00 17.82 ? 421 LYS A C 1 ATOM 2936 O O . LYS A 1 386 ? 38.772 43.381 0.559 1.00 19.20 ? 421 LYS A O 1 ATOM 2937 C CB . LYS A 1 386 ? 40.591 41.366 -0.863 1.00 14.51 ? 421 LYS A CB 1 ATOM 2938 C CG . LYS A 1 386 ? 40.920 42.171 -2.138 1.00 15.64 ? 421 LYS A CG 1 ATOM 2939 C CD . LYS A 1 386 ? 40.583 41.401 -3.397 1.00 16.87 ? 421 LYS A CD 1 ATOM 2940 C CE . LYS A 1 386 ? 41.416 40.110 -3.511 1.00 22.83 ? 421 LYS A CE 1 ATOM 2941 N NZ . LYS A 1 386 ? 42.912 40.394 -3.436 1.00 20.66 ? 421 LYS A NZ 1 ATOM 2942 N N . PRO A 1 387 ? 40.653 44.605 0.254 1.00 14.53 ? 422 PRO A N 1 ATOM 2943 C CA . PRO A 1 387 ? 39.862 45.839 0.266 1.00 16.90 ? 422 PRO A CA 1 ATOM 2944 C C . PRO A 1 387 ? 39.148 46.059 -1.065 1.00 19.20 ? 422 PRO A C 1 ATOM 2945 O O . PRO A 1 387 ? 39.657 45.682 -2.127 1.00 19.58 ? 422 PRO A O 1 ATOM 2946 C CB . PRO A 1 387 ? 40.917 46.910 0.495 1.00 18.97 ? 422 PRO A CB 1 ATOM 2947 C CG . PRO A 1 387 ? 42.150 46.362 -0.178 1.00 16.06 ? 422 PRO A CG 1 ATOM 2948 C CD . PRO A 1 387 ? 42.099 44.876 0.152 1.00 17.08 ? 422 PRO A CD 1 ATOM 2949 N N . TYR A 1 388 ? 37.976 46.681 -1.000 1.00 18.57 ? 423 TYR A N 1 ATOM 2950 C CA . TYR A 1 388 ? 37.209 47.007 -2.193 1.00 20.17 ? 423 TYR A CA 1 ATOM 2951 C C . TYR A 1 388 ? 36.524 48.348 -1.993 1.00 19.24 ? 423 TYR A C 1 ATOM 2952 O O . TYR A 1 388 ? 35.869 48.549 -0.988 1.00 19.88 ? 423 TYR A O 1 ATOM 2953 C CB . TYR A 1 388 ? 36.075 46.003 -2.362 1.00 20.30 ? 423 TYR A CB 1 ATOM 2954 C CG . TYR A 1 388 ? 36.427 44.676 -2.987 1.00 20.48 ? 423 TYR A CG 1 ATOM 2955 C CD1 . TYR A 1 388 ? 36.821 43.595 -2.205 1.00 18.63 ? 423 TYR A CD1 1 ATOM 2956 C CD2 . TYR A 1 388 ? 36.332 44.500 -4.355 1.00 18.67 ? 423 TYR A CD2 1 ATOM 2957 C CE1 . TYR A 1 388 ? 37.128 42.375 -2.770 1.00 17.42 ? 423 TYR A CE1 1 ATOM 2958 C CE2 . TYR A 1 388 ? 36.638 43.282 -4.945 1.00 20.06 ? 423 TYR A CE2 1 ATOM 2959 C CZ . TYR A 1 388 ? 37.028 42.222 -4.146 1.00 21.48 ? 423 TYR A CZ 1 ATOM 2960 O OH . TYR A 1 388 ? 37.333 41.025 -4.726 1.00 18.88 ? 423 TYR A OH 1 ATOM 2961 N N . MET A 1 389 ? 36.601 49.242 -2.972 1.00 22.04 ? 424 MET A N 1 ATOM 2962 C CA . MET A 1 389 ? 35.567 50.265 -3.043 1.00 18.05 ? 424 MET A CA 1 ATOM 2963 C C . MET A 1 389 ? 34.264 49.521 -3.327 1.00 18.78 ? 424 MET A C 1 ATOM 2964 O O . MET A 1 389 ? 34.281 48.532 -4.046 1.00 20.26 ? 424 MET A O 1 ATOM 2965 C CB . MET A 1 389 ? 35.892 51.260 -4.142 1.00 24.28 ? 424 MET A CB 1 ATOM 2966 C CG . MET A 1 389 ? 37.071 52.130 -3.756 1.00 27.94 ? 424 MET A CG 1 ATOM 2967 S SD . MET A 1 389 ? 36.710 53.047 -2.237 1.00 44.34 ? 424 MET A SD 1 ATOM 2968 C CE . MET A 1 389 ? 35.820 54.456 -2.897 1.00 40.16 ? 424 MET A CE 1 ATOM 2969 N N . LYS A 1 390 ? 33.144 49.964 -2.751 1.00 18.40 ? 425 LYS A N 1 ATOM 2970 C CA . LYS A 1 390 ? 31.932 49.141 -2.822 1.00 18.14 ? 425 LYS A CA 1 ATOM 2971 C C . LYS A 1 390 ? 31.453 48.882 -4.250 1.00 21.86 ? 425 LYS A C 1 ATOM 2972 O O . LYS A 1 390 ? 30.875 47.842 -4.524 1.00 18.89 ? 425 LYS A O 1 ATOM 2973 C CB . LYS A 1 390 ? 30.797 49.662 -1.923 1.00 18.56 ? 425 LYS A CB 1 ATOM 2974 C CG . LYS A 1 390 ? 30.251 51.070 -2.277 1.00 16.78 ? 425 LYS A CG 1 ATOM 2975 C CD . LYS A 1 390 ? 29.244 51.528 -1.230 1.00 19.47 ? 425 LYS A CD 1 ATOM 2976 C CE . LYS A 1 390 ? 28.679 52.932 -1.603 1.00 18.69 ? 425 LYS A CE 1 ATOM 2977 N NZ . LYS A 1 390 ? 27.437 53.251 -0.849 1.00 17.95 ? 425 LYS A NZ 1 ATOM 2978 N N . GLN A 1 391 ? 31.726 49.796 -5.175 1.00 17.69 ? 426 GLN A N 1 ATOM 2979 C CA . GLN A 1 391 ? 31.273 49.577 -6.542 1.00 22.20 ? 426 GLN A CA 1 ATOM 2980 C C . GLN A 1 391 ? 32.083 48.483 -7.224 1.00 21.57 ? 426 GLN A C 1 ATOM 2981 O O . GLN A 1 391 ? 31.706 48.009 -8.291 1.00 21.66 ? 426 GLN A O 1 ATOM 2982 C CB . GLN A 1 391 ? 31.391 50.863 -7.359 1.00 27.33 ? 426 GLN A CB 1 ATOM 2983 C CG . GLN A 1 391 ? 32.825 51.370 -7.472 1.00 27.76 ? 426 GLN A CG 1 ATOM 2984 C CD . GLN A 1 391 ? 33.161 52.458 -6.452 1.00 37.24 ? 426 GLN A CD 1 ATOM 2985 O OE1 . GLN A 1 391 ? 32.775 52.394 -5.261 1.00 29.33 ? 426 GLN A OE1 1 ATOM 2986 N NE2 . GLN A 1 391 ? 33.881 53.483 -6.923 1.00 42.10 ? 426 GLN A NE2 1 ATOM 2987 N N . HIS A 1 392 ? 33.207 48.104 -6.623 1.00 18.97 ? 427 HIS A N 1 ATOM 2988 C CA . HIS A 1 392 ? 34.045 47.055 -7.186 1.00 19.99 ? 427 HIS A CA 1 ATOM 2989 C C . HIS A 1 392 ? 33.734 45.677 -6.618 1.00 16.67 ? 427 HIS A C 1 ATOM 2990 O O . HIS A 1 392 ? 34.281 44.671 -7.101 1.00 18.94 ? 427 HIS A O 1 ATOM 2991 C CB . HIS A 1 392 ? 35.523 47.392 -6.963 1.00 19.61 ? 427 HIS A CB 1 ATOM 2992 C CG . HIS A 1 392 ? 36.022 48.510 -7.830 1.00 24.32 ? 427 HIS A CG 1 ATOM 2993 N ND1 . HIS A 1 392 ? 37.131 49.262 -7.510 1.00 28.57 ? 427 HIS A ND1 1 ATOM 2994 C CD2 . HIS A 1 392 ? 35.558 49.006 -9.003 1.00 29.02 ? 427 HIS A CD2 1 ATOM 2995 C CE1 . HIS A 1 392 ? 37.337 50.165 -8.453 1.00 32.22 ? 427 HIS A CE1 1 ATOM 2996 N NE2 . HIS A 1 392 ? 36.399 50.031 -9.371 1.00 29.84 ? 427 HIS A NE2 1 ATOM 2997 N N . LEU A 1 393 ? 32.892 45.619 -5.588 1.00 16.67 ? 428 LEU A N 1 ATOM 2998 C CA . LEU A 1 393 ? 32.470 44.315 -5.039 1.00 16.59 ? 428 LEU A CA 1 ATOM 2999 C C . LEU A 1 393 ? 31.767 43.529 -6.138 1.00 18.57 ? 428 LEU A C 1 ATOM 3000 O O . LEU A 1 393 ? 31.083 44.121 -6.973 1.00 20.80 ? 428 LEU A O 1 ATOM 3001 C CB . LEU A 1 393 ? 31.517 44.487 -3.860 1.00 14.84 ? 428 LEU A CB 1 ATOM 3002 C CG . LEU A 1 393 ? 32.139 45.014 -2.573 1.00 15.71 ? 428 LEU A CG 1 ATOM 3003 C CD1 . LEU A 1 393 ? 31.078 45.468 -1.586 1.00 14.52 ? 428 LEU A CD1 1 ATOM 3004 C CD2 . LEU A 1 393 ? 33.034 43.915 -1.930 1.00 17.79 ? 428 LEU A CD2 1 ATOM 3005 N N . PRO A 1 394 ? 31.933 42.197 -6.143 1.00 18.44 ? 429 PRO A N 1 ATOM 3006 C CA . PRO A 1 394 ? 31.204 41.328 -7.072 1.00 19.55 ? 429 PRO A CA 1 ATOM 3007 C C . PRO A 1 394 ? 29.733 41.709 -7.114 1.00 16.97 ? 429 PRO A C 1 ATOM 3008 O O . PRO A 1 394 ? 29.126 41.942 -6.066 1.00 17.43 ? 429 PRO A O 1 ATOM 3009 C CB . PRO A 1 394 ? 31.372 39.936 -6.435 1.00 17.80 ? 429 PRO A CB 1 ATOM 3010 C CG . PRO A 1 394 ? 32.755 40.029 -5.812 1.00 19.07 ? 429 PRO A CG 1 ATOM 3011 C CD . PRO A 1 394 ? 32.744 41.412 -5.186 1.00 17.90 ? 429 PRO A CD 1 ATOM 3012 N N . LYS A 1 395 ? 29.180 41.812 -8.322 1.00 17.45 ? 430 LYS A N 1 ATOM 3013 C CA . LYS A 1 395 ? 27.827 42.305 -8.491 1.00 18.00 ? 430 LYS A CA 1 ATOM 3014 C C . LYS A 1 395 ? 26.794 41.362 -7.861 1.00 20.80 ? 430 LYS A C 1 ATOM 3015 O O . LYS A 1 395 ? 25.716 41.795 -7.442 1.00 17.82 ? 430 LYS A O 1 ATOM 3016 C CB . LYS A 1 395 ? 27.538 42.556 -9.994 1.00 20.87 ? 430 LYS A CB 1 ATOM 3017 C CG . LYS A 1 395 ? 28.509 43.532 -10.685 1.00 22.09 ? 430 LYS A CG 1 ATOM 3018 C CD . LYS A 1 395 ? 28.437 44.991 -10.131 1.00 20.72 ? 430 LYS A CD 1 ATOM 3019 C CE . LYS A 1 395 ? 27.207 45.776 -10.631 1.00 20.73 ? 430 LYS A CE 1 ATOM 3020 N NZ . LYS A 1 395 ? 27.030 47.133 -9.983 1.00 20.95 ? 430 LYS A NZ 1 ATOM 3021 N N . ARG A 1 396 ? 27.133 40.073 -7.772 1.00 19.62 ? 431 ARG A N 1 ATOM 3022 C CA . ARG A 1 396 ? 26.212 39.087 -7.221 1.00 20.19 ? 431 ARG A CA 1 ATOM 3023 C C . ARG A 1 396 ? 25.874 39.401 -5.752 1.00 19.59 ? 431 ARG A C 1 ATOM 3024 O O . ARG A 1 396 ? 24.865 38.927 -5.223 1.00 17.62 ? 431 ARG A O 1 ATOM 3025 C CB . ARG A 1 396 ? 26.839 37.689 -7.299 1.00 15.02 ? 431 ARG A CB 1 ATOM 3026 C CG . ARG A 1 396 ? 28.191 37.615 -6.583 1.00 15.70 ? 431 ARG A CG 1 ATOM 3027 C CD . ARG A 1 396 ? 28.857 36.207 -6.696 1.00 16.68 ? 431 ARG A CD 1 ATOM 3028 N NE . ARG A 1 396 ? 30.223 36.280 -6.173 1.00 19.07 ? 431 ARG A NE 1 ATOM 3029 C CZ . ARG A 1 396 ? 30.531 36.141 -4.879 1.00 16.53 ? 431 ARG A CZ 1 ATOM 3030 N NH1 . ARG A 1 396 ? 29.571 35.863 -3.991 1.00 15.63 ? 431 ARG A NH1 1 ATOM 3031 N NH2 . ARG A 1 396 ? 31.788 36.255 -4.481 1.00 16.08 ? 431 ARG A NH2 1 ATOM 3032 N N . LEU A 1 397 ? 26.735 40.178 -5.092 1.00 15.59 ? 432 LEU A N 1 ATOM 3033 C CA . LEU A 1 397 ? 26.527 40.519 -3.683 1.00 19.07 ? 432 LEU A CA 1 ATOM 3034 C C . LEU A 1 397 ? 25.474 41.604 -3.541 1.00 18.75 ? 432 LEU A C 1 ATOM 3035 O O . LEU A 1 397 ? 24.847 41.730 -2.492 1.00 17.16 ? 432 LEU A O 1 ATOM 3036 C CB . LEU A 1 397 ? 27.834 40.955 -3.004 1.00 17.77 ? 432 LEU A CB 1 ATOM 3037 C CG . LEU A 1 397 ? 28.957 39.914 -2.897 1.00 13.70 ? 432 LEU A CG 1 ATOM 3038 C CD1 . LEU A 1 397 ? 30.189 40.580 -2.305 1.00 17.86 ? 432 LEU A CD1 1 ATOM 3039 C CD2 . LEU A 1 397 ? 28.508 38.745 -2.034 1.00 18.46 ? 432 LEU A CD2 1 ATOM 3040 N N . HIS A 1 398 ? 25.294 42.388 -4.597 1.00 18.06 ? 433 HIS A N 1 ATOM 3041 C CA . HIS A 1 398 ? 24.275 43.450 -4.600 1.00 16.03 ? 433 HIS A CA 1 ATOM 3042 C C . HIS A 1 398 ? 24.385 44.354 -3.382 1.00 17.07 ? 433 HIS A C 1 ATOM 3043 O O . HIS A 1 398 ? 23.387 44.662 -2.729 1.00 17.66 ? 433 HIS A O 1 ATOM 3044 C CB . HIS A 1 398 ? 22.861 42.852 -4.695 1.00 16.28 ? 433 HIS A CB 1 ATOM 3045 C CG . HIS A 1 398 ? 22.585 42.206 -6.016 1.00 17.54 ? 433 HIS A CG 1 ATOM 3046 N ND1 . HIS A 1 398 ? 22.327 42.940 -7.157 1.00 18.44 ? 433 HIS A ND1 1 ATOM 3047 C CD2 . HIS A 1 398 ? 22.561 40.904 -6.388 1.00 19.61 ? 433 HIS A CD2 1 ATOM 3048 C CE1 . HIS A 1 398 ? 22.154 42.111 -8.174 1.00 20.90 ? 433 HIS A CE1 1 ATOM 3049 N NE2 . HIS A 1 398 ? 22.292 40.873 -7.736 1.00 20.62 ? 433 HIS A NE2 1 ATOM 3050 N N . TYR A 1 399 ? 25.606 44.772 -3.073 1.00 17.10 ? 434 TYR A N 1 ATOM 3051 C CA . TYR A 1 399 ? 25.859 45.445 -1.804 1.00 19.50 ? 434 TYR A CA 1 ATOM 3052 C C . TYR A 1 399 ? 26.562 46.779 -2.012 1.00 20.86 ? 434 TYR A C 1 ATOM 3053 O O . TYR A 1 399 ? 27.728 46.934 -1.664 1.00 19.44 ? 434 TYR A O 1 ATOM 3054 C CB . TYR A 1 399 ? 26.729 44.543 -0.904 1.00 18.27 ? 434 TYR A CB 1 ATOM 3055 C CG . TYR A 1 399 ? 26.739 44.937 0.554 1.00 17.76 ? 434 TYR A CG 1 ATOM 3056 C CD1 . TYR A 1 399 ? 25.609 44.794 1.345 1.00 14.54 ? 434 TYR A CD1 1 ATOM 3057 C CD2 . TYR A 1 399 ? 27.881 45.450 1.139 1.00 15.33 ? 434 TYR A CD2 1 ATOM 3058 C CE1 . TYR A 1 399 ? 25.612 45.163 2.685 1.00 15.48 ? 434 TYR A CE1 1 ATOM 3059 C CE2 . TYR A 1 399 ? 27.909 45.795 2.490 1.00 16.02 ? 434 TYR A CE2 1 ATOM 3060 C CZ . TYR A 1 399 ? 26.791 45.654 3.248 1.00 14.82 ? 434 TYR A CZ 1 ATOM 3061 O OH . TYR A 1 399 ? 26.839 46.011 4.562 1.00 17.66 ? 434 TYR A OH 1 ATOM 3062 N N . ALA A 1 400 ? 25.865 47.760 -2.571 1.00 20.13 ? 435 ALA A N 1 ATOM 3063 C CA . ALA A 1 400 ? 26.539 49.034 -2.798 1.00 16.31 ? 435 ALA A CA 1 ATOM 3064 C C . ALA A 1 400 ? 25.570 50.210 -2.779 1.00 20.62 ? 435 ALA A C 1 ATOM 3065 O O . ALA A 1 400 ? 25.935 51.320 -2.348 1.00 21.89 ? 435 ALA A O 1 ATOM 3066 C CB . ALA A 1 400 ? 27.326 48.988 -4.106 1.00 19.94 ? 435 ALA A CB 1 ATOM 3067 N N . ASN A 1 401 ? 24.335 49.965 -3.214 1.00 17.79 ? 436 ASN A N 1 ATOM 3068 C CA . ASN A 1 401 ? 23.428 51.087 -3.457 1.00 21.54 ? 436 ASN A CA 1 ATOM 3069 C C . ASN A 1 401 ? 22.645 51.518 -2.218 1.00 23.05 ? 436 ASN A C 1 ATOM 3070 O O . ASN A 1 401 ? 21.417 51.434 -2.165 1.00 22.04 ? 436 ASN A O 1 ATOM 3071 C CB . ASN A 1 401 ? 22.503 50.822 -4.646 1.00 23.33 ? 436 ASN A CB 1 ATOM 3072 C CG . ASN A 1 401 ? 21.646 52.025 -4.981 1.00 24.59 ? 436 ASN A CG 1 ATOM 3073 O OD1 . ASN A 1 401 ? 22.069 53.161 -4.770 1.00 24.04 ? 436 ASN A OD1 1 ATOM 3074 N ND2 . ASN A 1 401 ? 20.423 51.785 -5.458 1.00 25.05 ? 436 ASN A ND2 1 ATOM 3075 N N . ASN A 1 402 ? 23.370 51.988 -1.211 1.00 20.48 ? 437 ASN A N 1 ATOM 3076 C CA . ASN A 1 402 ? 22.744 52.476 -0.001 1.00 19.72 ? 437 ASN A CA 1 ATOM 3077 C C . ASN A 1 402 ? 23.729 53.382 0.741 1.00 20.08 ? 437 ASN A C 1 ATOM 3078 O O . ASN A 1 402 ? 24.899 53.054 0.843 1.00 19.94 ? 437 ASN A O 1 ATOM 3079 C CB . ASN A 1 402 ? 22.306 51.302 0.890 1.00 19.44 ? 437 ASN A CB 1 ATOM 3080 C CG . ASN A 1 402 ? 21.340 51.731 1.992 1.00 21.60 ? 437 ASN A CG 1 ATOM 3081 O OD1 . ASN A 1 402 ? 21.729 52.430 2.917 1.00 18.73 ? 437 ASN A OD1 1 ATOM 3082 N ND2 . ASN A 1 402 ? 20.082 51.309 1.896 1.00 17.46 ? 437 ASN A ND2 1 ATOM 3083 N N . ARG A 1 403 ? 23.257 54.518 1.245 1.00 22.07 ? 438 ARG A N 1 ATOM 3084 C CA . ARG A 1 403 ? 24.120 55.465 1.965 1.00 22.08 ? 438 ARG A CA 1 ATOM 3085 C C . ARG A 1 403 ? 24.712 54.905 3.263 1.00 21.77 ? 438 ARG A C 1 ATOM 3086 O O . ARG A 1 403 ? 25.679 55.447 3.815 1.00 22.82 ? 438 ARG A O 1 ATOM 3087 C CB . ARG A 1 403 ? 23.354 56.762 2.271 1.00 20.26 ? 438 ARG A CB 1 ATOM 3088 C CG . ARG A 1 403 ? 22.163 56.593 3.168 1.00 22.35 ? 438 ARG A CG 1 ATOM 3089 C CD . ARG A 1 403 ? 21.293 57.873 3.167 1.00 25.11 ? 438 ARG A CD 1 ATOM 3090 N NE . ARG A 1 403 ? 20.394 57.871 4.310 1.00 25.68 ? 438 ARG A NE 1 ATOM 3091 C CZ . ARG A 1 403 ? 19.158 58.359 4.308 1.00 30.81 ? 438 ARG A CZ 1 ATOM 3092 N NH1 . ARG A 1 403 ? 18.654 58.914 3.213 1.00 31.39 ? 438 ARG A NH1 1 ATOM 3093 N NH2 . ARG A 1 403 ? 18.427 58.287 5.408 1.00 30.15 ? 438 ARG A NH2 1 ATOM 3094 N N . ARG A 1 404 ? 24.131 53.818 3.758 1.00 17.91 ? 439 ARG A N 1 ATOM 3095 C CA . ARG A 1 404 ? 24.610 53.202 4.985 1.00 17.55 ? 439 ARG A CA 1 ATOM 3096 C C . ARG A 1 404 ? 25.764 52.225 4.748 1.00 17.04 ? 439 ARG A C 1 ATOM 3097 O O . ARG A 1 404 ? 26.329 51.687 5.699 1.00 18.66 ? 439 ARG A O 1 ATOM 3098 C CB . ARG A 1 404 ? 23.461 52.457 5.668 1.00 19.62 ? 439 ARG A CB 1 ATOM 3099 C CG . ARG A 1 404 ? 22.386 53.377 6.176 1.00 23.12 ? 439 ARG A CG 1 ATOM 3100 C CD . ARG A 1 404 ? 21.096 52.631 6.493 1.00 18.25 ? 439 ARG A CD 1 ATOM 3101 N NE . ARG A 1 404 ? 20.001 53.582 6.722 1.00 19.00 ? 439 ARG A NE 1 ATOM 3102 C CZ . ARG A 1 404 ? 18.721 53.246 6.823 1.00 24.04 ? 439 ARG A CZ 1 ATOM 3103 N NH1 . ARG A 1 404 ? 18.350 51.967 6.728 1.00 20.48 ? 439 ARG A NH1 1 ATOM 3104 N NH2 . ARG A 1 404 ? 17.809 54.195 7.019 1.00 24.21 ? 439 ARG A NH2 1 ATOM 3105 N N . ILE A 1 405 ? 26.068 51.955 3.487 1.00 18.02 ? 440 ILE A N 1 ATOM 3106 C CA . ILE A 1 405 ? 27.206 51.109 3.173 1.00 21.60 ? 440 ILE A CA 1 ATOM 3107 C C . ILE A 1 405 ? 28.406 51.993 2.883 1.00 19.05 ? 440 ILE A C 1 ATOM 3108 O O . ILE A 1 405 ? 28.432 52.750 1.902 1.00 20.03 ? 440 ILE A O 1 ATOM 3109 C CB . ILE A 1 405 ? 26.930 50.187 1.986 1.00 19.74 ? 440 ILE A CB 1 ATOM 3110 C CG1 . ILE A 1 405 ? 25.683 49.320 2.281 1.00 13.13 ? 440 ILE A CG1 1 ATOM 3111 C CG2 . ILE A 1 405 ? 28.169 49.331 1.672 1.00 19.09 ? 440 ILE A CG2 1 ATOM 3112 C CD1 . ILE A 1 405 ? 25.211 48.575 1.047 1.00 18.64 ? 440 ILE A CD1 1 ATOM 3113 N N . GLU A 1 406 ? 29.385 51.927 3.771 1.00 19.09 ? 441 GLU A N 1 ATOM 3114 C CA . GLU A 1 406 ? 30.610 52.694 3.597 1.00 20.04 ? 441 GLU A CA 1 ATOM 3115 C C . GLU A 1 406 ? 31.253 52.426 2.228 1.00 26.89 ? 441 GLU A C 1 ATOM 3116 O O . GLU A 1 406 ? 31.173 51.306 1.708 1.00 20.34 ? 441 GLU A O 1 ATOM 3117 C CB . GLU A 1 406 ? 31.586 52.365 4.732 1.00 22.24 ? 441 GLU A CB 1 ATOM 3118 C CG . GLU A 1 406 ? 31.158 52.898 6.103 1.00 21.16 ? 441 GLU A CG 1 ATOM 3119 C CD . GLU A 1 406 ? 30.040 52.099 6.783 1.00 21.04 ? 441 GLU A CD 1 ATOM 3120 O OE1 . GLU A 1 406 ? 29.621 51.047 6.252 1.00 20.25 ? 441 GLU A OE1 1 ATOM 3121 O OE2 . GLU A 1 406 ? 29.605 52.517 7.875 1.00 22.79 ? 441 GLU A OE2 1 ATOM 3122 N N . ASP A 1 407 ? 31.878 53.455 1.643 1.00 18.72 ? 442 ASP A N 1 ATOM 3123 C CA . ASP A 1 407 ? 32.591 53.302 0.377 1.00 22.92 ? 442 ASP A CA 1 ATOM 3124 C C . ASP A 1 407 ? 33.666 52.223 0.469 1.00 22.57 ? 442 ASP A C 1 ATOM 3125 O O . ASP A 1 407 ? 33.881 51.501 -0.484 1.00 20.43 ? 442 ASP A O 1 ATOM 3126 C CB . ASP A 1 407 ? 33.287 54.605 -0.040 1.00 26.77 ? 442 ASP A CB 1 ATOM 3127 C CG . ASP A 1 407 ? 32.304 55.692 -0.457 1.00 31.22 ? 442 ASP A CG 1 ATOM 3128 O OD1 . ASP A 1 407 ? 31.132 55.368 -0.725 1.00 26.46 ? 442 ASP A OD1 1 ATOM 3129 O OD2 . ASP A 1 407 ? 32.705 56.871 -0.519 1.00 33.26 ? 442 ASP A OD2 1 ATOM 3130 N N . LEU A 1 408 ? 34.359 52.153 1.601 1.00 21.96 ? 443 LEU A N 1 ATOM 3131 C CA . LEU A 1 408 ? 35.483 51.222 1.738 1.00 20.36 ? 443 LEU A CA 1 ATOM 3132 C C . LEU A 1 408 ? 35.020 49.970 2.464 1.00 19.03 ? 443 LEU A C 1 ATOM 3133 O O . LEU A 1 408 ? 34.516 50.055 3.585 1.00 20.79 ? 443 LEU A O 1 ATOM 3134 C CB . LEU A 1 408 ? 36.636 51.878 2.501 1.00 16.52 ? 443 LEU A CB 1 ATOM 3135 C CG . LEU A 1 408 ? 37.896 51.032 2.677 1.00 23.68 ? 443 LEU A CG 1 ATOM 3136 C CD1 . LEU A 1 408 ? 38.296 50.383 1.360 1.00 26.98 ? 443 LEU A CD1 1 ATOM 3137 C CD2 . LEU A 1 408 ? 39.025 51.916 3.195 1.00 28.47 ? 443 LEU A CD2 1 ATOM 3138 N N . HIS A 1 409 ? 35.206 48.822 1.816 1.00 15.89 ? 444 HIS A N 1 ATOM 3139 C CA . HIS A 1 409 ? 34.784 47.542 2.347 1.00 18.53 ? 444 HIS A CA 1 ATOM 3140 C C . HIS A 1 409 ? 35.966 46.596 2.377 1.00 20.35 ? 444 HIS A C 1 ATOM 3141 O O . HIS A 1 409 ? 36.878 46.701 1.557 1.00 17.79 ? 444 HIS A O 1 ATOM 3142 C CB . HIS A 1 409 ? 33.708 46.940 1.443 1.00 17.14 ? 444 HIS A CB 1 ATOM 3143 C CG . HIS A 1 409 ? 32.900 45.864 2.106 1.00 16.11 ? 444 HIS A CG 1 ATOM 3144 N ND1 . HIS A 1 409 ? 31.819 46.154 2.906 1.00 16.80 ? 444 HIS A ND1 1 ATOM 3145 C CD2 . HIS A 1 409 ? 33.007 44.512 2.088 1.00 16.93 ? 444 HIS A CD2 1 ATOM 3146 C CE1 . HIS A 1 409 ? 31.302 45.029 3.371 1.00 21.96 ? 444 HIS A CE1 1 ATOM 3147 N NE2 . HIS A 1 409 ? 32.002 44.015 2.891 1.00 15.42 ? 444 HIS A NE2 1 ATOM 3148 N N . LEU A 1 410 ? 35.948 45.665 3.323 1.00 19.06 ? 445 LEU A N 1 ATOM 3149 C CA . LEU A 1 410 ? 36.915 44.589 3.340 1.00 14.92 ? 445 LEU A CA 1 ATOM 3150 C C . LEU A 1 410 ? 36.140 43.286 3.231 1.00 15.13 ? 445 LEU A C 1 ATOM 3151 O O . LEU A 1 410 ? 35.318 42.984 4.084 1.00 18.02 ? 445 LEU A O 1 ATOM 3152 C CB . LEU A 1 410 ? 37.700 44.580 4.671 1.00 15.62 ? 445 LEU A CB 1 ATOM 3153 C CG . LEU A 1 410 ? 38.310 45.914 5.101 1.00 17.70 ? 445 LEU A CG 1 ATOM 3154 C CD1 . LEU A 1 410 ? 39.021 45.779 6.455 1.00 21.41 ? 445 LEU A CD1 1 ATOM 3155 C CD2 . LEU A 1 410 ? 39.272 46.469 4.066 1.00 17.58 ? 445 LEU A CD2 1 ATOM 3156 N N . LEU A 1 411 ? 36.405 42.522 2.182 1.00 15.20 ? 446 LEU A N 1 ATOM 3157 C CA . LEU A 1 411 ? 35.888 41.170 2.097 1.00 15.23 ? 446 LEU A CA 1 ATOM 3158 C C . LEU A 1 411 ? 36.888 40.286 2.810 1.00 18.91 ? 446 LEU A C 1 ATOM 3159 O O . LEU A 1 411 ? 38.067 40.246 2.431 1.00 17.35 ? 446 LEU A O 1 ATOM 3160 C CB . LEU A 1 411 ? 35.786 40.724 0.645 1.00 17.43 ? 446 LEU A CB 1 ATOM 3161 C CG . LEU A 1 411 ? 34.497 40.721 -0.166 1.00 27.94 ? 446 LEU A CG 1 ATOM 3162 C CD1 . LEU A 1 411 ? 34.720 39.832 -1.395 1.00 25.32 ? 446 LEU A CD1 1 ATOM 3163 C CD2 . LEU A 1 411 ? 33.257 40.297 0.611 1.00 19.72 ? 446 LEU A CD2 1 ATOM 3164 N N . VAL A 1 412 ? 36.429 39.589 3.848 1.00 16.63 ? 447 VAL A N 1 ATOM 3165 C CA . VAL A 1 412 ? 37.314 38.818 4.724 1.00 15.86 ? 447 VAL A CA 1 ATOM 3166 C C . VAL A 1 412 ? 37.310 37.328 4.351 1.00 16.89 ? 447 VAL A C 1 ATOM 3167 O O . VAL A 1 412 ? 36.271 36.789 3.991 1.00 18.31 ? 447 VAL A O 1 ATOM 3168 C CB . VAL A 1 412 ? 36.891 39.001 6.182 1.00 18.14 ? 447 VAL A CB 1 ATOM 3169 C CG1 . VAL A 1 412 ? 37.803 38.198 7.119 1.00 18.42 ? 447 VAL A CG1 1 ATOM 3170 C CG2 . VAL A 1 412 ? 36.911 40.498 6.532 1.00 17.62 ? 447 VAL A CG2 1 ATOM 3171 N N . GLU A 1 413 ? 38.482 36.685 4.387 1.00 17.98 ? 448 GLU A N 1 ATOM 3172 C CA . GLU A 1 413 ? 38.588 35.274 4.025 1.00 20.00 ? 448 GLU A CA 1 ATOM 3173 C C . GLU A 1 413 ? 37.878 34.411 5.056 1.00 18.02 ? 448 GLU A C 1 ATOM 3174 O O . GLU A 1 413 ? 37.958 34.696 6.240 1.00 17.79 ? 448 GLU A O 1 ATOM 3175 C CB . GLU A 1 413 ? 40.068 34.851 3.967 1.00 21.04 ? 448 GLU A CB 1 ATOM 3176 C CG . GLU A 1 413 ? 40.308 33.409 3.506 1.00 22.99 ? 448 GLU A CG 1 ATOM 3177 C CD . GLU A 1 413 ? 41.782 33.070 3.519 1.00 28.46 ? 448 GLU A CD 1 ATOM 3178 O OE1 . GLU A 1 413 ? 42.586 34.009 3.383 1.00 26.08 ? 448 GLU A OE1 1 ATOM 3179 O OE2 . GLU A 1 413 ? 42.132 31.886 3.698 1.00 34.52 ? 448 GLU A OE2 1 ATOM 3180 N N . ARG A 1 414 ? 37.191 33.361 4.611 1.00 19.65 ? 449 ARG A N 1 ATOM 3181 C CA . ARG A 1 414 ? 36.519 32.461 5.556 1.00 19.51 ? 449 ARG A CA 1 ATOM 3182 C C . ARG A 1 414 ? 37.496 31.993 6.650 1.00 17.59 ? 449 ARG A C 1 ATOM 3183 O O . ARG A 1 414 ? 38.696 31.838 6.373 1.00 18.18 ? 449 ARG A O 1 ATOM 3184 C CB . ARG A 1 414 ? 35.910 31.272 4.797 1.00 20.05 ? 449 ARG A CB 1 ATOM 3185 C CG . ARG A 1 414 ? 36.947 30.305 4.217 1.00 22.83 ? 449 ARG A CG 1 ATOM 3186 C CD . ARG A 1 414 ? 36.354 29.336 3.206 1.00 26.97 ? 449 ARG A CD 1 ATOM 3187 N NE . ARG A 1 414 ? 36.013 30.033 1.964 1.00 32.90 ? 449 ARG A NE 1 ATOM 3188 C CZ . ARG A 1 414 ? 35.340 29.490 0.951 1.00 38.01 ? 449 ARG A CZ 1 ATOM 3189 N NH1 . ARG A 1 414 ? 34.916 28.231 1.019 1.00 37.12 ? 449 ARG A NH1 1 ATOM 3190 N NH2 . ARG A 1 414 ? 35.078 30.212 -0.129 1.00 35.68 ? 449 ARG A NH2 1 ATOM 3191 N N . ARG A 1 415 ? 36.985 31.834 7.882 1.00 16.06 ? 450 ARG A N 1 ATOM 3192 C CA . ARG A 1 415 ? 37.745 31.415 9.074 1.00 18.91 ? 450 ARG A CA 1 ATOM 3193 C C . ARG A 1 415 ? 38.549 32.528 9.737 1.00 15.83 ? 450 ARG A C 1 ATOM 3194 O O . ARG A 1 415 ? 39.142 32.311 10.802 1.00 16.25 ? 450 ARG A O 1 ATOM 3195 C CB . ARG A 1 415 ? 38.638 30.173 8.818 1.00 20.09 ? 450 ARG A CB 1 ATOM 3196 C CG . ARG A 1 415 ? 37.910 28.994 8.184 1.00 23.96 ? 450 ARG A CG 1 ATOM 3197 C CD . ARG A 1 415 ? 38.876 27.832 7.848 1.00 25.22 ? 450 ARG A CD 1 ATOM 3198 N NE . ARG A 1 415 ? 39.261 27.075 9.038 1.00 29.05 ? 450 ARG A NE 1 ATOM 3199 C CZ . ARG A 1 415 ? 40.460 27.130 9.614 1.00 35.62 ? 450 ARG A CZ 1 ATOM 3200 N NH1 . ARG A 1 415 ? 41.421 27.889 9.106 1.00 35.01 ? 450 ARG A NH1 1 ATOM 3201 N NH2 . ARG A 1 415 ? 40.704 26.408 10.695 1.00 35.91 ? 450 ARG A NH2 1 ATOM 3202 N N . TRP A 1 416 ? 38.538 33.721 9.139 1.00 16.54 ? 451 TRP A N 1 ATOM 3203 C CA . TRP A 1 416 ? 39.272 34.857 9.687 1.00 17.48 ? 451 TRP A CA 1 ATOM 3204 C C . TRP A 1 416 ? 38.431 36.034 10.166 1.00 19.73 ? 451 TRP A C 1 ATOM 3205 O O . TRP A 1 416 ? 37.271 36.190 9.783 1.00 15.28 ? 451 TRP A O 1 ATOM 3206 C CB . TRP A 1 416 ? 40.322 35.366 8.673 1.00 17.10 ? 451 TRP A CB 1 ATOM 3207 C CG . TRP A 1 416 ? 41.504 34.450 8.634 1.00 17.69 ? 451 TRP A CG 1 ATOM 3208 C CD1 . TRP A 1 416 ? 41.578 33.224 8.040 1.00 21.95 ? 451 TRP A CD1 1 ATOM 3209 C CD2 . TRP A 1 416 ? 42.770 34.687 9.226 1.00 17.67 ? 451 TRP A CD2 1 ATOM 3210 N NE1 . TRP A 1 416 ? 42.827 32.676 8.234 1.00 21.64 ? 451 TRP A NE1 1 ATOM 3211 C CE2 . TRP A 1 416 ? 43.567 33.543 8.988 1.00 19.81 ? 451 TRP A CE2 1 ATOM 3212 C CE3 . TRP A 1 416 ? 43.302 35.740 9.978 1.00 20.64 ? 451 TRP A CE3 1 ATOM 3213 C CZ2 . TRP A 1 416 ? 44.881 33.443 9.440 1.00 21.80 ? 451 TRP A CZ2 1 ATOM 3214 C CZ3 . TRP A 1 416 ? 44.609 35.634 10.435 1.00 24.27 ? 451 TRP A CZ3 1 ATOM 3215 C CH2 . TRP A 1 416 ? 45.384 34.501 10.152 1.00 24.96 ? 451 TRP A CH2 1 ATOM 3216 N N . HIS A 1 417 ? 39.042 36.851 11.021 1.00 18.53 ? 452 HIS A N 1 ATOM 3217 C CA . HIS A 1 417 ? 38.484 38.121 11.445 1.00 17.81 ? 452 HIS A CA 1 ATOM 3218 C C . HIS A 1 417 ? 39.426 39.256 11.026 1.00 21.94 ? 452 HIS A C 1 ATOM 3219 O O . HIS A 1 417 ? 40.631 39.050 10.854 1.00 19.77 ? 452 HIS A O 1 ATOM 3220 C CB . HIS A 1 417 ? 38.369 38.180 12.974 1.00 19.21 ? 452 HIS A CB 1 ATOM 3221 C CG . HIS A 1 417 ? 37.049 37.733 13.514 1.00 21.27 ? 452 HIS A CG 1 ATOM 3222 N ND1 . HIS A 1 417 ? 36.807 37.619 14.869 1.00 23.40 ? 452 HIS A ND1 1 ATOM 3223 C CD2 . HIS A 1 417 ? 35.900 37.366 12.891 1.00 18.41 ? 452 HIS A CD2 1 ATOM 3224 C CE1 . HIS A 1 417 ? 35.562 37.213 15.057 1.00 24.40 ? 452 HIS A CE1 1 ATOM 3225 N NE2 . HIS A 1 417 ? 34.987 37.067 13.877 1.00 21.97 ? 452 HIS A NE2 1 ATOM 3226 N N . VAL A 1 418 ? 38.861 40.447 10.866 1.00 18.42 ? 453 VAL A N 1 ATOM 3227 C CA . VAL A 1 418 ? 39.646 41.673 10.763 1.00 15.60 ? 453 VAL A CA 1 ATOM 3228 C C . VAL A 1 418 ? 39.279 42.578 11.934 1.00 24.33 ? 453 VAL A C 1 ATOM 3229 O O . VAL A 1 418 ? 38.107 42.713 12.293 1.00 20.96 ? 453 VAL A O 1 ATOM 3230 C CB . VAL A 1 418 ? 39.459 42.386 9.387 1.00 19.82 ? 453 VAL A CB 1 ATOM 3231 C CG1 . VAL A 1 418 ? 38.019 42.885 9.218 1.00 22.98 ? 453 VAL A CG1 1 ATOM 3232 C CG2 . VAL A 1 418 ? 40.433 43.546 9.252 1.00 23.01 ? 453 VAL A CG2 1 ATOM 3233 N N . ALA A 1 419 ? 40.290 43.168 12.566 1.00 22.29 ? 454 ALA A N 1 ATOM 3234 C CA . ALA A 1 419 ? 40.048 44.054 13.691 1.00 20.67 ? 454 ALA A CA 1 ATOM 3235 C C . ALA A 1 419 ? 40.931 45.267 13.489 1.00 23.85 ? 454 ALA A C 1 ATOM 3236 O O . ALA A 1 419 ? 41.861 45.218 12.689 1.00 21.13 ? 454 ALA A O 1 ATOM 3237 C CB . ALA A 1 419 ? 40.385 43.358 15.008 1.00 22.57 ? 454 ALA A CB 1 ATOM 3238 N N . ARG A 1 420 ? 40.649 46.343 14.215 1.00 21.18 ? 455 ARG A N 1 ATOM 3239 C CA . ARG A 1 420 ? 41.379 47.592 14.023 1.00 22.46 ? 455 ARG A CA 1 ATOM 3240 C C . ARG A 1 420 ? 42.808 47.502 14.597 1.00 25.46 ? 455 ARG A C 1 ATOM 3241 O O . ARG A 1 420 ? 43.783 47.891 13.945 1.00 24.73 ? 455 ARG A O 1 ATOM 3242 C CB . ARG A 1 420 ? 40.580 48.731 14.663 1.00 27.48 ? 455 ARG A CB 1 ATOM 3243 C CG . ARG A 1 420 ? 40.916 50.124 14.192 1.00 36.35 ? 455 ARG A CG 1 ATOM 3244 C CD . ARG A 1 420 ? 39.861 51.117 14.677 1.00 29.26 ? 455 ARG A CD 1 ATOM 3245 N NE . ARG A 1 420 ? 39.563 50.940 16.096 1.00 31.28 ? 455 ARG A NE 1 ATOM 3246 C CZ . ARG A 1 420 ? 40.096 51.677 17.066 1.00 41.51 ? 455 ARG A CZ 1 ATOM 3247 N NH1 . ARG A 1 420 ? 40.949 52.646 16.766 1.00 42.90 ? 455 ARG A NH1 1 ATOM 3248 N NH2 . ARG A 1 420 ? 39.785 51.449 18.337 1.00 39.93 ? 455 ARG A NH2 1 ATOM 3249 N N . LYS A 1 421 ? 42.936 46.949 15.800 1.00 29.13 ? 456 LYS A N 1 ATOM 3250 C CA . LYS A 1 421 ? 44.238 46.834 16.451 1.00 29.73 ? 456 LYS A CA 1 ATOM 3251 C C . LYS A 1 421 ? 44.167 45.797 17.581 1.00 39.04 ? 456 LYS A C 1 ATOM 3252 O O . LYS A 1 421 ? 43.077 45.465 18.056 1.00 34.99 ? 456 LYS A O 1 ATOM 3253 C CB . LYS A 1 421 ? 44.667 48.196 17.001 1.00 27.86 ? 456 LYS A CB 1 ATOM 3254 C CG . LYS A 1 421 ? 43.783 48.691 18.124 1.00 35.09 ? 456 LYS A CG 1 ATOM 3255 C CD . LYS A 1 421 ? 44.295 50.001 18.684 1.00 34.88 ? 456 LYS A CD 1 ATOM 3256 C CE . LYS A 1 421 ? 43.306 50.573 19.688 1.00 45.25 ? 456 LYS A CE 1 ATOM 3257 N NZ . LYS A 1 421 ? 43.778 51.867 20.236 1.00 45.43 ? 456 LYS A NZ 1 ATOM 3258 N N . PRO A 1 422 ? 45.326 45.277 18.012 1.00 36.47 ? 457 PRO A N 1 ATOM 3259 C CA . PRO A 1 422 ? 45.346 44.174 18.981 1.00 39.03 ? 457 PRO A CA 1 ATOM 3260 C C . PRO A 1 422 ? 44.590 44.417 20.284 1.00 43.27 ? 457 PRO A C 1 ATOM 3261 O O . PRO A 1 422 ? 44.149 43.448 20.904 1.00 51.10 ? 457 PRO A O 1 ATOM 3262 C CB . PRO A 1 422 ? 46.835 43.982 19.248 1.00 34.92 ? 457 PRO A CB 1 ATOM 3263 C CG . PRO A 1 422 ? 47.458 44.319 17.935 1.00 37.53 ? 457 PRO A CG 1 ATOM 3264 C CD . PRO A 1 422 ? 46.657 45.487 17.409 1.00 29.77 ? 457 PRO A CD 1 ATOM 3265 N N . LEU A 1 423 ? 44.431 45.672 20.684 1.00 45.81 ? 458 LEU A N 1 ATOM 3266 C CA . LEU A 1 423 ? 43.643 45.990 21.869 1.00 54.19 ? 458 LEU A CA 1 ATOM 3267 C C . LEU A 1 423 ? 42.202 45.498 21.742 1.00 57.93 ? 458 LEU A C 1 ATOM 3268 O O . LEU A 1 423 ? 41.527 45.287 22.746 1.00 58.76 ? 458 LEU A O 1 ATOM 3269 C CB . LEU A 1 423 ? 43.648 47.498 22.128 1.00 56.36 ? 458 LEU A CB 1 ATOM 3270 N N . ASP A 1 424 ? 41.736 45.316 20.508 1.00 56.94 ? 459 ASP A N 1 ATOM 3271 C CA . ASP A 1 424 ? 40.348 44.924 20.261 1.00 57.48 ? 459 ASP A CA 1 ATOM 3272 C C . ASP A 1 424 ? 40.121 43.411 20.365 1.00 63.78 ? 459 ASP A C 1 ATOM 3273 O O . ASP A 1 424 ? 38.991 42.939 20.205 1.00 62.68 ? 459 ASP A O 1 ATOM 3274 C CB . ASP A 1 424 ? 39.866 45.438 18.895 1.00 50.92 ? 459 ASP A CB 1 ATOM 3275 C CG . ASP A 1 424 ? 39.931 46.957 18.779 1.00 50.75 ? 459 ASP A CG 1 ATOM 3276 O OD1 . ASP A 1 424 ? 39.839 47.652 19.816 1.00 52.97 ? 459 ASP A OD1 1 ATOM 3277 O OD2 . ASP A 1 424 ? 40.072 47.457 17.644 1.00 41.42 ? 459 ASP A OD2 1 ATOM 3278 N N . VAL A 1 425 ? 41.190 42.658 20.624 1.00 56.23 ? 460 VAL A N 1 ATOM 3279 C CA . VAL A 1 425 ? 41.082 41.212 20.838 1.00 60.31 ? 460 VAL A CA 1 ATOM 3280 C C . VAL A 1 425 ? 41.517 40.826 22.261 1.00 69.39 ? 460 VAL A C 1 ATOM 3281 O O . VAL A 1 425 ? 42.565 41.272 22.746 1.00 59.94 ? 460 VAL A O 1 ATOM 3282 C CB . VAL A 1 425 ? 41.866 40.412 19.765 1.00 56.22 ? 460 VAL A CB 1 ATOM 3283 C CG1 . VAL A 1 425 ? 41.952 38.930 20.125 1.00 48.53 ? 460 VAL A CG1 1 ATOM 3284 C CG2 . VAL A 1 425 ? 41.213 40.591 18.400 1.00 45.04 ? 460 VAL A CG2 1 ATOM 3285 N N . TYR A 1 426 ? 40.692 40.013 22.926 1.00 69.51 ? 461 TYR A N 1 ATOM 3286 C CA . TYR A 1 426 ? 40.917 39.640 24.323 1.00 69.97 ? 461 TYR A CA 1 ATOM 3287 C C . TYR A 1 426 ? 41.122 38.135 24.516 1.00 71.63 ? 461 TYR A C 1 ATOM 3288 O O . TYR A 1 426 ? 40.176 37.412 24.836 1.00 66.86 ? 461 TYR A O 1 ATOM 3289 C CB . TYR A 1 426 ? 39.738 40.089 25.192 1.00 69.08 ? 461 TYR A CB 1 ATOM 3290 C CG . TYR A 1 426 ? 39.369 41.554 25.071 1.00 74.14 ? 461 TYR A CG 1 ATOM 3291 C CD1 . TYR A 1 426 ? 40.072 42.531 25.771 1.00 70.08 ? 461 TYR A CD1 1 ATOM 3292 C CD2 . TYR A 1 426 ? 38.298 41.957 24.276 1.00 71.57 ? 461 TYR A CD2 1 ATOM 3293 C CE1 . TYR A 1 426 ? 39.729 43.868 25.670 1.00 70.47 ? 461 TYR A CE1 1 ATOM 3294 C CE2 . TYR A 1 426 ? 37.948 43.290 24.170 1.00 71.28 ? 461 TYR A CE2 1 ATOM 3295 C CZ . TYR A 1 426 ? 38.666 44.241 24.868 1.00 72.57 ? 461 TYR A CZ 1 ATOM 3296 O OH . TYR A 1 426 ? 38.316 45.569 24.763 1.00 76.24 ? 461 TYR A OH 1 ATOM 3297 N N . LYS A 1 427 ? 42.354 37.667 24.334 1.00 71.87 ? 462 LYS A N 1 ATOM 3298 C CA . LYS A 1 427 ? 42.678 36.264 24.577 1.00 68.73 ? 462 LYS A CA 1 ATOM 3299 C C . LYS A 1 427 ? 42.795 36.014 26.080 1.00 75.54 ? 462 LYS A C 1 ATOM 3300 O O . LYS A 1 427 ? 43.022 36.945 26.855 1.00 78.33 ? 462 LYS A O 1 ATOM 3301 C CB . LYS A 1 427 ? 43.975 35.874 23.863 1.00 71.74 ? 462 LYS A CB 1 ATOM 3302 N N . LYS A 1 428 ? 42.635 34.760 26.493 1.00 77.60 ? 463 LYS A N 1 ATOM 3303 C CA . LYS A 1 428 ? 42.673 34.428 27.915 1.00 77.82 ? 463 LYS A CA 1 ATOM 3304 C C . LYS A 1 428 ? 43.965 33.700 28.289 1.00 79.55 ? 463 LYS A C 1 ATOM 3305 O O . LYS A 1 428 ? 45.006 33.890 27.657 1.00 76.43 ? 463 LYS A O 1 ATOM 3306 C CB . LYS A 1 428 ? 41.455 33.585 28.310 1.00 70.44 ? 463 LYS A CB 1 ATOM 3307 C CG . LYS A 1 428 ? 40.126 34.061 27.722 1.00 68.51 ? 463 LYS A CG 1 ATOM 3308 C CD . LYS A 1 428 ? 39.836 35.532 28.023 1.00 68.27 ? 463 LYS A CD 1 ATOM 3309 C CE . LYS A 1 428 ? 38.586 36.004 27.281 1.00 65.47 ? 463 LYS A CE 1 ATOM 3310 N NZ . LYS A 1 428 ? 38.418 37.485 27.285 1.00 65.81 ? 463 LYS A NZ 1 ATOM 3311 N N . CYS A 1 433 ? 40.494 32.474 23.521 1.00 49.25 ? 468 CYS A N 1 ATOM 3312 C CA . CYS A 1 433 ? 39.374 33.405 23.553 1.00 43.40 ? 468 CYS A CA 1 ATOM 3313 C C . CYS A 1 433 ? 38.039 32.680 23.711 1.00 36.12 ? 468 CYS A C 1 ATOM 3314 O O . CYS A 1 433 ? 37.966 31.454 23.642 1.00 38.06 ? 468 CYS A O 1 ATOM 3315 C CB . CYS A 1 433 ? 39.350 34.251 22.287 1.00 51.78 ? 468 CYS A CB 1 ATOM 3316 S SG . CYS A 1 433 ? 38.885 33.304 20.825 1.00 46.24 ? 468 CYS A SG 1 ATOM 3317 N N . PHE A 1 434 ? 36.979 33.455 23.894 1.00 36.46 ? 469 PHE A N 1 ATOM 3318 C CA . PHE A 1 434 ? 35.688 32.898 24.279 1.00 42.38 ? 469 PHE A CA 1 ATOM 3319 C C . PHE A 1 434 ? 34.819 32.413 23.134 1.00 41.81 ? 469 PHE A C 1 ATOM 3320 O O . PHE A 1 434 ? 33.762 31.838 23.365 1.00 44.06 ? 469 PHE A O 1 ATOM 3321 C CB . PHE A 1 434 ? 34.917 33.888 25.151 1.00 51.47 ? 469 PHE A CB 1 ATOM 3322 C CG . PHE A 1 434 ? 35.384 33.911 26.572 1.00 49.63 ? 469 PHE A CG 1 ATOM 3323 C CD1 . PHE A 1 434 ? 36.222 32.912 27.051 1.00 53.52 ? 469 PHE A CD1 1 ATOM 3324 C CD2 . PHE A 1 434 ? 34.993 34.923 27.432 1.00 60.93 ? 469 PHE A CD2 1 ATOM 3325 C CE1 . PHE A 1 434 ? 36.666 32.922 28.363 1.00 51.84 ? 469 PHE A CE1 1 ATOM 3326 C CE2 . PHE A 1 434 ? 35.429 34.939 28.748 1.00 61.96 ? 469 PHE A CE2 1 ATOM 3327 C CZ . PHE A 1 434 ? 36.266 33.936 29.213 1.00 58.03 ? 469 PHE A CZ 1 ATOM 3328 N N . PHE A 1 435 ? 35.274 32.610 21.904 1.00 31.53 ? 470 PHE A N 1 ATOM 3329 C CA . PHE A 1 435 ? 34.476 32.207 20.745 1.00 27.85 ? 470 PHE A CA 1 ATOM 3330 C C . PHE A 1 435 ? 35.251 31.308 19.800 1.00 28.50 ? 470 PHE A C 1 ATOM 3331 O O . PHE A 1 435 ? 36.474 31.439 19.665 1.00 31.06 ? 470 PHE A O 1 ATOM 3332 C CB . PHE A 1 435 ? 33.950 33.442 20.004 1.00 26.57 ? 470 PHE A CB 1 ATOM 3333 C CG . PHE A 1 435 ? 35.006 34.205 19.283 1.00 31.18 ? 470 PHE A CG 1 ATOM 3334 C CD1 . PHE A 1 435 ? 35.355 33.873 17.980 1.00 31.14 ? 470 PHE A CD1 1 ATOM 3335 C CD2 . PHE A 1 435 ? 35.663 35.252 19.906 1.00 34.43 ? 470 PHE A CD2 1 ATOM 3336 C CE1 . PHE A 1 435 ? 36.342 34.566 17.315 1.00 29.57 ? 470 PHE A CE1 1 ATOM 3337 C CE2 . PHE A 1 435 ? 36.655 35.951 19.237 1.00 35.14 ? 470 PHE A CE2 1 ATOM 3338 C CZ . PHE A 1 435 ? 36.990 35.603 17.942 1.00 29.31 ? 470 PHE A CZ 1 ATOM 3339 N N . GLN A 1 436 ? 34.542 30.389 19.152 1.00 20.57 ? 471 GLN A N 1 ATOM 3340 C CA . GLN A 1 436 ? 35.151 29.507 18.171 1.00 24.70 ? 471 GLN A CA 1 ATOM 3341 C C . GLN A 1 436 ? 34.375 29.474 16.856 1.00 18.72 ? 471 GLN A C 1 ATOM 3342 O O . GLN A 1 436 ? 34.741 28.757 15.944 1.00 19.13 ? 471 GLN A O 1 ATOM 3343 C CB . GLN A 1 436 ? 35.271 28.092 18.742 1.00 25.49 ? 471 GLN A CB 1 ATOM 3344 C CG . GLN A 1 436 ? 36.122 28.048 20.017 1.00 29.20 ? 471 GLN A CG 1 ATOM 3345 C CD . GLN A 1 436 ? 36.056 26.714 20.724 1.00 37.54 ? 471 GLN A CD 1 ATOM 3346 O OE1 . GLN A 1 436 ? 35.566 26.621 21.857 1.00 45.94 ? 471 GLN A OE1 1 ATOM 3347 N NE2 . GLN A 1 436 ? 36.565 25.670 20.070 1.00 36.84 ? 471 GLN A NE2 1 ATOM 3348 N N . GLY A 1 437 ? 33.272 30.214 16.788 1.00 20.62 ? 472 GLY A N 1 ATOM 3349 C CA . GLY A 1 437 ? 32.481 30.261 15.576 1.00 19.27 ? 472 GLY A CA 1 ATOM 3350 C C . GLY A 1 437 ? 32.049 31.685 15.242 1.00 18.88 ? 472 GLY A C 1 ATOM 3351 O O . GLY A 1 437 ? 31.887 32.509 16.137 1.00 19.05 ? 472 GLY A O 1 ATOM 3352 N N . ASP A 1 438 ? 31.850 31.970 13.959 1.00 19.22 ? 473 ASP A N 1 ATOM 3353 C CA . ASP A 1 438 ? 31.269 33.254 13.560 1.00 15.92 ? 473 ASP A CA 1 ATOM 3354 C C . ASP A 1 438 ? 30.777 33.147 12.119 1.00 16.36 ? 473 ASP A C 1 ATOM 3355 O O . ASP A 1 438 ? 31.005 32.146 11.446 1.00 16.87 ? 473 ASP A O 1 ATOM 3356 C CB . ASP A 1 438 ? 32.294 34.398 13.686 1.00 15.93 ? 473 ASP A CB 1 ATOM 3357 C CG . ASP A 1 438 ? 31.643 35.760 13.889 1.00 19.35 ? 473 ASP A CG 1 ATOM 3358 O OD1 . ASP A 1 438 ? 30.390 35.860 13.838 1.00 18.31 ? 473 ASP A OD1 1 ATOM 3359 O OD2 . ASP A 1 438 ? 32.394 36.751 14.082 1.00 21.18 ? 473 ASP A OD2 1 ATOM 3360 N N . HIS A 1 439 ? 30.114 34.197 11.642 1.00 14.36 ? 474 HIS A N 1 ATOM 3361 C CA . HIS A 1 439 ? 29.528 34.181 10.307 1.00 14.78 ? 474 HIS A CA 1 ATOM 3362 C C . HIS A 1 439 ? 29.476 35.635 9.865 1.00 14.93 ? 474 HIS A C 1 ATOM 3363 O O . HIS A 1 439 ? 29.699 36.524 10.681 1.00 14.80 ? 474 HIS A O 1 ATOM 3364 C CB . HIS A 1 439 ? 28.097 33.613 10.401 1.00 15.77 ? 474 HIS A CB 1 ATOM 3365 C CG . HIS A 1 439 ? 27.284 34.236 11.493 1.00 17.53 ? 474 HIS A CG 1 ATOM 3366 N ND1 . HIS A 1 439 ? 26.522 35.367 11.304 1.00 15.65 ? 474 HIS A ND1 1 ATOM 3367 C CD2 . HIS A 1 439 ? 27.140 33.898 12.797 1.00 15.80 ? 474 HIS A CD2 1 ATOM 3368 C CE1 . HIS A 1 439 ? 25.951 35.707 12.446 1.00 19.33 ? 474 HIS A CE1 1 ATOM 3369 N NE2 . HIS A 1 439 ? 26.302 34.828 13.365 1.00 18.77 ? 474 HIS A NE2 1 ATOM 3370 N N . GLY A 1 440 ? 29.176 35.879 8.594 1.00 15.23 ? 475 GLY A N 1 ATOM 3371 C CA . GLY A 1 440 ? 29.167 37.237 8.057 1.00 15.76 ? 475 GLY A CA 1 ATOM 3372 C C . GLY A 1 440 ? 29.810 37.303 6.688 1.00 16.46 ? 475 GLY A C 1 ATOM 3373 O O . GLY A 1 440 ? 29.596 38.258 5.928 1.00 15.98 ? 475 GLY A O 1 ATOM 3374 N N . PHE A 1 441 ? 30.570 36.257 6.366 1.00 15.28 ? 476 PHE A N 1 ATOM 3375 C CA . PHE A 1 441 ? 31.368 36.176 5.137 1.00 17.61 ? 476 PHE A CA 1 ATOM 3376 C C . PHE A 1 441 ? 30.531 36.172 3.861 1.00 15.46 ? 476 PHE A C 1 ATOM 3377 O O . PHE A 1 441 ? 29.321 35.939 3.906 1.00 14.66 ? 476 PHE A O 1 ATOM 3378 C CB . PHE A 1 441 ? 32.168 34.859 5.135 1.00 16.81 ? 476 PHE A CB 1 ATOM 3379 C CG . PHE A 1 441 ? 33.077 34.686 6.315 1.00 14.48 ? 476 PHE A CG 1 ATOM 3380 C CD1 . PHE A 1 441 ? 34.254 35.430 6.403 1.00 17.78 ? 476 PHE A CD1 1 ATOM 3381 C CD2 . PHE A 1 441 ? 32.788 33.761 7.308 1.00 16.15 ? 476 PHE A CD2 1 ATOM 3382 C CE1 . PHE A 1 441 ? 35.114 35.259 7.471 1.00 17.63 ? 476 PHE A CE1 1 ATOM 3383 C CE2 . PHE A 1 441 ? 33.615 33.594 8.397 1.00 16.09 ? 476 PHE A CE2 1 ATOM 3384 C CZ . PHE A 1 441 ? 34.801 34.335 8.479 1.00 16.77 ? 476 PHE A CZ 1 ATOM 3385 N N . ASP A 1 442 ? 31.211 36.401 2.743 1.00 15.41 ? 477 ASP A N 1 ATOM 3386 C CA . ASP A 1 442 ? 30.693 36.200 1.372 1.00 13.90 ? 477 ASP A CA 1 ATOM 3387 C C . ASP A 1 442 ? 29.628 35.101 1.354 1.00 18.61 ? 477 ASP A C 1 ATOM 3388 O O . ASP A 1 442 ? 29.895 33.961 1.772 1.00 16.10 ? 477 ASP A O 1 ATOM 3389 C CB . ASP A 1 442 ? 31.881 35.812 0.489 1.00 16.32 ? 477 ASP A CB 1 ATOM 3390 C CG . ASP A 1 442 ? 31.543 35.757 -0.990 1.00 18.68 ? 477 ASP A CG 1 ATOM 3391 O OD1 . ASP A 1 442 ? 30.373 35.536 -1.354 1.00 20.90 ? 477 ASP A OD1 1 ATOM 3392 O OD2 . ASP A 1 442 ? 32.476 35.917 -1.793 1.00 21.48 ? 477 ASP A OD2 1 ATOM 3393 N N . ASN A 1 443 ? 28.418 35.440 0.895 1.00 15.48 ? 478 ASN A N 1 ATOM 3394 C CA . ASN A 1 443 ? 27.306 34.472 0.901 1.00 16.58 ? 478 ASN A CA 1 ATOM 3395 C C . ASN A 1 443 ? 27.443 33.262 -0.029 1.00 19.59 ? 478 ASN A C 1 ATOM 3396 O O . ASN A 1 443 ? 26.559 32.414 -0.060 1.00 20.96 ? 478 ASN A O 1 ATOM 3397 C CB . ASN A 1 443 ? 25.944 35.170 0.675 1.00 17.06 ? 478 ASN A CB 1 ATOM 3398 C CG . ASN A 1 443 ? 25.798 35.734 -0.735 1.00 16.77 ? 478 ASN A CG 1 ATOM 3399 O OD1 . ASN A 1 443 ? 26.786 35.999 -1.409 1.00 18.19 ? 478 ASN A OD1 1 ATOM 3400 N ND2 . ASN A 1 443 ? 24.553 35.926 -1.181 1.00 15.30 ? 478 ASN A ND2 1 ATOM 3401 N N . LYS A 1 444 ? 28.537 33.137 -0.768 1.00 18.78 ? 479 LYS A N 1 ATOM 3402 C CA . LYS A 1 444 ? 28.713 31.881 -1.519 1.00 21.76 ? 479 LYS A CA 1 ATOM 3403 C C . LYS A 1 444 ? 29.589 30.865 -0.785 1.00 22.95 ? 479 LYS A C 1 ATOM 3404 O O . LYS A 1 444 ? 29.731 29.719 -1.226 1.00 24.08 ? 479 LYS A O 1 ATOM 3405 C CB . LYS A 1 444 ? 29.215 32.116 -2.942 1.00 22.88 ? 479 LYS A CB 1 ATOM 3406 C CG . LYS A 1 444 ? 30.686 32.481 -3.071 1.00 21.93 ? 479 LYS A CG 1 ATOM 3407 C CD . LYS A 1 444 ? 31.076 32.346 -4.561 1.00 27.34 ? 479 LYS A CD 1 ATOM 3408 C CE . LYS A 1 444 ? 32.496 32.774 -4.840 1.00 29.00 ? 479 LYS A CE 1 ATOM 3409 N NZ . LYS A 1 444 ? 33.493 31.906 -4.154 1.00 34.10 ? 479 LYS A NZ 1 ATOM 3410 N N . VAL A 1 445 ? 30.157 31.290 0.336 1.00 19.71 ? 480 VAL A N 1 ATOM 3411 C CA . VAL A 1 445 ? 30.973 30.412 1.189 1.00 20.34 ? 480 VAL A CA 1 ATOM 3412 C C . VAL A 1 445 ? 30.141 29.254 1.734 1.00 19.83 ? 480 VAL A C 1 ATOM 3413 O O . VAL A 1 445 ? 29.055 29.459 2.254 1.00 15.55 ? 480 VAL A O 1 ATOM 3414 C CB . VAL A 1 445 ? 31.607 31.223 2.346 1.00 17.56 ? 480 VAL A CB 1 ATOM 3415 C CG1 . VAL A 1 445 ? 32.135 30.315 3.431 1.00 23.21 ? 480 VAL A CG1 1 ATOM 3416 C CG2 . VAL A 1 445 ? 32.713 32.142 1.797 1.00 21.17 ? 480 VAL A CG2 1 ATOM 3417 N N . ASN A 1 446 ? 30.632 28.026 1.597 1.00 20.75 ? 481 ASN A N 1 ATOM 3418 C CA . ASN A 1 446 ? 29.816 26.874 2.007 1.00 22.51 ? 481 ASN A CA 1 ATOM 3419 C C . ASN A 1 446 ? 29.334 26.919 3.444 1.00 17.62 ? 481 ASN A C 1 ATOM 3420 O O . ASN A 1 446 ? 28.172 26.606 3.722 1.00 20.38 ? 481 ASN A O 1 ATOM 3421 C CB . ASN A 1 446 ? 30.530 25.538 1.742 1.00 26.13 ? 481 ASN A CB 1 ATOM 3422 C CG . ASN A 1 446 ? 30.386 25.078 0.302 1.00 39.66 ? 481 ASN A CG 1 ATOM 3423 O OD1 . ASN A 1 446 ? 29.528 25.571 -0.441 1.00 43.03 ? 481 ASN A OD1 1 ATOM 3424 N ND2 . ASN A 1 446 ? 31.226 24.122 -0.102 1.00 41.82 ? 481 ASN A ND2 1 ATOM 3425 N N . SER A 1 447 ? 30.217 27.301 4.361 1.00 15.67 ? 482 SER A N 1 ATOM 3426 C CA . SER A 1 447 ? 29.863 27.311 5.764 1.00 16.40 ? 482 SER A CA 1 ATOM 3427 C C . SER A 1 447 ? 28.760 28.331 6.081 1.00 17.16 ? 482 SER A C 1 ATOM 3428 O O . SER A 1 447 ? 28.171 28.272 7.141 1.00 16.33 ? 482 SER A O 1 ATOM 3429 C CB . SER A 1 447 ? 31.109 27.585 6.628 1.00 19.11 ? 482 SER A CB 1 ATOM 3430 O OG . SER A 1 447 ? 31.736 28.807 6.240 1.00 18.52 ? 482 SER A OG 1 ATOM 3431 N N . MET A 1 448 ? 28.518 29.282 5.178 1.00 15.34 ? 483 MET A N 1 ATOM 3432 C CA . MET A 1 448 ? 27.450 30.269 5.418 1.00 16.19 ? 483 MET A CA 1 ATOM 3433 C C . MET A 1 448 ? 26.073 29.841 4.975 1.00 15.64 ? 483 MET A C 1 ATOM 3434 O O . MET A 1 448 ? 25.081 30.499 5.322 1.00 17.58 ? 483 MET A O 1 ATOM 3435 C CB . MET A 1 448 ? 27.787 31.606 4.760 1.00 13.95 ? 483 MET A CB 1 ATOM 3436 C CG . MET A 1 448 ? 29.089 32.195 5.271 1.00 11.38 ? 483 MET A CG 1 ATOM 3437 S SD . MET A 1 448 ? 28.927 32.688 7.002 1.00 16.18 ? 483 MET A SD 1 ATOM 3438 C CE . MET A 1 448 ? 29.723 31.355 7.888 1.00 15.44 ? 483 MET A CE 1 ATOM 3439 N N . GLN A 1 449 ? 26.000 28.763 4.191 1.00 14.85 ? 484 GLN A N 1 ATOM 3440 C CA . GLN A 1 449 ? 24.704 28.278 3.707 1.00 14.04 ? 484 GLN A CA 1 ATOM 3441 C C . GLN A 1 449 ? 23.813 27.817 4.853 1.00 17.78 ? 484 GLN A C 1 ATOM 3442 O O . GLN A 1 449 ? 24.292 27.340 5.897 1.00 20.07 ? 484 GLN A O 1 ATOM 3443 C CB . GLN A 1 449 ? 24.884 27.157 2.679 1.00 18.67 ? 484 GLN A CB 1 ATOM 3444 C CG . GLN A 1 449 ? 25.848 27.520 1.501 1.00 19.41 ? 484 GLN A CG 1 ATOM 3445 C CD . GLN A 1 449 ? 25.534 28.864 0.852 1.00 20.70 ? 484 GLN A CD 1 ATOM 3446 O OE1 . GLN A 1 449 ? 24.459 29.058 0.284 1.00 15.91 ? 484 GLN A OE1 1 ATOM 3447 N NE2 . GLN A 1 449 ? 26.483 29.797 0.926 1.00 18.00 ? 484 GLN A NE2 1 ATOM 3448 N N . THR A 1 450 ? 22.510 27.964 4.665 1.00 17.10 ? 485 THR A N 1 ATOM 3449 C CA . THR A 1 450 ? 21.584 27.661 5.739 1.00 14.27 ? 485 THR A CA 1 ATOM 3450 C C . THR A 1 450 ? 20.509 26.699 5.242 1.00 18.10 ? 485 THR A C 1 ATOM 3451 O O . THR A 1 450 ? 20.653 26.133 4.153 1.00 20.94 ? 485 THR A O 1 ATOM 3452 C CB . THR A 1 450 ? 20.998 28.949 6.409 1.00 18.75 ? 485 THR A CB 1 ATOM 3453 O OG1 . THR A 1 450 ? 20.357 28.591 7.631 1.00 18.42 ? 485 THR A OG1 1 ATOM 3454 C CG2 . THR A 1 450 ? 20.014 29.669 5.499 1.00 18.89 ? 485 THR A CG2 1 ATOM 3455 N N . VAL A 1 451 ? 19.462 26.492 6.038 1.00 18.55 ? 486 VAL A N 1 ATOM 3456 C CA . VAL A 1 451 ? 18.517 25.403 5.799 1.00 19.16 ? 486 VAL A CA 1 ATOM 3457 C C . VAL A 1 451 ? 17.188 25.912 5.236 1.00 23.60 ? 486 VAL A C 1 ATOM 3458 O O . VAL A 1 451 ? 16.775 27.050 5.525 1.00 18.18 ? 486 VAL A O 1 ATOM 3459 C CB . VAL A 1 451 ? 18.285 24.611 7.106 1.00 21.60 ? 486 VAL A CB 1 ATOM 3460 C CG1 . VAL A 1 451 ? 17.674 25.511 8.193 1.00 20.27 ? 486 VAL A CG1 1 ATOM 3461 C CG2 . VAL A 1 451 ? 17.422 23.374 6.887 1.00 31.04 ? 486 VAL A CG2 1 ATOM 3462 N N . PHE A 1 452 ? 16.559 25.088 4.393 1.00 19.44 ? 487 PHE A N 1 ATOM 3463 C CA . PHE A 1 452 ? 15.152 25.252 4.020 1.00 17.57 ? 487 PHE A CA 1 ATOM 3464 C C . PHE A 1 452 ? 14.440 23.901 3.914 1.00 19.46 ? 487 PHE A C 1 ATOM 3465 O O . PHE A 1 452 ? 14.892 23.009 3.189 1.00 21.69 ? 487 PHE A O 1 ATOM 3466 C CB . PHE A 1 452 ? 14.946 25.977 2.674 1.00 19.93 ? 487 PHE A CB 1 ATOM 3467 C CG . PHE A 1 452 ? 13.505 25.954 2.222 1.00 22.12 ? 487 PHE A CG 1 ATOM 3468 C CD1 . PHE A 1 452 ? 12.615 26.894 2.700 1.00 23.23 ? 487 PHE A CD1 1 ATOM 3469 C CD2 . PHE A 1 452 ? 13.025 24.953 1.393 1.00 21.17 ? 487 PHE A CD2 1 ATOM 3470 C CE1 . PHE A 1 452 ? 11.291 26.855 2.353 1.00 21.52 ? 487 PHE A CE1 1 ATOM 3471 C CE2 . PHE A 1 452 ? 11.705 24.917 1.037 1.00 24.53 ? 487 PHE A CE2 1 ATOM 3472 C CZ . PHE A 1 452 ? 10.836 25.874 1.513 1.00 24.78 ? 487 PHE A CZ 1 ATOM 3473 N N . VAL A 1 453 ? 13.316 23.791 4.619 1.00 19.37 ? 488 VAL A N 1 ATOM 3474 C CA . VAL A 1 453 ? 12.371 22.699 4.490 1.00 19.01 ? 488 VAL A CA 1 ATOM 3475 C C . VAL A 1 453 ? 10.966 23.276 4.458 1.00 22.24 ? 488 VAL A C 1 ATOM 3476 O O . VAL A 1 453 ? 10.625 24.155 5.263 1.00 19.74 ? 488 VAL A O 1 ATOM 3477 C CB . VAL A 1 453 ? 12.436 21.757 5.698 1.00 17.28 ? 488 VAL A CB 1 ATOM 3478 C CG1 . VAL A 1 453 ? 11.335 20.671 5.594 1.00 18.92 ? 488 VAL A CG1 1 ATOM 3479 C CG2 . VAL A 1 453 ? 13.837 21.157 5.833 1.00 18.24 ? 488 VAL A CG2 1 ATOM 3480 N N . GLY A 1 454 ? 10.160 22.800 3.515 1.00 19.18 ? 489 GLY A N 1 ATOM 3481 C CA . GLY A 1 454 ? 8.741 23.118 3.487 1.00 23.47 ? 489 GLY A CA 1 ATOM 3482 C C . GLY A 1 454 ? 7.960 21.825 3.700 1.00 24.79 ? 489 GLY A C 1 ATOM 3483 O O . GLY A 1 454 ? 8.255 20.818 3.052 1.00 22.25 ? 489 GLY A O 1 ATOM 3484 N N . TYR A 1 455 ? 6.997 21.841 4.615 1.00 20.51 ? 490 TYR A N 1 ATOM 3485 C CA . TYR A 1 455 ? 6.170 20.666 4.881 1.00 21.84 ? 490 TYR A CA 1 ATOM 3486 C C . TYR A 1 455 ? 4.707 21.055 4.974 1.00 28.43 ? 490 TYR A C 1 ATOM 3487 O O . TYR A 1 455 ? 4.335 21.989 5.706 1.00 24.21 ? 490 TYR A O 1 ATOM 3488 C CB . TYR A 1 455 ? 6.615 20.009 6.185 1.00 22.87 ? 490 TYR A CB 1 ATOM 3489 C CG . TYR A 1 455 ? 5.809 18.802 6.636 1.00 26.29 ? 490 TYR A CG 1 ATOM 3490 C CD1 . TYR A 1 455 ? 4.638 18.951 7.390 1.00 25.68 ? 490 TYR A CD1 1 ATOM 3491 C CD2 . TYR A 1 455 ? 6.240 17.512 6.348 1.00 24.35 ? 490 TYR A CD2 1 ATOM 3492 C CE1 . TYR A 1 455 ? 3.894 17.839 7.822 1.00 26.64 ? 490 TYR A CE1 1 ATOM 3493 C CE2 . TYR A 1 455 ? 5.511 16.398 6.772 1.00 27.13 ? 490 TYR A CE2 1 ATOM 3494 C CZ . TYR A 1 455 ? 4.344 16.564 7.505 1.00 31.02 ? 490 TYR A CZ 1 ATOM 3495 O OH . TYR A 1 455 ? 3.645 15.451 7.933 1.00 30.20 ? 490 TYR A OH 1 ATOM 3496 N N . GLY A 1 456 ? 3.865 20.332 4.249 1.00 24.32 ? 491 GLY A N 1 ATOM 3497 C CA . GLY A 1 456 ? 2.438 20.588 4.317 1.00 25.79 ? 491 GLY A CA 1 ATOM 3498 C C . GLY A 1 456 ? 1.735 20.385 2.999 1.00 26.26 ? 491 GLY A C 1 ATOM 3499 O O . GLY A 1 456 ? 2.366 20.026 2.010 1.00 28.25 ? 491 GLY A O 1 ATOM 3500 N N . PRO A 1 457 ? 0.412 20.626 2.978 1.00 24.64 ? 492 PRO A N 1 ATOM 3501 C CA . PRO A 1 457 ? -0.434 20.323 1.819 1.00 28.90 ? 492 PRO A CA 1 ATOM 3502 C C . PRO A 1 457 ? -0.018 21.033 0.545 1.00 30.17 ? 492 PRO A C 1 ATOM 3503 O O . PRO A 1 457 ? -0.212 20.506 -0.551 1.00 30.10 ? 492 PRO A O 1 ATOM 3504 C CB . PRO A 1 457 ? -1.826 20.803 2.256 1.00 26.80 ? 492 PRO A CB 1 ATOM 3505 C CG . PRO A 1 457 ? -1.594 21.721 3.432 1.00 26.97 ? 492 PRO A CG 1 ATOM 3506 C CD . PRO A 1 457 ? -0.359 21.175 4.107 1.00 25.67 ? 492 PRO A CD 1 ATOM 3507 N N . THR A 1 458 ? 0.543 22.230 0.673 1.00 27.78 ? 493 THR A N 1 ATOM 3508 C CA . THR A 1 458 ? 0.871 22.996 -0.515 1.00 24.75 ? 493 THR A CA 1 ATOM 3509 C C . THR A 1 458 ? 2.269 22.673 -1.029 1.00 21.58 ? 493 THR A C 1 ATOM 3510 O O . THR A 1 458 ? 2.579 22.958 -2.188 1.00 24.68 ? 493 THR A O 1 ATOM 3511 C CB . THR A 1 458 ? 0.731 24.507 -0.269 1.00 28.60 ? 493 THR A CB 1 ATOM 3512 O OG1 . THR A 1 458 ? -0.429 24.751 0.536 1.00 31.78 ? 493 THR A OG1 1 ATOM 3513 C CG2 . THR A 1 458 ? 0.617 25.259 -1.583 1.00 31.50 ? 493 THR A CG2 1 ATOM 3514 N N . PHE A 1 459 ? 3.112 22.103 -0.171 1.00 26.49 ? 494 PHE A N 1 ATOM 3515 C CA . PHE A 1 459 ? 4.449 21.686 -0.589 1.00 23.51 ? 494 PHE A CA 1 ATOM 3516 C C . PHE A 1 459 ? 4.419 20.298 -1.224 1.00 28.31 ? 494 PHE A C 1 ATOM 3517 O O . PHE A 1 459 ? 3.474 19.546 -1.044 1.00 30.11 ? 494 PHE A O 1 ATOM 3518 C CB . PHE A 1 459 ? 5.427 21.711 0.589 1.00 20.75 ? 494 PHE A CB 1 ATOM 3519 C CG . PHE A 1 459 ? 5.848 23.110 0.978 1.00 17.91 ? 494 PHE A CG 1 ATOM 3520 C CD1 . PHE A 1 459 ? 6.669 23.855 0.141 1.00 21.99 ? 494 PHE A CD1 1 ATOM 3521 C CD2 . PHE A 1 459 ? 5.419 23.668 2.165 1.00 22.90 ? 494 PHE A CD2 1 ATOM 3522 C CE1 . PHE A 1 459 ? 7.045 25.143 0.487 1.00 22.93 ? 494 PHE A CE1 1 ATOM 3523 C CE2 . PHE A 1 459 ? 5.786 24.956 2.508 1.00 24.23 ? 494 PHE A CE2 1 ATOM 3524 C CZ . PHE A 1 459 ? 6.602 25.685 1.674 1.00 23.60 ? 494 PHE A CZ 1 ATOM 3525 N N . LYS A 1 460 ? 5.453 19.958 -1.973 1.00 26.93 ? 495 LYS A N 1 ATOM 3526 C CA . LYS A 1 460 ? 5.509 18.615 -2.529 1.00 31.45 ? 495 LYS A CA 1 ATOM 3527 C C . LYS A 1 460 ? 5.847 17.596 -1.446 1.00 31.75 ? 495 LYS A C 1 ATOM 3528 O O . LYS A 1 460 ? 6.234 17.949 -0.329 1.00 30.05 ? 495 LYS A O 1 ATOM 3529 C CB . LYS A 1 460 ? 6.487 18.547 -3.697 1.00 26.08 ? 495 LYS A CB 1 ATOM 3530 C CG . LYS A 1 460 ? 6.026 19.369 -4.895 1.00 26.53 ? 495 LYS A CG 1 ATOM 3531 C CD . LYS A 1 460 ? 6.926 19.176 -6.089 1.00 32.14 ? 495 LYS A CD 1 ATOM 3532 C CE . LYS A 1 460 ? 6.334 19.845 -7.332 1.00 31.63 ? 495 LYS A CE 1 ATOM 3533 N NZ . LYS A 1 460 ? 7.320 19.856 -8.447 1.00 40.16 ? 495 LYS A NZ 1 ATOM 3534 N N . TYR A 1 461 ? 5.680 16.325 -1.784 1.00 27.90 ? 496 TYR A N 1 ATOM 3535 C CA . TYR A 1 461 ? 5.940 15.229 -0.870 1.00 27.99 ? 496 TYR A CA 1 ATOM 3536 C C . TYR A 1 461 ? 7.253 14.541 -1.260 1.00 25.44 ? 496 TYR A C 1 ATOM 3537 O O . TYR A 1 461 ? 7.473 14.253 -2.434 1.00 29.66 ? 496 TYR A O 1 ATOM 3538 C CB . TYR A 1 461 ? 4.757 14.262 -0.963 1.00 33.22 ? 496 TYR A CB 1 ATOM 3539 C CG . TYR A 1 461 ? 4.932 12.912 -0.319 1.00 33.06 ? 496 TYR A CG 1 ATOM 3540 C CD1 . TYR A 1 461 ? 4.847 12.758 1.061 1.00 33.60 ? 496 TYR A CD1 1 ATOM 3541 C CD2 . TYR A 1 461 ? 5.125 11.776 -1.098 1.00 35.37 ? 496 TYR A CD2 1 ATOM 3542 C CE1 . TYR A 1 461 ? 4.974 11.516 1.644 1.00 35.41 ? 496 TYR A CE1 1 ATOM 3543 C CE2 . TYR A 1 461 ? 5.261 10.535 -0.522 1.00 33.35 ? 496 TYR A CE2 1 ATOM 3544 C CZ . TYR A 1 461 ? 5.180 10.406 0.847 1.00 33.66 ? 496 TYR A CZ 1 ATOM 3545 O OH . TYR A 1 461 ? 5.314 9.157 1.415 1.00 40.67 ? 496 TYR A OH 1 ATOM 3546 N N . ARG A 1 462 ? 8.121 14.311 -0.280 1.00 24.82 ? 497 ARG A N 1 ATOM 3547 C CA . ARG A 1 462 ? 9.402 13.628 -0.484 1.00 30.68 ? 497 ARG A CA 1 ATOM 3548 C C . ARG A 1 462 ? 10.152 14.126 -1.717 1.00 34.97 ? 497 ARG A C 1 ATOM 3549 O O . ARG A 1 462 ? 10.499 13.344 -2.614 1.00 29.83 ? 497 ARG A O 1 ATOM 3550 C CB . ARG A 1 462 ? 9.193 12.113 -0.586 1.00 30.55 ? 497 ARG A CB 1 ATOM 3551 C CG . ARG A 1 462 ? 8.648 11.454 0.672 1.00 34.42 ? 497 ARG A CG 1 ATOM 3552 C CD . ARG A 1 462 ? 8.729 9.935 0.550 1.00 30.81 ? 497 ARG A CD 1 ATOM 3553 N NE . ARG A 1 462 ? 8.195 9.251 1.720 1.00 32.99 ? 497 ARG A NE 1 ATOM 3554 C CZ . ARG A 1 462 ? 8.896 8.990 2.817 1.00 37.06 ? 497 ARG A CZ 1 ATOM 3555 N NH1 . ARG A 1 462 ? 10.166 9.369 2.901 1.00 40.29 ? 497 ARG A NH1 1 ATOM 3556 N NH2 . ARG A 1 462 ? 8.328 8.355 3.838 1.00 41.81 ? 497 ARG A NH2 1 ATOM 3557 N N . THR A 1 463 ? 10.389 15.433 -1.773 1.00 27.58 ? 498 THR A N 1 ATOM 3558 C CA . THR A 1 463 ? 10.968 16.040 -2.947 1.00 27.12 ? 498 THR A CA 1 ATOM 3559 C C . THR A 1 463 ? 12.195 16.870 -2.583 1.00 29.90 ? 498 THR A C 1 ATOM 3560 O O . THR A 1 463 ? 12.138 17.680 -1.663 1.00 24.92 ? 498 THR A O 1 ATOM 3561 C CB . THR A 1 463 ? 9.947 16.949 -3.633 1.00 27.13 ? 498 THR A CB 1 ATOM 3562 O OG1 . THR A 1 463 ? 8.873 16.154 -4.153 1.00 31.33 ? 498 THR A OG1 1 ATOM 3563 C CG2 . THR A 1 463 ? 10.591 17.716 -4.763 1.00 27.08 ? 498 THR A CG2 1 ATOM 3564 N N . LYS A 1 464 ? 13.295 16.665 -3.299 1.00 27.10 ? 499 LYS A N 1 ATOM 3565 C CA . LYS A 1 464 ? 14.464 17.518 -3.143 1.00 23.25 ? 499 LYS A CA 1 ATOM 3566 C C . LYS A 1 464 ? 14.488 18.546 -4.259 1.00 25.89 ? 499 LYS A C 1 ATOM 3567 O O . LYS A 1 464 ? 14.221 18.220 -5.410 1.00 24.30 ? 499 LYS A O 1 ATOM 3568 C CB . LYS A 1 464 ? 15.750 16.688 -3.142 1.00 27.91 ? 499 LYS A CB 1 ATOM 3569 C CG . LYS A 1 464 ? 17.000 17.495 -2.798 1.00 29.20 ? 499 LYS A CG 1 ATOM 3570 C CD . LYS A 1 464 ? 18.187 16.603 -2.462 1.00 26.69 ? 499 LYS A CD 1 ATOM 3571 C CE . LYS A 1 464 ? 19.370 17.463 -2.011 1.00 28.49 ? 499 LYS A CE 1 ATOM 3572 N NZ . LYS A 1 464 ? 20.584 16.656 -1.716 1.00 27.99 ? 499 LYS A NZ 1 ATOM 3573 N N . VAL A 1 465 ? 14.794 19.797 -3.917 1.00 22.10 ? 500 VAL A N 1 ATOM 3574 C CA . VAL A 1 465 ? 14.873 20.872 -4.904 1.00 17.81 ? 500 VAL A CA 1 ATOM 3575 C C . VAL A 1 465 ? 16.279 21.456 -4.887 1.00 20.19 ? 500 VAL A C 1 ATOM 3576 O O . VAL A 1 465 ? 16.973 21.338 -3.885 1.00 23.59 ? 500 VAL A O 1 ATOM 3577 C CB . VAL A 1 465 ? 13.835 21.971 -4.595 1.00 23.31 ? 500 VAL A CB 1 ATOM 3578 C CG1 . VAL A 1 465 ? 12.444 21.364 -4.616 1.00 23.93 ? 500 VAL A CG1 1 ATOM 3579 C CG2 . VAL A 1 465 ? 14.120 22.622 -3.203 1.00 21.57 ? 500 VAL A CG2 1 ATOM 3580 N N . PRO A 1 466 ? 16.707 22.093 -5.987 1.00 23.63 ? 501 PRO A N 1 ATOM 3581 C CA . PRO A 1 466 ? 18.080 22.606 -5.935 1.00 23.66 ? 501 PRO A CA 1 ATOM 3582 C C . PRO A 1 466 ? 18.172 23.773 -4.950 1.00 22.40 ? 501 PRO A C 1 ATOM 3583 O O . PRO A 1 466 ? 17.139 24.330 -4.573 1.00 21.60 ? 501 PRO A O 1 ATOM 3584 C CB . PRO A 1 466 ? 18.352 23.069 -7.374 1.00 25.96 ? 501 PRO A CB 1 ATOM 3585 C CG . PRO A 1 466 ? 17.045 23.130 -8.048 1.00 29.46 ? 501 PRO A CG 1 ATOM 3586 C CD . PRO A 1 466 ? 16.103 22.218 -7.324 1.00 26.51 ? 501 PRO A CD 1 ATOM 3587 N N . PRO A 1 467 ? 19.385 24.100 -4.503 1.00 25.60 ? 502 PRO A N 1 ATOM 3588 C CA . PRO A 1 467 ? 19.512 25.226 -3.579 1.00 20.74 ? 502 PRO A CA 1 ATOM 3589 C C . PRO A 1 467 ? 19.043 26.497 -4.271 1.00 21.35 ? 502 PRO A C 1 ATOM 3590 O O . PRO A 1 467 ? 19.073 26.599 -5.500 1.00 23.55 ? 502 PRO A O 1 ATOM 3591 C CB . PRO A 1 467 ? 21.017 25.285 -3.287 1.00 21.25 ? 502 PRO A CB 1 ATOM 3592 C CG . PRO A 1 467 ? 21.669 24.543 -4.413 1.00 29.91 ? 502 PRO A CG 1 ATOM 3593 C CD . PRO A 1 467 ? 20.686 23.491 -4.835 1.00 23.10 ? 502 PRO A CD 1 ATOM 3594 N N . PHE A 1 468 ? 18.571 27.440 -3.477 1.00 18.40 ? 503 PHE A N 1 ATOM 3595 C CA . PHE A 1 468 ? 18.036 28.687 -3.998 1.00 17.62 ? 503 PHE A CA 1 ATOM 3596 C C . PHE A 1 468 ? 18.338 29.773 -2.970 1.00 18.79 ? 503 PHE A C 1 ATOM 3597 O O . PHE A 1 468 ? 18.745 29.474 -1.847 1.00 17.46 ? 503 PHE A O 1 ATOM 3598 C CB . PHE A 1 468 ? 16.526 28.571 -4.233 1.00 20.35 ? 503 PHE A CB 1 ATOM 3599 C CG . PHE A 1 468 ? 15.730 28.298 -2.981 1.00 21.98 ? 503 PHE A CG 1 ATOM 3600 C CD1 . PHE A 1 468 ? 15.312 29.344 -2.149 1.00 20.27 ? 503 PHE A CD1 1 ATOM 3601 C CD2 . PHE A 1 468 ? 15.393 26.999 -2.630 1.00 23.15 ? 503 PHE A CD2 1 ATOM 3602 C CE1 . PHE A 1 468 ? 14.589 29.095 -0.999 1.00 19.17 ? 503 PHE A CE1 1 ATOM 3603 C CE2 . PHE A 1 468 ? 14.652 26.746 -1.471 1.00 21.62 ? 503 PHE A CE2 1 ATOM 3604 C CZ . PHE A 1 468 ? 14.254 27.786 -0.655 1.00 22.20 ? 503 PHE A CZ 1 ATOM 3605 N N . GLU A 1 469 ? 18.090 31.019 -3.356 1.00 18.43 ? 504 GLU A N 1 ATOM 3606 C CA . GLU A 1 469 ? 18.402 32.181 -2.523 1.00 18.22 ? 504 GLU A CA 1 ATOM 3607 C C . GLU A 1 469 ? 17.238 32.620 -1.649 1.00 16.19 ? 504 GLU A C 1 ATOM 3608 O O . GLU A 1 469 ? 16.072 32.550 -2.053 1.00 18.96 ? 504 GLU A O 1 ATOM 3609 C CB . GLU A 1 469 ? 18.834 33.340 -3.423 1.00 15.93 ? 504 GLU A CB 1 ATOM 3610 C CG . GLU A 1 469 ? 20.095 32.984 -4.213 1.00 23.19 ? 504 GLU A CG 1 ATOM 3611 C CD . GLU A 1 469 ? 20.698 34.136 -4.984 1.00 21.22 ? 504 GLU A CD 1 ATOM 3612 O OE1 . GLU A 1 469 ? 19.967 35.106 -5.328 1.00 26.19 ? 504 GLU A OE1 1 ATOM 3613 O OE2 . GLU A 1 469 ? 21.921 34.075 -5.256 1.00 25.48 ? 504 GLU A OE2 1 ATOM 3614 N N . ASN A 1 470 ? 17.548 33.099 -0.446 1.00 17.57 ? 505 ASN A N 1 ATOM 3615 C CA . ASN A 1 470 ? 16.480 33.464 0.467 1.00 16.45 ? 505 ASN A CA 1 ATOM 3616 C C . ASN A 1 470 ? 15.605 34.633 -0.020 1.00 15.27 ? 505 ASN A C 1 ATOM 3617 O O . ASN A 1 470 ? 14.473 34.774 0.431 1.00 17.39 ? 505 ASN A O 1 ATOM 3618 C CB . ASN A 1 470 ? 16.984 33.647 1.910 1.00 18.31 ? 505 ASN A CB 1 ATOM 3619 C CG . ASN A 1 470 ? 17.883 34.859 2.094 1.00 16.43 ? 505 ASN A CG 1 ATOM 3620 O OD1 . ASN A 1 470 ? 18.342 35.473 1.142 1.00 20.36 ? 505 ASN A OD1 1 ATOM 3621 N ND2 . ASN A 1 470 ? 18.146 35.192 3.355 1.00 22.47 ? 505 ASN A ND2 1 ATOM 3622 N N . ILE A 1 471 ? 16.093 35.411 -0.983 1.00 17.79 ? 506 ILE A N 1 ATOM 3623 C CA . ILE A 1 471 ? 15.302 36.536 -1.533 1.00 17.10 ? 506 ILE A CA 1 ATOM 3624 C C . ILE A 1 471 ? 14.058 36.027 -2.279 1.00 20.10 ? 506 ILE A C 1 ATOM 3625 O O . ILE A 1 471 ? 13.094 36.775 -2.494 1.00 19.52 ? 506 ILE A O 1 ATOM 3626 C CB . ILE A 1 471 ? 16.131 37.417 -2.496 1.00 20.58 ? 506 ILE A CB 1 ATOM 3627 C CG1 . ILE A 1 471 ? 16.646 36.583 -3.691 1.00 19.98 ? 506 ILE A CG1 1 ATOM 3628 C CG2 . ILE A 1 471 ? 17.258 38.142 -1.739 1.00 19.70 ? 506 ILE A CG2 1 ATOM 3629 C CD1 . ILE A 1 471 ? 17.283 37.414 -4.821 1.00 18.65 ? 506 ILE A CD1 1 ATOM 3630 N N . GLU A 1 472 ? 14.085 34.746 -2.660 1.00 17.60 ? 507 GLU A N 1 ATOM 3631 C CA . GLU A 1 472 ? 12.973 34.119 -3.381 1.00 18.86 ? 507 GLU A CA 1 ATOM 3632 C C . GLU A 1 472 ? 11.784 33.712 -2.482 1.00 19.67 ? 507 GLU A C 1 ATOM 3633 O O . GLU A 1 472 ? 10.668 33.513 -2.983 1.00 18.63 ? 507 GLU A O 1 ATOM 3634 C CB . GLU A 1 472 ? 13.455 32.874 -4.139 1.00 15.75 ? 507 GLU A CB 1 ATOM 3635 C CG . GLU A 1 472 ? 14.610 33.099 -5.112 1.00 18.31 ? 507 GLU A CG 1 ATOM 3636 C CD . GLU A 1 472 ? 14.267 34.047 -6.265 1.00 18.00 ? 507 GLU A CD 1 ATOM 3637 O OE1 . GLU A 1 472 ? 13.072 34.151 -6.632 1.00 24.08 ? 507 GLU A OE1 1 ATOM 3638 O OE2 . GLU A 1 472 ? 15.208 34.689 -6.801 1.00 21.95 ? 507 GLU A OE2 1 ATOM 3639 N N . LEU A 1 473 ? 12.014 33.592 -1.172 1.00 17.47 ? 508 LEU A N 1 ATOM 3640 C CA . LEU A 1 473 ? 10.993 33.054 -0.261 1.00 22.68 ? 508 LEU A CA 1 ATOM 3641 C C . LEU A 1 473 ? 9.763 33.950 -0.061 1.00 22.45 ? 508 LEU A C 1 ATOM 3642 O O . LEU A 1 473 ? 8.633 33.447 0.050 1.00 22.59 ? 508 LEU A O 1 ATOM 3643 C CB . LEU A 1 473 ? 11.598 32.676 1.090 1.00 19.79 ? 508 LEU A CB 1 ATOM 3644 C CG . LEU A 1 473 ? 12.138 31.244 1.161 1.00 28.61 ? 508 LEU A CG 1 ATOM 3645 C CD1 . LEU A 1 473 ? 12.666 30.897 2.558 1.00 27.20 ? 508 LEU A CD1 1 ATOM 3646 C CD2 . LEU A 1 473 ? 11.051 30.262 0.740 1.00 26.14 ? 508 LEU A CD2 1 ATOM 3647 N N . TYR A 1 474 ? 9.965 35.268 -0.040 1.00 22.06 ? 509 TYR A N 1 ATOM 3648 C CA . TYR A 1 474 ? 8.840 36.173 0.150 1.00 18.00 ? 509 TYR A CA 1 ATOM 3649 C C . TYR A 1 474 ? 7.728 35.926 -0.884 1.00 20.48 ? 509 TYR A C 1 ATOM 3650 O O . TYR A 1 474 ? 6.564 35.780 -0.496 1.00 23.55 ? 509 TYR A O 1 ATOM 3651 C CB . TYR A 1 474 ? 9.318 37.627 0.169 1.00 18.66 ? 509 TYR A CB 1 ATOM 3652 C CG . TYR A 1 474 ? 8.241 38.701 0.147 1.00 20.61 ? 509 TYR A CG 1 ATOM 3653 C CD1 . TYR A 1 474 ? 7.627 39.149 1.319 1.00 23.47 ? 509 TYR A CD1 1 ATOM 3654 C CD2 . TYR A 1 474 ? 7.893 39.316 -1.048 1.00 21.95 ? 509 TYR A CD2 1 ATOM 3655 C CE1 . TYR A 1 474 ? 6.652 40.172 1.282 1.00 20.63 ? 509 TYR A CE1 1 ATOM 3656 C CE2 . TYR A 1 474 ? 6.934 40.312 -1.091 1.00 20.83 ? 509 TYR A CE2 1 ATOM 3657 C CZ . TYR A 1 474 ? 6.326 40.741 0.058 1.00 21.37 ? 509 TYR A CZ 1 ATOM 3658 O OH . TYR A 1 474 ? 5.380 41.741 -0.034 1.00 22.59 ? 509 TYR A OH 1 ATOM 3659 N N . ASN A 1 475 ? 8.079 35.816 -2.166 1.00 20.75 ? 510 ASN A N 1 ATOM 3660 C CA . ASN A 1 475 ? 7.054 35.521 -3.166 1.00 21.91 ? 510 ASN A CA 1 ATOM 3661 C C . ASN A 1 475 ? 6.290 34.239 -2.841 1.00 23.99 ? 510 ASN A C 1 ATOM 3662 O O . ASN A 1 475 ? 5.066 34.209 -2.921 1.00 29.59 ? 510 ASN A O 1 ATOM 3663 C CB . ASN A 1 475 ? 7.630 35.424 -4.571 1.00 21.16 ? 510 ASN A CB 1 ATOM 3664 C CG . ASN A 1 475 ? 8.023 36.774 -5.150 1.00 20.67 ? 510 ASN A CG 1 ATOM 3665 O OD1 . ASN A 1 475 ? 7.432 37.817 -4.827 1.00 25.06 ? 510 ASN A OD1 1 ATOM 3666 N ND2 . ASN A 1 475 ? 9.031 36.764 -6.000 1.00 22.63 ? 510 ASN A ND2 1 ATOM 3667 N N . VAL A 1 476 ? 7.025 33.194 -2.475 1.00 22.68 ? 511 VAL A N 1 ATOM 3668 C CA . VAL A 1 476 ? 6.441 31.891 -2.145 1.00 24.60 ? 511 VAL A CA 1 ATOM 3669 C C . VAL A 1 476 ? 5.530 31.943 -0.920 1.00 27.30 ? 511 VAL A C 1 ATOM 3670 O O . VAL A 1 476 ? 4.465 31.315 -0.891 1.00 25.37 ? 511 VAL A O 1 ATOM 3671 C CB . VAL A 1 476 ? 7.541 30.824 -1.954 1.00 24.95 ? 511 VAL A CB 1 ATOM 3672 C CG1 . VAL A 1 476 ? 6.957 29.500 -1.424 1.00 29.16 ? 511 VAL A CG1 1 ATOM 3673 C CG2 . VAL A 1 476 ? 8.268 30.618 -3.258 1.00 24.42 ? 511 VAL A CG2 1 ATOM 3674 N N . MET A 1 477 ? 5.921 32.709 0.090 1.00 22.41 ? 512 MET A N 1 ATOM 3675 C CA . MET A 1 477 ? 5.053 32.842 1.244 1.00 20.37 ? 512 MET A CA 1 ATOM 3676 C C . MET A 1 477 ? 3.799 33.614 0.840 1.00 23.53 ? 512 MET A C 1 ATOM 3677 O O . MET A 1 477 ? 2.692 33.286 1.272 1.00 23.94 ? 512 MET A O 1 ATOM 3678 C CB . MET A 1 477 ? 5.803 33.463 2.428 1.00 20.69 ? 512 MET A CB 1 ATOM 3679 C CG . MET A 1 477 ? 6.954 32.570 2.910 1.00 21.04 ? 512 MET A CG 1 ATOM 3680 S SD . MET A 1 477 ? 7.831 33.219 4.355 1.00 25.32 ? 512 MET A SD 1 ATOM 3681 C CE . MET A 1 477 ? 8.694 34.604 3.605 1.00 23.09 ? 512 MET A CE 1 ATOM 3682 N N . CYS A 1 478 ? 3.957 34.614 -0.018 1.00 21.11 ? 513 CYS A N 1 ATOM 3683 C CA . CYS A 1 478 ? 2.784 35.300 -0.557 1.00 25.12 ? 513 CYS A CA 1 ATOM 3684 C C . CYS A 1 478 ? 1.854 34.332 -1.310 1.00 25.69 ? 513 CYS A C 1 ATOM 3685 O O . CYS A 1 478 ? 0.646 34.338 -1.066 1.00 29.75 ? 513 CYS A O 1 ATOM 3686 C CB . CYS A 1 478 ? 3.187 36.479 -1.440 1.00 26.71 ? 513 CYS A CB 1 ATOM 3687 S SG . CYS A 1 478 ? 3.830 37.891 -0.517 1.00 25.34 ? 513 CYS A SG 1 ATOM 3688 N N . ASP A 1 479 ? 2.413 33.509 -2.205 1.00 25.61 ? 514 ASP A N 1 ATOM 3689 C CA . ASP A 1 479 ? 1.658 32.428 -2.853 1.00 27.78 ? 514 ASP A CA 1 ATOM 3690 C C . ASP A 1 479 ? 0.929 31.506 -1.852 1.00 30.63 ? 514 ASP A C 1 ATOM 3691 O O . ASP A 1 479 ? -0.251 31.213 -2.025 1.00 32.51 ? 514 ASP A O 1 ATOM 3692 C CB . ASP A 1 479 ? 2.557 31.548 -3.732 1.00 28.41 ? 514 ASP A CB 1 ATOM 3693 C CG . ASP A 1 479 ? 3.159 32.289 -4.924 1.00 29.01 ? 514 ASP A CG 1 ATOM 3694 O OD1 . ASP A 1 479 ? 2.529 33.228 -5.447 1.00 33.27 ? 514 ASP A OD1 1 ATOM 3695 O OD2 . ASP A 1 479 ? 4.272 31.905 -5.348 1.00 33.80 ? 514 ASP A OD2 1 ATOM 3696 N N . LEU A 1 480 ? 1.635 31.038 -0.823 1.00 27.70 ? 515 LEU A N 1 ATOM 3697 C CA . LEU A 1 480 ? 1.039 30.185 0.217 1.00 28.18 ? 515 LEU A CA 1 ATOM 3698 C C . LEU A 1 480 ? -0.123 30.838 0.949 1.00 29.45 ? 515 LEU A C 1 ATOM 3699 O O . LEU A 1 480 ? -0.966 30.145 1.526 1.00 29.02 ? 515 LEU A O 1 ATOM 3700 C CB . LEU A 1 480 ? 2.093 29.743 1.242 1.00 26.50 ? 515 LEU A CB 1 ATOM 3701 C CG . LEU A 1 480 ? 3.185 28.813 0.705 1.00 28.87 ? 515 LEU A CG 1 ATOM 3702 C CD1 . LEU A 1 480 ? 4.407 28.778 1.637 1.00 33.40 ? 515 LEU A CD1 1 ATOM 3703 C CD2 . LEU A 1 480 ? 2.635 27.417 0.516 1.00 33.90 ? 515 LEU A CD2 1 ATOM 3704 N N . LEU A 1 481 ? -0.167 32.168 0.929 1.00 24.70 ? 516 LEU A N 1 ATOM 3705 C CA . LEU A 1 481 ? -1.182 32.910 1.671 1.00 22.91 ? 516 LEU A CA 1 ATOM 3706 C C . LEU A 1 481 ? -2.201 33.601 0.782 1.00 29.90 ? 516 LEU A C 1 ATOM 3707 O O . LEU A 1 481 ? -3.083 34.295 1.286 1.00 27.91 ? 516 LEU A O 1 ATOM 3708 C CB . LEU A 1 481 ? -0.523 33.958 2.576 1.00 25.98 ? 516 LEU A CB 1 ATOM 3709 C CG . LEU A 1 481 ? 0.244 33.351 3.760 1.00 26.40 ? 516 LEU A CG 1 ATOM 3710 C CD1 . LEU A 1 481 ? 1.211 34.361 4.431 1.00 22.70 ? 516 LEU A CD1 1 ATOM 3711 C CD2 . LEU A 1 481 ? -0.746 32.788 4.769 1.00 24.43 ? 516 LEU A CD2 1 ATOM 3712 N N . GLY A 1 482 ? -2.070 33.419 -0.531 1.00 31.00 ? 517 GLY A N 1 ATOM 3713 C CA . GLY A 1 482 ? -2.931 34.089 -1.489 1.00 30.37 ? 517 GLY A CA 1 ATOM 3714 C C . GLY A 1 482 ? -2.690 35.587 -1.578 1.00 37.29 ? 517 GLY A C 1 ATOM 3715 O O . GLY A 1 482 ? -3.618 36.352 -1.828 1.00 36.53 ? 517 GLY A O 1 ATOM 3716 N N . LEU A 1 483 ? -1.448 36.016 -1.378 1.00 28.87 ? 518 LEU A N 1 ATOM 3717 C CA . LEU A 1 483 ? -1.131 37.440 -1.371 1.00 25.01 ? 518 LEU A CA 1 ATOM 3718 C C . LEU A 1 483 ? -0.435 37.886 -2.639 1.00 24.84 ? 518 LEU A C 1 ATOM 3719 O O . LEU A 1 483 ? 0.263 37.108 -3.281 1.00 32.13 ? 518 LEU A O 1 ATOM 3720 C CB . LEU A 1 483 ? -0.224 37.776 -0.179 1.00 27.10 ? 518 LEU A CB 1 ATOM 3721 C CG . LEU A 1 483 ? -0.764 37.511 1.219 1.00 26.80 ? 518 LEU A CG 1 ATOM 3722 C CD1 . LEU A 1 483 ? 0.339 37.654 2.260 1.00 29.51 ? 518 LEU A CD1 1 ATOM 3723 C CD2 . LEU A 1 483 ? -1.875 38.495 1.508 1.00 26.64 ? 518 LEU A CD2 1 ATOM 3724 N N . LYS A 1 484 ? -0.617 39.152 -2.995 1.00 26.90 ? 519 LYS A N 1 ATOM 3725 C CA . LYS A 1 484 ? 0.139 39.737 -4.087 1.00 29.80 ? 519 LYS A CA 1 ATOM 3726 C C . LYS A 1 484 ? 1.372 40.394 -3.499 1.00 27.79 ? 519 LYS A C 1 ATOM 3727 O O . LYS A 1 484 ? 1.259 41.320 -2.701 1.00 25.72 ? 519 LYS A O 1 ATOM 3728 C CB . LYS A 1 484 ? -0.700 40.765 -4.843 1.00 31.86 ? 519 LYS A CB 1 ATOM 3729 C CG . LYS A 1 484 ? -1.951 40.142 -5.466 1.00 40.12 ? 519 LYS A CG 1 ATOM 3730 C CD . LYS A 1 484 ? -2.506 40.972 -6.616 1.00 48.13 ? 519 LYS A CD 1 ATOM 3731 C CE . LYS A 1 484 ? -3.745 40.306 -7.211 1.00 56.88 ? 519 LYS A CE 1 ATOM 3732 N NZ . LYS A 1 484 ? -4.219 41.000 -8.441 1.00 65.43 ? 519 LYS A NZ 1 ATOM 3733 N N . PRO A 1 485 ? 2.561 39.909 -3.888 1.00 31.28 ? 520 PRO A N 1 ATOM 3734 C CA . PRO A 1 485 ? 3.800 40.429 -3.298 1.00 23.37 ? 520 PRO A CA 1 ATOM 3735 C C . PRO A 1 485 ? 4.080 41.868 -3.706 1.00 25.24 ? 520 PRO A C 1 ATOM 3736 O O . PRO A 1 485 ? 3.801 42.261 -4.846 1.00 25.52 ? 520 PRO A O 1 ATOM 3737 C CB . PRO A 1 485 ? 4.875 39.490 -3.859 1.00 22.64 ? 520 PRO A CB 1 ATOM 3738 C CG . PRO A 1 485 ? 4.292 38.937 -5.105 1.00 33.47 ? 520 PRO A CG 1 ATOM 3739 C CD . PRO A 1 485 ? 2.813 38.834 -4.862 1.00 25.15 ? 520 PRO A CD 1 ATOM 3740 N N . ALA A 1 486 ? 4.631 42.643 -2.780 1.00 24.82 ? 521 ALA A N 1 ATOM 3741 C CA . ALA A 1 486 ? 5.157 43.963 -3.099 1.00 21.69 ? 521 ALA A CA 1 ATOM 3742 C C . ALA A 1 486 ? 6.386 43.790 -3.987 1.00 26.32 ? 521 ALA A C 1 ATOM 3743 O O . ALA A 1 486 ? 6.962 42.695 -4.038 1.00 23.41 ? 521 ALA A O 1 ATOM 3744 C CB . ALA A 1 486 ? 5.505 44.723 -1.801 1.00 21.08 ? 521 ALA A CB 1 ATOM 3745 N N . PRO A 1 487 ? 6.788 44.851 -4.709 1.00 25.70 ? 522 PRO A N 1 ATOM 3746 C CA . PRO A 1 487 ? 7.950 44.702 -5.590 1.00 24.62 ? 522 PRO A CA 1 ATOM 3747 C C . PRO A 1 487 ? 9.172 44.260 -4.791 1.00 21.01 ? 522 PRO A C 1 ATOM 3748 O O . PRO A 1 487 ? 9.482 44.822 -3.741 1.00 23.96 ? 522 PRO A O 1 ATOM 3749 C CB . PRO A 1 487 ? 8.155 46.114 -6.132 1.00 27.20 ? 522 PRO A CB 1 ATOM 3750 C CG . PRO A 1 487 ? 6.786 46.724 -6.077 1.00 27.17 ? 522 PRO A CG 1 ATOM 3751 C CD . PRO A 1 487 ? 6.207 46.209 -4.798 1.00 25.85 ? 522 PRO A CD 1 ATOM 3752 N N . ASN A 1 488 ? 9.841 43.241 -5.288 1.00 20.17 ? 523 ASN A N 1 ATOM 3753 C CA . ASN A 1 488 ? 10.985 42.694 -4.577 1.00 19.30 ? 523 ASN A CA 1 ATOM 3754 C C . ASN A 1 488 ? 11.971 42.054 -5.534 1.00 20.99 ? 523 ASN A C 1 ATOM 3755 O O . ASN A 1 488 ? 11.783 42.110 -6.759 1.00 21.06 ? 523 ASN A O 1 ATOM 3756 C CB . ASN A 1 488 ? 10.519 41.698 -3.519 1.00 17.40 ? 523 ASN A CB 1 ATOM 3757 C CG . ASN A 1 488 ? 9.918 40.452 -4.122 1.00 23.76 ? 523 ASN A CG 1 ATOM 3758 O OD1 . ASN A 1 488 ? 10.621 39.483 -4.398 1.00 22.02 ? 523 ASN A OD1 1 ATOM 3759 N ND2 . ASN A 1 488 ? 8.604 40.462 -4.313 1.00 20.16 ? 523 ASN A ND2 1 ATOM 3760 N N . ASN A 1 489 ? 13.028 41.449 -4.991 1.00 18.43 ? 524 ASN A N 1 ATOM 3761 C CA . ASN A 1 489 ? 14.113 40.989 -5.840 1.00 19.59 ? 524 ASN A CA 1 ATOM 3762 C C . ASN A 1 489 ? 14.070 39.520 -6.207 1.00 16.96 ? 524 ASN A C 1 ATOM 3763 O O . ASN A 1 489 ? 14.872 39.071 -7.019 1.00 21.16 ? 524 ASN A O 1 ATOM 3764 C CB . ASN A 1 489 ? 15.467 41.352 -5.230 1.00 19.12 ? 524 ASN A CB 1 ATOM 3765 C CG . ASN A 1 489 ? 15.611 42.857 -5.023 1.00 18.30 ? 524 ASN A CG 1 ATOM 3766 O OD1 . ASN A 1 489 ? 15.759 43.331 -3.907 1.00 16.04 ? 524 ASN A OD1 1 ATOM 3767 N ND2 . ASN A 1 489 ? 15.524 43.603 -6.119 1.00 19.81 ? 524 ASN A ND2 1 ATOM 3768 N N . GLY A 1 490 ? 13.148 38.778 -5.608 1.00 19.16 ? 525 GLY A N 1 ATOM 3769 C CA . GLY A 1 490 ? 12.883 37.428 -6.083 1.00 17.87 ? 525 GLY A CA 1 ATOM 3770 C C . GLY A 1 490 ? 12.420 37.461 -7.533 1.00 22.42 ? 525 GLY A C 1 ATOM 3771 O O . GLY A 1 490 ? 12.132 38.523 -8.098 1.00 23.96 ? 525 GLY A O 1 ATOM 3772 N N . THR A 1 491 ? 12.380 36.290 -8.157 1.00 18.29 ? 526 THR A N 1 ATOM 3773 C CA . THR A 1 491 ? 11.917 36.171 -9.533 1.00 23.76 ? 526 THR A CA 1 ATOM 3774 C C . THR A 1 491 ? 10.718 35.241 -9.431 1.00 23.39 ? 526 THR A C 1 ATOM 3775 O O . THR A 1 491 ? 10.867 34.038 -9.231 1.00 24.52 ? 526 THR A O 1 ATOM 3776 C CB . THR A 1 491 ? 13.019 35.582 -10.464 1.00 25.95 ? 526 THR A CB 1 ATOM 3777 O OG1 . THR A 1 491 ? 14.061 36.546 -10.629 1.00 21.35 ? 526 THR A OG1 1 ATOM 3778 C CG2 . THR A 1 491 ? 12.467 35.218 -11.853 1.00 25.32 ? 526 THR A CG2 1 ATOM 3779 N N . HIS A 1 492 ? 9.531 35.820 -9.534 1.00 20.92 ? 527 HIS A N 1 ATOM 3780 C CA . HIS A 1 492 ? 8.312 35.106 -9.185 1.00 25.58 ? 527 HIS A CA 1 ATOM 3781 C C . HIS A 1 492 ? 8.035 33.994 -10.187 1.00 25.40 ? 527 HIS A C 1 ATOM 3782 O O . HIS A 1 492 ? 7.881 34.239 -11.383 1.00 27.13 ? 527 HIS A O 1 ATOM 3783 C CB . HIS A 1 492 ? 7.140 36.076 -9.086 1.00 26.36 ? 527 HIS A CB 1 ATOM 3784 C CG . HIS A 1 492 ? 6.020 35.595 -8.219 1.00 24.88 ? 527 HIS A CG 1 ATOM 3785 N ND1 . HIS A 1 492 ? 4.922 36.377 -7.931 1.00 27.40 ? 527 HIS A ND1 1 ATOM 3786 C CD2 . HIS A 1 492 ? 5.822 34.417 -7.579 1.00 25.15 ? 527 HIS A CD2 1 ATOM 3787 C CE1 . HIS A 1 492 ? 4.097 35.703 -7.151 1.00 29.12 ? 527 HIS A CE1 1 ATOM 3788 N NE2 . HIS A 1 492 ? 4.622 34.513 -6.917 1.00 29.41 ? 527 HIS A NE2 1 ATOM 3789 N N . GLY A 1 493 ? 7.993 32.764 -9.690 1.00 24.27 ? 528 GLY A N 1 ATOM 3790 C CA . GLY A 1 493 ? 7.840 31.603 -10.551 1.00 23.67 ? 528 GLY A CA 1 ATOM 3791 C C . GLY A 1 493 ? 9.058 30.700 -10.512 1.00 24.73 ? 528 GLY A C 1 ATOM 3792 O O . GLY A 1 493 ? 8.955 29.512 -10.803 1.00 25.41 ? 528 GLY A O 1 ATOM 3793 N N . SER A 1 494 ? 10.207 31.253 -10.123 1.00 24.22 ? 529 SER A N 1 ATOM 3794 C CA . SER A 1 494 ? 11.459 30.487 -10.112 1.00 17.54 ? 529 SER A CA 1 ATOM 3795 C C . SER A 1 494 ? 11.434 29.376 -9.075 1.00 22.92 ? 529 SER A C 1 ATOM 3796 O O . SER A 1 494 ? 12.255 28.447 -9.135 1.00 24.95 ? 529 SER A O 1 ATOM 3797 C CB . SER A 1 494 ? 12.648 31.407 -9.825 1.00 20.54 ? 529 SER A CB 1 ATOM 3798 O OG . SER A 1 494 ? 12.642 31.782 -8.453 1.00 23.26 ? 529 SER A OG 1 ATOM 3799 N N . LEU A 1 495 ? 10.515 29.473 -8.112 1.00 22.08 ? 530 LEU A N 1 ATOM 3800 C CA . LEU A 1 495 ? 10.341 28.409 -7.117 1.00 21.53 ? 530 LEU A CA 1 ATOM 3801 C C . LEU A 1 495 ? 9.010 27.661 -7.226 1.00 23.62 ? 530 LEU A C 1 ATOM 3802 O O . LEU A 1 495 ? 8.573 27.028 -6.267 1.00 20.92 ? 530 LEU A O 1 ATOM 3803 C CB . LEU A 1 495 ? 10.463 28.950 -5.685 1.00 22.88 ? 530 LEU A CB 1 ATOM 3804 C CG . LEU A 1 495 ? 11.802 29.555 -5.248 1.00 24.38 ? 530 LEU A CG 1 ATOM 3805 C CD1 . LEU A 1 495 ? 11.784 29.833 -3.718 1.00 22.83 ? 530 LEU A CD1 1 ATOM 3806 C CD2 . LEU A 1 495 ? 12.954 28.656 -5.586 1.00 22.97 ? 530 LEU A CD2 1 ATOM 3807 N N . ASN A 1 496 ? 8.364 27.713 -8.383 1.00 23.52 ? 531 ASN A N 1 ATOM 3808 C CA . ASN A 1 496 ? 7.112 26.974 -8.540 1.00 25.73 ? 531 ASN A CA 1 ATOM 3809 C C . ASN A 1 496 ? 7.281 25.469 -8.322 1.00 26.99 ? 531 ASN A C 1 ATOM 3810 O O . ASN A 1 496 ? 6.331 24.766 -7.959 1.00 25.83 ? 531 ASN A O 1 ATOM 3811 C CB . ASN A 1 496 ? 6.462 27.262 -9.904 1.00 25.87 ? 531 ASN A CB 1 ATOM 3812 C CG . ASN A 1 496 ? 5.647 28.549 -9.895 1.00 26.66 ? 531 ASN A CG 1 ATOM 3813 O OD1 . ASN A 1 496 ? 5.392 29.118 -8.839 1.00 31.91 ? 531 ASN A OD1 1 ATOM 3814 N ND2 . ASN A 1 496 ? 5.240 29.012 -11.071 1.00 28.81 ? 531 ASN A ND2 1 ATOM 3815 N N . HIS A 1 497 ? 8.500 24.983 -8.513 1.00 26.52 ? 532 HIS A N 1 ATOM 3816 C CA . HIS A 1 497 ? 8.761 23.553 -8.434 1.00 27.29 ? 532 HIS A CA 1 ATOM 3817 C C . HIS A 1 497 ? 8.779 23.046 -6.990 1.00 28.47 ? 532 HIS A C 1 ATOM 3818 O O . HIS A 1 497 ? 8.911 21.849 -6.747 1.00 26.84 ? 532 HIS A O 1 ATOM 3819 C CB . HIS A 1 497 ? 10.061 23.191 -9.168 1.00 30.37 ? 532 HIS A CB 1 ATOM 3820 C CG . HIS A 1 497 ? 11.283 23.855 -8.607 1.00 26.10 ? 532 HIS A CG 1 ATOM 3821 N ND1 . HIS A 1 497 ? 11.560 25.192 -8.800 1.00 28.36 ? 532 HIS A ND1 1 ATOM 3822 C CD2 . HIS A 1 497 ? 12.302 23.362 -7.865 1.00 25.92 ? 532 HIS A CD2 1 ATOM 3823 C CE1 . HIS A 1 497 ? 12.704 25.492 -8.209 1.00 25.77 ? 532 HIS A CE1 1 ATOM 3824 N NE2 . HIS A 1 497 ? 13.170 24.401 -7.628 1.00 24.41 ? 532 HIS A NE2 1 ATOM 3825 N N . LEU A 1 498 ? 8.637 23.956 -6.026 1.00 26.75 ? 533 LEU A N 1 ATOM 3826 C CA . LEU A 1 498 ? 8.566 23.554 -4.626 1.00 26.57 ? 533 LEU A CA 1 ATOM 3827 C C . LEU A 1 498 ? 7.148 23.193 -4.240 1.00 25.55 ? 533 LEU A C 1 ATOM 3828 O O . LEU A 1 498 ? 6.930 22.577 -3.196 1.00 24.16 ? 533 LEU A O 1 ATOM 3829 C CB . LEU A 1 498 ? 8.994 24.694 -3.696 1.00 21.64 ? 533 LEU A CB 1 ATOM 3830 C CG . LEU A 1 498 ? 10.489 24.877 -3.427 1.00 18.77 ? 533 LEU A CG 1 ATOM 3831 C CD1 . LEU A 1 498 ? 11.231 25.188 -4.687 1.00 18.62 ? 533 LEU A CD1 1 ATOM 3832 C CD2 . LEU A 1 498 ? 10.670 25.998 -2.380 1.00 22.99 ? 533 LEU A CD2 1 ATOM 3833 N N . LEU A 1 499 ? 6.190 23.612 -5.066 1.00 27.15 ? 534 LEU A N 1 ATOM 3834 C CA . LEU A 1 499 ? 4.787 23.584 -4.683 1.00 26.22 ? 534 LEU A CA 1 ATOM 3835 C C . LEU A 1 499 ? 3.970 22.554 -5.465 1.00 25.55 ? 534 LEU A C 1 ATOM 3836 O O . LEU A 1 499 ? 4.203 22.327 -6.649 1.00 29.35 ? 534 LEU A O 1 ATOM 3837 C CB . LEU A 1 499 ? 4.149 24.962 -4.865 1.00 26.25 ? 534 LEU A CB 1 ATOM 3838 C CG . LEU A 1 499 ? 4.769 26.135 -4.106 1.00 28.57 ? 534 LEU A CG 1 ATOM 3839 C CD1 . LEU A 1 499 ? 3.989 27.410 -4.394 1.00 36.49 ? 534 LEU A CD1 1 ATOM 3840 C CD2 . LEU A 1 499 ? 4.819 25.855 -2.616 1.00 25.47 ? 534 LEU A CD2 1 ATOM 3841 N N . ARG A 1 500 ? 3.009 21.959 -4.765 1.00 32.37 ? 535 ARG A N 1 ATOM 3842 C CA . ARG A 1 500 ? 2.016 21.051 -5.335 1.00 33.46 ? 535 ARG A CA 1 ATOM 3843 C C . ARG A 1 500 ? 0.949 21.846 -6.084 1.00 36.56 ? 535 ARG A C 1 ATOM 3844 O O . ARG A 1 500 ? 0.564 21.487 -7.194 1.00 43.39 ? 535 ARG A O 1 ATOM 3845 C CB . ARG A 1 500 ? 1.378 20.245 -4.199 1.00 38.31 ? 535 ARG A CB 1 ATOM 3846 C CG . ARG A 1 500 ? 0.126 19.472 -4.569 1.00 47.22 ? 535 ARG A CG 1 ATOM 3847 C CD . ARG A 1 500 ? -0.428 18.761 -3.351 1.00 39.73 ? 535 ARG A CD 1 ATOM 3848 N NE . ARG A 1 500 ? 0.616 18.030 -2.641 1.00 40.21 ? 535 ARG A NE 1 ATOM 3849 C CZ . ARG A 1 500 ? 0.924 16.754 -2.871 1.00 46.98 ? 535 ARG A CZ 1 ATOM 3850 N NH1 . ARG A 1 500 ? 0.267 16.063 -3.793 1.00 48.26 ? 535 ARG A NH1 1 ATOM 3851 N NH2 . ARG A 1 500 ? 1.890 16.164 -2.181 1.00 45.39 ? 535 ARG A NH2 1 ATOM 3852 N N . THR A 1 501 ? 0.467 22.914 -5.453 1.00 31.67 ? 536 THR A N 1 ATOM 3853 C CA . THR A 1 501 ? -0.472 23.864 -6.056 1.00 37.17 ? 536 THR A CA 1 ATOM 3854 C C . THR A 1 501 ? -0.114 25.272 -5.584 1.00 38.75 ? 536 THR A C 1 ATOM 3855 O O . THR A 1 501 ? 0.936 25.469 -4.976 1.00 36.63 ? 536 THR A O 1 ATOM 3856 C CB . THR A 1 501 ? -1.936 23.583 -5.651 1.00 44.83 ? 536 THR A CB 1 ATOM 3857 O OG1 . THR A 1 501 ? -2.053 23.574 -4.220 1.00 46.02 ? 536 THR A OG1 1 ATOM 3858 C CG2 . THR A 1 501 ? -2.414 22.252 -6.212 1.00 52.04 ? 536 THR A CG2 1 ATOM 3859 N N . ASN A 1 502 ? -0.992 26.238 -5.850 1.00 37.98 ? 537 ASN A N 1 ATOM 3860 C CA . ASN A 1 502 ? -0.749 27.645 -5.514 1.00 37.61 ? 537 ASN A CA 1 ATOM 3861 C C . ASN A 1 502 ? 0.460 28.235 -6.242 1.00 43.99 ? 537 ASN A C 1 ATOM 3862 O O . ASN A 1 502 ? 1.002 29.266 -5.825 1.00 37.93 ? 537 ASN A O 1 ATOM 3863 C CB . ASN A 1 502 ? -0.614 27.852 -3.998 1.00 42.86 ? 537 ASN A CB 1 ATOM 3864 C CG . ASN A 1 502 ? -1.933 27.687 -3.261 1.00 43.36 ? 537 ASN A CG 1 ATOM 3865 O OD1 . ASN A 1 502 ? -2.933 27.256 -3.839 1.00 54.49 ? 537 ASN A OD1 1 ATOM 3866 N ND2 . ASN A 1 502 ? -1.940 28.031 -1.975 1.00 48.68 ? 537 ASN A ND2 1 ATOM 3867 N N . THR A 1 503 ? 0.880 27.585 -7.329 1.00 40.30 ? 538 THR A N 1 ATOM 3868 C CA . THR A 1 503 ? 1.989 28.094 -8.127 1.00 41.02 ? 538 THR A CA 1 ATOM 3869 C C . THR A 1 503 ? 1.591 29.437 -8.736 1.00 42.90 ? 538 THR A C 1 ATOM 3870 O O . THR A 1 503 ? 0.406 29.775 -8.809 1.00 45.83 ? 538 THR A O 1 ATOM 3871 C CB . THR A 1 503 ? 2.403 27.122 -9.262 1.00 36.01 ? 538 THR A CB 1 ATOM 3872 O OG1 . THR A 1 503 ? 1.255 26.779 -10.047 1.00 40.70 ? 538 THR A OG1 1 ATOM 3873 C CG2 . THR A 1 503 ? 3.043 25.837 -8.701 1.00 31.57 ? 538 THR A CG2 1 ATOM 3874 N N . PHE A 1 504 ? 2.582 30.210 -9.163 1.00 39.19 ? 539 PHE A N 1 ATOM 3875 C CA . PHE A 1 504 ? 2.318 31.487 -9.808 1.00 39.94 ? 539 PHE A CA 1 ATOM 3876 C C . PHE A 1 504 ? 2.598 31.321 -11.286 1.00 36.87 ? 539 PHE A C 1 ATOM 3877 O O . PHE A 1 504 ? 3.716 30.970 -11.668 1.00 44.04 ? 539 PHE A O 1 ATOM 3878 C CB . PHE A 1 504 ? 3.219 32.571 -9.205 1.00 35.63 ? 539 PHE A CB 1 ATOM 3879 C CG . PHE A 1 504 ? 3.228 33.868 -9.972 1.00 30.79 ? 539 PHE A CG 1 ATOM 3880 C CD1 . PHE A 1 504 ? 2.198 34.783 -9.830 1.00 35.44 ? 539 PHE A CD1 1 ATOM 3881 C CD2 . PHE A 1 504 ? 4.286 34.184 -10.805 1.00 26.94 ? 539 PHE A CD2 1 ATOM 3882 C CE1 . PHE A 1 504 ? 2.217 35.990 -10.523 1.00 35.91 ? 539 PHE A CE1 1 ATOM 3883 C CE2 . PHE A 1 504 ? 4.306 35.382 -11.503 1.00 35.37 ? 539 PHE A CE2 1 ATOM 3884 C CZ . PHE A 1 504 ? 3.270 36.290 -11.358 1.00 33.87 ? 539 PHE A CZ 1 ATOM 3885 N N . ARG A 1 505 ? 1.601 31.563 -12.128 1.00 38.74 ? 540 ARG A N 1 ATOM 3886 C CA . ARG A 1 505 ? 1.826 31.441 -13.563 1.00 37.77 ? 540 ARG A CA 1 ATOM 3887 C C . ARG A 1 505 ? 2.494 32.703 -14.092 1.00 36.68 ? 540 ARG A C 1 ATOM 3888 O O . ARG A 1 505 ? 1.867 33.760 -14.170 1.00 36.02 ? 540 ARG A O 1 ATOM 3889 C CB . ARG A 1 505 ? 0.518 31.174 -14.306 1.00 47.68 ? 540 ARG A CB 1 ATOM 3890 C CG . ARG A 1 505 ? 0.693 31.144 -15.814 1.00 45.52 ? 540 ARG A CG 1 ATOM 3891 C CD . ARG A 1 505 ? -0.620 30.871 -16.534 1.00 61.00 ? 540 ARG A CD 1 ATOM 3892 N NE . ARG A 1 505 ? -0.409 30.641 -17.962 1.00 66.13 ? 540 ARG A NE 1 ATOM 3893 C CZ . ARG A 1 505 ? -0.252 31.607 -18.862 1.00 67.81 ? 540 ARG A CZ 1 ATOM 3894 N NH1 . ARG A 1 505 ? -0.279 32.880 -18.488 1.00 68.06 ? 540 ARG A NH1 1 ATOM 3895 N NH2 . ARG A 1 505 ? -0.064 31.301 -20.140 1.00 75.62 ? 540 ARG A NH2 1 ATOM 3896 N N . PRO A 1 506 ? 3.783 32.603 -14.447 1.00 35.88 ? 541 PRO A N 1 ATOM 3897 C CA . PRO A 1 506 ? 4.490 33.817 -14.843 1.00 35.85 ? 541 PRO A CA 1 ATOM 3898 C C . PRO A 1 506 ? 4.187 34.137 -16.292 1.00 43.99 ? 541 PRO A C 1 ATOM 3899 O O . PRO A 1 506 ? 3.785 33.256 -17.055 1.00 36.67 ? 541 PRO A O 1 ATOM 3900 C CB . PRO A 1 506 ? 5.958 33.419 -14.705 1.00 31.18 ? 541 PRO A CB 1 ATOM 3901 C CG . PRO A 1 506 ? 5.959 31.955 -15.025 1.00 38.50 ? 541 PRO A CG 1 ATOM 3902 C CD . PRO A 1 506 ? 4.630 31.403 -14.559 1.00 36.03 ? 541 PRO A CD 1 ATOM 3903 N N . THR A 1 507 ? 4.386 35.393 -16.663 1.00 41.64 ? 542 THR A N 1 ATOM 3904 C CA . THR A 1 507 ? 4.171 35.817 -18.032 1.00 44.33 ? 542 THR A CA 1 ATOM 3905 C C . THR A 1 507 ? 5.421 36.508 -18.544 1.00 45.65 ? 542 THR A C 1 ATOM 3906 O O . THR A 1 507 ? 5.986 37.373 -17.868 1.00 43.90 ? 542 THR A O 1 ATOM 3907 C CB . THR A 1 507 ? 2.981 36.777 -18.132 1.00 51.10 ? 542 THR A CB 1 ATOM 3908 O OG1 . THR A 1 507 ? 3.285 37.982 -17.423 1.00 56.52 ? 542 THR A OG1 1 ATOM 3909 C CG2 . THR A 1 507 ? 1.745 36.144 -17.529 1.00 43.03 ? 542 THR A CG2 1 ATOM 3910 N N . LEU A 1 508 ? 5.848 36.098 -19.735 1.00 38.51 ? 543 LEU A N 1 ATOM 3911 C CA . LEU A 1 508 ? 7.006 36.656 -20.421 1.00 38.09 ? 543 LEU A CA 1 ATOM 3912 C C . LEU A 1 508 ? 6.843 38.169 -20.567 1.00 42.02 ? 543 LEU A C 1 ATOM 3913 O O . LEU A 1 508 ? 5.760 38.646 -20.901 1.00 47.40 ? 543 LEU A O 1 ATOM 3914 C CB . LEU A 1 508 ? 7.119 35.987 -21.791 1.00 44.14 ? 543 LEU A CB 1 ATOM 3915 C CG . LEU A 1 508 ? 8.471 35.673 -22.427 1.00 43.48 ? 543 LEU A CG 1 ATOM 3916 C CD1 . LEU A 1 508 ? 9.424 35.049 -21.434 1.00 36.02 ? 543 LEU A CD1 1 ATOM 3917 C CD2 . LEU A 1 508 ? 8.262 34.740 -23.613 1.00 46.30 ? 543 LEU A CD2 1 ATOM 3918 N N . PRO A 1 509 ? 7.907 38.939 -20.276 1.00 46.34 ? 544 PRO A N 1 ATOM 3919 C CA . PRO A 1 509 ? 7.796 40.390 -20.460 1.00 42.08 ? 544 PRO A CA 1 ATOM 3920 C C . PRO A 1 509 ? 7.772 40.704 -21.947 1.00 45.38 ? 544 PRO A C 1 ATOM 3921 O O . PRO A 1 509 ? 8.285 39.908 -22.738 1.00 36.95 ? 544 PRO A O 1 ATOM 3922 C CB . PRO A 1 509 ? 9.078 40.924 -19.818 1.00 42.45 ? 544 PRO A CB 1 ATOM 3923 C CG . PRO A 1 509 ? 10.045 39.790 -19.913 1.00 38.77 ? 544 PRO A CG 1 ATOM 3924 C CD . PRO A 1 509 ? 9.241 38.537 -19.791 1.00 36.99 ? 544 PRO A CD 1 ATOM 3925 N N . GLU A 1 510 ? 7.180 41.831 -22.325 1.00 45.53 ? 545 GLU A N 1 ATOM 3926 C CA . GLU A 1 510 ? 7.021 42.150 -23.735 1.00 43.35 ? 545 GLU A CA 1 ATOM 3927 C C . GLU A 1 510 ? 8.220 42.899 -24.280 1.00 41.80 ? 545 GLU A C 1 ATOM 3928 O O . GLU A 1 510 ? 8.717 43.839 -23.656 1.00 39.78 ? 545 GLU A O 1 ATOM 3929 C CB . GLU A 1 510 ? 5.736 42.945 -23.970 1.00 48.86 ? 545 GLU A CB 1 ATOM 3930 C CG . GLU A 1 510 ? 4.472 42.144 -23.672 1.00 55.51 ? 545 GLU A CG 1 ATOM 3931 C CD . GLU A 1 510 ? 3.193 42.918 -23.945 1.00 68.07 ? 545 GLU A CD 1 ATOM 3932 O OE1 . GLU A 1 510 ? 3.277 44.125 -24.267 1.00 70.91 ? 545 GLU A OE1 1 ATOM 3933 O OE2 . GLU A 1 510 ? 2.101 42.314 -23.840 1.00 70.20 ? 545 GLU A OE2 1 ATOM 3934 N N . GLU A 1 511 ? 8.687 42.469 -25.447 1.00 38.57 ? 546 GLU A N 1 ATOM 3935 C CA . GLU A 1 511 ? 9.771 43.160 -26.132 1.00 44.47 ? 546 GLU A CA 1 ATOM 3936 C C . GLU A 1 511 ? 9.346 44.597 -26.399 1.00 40.05 ? 546 GLU A C 1 ATOM 3937 O O . GLU A 1 511 ? 8.217 44.852 -26.819 1.00 42.46 ? 546 GLU A O 1 ATOM 3938 C CB . GLU A 1 511 ? 10.151 42.442 -27.436 1.00 38.68 ? 546 GLU A CB 1 ATOM 3939 C CG . GLU A 1 511 ? 11.201 43.180 -28.278 1.00 44.14 ? 546 GLU A CG 1 ATOM 3940 C CD . GLU A 1 511 ? 12.268 42.258 -28.865 1.00 51.83 ? 546 GLU A CD 1 ATOM 3941 O OE1 . GLU A 1 511 ? 11.921 41.149 -29.335 1.00 52.68 ? 546 GLU A OE1 1 ATOM 3942 O OE2 . GLU A 1 511 ? 13.464 42.642 -28.851 1.00 48.82 ? 546 GLU A OE2 1 ATOM 3943 N N . VAL A 1 512 ? 10.246 45.533 -26.132 1.00 33.31 ? 547 VAL A N 1 ATOM 3944 C CA . VAL A 1 512 ? 9.933 46.941 -26.288 1.00 33.45 ? 547 VAL A CA 1 ATOM 3945 C C . VAL A 1 512 ? 10.524 47.480 -27.581 1.00 41.30 ? 547 VAL A C 1 ATOM 3946 O O . VAL A 1 512 ? 9.892 48.269 -28.280 1.00 43.51 ? 547 VAL A O 1 ATOM 3947 C CB . VAL A 1 512 ? 10.444 47.738 -25.089 1.00 37.97 ? 547 VAL A CB 1 ATOM 3948 C CG1 . VAL A 1 512 ? 10.226 49.232 -25.288 1.00 36.16 ? 547 VAL A CG1 1 ATOM 3949 C CG2 . VAL A 1 512 ? 9.749 47.254 -23.824 1.00 38.83 ? 547 VAL A CG2 1 ATOM 3950 N N . SER A 1 513 ? 11.734 47.042 -27.907 1.00 35.28 ? 548 SER A N 1 ATOM 3951 C CA . SER A 1 513 ? 12.372 47.464 -29.140 1.00 39.80 ? 548 SER A CA 1 ATOM 3952 C C . SER A 1 513 ? 12.538 46.276 -30.071 1.00 44.83 ? 548 SER A C 1 ATOM 3953 O O . SER A 1 513 ? 13.126 45.266 -29.694 1.00 37.73 ? 548 SER A O 1 ATOM 3954 C CB . SER A 1 513 ? 13.728 48.114 -28.865 1.00 35.08 ? 548 SER A CB 1 ATOM 3955 O OG . SER A 1 513 ? 13.565 49.353 -28.203 1.00 35.23 ? 548 SER A OG 1 ATOM 3956 N N . ARG A 1 514 ? 11.989 46.399 -31.277 1.00 40.76 ? 549 ARG A N 1 ATOM 3957 C CA . ARG A 1 514 ? 12.205 45.422 -32.331 1.00 40.02 ? 549 ARG A CA 1 ATOM 3958 C C . ARG A 1 514 ? 13.490 45.795 -33.077 1.00 39.04 ? 549 ARG A C 1 ATOM 3959 O O . ARG A 1 514 ? 13.860 46.968 -33.132 1.00 43.15 ? 549 ARG A O 1 ATOM 3960 C CB . ARG A 1 514 ? 11.005 45.396 -33.284 1.00 43.94 ? 549 ARG A CB 1 ATOM 3961 N N . PRO A 1 515 ? 14.187 44.795 -33.634 1.00 33.55 ? 550 PRO A N 1 ATOM 3962 C CA . PRO A 1 515 ? 15.468 45.048 -34.291 1.00 43.88 ? 550 PRO A CA 1 ATOM 3963 C C . PRO A 1 515 ? 15.329 45.300 -35.789 1.00 50.88 ? 550 PRO A C 1 ATOM 3964 O O . PRO A 1 515 ? 14.312 44.968 -36.404 1.00 47.74 ? 550 PRO A O 1 ATOM 3965 C CB . PRO A 1 515 ? 16.209 43.736 -34.084 1.00 40.11 ? 550 PRO A CB 1 ATOM 3966 C CG . PRO A 1 515 ? 15.123 42.711 -34.140 1.00 42.08 ? 550 PRO A CG 1 ATOM 3967 C CD . PRO A 1 515 ? 13.886 43.354 -33.567 1.00 39.15 ? 550 PRO A CD 1 ATOM 3968 N N . ASN A 1 516 ? 16.374 45.883 -36.360 1.00 49.65 ? 551 ASN A N 1 ATOM 3969 C CA . ASN A 1 516 ? 16.477 46.061 -37.791 1.00 47.24 ? 551 ASN A CA 1 ATOM 3970 C C . ASN A 1 516 ? 17.408 44.999 -38.318 1.00 53.55 ? 551 ASN A C 1 ATOM 3971 O O . ASN A 1 516 ? 18.222 44.459 -37.572 1.00 47.56 ? 551 ASN A O 1 ATOM 3972 C CB . ASN A 1 516 ? 17.043 47.438 -38.107 1.00 46.28 ? 551 ASN A CB 1 ATOM 3973 C CG . ASN A 1 516 ? 16.258 48.546 -37.451 1.00 45.80 ? 551 ASN A CG 1 ATOM 3974 O OD1 . ASN A 1 516 ? 15.292 49.054 -38.014 1.00 52.49 ? 551 ASN A OD1 1 ATOM 3975 N ND2 . ASN A 1 516 ? 16.664 48.923 -36.247 1.00 48.80 ? 551 ASN A ND2 1 ATOM 3976 N N . TYR A 1 517 ? 17.293 44.699 -39.605 1.00 47.27 ? 552 TYR A N 1 ATOM 3977 C CA . TYR A 1 517 ? 18.175 43.731 -40.235 1.00 53.38 ? 552 TYR A CA 1 ATOM 3978 C C . TYR A 1 517 ? 18.854 44.375 -41.443 1.00 63.84 ? 552 TYR A C 1 ATOM 3979 O O . TYR A 1 517 ? 18.513 44.070 -42.588 1.00 62.22 ? 552 TYR A O 1 ATOM 3980 C CB . TYR A 1 517 ? 17.382 42.494 -40.667 1.00 60.36 ? 552 TYR A CB 1 ATOM 3981 C CG . TYR A 1 517 ? 16.627 41.807 -39.545 1.00 56.64 ? 552 TYR A CG 1 ATOM 3982 C CD1 . TYR A 1 517 ? 15.410 42.308 -39.080 1.00 54.34 ? 552 TYR A CD1 1 ATOM 3983 C CD2 . TYR A 1 517 ? 17.121 40.647 -38.962 1.00 51.41 ? 552 TYR A CD2 1 ATOM 3984 C CE1 . TYR A 1 517 ? 14.718 41.678 -38.057 1.00 51.62 ? 552 TYR A CE1 1 ATOM 3985 C CE2 . TYR A 1 517 ? 16.433 40.009 -37.939 1.00 53.85 ? 552 TYR A CE2 1 ATOM 3986 C CZ . TYR A 1 517 ? 15.233 40.527 -37.492 1.00 50.49 ? 552 TYR A CZ 1 ATOM 3987 O OH . TYR A 1 517 ? 14.559 39.887 -36.476 1.00 50.57 ? 552 TYR A OH 1 ATOM 3988 N N . PRO A 1 518 ? 19.818 45.275 -41.190 1.00 59.14 ? 553 PRO A N 1 ATOM 3989 C CA . PRO A 1 518 ? 20.458 46.041 -42.267 1.00 49.92 ? 553 PRO A CA 1 ATOM 3990 C C . PRO A 1 518 ? 21.211 45.170 -43.271 1.00 60.54 ? 553 PRO A C 1 ATOM 3991 O O . PRO A 1 518 ? 21.924 44.239 -42.881 1.00 47.31 ? 553 PRO A O 1 ATOM 3992 C CB . PRO A 1 518 ? 21.438 46.953 -41.517 1.00 55.04 ? 553 PRO A CB 1 ATOM 3993 C CG . PRO A 1 518 ? 21.677 46.271 -40.208 1.00 55.98 ? 553 PRO A CG 1 ATOM 3994 C CD . PRO A 1 518 ? 20.378 45.603 -39.866 1.00 50.25 ? 553 PRO A CD 1 ATOM 3995 N N . GLY A 1 519 ? 21.045 45.472 -44.558 1.00 61.50 ? 554 GLY A N 1 ATOM 3996 C CA . GLY A 1 519 ? 21.808 44.803 -45.597 1.00 59.46 ? 554 GLY A CA 1 ATOM 3997 C C . GLY A 1 519 ? 23.050 45.611 -45.923 1.00 64.64 ? 554 GLY A C 1 ATOM 3998 O O . GLY A 1 519 ? 23.564 46.343 -45.078 1.00 58.98 ? 554 GLY A O 1 ATOM 3999 N N . ILE A 1 520 ? 23.545 45.480 -47.148 1.00 65.59 ? 555 ILE A N 1 ATOM 4000 C CA . ILE A 1 520 ? 24.613 46.350 -47.611 1.00 64.72 ? 555 ILE A CA 1 ATOM 4001 C C . ILE A 1 520 ? 23.978 47.668 -48.025 1.00 68.01 ? 555 ILE A C 1 ATOM 4002 O O . ILE A 1 520 ? 23.044 47.683 -48.824 1.00 74.03 ? 555 ILE A O 1 ATOM 4003 C CB . ILE A 1 520 ? 25.347 45.755 -48.823 1.00 66.09 ? 555 ILE A CB 1 ATOM 4004 C CG1 . ILE A 1 520 ? 25.652 44.265 -48.608 1.00 63.96 ? 555 ILE A CG1 1 ATOM 4005 C CG2 . ILE A 1 520 ? 26.610 46.552 -49.122 1.00 65.05 ? 555 ILE A CG2 1 ATOM 4006 C CD1 . ILE A 1 520 ? 26.653 43.974 -47.520 1.00 59.60 ? 555 ILE A CD1 1 ATOM 4007 N N . MET A 1 521 ? 24.466 48.771 -47.469 1.00 61.83 ? 556 MET A N 1 ATOM 4008 C CA . MET A 1 521 ? 23.947 50.093 -47.811 1.00 65.28 ? 556 MET A CA 1 ATOM 4009 C C . MET A 1 521 ? 25.056 51.135 -47.815 1.00 66.80 ? 556 MET A C 1 ATOM 4010 O O . MET A 1 521 ? 24.785 52.338 -47.846 1.00 69.43 ? 556 MET A O 1 ATOM 4011 C CB . MET A 1 521 ? 22.846 50.517 -46.836 1.00 63.26 ? 556 MET A CB 1 ATOM 4012 C CG . MET A 1 521 ? 21.563 49.716 -46.969 1.00 73.67 ? 556 MET A CG 1 ATOM 4013 S SD . MET A 1 521 ? 20.736 49.474 -45.387 1.00 87.52 ? 556 MET A SD 1 ATOM 4014 C CE . MET A 1 521 ? 22.126 49.043 -44.346 1.00 64.36 ? 556 MET A CE 1 ATOM 4015 N N . TYR A 1 522 ? 26.302 50.667 -47.771 1.00 62.03 ? 557 TYR A N 1 ATOM 4016 C CA . TYR A 1 522 ? 27.467 51.546 -47.757 1.00 59.77 ? 557 TYR A CA 1 ATOM 4017 C C . TYR A 1 522 ? 28.647 50.879 -48.449 1.00 63.54 ? 557 TYR A C 1 ATOM 4018 O O . TYR A 1 522 ? 28.643 49.667 -48.671 1.00 62.55 ? 557 TYR A O 1 ATOM 4019 C CB . TYR A 1 522 ? 27.844 51.929 -46.319 1.00 58.52 ? 557 TYR A CB 1 ATOM 4020 C CG . TYR A 1 522 ? 26.727 52.632 -45.587 1.00 57.01 ? 557 TYR A CG 1 ATOM 4021 C CD1 . TYR A 1 522 ? 26.514 53.990 -45.755 1.00 59.08 ? 557 TYR A CD1 1 ATOM 4022 C CD2 . TYR A 1 522 ? 25.867 51.930 -44.749 1.00 56.91 ? 557 TYR A CD2 1 ATOM 4023 C CE1 . TYR A 1 522 ? 25.481 54.635 -45.102 1.00 57.23 ? 557 TYR A CE1 1 ATOM 4024 C CE2 . TYR A 1 522 ? 24.833 52.565 -44.094 1.00 52.87 ? 557 TYR A CE2 1 ATOM 4025 C CZ . TYR A 1 522 ? 24.645 53.918 -44.273 1.00 54.18 ? 557 TYR A CZ 1 ATOM 4026 O OH . TYR A 1 522 ? 23.614 54.561 -43.624 1.00 57.29 ? 557 TYR A OH 1 ATOM 4027 N N . LEU A 1 523 ? 29.653 51.675 -48.795 1.00 63.42 ? 558 LEU A N 1 ATOM 4028 C CA . LEU A 1 523 ? 30.877 51.142 -49.379 1.00 60.35 ? 558 LEU A CA 1 ATOM 4029 C C . LEU A 1 523 ? 32.049 51.490 -48.475 1.00 60.68 ? 558 LEU A C 1 ATOM 4030 O O . LEU A 1 523 ? 31.973 52.446 -47.703 1.00 58.99 ? 558 LEU A O 1 ATOM 4031 C CB . LEU A 1 523 ? 31.110 51.713 -50.782 1.00 65.03 ? 558 LEU A CB 1 ATOM 4032 C CG . LEU A 1 523 ? 29.980 51.566 -51.805 1.00 62.60 ? 558 LEU A CG 1 ATOM 4033 C CD1 . LEU A 1 523 ? 29.068 52.793 -51.801 1.00 62.79 ? 558 LEU A CD1 1 ATOM 4034 C CD2 . LEU A 1 523 ? 30.538 51.300 -53.198 1.00 58.90 ? 558 LEU A CD2 1 ATOM 4035 N N . GLN A 1 524 ? 33.131 50.719 -48.577 1.00 58.86 ? 559 GLN A N 1 ATOM 4036 C CA . GLN A 1 524 ? 34.334 50.969 -47.789 1.00 59.34 ? 559 GLN A CA 1 ATOM 4037 C C . GLN A 1 524 ? 34.780 52.416 -47.947 1.00 62.33 ? 559 GLN A C 1 ATOM 4038 O O . GLN A 1 524 ? 35.344 53.010 -47.029 1.00 61.19 ? 559 GLN A O 1 ATOM 4039 C CB . GLN A 1 524 ? 35.460 50.021 -48.206 1.00 58.92 ? 559 GLN A CB 1 ATOM 4040 N N . SER A 1 525 ? 34.499 52.977 -49.119 1.00 63.52 ? 560 SER A N 1 ATOM 4041 C CA . SER A 1 525 ? 34.812 54.365 -49.430 1.00 62.47 ? 560 SER A CA 1 ATOM 4042 C C . SER A 1 525 ? 33.963 55.347 -48.622 1.00 62.66 ? 560 SER A C 1 ATOM 4043 O O . SER A 1 525 ? 34.327 56.515 -48.471 1.00 64.87 ? 560 SER A O 1 ATOM 4044 C CB . SER A 1 525 ? 34.637 54.618 -50.934 1.00 62.75 ? 560 SER A CB 1 ATOM 4045 O OG . SER A 1 525 ? 33.421 54.061 -51.413 1.00 56.70 ? 560 SER A OG 1 ATOM 4046 N N . ASP A 1 526 ? 32.834 54.874 -48.101 1.00 59.53 ? 561 ASP A N 1 ATOM 4047 C CA . ASP A 1 526 ? 31.953 55.724 -47.309 1.00 63.17 ? 561 ASP A CA 1 ATOM 4048 C C . ASP A 1 526 ? 32.466 55.937 -45.884 1.00 64.14 ? 561 ASP A C 1 ATOM 4049 O O . ASP A 1 526 ? 31.909 56.737 -45.132 1.00 61.50 ? 561 ASP A O 1 ATOM 4050 C CB . ASP A 1 526 ? 30.541 55.138 -47.268 1.00 58.48 ? 561 ASP A CB 1 ATOM 4051 C CG . ASP A 1 526 ? 29.860 55.179 -48.613 1.00 66.25 ? 561 ASP A CG 1 ATOM 4052 O OD1 . ASP A 1 526 ? 30.154 56.112 -49.386 1.00 69.72 ? 561 ASP A OD1 1 ATOM 4053 O OD2 . ASP A 1 526 ? 29.034 54.285 -48.898 1.00 63.48 ? 561 ASP A OD2 1 ATOM 4054 N N . PHE A 1 527 ? 33.532 55.235 -45.516 1.00 59.58 ? 562 PHE A N 1 ATOM 4055 C CA . PHE A 1 527 ? 33.986 55.237 -44.130 1.00 61.23 ? 562 PHE A CA 1 ATOM 4056 C C . PHE A 1 527 ? 35.318 55.947 -43.910 1.00 60.02 ? 562 PHE A C 1 ATOM 4057 O O . PHE A 1 527 ? 36.316 55.638 -44.558 1.00 63.19 ? 562 PHE A O 1 ATOM 4058 C CB . PHE A 1 527 ? 34.074 53.801 -43.606 1.00 60.83 ? 562 PHE A CB 1 ATOM 4059 C CG . PHE A 1 527 ? 32.750 53.104 -43.527 1.00 59.38 ? 562 PHE A CG 1 ATOM 4060 C CD1 . PHE A 1 527 ? 31.986 53.169 -42.373 1.00 60.58 ? 562 PHE A CD1 1 ATOM 4061 C CD2 . PHE A 1 527 ? 32.265 52.382 -44.604 1.00 58.60 ? 562 PHE A CD2 1 ATOM 4062 C CE1 . PHE A 1 527 ? 30.756 52.525 -42.294 1.00 55.44 ? 562 PHE A CE1 1 ATOM 4063 C CE2 . PHE A 1 527 ? 31.037 51.739 -44.533 1.00 60.74 ? 562 PHE A CE2 1 ATOM 4064 C CZ . PHE A 1 527 ? 30.283 51.812 -43.374 1.00 56.92 ? 562 PHE A CZ 1 ATOM 4065 N N . ASP A 1 528 ? 35.325 56.898 -42.982 1.00 61.62 ? 563 ASP A N 1 ATOM 4066 C CA . ASP A 1 528 ? 36.566 57.519 -42.531 1.00 64.85 ? 563 ASP A CA 1 ATOM 4067 C C . ASP A 1 528 ? 36.667 57.436 -41.009 1.00 63.38 ? 563 ASP A C 1 ATOM 4068 O O . ASP A 1 528 ? 36.330 58.387 -40.298 1.00 55.10 ? 563 ASP A O 1 ATOM 4069 C CB . ASP A 1 528 ? 36.654 58.973 -42.992 1.00 65.36 ? 563 ASP A CB 1 ATOM 4070 C CG . ASP A 1 528 ? 38.070 59.521 -42.918 1.00 70.13 ? 563 ASP A CG 1 ATOM 4071 O OD1 . ASP A 1 528 ? 39.016 58.710 -42.787 1.00 66.93 ? 563 ASP A OD1 1 ATOM 4072 O OD2 . ASP A 1 528 ? 38.238 60.759 -43.000 1.00 73.25 ? 563 ASP A OD2 1 ATOM 4073 N N . LEU A 1 529 ? 37.135 56.291 -40.518 1.00 61.06 ? 564 LEU A N 1 ATOM 4074 C CA . LEU A 1 529 ? 37.147 56.017 -39.086 1.00 55.76 ? 564 LEU A CA 1 ATOM 4075 C C . LEU A 1 529 ? 38.566 55.899 -38.531 1.00 57.65 ? 564 LEU A C 1 ATOM 4076 O O . LEU A 1 529 ? 38.767 55.782 -37.324 1.00 52.56 ? 564 LEU A O 1 ATOM 4077 C CB . LEU A 1 529 ? 36.347 54.744 -38.799 1.00 56.13 ? 564 LEU A CB 1 ATOM 4078 C CG . LEU A 1 529 ? 34.918 54.749 -39.361 1.00 56.57 ? 564 LEU A CG 1 ATOM 4079 C CD1 . LEU A 1 529 ? 34.222 53.414 -39.145 1.00 53.14 ? 564 LEU A CD1 1 ATOM 4080 C CD2 . LEU A 1 529 ? 34.102 55.879 -38.757 1.00 53.12 ? 564 LEU A CD2 1 ATOM 4081 N N . GLY A 1 530 ? 39.552 55.942 -39.416 1.00 51.72 ? 565 GLY A N 1 ATOM 4082 C CA . GLY A 1 530 ? 40.938 55.870 -38.997 1.00 55.11 ? 565 GLY A CA 1 ATOM 4083 C C . GLY A 1 530 ? 41.421 54.447 -38.792 1.00 58.51 ? 565 GLY A C 1 ATOM 4084 O O . GLY A 1 530 ? 42.505 54.223 -38.251 1.00 57.62 ? 565 GLY A O 1 ATOM 4085 N N . CYS A 1 531 ? 40.624 53.481 -39.233 1.00 57.54 ? 566 CYS A N 1 ATOM 4086 C CA . CYS A 1 531 ? 40.980 52.076 -39.076 1.00 55.24 ? 566 CYS A CA 1 ATOM 4087 C C . CYS A 1 531 ? 41.825 51.569 -40.248 1.00 60.94 ? 566 CYS A C 1 ATOM 4088 O O . CYS A 1 531 ? 41.752 52.098 -41.357 1.00 58.48 ? 566 CYS A O 1 ATOM 4089 C CB . CYS A 1 531 ? 39.720 51.221 -38.901 1.00 59.67 ? 566 CYS A CB 1 ATOM 4090 S SG . CYS A 1 531 ? 38.610 51.776 -37.563 1.00 63.54 ? 566 CYS A SG 1 ATOM 4091 N N . THR A 1 532 ? 42.638 50.550 -39.988 1.00 56.07 ? 567 THR A N 1 ATOM 4092 C CA . THR A 1 532 ? 43.495 49.961 -41.008 1.00 56.15 ? 567 THR A CA 1 ATOM 4093 C C . THR A 1 532 ? 43.516 48.441 -40.908 1.00 57.98 ? 567 THR A C 1 ATOM 4094 O O . THR A 1 532 ? 43.618 47.881 -39.817 1.00 57.15 ? 567 THR A O 1 ATOM 4095 C CB . THR A 1 532 ? 44.949 50.474 -40.896 1.00 58.03 ? 567 THR A CB 1 ATOM 4096 O OG1 . THR A 1 532 ? 45.423 50.295 -39.554 1.00 60.71 ? 567 THR A OG1 1 ATOM 4097 C CG2 . THR A 1 532 ? 45.033 51.947 -41.261 1.00 58.25 ? 567 THR A CG2 1 ATOM 4098 N N . CYS A 1 533 ? 43.408 47.776 -42.051 1.00 62.45 ? 568 CYS A N 1 ATOM 4099 C CA . CYS A 1 533 ? 43.604 46.335 -42.103 1.00 62.47 ? 568 CYS A CA 1 ATOM 4100 C C . CYS A 1 533 ? 44.578 45.973 -43.217 1.00 65.49 ? 568 CYS A C 1 ATOM 4101 O O . CYS A 1 533 ? 44.304 46.205 -44.397 1.00 64.68 ? 568 CYS A O 1 ATOM 4102 C CB . CYS A 1 533 ? 42.279 45.593 -42.280 1.00 60.02 ? 568 CYS A CB 1 ATOM 4103 S SG . CYS A 1 533 ? 42.392 43.859 -41.792 1.00 60.80 ? 568 CYS A SG 1 ATOM 4104 N N . ASP A 1 534 ? 45.710 45.394 -42.824 1.00 72.67 ? 569 ASP A N 1 ATOM 4105 C CA . ASP A 1 534 ? 46.827 45.153 -43.735 1.00 70.50 ? 569 ASP A CA 1 ATOM 4106 C C . ASP A 1 534 ? 46.515 44.148 -44.833 1.00 71.47 ? 569 ASP A C 1 ATOM 4107 O O . ASP A 1 534 ? 47.142 44.165 -45.893 1.00 74.56 ? 569 ASP A O 1 ATOM 4108 C CB . ASP A 1 534 ? 48.071 44.715 -42.959 1.00 70.21 ? 569 ASP A CB 1 ATOM 4109 C CG . ASP A 1 534 ? 48.621 45.817 -42.072 1.00 76.73 ? 569 ASP A CG 1 ATOM 4110 O OD1 . ASP A 1 534 ? 48.311 47.001 -42.332 1.00 72.62 ? 569 ASP A OD1 1 ATOM 4111 O OD2 . ASP A 1 534 ? 49.364 45.499 -41.116 1.00 79.45 ? 569 ASP A OD2 1 ATOM 4112 N N . ASP A 1 535 ? 45.553 43.269 -44.583 1.00 69.98 ? 570 ASP A N 1 ATOM 4113 C CA . ASP A 1 535 ? 45.146 42.316 -45.605 1.00 71.90 ? 570 ASP A CA 1 ATOM 4114 C C . ASP A 1 535 ? 43.669 42.496 -45.914 1.00 72.47 ? 570 ASP A C 1 ATOM 4115 O O . ASP A 1 535 ? 42.973 43.252 -45.238 1.00 70.23 ? 570 ASP A O 1 ATOM 4116 C CB . ASP A 1 535 ? 45.422 40.880 -45.155 1.00 68.34 ? 570 ASP A CB 1 ATOM 4117 C CG . ASP A 1 535 ? 45.629 39.927 -46.329 1.00 72.55 ? 570 ASP A CG 1 ATOM 4118 O OD1 . ASP A 1 535 ? 44.640 39.647 -47.039 1.00 75.14 ? 570 ASP A OD1 1 ATOM 4119 O OD2 . ASP A 1 535 ? 46.770 39.450 -46.538 1.00 66.98 ? 570 ASP A OD2 1 ATOM 4120 N N . LYS A 1 536 ? 43.199 41.807 -46.948 1.00 70.98 ? 571 LYS A N 1 ATOM 4121 C CA . LYS A 1 536 ? 41.780 41.786 -47.268 1.00 72.29 ? 571 LYS A CA 1 ATOM 4122 C C . LYS A 1 536 ? 41.343 40.396 -47.725 1.00 76.56 ? 571 LYS A C 1 ATOM 4123 O O . LYS A 1 536 ? 42.117 39.650 -48.335 1.00 71.03 ? 571 LYS A O 1 ATOM 4124 C CB . LYS A 1 536 ? 41.431 42.841 -48.326 1.00 75.88 ? 571 LYS A CB 1 ATOM 4125 C CG . LYS A 1 536 ? 41.411 44.270 -47.797 1.00 76.63 ? 571 LYS A CG 1 ATOM 4126 C CD . LYS A 1 536 ? 40.433 44.413 -46.635 1.00 77.00 ? 571 LYS A CD 1 ATOM 4127 C CE . LYS A 1 536 ? 40.638 45.724 -45.888 1.00 73.00 ? 571 LYS A CE 1 ATOM 4128 N NZ . LYS A 1 536 ? 39.690 45.862 -44.740 1.00 63.50 ? 571 LYS A NZ 1 ATOM 4129 N N . ASN A 1 537 ? 40.103 40.048 -47.396 1.00 77.95 ? 572 ASN A N 1 ATOM 4130 C CA . ASN A 1 537 ? 39.478 38.841 -47.910 1.00 68.33 ? 572 ASN A CA 1 ATOM 4131 C C . ASN A 1 537 ? 38.626 39.244 -49.096 1.00 73.55 ? 572 ASN A C 1 ATOM 4132 O O . ASN A 1 537 ? 37.513 39.743 -48.930 1.00 73.71 ? 572 ASN A O 1 ATOM 4133 C CB . ASN A 1 537 ? 38.614 38.174 -46.836 1.00 71.99 ? 572 ASN A CB 1 ATOM 4134 C CG . ASN A 1 537 ? 38.174 36.766 -47.221 1.00 68.39 ? 572 ASN A CG 1 ATOM 4135 O OD1 . ASN A 1 537 ? 38.225 36.382 -48.389 1.00 63.65 ? 572 ASN A OD1 1 ATOM 4136 N ND2 . ASN A 1 537 ? 37.732 35.992 -46.232 1.00 67.49 ? 572 ASN A ND2 1 ATOM 4137 N N . LYS A 1 538 ? 39.169 39.046 -50.293 1.00 77.53 ? 573 LYS A N 1 ATOM 4138 C CA . LYS A 1 538 ? 38.475 39.404 -51.523 1.00 80.63 ? 573 LYS A CA 1 ATOM 4139 C C . LYS A 1 538 ? 37.414 38.365 -51.873 1.00 76.45 ? 573 LYS A C 1 ATOM 4140 O O . LYS A 1 538 ? 36.587 38.587 -52.759 1.00 74.04 ? 573 LYS A O 1 ATOM 4141 C CB . LYS A 1 538 ? 39.470 39.552 -52.680 1.00 83.40 ? 573 LYS A CB 1 ATOM 4142 C CG . LYS A 1 538 ? 40.412 40.746 -52.559 1.00 83.20 ? 573 LYS A CG 1 ATOM 4143 C CD . LYS A 1 538 ? 39.659 42.068 -52.650 1.00 84.28 ? 573 LYS A CD 1 ATOM 4144 C CE . LYS A 1 538 ? 38.781 42.132 -53.898 1.00 85.81 ? 573 LYS A CE 1 ATOM 4145 N NZ . LYS A 1 538 ? 39.541 41.887 -55.157 1.00 85.86 ? 573 LYS A NZ 1 ATOM 4146 N N . LEU A 1 539 ? 37.443 37.238 -51.164 1.00 71.93 ? 574 LEU A N 1 ATOM 4147 C CA . LEU A 1 539 ? 36.541 36.119 -51.439 1.00 67.99 ? 574 LEU A CA 1 ATOM 4148 C C . LEU A 1 539 ? 35.135 36.327 -50.875 1.00 66.41 ? 574 LEU A C 1 ATOM 4149 O O . LEU A 1 539 ? 34.152 35.906 -51.489 1.00 67.70 ? 574 LEU A O 1 ATOM 4150 C CB . LEU A 1 539 ? 37.131 34.802 -50.918 1.00 60.54 ? 574 LEU A CB 1 ATOM 4151 C CG . LEU A 1 539 ? 36.356 33.530 -51.265 1.00 54.94 ? 574 LEU A CG 1 ATOM 4152 C CD1 . LEU A 1 539 ? 36.324 33.319 -52.786 1.00 46.01 ? 574 LEU A CD1 1 ATOM 4153 C CD2 . LEU A 1 539 ? 36.938 32.315 -50.547 1.00 49.44 ? 574 LEU A CD2 1 ATOM 4154 N N . GLU A 1 540 ? 35.037 36.971 -49.712 1.00 71.12 ? 575 GLU A N 1 ATOM 4155 C CA . GLU A 1 540 ? 33.736 37.273 -49.117 1.00 69.38 ? 575 GLU A CA 1 ATOM 4156 C C . GLU A 1 540 ? 33.079 38.448 -49.845 1.00 71.73 ? 575 GLU A C 1 ATOM 4157 O O . GLU A 1 540 ? 31.881 38.705 -49.703 1.00 69.74 ? 575 GLU A O 1 ATOM 4158 C CB . GLU A 1 540 ? 33.874 37.579 -47.625 1.00 64.80 ? 575 GLU A CB 1 ATOM 4159 C CG . GLU A 1 540 ? 34.485 38.934 -47.309 1.00 68.91 ? 575 GLU A CG 1 ATOM 4160 C CD . GLU A 1 540 ? 34.350 39.304 -45.838 1.00 65.40 ? 575 GLU A CD 1 ATOM 4161 O OE1 . GLU A 1 540 ? 34.449 40.505 -45.513 1.00 65.74 ? 575 GLU A OE1 1 ATOM 4162 O OE2 . GLU A 1 540 ? 34.141 38.394 -45.006 1.00 65.54 ? 575 GLU A OE2 1 ATOM 4163 N N . GLU A 1 541 ? 33.883 39.156 -50.630 1.00 70.91 ? 576 GLU A N 1 ATOM 4164 C CA . GLU A 1 541 ? 33.387 40.215 -51.495 1.00 71.55 ? 576 GLU A CA 1 ATOM 4165 C C . GLU A 1 541 ? 32.740 39.588 -52.736 1.00 70.97 ? 576 GLU A C 1 ATOM 4166 O O . GLU A 1 541 ? 32.023 40.255 -53.488 1.00 69.98 ? 576 GLU A O 1 ATOM 4167 C CB . GLU A 1 541 ? 34.538 41.150 -51.869 1.00 71.39 ? 576 GLU A CB 1 ATOM 4168 C CG . GLU A 1 541 ? 35.466 41.419 -50.687 1.00 76.50 ? 576 GLU A CG 1 ATOM 4169 C CD . GLU A 1 541 ? 36.549 42.441 -50.983 1.00 86.18 ? 576 GLU A CD 1 ATOM 4170 O OE1 . GLU A 1 541 ? 36.434 43.160 -51.999 1.00 86.39 ? 576 GLU A OE1 1 ATOM 4171 O OE2 . GLU A 1 541 ? 37.516 42.528 -50.190 1.00 84.05 ? 576 GLU A OE2 1 ATOM 4172 N N . LEU A 1 542 ? 32.997 38.297 -52.938 1.00 63.63 ? 577 LEU A N 1 ATOM 4173 C CA . LEU A 1 542 ? 32.308 37.521 -53.962 1.00 60.52 ? 577 LEU A CA 1 ATOM 4174 C C . LEU A 1 542 ? 31.205 36.676 -53.330 1.00 64.05 ? 577 LEU A C 1 ATOM 4175 O O . LEU A 1 542 ? 30.451 35.996 -54.031 1.00 62.62 ? 577 LEU A O 1 ATOM 4176 C CB . LEU A 1 542 ? 33.281 36.634 -54.742 1.00 47.57 ? 577 LEU A CB 1 ATOM 4177 C CG . LEU A 1 542 ? 33.263 36.902 -56.248 1.00 51.75 ? 577 LEU A CG 1 ATOM 4178 C CD1 . LEU A 1 542 ? 31.820 37.032 -56.745 1.00 42.00 ? 577 LEU A CD1 1 ATOM 4179 C CD2 . LEU A 1 542 ? 34.073 38.145 -56.594 1.00 51.19 ? 577 LEU A CD2 1 ATOM 4180 N N . ASN A 1 543 ? 31.122 36.719 -52.002 1.00 64.35 ? 578 ASN A N 1 ATOM 4181 C CA . ASN A 1 543 ? 30.018 36.096 -51.279 1.00 65.14 ? 578 ASN A CA 1 ATOM 4182 C C . ASN A 1 543 ? 28.780 36.971 -51.411 1.00 62.18 ? 578 ASN A C 1 ATOM 4183 O O . ASN A 1 543 ? 28.705 38.049 -50.821 1.00 63.70 ? 578 ASN A O 1 ATOM 4184 C CB . ASN A 1 543 ? 30.376 35.886 -49.800 1.00 61.63 ? 578 ASN A CB 1 ATOM 4185 C CG . ASN A 1 543 ? 29.342 35.051 -49.053 1.00 64.51 ? 578 ASN A CG 1 ATOM 4186 O OD1 . ASN A 1 543 ? 28.351 34.596 -49.631 1.00 61.78 ? 578 ASN A OD1 1 ATOM 4187 N ND2 . ASN A 1 543 ? 29.577 34.839 -47.758 1.00 64.72 ? 578 ASN A ND2 1 ATOM 4188 N N . LYS A 1 544 ? 27.822 36.511 -52.210 1.00 62.56 ? 579 LYS A N 1 ATOM 4189 C CA . LYS A 1 544 ? 26.591 37.258 -52.434 1.00 61.31 ? 579 LYS A CA 1 ATOM 4190 C C . LYS A 1 544 ? 25.645 37.111 -51.239 1.00 58.84 ? 579 LYS A C 1 ATOM 4191 O O . LYS A 1 544 ? 24.916 38.045 -50.901 1.00 55.95 ? 579 LYS A O 1 ATOM 4192 C CB . LYS A 1 544 ? 25.926 36.833 -53.757 1.00 56.79 ? 579 LYS A CB 1 ATOM 4193 C CG . LYS A 1 544 ? 26.749 37.223 -55.006 1.00 58.00 ? 579 LYS A CG 1 ATOM 4194 C CD . LYS A 1 544 ? 26.186 36.641 -56.307 1.00 48.85 ? 579 LYS A CD 1 ATOM 4195 C CE . LYS A 1 544 ? 26.949 37.156 -57.541 1.00 44.44 ? 579 LYS A CE 1 ATOM 4196 N NZ . LYS A 1 544 ? 27.755 36.123 -58.228 1.00 33.40 ? 579 LYS A NZ 1 ATOM 4197 N N . ARG A 1 545 ? 25.679 35.949 -50.588 1.00 51.24 ? 580 ARG A N 1 ATOM 4198 C CA . ARG A 1 545 ? 24.850 35.711 -49.405 1.00 55.30 ? 580 ARG A CA 1 ATOM 4199 C C . ARG A 1 545 ? 25.592 36.063 -48.115 1.00 61.24 ? 580 ARG A C 1 ATOM 4200 O O . ARG A 1 545 ? 25.217 35.609 -47.027 1.00 58.56 ? 580 ARG A O 1 ATOM 4201 C CB . ARG A 1 545 ? 24.377 34.256 -49.355 1.00 55.65 ? 580 ARG A CB 1 ATOM 4202 N N . LEU A 1 546 ? 26.643 36.869 -48.250 1.00 61.41 ? 581 LEU A N 1 ATOM 4203 C CA . LEU A 1 546 ? 27.459 37.306 -47.118 1.00 59.51 ? 581 LEU A CA 1 ATOM 4204 C C . LEU A 1 546 ? 26.638 38.027 -46.048 1.00 60.55 ? 581 LEU A C 1 ATOM 4205 O O . LEU A 1 546 ? 25.985 39.040 -46.327 1.00 56.58 ? 581 LEU A O 1 ATOM 4206 C CB . LEU A 1 546 ? 28.597 38.220 -47.593 1.00 61.77 ? 581 LEU A CB 1 ATOM 4207 C CG . LEU A 1 546 ? 29.528 38.747 -46.498 1.00 58.90 ? 581 LEU A CG 1 ATOM 4208 C CD1 . LEU A 1 546 ? 30.353 37.605 -45.923 1.00 61.48 ? 581 LEU A CD1 1 ATOM 4209 C CD2 . LEU A 1 546 ? 30.426 39.861 -47.020 1.00 61.62 ? 581 LEU A CD2 1 ATOM 4210 N N . HIS A 1 547 ? 26.684 37.491 -44.828 1.00 62.25 ? 582 HIS A N 1 ATOM 4211 C CA . HIS A 1 547 ? 26.025 38.087 -43.662 1.00 56.07 ? 582 HIS A CA 1 ATOM 4212 C C . HIS A 1 547 ? 24.493 38.079 -43.753 1.00 57.36 ? 582 HIS A C 1 ATOM 4213 O O . HIS A 1 547 ? 23.816 38.937 -43.180 1.00 53.63 ? 582 HIS A O 1 ATOM 4214 C CB . HIS A 1 547 ? 26.568 39.495 -43.389 1.00 53.01 ? 582 HIS A CB 1 ATOM 4215 C CG . HIS A 1 547 ? 28.050 39.536 -43.175 1.00 55.84 ? 582 HIS A CG 1 ATOM 4216 N ND1 . HIS A 1 547 ? 28.811 40.658 -43.430 1.00 54.94 ? 582 HIS A ND1 1 ATOM 4217 C CD2 . HIS A 1 547 ? 28.912 38.588 -42.735 1.00 50.77 ? 582 HIS A CD2 1 ATOM 4218 C CE1 . HIS A 1 547 ? 30.077 40.401 -43.151 1.00 56.02 ? 582 HIS A CE1 1 ATOM 4219 N NE2 . HIS A 1 547 ? 30.166 39.151 -42.729 1.00 60.00 ? 582 HIS A NE2 1 ATOM 4220 N N . THR A 1 548 ? 23.956 37.107 -44.484 1.00 60.56 ? 583 THR A N 1 ATOM 4221 C CA . THR A 1 548 ? 22.523 36.844 -44.470 1.00 55.80 ? 583 THR A CA 1 ATOM 4222 C C . THR A 1 548 ? 22.282 35.826 -43.367 1.00 53.54 ? 583 THR A C 1 ATOM 4223 O O . THR A 1 548 ? 23.244 35.281 -42.817 1.00 51.68 ? 583 THR A O 1 ATOM 4224 C CB . THR A 1 548 ? 22.038 36.284 -45.817 1.00 55.53 ? 583 THR A CB 1 ATOM 4225 O OG1 . THR A 1 548 ? 22.659 35.016 -46.065 1.00 50.79 ? 583 THR A OG1 1 ATOM 4226 C CG2 . THR A 1 548 ? 22.391 37.242 -46.942 1.00 53.61 ? 583 THR A CG2 1 ATOM 4227 N N . LYS A 1 549 ? 21.018 35.567 -43.034 1.00 55.18 ? 584 LYS A N 1 ATOM 4228 C CA . LYS A 1 549 ? 20.713 34.660 -41.928 1.00 53.83 ? 584 LYS A CA 1 ATOM 4229 C C . LYS A 1 549 ? 21.333 33.280 -42.129 1.00 60.22 ? 584 LYS A C 1 ATOM 4230 O O . LYS A 1 549 ? 22.220 32.876 -41.373 1.00 55.06 ? 584 LYS A O 1 ATOM 4231 C CB . LYS A 1 549 ? 19.206 34.524 -41.692 1.00 54.58 ? 584 LYS A CB 1 ATOM 4232 C CG . LYS A 1 549 ? 18.880 33.727 -40.426 1.00 56.12 ? 584 LYS A CG 1 ATOM 4233 C CD . LYS A 1 549 ? 17.442 33.224 -40.398 1.00 61.44 ? 584 LYS A CD 1 ATOM 4234 C CE . LYS A 1 549 ? 16.453 34.331 -40.073 1.00 57.05 ? 584 LYS A CE 1 ATOM 4235 N NZ . LYS A 1 549 ? 15.044 33.830 -40.128 1.00 64.87 ? 584 LYS A NZ 1 ATOM 4236 N N . GLY A 1 550 ? 20.881 32.572 -43.161 1.00 61.49 ? 585 GLY A N 1 ATOM 4237 C CA . GLY A 1 550 ? 21.346 31.218 -43.399 1.00 60.04 ? 585 GLY A CA 1 ATOM 4238 C C . GLY A 1 550 ? 21.136 30.363 -42.163 1.00 61.19 ? 585 GLY A C 1 ATOM 4239 O O . GLY A 1 550 ? 20.108 30.467 -41.492 1.00 55.53 ? 585 GLY A O 1 ATOM 4240 N N . SER A 1 551 ? 22.125 29.537 -41.843 1.00 59.66 ? 586 SER A N 1 ATOM 4241 C CA . SER A 1 551 ? 22.021 28.651 -40.695 1.00 60.27 ? 586 SER A CA 1 ATOM 4242 C C . SER A 1 551 ? 22.714 29.240 -39.471 1.00 60.86 ? 586 SER A C 1 ATOM 4243 O O . SER A 1 551 ? 23.018 28.520 -38.519 1.00 59.95 ? 586 SER A O 1 ATOM 4244 C CB . SER A 1 551 ? 22.614 27.282 -41.029 1.00 66.73 ? 586 SER A CB 1 ATOM 4245 O OG . SER A 1 551 ? 23.973 27.400 -41.421 1.00 66.40 ? 586 SER A OG 1 ATOM 4246 N N . THR A 1 552 ? 22.960 30.549 -39.503 1.00 60.34 ? 587 THR A N 1 ATOM 4247 C CA . THR A 1 552 ? 23.627 31.240 -38.401 1.00 56.61 ? 587 THR A CA 1 ATOM 4248 C C . THR A 1 552 ? 22.793 31.174 -37.130 1.00 55.58 ? 587 THR A C 1 ATOM 4249 O O . THR A 1 552 ? 23.290 30.811 -36.060 1.00 55.84 ? 587 THR A O 1 ATOM 4250 C CB . THR A 1 552 ? 23.907 32.722 -38.739 1.00 52.16 ? 587 THR A CB 1 ATOM 4251 O OG1 . THR A 1 552 ? 24.924 32.799 -39.746 1.00 55.37 ? 587 THR A OG1 1 ATOM 4252 C CG2 . THR A 1 552 ? 24.375 33.487 -37.496 1.00 52.57 ? 587 THR A CG2 1 ATOM 4253 N N . GLU A 1 553 ? 21.517 31.519 -37.259 1.00 56.29 ? 588 GLU A N 1 ATOM 4254 C CA . GLU A 1 553 ? 20.629 31.567 -36.111 1.00 52.89 ? 588 GLU A CA 1 ATOM 4255 C C . GLU A 1 553 ? 20.486 30.205 -35.431 1.00 53.33 ? 588 GLU A C 1 ATOM 4256 O O . GLU A 1 553 ? 20.577 30.103 -34.212 1.00 48.73 ? 588 GLU A O 1 ATOM 4257 C CB . GLU A 1 553 ? 19.267 32.107 -36.527 1.00 54.93 ? 588 GLU A CB 1 ATOM 4258 C CG . GLU A 1 553 ? 18.308 32.282 -35.382 1.00 48.41 ? 588 GLU A CG 1 ATOM 4259 C CD . GLU A 1 553 ? 17.117 33.123 -35.766 1.00 57.07 ? 588 GLU A CD 1 ATOM 4260 O OE1 . GLU A 1 553 ? 17.191 34.362 -35.612 1.00 57.09 ? 588 GLU A OE1 1 ATOM 4261 O OE2 . GLU A 1 553 ? 16.111 32.543 -36.232 1.00 61.96 ? 588 GLU A OE2 1 ATOM 4262 N N . GLU A 1 554 ? 20.278 29.154 -36.215 1.00 51.52 ? 589 GLU A N 1 ATOM 4263 C CA . GLU A 1 554 ? 20.107 27.831 -35.626 1.00 54.44 ? 589 GLU A CA 1 ATOM 4264 C C . GLU A 1 554 ? 21.418 27.246 -35.095 1.00 49.89 ? 589 GLU A C 1 ATOM 4265 O O . GLU A 1 554 ? 21.404 26.303 -34.308 1.00 50.78 ? 589 GLU A O 1 ATOM 4266 C CB . GLU A 1 554 ? 19.422 26.867 -36.602 1.00 57.79 ? 589 GLU A CB 1 ATOM 4267 C CG . GLU A 1 554 ? 20.221 26.532 -37.847 1.00 62.22 ? 589 GLU A CG 1 ATOM 4268 C CD . GLU A 1 554 ? 19.487 25.556 -38.763 1.00 71.51 ? 589 GLU A CD 1 ATOM 4269 O OE1 . GLU A 1 554 ? 19.817 25.501 -39.970 1.00 72.18 ? 589 GLU A OE1 1 ATOM 4270 O OE2 . GLU A 1 554 ? 18.580 24.842 -38.275 1.00 70.40 ? 589 GLU A OE2 1 ATOM 4271 N N . ARG A 1 555 ? 22.551 27.805 -35.512 1.00 49.31 ? 590 ARG A N 1 ATOM 4272 C CA . ARG A 1 555 ? 23.837 27.337 -34.996 1.00 47.25 ? 590 ARG A CA 1 ATOM 4273 C C . ARG A 1 555 ? 24.336 28.155 -33.802 1.00 46.68 ? 590 ARG A C 1 ATOM 4274 O O . ARG A 1 555 ? 24.922 27.599 -32.874 1.00 42.83 ? 590 ARG A O 1 ATOM 4275 C CB . ARG A 1 555 ? 24.908 27.300 -36.094 1.00 52.86 ? 590 ARG A CB 1 ATOM 4276 C CG . ARG A 1 555 ? 24.820 26.081 -37.014 1.00 60.35 ? 590 ARG A CG 1 ATOM 4277 C CD . ARG A 1 555 ? 25.976 26.023 -38.014 1.00 62.36 ? 590 ARG A CD 1 ATOM 4278 N NE . ARG A 1 555 ? 25.997 27.189 -38.894 1.00 65.91 ? 590 ARG A NE 1 ATOM 4279 C CZ . ARG A 1 555 ? 26.916 28.150 -38.841 1.00 65.70 ? 590 ARG A CZ 1 ATOM 4280 N NH1 . ARG A 1 555 ? 27.902 28.076 -37.953 1.00 63.51 ? 590 ARG A NH1 1 ATOM 4281 N NH2 . ARG A 1 555 ? 26.854 29.181 -39.680 1.00 56.80 ? 590 ARG A NH2 1 ATOM 4282 N N . HIS A 1 556 ? 24.109 29.465 -33.827 1.00 39.27 ? 591 HIS A N 1 ATOM 4283 C CA . HIS A 1 556 ? 24.727 30.355 -32.846 1.00 45.12 ? 591 HIS A CA 1 ATOM 4284 C C . HIS A 1 556 ? 23.754 31.018 -31.863 1.00 44.09 ? 591 HIS A C 1 ATOM 4285 O O . HIS A 1 556 ? 24.174 31.576 -30.848 1.00 38.88 ? 591 HIS A O 1 ATOM 4286 C CB . HIS A 1 556 ? 25.579 31.412 -33.553 1.00 37.44 ? 591 HIS A CB 1 ATOM 4287 C CG . HIS A 1 556 ? 26.688 30.832 -34.371 1.00 43.17 ? 591 HIS A CG 1 ATOM 4288 N ND1 . HIS A 1 556 ? 27.602 29.937 -33.854 1.00 38.48 ? 591 HIS A ND1 1 ATOM 4289 C CD2 . HIS A 1 556 ? 27.026 31.008 -35.670 1.00 44.04 ? 591 HIS A CD2 1 ATOM 4290 C CE1 . HIS A 1 556 ? 28.455 29.588 -34.801 1.00 43.63 ? 591 HIS A CE1 1 ATOM 4291 N NE2 . HIS A 1 556 ? 28.129 30.225 -35.912 1.00 42.99 ? 591 HIS A NE2 1 ATOM 4292 N N . LEU A 1 557 ? 22.461 30.940 -32.155 1.00 37.45 ? 592 LEU A N 1 ATOM 4293 C CA . LEU A 1 557 ? 21.451 31.558 -31.306 1.00 40.57 ? 592 LEU A CA 1 ATOM 4294 C C . LEU A 1 557 ? 20.408 30.526 -30.842 1.00 39.67 ? 592 LEU A C 1 ATOM 4295 O O . LEU A 1 557 ? 19.256 30.549 -31.262 1.00 40.56 ? 592 LEU A O 1 ATOM 4296 C CB . LEU A 1 557 ? 20.795 32.709 -32.062 1.00 40.32 ? 592 LEU A CB 1 ATOM 4297 C CG . LEU A 1 557 ? 19.891 33.662 -31.284 1.00 40.86 ? 592 LEU A CG 1 ATOM 4298 C CD1 . LEU A 1 557 ? 20.717 34.553 -30.355 1.00 36.11 ? 592 LEU A CD1 1 ATOM 4299 C CD2 . LEU A 1 557 ? 19.081 34.493 -32.256 1.00 44.60 ? 592 LEU A CD2 1 ATOM 4300 N N . LEU A 1 558 ? 20.821 29.645 -29.935 1.00 40.62 ? 593 LEU A N 1 ATOM 4301 C CA . LEU A 1 558 ? 20.063 28.432 -29.611 1.00 35.34 ? 593 LEU A CA 1 ATOM 4302 C C . LEU A 1 558 ? 18.745 28.612 -28.859 1.00 37.18 ? 593 LEU A C 1 ATOM 4303 O O . LEU A 1 558 ? 17.901 27.714 -28.889 1.00 38.15 ? 593 LEU A O 1 ATOM 4304 C CB . LEU A 1 558 ? 20.944 27.449 -28.839 1.00 36.27 ? 593 LEU A CB 1 ATOM 4305 C CG . LEU A 1 558 ? 22.268 27.045 -29.489 1.00 32.06 ? 593 LEU A CG 1 ATOM 4306 C CD1 . LEU A 1 558 ? 22.966 26.023 -28.617 1.00 33.39 ? 593 LEU A CD1 1 ATOM 4307 C CD2 . LEU A 1 558 ? 22.049 26.515 -30.931 1.00 37.13 ? 593 LEU A CD2 1 ATOM 4308 N N . TYR A 1 559 ? 18.561 29.750 -28.191 1.00 34.66 ? 594 TYR A N 1 ATOM 4309 C CA . TYR A 1 559 ? 17.399 29.932 -27.315 1.00 30.10 ? 594 TYR A CA 1 ATOM 4310 C C . TYR A 1 559 ? 16.569 31.160 -27.691 1.00 33.95 ? 594 TYR A C 1 ATOM 4311 O O . TYR A 1 559 ? 15.802 31.687 -26.875 1.00 33.76 ? 594 TYR A O 1 ATOM 4312 C CB . TYR A 1 559 ? 17.857 29.990 -25.847 1.00 34.08 ? 594 TYR A CB 1 ATOM 4313 C CG . TYR A 1 559 ? 19.042 29.083 -25.594 1.00 28.82 ? 594 TYR A CG 1 ATOM 4314 C CD1 . TYR A 1 559 ? 18.889 27.707 -25.593 1.00 31.34 ? 594 TYR A CD1 1 ATOM 4315 C CD2 . TYR A 1 559 ? 20.312 29.603 -25.391 1.00 30.63 ? 594 TYR A CD2 1 ATOM 4316 C CE1 . TYR A 1 559 ? 19.962 26.872 -25.379 1.00 28.95 ? 594 TYR A CE1 1 ATOM 4317 C CE2 . TYR A 1 559 ? 21.393 28.781 -25.196 1.00 26.06 ? 594 TYR A CE2 1 ATOM 4318 C CZ . TYR A 1 559 ? 21.210 27.416 -25.191 1.00 31.66 ? 594 TYR A CZ 1 ATOM 4319 O OH . TYR A 1 559 ? 22.284 26.586 -24.998 1.00 29.00 ? 594 TYR A OH 1 ATOM 4320 N N . GLY A 1 560 ? 16.710 31.594 -28.942 1.00 29.69 ? 595 GLY A N 1 ATOM 4321 C CA . GLY A 1 560 ? 16.007 32.761 -29.442 1.00 35.76 ? 595 GLY A CA 1 ATOM 4322 C C . GLY A 1 560 ? 16.808 34.012 -29.147 1.00 40.62 ? 595 GLY A C 1 ATOM 4323 O O . GLY A 1 560 ? 17.726 33.986 -28.321 1.00 42.09 ? 595 GLY A O 1 ATOM 4324 N N . ARG A 1 561 ? 16.484 35.112 -29.815 1.00 33.87 ? 596 ARG A N 1 ATOM 4325 C CA . ARG A 1 561 ? 17.185 36.352 -29.527 1.00 40.88 ? 596 ARG A CA 1 ATOM 4326 C C . ARG A 1 561 ? 16.723 36.928 -28.184 1.00 35.35 ? 596 ARG A C 1 ATOM 4327 O O . ARG A 1 561 ? 15.554 36.804 -27.817 1.00 34.33 ? 596 ARG A O 1 ATOM 4328 C CB . ARG A 1 561 ? 16.999 37.369 -30.657 1.00 41.74 ? 596 ARG A CB 1 ATOM 4329 C CG . ARG A 1 561 ? 15.580 37.853 -30.820 1.00 44.93 ? 596 ARG A CG 1 ATOM 4330 C CD . ARG A 1 561 ? 15.503 39.121 -31.672 1.00 47.95 ? 596 ARG A CD 1 ATOM 4331 N NE . ARG A 1 561 ? 14.168 39.702 -31.577 1.00 49.73 ? 596 ARG A NE 1 ATOM 4332 C CZ . ARG A 1 561 ? 13.138 39.313 -32.320 1.00 54.87 ? 596 ARG A CZ 1 ATOM 4333 N NH1 . ARG A 1 561 ? 13.299 38.351 -33.227 1.00 52.05 ? 596 ARG A NH1 1 ATOM 4334 N NH2 . ARG A 1 561 ? 11.949 39.884 -32.161 1.00 52.63 ? 596 ARG A NH2 1 ATOM 4335 N N . PRO A 1 562 ? 17.647 37.547 -27.438 1.00 31.74 ? 597 PRO A N 1 ATOM 4336 C CA . PRO A 1 562 ? 17.246 38.278 -26.230 1.00 34.90 ? 597 PRO A CA 1 ATOM 4337 C C . PRO A 1 562 ? 16.250 39.372 -26.595 1.00 34.78 ? 597 PRO A C 1 ATOM 4338 O O . PRO A 1 562 ? 16.454 40.045 -27.604 1.00 38.15 ? 597 PRO A O 1 ATOM 4339 C CB . PRO A 1 562 ? 18.553 38.934 -25.765 1.00 35.13 ? 597 PRO A CB 1 ATOM 4340 C CG . PRO A 1 562 ? 19.648 38.160 -26.421 1.00 35.01 ? 597 PRO A CG 1 ATOM 4341 C CD . PRO A 1 562 ? 19.093 37.638 -27.704 1.00 36.73 ? 597 PRO A CD 1 ATOM 4342 N N . ALA A 1 563 ? 15.189 39.547 -25.812 1.00 32.66 ? 598 ALA A N 1 ATOM 4343 C CA . ALA A 1 563 ? 14.304 40.688 -26.028 1.00 38.55 ? 598 ALA A CA 1 ATOM 4344 C C . ALA A 1 563 ? 14.892 41.927 -25.376 1.00 37.50 ? 598 ALA A C 1 ATOM 4345 O O . ALA A 1 563 ? 15.472 41.853 -24.288 1.00 33.10 ? 598 ALA A O 1 ATOM 4346 C CB . ALA A 1 563 ? 12.919 40.415 -25.488 1.00 32.79 ? 598 ALA A CB 1 ATOM 4347 N N . VAL A 1 564 ? 14.763 43.062 -26.050 1.00 36.26 ? 599 VAL A N 1 ATOM 4348 C CA . VAL A 1 564 ? 15.200 44.333 -25.488 1.00 32.66 ? 599 VAL A CA 1 ATOM 4349 C C . VAL A 1 564 ? 14.001 44.950 -24.796 1.00 38.92 ? 599 VAL A C 1 ATOM 4350 O O . VAL A 1 564 ? 12.983 45.214 -25.429 1.00 41.16 ? 599 VAL A O 1 ATOM 4351 C CB . VAL A 1 564 ? 15.727 45.279 -26.579 1.00 36.66 ? 599 VAL A CB 1 ATOM 4352 C CG1 . VAL A 1 564 ? 16.129 46.628 -25.982 1.00 34.90 ? 599 VAL A CG1 1 ATOM 4353 C CG2 . VAL A 1 564 ? 16.895 44.651 -27.308 1.00 36.68 ? 599 VAL A CG2 1 ATOM 4354 N N . LEU A 1 565 ? 14.109 45.167 -23.490 1.00 34.21 ? 600 LEU A N 1 ATOM 4355 C CA . LEU A 1 565 ? 12.958 45.605 -22.707 1.00 32.15 ? 600 LEU A CA 1 ATOM 4356 C C . LEU A 1 565 ? 12.995 47.097 -22.404 1.00 30.34 ? 600 LEU A C 1 ATOM 4357 O O . LEU A 1 565 ? 12.393 47.551 -21.441 1.00 36.71 ? 600 LEU A O 1 ATOM 4358 C CB . LEU A 1 565 ? 12.856 44.803 -21.412 1.00 35.07 ? 600 LEU A CB 1 ATOM 4359 C CG . LEU A 1 565 ? 12.871 43.282 -21.581 1.00 35.12 ? 600 LEU A CG 1 ATOM 4360 C CD1 . LEU A 1 565 ? 12.949 42.609 -20.217 1.00 35.75 ? 600 LEU A CD1 1 ATOM 4361 C CD2 . LEU A 1 565 ? 11.643 42.806 -22.336 1.00 36.05 ? 600 LEU A CD2 1 ATOM 4362 N N . TYR A 1 566 ? 13.714 47.854 -23.227 1.00 34.66 ? 601 TYR A N 1 ATOM 4363 C CA . TYR A 1 566 ? 13.737 49.311 -23.112 1.00 31.61 ? 601 TYR A CA 1 ATOM 4364 C C . TYR A 1 566 ? 13.710 49.938 -24.507 1.00 36.74 ? 601 TYR A C 1 ATOM 4365 O O . TYR A 1 566 ? 13.895 49.243 -25.504 1.00 32.52 ? 601 TYR A O 1 ATOM 4366 C CB . TYR A 1 566 ? 14.953 49.800 -22.305 1.00 28.05 ? 601 TYR A CB 1 ATOM 4367 C CG . TYR A 1 566 ? 16.320 49.480 -22.884 1.00 32.87 ? 601 TYR A CG 1 ATOM 4368 C CD1 . TYR A 1 566 ? 16.884 48.212 -22.753 1.00 29.81 ? 601 TYR A CD1 1 ATOM 4369 C CD2 . TYR A 1 566 ? 17.060 50.456 -23.528 1.00 31.97 ? 601 TYR A CD2 1 ATOM 4370 C CE1 . TYR A 1 566 ? 18.140 47.920 -23.271 1.00 31.88 ? 601 TYR A CE1 1 ATOM 4371 C CE2 . TYR A 1 566 ? 18.331 50.175 -24.046 1.00 37.85 ? 601 TYR A CE2 1 ATOM 4372 C CZ . TYR A 1 566 ? 18.858 48.907 -23.913 1.00 28.91 ? 601 TYR A CZ 1 ATOM 4373 O OH . TYR A 1 566 ? 20.102 48.625 -24.438 1.00 32.48 ? 601 TYR A OH 1 ATOM 4374 N N . ARG A 1 567 ? 13.483 51.245 -24.579 1.00 36.63 ? 602 ARG A N 1 ATOM 4375 C CA . ARG A 1 567 ? 13.355 51.917 -25.875 1.00 32.94 ? 602 ARG A CA 1 ATOM 4376 C C . ARG A 1 567 ? 14.727 52.317 -26.407 1.00 39.34 ? 602 ARG A C 1 ATOM 4377 O O . ARG A 1 567 ? 15.428 53.131 -25.806 1.00 41.52 ? 602 ARG A O 1 ATOM 4378 C CB . ARG A 1 567 ? 12.436 53.139 -25.754 1.00 39.73 ? 602 ARG A CB 1 ATOM 4379 N N . THR A 1 568 ? 15.114 51.733 -27.533 1.00 30.99 ? 603 THR A N 1 ATOM 4380 C CA . THR A 1 568 ? 16.440 51.970 -28.085 1.00 36.91 ? 603 THR A CA 1 ATOM 4381 C C . THR A 1 568 ? 16.415 51.553 -29.549 1.00 42.95 ? 603 THR A C 1 ATOM 4382 O O . THR A 1 568 ? 15.385 51.100 -30.047 1.00 46.45 ? 603 THR A O 1 ATOM 4383 C CB . THR A 1 568 ? 17.510 51.164 -27.301 1.00 35.91 ? 603 THR A CB 1 ATOM 4384 O OG1 . THR A 1 568 ? 18.833 51.632 -27.608 1.00 41.17 ? 603 THR A OG1 1 ATOM 4385 C CG2 . THR A 1 568 ? 17.399 49.676 -27.604 1.00 37.76 ? 603 THR A CG2 1 ATOM 4386 N N . SER A 1 569 ? 17.547 51.695 -30.231 1.00 41.96 ? 604 SER A N 1 ATOM 4387 C CA . SER A 1 569 ? 17.648 51.318 -31.633 1.00 43.26 ? 604 SER A CA 1 ATOM 4388 C C . SER A 1 569 ? 18.828 50.391 -31.887 1.00 39.96 ? 604 SER A C 1 ATOM 4389 O O . SER A 1 569 ? 19.983 50.751 -31.632 1.00 41.56 ? 604 SER A O 1 ATOM 4390 C CB . SER A 1 569 ? 17.761 52.569 -32.514 1.00 47.67 ? 604 SER A CB 1 ATOM 4391 O OG . SER A 1 569 ? 17.927 52.216 -33.880 1.00 53.63 ? 604 SER A OG 1 ATOM 4392 N N . TYR A 1 570 ? 18.538 49.204 -32.415 1.00 42.68 ? 605 TYR A N 1 ATOM 4393 C CA . TYR A 1 570 ? 19.577 48.205 -32.620 1.00 45.28 ? 605 TYR A CA 1 ATOM 4394 C C . TYR A 1 570 ? 19.372 47.331 -33.861 1.00 41.63 ? 605 TYR A C 1 ATOM 4395 O O . TYR A 1 570 ? 18.261 47.215 -34.366 1.00 41.72 ? 605 TYR A O 1 ATOM 4396 C CB . TYR A 1 570 ? 19.725 47.340 -31.363 1.00 40.76 ? 605 TYR A CB 1 ATOM 4397 C CG . TYR A 1 570 ? 18.688 46.251 -31.181 1.00 33.24 ? 605 TYR A CG 1 ATOM 4398 C CD1 . TYR A 1 570 ? 17.384 46.550 -30.828 1.00 37.21 ? 605 TYR A CD1 1 ATOM 4399 C CD2 . TYR A 1 570 ? 19.035 44.916 -31.318 1.00 42.06 ? 605 TYR A CD2 1 ATOM 4400 C CE1 . TYR A 1 570 ? 16.447 45.551 -30.641 1.00 35.82 ? 605 TYR A CE1 1 ATOM 4401 C CE2 . TYR A 1 570 ? 18.107 43.911 -31.130 1.00 37.53 ? 605 TYR A CE2 1 ATOM 4402 C CZ . TYR A 1 570 ? 16.815 44.237 -30.788 1.00 33.71 ? 605 TYR A CZ 1 ATOM 4403 O OH . TYR A 1 570 ? 15.888 43.234 -30.601 1.00 44.01 ? 605 TYR A OH 1 ATOM 4404 N N . ASP A 1 571 ? 20.458 46.713 -34.325 1.00 44.76 ? 606 ASP A N 1 ATOM 4405 C CA . ASP A 1 571 ? 20.463 45.926 -35.557 1.00 42.97 ? 606 ASP A CA 1 ATOM 4406 C C . ASP A 1 571 ? 20.916 44.492 -35.313 1.00 44.81 ? 606 ASP A C 1 ATOM 4407 O O . ASP A 1 571 ? 21.914 44.259 -34.633 1.00 46.31 ? 606 ASP A O 1 ATOM 4408 C CB . ASP A 1 571 ? 21.432 46.541 -36.569 1.00 45.13 ? 606 ASP A CB 1 ATOM 4409 C CG . ASP A 1 571 ? 21.193 48.016 -36.788 1.00 45.03 ? 606 ASP A CG 1 ATOM 4410 O OD1 . ASP A 1 571 ? 20.027 48.452 -36.729 1.00 49.40 ? 606 ASP A OD1 1 ATOM 4411 O OD2 . ASP A 1 571 ? 22.180 48.740 -37.020 1.00 46.80 ? 606 ASP A OD2 1 ATOM 4412 N N . ILE A 1 572 ? 20.208 43.530 -35.885 1.00 40.07 ? 607 ILE A N 1 ATOM 4413 C CA . ILE A 1 572 ? 20.695 42.158 -35.887 1.00 40.50 ? 607 ILE A CA 1 ATOM 4414 C C . ILE A 1 572 ? 21.768 42.033 -36.964 1.00 45.00 ? 607 ILE A C 1 ATOM 4415 O O . ILE A 1 572 ? 21.556 42.437 -38.105 1.00 45.95 ? 607 ILE A O 1 ATOM 4416 C CB . ILE A 1 572 ? 19.562 41.166 -36.186 1.00 38.89 ? 607 ILE A CB 1 ATOM 4417 C CG1 . ILE A 1 572 ? 18.451 41.279 -35.144 1.00 44.73 ? 607 ILE A CG1 1 ATOM 4418 C CG2 . ILE A 1 572 ? 20.095 39.750 -36.257 1.00 44.06 ? 607 ILE A CG2 1 ATOM 4419 C CD1 . ILE A 1 572 ? 18.855 40.859 -33.736 1.00 41.97 ? 607 ILE A CD1 1 ATOM 4420 N N . LEU A 1 573 ? 22.927 41.495 -36.609 1.00 41.57 ? 608 LEU A N 1 ATOM 4421 C CA . LEU A 1 573 ? 23.991 41.304 -37.588 1.00 40.22 ? 608 LEU A CA 1 ATOM 4422 C C . LEU A 1 573 ? 24.384 39.842 -37.586 1.00 44.81 ? 608 LEU A C 1 ATOM 4423 O O . LEU A 1 573 ? 24.612 39.274 -36.519 1.00 41.75 ? 608 LEU A O 1 ATOM 4424 C CB . LEU A 1 573 ? 25.203 42.165 -37.245 1.00 41.57 ? 608 LEU A CB 1 ATOM 4425 C CG . LEU A 1 573 ? 24.981 43.669 -37.068 1.00 44.43 ? 608 LEU A CG 1 ATOM 4426 C CD1 . LEU A 1 573 ? 26.269 44.334 -36.615 1.00 44.21 ? 608 LEU A CD1 1 ATOM 4427 C CD2 . LEU A 1 573 ? 24.471 44.310 -38.360 1.00 43.24 ? 608 LEU A CD2 1 ATOM 4428 N N . TYR A 1 574 ? 24.451 39.238 -38.776 1.00 44.00 ? 609 TYR A N 1 ATOM 4429 C CA . TYR A 1 574 ? 24.790 37.821 -38.928 1.00 39.43 ? 609 TYR A CA 1 ATOM 4430 C C . TYR A 1 574 ? 26.213 37.613 -39.423 1.00 44.59 ? 609 TYR A C 1 ATOM 4431 O O . TYR A 1 574 ? 26.768 38.444 -40.144 1.00 47.65 ? 609 TYR A O 1 ATOM 4432 C CB . TYR A 1 574 ? 23.831 37.131 -39.900 1.00 47.58 ? 609 TYR A CB 1 ATOM 4433 C CG . TYR A 1 574 ? 22.385 37.143 -39.470 1.00 45.33 ? 609 TYR A CG 1 ATOM 4434 C CD1 . TYR A 1 574 ? 21.913 36.233 -38.525 1.00 46.51 ? 609 TYR A CD1 1 ATOM 4435 C CD2 . TYR A 1 574 ? 21.488 38.055 -40.004 1.00 49.56 ? 609 TYR A CD2 1 ATOM 4436 C CE1 . TYR A 1 574 ? 20.599 36.234 -38.132 1.00 42.29 ? 609 TYR A CE1 1 ATOM 4437 C CE2 . TYR A 1 574 ? 20.159 38.064 -39.610 1.00 47.38 ? 609 TYR A CE2 1 ATOM 4438 C CZ . TYR A 1 574 ? 19.721 37.149 -38.673 1.00 50.53 ? 609 TYR A CZ 1 ATOM 4439 O OH . TYR A 1 574 ? 18.400 37.145 -38.272 1.00 51.97 ? 609 TYR A OH 1 ATOM 4440 N N . HIS A 1 575 ? 26.796 36.492 -39.028 1.00 36.80 ? 610 HIS A N 1 ATOM 4441 C CA . HIS A 1 575 ? 28.139 36.132 -39.430 1.00 43.90 ? 610 HIS A CA 1 ATOM 4442 C C . HIS A 1 575 ? 28.184 34.618 -39.429 1.00 46.84 ? 610 HIS A C 1 ATOM 4443 O O . HIS A 1 575 ? 27.316 33.969 -38.844 1.00 46.20 ? 610 HIS A O 1 ATOM 4444 C CB . HIS A 1 575 ? 29.185 36.685 -38.451 1.00 46.22 ? 610 HIS A CB 1 ATOM 4445 C CG . HIS A 1 575 ? 29.031 38.145 -38.150 1.00 44.45 ? 610 HIS A CG 1 ATOM 4446 N ND1 . HIS A 1 575 ? 28.053 38.635 -37.310 1.00 45.17 ? 610 HIS A ND1 1 ATOM 4447 C CD2 . HIS A 1 575 ? 29.731 39.223 -38.576 1.00 47.31 ? 610 HIS A CD2 1 ATOM 4448 C CE1 . HIS A 1 575 ? 28.153 39.950 -37.237 1.00 45.47 ? 610 HIS A CE1 1 ATOM 4449 N NE2 . HIS A 1 575 ? 29.169 40.332 -37.989 1.00 49.15 ? 610 HIS A NE2 1 ATOM 4450 N N . THR A 1 576 ? 29.184 34.053 -40.089 1.00 41.15 ? 611 THR A N 1 ATOM 4451 C CA . THR A 1 576 ? 29.331 32.606 -40.130 1.00 46.51 ? 611 THR A CA 1 ATOM 4452 C C . THR A 1 576 ? 29.521 32.050 -38.717 1.00 48.35 ? 611 THR A C 1 ATOM 4453 O O . THR A 1 576 ? 28.983 30.993 -38.373 1.00 50.69 ? 611 THR A O 1 ATOM 4454 C CB . THR A 1 576 ? 30.534 32.188 -41.011 1.00 45.69 ? 611 THR A CB 1 ATOM 4455 O OG1 . THR A 1 576 ? 30.338 32.665 -42.350 1.00 47.89 ? 611 THR A OG1 1 ATOM 4456 C CG2 . THR A 1 576 ? 30.699 30.666 -41.028 1.00 41.94 ? 611 THR A CG2 1 ATOM 4457 N N . ASP A 1 577 ? 30.267 32.786 -37.897 1.00 47.69 ? 612 ASP A N 1 ATOM 4458 C CA . ASP A 1 577 ? 30.711 32.278 -36.605 1.00 41.35 ? 612 ASP A CA 1 ATOM 4459 C C . ASP A 1 577 ? 29.927 32.813 -35.409 1.00 42.55 ? 612 ASP A C 1 ATOM 4460 O O . ASP A 1 577 ? 30.079 32.299 -34.298 1.00 43.22 ? 612 ASP A O 1 ATOM 4461 C CB . ASP A 1 577 ? 32.196 32.572 -36.409 1.00 42.55 ? 612 ASP A CB 1 ATOM 4462 C CG . ASP A 1 577 ? 33.079 31.753 -37.325 1.00 45.98 ? 612 ASP A CG 1 ATOM 4463 O OD1 . ASP A 1 577 ? 32.604 30.708 -37.823 1.00 40.74 ? 612 ASP A OD1 1 ATOM 4464 O OD2 . ASP A 1 577 ? 34.249 32.149 -37.536 1.00 44.25 ? 612 ASP A OD2 1 ATOM 4465 N N . PHE A 1 578 ? 29.097 33.827 -35.633 1.00 38.85 ? 613 PHE A N 1 ATOM 4466 C CA . PHE A 1 578 ? 28.342 34.450 -34.550 1.00 45.04 ? 613 PHE A CA 1 ATOM 4467 C C . PHE A 1 578 ? 27.248 35.379 -35.052 1.00 40.70 ? 613 PHE A C 1 ATOM 4468 O O . PHE A 1 578 ? 27.268 35.825 -36.194 1.00 43.81 ? 613 PHE A O 1 ATOM 4469 C CB . PHE A 1 578 ? 29.278 35.250 -33.641 1.00 34.87 ? 613 PHE A CB 1 ATOM 4470 C CG . PHE A 1 578 ? 29.871 36.467 -34.301 1.00 38.31 ? 613 PHE A CG 1 ATOM 4471 C CD1 . PHE A 1 578 ? 30.984 36.354 -35.114 1.00 40.57 ? 613 PHE A CD1 1 ATOM 4472 C CD2 . PHE A 1 578 ? 29.325 37.726 -34.089 1.00 38.03 ? 613 PHE A CD2 1 ATOM 4473 C CE1 . PHE A 1 578 ? 31.539 37.477 -35.721 1.00 45.56 ? 613 PHE A CE1 1 ATOM 4474 C CE2 . PHE A 1 578 ? 29.872 38.849 -34.691 1.00 39.08 ? 613 PHE A CE2 1 ATOM 4475 C CZ . PHE A 1 578 ? 30.981 38.725 -35.502 1.00 41.94 ? 613 PHE A CZ 1 ATOM 4476 N N . GLU A 1 579 ? 26.300 35.677 -34.174 1.00 35.77 ? 614 GLU A N 1 ATOM 4477 C CA . GLU A 1 579 ? 25.292 36.699 -34.423 1.00 36.81 ? 614 GLU A CA 1 ATOM 4478 C C . GLU A 1 579 ? 25.398 37.747 -33.310 1.00 40.40 ? 614 GLU A C 1 ATOM 4479 O O . GLU A 1 579 ? 25.892 37.447 -32.226 1.00 37.35 ? 614 GLU A O 1 ATOM 4480 C CB . GLU A 1 579 ? 23.895 36.058 -34.438 1.00 37.23 ? 614 GLU A CB 1 ATOM 4481 C CG . GLU A 1 579 ? 22.738 37.035 -34.610 1.00 38.72 ? 614 GLU A CG 1 ATOM 4482 C CD . GLU A 1 579 ? 21.405 36.345 -34.850 1.00 44.85 ? 614 GLU A CD 1 ATOM 4483 O OE1 . GLU A 1 579 ? 21.414 35.179 -35.310 1.00 43.96 ? 614 GLU A OE1 1 ATOM 4484 O OE2 . GLU A 1 579 ? 20.347 36.966 -34.584 1.00 40.82 ? 614 GLU A OE2 1 ATOM 4485 N N . SER A 1 580 ? 24.948 38.972 -33.565 1.00 37.43 ? 615 SER A N 1 ATOM 4486 C CA . SER A 1 580 ? 25.009 40.011 -32.547 1.00 36.11 ? 615 SER A CA 1 ATOM 4487 C C . SER A 1 580 ? 23.847 40.981 -32.665 1.00 37.75 ? 615 SER A C 1 ATOM 4488 O O . SER A 1 580 ? 23.231 41.092 -33.718 1.00 39.13 ? 615 SER A O 1 ATOM 4489 C CB . SER A 1 580 ? 26.338 40.766 -32.619 1.00 36.52 ? 615 SER A CB 1 ATOM 4490 O OG . SER A 1 580 ? 26.411 41.569 -33.780 1.00 40.05 ? 615 SER A OG 1 ATOM 4491 N N . GLY A 1 581 ? 23.538 41.665 -31.567 1.00 36.95 ? 616 GLY A N 1 ATOM 4492 C CA . GLY A 1 581 ? 22.520 42.700 -31.566 1.00 30.13 ? 616 GLY A CA 1 ATOM 4493 C C . GLY A 1 581 ? 23.203 44.037 -31.363 1.00 41.72 ? 616 GLY A C 1 ATOM 4494 O O . GLY A 1 581 ? 23.454 44.444 -30.230 1.00 37.57 ? 616 GLY A O 1 ATOM 4495 N N . TYR A 1 582 ? 23.522 44.713 -32.463 1.00 37.17 ? 617 TYR A N 1 ATOM 4496 C CA . TYR A 1 582 ? 24.351 45.921 -32.425 1.00 39.83 ? 617 TYR A CA 1 ATOM 4497 C C . TYR A 1 582 ? 23.536 47.170 -32.122 1.00 42.58 ? 617 TYR A C 1 ATOM 4498 O O . TYR A 1 582 ? 22.557 47.458 -32.801 1.00 46.73 ? 617 TYR A O 1 ATOM 4499 C CB . TYR A 1 582 ? 25.120 46.093 -33.746 1.00 36.88 ? 617 TYR A CB 1 ATOM 4500 C CG . TYR A 1 582 ? 26.013 47.311 -33.781 1.00 38.26 ? 617 TYR A CG 1 ATOM 4501 C CD1 . TYR A 1 582 ? 27.322 47.246 -33.323 1.00 36.04 ? 617 TYR A CD1 1 ATOM 4502 C CD2 . TYR A 1 582 ? 25.548 48.527 -34.272 1.00 40.85 ? 617 TYR A CD2 1 ATOM 4503 C CE1 . TYR A 1 582 ? 28.141 48.358 -33.347 1.00 36.27 ? 617 TYR A CE1 1 ATOM 4504 C CE2 . TYR A 1 582 ? 26.358 49.647 -34.293 1.00 40.62 ? 617 TYR A CE2 1 ATOM 4505 C CZ . TYR A 1 582 ? 27.653 49.553 -33.830 1.00 38.63 ? 617 TYR A CZ 1 ATOM 4506 O OH . TYR A 1 582 ? 28.478 50.652 -33.846 1.00 42.49 ? 617 TYR A OH 1 ATOM 4507 N N . SER A 1 583 ? 23.951 47.922 -31.106 1.00 37.55 ? 618 SER A N 1 ATOM 4508 C CA . SER A 1 583 ? 23.227 49.122 -30.700 1.00 40.06 ? 618 SER A CA 1 ATOM 4509 C C . SER A 1 583 ? 23.722 50.335 -31.471 1.00 43.87 ? 618 SER A C 1 ATOM 4510 O O . SER A 1 583 ? 24.921 50.631 -31.478 1.00 42.83 ? 618 SER A O 1 ATOM 4511 C CB . SER A 1 583 ? 23.398 49.381 -29.201 1.00 39.50 ? 618 SER A CB 1 ATOM 4512 O OG . SER A 1 583 ? 22.819 50.619 -28.829 1.00 36.04 ? 618 SER A OG 1 ATOM 4513 N N . GLU A 1 584 ? 22.796 51.034 -32.118 1.00 45.70 ? 619 GLU A N 1 ATOM 4514 C CA . GLU A 1 584 ? 23.145 52.231 -32.866 1.00 46.82 ? 619 GLU A CA 1 ATOM 4515 C C . GLU A 1 584 ? 23.351 53.412 -31.929 1.00 46.00 ? 619 GLU A C 1 ATOM 4516 O O . GLU A 1 584 ? 23.851 54.459 -32.344 1.00 51.97 ? 619 GLU A O 1 ATOM 4517 C CB . GLU A 1 584 ? 22.071 52.560 -33.903 1.00 47.56 ? 619 GLU A CB 1 ATOM 4518 C CG . GLU A 1 584 ? 22.149 51.722 -35.166 1.00 52.99 ? 619 GLU A CG 1 ATOM 4519 C CD . GLU A 1 584 ? 21.076 52.094 -36.180 1.00 56.11 ? 619 GLU A CD 1 ATOM 4520 O OE1 . GLU A 1 584 ? 20.333 53.076 -35.940 1.00 50.17 ? 619 GLU A OE1 1 ATOM 4521 O OE2 . GLU A 1 584 ? 20.973 51.393 -37.209 1.00 60.78 ? 619 GLU A OE2 1 ATOM 4522 N N . ILE A 1 585 ? 22.972 53.233 -30.664 1.00 44.64 ? 620 ILE A N 1 ATOM 4523 C CA . ILE A 1 585 ? 23.085 54.291 -29.666 1.00 41.38 ? 620 ILE A CA 1 ATOM 4524 C C . ILE A 1 585 ? 24.385 54.159 -28.882 1.00 44.22 ? 620 ILE A C 1 ATOM 4525 O O . ILE A 1 585 ? 25.088 55.141 -28.659 1.00 37.17 ? 620 ILE A O 1 ATOM 4526 C CB . ILE A 1 585 ? 21.888 54.275 -28.689 1.00 38.52 ? 620 ILE A CB 1 ATOM 4527 C CG1 . ILE A 1 585 ? 20.569 54.343 -29.458 1.00 50.70 ? 620 ILE A CG1 1 ATOM 4528 C CG2 . ILE A 1 585 ? 21.974 55.425 -27.703 1.00 44.58 ? 620 ILE A CG2 1 ATOM 4529 C CD1 . ILE A 1 585 ? 20.354 55.665 -30.176 1.00 48.96 ? 620 ILE A CD1 1 ATOM 4530 N N . PHE A 1 586 ? 24.716 52.941 -28.466 1.00 40.96 ? 621 PHE A N 1 ATOM 4531 C CA . PHE A 1 586 ? 25.898 52.753 -27.627 1.00 34.38 ? 621 PHE A CA 1 ATOM 4532 C C . PHE A 1 586 ? 27.116 52.329 -28.426 1.00 37.06 ? 621 PHE A C 1 ATOM 4533 O O . PHE A 1 586 ? 28.208 52.209 -27.873 1.00 35.02 ? 621 PHE A O 1 ATOM 4534 C CB . PHE A 1 586 ? 25.592 51.805 -26.461 1.00 36.43 ? 621 PHE A CB 1 ATOM 4535 C CG . PHE A 1 586 ? 24.514 52.324 -25.554 1.00 35.94 ? 621 PHE A CG 1 ATOM 4536 C CD1 . PHE A 1 586 ? 24.797 53.303 -24.613 1.00 36.62 ? 621 PHE A CD1 1 ATOM 4537 C CD2 . PHE A 1 586 ? 23.213 51.861 -25.663 1.00 35.11 ? 621 PHE A CD2 1 ATOM 4538 C CE1 . PHE A 1 586 ? 23.803 53.809 -23.789 1.00 35.74 ? 621 PHE A CE1 1 ATOM 4539 C CE2 . PHE A 1 586 ? 22.211 52.355 -24.838 1.00 34.02 ? 621 PHE A CE2 1 ATOM 4540 C CZ . PHE A 1 586 ? 22.509 53.331 -23.897 1.00 36.46 ? 621 PHE A CZ 1 ATOM 4541 N N . LEU A 1 587 ? 26.916 52.135 -29.732 1.00 41.57 ? 622 LEU A N 1 ATOM 4542 C CA . LEU A 1 587 ? 28.006 51.946 -30.697 1.00 34.51 ? 622 LEU A CA 1 ATOM 4543 C C . LEU A 1 587 ? 28.778 50.653 -30.506 1.00 31.02 ? 622 LEU A C 1 ATOM 4544 O O . LEU A 1 587 ? 30.000 50.601 -30.697 1.00 35.21 ? 622 LEU A O 1 ATOM 4545 C CB . LEU A 1 587 ? 28.962 53.141 -30.690 1.00 37.19 ? 622 LEU A CB 1 ATOM 4546 C CG . LEU A 1 587 ? 28.321 54.521 -30.825 1.00 41.79 ? 622 LEU A CG 1 ATOM 4547 C CD1 . LEU A 1 587 ? 29.398 55.583 -30.894 1.00 42.74 ? 622 LEU A CD1 1 ATOM 4548 C CD2 . LEU A 1 587 ? 27.418 54.600 -32.040 1.00 49.71 ? 622 LEU A CD2 1 ATOM 4549 N N . MET A 1 588 ? 28.041 49.614 -30.142 1.00 35.80 ? 623 MET A N 1 ATOM 4550 C CA . MET A 1 588 ? 28.605 48.313 -29.852 1.00 35.57 ? 623 MET A CA 1 ATOM 4551 C C . MET A 1 588 ? 27.435 47.369 -29.633 1.00 30.82 ? 623 MET A C 1 ATOM 4552 O O . MET A 1 588 ? 26.304 47.805 -29.426 1.00 37.65 ? 623 MET A O 1 ATOM 4553 C CB . MET A 1 588 ? 29.522 48.374 -28.613 1.00 37.09 ? 623 MET A CB 1 ATOM 4554 C CG . MET A 1 588 ? 28.808 48.534 -27.254 1.00 34.67 ? 623 MET A CG 1 ATOM 4555 S SD . MET A 1 588 ? 29.973 48.894 -25.894 1.00 35.37 ? 623 MET A SD 1 ATOM 4556 C CE . MET A 1 588 ? 30.483 50.566 -26.281 1.00 34.58 ? 623 MET A CE 1 ATOM 4557 N N . PRO A 1 589 ? 27.689 46.068 -29.703 1.00 28.79 ? 624 PRO A N 1 ATOM 4558 C CA . PRO A 1 589 ? 26.589 45.134 -29.464 1.00 32.89 ? 624 PRO A CA 1 ATOM 4559 C C . PRO A 1 589 ? 26.107 45.161 -28.007 1.00 36.83 ? 624 PRO A C 1 ATOM 4560 O O . PRO A 1 589 ? 26.902 45.374 -27.086 1.00 30.36 ? 624 PRO A O 1 ATOM 4561 C CB . PRO A 1 589 ? 27.214 43.777 -29.781 1.00 29.74 ? 624 PRO A CB 1 ATOM 4562 C CG . PRO A 1 589 ? 28.378 44.076 -30.634 1.00 32.89 ? 624 PRO A CG 1 ATOM 4563 C CD . PRO A 1 589 ? 28.902 45.391 -30.178 1.00 33.33 ? 624 PRO A CD 1 ATOM 4564 N N . LEU A 1 590 ? 24.805 44.972 -27.824 1.00 32.40 ? 625 LEU A N 1 ATOM 4565 C CA . LEU A 1 590 ? 24.205 44.784 -26.515 1.00 35.08 ? 625 LEU A CA 1 ATOM 4566 C C . LEU A 1 590 ? 24.460 43.348 -26.100 1.00 36.39 ? 625 LEU A C 1 ATOM 4567 O O . LEU A 1 590 ? 24.470 43.018 -24.906 1.00 29.97 ? 625 LEU A O 1 ATOM 4568 C CB . LEU A 1 590 ? 22.699 45.021 -26.597 1.00 31.70 ? 625 LEU A CB 1 ATOM 4569 C CG . LEU A 1 590 ? 22.269 46.401 -27.099 1.00 34.42 ? 625 LEU A CG 1 ATOM 4570 C CD1 . LEU A 1 590 ? 20.753 46.517 -27.105 1.00 36.60 ? 625 LEU A CD1 1 ATOM 4571 C CD2 . LEU A 1 590 ? 22.875 47.468 -26.216 1.00 32.62 ? 625 LEU A CD2 1 ATOM 4572 N N . TRP A 1 591 ? 24.649 42.501 -27.110 1.00 31.13 ? 626 TRP A N 1 ATOM 4573 C CA . TRP A 1 591 ? 24.902 41.080 -26.931 1.00 30.59 ? 626 TRP A CA 1 ATOM 4574 C C . TRP A 1 591 ? 25.473 40.480 -28.217 1.00 34.55 ? 626 TRP A C 1 ATOM 4575 O O . TRP A 1 591 ? 25.172 40.943 -29.321 1.00 34.94 ? 626 TRP A O 1 ATOM 4576 C CB . TRP A 1 591 ? 23.636 40.334 -26.521 1.00 28.07 ? 626 TRP A CB 1 ATOM 4577 C CG . TRP A 1 591 ? 22.519 40.417 -27.523 1.00 34.50 ? 626 TRP A CG 1 ATOM 4578 C CD1 . TRP A 1 591 ? 21.458 41.267 -27.487 1.00 32.72 ? 626 TRP A CD1 1 ATOM 4579 C CD2 . TRP A 1 591 ? 22.354 39.618 -28.708 1.00 31.93 ? 626 TRP A CD2 1 ATOM 4580 N NE1 . TRP A 1 591 ? 20.645 41.057 -28.576 1.00 31.71 ? 626 TRP A NE1 1 ATOM 4581 C CE2 . TRP A 1 591 ? 21.167 40.045 -29.335 1.00 33.35 ? 626 TRP A CE2 1 ATOM 4582 C CE3 . TRP A 1 591 ? 23.094 38.586 -29.295 1.00 31.55 ? 626 TRP A CE3 1 ATOM 4583 C CZ2 . TRP A 1 591 ? 20.702 39.480 -30.532 1.00 38.95 ? 626 TRP A CZ2 1 ATOM 4584 C CZ3 . TRP A 1 591 ? 22.631 38.023 -30.481 1.00 37.96 ? 626 TRP A CZ3 1 ATOM 4585 C CH2 . TRP A 1 591 ? 21.445 38.473 -31.083 1.00 28.30 ? 626 TRP A CH2 1 ATOM 4586 N N . THR A 1 592 ? 26.290 39.445 -28.050 1.00 32.67 ? 627 THR A N 1 ATOM 4587 C CA . THR A 1 592 ? 26.954 38.749 -29.140 1.00 31.55 ? 627 THR A CA 1 ATOM 4588 C C . THR A 1 592 ? 26.859 37.283 -28.787 1.00 38.02 ? 627 THR A C 1 ATOM 4589 O O . THR A 1 592 ? 27.301 36.865 -27.712 1.00 33.60 ? 627 THR A O 1 ATOM 4590 C CB . THR A 1 592 ? 28.449 39.099 -29.208 1.00 33.03 ? 627 THR A CB 1 ATOM 4591 O OG1 . THR A 1 592 ? 28.617 40.501 -29.444 1.00 35.81 ? 627 THR A OG1 1 ATOM 4592 C CG2 . THR A 1 592 ? 29.133 38.301 -30.313 1.00 35.61 ? 627 THR A CG2 1 ATOM 4593 N N . SER A 1 593 ? 26.295 36.491 -29.685 1.00 35.54 ? 628 SER A N 1 ATOM 4594 C CA . SER A 1 593 ? 26.002 35.106 -29.364 1.00 33.32 ? 628 SER A CA 1 ATOM 4595 C C . SER A 1 593 ? 26.655 34.134 -30.344 1.00 36.34 ? 628 SER A C 1 ATOM 4596 O O . SER A 1 593 ? 26.576 34.323 -31.555 1.00 40.22 ? 628 SER A O 1 ATOM 4597 C CB . SER A 1 593 ? 24.489 34.895 -29.322 1.00 29.33 ? 628 SER A CB 1 ATOM 4598 O OG . SER A 1 593 ? 24.197 33.520 -29.124 1.00 34.52 ? 628 SER A OG 1 ATOM 4599 N N . TYR A 1 594 ? 27.305 33.102 -29.812 1.00 34.09 ? 629 TYR A N 1 ATOM 4600 C CA . TYR A 1 594 ? 27.997 32.125 -30.644 1.00 35.42 ? 629 TYR A CA 1 ATOM 4601 C C . TYR A 1 594 ? 28.138 30.765 -29.963 1.00 39.39 ? 629 TYR A C 1 ATOM 4602 O O . TYR A 1 594 ? 28.136 30.671 -28.728 1.00 31.98 ? 629 TYR A O 1 ATOM 4603 C CB . TYR A 1 594 ? 29.367 32.661 -31.087 1.00 37.69 ? 629 TYR A CB 1 ATOM 4604 C CG . TYR A 1 594 ? 30.352 32.946 -29.966 1.00 34.22 ? 629 TYR A CG 1 ATOM 4605 C CD1 . TYR A 1 594 ? 30.331 34.154 -29.274 1.00 34.62 ? 629 TYR A CD1 1 ATOM 4606 C CD2 . TYR A 1 594 ? 31.309 32.009 -29.613 1.00 33.24 ? 629 TYR A CD2 1 ATOM 4607 C CE1 . TYR A 1 594 ? 31.235 34.409 -28.257 1.00 32.76 ? 629 TYR A CE1 1 ATOM 4608 C CE2 . TYR A 1 594 ? 32.218 32.257 -28.613 1.00 35.92 ? 629 TYR A CE2 1 ATOM 4609 C CZ . TYR A 1 594 ? 32.172 33.455 -27.933 1.00 37.47 ? 629 TYR A CZ 1 ATOM 4610 O OH . TYR A 1 594 ? 33.088 33.683 -26.934 1.00 35.81 ? 629 TYR A OH 1 ATOM 4611 N N . THR A 1 595 ? 28.250 29.713 -30.772 1.00 31.71 ? 630 THR A N 1 ATOM 4612 C CA . THR A 1 595 ? 28.393 28.349 -30.266 1.00 34.06 ? 630 THR A CA 1 ATOM 4613 C C . THR A 1 595 ? 29.750 27.762 -30.648 1.00 35.31 ? 630 THR A C 1 ATOM 4614 O O . THR A 1 595 ? 30.194 27.903 -31.788 1.00 35.05 ? 630 THR A O 1 ATOM 4615 C CB . THR A 1 595 ? 27.282 27.422 -30.808 1.00 33.55 ? 630 THR A CB 1 ATOM 4616 O OG1 . THR A 1 595 ? 25.993 27.957 -30.492 1.00 33.30 ? 630 THR A OG1 1 ATOM 4617 C CG2 . THR A 1 595 ? 27.406 26.017 -30.230 1.00 35.44 ? 630 THR A CG2 1 ATOM 4618 N N . ILE A 1 596 ? 30.393 27.103 -29.685 1.00 32.18 ? 631 ILE A N 1 ATOM 4619 C CA . ILE A 1 596 ? 31.692 26.473 -29.869 1.00 33.10 ? 631 ILE A CA 1 ATOM 4620 C C . ILE A 1 596 ? 31.537 24.980 -29.611 1.00 39.04 ? 631 ILE A C 1 ATOM 4621 O O . ILE A 1 596 ? 31.191 24.568 -28.500 1.00 32.70 ? 631 ILE A O 1 ATOM 4622 C CB . ILE A 1 596 ? 32.737 27.042 -28.882 1.00 37.67 ? 631 ILE A CB 1 ATOM 4623 C CG1 . ILE A 1 596 ? 32.832 28.566 -28.999 1.00 34.81 ? 631 ILE A CG1 1 ATOM 4624 C CG2 . ILE A 1 596 ? 34.104 26.413 -29.115 1.00 35.11 ? 631 ILE A CG2 1 ATOM 4625 C CD1 . ILE A 1 596 ? 33.367 29.043 -30.356 1.00 37.92 ? 631 ILE A CD1 1 ATOM 4626 N N . SER A 1 597 ? 31.774 24.158 -30.631 1.00 35.16 ? 632 SER A N 1 ATOM 4627 C CA . SER A 1 597 ? 31.608 22.719 -30.464 1.00 35.94 ? 632 SER A CA 1 ATOM 4628 C C . SER A 1 597 ? 32.765 22.161 -29.646 1.00 35.37 ? 632 SER A C 1 ATOM 4629 O O . SER A 1 597 ? 33.813 22.801 -29.526 1.00 39.28 ? 632 SER A O 1 ATOM 4630 C CB . SER A 1 597 ? 31.526 22.020 -31.826 1.00 46.28 ? 632 SER A CB 1 ATOM 4631 O OG . SER A 1 597 ? 32.802 21.948 -32.435 1.00 43.57 ? 632 SER A OG 1 ATOM 4632 N N . LYS A 1 598 ? 32.572 20.969 -29.090 1.00 36.52 ? 633 LYS A N 1 ATOM 4633 C CA . LYS A 1 598 ? 33.619 20.293 -28.338 1.00 39.71 ? 633 LYS A CA 1 ATOM 4634 C C . LYS A 1 598 ? 34.905 20.152 -29.149 1.00 47.02 ? 633 LYS A C 1 ATOM 4635 O O . LYS A 1 598 ? 36.011 20.240 -28.611 1.00 45.14 ? 633 LYS A O 1 ATOM 4636 C CB . LYS A 1 598 ? 33.137 18.909 -27.885 1.00 30.48 ? 633 LYS A CB 1 ATOM 4637 C CG . LYS A 1 598 ? 34.242 18.039 -27.334 1.00 33.51 ? 633 LYS A CG 1 ATOM 4638 C CD . LYS A 1 598 ? 33.709 16.743 -26.750 1.00 37.39 ? 633 LYS A CD 1 ATOM 4639 C CE . LYS A 1 598 ? 34.756 16.129 -25.828 1.00 49.19 ? 633 LYS A CE 1 ATOM 4640 N NZ . LYS A 1 598 ? 34.203 15.011 -25.025 1.00 59.43 ? 633 LYS A NZ 1 ATOM 4641 N N . GLN A 1 599 ? 34.751 19.947 -30.451 1.00 52.05 ? 634 GLN A N 1 ATOM 4642 C CA . GLN A 1 599 ? 35.882 19.626 -31.313 1.00 50.94 ? 634 GLN A CA 1 ATOM 4643 C C . GLN A 1 599 ? 36.490 20.864 -31.968 1.00 51.15 ? 634 GLN A C 1 ATOM 4644 O O . GLN A 1 599 ? 37.403 20.752 -32.785 1.00 55.60 ? 634 GLN A O 1 ATOM 4645 C CB . GLN A 1 599 ? 35.450 18.618 -32.384 1.00 46.65 ? 634 GLN A CB 1 ATOM 4646 C CG . GLN A 1 599 ? 34.840 17.336 -31.822 1.00 47.79 ? 634 GLN A CG 1 ATOM 4647 C CD . GLN A 1 599 ? 33.349 17.461 -31.513 1.00 54.08 ? 634 GLN A CD 1 ATOM 4648 O OE1 . GLN A 1 599 ? 32.719 18.483 -31.798 1.00 57.27 ? 634 GLN A OE1 1 ATOM 4649 N NE2 . GLN A 1 599 ? 32.781 16.416 -30.925 1.00 49.60 ? 634 GLN A NE2 1 ATOM 4650 N N . ALA A 1 600 ? 35.989 22.039 -31.601 1.00 46.62 ? 635 ALA A N 1 ATOM 4651 C CA . ALA A 1 600 ? 36.420 23.285 -32.234 1.00 44.98 ? 635 ALA A CA 1 ATOM 4652 C C . ALA A 1 600 ? 37.917 23.542 -32.087 1.00 49.16 ? 635 ALA A C 1 ATOM 4653 O O . ALA A 1 600 ? 38.568 23.018 -31.177 1.00 46.02 ? 635 ALA A O 1 ATOM 4654 C CB . ALA A 1 600 ? 35.624 24.458 -31.695 1.00 47.82 ? 635 ALA A CB 1 ATOM 4655 N N . GLU A 1 601 ? 38.457 24.352 -32.993 1.00 48.90 ? 636 GLU A N 1 ATOM 4656 C CA . GLU A 1 601 ? 39.887 24.642 -33.015 1.00 52.47 ? 636 GLU A CA 1 ATOM 4657 C C . GLU A 1 601 ? 40.211 26.078 -32.623 1.00 44.30 ? 636 GLU A C 1 ATOM 4658 O O . GLU A 1 601 ? 39.550 27.019 -33.063 1.00 43.75 ? 636 GLU A O 1 ATOM 4659 C CB . GLU A 1 601 ? 40.472 24.359 -34.406 1.00 60.06 ? 636 GLU A CB 1 ATOM 4660 C CG . GLU A 1 601 ? 40.558 22.886 -34.763 1.00 67.10 ? 636 GLU A CG 1 ATOM 4661 C CD . GLU A 1 601 ? 41.872 22.531 -35.434 1.00 78.21 ? 636 GLU A CD 1 ATOM 4662 O OE1 . GLU A 1 601 ? 42.167 23.098 -36.513 1.00 68.97 ? 636 GLU A OE1 1 ATOM 4663 O OE2 . GLU A 1 601 ? 42.611 21.688 -34.873 1.00 79.83 ? 636 GLU A OE2 1 ATOM 4664 N N . VAL A 1 602 ? 41.246 26.236 -31.803 1.00 47.81 ? 637 VAL A N 1 ATOM 4665 C CA . VAL A 1 602 ? 41.764 27.554 -31.472 1.00 50.05 ? 637 VAL A CA 1 ATOM 4666 C C . VAL A 1 602 ? 42.882 27.911 -32.453 1.00 53.56 ? 637 VAL A C 1 ATOM 4667 O O . VAL A 1 602 ? 43.752 27.087 -32.739 1.00 50.54 ? 637 VAL A O 1 ATOM 4668 C CB . VAL A 1 602 ? 42.325 27.604 -30.038 1.00 48.33 ? 637 VAL A CB 1 ATOM 4669 C CG1 . VAL A 1 602 ? 42.818 29.000 -29.715 1.00 47.86 ? 637 VAL A CG1 1 ATOM 4670 C CG2 . VAL A 1 602 ? 41.267 27.156 -29.024 1.00 46.44 ? 637 VAL A CG2 1 ATOM 4671 N N . SER A 1 603 ? 42.853 29.137 -32.965 1.00 48.82 ? 638 SER A N 1 ATOM 4672 C CA . SER A 1 603 ? 43.872 29.601 -33.898 1.00 53.32 ? 638 SER A CA 1 ATOM 4673 C C . SER A 1 603 ? 44.377 30.982 -33.491 1.00 53.63 ? 638 SER A C 1 ATOM 4674 O O . SER A 1 603 ? 43.799 31.629 -32.618 1.00 51.02 ? 638 SER A O 1 ATOM 4675 C CB . SER A 1 603 ? 43.316 29.628 -35.321 1.00 45.15 ? 638 SER A CB 1 ATOM 4676 O OG . SER A 1 603 ? 42.196 30.495 -35.417 1.00 47.75 ? 638 SER A OG 1 ATOM 4677 N N . SER A 1 604 ? 45.455 31.434 -34.124 1.00 52.49 ? 639 SER A N 1 ATOM 4678 C CA . SER A 1 604 ? 46.067 32.703 -33.750 1.00 52.45 ? 639 SER A CA 1 ATOM 4679 C C . SER A 1 604 ? 45.441 33.879 -34.484 1.00 51.49 ? 639 SER A C 1 ATOM 4680 O O . SER A 1 604 ? 44.590 33.706 -35.348 1.00 52.01 ? 639 SER A O 1 ATOM 4681 C CB . SER A 1 604 ? 47.568 32.673 -34.035 1.00 56.52 ? 639 SER A CB 1 ATOM 4682 O OG . SER A 1 604 ? 48.175 31.541 -33.441 1.00 63.40 ? 639 SER A OG 1 ATOM 4683 N N . ILE A 1 605 ? 45.851 35.083 -34.108 1.00 56.42 ? 640 ILE A N 1 ATOM 4684 C CA . ILE A 1 605 ? 45.608 36.251 -34.935 1.00 54.83 ? 640 ILE A CA 1 ATOM 4685 C C . ILE A 1 605 ? 46.892 36.463 -35.722 1.00 63.09 ? 640 ILE A C 1 ATOM 4686 O O . ILE A 1 605 ? 47.933 36.764 -35.133 1.00 65.03 ? 640 ILE A O 1 ATOM 4687 C CB . ILE A 1 605 ? 45.304 37.508 -34.100 1.00 59.35 ? 640 ILE A CB 1 ATOM 4688 C CG1 . ILE A 1 605 ? 43.932 37.390 -33.428 1.00 49.48 ? 640 ILE A CG1 1 ATOM 4689 C CG2 . ILE A 1 605 ? 45.351 38.758 -34.976 1.00 56.54 ? 640 ILE A CG2 1 ATOM 4690 C CD1 . ILE A 1 605 ? 43.507 38.636 -32.703 1.00 45.51 ? 640 ILE A CD1 1 ATOM 4691 N N . PRO A 1 606 ? 46.833 36.274 -37.051 1.00 64.07 ? 641 PRO A N 1 ATOM 4692 C CA . PRO A 1 606 ? 48.011 36.382 -37.921 1.00 61.74 ? 641 PRO A CA 1 ATOM 4693 C C . PRO A 1 606 ? 48.738 37.708 -37.729 1.00 62.96 ? 641 PRO A C 1 ATOM 4694 O O . PRO A 1 606 ? 48.094 38.720 -37.445 1.00 59.08 ? 641 PRO A O 1 ATOM 4695 C CB . PRO A 1 606 ? 47.410 36.307 -39.326 1.00 61.80 ? 641 PRO A CB 1 ATOM 4696 C CG . PRO A 1 606 ? 46.158 35.526 -39.153 1.00 63.16 ? 641 PRO A CG 1 ATOM 4697 C CD . PRO A 1 606 ? 45.616 35.938 -37.812 1.00 59.56 ? 641 PRO A CD 1 ATOM 4698 N N . GLU A 1 607 ? 50.060 37.688 -37.884 1.00 63.95 ? 642 GLU A N 1 ATOM 4699 C CA . GLU A 1 607 ? 50.906 38.856 -37.638 1.00 66.46 ? 642 GLU A CA 1 ATOM 4700 C C . GLU A 1 607 ? 50.433 40.128 -38.345 1.00 61.08 ? 642 GLU A C 1 ATOM 4701 O O . GLU A 1 607 ? 50.471 41.213 -37.773 1.00 61.76 ? 642 GLU A O 1 ATOM 4702 C CB . GLU A 1 607 ? 52.357 38.551 -38.027 1.00 64.06 ? 642 GLU A CB 1 ATOM 4703 N N . HIS A 1 608 ? 49.983 39.991 -39.586 1.00 63.33 ? 643 HIS A N 1 ATOM 4704 C CA . HIS A 1 608 ? 49.593 41.151 -40.377 1.00 64.37 ? 643 HIS A CA 1 ATOM 4705 C C . HIS A 1 608 ? 48.211 41.669 -39.990 1.00 62.58 ? 643 HIS A C 1 ATOM 4706 O O . HIS A 1 608 ? 47.777 42.716 -40.468 1.00 64.13 ? 643 HIS A O 1 ATOM 4707 C CB . HIS A 1 608 ? 49.617 40.804 -41.864 1.00 66.95 ? 643 HIS A CB 1 ATOM 4708 C CG . HIS A 1 608 ? 48.642 39.736 -42.244 1.00 63.83 ? 643 HIS A CG 1 ATOM 4709 N ND1 . HIS A 1 608 ? 48.872 38.398 -42.006 1.00 64.00 ? 643 HIS A ND1 1 ATOM 4710 C CD2 . HIS A 1 608 ? 47.426 39.810 -42.833 1.00 65.70 ? 643 HIS A CD2 1 ATOM 4711 C CE1 . HIS A 1 608 ? 47.842 37.693 -42.441 1.00 67.16 ? 643 HIS A CE1 1 ATOM 4712 N NE2 . HIS A 1 608 ? 46.950 38.526 -42.947 1.00 65.05 ? 643 HIS A NE2 1 ATOM 4713 N N . LEU A 1 609 ? 47.520 40.934 -39.124 1.00 64.32 ? 644 LEU A N 1 ATOM 4714 C CA . LEU A 1 609 ? 46.167 41.309 -38.724 1.00 60.82 ? 644 LEU A CA 1 ATOM 4715 C C . LEU A 1 609 ? 46.098 41.788 -37.276 1.00 59.82 ? 644 LEU A C 1 ATOM 4716 O O . LEU A 1 609 ? 45.015 42.083 -36.766 1.00 54.26 ? 644 LEU A O 1 ATOM 4717 C CB . LEU A 1 609 ? 45.202 40.145 -38.941 1.00 60.79 ? 644 LEU A CB 1 ATOM 4718 C CG . LEU A 1 609 ? 44.947 39.754 -40.396 1.00 59.78 ? 644 LEU A CG 1 ATOM 4719 C CD1 . LEU A 1 609 ? 43.972 38.589 -40.468 1.00 56.01 ? 644 LEU A CD1 1 ATOM 4720 C CD2 . LEU A 1 609 ? 44.432 40.949 -41.177 1.00 55.13 ? 644 LEU A CD2 1 ATOM 4721 N N . THR A 1 610 ? 47.259 41.873 -36.632 1.00 62.34 ? 645 THR A N 1 ATOM 4722 C CA . THR A 1 610 ? 47.352 42.270 -35.227 1.00 59.54 ? 645 THR A CA 1 ATOM 4723 C C . THR A 1 610 ? 46.558 43.536 -34.920 1.00 52.42 ? 645 THR A C 1 ATOM 4724 O O . THR A 1 610 ? 45.809 43.588 -33.950 1.00 59.24 ? 645 THR A O 1 ATOM 4725 C CB . THR A 1 610 ? 48.820 42.467 -34.792 1.00 63.03 ? 645 THR A CB 1 ATOM 4726 O OG1 . THR A 1 610 ? 49.549 41.253 -35.008 1.00 65.00 ? 645 THR A OG1 1 ATOM 4727 C CG2 . THR A 1 610 ? 48.902 42.839 -33.315 1.00 56.08 ? 645 THR A CG2 1 ATOM 4728 N N . ASN A 1 611 ? 46.700 44.546 -35.767 1.00 56.55 ? 646 ASN A N 1 ATOM 4729 C CA . ASN A 1 611 ? 46.032 45.819 -35.535 1.00 53.34 ? 646 ASN A CA 1 ATOM 4730 C C . ASN A 1 611 ? 44.865 46.066 -36.484 1.00 47.12 ? 646 ASN A C 1 ATOM 4731 O O . ASN A 1 611 ? 44.429 47.200 -36.662 1.00 50.45 ? 646 ASN A O 1 ATOM 4732 C CB . ASN A 1 611 ? 47.043 46.963 -35.620 1.00 63.80 ? 646 ASN A CB 1 ATOM 4733 C CG . ASN A 1 611 ? 48.247 46.742 -34.719 1.00 67.21 ? 646 ASN A CG 1 ATOM 4734 O OD1 . ASN A 1 611 ? 49.373 46.587 -35.196 1.00 69.19 ? 646 ASN A OD1 1 ATOM 4735 N ND2 . ASN A 1 611 ? 48.012 46.722 -33.408 1.00 66.44 ? 646 ASN A ND2 1 ATOM 4736 N N . CYS A 1 612 ? 44.351 44.993 -37.075 1.00 50.99 ? 647 CYS A N 1 ATOM 4737 C CA . CYS A 1 612 ? 43.274 45.095 -38.055 1.00 54.18 ? 647 CYS A CA 1 ATOM 4738 C C . CYS A 1 612 ? 41.915 45.430 -37.452 1.00 49.71 ? 647 CYS A C 1 ATOM 4739 O O . CYS A 1 612 ? 41.444 44.746 -36.545 1.00 49.68 ? 647 CYS A O 1 ATOM 4740 C CB . CYS A 1 612 ? 43.153 43.792 -38.849 1.00 53.99 ? 647 CYS A CB 1 ATOM 4741 S SG . CYS A 1 612 ? 41.668 43.714 -39.883 1.00 54.77 ? 647 CYS A SG 1 ATOM 4742 N N . VAL A 1 613 ? 41.294 46.487 -37.964 1.00 43.73 ? 648 VAL A N 1 ATOM 4743 C CA . VAL A 1 613 ? 39.889 46.774 -37.691 1.00 45.78 ? 648 VAL A CA 1 ATOM 4744 C C . VAL A 1 613 ? 39.202 47.174 -38.986 1.00 49.03 ? 648 VAL A C 1 ATOM 4745 O O . VAL A 1 613 ? 39.636 48.106 -39.665 1.00 46.99 ? 648 VAL A O 1 ATOM 4746 C CB . VAL A 1 613 ? 39.698 47.904 -36.662 1.00 49.57 ? 648 VAL A CB 1 ATOM 4747 C CG1 . VAL A 1 613 ? 38.207 48.186 -36.461 1.00 43.79 ? 648 VAL A CG1 1 ATOM 4748 C CG2 . VAL A 1 613 ? 40.348 47.536 -35.348 1.00 44.43 ? 648 VAL A CG2 1 ATOM 4749 N N . ARG A 1 614 ? 38.132 46.464 -39.330 1.00 48.26 ? 649 ARG A N 1 ATOM 4750 C CA . ARG A 1 614 ? 37.435 46.691 -40.597 1.00 51.39 ? 649 ARG A CA 1 ATOM 4751 C C . ARG A 1 614 ? 36.085 47.368 -40.382 1.00 49.37 ? 649 ARG A C 1 ATOM 4752 O O . ARG A 1 614 ? 35.344 47.001 -39.474 1.00 47.54 ? 649 ARG A O 1 ATOM 4753 C CB . ARG A 1 614 ? 37.247 45.363 -41.336 1.00 44.24 ? 649 ARG A CB 1 ATOM 4754 C CG . ARG A 1 614 ? 38.529 44.557 -41.450 1.00 46.16 ? 649 ARG A CG 1 ATOM 4755 C CD . ARG A 1 614 ? 38.282 43.148 -41.965 1.00 56.34 ? 649 ARG A CD 1 ATOM 4756 N NE . ARG A 1 614 ? 37.521 43.122 -43.213 1.00 57.52 ? 649 ARG A NE 1 ATOM 4757 C CZ . ARG A 1 614 ? 36.322 42.560 -43.343 1.00 59.20 ? 649 ARG A CZ 1 ATOM 4758 N NH1 . ARG A 1 614 ? 35.742 41.967 -42.304 1.00 48.74 ? 649 ARG A NH1 1 ATOM 4759 N NH2 . ARG A 1 614 ? 35.703 42.582 -44.515 1.00 61.79 ? 649 ARG A NH2 1 ATOM 4760 N N . PRO A 1 615 ? 35.767 48.371 -41.215 1.00 47.42 ? 650 PRO A N 1 ATOM 4761 C CA . PRO A 1 615 ? 34.456 49.032 -41.176 1.00 46.56 ? 650 PRO A CA 1 ATOM 4762 C C . PRO A 1 615 ? 33.348 48.065 -41.579 1.00 47.41 ? 650 PRO A C 1 ATOM 4763 O O . PRO A 1 615 ? 33.625 47.083 -42.269 1.00 47.69 ? 650 PRO A O 1 ATOM 4764 C CB . PRO A 1 615 ? 34.591 50.149 -42.219 1.00 55.58 ? 650 PRO A CB 1 ATOM 4765 C CG . PRO A 1 615 ? 35.686 49.697 -43.129 1.00 53.29 ? 650 PRO A CG 1 ATOM 4766 C CD . PRO A 1 615 ? 36.643 48.932 -42.259 1.00 53.00 ? 650 PRO A CD 1 ATOM 4767 N N . ASP A 1 616 ? 32.118 48.333 -41.148 1.00 47.86 ? 651 ASP A N 1 ATOM 4768 C CA . ASP A 1 616 ? 31.001 47.430 -41.419 1.00 50.97 ? 651 ASP A CA 1 ATOM 4769 C C . ASP A 1 616 ? 29.985 48.110 -42.321 1.00 54.31 ? 651 ASP A C 1 ATOM 4770 O O . ASP A 1 616 ? 29.210 48.960 -41.868 1.00 49.81 ? 651 ASP A O 1 ATOM 4771 C CB . ASP A 1 616 ? 30.327 46.988 -40.112 1.00 48.75 ? 651 ASP A CB 1 ATOM 4772 C CG . ASP A 1 616 ? 29.346 45.833 -40.309 1.00 54.09 ? 651 ASP A CG 1 ATOM 4773 O OD1 . ASP A 1 616 ? 28.641 45.803 -41.339 1.00 52.76 ? 651 ASP A OD1 1 ATOM 4774 O OD2 . ASP A 1 616 ? 29.281 44.942 -39.430 1.00 51.75 ? 651 ASP A OD2 1 ATOM 4775 N N . VAL A 1 617 ? 29.975 47.704 -43.591 1.00 51.50 ? 652 VAL A N 1 ATOM 4776 C CA . VAL A 1 617 ? 29.099 48.298 -44.596 1.00 55.05 ? 652 VAL A CA 1 ATOM 4777 C C . VAL A 1 617 ? 27.612 48.219 -44.249 1.00 56.40 ? 652 VAL A C 1 ATOM 4778 O O . VAL A 1 617 ? 26.806 48.951 -44.821 1.00 57.36 ? 652 VAL A O 1 ATOM 4779 C CB . VAL A 1 617 ? 29.327 47.672 -45.994 1.00 53.40 ? 652 VAL A CB 1 ATOM 4780 C CG1 . VAL A 1 617 ? 30.709 48.037 -46.523 1.00 57.11 ? 652 VAL A CG1 1 ATOM 4781 C CG2 . VAL A 1 617 ? 29.154 46.165 -45.938 1.00 55.28 ? 652 VAL A CG2 1 ATOM 4782 N N . ARG A 1 618 ? 27.248 47.339 -43.318 1.00 49.16 ? 653 ARG A N 1 ATOM 4783 C CA . ARG A 1 618 ? 25.852 47.208 -42.909 1.00 47.86 ? 653 ARG A CA 1 ATOM 4784 C C . ARG A 1 618 ? 25.408 48.373 -42.043 1.00 45.51 ? 653 ARG A C 1 ATOM 4785 O O . ARG A 1 618 ? 24.222 48.684 -41.955 1.00 43.81 ? 653 ARG A O 1 ATOM 4786 C CB . ARG A 1 618 ? 25.642 45.914 -42.134 1.00 53.60 ? 653 ARG A CB 1 ATOM 4787 C CG . ARG A 1 618 ? 25.554 44.674 -42.983 1.00 49.82 ? 653 ARG A CG 1 ATOM 4788 C CD . ARG A 1 618 ? 25.573 43.456 -42.092 1.00 51.19 ? 653 ARG A CD 1 ATOM 4789 N NE . ARG A 1 618 ? 26.783 43.442 -41.278 1.00 47.57 ? 653 ARG A NE 1 ATOM 4790 C CZ . ARG A 1 618 ? 27.167 42.416 -40.529 1.00 46.30 ? 653 ARG A CZ 1 ATOM 4791 N NH1 . ARG A 1 618 ? 26.434 41.309 -40.487 1.00 46.39 ? 653 ARG A NH1 1 ATOM 4792 N NH2 . ARG A 1 618 ? 28.291 42.497 -39.829 1.00 50.19 ? 653 ARG A NH2 1 ATOM 4793 N N . VAL A 1 619 ? 26.371 49.013 -41.394 1.00 49.53 ? 654 VAL A N 1 ATOM 4794 C CA . VAL A 1 619 ? 26.061 50.039 -40.413 1.00 52.45 ? 654 VAL A CA 1 ATOM 4795 C C . VAL A 1 619 ? 26.703 51.353 -40.800 1.00 46.76 ? 654 VAL A C 1 ATOM 4796 O O . VAL A 1 619 ? 27.881 51.396 -41.160 1.00 50.71 ? 654 VAL A O 1 ATOM 4797 C CB . VAL A 1 619 ? 26.542 49.633 -38.997 1.00 45.65 ? 654 VAL A CB 1 ATOM 4798 C CG1 . VAL A 1 619 ? 26.200 50.713 -37.988 1.00 47.15 ? 654 VAL A CG1 1 ATOM 4799 C CG2 . VAL A 1 619 ? 25.918 48.313 -38.598 1.00 44.98 ? 654 VAL A CG2 1 ATOM 4800 N N . SER A 1 620 ? 25.906 52.411 -40.718 1.00 41.59 ? 655 SER A N 1 ATOM 4801 C CA . SER A 1 620 ? 26.330 53.769 -41.030 1.00 51.57 ? 655 SER A CA 1 ATOM 4802 C C . SER A 1 620 ? 27.597 54.172 -40.295 1.00 56.37 ? 655 SER A C 1 ATOM 4803 O O . SER A 1 620 ? 27.796 53.789 -39.144 1.00 57.31 ? 655 SER A O 1 ATOM 4804 C CB . SER A 1 620 ? 25.214 54.752 -40.676 1.00 49.02 ? 655 SER A CB 1 ATOM 4805 O OG . SER A 1 620 ? 25.750 56.043 -40.451 1.00 59.47 ? 655 SER A OG 1 ATOM 4806 N N . PRO A 1 621 ? 28.459 54.959 -40.957 1.00 55.59 ? 656 PRO A N 1 ATOM 4807 C CA . PRO A 1 621 ? 29.670 55.484 -40.314 1.00 57.30 ? 656 PRO A CA 1 ATOM 4808 C C . PRO A 1 621 ? 29.318 56.359 -39.111 1.00 55.73 ? 656 PRO A C 1 ATOM 4809 O O . PRO A 1 621 ? 30.142 56.534 -38.209 1.00 58.45 ? 656 PRO A O 1 ATOM 4810 C CB . PRO A 1 621 ? 30.313 56.338 -41.414 1.00 57.83 ? 656 PRO A CB 1 ATOM 4811 C CG . PRO A 1 621 ? 29.743 55.820 -42.689 1.00 58.47 ? 656 PRO A CG 1 ATOM 4812 C CD . PRO A 1 621 ? 28.351 55.378 -42.364 1.00 56.51 ? 656 PRO A CD 1 ATOM 4813 N N . GLY A 1 622 ? 28.102 56.898 -39.104 1.00 44.36 ? 657 GLY A N 1 ATOM 4814 C CA . GLY A 1 622 ? 27.635 57.708 -37.999 1.00 48.12 ? 657 GLY A CA 1 ATOM 4815 C C . GLY A 1 622 ? 27.328 56.871 -36.766 1.00 50.08 ? 657 GLY A C 1 ATOM 4816 O O . GLY A 1 622 ? 27.395 57.371 -35.651 1.00 52.24 ? 657 GLY A O 1 ATOM 4817 N N . PHE A 1 623 ? 26.993 55.598 -36.973 1.00 51.63 ? 658 PHE A N 1 ATOM 4818 C CA . PHE A 1 623 ? 26.692 54.675 -35.878 1.00 46.86 ? 658 PHE A CA 1 ATOM 4819 C C . PHE A 1 623 ? 27.830 53.691 -35.692 1.00 47.02 ? 658 PHE A C 1 ATOM 4820 O O . PHE A 1 623 ? 27.608 52.540 -35.312 1.00 49.49 ? 658 PHE A O 1 ATOM 4821 C CB . PHE A 1 623 ? 25.418 53.884 -36.172 1.00 45.83 ? 658 PHE A CB 1 ATOM 4822 C CG . PHE A 1 623 ? 24.199 54.735 -36.345 1.00 51.64 ? 658 PHE A CG 1 ATOM 4823 C CD1 . PHE A 1 623 ? 23.872 55.707 -35.410 1.00 48.48 ? 658 PHE A CD1 1 ATOM 4824 C CD2 . PHE A 1 623 ? 23.372 54.564 -37.450 1.00 54.57 ? 658 PHE A CD2 1 ATOM 4825 C CE1 . PHE A 1 623 ? 22.739 56.493 -35.569 1.00 49.41 ? 658 PHE A CE1 1 ATOM 4826 C CE2 . PHE A 1 623 ? 22.241 55.347 -37.617 1.00 52.52 ? 658 PHE A CE2 1 ATOM 4827 C CZ . PHE A 1 623 ? 21.925 56.314 -36.677 1.00 51.79 ? 658 PHE A CZ 1 ATOM 4828 N N . SER A 1 624 ? 29.045 54.138 -35.980 1.00 47.56 ? 659 SER A N 1 ATOM 4829 C CA . SER A 1 624 ? 30.233 53.307 -35.836 1.00 46.88 ? 659 SER A CA 1 ATOM 4830 C C . SER A 1 624 ? 31.255 54.008 -34.942 1.00 51.23 ? 659 SER A C 1 ATOM 4831 O O . SER A 1 624 ? 31.309 55.239 -34.898 1.00 49.82 ? 659 SER A O 1 ATOM 4832 C CB . SER A 1 624 ? 30.865 53.027 -37.208 1.00 48.95 ? 659 SER A CB 1 ATOM 4833 O OG . SER A 1 624 ? 30.036 52.225 -38.039 1.00 47.03 ? 659 SER A OG 1 ATOM 4834 N N . GLN A 1 625 ? 32.059 53.224 -34.229 1.00 45.53 ? 660 GLN A N 1 ATOM 4835 C CA . GLN A 1 625 ? 33.174 53.769 -33.466 1.00 46.08 ? 660 GLN A CA 1 ATOM 4836 C C . GLN A 1 625 ? 34.275 54.139 -34.453 1.00 51.56 ? 660 GLN A C 1 ATOM 4837 O O . GLN A 1 625 ? 34.191 53.800 -35.635 1.00 51.06 ? 660 GLN A O 1 ATOM 4838 C CB . GLN A 1 625 ? 33.717 52.730 -32.484 1.00 44.51 ? 660 GLN A CB 1 ATOM 4839 C CG . GLN A 1 625 ? 32.697 52.136 -31.508 1.00 41.43 ? 660 GLN A CG 1 ATOM 4840 C CD . GLN A 1 625 ? 33.276 50.959 -30.737 1.00 37.66 ? 660 GLN A CD 1 ATOM 4841 O OE1 . GLN A 1 625 ? 34.439 50.985 -30.345 1.00 37.64 ? 660 GLN A OE1 1 ATOM 4842 N NE2 . GLN A 1 625 ? 32.474 49.910 -30.542 1.00 39.01 ? 660 GLN A NE2 1 ATOM 4843 N N . ASN A 1 626 ? 35.312 54.819 -33.976 1.00 52.60 ? 661 ASN A N 1 ATOM 4844 C CA . ASN A 1 626 ? 36.458 55.116 -34.827 1.00 50.02 ? 661 ASN A CA 1 ATOM 4845 C C . ASN A 1 626 ? 37.774 54.794 -34.143 1.00 49.57 ? 661 ASN A C 1 ATOM 4846 O O . ASN A 1 626 ? 37.936 55.032 -32.949 1.00 50.69 ? 661 ASN A O 1 ATOM 4847 C CB . ASN A 1 626 ? 36.437 56.575 -35.281 1.00 52.46 ? 661 ASN A CB 1 ATOM 4848 C CG . ASN A 1 626 ? 36.620 57.541 -34.138 1.00 53.78 ? 661 ASN A CG 1 ATOM 4849 O OD1 . ASN A 1 626 ? 37.738 57.745 -33.655 1.00 60.39 ? 661 ASN A OD1 1 ATOM 4850 N ND2 . ASN A 1 626 ? 35.526 58.160 -33.705 1.00 49.38 ? 661 ASN A ND2 1 ATOM 4851 N N . CYS A 1 627 ? 38.715 54.255 -34.906 1.00 53.62 ? 662 CYS A N 1 ATOM 4852 C CA . CYS A 1 627 ? 39.979 53.805 -34.342 1.00 51.28 ? 662 CYS A CA 1 ATOM 4853 C C . CYS A 1 627 ? 40.894 54.955 -33.940 1.00 52.86 ? 662 CYS A C 1 ATOM 4854 O O . CYS A 1 627 ? 41.870 54.751 -33.216 1.00 49.18 ? 662 CYS A O 1 ATOM 4855 C CB . CYS A 1 627 ? 40.685 52.872 -35.320 1.00 49.35 ? 662 CYS A CB 1 ATOM 4856 S SG . CYS A 1 627 ? 39.655 51.486 -35.839 1.00 57.12 ? 662 CYS A SG 1 ATOM 4857 N N . LEU A 1 628 ? 40.577 56.159 -34.404 1.00 53.82 ? 663 LEU A N 1 ATOM 4858 C CA . LEU A 1 628 ? 41.374 57.334 -34.072 1.00 53.22 ? 663 LEU A CA 1 ATOM 4859 C C . LEU A 1 628 ? 41.310 57.624 -32.569 1.00 55.31 ? 663 LEU A C 1 ATOM 4860 O O . LEU A 1 628 ? 42.334 57.897 -31.930 1.00 53.03 ? 663 LEU A O 1 ATOM 4861 C CB . LEU A 1 628 ? 40.894 58.553 -34.864 1.00 57.61 ? 663 LEU A CB 1 ATOM 4862 C CG . LEU A 1 628 ? 41.889 59.715 -34.973 1.00 59.39 ? 663 LEU A CG 1 ATOM 4863 C CD1 . LEU A 1 628 ? 42.948 59.413 -36.028 1.00 63.05 ? 663 LEU A CD1 1 ATOM 4864 C CD2 . LEU A 1 628 ? 41.179 61.035 -35.264 1.00 58.06 ? 663 LEU A CD2 1 ATOM 4865 N N . ALA A 1 629 ? 40.100 57.563 -32.021 1.00 49.90 ? 664 ALA A N 1 ATOM 4866 C CA . ALA A 1 629 ? 39.875 57.692 -30.586 1.00 53.52 ? 664 ALA A CA 1 ATOM 4867 C C . ALA A 1 629 ? 40.767 56.740 -29.794 1.00 47.55 ? 664 ALA A C 1 ATOM 4868 O O . ALA A 1 629 ? 41.320 57.103 -28.751 1.00 46.36 ? 664 ALA A O 1 ATOM 4869 C CB . ALA A 1 629 ? 38.417 57.429 -30.264 1.00 45.92 ? 664 ALA A CB 1 ATOM 4870 N N . TYR A 1 630 ? 40.907 55.520 -30.293 1.00 44.35 ? 665 TYR A N 1 ATOM 4871 C CA . TYR A 1 630 ? 41.747 54.536 -29.625 1.00 49.05 ? 665 TYR A CA 1 ATOM 4872 C C . TYR A 1 630 ? 43.240 54.836 -29.785 1.00 52.68 ? 665 TYR A C 1 ATOM 4873 O O . TYR A 1 630 ? 44.046 54.480 -28.924 1.00 48.36 ? 665 TYR A O 1 ATOM 4874 C CB . TYR A 1 630 ? 41.410 53.120 -30.092 1.00 46.90 ? 665 TYR A CB 1 ATOM 4875 C CG . TYR A 1 630 ? 40.045 52.651 -29.629 1.00 47.62 ? 665 TYR A CG 1 ATOM 4876 C CD1 . TYR A 1 630 ? 39.777 52.440 -28.278 1.00 45.29 ? 665 TYR A CD1 1 ATOM 4877 C CD2 . TYR A 1 630 ? 39.029 52.418 -30.536 1.00 46.31 ? 665 TYR A CD2 1 ATOM 4878 C CE1 . TYR A 1 630 ? 38.527 52.017 -27.848 1.00 34.67 ? 665 TYR A CE1 1 ATOM 4879 C CE2 . TYR A 1 630 ? 37.780 51.993 -30.121 1.00 46.54 ? 665 TYR A CE2 1 ATOM 4880 C CZ . TYR A 1 630 ? 37.533 51.792 -28.777 1.00 43.56 ? 665 TYR A CZ 1 ATOM 4881 O OH . TYR A 1 630 ? 36.286 51.367 -28.383 1.00 34.37 ? 665 TYR A OH 1 ATOM 4882 N N . LYS A 1 631 ? 43.603 55.496 -30.883 1.00 53.34 ? 666 LYS A N 1 ATOM 4883 C CA . LYS A 1 631 ? 44.984 55.921 -31.088 1.00 47.44 ? 666 LYS A CA 1 ATOM 4884 C C . LYS A 1 631 ? 45.288 57.131 -30.204 1.00 50.33 ? 666 LYS A C 1 ATOM 4885 O O . LYS A 1 631 ? 46.419 57.322 -29.763 1.00 51.31 ? 666 LYS A O 1 ATOM 4886 C CB . LYS A 1 631 ? 45.236 56.261 -32.564 1.00 48.19 ? 666 LYS A CB 1 ATOM 4887 N N . ASN A 1 632 ? 44.268 57.944 -29.949 1.00 45.56 ? 667 ASN A N 1 ATOM 4888 C CA . ASN A 1 632 ? 44.425 59.119 -29.108 1.00 44.97 ? 667 ASN A CA 1 ATOM 4889 C C . ASN A 1 632 ? 44.476 58.763 -27.624 1.00 51.72 ? 667 ASN A C 1 ATOM 4890 O O . ASN A 1 632 ? 45.384 59.196 -26.911 1.00 47.22 ? 667 ASN A O 1 ATOM 4891 C CB . ASN A 1 632 ? 43.305 60.131 -29.374 1.00 46.01 ? 667 ASN A CB 1 ATOM 4892 C CG . ASN A 1 632 ? 43.522 60.935 -30.658 1.00 57.92 ? 667 ASN A CG 1 ATOM 4893 O OD1 . ASN A 1 632 ? 44.507 60.745 -31.379 1.00 56.21 ? 667 ASN A OD1 1 ATOM 4894 N ND2 . ASN A 1 632 ? 42.589 61.834 -30.949 1.00 49.20 ? 667 ASN A ND2 1 ATOM 4895 N N . ASP A 1 633 ? 43.503 57.975 -27.163 1.00 54.45 ? 668 ASP A N 1 ATOM 4896 C CA . ASP A 1 633 ? 43.439 57.567 -25.755 1.00 43.19 ? 668 ASP A CA 1 ATOM 4897 C C . ASP A 1 633 ? 44.619 56.679 -25.386 1.00 39.32 ? 668 ASP A C 1 ATOM 4898 O O . ASP A 1 633 ? 44.663 55.502 -25.748 1.00 41.36 ? 668 ASP A O 1 ATOM 4899 C CB . ASP A 1 633 ? 42.134 56.830 -25.459 1.00 46.81 ? 668 ASP A CB 1 ATOM 4900 C CG . ASP A 1 633 ? 41.729 56.933 -23.997 1.00 46.71 ? 668 ASP A CG 1 ATOM 4901 O OD1 . ASP A 1 633 ? 42.634 56.955 -23.126 1.00 47.77 ? 668 ASP A OD1 1 ATOM 4902 O OD2 . ASP A 1 633 ? 40.509 57.018 -23.723 1.00 37.50 ? 668 ASP A OD2 1 ATOM 4903 N N . LYS A 1 634 ? 45.577 57.245 -24.661 1.00 42.33 ? 669 LYS A N 1 ATOM 4904 C CA . LYS A 1 634 ? 46.786 56.509 -24.313 1.00 44.94 ? 669 LYS A CA 1 ATOM 4905 C C . LYS A 1 634 ? 46.536 55.437 -23.242 1.00 47.02 ? 669 LYS A C 1 ATOM 4906 O O . LYS A 1 634 ? 47.410 54.611 -22.963 1.00 43.79 ? 669 LYS A O 1 ATOM 4907 C CB . LYS A 1 634 ? 47.884 57.466 -23.846 1.00 48.43 ? 669 LYS A CB 1 ATOM 4908 C CG . LYS A 1 634 ? 47.570 58.140 -22.523 1.00 49.29 ? 669 LYS A CG 1 ATOM 4909 C CD . LYS A 1 634 ? 48.648 59.129 -22.112 1.00 59.86 ? 669 LYS A CD 1 ATOM 4910 C CE . LYS A 1 634 ? 48.328 59.712 -20.746 1.00 48.47 ? 669 LYS A CE 1 ATOM 4911 N NZ . LYS A 1 634 ? 46.930 60.254 -20.706 1.00 48.54 ? 669 LYS A NZ 1 ATOM 4912 N N . GLN A 1 635 ? 45.351 55.440 -22.642 1.00 41.95 ? 670 GLN A N 1 ATOM 4913 C CA . GLN A 1 635 ? 45.077 54.469 -21.581 1.00 45.31 ? 670 GLN A CA 1 ATOM 4914 C C . GLN A 1 635 ? 44.095 53.385 -21.997 1.00 47.21 ? 670 GLN A C 1 ATOM 4915 O O . GLN A 1 635 ? 44.165 52.253 -21.522 1.00 45.56 ? 670 GLN A O 1 ATOM 4916 C CB . GLN A 1 635 ? 44.586 55.181 -20.326 1.00 41.60 ? 670 GLN A CB 1 ATOM 4917 C CG . GLN A 1 635 ? 45.637 56.096 -19.738 1.00 50.39 ? 670 GLN A CG 1 ATOM 4918 C CD . GLN A 1 635 ? 45.100 56.947 -18.624 1.00 44.33 ? 670 GLN A CD 1 ATOM 4919 O OE1 . GLN A 1 635 ? 44.698 58.094 -18.839 1.00 48.61 ? 670 GLN A OE1 1 ATOM 4920 N NE2 . GLN A 1 635 ? 45.096 56.397 -17.416 1.00 50.76 ? 670 GLN A NE2 1 ATOM 4921 N N . MET A 1 636 ? 43.179 53.736 -22.888 1.00 40.40 ? 671 MET A N 1 ATOM 4922 C CA . MET A 1 636 ? 42.173 52.791 -23.332 1.00 39.69 ? 671 MET A CA 1 ATOM 4923 C C . MET A 1 636 ? 42.651 52.021 -24.568 1.00 42.19 ? 671 MET A C 1 ATOM 4924 O O . MET A 1 636 ? 43.228 52.603 -25.492 1.00 40.37 ? 671 MET A O 1 ATOM 4925 C CB . MET A 1 636 ? 40.853 53.525 -23.600 1.00 36.25 ? 671 MET A CB 1 ATOM 4926 C CG . MET A 1 636 ? 39.697 52.611 -23.970 1.00 36.48 ? 671 MET A CG 1 ATOM 4927 S SD . MET A 1 636 ? 39.275 51.470 -22.625 1.00 34.10 ? 671 MET A SD 1 ATOM 4928 C CE . MET A 1 636 ? 38.431 52.605 -21.539 1.00 37.52 ? 671 MET A CE 1 ATOM 4929 N N . SER A 1 637 ? 42.457 50.706 -24.568 1.00 34.55 ? 672 SER A N 1 ATOM 4930 C CA . SER A 1 637 ? 42.656 49.908 -25.780 1.00 36.01 ? 672 SER A CA 1 ATOM 4931 C C . SER A 1 637 ? 41.307 49.346 -26.199 1.00 31.32 ? 672 SER A C 1 ATOM 4932 O O . SER A 1 637 ? 40.263 49.926 -25.874 1.00 32.30 ? 672 SER A O 1 ATOM 4933 C CB . SER A 1 637 ? 43.679 48.796 -25.556 1.00 38.58 ? 672 SER A CB 1 ATOM 4934 O OG . SER A 1 637 ? 43.815 47.973 -26.700 1.00 32.89 ? 672 SER A OG 1 ATOM 4935 N N . TYR A 1 638 ? 41.306 48.230 -26.917 1.00 33.52 ? 673 TYR A N 1 ATOM 4936 C CA . TYR A 1 638 ? 40.037 47.664 -27.362 1.00 32.23 ? 673 TYR A CA 1 ATOM 4937 C C . TYR A 1 638 ? 40.105 46.153 -27.452 1.00 25.48 ? 673 TYR A C 1 ATOM 4938 O O . TYR A 1 638 ? 41.188 45.557 -27.471 1.00 35.37 ? 673 TYR A O 1 ATOM 4939 C CB . TYR A 1 638 ? 39.587 48.266 -28.704 1.00 41.74 ? 673 TYR A CB 1 ATOM 4940 C CG . TYR A 1 638 ? 40.505 47.922 -29.856 1.00 41.20 ? 673 TYR A CG 1 ATOM 4941 C CD1 . TYR A 1 638 ? 41.644 48.677 -30.108 1.00 42.93 ? 673 TYR A CD1 1 ATOM 4942 C CD2 . TYR A 1 638 ? 40.242 46.833 -30.682 1.00 42.41 ? 673 TYR A CD2 1 ATOM 4943 C CE1 . TYR A 1 638 ? 42.499 48.364 -31.152 1.00 48.07 ? 673 TYR A CE1 1 ATOM 4944 C CE2 . TYR A 1 638 ? 41.092 46.509 -31.735 1.00 46.63 ? 673 TYR A CE2 1 ATOM 4945 C CZ . TYR A 1 638 ? 42.219 47.280 -31.963 1.00 54.01 ? 673 TYR A CZ 1 ATOM 4946 O OH . TYR A 1 638 ? 43.067 46.970 -33.000 1.00 57.56 ? 673 TYR A OH 1 ATOM 4947 N N . GLY A 1 639 ? 38.937 45.531 -27.491 1.00 29.61 ? 674 GLY A N 1 ATOM 4948 C CA . GLY A 1 639 ? 38.856 44.091 -27.641 1.00 33.48 ? 674 GLY A CA 1 ATOM 4949 C C . GLY A 1 639 ? 37.691 43.706 -28.528 1.00 32.12 ? 674 GLY A C 1 ATOM 4950 O O . GLY A 1 639 ? 36.945 44.565 -28.986 1.00 34.08 ? 674 GLY A O 1 ATOM 4951 N N . PHE A 1 640 ? 37.523 42.409 -28.755 1.00 31.43 ? 675 PHE A N 1 ATOM 4952 C CA . PHE A 1 640 ? 36.396 41.915 -29.524 1.00 32.65 ? 675 PHE A CA 1 ATOM 4953 C C . PHE A 1 640 ? 35.497 40.967 -28.725 1.00 34.57 ? 675 PHE A C 1 ATOM 4954 O O . PHE A 1 640 ? 35.986 40.119 -27.980 1.00 32.77 ? 675 PHE A O 1 ATOM 4955 C CB . PHE A 1 640 ? 36.898 41.182 -30.767 1.00 38.71 ? 675 PHE A CB 1 ATOM 4956 C CG . PHE A 1 640 ? 37.715 42.039 -31.689 1.00 37.49 ? 675 PHE A CG 1 ATOM 4957 C CD1 . PHE A 1 640 ? 37.125 43.056 -32.410 1.00 40.98 ? 675 PHE A CD1 1 ATOM 4958 C CD2 . PHE A 1 640 ? 39.072 41.810 -31.846 1.00 41.23 ? 675 PHE A CD2 1 ATOM 4959 C CE1 . PHE A 1 640 ? 37.875 43.839 -33.272 1.00 37.43 ? 675 PHE A CE1 1 ATOM 4960 C CE2 . PHE A 1 640 ? 39.827 42.591 -32.706 1.00 43.48 ? 675 PHE A CE2 1 ATOM 4961 C CZ . PHE A 1 640 ? 39.226 43.607 -33.414 1.00 36.15 ? 675 PHE A CZ 1 ATOM 4962 N N . LEU A 1 641 ? 34.189 41.090 -28.924 1.00 32.11 ? 676 LEU A N 1 ATOM 4963 C CA . LEU A 1 641 ? 33.221 40.211 -28.276 1.00 33.39 ? 676 LEU A CA 1 ATOM 4964 C C . LEU A 1 641 ? 33.234 38.774 -28.829 1.00 36.96 ? 676 LEU A C 1 ATOM 4965 O O . LEU A 1 641 ? 33.348 37.811 -28.054 1.00 32.44 ? 676 LEU A O 1 ATOM 4966 C CB . LEU A 1 641 ? 31.825 40.827 -28.329 1.00 27.78 ? 676 LEU A CB 1 ATOM 4967 C CG . LEU A 1 641 ? 31.635 42.130 -27.543 1.00 28.07 ? 676 LEU A CG 1 ATOM 4968 C CD1 . LEU A 1 641 ? 30.259 42.714 -27.790 1.00 27.74 ? 676 LEU A CD1 1 ATOM 4969 C CD2 . LEU A 1 641 ? 31.868 41.915 -26.035 1.00 31.40 ? 676 LEU A CD2 1 ATOM 4970 N N . PHE A 1 642 ? 33.122 38.607 -30.153 1.00 33.90 ? 677 PHE A N 1 ATOM 4971 C CA . PHE A 1 642 ? 33.450 37.303 -30.726 1.00 34.81 ? 677 PHE A CA 1 ATOM 4972 C C . PHE A 1 642 ? 34.959 37.214 -30.934 1.00 35.08 ? 677 PHE A C 1 ATOM 4973 O O . PHE A 1 642 ? 35.543 38.076 -31.577 1.00 34.97 ? 677 PHE A O 1 ATOM 4974 C CB . PHE A 1 642 ? 32.720 37.007 -32.039 1.00 40.14 ? 677 PHE A CB 1 ATOM 4975 C CG . PHE A 1 642 ? 33.056 35.660 -32.595 1.00 38.85 ? 677 PHE A CG 1 ATOM 4976 C CD1 . PHE A 1 642 ? 32.421 34.526 -32.110 1.00 40.29 ? 677 PHE A CD1 1 ATOM 4977 C CD2 . PHE A 1 642 ? 34.043 35.514 -33.563 1.00 42.05 ? 677 PHE A CD2 1 ATOM 4978 C CE1 . PHE A 1 642 ? 32.742 33.274 -32.587 1.00 35.59 ? 677 PHE A CE1 1 ATOM 4979 C CE2 . PHE A 1 642 ? 34.375 34.260 -34.049 1.00 40.46 ? 677 PHE A CE2 1 ATOM 4980 C CZ . PHE A 1 642 ? 33.730 33.136 -33.557 1.00 42.96 ? 677 PHE A CZ 1 ATOM 4981 N N . PRO A 1 643 ? 35.593 36.170 -30.381 1.00 32.96 ? 678 PRO A N 1 ATOM 4982 C CA . PRO A 1 643 ? 37.054 36.046 -30.434 1.00 37.47 ? 678 PRO A CA 1 ATOM 4983 C C . PRO A 1 643 ? 37.583 35.525 -31.776 1.00 42.81 ? 678 PRO A C 1 ATOM 4984 O O . PRO A 1 643 ? 37.204 34.433 -32.211 1.00 44.01 ? 678 PRO A O 1 ATOM 4985 C CB . PRO A 1 643 ? 37.352 35.029 -29.331 1.00 36.95 ? 678 PRO A CB 1 ATOM 4986 C CG . PRO A 1 643 ? 36.125 34.181 -29.270 1.00 39.14 ? 678 PRO A CG 1 ATOM 4987 C CD . PRO A 1 643 ? 34.970 35.095 -29.586 1.00 37.58 ? 678 PRO A CD 1 ATOM 4988 N N . PRO A 1 644 ? 38.459 36.306 -32.426 1.00 43.91 ? 679 PRO A N 1 ATOM 4989 C CA . PRO A 1 644 ? 39.163 35.869 -33.636 1.00 46.59 ? 679 PRO A CA 1 ATOM 4990 C C . PRO A 1 644 ? 39.834 34.516 -33.437 1.00 43.18 ? 679 PRO A C 1 ATOM 4991 O O . PRO A 1 644 ? 39.977 33.763 -34.396 1.00 47.70 ? 679 PRO A O 1 ATOM 4992 C CB . PRO A 1 644 ? 40.223 36.955 -33.821 1.00 50.23 ? 679 PRO A CB 1 ATOM 4993 C CG . PRO A 1 644 ? 39.582 38.182 -33.260 1.00 47.81 ? 679 PRO A CG 1 ATOM 4994 C CD . PRO A 1 644 ? 38.772 37.707 -32.083 1.00 41.64 ? 679 PRO A CD 1 ATOM 4995 N N . TYR A 1 645 ? 40.228 34.212 -32.203 1.00 39.08 ? 680 TYR A N 1 ATOM 4996 C CA . TYR A 1 645 ? 40.864 32.939 -31.892 1.00 40.68 ? 680 TYR A CA 1 ATOM 4997 C C . TYR A 1 645 ? 39.989 31.728 -32.229 1.00 39.67 ? 680 TYR A C 1 ATOM 4998 O O . TYR A 1 645 ? 40.497 30.623 -32.409 1.00 42.28 ? 680 TYR A O 1 ATOM 4999 C CB . TYR A 1 645 ? 41.284 32.903 -30.424 1.00 39.54 ? 680 TYR A CB 1 ATOM 5000 C CG . TYR A 1 645 ? 42.146 34.081 -30.037 1.00 44.79 ? 680 TYR A CG 1 ATOM 5001 C CD1 . TYR A 1 645 ? 43.472 34.150 -30.436 1.00 38.75 ? 680 TYR A CD1 1 ATOM 5002 C CD2 . TYR A 1 645 ? 41.632 35.132 -29.289 1.00 45.31 ? 680 TYR A CD2 1 ATOM 5003 C CE1 . TYR A 1 645 ? 44.268 35.234 -30.098 1.00 50.41 ? 680 TYR A CE1 1 ATOM 5004 C CE2 . TYR A 1 645 ? 42.422 36.219 -28.944 1.00 45.58 ? 680 TYR A CE2 1 ATOM 5005 C CZ . TYR A 1 645 ? 43.740 36.264 -29.348 1.00 44.70 ? 680 TYR A CZ 1 ATOM 5006 O OH . TYR A 1 645 ? 44.528 37.345 -29.013 1.00 44.84 ? 680 TYR A OH 1 ATOM 5007 N N . LEU A 1 646 ? 38.680 31.934 -32.329 1.00 46.93 ? 681 LEU A N 1 ATOM 5008 C CA . LEU A 1 646 ? 37.754 30.811 -32.480 1.00 41.31 ? 681 LEU A CA 1 ATOM 5009 C C . LEU A 1 646 ? 37.005 30.844 -33.809 1.00 42.12 ? 681 LEU A C 1 ATOM 5010 O O . LEU A 1 646 ? 35.960 30.213 -33.965 1.00 41.74 ? 681 LEU A O 1 ATOM 5011 C CB . LEU A 1 646 ? 36.768 30.752 -31.304 1.00 34.99 ? 681 LEU A CB 1 ATOM 5012 C CG . LEU A 1 646 ? 37.396 30.589 -29.920 1.00 40.98 ? 681 LEU A CG 1 ATOM 5013 C CD1 . LEU A 1 646 ? 36.316 30.622 -28.865 1.00 39.50 ? 681 LEU A CD1 1 ATOM 5014 C CD2 . LEU A 1 646 ? 38.192 29.295 -29.820 1.00 37.00 ? 681 LEU A CD2 1 ATOM 5015 N N . SER A 1 647 ? 37.547 31.584 -34.766 1.00 43.33 ? 682 SER A N 1 ATOM 5016 C CA . SER A 1 647 ? 37.043 31.556 -36.134 1.00 45.14 ? 682 SER A CA 1 ATOM 5017 C C . SER A 1 647 ? 37.046 30.140 -36.706 1.00 41.02 ? 682 SER A C 1 ATOM 5018 O O . SER A 1 647 ? 37.944 29.341 -36.413 1.00 39.76 ? 682 SER A O 1 ATOM 5019 C CB . SER A 1 647 ? 37.906 32.440 -37.020 1.00 44.04 ? 682 SER A CB 1 ATOM 5020 O OG . SER A 1 647 ? 39.260 32.028 -36.952 1.00 43.18 ? 682 SER A OG 1 ATOM 5021 N N . SER A 1 648 ? 36.037 29.850 -37.526 1.00 39.66 ? 683 SER A N 1 ATOM 5022 C CA . SER A 1 648 ? 35.862 28.536 -38.152 1.00 46.32 ? 683 SER A CA 1 ATOM 5023 C C . SER A 1 648 ? 36.829 28.297 -39.312 1.00 49.30 ? 683 SER A C 1 ATOM 5024 O O . SER A 1 648 ? 37.064 27.156 -39.711 1.00 46.73 ? 683 SER A O 1 ATOM 5025 C CB . SER A 1 648 ? 34.428 28.377 -38.669 1.00 38.41 ? 683 SER A CB 1 ATOM 5026 O OG . SER A 1 648 ? 34.018 29.522 -39.395 1.00 41.53 ? 683 SER A OG 1 ATOM 5027 N N . SER A 1 649 ? 37.382 29.376 -39.848 1.00 45.55 ? 684 SER A N 1 ATOM 5028 C CA . SER A 1 649 ? 38.283 29.286 -40.986 1.00 46.31 ? 684 SER A CA 1 ATOM 5029 C C . SER A 1 649 ? 39.077 30.575 -41.063 1.00 47.04 ? 684 SER A C 1 ATOM 5030 O O . SER A 1 649 ? 38.635 31.604 -40.545 1.00 47.62 ? 684 SER A O 1 ATOM 5031 C CB . SER A 1 649 ? 37.477 29.123 -42.272 1.00 44.15 ? 684 SER A CB 1 ATOM 5032 O OG . SER A 1 649 ? 36.733 30.301 -42.541 1.00 42.67 ? 684 SER A OG 1 ATOM 5033 N N . PRO A 1 650 ? 40.255 30.528 -41.708 1.00 50.63 ? 685 PRO A N 1 ATOM 5034 C CA . PRO A 1 650 ? 41.018 31.756 -41.950 1.00 52.44 ? 685 PRO A CA 1 ATOM 5035 C C . PRO A 1 650 ? 40.169 32.824 -42.643 1.00 45.83 ? 685 PRO A C 1 ATOM 5036 O O . PRO A 1 650 ? 40.338 34.010 -42.363 1.00 46.08 ? 685 PRO A O 1 ATOM 5037 C CB . PRO A 1 650 ? 42.161 31.274 -42.845 1.00 52.88 ? 685 PRO A CB 1 ATOM 5038 C CG . PRO A 1 650 ? 42.416 29.863 -42.350 1.00 50.84 ? 685 PRO A CG 1 ATOM 5039 C CD . PRO A 1 650 ? 41.033 29.318 -42.042 1.00 50.25 ? 685 PRO A CD 1 ATOM 5040 N N . GLU A 1 651 ? 39.248 32.398 -43.501 1.00 47.56 ? 686 GLU A N 1 ATOM 5041 C CA . GLU A 1 651 ? 38.337 33.314 -44.187 1.00 47.33 ? 686 GLU A CA 1 ATOM 5042 C C . GLU A 1 651 ? 37.372 33.996 -43.226 1.00 49.07 ? 686 GLU A C 1 ATOM 5043 O O . GLU A 1 651 ? 37.178 35.214 -43.283 1.00 49.48 ? 686 GLU A O 1 ATOM 5044 C CB . GLU A 1 651 ? 37.526 32.565 -45.253 1.00 55.88 ? 686 GLU A CB 1 ATOM 5045 C CG . GLU A 1 651 ? 38.344 31.989 -46.409 1.00 53.35 ? 686 GLU A CG 1 ATOM 5046 C CD . GLU A 1 651 ? 39.019 30.661 -46.079 1.00 60.46 ? 686 GLU A CD 1 ATOM 5047 O OE1 . GLU A 1 651 ? 38.941 30.214 -44.913 1.00 59.98 ? 686 GLU A OE1 1 ATOM 5048 O OE2 . GLU A 1 651 ? 39.630 30.061 -46.995 1.00 60.70 ? 686 GLU A OE2 1 ATOM 5049 N N . ALA A 1 652 ? 36.766 33.199 -42.346 1.00 46.47 ? 687 ALA A N 1 ATOM 5050 C CA . ALA A 1 652 ? 35.720 33.689 -41.451 1.00 45.48 ? 687 ALA A CA 1 ATOM 5051 C C . ALA A 1 652 ? 36.288 34.650 -40.419 1.00 41.73 ? 687 ALA A C 1 ATOM 5052 O O . ALA A 1 652 ? 35.612 35.579 -39.994 1.00 43.07 ? 687 ALA A O 1 ATOM 5053 C CB . ALA A 1 652 ? 35.022 32.524 -40.766 1.00 40.80 ? 687 ALA A CB 1 ATOM 5054 N N . LYS A 1 653 ? 37.544 34.419 -40.046 1.00 42.43 ? 688 LYS A N 1 ATOM 5055 C CA . LYS A 1 653 ? 38.250 35.222 -39.048 1.00 40.48 ? 688 LYS A CA 1 ATOM 5056 C C . LYS A 1 653 ? 38.168 36.711 -39.333 1.00 44.44 ? 688 LYS A C 1 ATOM 5057 O O . LYS A 1 653 ? 38.236 37.518 -38.413 1.00 42.64 ? 688 LYS A O 1 ATOM 5058 C CB . LYS A 1 653 ? 39.715 34.778 -38.937 1.00 42.89 ? 688 LYS A CB 1 ATOM 5059 C CG . LYS A 1 653 ? 40.426 35.273 -37.691 1.00 49.17 ? 688 LYS A CG 1 ATOM 5060 C CD . LYS A 1 653 ? 41.903 34.946 -37.739 1.00 49.91 ? 688 LYS A CD 1 ATOM 5061 C CE . LYS A 1 653 ? 42.139 33.449 -37.683 1.00 46.36 ? 688 LYS A CE 1 ATOM 5062 N NZ . LYS A 1 653 ? 42.290 32.983 -36.279 1.00 51.59 ? 688 LYS A NZ 1 ATOM 5063 N N . TYR A 1 654 ? 38.009 37.071 -40.607 1.00 41.20 ? 689 TYR A N 1 ATOM 5064 C CA . TYR A 1 654 ? 37.883 38.469 -41.011 1.00 46.74 ? 689 TYR A CA 1 ATOM 5065 C C . TYR A 1 654 ? 36.628 39.133 -40.455 1.00 46.35 ? 689 TYR A C 1 ATOM 5066 O O . TYR A 1 654 ? 36.624 40.340 -40.214 1.00 47.23 ? 689 TYR A O 1 ATOM 5067 C CB . TYR A 1 654 ? 37.940 38.611 -42.543 1.00 53.86 ? 689 TYR A CB 1 ATOM 5068 C CG . TYR A 1 654 ? 39.346 38.496 -43.087 1.00 53.39 ? 689 TYR A CG 1 ATOM 5069 C CD1 . TYR A 1 654 ? 39.920 37.253 -43.330 1.00 51.87 ? 689 TYR A CD1 1 ATOM 5070 C CD2 . TYR A 1 654 ? 40.115 39.629 -43.324 1.00 54.68 ? 689 TYR A CD2 1 ATOM 5071 C CE1 . TYR A 1 654 ? 41.215 37.144 -43.813 1.00 56.20 ? 689 TYR A CE1 1 ATOM 5072 C CE2 . TYR A 1 654 ? 41.410 39.528 -43.807 1.00 56.85 ? 689 TYR A CE2 1 ATOM 5073 C CZ . TYR A 1 654 ? 41.954 38.286 -44.047 1.00 51.94 ? 689 TYR A CZ 1 ATOM 5074 O OH . TYR A 1 654 ? 43.241 38.188 -44.523 1.00 63.69 ? 689 TYR A OH 1 ATOM 5075 N N . ASP A 1 655 ? 35.571 38.349 -40.255 1.00 47.95 ? 690 ASP A N 1 ATOM 5076 C CA . ASP A 1 655 ? 34.350 38.853 -39.617 1.00 49.78 ? 690 ASP A CA 1 ATOM 5077 C C . ASP A 1 655 ? 34.628 39.354 -38.193 1.00 46.36 ? 690 ASP A C 1 ATOM 5078 O O . ASP A 1 655 ? 34.015 40.312 -37.718 1.00 45.85 ? 690 ASP A O 1 ATOM 5079 C CB . ASP A 1 655 ? 33.275 37.761 -39.562 1.00 48.75 ? 690 ASP A CB 1 ATOM 5080 C CG . ASP A 1 655 ? 32.474 37.649 -40.852 1.00 56.03 ? 690 ASP A CG 1 ATOM 5081 O OD1 . ASP A 1 655 ? 32.379 38.657 -41.590 1.00 51.49 ? 690 ASP A OD1 1 ATOM 5082 O OD2 . ASP A 1 655 ? 31.923 36.552 -41.116 1.00 51.17 ? 690 ASP A OD2 1 ATOM 5083 N N . ALA A 1 656 ? 35.558 38.700 -37.512 1.00 46.76 ? 691 ALA A N 1 ATOM 5084 C CA . ALA A 1 656 ? 35.831 39.028 -36.116 1.00 46.21 ? 691 ALA A CA 1 ATOM 5085 C C . ALA A 1 656 ? 36.441 40.424 -35.959 1.00 51.33 ? 691 ALA A C 1 ATOM 5086 O O . ALA A 1 656 ? 36.384 41.015 -34.876 1.00 47.41 ? 691 ALA A O 1 ATOM 5087 C CB . ALA A 1 656 ? 36.733 37.974 -35.493 1.00 40.90 ? 691 ALA A CB 1 ATOM 5088 N N . PHE A 1 657 ? 37.015 40.955 -37.038 1.00 42.43 ? 692 PHE A N 1 ATOM 5089 C CA . PHE A 1 657 ? 37.729 42.224 -36.951 1.00 41.96 ? 692 PHE A CA 1 ATOM 5090 C C . PHE A 1 657 ? 36.863 43.411 -37.312 1.00 44.36 ? 692 PHE A C 1 ATOM 5091 O O . PHE A 1 657 ? 37.347 44.542 -37.388 1.00 50.26 ? 692 PHE A O 1 ATOM 5092 C CB . PHE A 1 657 ? 39.007 42.199 -37.795 1.00 49.13 ? 692 PHE A CB 1 ATOM 5093 C CG . PHE A 1 657 ? 40.036 41.232 -37.291 1.00 48.45 ? 692 PHE A CG 1 ATOM 5094 C CD1 . PHE A 1 657 ? 40.889 41.584 -36.259 1.00 47.72 ? 692 PHE A CD1 1 ATOM 5095 C CD2 . PHE A 1 657 ? 40.142 39.968 -37.838 1.00 45.68 ? 692 PHE A CD2 1 ATOM 5096 C CE1 . PHE A 1 657 ? 41.833 40.699 -35.786 1.00 49.88 ? 692 PHE A CE1 1 ATOM 5097 C CE2 . PHE A 1 657 ? 41.086 39.075 -37.369 1.00 51.56 ? 692 PHE A CE2 1 ATOM 5098 C CZ . PHE A 1 657 ? 41.935 39.442 -36.339 1.00 51.02 ? 692 PHE A CZ 1 ATOM 5099 N N . LEU A 1 658 ? 35.577 43.161 -37.518 1.00 41.51 ? 693 LEU A N 1 ATOM 5100 C CA . LEU A 1 658 ? 34.650 44.243 -37.814 1.00 38.94 ? 693 LEU A CA 1 ATOM 5101 C C . LEU A 1 658 ? 34.554 45.238 -36.666 1.00 46.16 ? 693 LEU A C 1 ATOM 5102 O O . LEU A 1 658 ? 34.600 44.858 -35.494 1.00 46.65 ? 693 LEU A O 1 ATOM 5103 C CB . LEU A 1 658 ? 33.260 43.689 -38.109 1.00 42.99 ? 693 LEU A CB 1 ATOM 5104 C CG . LEU A 1 658 ? 33.060 42.920 -39.410 1.00 46.46 ? 693 LEU A CG 1 ATOM 5105 C CD1 . LEU A 1 658 ? 31.632 42.403 -39.490 1.00 39.50 ? 693 LEU A CD1 1 ATOM 5106 C CD2 . LEU A 1 658 ? 33.386 43.827 -40.594 1.00 48.13 ? 693 LEU A CD2 1 ATOM 5107 N N . VAL A 1 659 ? 34.389 46.509 -37.019 1.00 42.32 ? 694 VAL A N 1 ATOM 5108 C CA . VAL A 1 659 ? 34.235 47.599 -36.062 1.00 42.67 ? 694 VAL A CA 1 ATOM 5109 C C . VAL A 1 659 ? 32.992 47.429 -35.180 1.00 47.59 ? 694 VAL A C 1 ATOM 5110 O O . VAL A 1 659 ? 32.873 48.065 -34.135 1.00 46.21 ? 694 VAL A O 1 ATOM 5111 C CB . VAL A 1 659 ? 34.143 48.966 -36.791 1.00 47.42 ? 694 VAL A CB 1 ATOM 5112 C CG1 . VAL A 1 659 ? 32.730 49.211 -37.311 1.00 46.88 ? 694 VAL A CG1 1 ATOM 5113 C CG2 . VAL A 1 659 ? 34.565 50.100 -35.876 1.00 47.21 ? 694 VAL A CG2 1 ATOM 5114 N N . THR A 1 660 ? 32.071 46.572 -35.607 1.00 43.16 ? 695 THR A N 1 ATOM 5115 C CA . THR A 1 660 ? 30.816 46.362 -34.887 1.00 39.66 ? 695 THR A CA 1 ATOM 5116 C C . THR A 1 660 ? 30.922 45.167 -33.936 1.00 37.24 ? 695 THR A C 1 ATOM 5117 O O . THR A 1 660 ? 29.940 44.729 -33.352 1.00 35.80 ? 695 THR A O 1 ATOM 5118 C CB . THR A 1 660 ? 29.673 46.108 -35.870 1.00 41.68 ? 695 THR A CB 1 ATOM 5119 O OG1 . THR A 1 660 ? 30.137 45.235 -36.908 1.00 36.28 ? 695 THR A OG1 1 ATOM 5120 C CG2 . THR A 1 660 ? 29.211 47.407 -36.492 1.00 40.02 ? 695 THR A CG2 1 ATOM 5121 N N . ASN A 1 661 ? 32.129 44.638 -33.814 1.00 37.90 ? 696 ASN A N 1 ATOM 5122 C CA . ASN A 1 661 ? 32.425 43.550 -32.903 1.00 41.40 ? 696 ASN A CA 1 ATOM 5123 C C . ASN A 1 661 ? 33.428 44.083 -31.882 1.00 40.21 ? 696 ASN A C 1 ATOM 5124 O O . ASN A 1 661 ? 33.933 43.356 -31.028 1.00 35.95 ? 696 ASN A O 1 ATOM 5125 C CB . ASN A 1 661 ? 33.022 42.395 -33.698 1.00 36.81 ? 696 ASN A CB 1 ATOM 5126 C CG . ASN A 1 661 ? 33.276 41.174 -32.859 1.00 33.81 ? 696 ASN A CG 1 ATOM 5127 O OD1 . ASN A 1 661 ? 32.431 40.760 -32.072 1.00 36.98 ? 696 ASN A OD1 1 ATOM 5128 N ND2 . ASN A 1 661 ? 34.457 40.587 -33.020 1.00 37.07 ? 696 ASN A ND2 1 ATOM 5129 N N . MET A 1 662 ? 33.698 45.378 -31.980 1.00 40.44 ? 697 MET A N 1 ATOM 5130 C CA . MET A 1 662 ? 34.745 46.016 -31.202 1.00 38.99 ? 697 MET A CA 1 ATOM 5131 C C . MET A 1 662 ? 34.190 46.628 -29.916 1.00 30.81 ? 697 MET A C 1 ATOM 5132 O O . MET A 1 662 ? 33.111 47.213 -29.922 1.00 30.07 ? 697 MET A O 1 ATOM 5133 C CB . MET A 1 662 ? 35.403 47.104 -32.048 1.00 37.63 ? 697 MET A CB 1 ATOM 5134 C CG . MET A 1 662 ? 36.653 47.709 -31.454 1.00 45.33 ? 697 MET A CG 1 ATOM 5135 S SD . MET A 1 662 ? 37.451 48.902 -32.572 1.00 51.28 ? 697 MET A SD 1 ATOM 5136 C CE . MET A 1 662 ? 36.180 50.127 -32.720 1.00 39.66 ? 697 MET A CE 1 ATOM 5137 N N . VAL A 1 663 ? 34.927 46.486 -28.815 1.00 35.68 ? 698 VAL A N 1 ATOM 5138 C CA . VAL A 1 663 ? 34.558 47.166 -27.559 1.00 33.01 ? 698 VAL A CA 1 ATOM 5139 C C . VAL A 1 663 ? 35.776 47.724 -26.825 1.00 25.79 ? 698 VAL A C 1 ATOM 5140 O O . VAL A 1 663 ? 36.881 47.177 -26.930 1.00 32.41 ? 698 VAL A O 1 ATOM 5141 C CB . VAL A 1 663 ? 33.756 46.239 -26.614 1.00 34.57 ? 698 VAL A CB 1 ATOM 5142 C CG1 . VAL A 1 663 ? 32.330 46.051 -27.127 1.00 30.92 ? 698 VAL A CG1 1 ATOM 5143 C CG2 . VAL A 1 663 ? 34.464 44.913 -26.458 1.00 32.45 ? 698 VAL A CG2 1 ATOM 5144 N N . PRO A 1 664 ? 35.588 48.830 -26.089 1.00 30.41 ? 699 PRO A N 1 ATOM 5145 C CA . PRO A 1 664 ? 36.756 49.422 -25.439 1.00 31.25 ? 699 PRO A CA 1 ATOM 5146 C C . PRO A 1 664 ? 37.164 48.658 -24.188 1.00 29.70 ? 699 PRO A C 1 ATOM 5147 O O . PRO A 1 664 ? 36.347 48.427 -23.303 1.00 31.56 ? 699 PRO A O 1 ATOM 5148 C CB . PRO A 1 664 ? 36.281 50.830 -25.086 1.00 32.47 ? 699 PRO A CB 1 ATOM 5149 C CG . PRO A 1 664 ? 34.798 50.702 -24.932 1.00 31.87 ? 699 PRO A CG 1 ATOM 5150 C CD . PRO A 1 664 ? 34.381 49.663 -25.936 1.00 26.47 ? 699 PRO A CD 1 ATOM 5151 N N . MET A 1 665 ? 38.430 48.272 -24.118 1.00 30.43 ? 700 MET A N 1 ATOM 5152 C CA . MET A 1 665 ? 38.945 47.586 -22.955 1.00 30.59 ? 700 MET A CA 1 ATOM 5153 C C . MET A 1 665 ? 40.286 48.145 -22.545 1.00 36.52 ? 700 MET A C 1 ATOM 5154 O O . MET A 1 665 ? 41.161 48.390 -23.380 1.00 34.10 ? 700 MET A O 1 ATOM 5155 C CB . MET A 1 665 ? 39.105 46.106 -23.248 1.00 30.88 ? 700 MET A CB 1 ATOM 5156 C CG . MET A 1 665 ? 37.824 45.424 -23.653 1.00 31.38 ? 700 MET A CG 1 ATOM 5157 S SD . MET A 1 665 ? 38.055 43.664 -23.833 1.00 31.74 ? 700 MET A SD 1 ATOM 5158 C CE . MET A 1 665 ? 36.325 43.182 -23.871 1.00 25.50 ? 700 MET A CE 1 ATOM 5159 N N . TYR A 1 666 ? 40.449 48.342 -21.247 1.00 28.32 ? 701 TYR A N 1 ATOM 5160 C CA . TYR A 1 666 ? 41.751 48.662 -20.700 1.00 29.74 ? 701 TYR A CA 1 ATOM 5161 C C . TYR A 1 666 ? 42.665 47.500 -20.954 1.00 30.44 ? 701 TYR A C 1 ATOM 5162 O O . TYR A 1 666 ? 42.220 46.353 -20.926 1.00 33.72 ? 701 TYR A O 1 ATOM 5163 C CB . TYR A 1 666 ? 41.631 48.874 -19.193 1.00 28.87 ? 701 TYR A CB 1 ATOM 5164 C CG . TYR A 1 666 ? 41.025 50.185 -18.832 1.00 27.20 ? 701 TYR A CG 1 ATOM 5165 C CD1 . TYR A 1 666 ? 41.683 51.371 -19.142 1.00 32.96 ? 701 TYR A CD1 1 ATOM 5166 C CD2 . TYR A 1 666 ? 39.800 50.258 -18.171 1.00 27.60 ? 701 TYR A CD2 1 ATOM 5167 C CE1 . TYR A 1 666 ? 41.150 52.581 -18.812 1.00 31.19 ? 701 TYR A CE1 1 ATOM 5168 C CE2 . TYR A 1 666 ? 39.254 51.474 -17.825 1.00 29.29 ? 701 TYR A CE2 1 ATOM 5169 C CZ . TYR A 1 666 ? 39.941 52.640 -18.150 1.00 36.24 ? 701 TYR A CZ 1 ATOM 5170 O OH . TYR A 1 666 ? 39.428 53.870 -17.828 1.00 37.05 ? 701 TYR A OH 1 ATOM 5171 N N . PRO A 1 667 ? 43.958 47.778 -21.199 1.00 31.27 ? 702 PRO A N 1 ATOM 5172 C CA . PRO A 1 667 ? 44.929 46.689 -21.314 1.00 28.97 ? 702 PRO A CA 1 ATOM 5173 C C . PRO A 1 667 ? 44.895 45.743 -20.094 1.00 31.56 ? 702 PRO A C 1 ATOM 5174 O O . PRO A 1 667 ? 45.036 44.532 -20.271 1.00 30.66 ? 702 PRO A O 1 ATOM 5175 C CB . PRO A 1 667 ? 46.266 47.422 -21.405 1.00 32.29 ? 702 PRO A CB 1 ATOM 5176 C CG . PRO A 1 667 ? 45.916 48.750 -22.027 1.00 36.80 ? 702 PRO A CG 1 ATOM 5177 C CD . PRO A 1 667 ? 44.555 49.098 -21.472 1.00 35.02 ? 702 PRO A CD 1 ATOM 5178 N N . ALA A 1 668 ? 44.705 46.275 -18.887 1.00 30.03 ? 703 ALA A N 1 ATOM 5179 C CA . ALA A 1 668 ? 44.546 45.400 -17.716 1.00 29.30 ? 703 ALA A CA 1 ATOM 5180 C C . ALA A 1 668 ? 43.413 44.396 -17.914 1.00 26.95 ? 703 ALA A C 1 ATOM 5181 O O . ALA A 1 668 ? 43.572 43.206 -17.658 1.00 30.32 ? 703 ALA A O 1 ATOM 5182 C CB . ALA A 1 668 ? 44.305 46.218 -16.454 1.00 27.69 ? 703 ALA A CB 1 ATOM 5183 N N . PHE A 1 669 ? 42.262 44.878 -18.366 1.00 25.61 ? 704 PHE A N 1 ATOM 5184 C CA . PHE A 1 669 ? 41.141 43.981 -18.576 1.00 25.70 ? 704 PHE A CA 1 ATOM 5185 C C . PHE A 1 669 ? 41.410 43.004 -19.718 1.00 32.17 ? 704 PHE A C 1 ATOM 5186 O O . PHE A 1 669 ? 40.975 41.841 -19.692 1.00 31.17 ? 704 PHE A O 1 ATOM 5187 C CB . PHE A 1 669 ? 39.858 44.764 -18.836 1.00 25.21 ? 704 PHE A CB 1 ATOM 5188 C CG . PHE A 1 669 ? 38.648 43.896 -18.896 1.00 28.69 ? 704 PHE A CG 1 ATOM 5189 C CD1 . PHE A 1 669 ? 38.032 43.470 -17.734 1.00 23.39 ? 704 PHE A CD1 1 ATOM 5190 C CD2 . PHE A 1 669 ? 38.143 43.464 -20.114 1.00 28.85 ? 704 PHE A CD2 1 ATOM 5191 C CE1 . PHE A 1 669 ? 36.926 42.650 -17.788 1.00 25.35 ? 704 PHE A CE1 1 ATOM 5192 C CE2 . PHE A 1 669 ? 37.038 42.643 -20.169 1.00 27.72 ? 704 PHE A CE2 1 ATOM 5193 C CZ . PHE A 1 669 ? 36.430 42.227 -19.002 1.00 27.35 ? 704 PHE A CZ 1 ATOM 5194 N N . LYS A 1 670 ? 42.137 43.472 -20.727 1.00 33.60 ? 705 LYS A N 1 ATOM 5195 C CA . LYS A 1 670 ? 42.437 42.625 -21.870 1.00 27.07 ? 705 LYS A CA 1 ATOM 5196 C C . LYS A 1 670 ? 43.256 41.404 -21.473 1.00 26.47 ? 705 LYS A C 1 ATOM 5197 O O . LYS A 1 670 ? 43.166 40.357 -22.111 1.00 33.74 ? 705 LYS A O 1 ATOM 5198 C CB . LYS A 1 670 ? 43.149 43.430 -22.966 1.00 31.33 ? 705 LYS A CB 1 ATOM 5199 C CG . LYS A 1 670 ? 42.260 44.455 -23.619 1.00 28.61 ? 705 LYS A CG 1 ATOM 5200 C CD . LYS A 1 670 ? 43.030 45.287 -24.643 1.00 37.66 ? 705 LYS A CD 1 ATOM 5201 C CE . LYS A 1 670 ? 43.721 44.395 -25.677 1.00 38.40 ? 705 LYS A CE 1 ATOM 5202 N NZ . LYS A 1 670 ? 42.749 43.709 -26.578 1.00 39.14 ? 705 LYS A NZ 1 ATOM 5203 N N . ARG A 1 671 ? 44.040 41.526 -20.410 1.00 30.78 ? 706 ARG A N 1 ATOM 5204 C CA . ARG A 1 671 ? 44.797 40.385 -19.926 1.00 30.73 ? 706 ARG A CA 1 ATOM 5205 C C . ARG A 1 671 ? 43.845 39.263 -19.549 1.00 30.93 ? 706 ARG A C 1 ATOM 5206 O O . ARG A 1 671 ? 44.135 38.088 -19.767 1.00 31.02 ? 706 ARG A O 1 ATOM 5207 C CB . ARG A 1 671 ? 45.674 40.761 -18.733 1.00 34.94 ? 706 ARG A CB 1 ATOM 5208 C CG . ARG A 1 671 ? 46.821 41.708 -19.063 1.00 35.05 ? 706 ARG A CG 1 ATOM 5209 C CD . ARG A 1 671 ? 47.755 41.853 -17.872 1.00 34.31 ? 706 ARG A CD 1 ATOM 5210 N NE . ARG A 1 671 ? 48.455 40.603 -17.605 1.00 31.69 ? 706 ARG A NE 1 ATOM 5211 C CZ . ARG A 1 671 ? 49.090 40.323 -16.474 1.00 29.22 ? 706 ARG A CZ 1 ATOM 5212 N NH1 . ARG A 1 671 ? 49.096 41.201 -15.481 1.00 35.71 ? 706 ARG A NH1 1 ATOM 5213 N NH2 . ARG A 1 671 ? 49.699 39.153 -16.328 1.00 36.86 ? 706 ARG A NH2 1 ATOM 5214 N N . VAL A 1 672 ? 42.689 39.642 -19.013 1.00 30.31 ? 707 VAL A N 1 ATOM 5215 C CA . VAL A 1 672 ? 41.700 38.678 -18.555 1.00 29.59 ? 707 VAL A CA 1 ATOM 5216 C C . VAL A 1 672 ? 40.863 38.181 -19.725 1.00 29.35 ? 707 VAL A C 1 ATOM 5217 O O . VAL A 1 672 ? 40.664 36.973 -19.911 1.00 30.51 ? 707 VAL A O 1 ATOM 5218 C CB . VAL A 1 672 ? 40.770 39.327 -17.495 1.00 24.98 ? 707 VAL A CB 1 ATOM 5219 C CG1 . VAL A 1 672 ? 39.582 38.414 -17.188 1.00 28.28 ? 707 VAL A CG1 1 ATOM 5220 C CG2 . VAL A 1 672 ? 41.564 39.666 -16.242 1.00 25.94 ? 707 VAL A CG2 1 ATOM 5221 N N . TRP A 1 673 ? 40.383 39.125 -20.517 1.00 26.74 ? 708 TRP A N 1 ATOM 5222 C CA . TRP A 1 673 ? 39.490 38.831 -21.628 1.00 29.92 ? 708 TRP A CA 1 ATOM 5223 C C . TRP A 1 673 ? 40.140 37.959 -22.701 1.00 33.15 ? 708 TRP A C 1 ATOM 5224 O O . TRP A 1 673 ? 39.526 37.009 -23.180 1.00 33.08 ? 708 TRP A O 1 ATOM 5225 C CB . TRP A 1 673 ? 38.964 40.127 -22.243 1.00 32.12 ? 708 TRP A CB 1 ATOM 5226 C CG . TRP A 1 673 ? 37.826 39.923 -23.174 1.00 31.94 ? 708 TRP A CG 1 ATOM 5227 C CD1 . TRP A 1 673 ? 37.834 40.114 -24.519 1.00 32.44 ? 708 TRP A CD1 1 ATOM 5228 C CD2 . TRP A 1 673 ? 36.499 39.487 -22.838 1.00 34.86 ? 708 TRP A CD2 1 ATOM 5229 N NE1 . TRP A 1 673 ? 36.601 39.832 -25.046 1.00 34.44 ? 708 TRP A NE1 1 ATOM 5230 C CE2 . TRP A 1 673 ? 35.761 39.443 -24.034 1.00 34.44 ? 708 TRP A CE2 1 ATOM 5231 C CE3 . TRP A 1 673 ? 35.863 39.140 -21.639 1.00 37.22 ? 708 TRP A CE3 1 ATOM 5232 C CZ2 . TRP A 1 673 ? 34.415 39.058 -24.075 1.00 34.60 ? 708 TRP A CZ2 1 ATOM 5233 C CZ3 . TRP A 1 673 ? 34.529 38.761 -21.677 1.00 34.01 ? 708 TRP A CZ3 1 ATOM 5234 C CH2 . TRP A 1 673 ? 33.819 38.720 -22.890 1.00 37.69 ? 708 TRP A CH2 1 ATOM 5235 N N . THR A 1 674 ? 41.381 38.262 -23.067 1.00 32.53 ? 709 THR A N 1 ATOM 5236 C CA . THR A 1 674 ? 42.066 37.449 -24.066 1.00 34.52 ? 709 THR A CA 1 ATOM 5237 C C . THR A 1 674 ? 42.249 36.019 -23.574 1.00 34.24 ? 709 THR A C 1 ATOM 5238 O O . THR A 1 674 ? 42.042 35.069 -24.331 1.00 38.00 ? 709 THR A O 1 ATOM 5239 C CB . THR A 1 674 ? 43.422 38.054 -24.462 1.00 32.83 ? 709 THR A CB 1 ATOM 5240 O OG1 . THR A 1 674 ? 43.207 39.345 -25.044 1.00 37.04 ? 709 THR A OG1 1 ATOM 5241 C CG2 . THR A 1 674 ? 44.147 37.155 -25.456 1.00 38.84 ? 709 THR A CG2 1 ATOM 5242 N N . TYR A 1 675 ? 42.615 35.859 -22.302 1.00 30.25 ? 710 TYR A N 1 ATOM 5243 C CA . TYR A 1 675 ? 42.792 34.519 -21.750 1.00 29.68 ? 710 TYR A CA 1 ATOM 5244 C C . TYR A 1 675 ? 41.457 33.800 -21.719 1.00 31.04 ? 710 TYR A C 1 ATOM 5245 O O . TYR A 1 675 ? 41.384 32.597 -21.949 1.00 31.01 ? 710 TYR A O 1 ATOM 5246 C CB . TYR A 1 675 ? 43.422 34.573 -20.356 1.00 26.71 ? 710 TYR A CB 1 ATOM 5247 C CG . TYR A 1 675 ? 43.718 33.220 -19.756 1.00 37.78 ? 710 TYR A CG 1 ATOM 5248 C CD1 . TYR A 1 675 ? 44.861 32.522 -20.113 1.00 36.42 ? 710 TYR A CD1 1 ATOM 5249 C CD2 . TYR A 1 675 ? 42.861 32.644 -18.814 1.00 30.92 ? 710 TYR A CD2 1 ATOM 5250 C CE1 . TYR A 1 675 ? 45.140 31.279 -19.567 1.00 38.64 ? 710 TYR A CE1 1 ATOM 5251 C CE2 . TYR A 1 675 ? 43.134 31.408 -18.265 1.00 32.06 ? 710 TYR A CE2 1 ATOM 5252 C CZ . TYR A 1 675 ? 44.274 30.727 -18.646 1.00 36.99 ? 710 TYR A CZ 1 ATOM 5253 O OH . TYR A 1 675 ? 44.559 29.496 -18.110 1.00 40.16 ? 710 TYR A OH 1 ATOM 5254 N N . PHE A 1 676 ? 40.392 34.546 -21.448 1.00 30.19 ? 711 PHE A N 1 ATOM 5255 C CA . PHE A 1 676 ? 39.047 33.986 -21.491 1.00 29.16 ? 711 PHE A CA 1 ATOM 5256 C C . PHE A 1 676 ? 38.729 33.517 -22.906 1.00 34.29 ? 711 PHE A C 1 ATOM 5257 O O . PHE A 1 676 ? 38.306 32.383 -23.109 1.00 36.11 ? 711 PHE A O 1 ATOM 5258 C CB . PHE A 1 676 ? 38.025 35.041 -21.069 1.00 30.22 ? 711 PHE A CB 1 ATOM 5259 C CG . PHE A 1 676 ? 36.593 34.637 -21.290 1.00 34.57 ? 711 PHE A CG 1 ATOM 5260 C CD1 . PHE A 1 676 ? 36.014 33.634 -20.530 1.00 35.48 ? 711 PHE A CD1 1 ATOM 5261 C CD2 . PHE A 1 676 ? 35.815 35.289 -22.232 1.00 34.51 ? 711 PHE A CD2 1 ATOM 5262 C CE1 . PHE A 1 676 ? 34.688 33.278 -20.720 1.00 36.27 ? 711 PHE A CE1 1 ATOM 5263 C CE2 . PHE A 1 676 ? 34.493 34.933 -22.429 1.00 32.90 ? 711 PHE A CE2 1 ATOM 5264 C CZ . PHE A 1 676 ? 33.931 33.928 -21.665 1.00 33.23 ? 711 PHE A CZ 1 ATOM 5265 N N . GLN A 1 677 ? 38.945 34.403 -23.875 1.00 32.21 ? 712 GLN A N 1 ATOM 5266 C CA . GLN A 1 677 ? 38.612 34.118 -25.273 1.00 37.53 ? 712 GLN A CA 1 ATOM 5267 C C . GLN A 1 677 ? 39.446 32.970 -25.853 1.00 34.33 ? 712 GLN A C 1 ATOM 5268 O O . GLN A 1 677 ? 38.924 32.108 -26.562 1.00 46.65 ? 712 GLN A O 1 ATOM 5269 C CB . GLN A 1 677 ? 38.795 35.364 -26.144 1.00 37.27 ? 712 GLN A CB 1 ATOM 5270 C CG . GLN A 1 677 ? 37.983 36.599 -25.761 1.00 36.84 ? 712 GLN A CG 1 ATOM 5271 C CD . GLN A 1 677 ? 36.509 36.507 -26.098 1.00 40.43 ? 712 GLN A CD 1 ATOM 5272 O OE1 . GLN A 1 677 ? 35.813 35.595 -25.650 1.00 45.65 ? 712 GLN A OE1 1 ATOM 5273 N NE2 . GLN A 1 677 ? 36.018 37.465 -26.885 1.00 34.50 ? 712 GLN A NE2 1 ATOM 5274 N N . ARG A 1 678 ? 40.738 32.953 -25.544 1.00 34.46 ? 713 ARG A N 1 ATOM 5275 C CA . ARG A 1 678 ? 41.685 32.052 -26.213 1.00 33.45 ? 713 ARG A CA 1 ATOM 5276 C C . ARG A 1 678 ? 41.850 30.696 -25.534 1.00 40.92 ? 713 ARG A C 1 ATOM 5277 O O . ARG A 1 678 ? 42.042 29.682 -26.199 1.00 42.02 ? 713 ARG A O 1 ATOM 5278 C CB . ARG A 1 678 ? 43.048 32.739 -26.355 1.00 37.56 ? 713 ARG A CB 1 ATOM 5279 C CG . ARG A 1 678 ? 44.159 31.883 -26.978 1.00 45.45 ? 713 ARG A CG 1 ATOM 5280 C CD . ARG A 1 678 ? 45.511 32.617 -26.936 1.00 51.45 ? 713 ARG A CD 1 ATOM 5281 N NE . ARG A 1 678 ? 45.971 32.837 -25.562 1.00 60.29 ? 713 ARG A NE 1 ATOM 5282 C CZ . ARG A 1 678 ? 46.852 32.063 -24.930 1.00 61.45 ? 713 ARG A CZ 1 ATOM 5283 N NH1 . ARG A 1 678 ? 47.382 31.019 -25.556 1.00 57.66 ? 713 ARG A NH1 1 ATOM 5284 N NH2 . ARG A 1 678 ? 47.205 32.332 -23.672 1.00 51.38 ? 713 ARG A NH2 1 ATOM 5285 N N . VAL A 1 679 ? 41.772 30.674 -24.209 1.00 34.84 ? 714 VAL A N 1 ATOM 5286 C CA . VAL A 1 679 ? 41.988 29.436 -23.476 1.00 33.74 ? 714 VAL A CA 1 ATOM 5287 C C . VAL A 1 679 ? 40.693 28.903 -22.851 1.00 36.75 ? 714 VAL A C 1 ATOM 5288 O O . VAL A 1 679 ? 40.347 27.737 -23.034 1.00 36.15 ? 714 VAL A O 1 ATOM 5289 C CB . VAL A 1 679 ? 43.079 29.613 -22.392 1.00 36.30 ? 714 VAL A CB 1 ATOM 5290 C CG1 . VAL A 1 679 ? 43.375 28.294 -21.690 1.00 32.92 ? 714 VAL A CG1 1 ATOM 5291 C CG2 . VAL A 1 679 ? 44.344 30.198 -23.006 1.00 37.45 ? 714 VAL A CG2 1 ATOM 5292 N N . LEU A 1 680 ? 39.962 29.755 -22.135 1.00 36.59 ? 715 LEU A N 1 ATOM 5293 C CA . LEU A 1 680 ? 38.849 29.269 -21.305 1.00 36.21 ? 715 LEU A CA 1 ATOM 5294 C C . LEU A 1 680 ? 37.594 28.804 -22.043 1.00 32.11 ? 715 LEU A C 1 ATOM 5295 O O . LEU A 1 680 ? 36.987 27.806 -21.664 1.00 29.73 ? 715 LEU A O 1 ATOM 5296 C CB . LEU A 1 680 ? 38.477 30.298 -20.238 1.00 30.37 ? 715 LEU A CB 1 ATOM 5297 C CG . LEU A 1 680 ? 39.628 30.540 -19.265 1.00 35.13 ? 715 LEU A CG 1 ATOM 5298 C CD1 . LEU A 1 680 ? 39.213 31.523 -18.183 1.00 33.94 ? 715 LEU A CD1 1 ATOM 5299 C CD2 . LEU A 1 680 ? 40.088 29.221 -18.666 1.00 32.14 ? 715 LEU A CD2 1 ATOM 5300 N N . VAL A 1 681 ? 37.187 29.532 -23.071 1.00 33.79 ? 716 VAL A N 1 ATOM 5301 C CA . VAL A 1 681 ? 35.981 29.160 -23.803 1.00 30.89 ? 716 VAL A CA 1 ATOM 5302 C C . VAL A 1 681 ? 36.119 27.766 -24.412 1.00 37.54 ? 716 VAL A C 1 ATOM 5303 O O . VAL A 1 681 ? 35.198 26.935 -24.332 1.00 31.61 ? 716 VAL A O 1 ATOM 5304 C CB . VAL A 1 681 ? 35.639 30.193 -24.895 1.00 37.32 ? 716 VAL A CB 1 ATOM 5305 C CG1 . VAL A 1 681 ? 34.590 29.643 -25.854 1.00 33.54 ? 716 VAL A CG1 1 ATOM 5306 C CG2 . VAL A 1 681 ? 35.163 31.490 -24.261 1.00 29.43 ? 716 VAL A CG2 1 ATOM 5307 N N . LYS A 1 682 ? 37.283 27.497 -24.994 1.00 35.15 ? 717 LYS A N 1 ATOM 5308 C CA . LYS A 1 682 ? 37.530 26.185 -25.581 1.00 37.17 ? 717 LYS A CA 1 ATOM 5309 C C . LYS A 1 682 ? 37.577 25.125 -24.494 1.00 35.19 ? 717 LYS A C 1 ATOM 5310 O O . LYS A 1 682 ? 37.077 24.019 -24.689 1.00 37.97 ? 717 LYS A O 1 ATOM 5311 C CB . LYS A 1 682 ? 38.821 26.184 -26.406 1.00 41.28 ? 717 LYS A CB 1 ATOM 5312 C CG . LYS A 1 682 ? 39.276 24.810 -26.875 1.00 42.84 ? 717 LYS A CG 1 ATOM 5313 C CD . LYS A 1 682 ? 38.196 24.092 -27.675 1.00 46.56 ? 717 LYS A CD 1 ATOM 5314 C CE . LYS A 1 682 ? 38.646 22.685 -28.057 1.00 48.36 ? 717 LYS A CE 1 ATOM 5315 N NZ . LYS A 1 682 ? 37.561 21.943 -28.742 1.00 51.29 ? 717 LYS A NZ 1 ATOM 5316 N N . LYS A 1 683 ? 38.166 25.462 -23.349 1.00 34.44 ? 718 LYS A N 1 ATOM 5317 C CA . LYS A 1 683 ? 38.194 24.539 -22.218 1.00 37.04 ? 718 LYS A CA 1 ATOM 5318 C C . LYS A 1 683 ? 36.768 24.171 -21.791 1.00 31.80 ? 718 LYS A C 1 ATOM 5319 O O . LYS A 1 683 ? 36.478 23.005 -21.526 1.00 31.28 ? 718 LYS A O 1 ATOM 5320 C CB . LYS A 1 683 ? 38.983 25.130 -21.048 1.00 34.45 ? 718 LYS A CB 1 ATOM 5321 C CG . LYS A 1 683 ? 39.049 24.243 -19.802 1.00 41.68 ? 718 LYS A CG 1 ATOM 5322 C CD . LYS A 1 683 ? 40.211 24.658 -18.903 1.00 43.84 ? 718 LYS A CD 1 ATOM 5323 C CE . LYS A 1 683 ? 40.177 23.962 -17.551 1.00 53.25 ? 718 LYS A CE 1 ATOM 5324 N NZ . LYS A 1 683 ? 39.417 24.753 -16.542 1.00 56.71 ? 718 LYS A NZ 1 ATOM 5325 N N . TYR A 1 684 ? 35.881 25.164 -21.745 1.00 33.86 ? 719 TYR A N 1 ATOM 5326 C CA . TYR A 1 684 ? 34.482 24.925 -21.378 1.00 29.95 ? 719 TYR A CA 1 ATOM 5327 C C . TYR A 1 684 ? 33.776 24.037 -22.417 1.00 36.91 ? 719 TYR A C 1 ATOM 5328 O O . TYR A 1 684 ? 33.053 23.105 -22.062 1.00 33.08 ? 719 TYR A O 1 ATOM 5329 C CB . TYR A 1 684 ? 33.710 26.244 -21.224 1.00 28.51 ? 719 TYR A CB 1 ATOM 5330 C CG . TYR A 1 684 ? 34.280 27.215 -20.199 1.00 30.17 ? 719 TYR A CG 1 ATOM 5331 C CD1 . TYR A 1 684 ? 35.160 26.791 -19.208 1.00 30.99 ? 719 TYR A CD1 1 ATOM 5332 C CD2 . TYR A 1 684 ? 33.932 28.558 -20.231 1.00 37.20 ? 719 TYR A CD2 1 ATOM 5333 C CE1 . TYR A 1 684 ? 35.682 27.689 -18.286 1.00 35.72 ? 719 TYR A CE1 1 ATOM 5334 C CE2 . TYR A 1 684 ? 34.445 29.456 -19.315 1.00 34.75 ? 719 TYR A CE2 1 ATOM 5335 C CZ . TYR A 1 684 ? 35.315 29.019 -18.348 1.00 37.42 ? 719 TYR A CZ 1 ATOM 5336 O OH . TYR A 1 684 ? 35.819 29.924 -17.441 1.00 40.45 ? 719 TYR A OH 1 ATOM 5337 N N . ALA A 1 685 ? 33.992 24.337 -23.696 1.00 35.35 ? 720 ALA A N 1 ATOM 5338 C CA . ALA A 1 685 ? 33.422 23.542 -24.788 1.00 34.84 ? 720 ALA A CA 1 ATOM 5339 C C . ALA A 1 685 ? 33.888 22.094 -24.720 1.00 34.07 ? 720 ALA A C 1 ATOM 5340 O O . ALA A 1 685 ? 33.112 21.171 -24.943 1.00 39.76 ? 720 ALA A O 1 ATOM 5341 C CB . ALA A 1 685 ? 33.777 24.150 -26.131 1.00 31.45 ? 720 ALA A CB 1 ATOM 5342 N N . SER A 1 686 ? 35.162 21.902 -24.409 1.00 38.08 ? 721 SER A N 1 ATOM 5343 C CA . SER A 1 686 ? 35.721 20.567 -24.249 1.00 36.29 ? 721 SER A CA 1 ATOM 5344 C C . SER A 1 686 ? 35.041 19.797 -23.107 1.00 42.09 ? 721 SER A C 1 ATOM 5345 O O . SER A 1 686 ? 34.664 18.629 -23.272 1.00 37.84 ? 721 SER A O 1 ATOM 5346 C CB . SER A 1 686 ? 37.236 20.669 -24.023 1.00 41.81 ? 721 SER A CB 1 ATOM 5347 O OG . SER A 1 686 ? 37.806 19.428 -23.635 1.00 52.71 ? 721 SER A OG 1 ATOM 5348 N N . GLU A 1 687 ? 34.867 20.460 -21.962 1.00 34.70 ? 722 GLU A N 1 ATOM 5349 C CA . GLU A 1 687 ? 34.351 19.813 -20.754 1.00 35.86 ? 722 GLU A CA 1 ATOM 5350 C C . GLU A 1 687 ? 32.836 19.635 -20.761 1.00 33.68 ? 722 GLU A C 1 ATOM 5351 O O . GLU A 1 687 ? 32.315 18.743 -20.110 1.00 34.89 ? 722 GLU A O 1 ATOM 5352 C CB . GLU A 1 687 ? 34.745 20.611 -19.497 1.00 40.41 ? 722 GLU A CB 1 ATOM 5353 C CG . GLU A 1 687 ? 36.248 20.822 -19.294 1.00 41.08 ? 722 GLU A CG 1 ATOM 5354 C CD . GLU A 1 687 ? 36.565 21.841 -18.197 1.00 42.06 ? 722 GLU A CD 1 ATOM 5355 O OE1 . GLU A 1 687 ? 35.709 22.697 -17.886 1.00 45.10 ? 722 GLU A OE1 1 ATOM 5356 O OE2 . GLU A 1 687 ? 37.682 21.785 -17.645 1.00 42.86 ? 722 GLU A OE2 1 ATOM 5357 N N . ARG A 1 688 ? 32.127 20.489 -21.483 1.00 29.88 ? 723 ARG A N 1 ATOM 5358 C CA . ARG A 1 688 ? 30.665 20.488 -21.430 1.00 33.33 ? 723 ARG A CA 1 ATOM 5359 C C . ARG A 1 688 ? 30.024 19.962 -22.707 1.00 32.03 ? 723 ARG A C 1 ATOM 5360 O O . ARG A 1 688 ? 28.797 19.986 -22.854 1.00 33.33 ? 723 ARG A O 1 ATOM 5361 C CB . ARG A 1 688 ? 30.151 21.891 -21.100 1.00 31.59 ? 723 ARG A CB 1 ATOM 5362 C CG . ARG A 1 688 ? 30.501 22.307 -19.675 1.00 32.71 ? 723 ARG A CG 1 ATOM 5363 C CD . ARG A 1 688 ? 30.282 23.793 -19.439 1.00 30.95 ? 723 ARG A CD 1 ATOM 5364 N NE . ARG A 1 688 ? 28.884 24.180 -19.571 1.00 31.96 ? 723 ARG A NE 1 ATOM 5365 C CZ . ARG A 1 688 ? 28.409 25.352 -19.167 1.00 32.22 ? 723 ARG A CZ 1 ATOM 5366 N NH1 . ARG A 1 688 ? 29.227 26.237 -18.602 1.00 29.95 ? 723 ARG A NH1 1 ATOM 5367 N NH2 . ARG A 1 688 ? 27.119 25.628 -19.307 1.00 27.64 ? 723 ARG A NH2 1 ATOM 5368 N N . ASN A 1 689 ? 30.870 19.482 -23.615 1.00 34.32 ? 724 ASN A N 1 ATOM 5369 C CA . ASN A 1 689 ? 30.438 18.962 -24.910 1.00 29.55 ? 724 ASN A CA 1 ATOM 5370 C C . ASN A 1 689 ? 29.834 20.078 -25.732 1.00 30.87 ? 724 ASN A C 1 ATOM 5371 O O . ASN A 1 689 ? 28.682 20.008 -26.141 1.00 33.32 ? 724 ASN A O 1 ATOM 5372 C CB . ASN A 1 689 ? 29.459 17.795 -24.744 1.00 34.11 ? 724 ASN A CB 1 ATOM 5373 C CG . ASN A 1 689 ? 29.232 17.032 -26.032 1.00 39.07 ? 724 ASN A CG 1 ATOM 5374 O OD1 . ASN A 1 689 ? 29.802 17.366 -27.068 1.00 39.89 ? 724 ASN A OD1 1 ATOM 5375 N ND2 . ASN A 1 689 ? 28.406 15.990 -25.970 1.00 32.58 ? 724 ASN A ND2 1 ATOM 5376 N N . GLY A 1 690 ? 30.636 21.119 -25.955 1.00 34.92 ? 725 GLY A N 1 ATOM 5377 C CA . GLY A 1 690 ? 30.193 22.307 -26.663 1.00 32.24 ? 725 GLY A CA 1 ATOM 5378 C C . GLY A 1 690 ? 29.561 23.329 -25.722 1.00 34.69 ? 725 GLY A C 1 ATOM 5379 O O . GLY A 1 690 ? 28.971 22.957 -24.710 1.00 33.53 ? 725 GLY A O 1 ATOM 5380 N N . VAL A 1 691 ? 29.700 24.613 -26.038 1.00 28.65 ? 726 VAL A N 1 ATOM 5381 C CA . VAL A 1 691 ? 28.994 25.652 -25.286 1.00 34.95 ? 726 VAL A CA 1 ATOM 5382 C C . VAL A 1 691 ? 28.428 26.732 -26.198 1.00 33.96 ? 726 VAL A C 1 ATOM 5383 O O . VAL A 1 691 ? 28.993 27.039 -27.252 1.00 37.24 ? 726 VAL A O 1 ATOM 5384 C CB . VAL A 1 691 ? 29.889 26.354 -24.227 1.00 31.13 ? 726 VAL A CB 1 ATOM 5385 C CG1 . VAL A 1 691 ? 30.248 25.414 -23.079 1.00 29.95 ? 726 VAL A CG1 1 ATOM 5386 C CG2 . VAL A 1 691 ? 31.146 26.940 -24.871 1.00 31.81 ? 726 VAL A CG2 1 ATOM 5387 N N . ASN A 1 692 ? 27.302 27.300 -25.788 1.00 30.25 ? 727 ASN A N 1 ATOM 5388 C CA . ASN A 1 692 ? 26.805 28.532 -26.381 1.00 28.74 ? 727 ASN A CA 1 ATOM 5389 C C . ASN A 1 692 ? 27.188 29.705 -25.488 1.00 32.96 ? 727 ASN A C 1 ATOM 5390 O O . ASN A 1 692 ? 26.968 29.667 -24.276 1.00 29.46 ? 727 ASN A O 1 ATOM 5391 C CB . ASN A 1 692 ? 25.291 28.470 -26.538 1.00 28.84 ? 727 ASN A CB 1 ATOM 5392 C CG . ASN A 1 692 ? 24.714 29.746 -27.087 1.00 30.82 ? 727 ASN A CG 1 ATOM 5393 O OD1 . ASN A 1 692 ? 24.160 30.563 -26.346 1.00 29.55 ? 727 ASN A OD1 1 ATOM 5394 N ND2 . ASN A 1 692 ? 24.839 29.935 -28.404 1.00 35.77 ? 727 ASN A ND2 1 ATOM 5395 N N . VAL A 1 693 ? 27.768 30.738 -26.081 1.00 31.53 ? 728 VAL A N 1 ATOM 5396 C CA . VAL A 1 693 ? 28.216 31.905 -25.336 1.00 30.97 ? 728 VAL A CA 1 ATOM 5397 C C . VAL A 1 693 ? 27.446 33.134 -25.772 1.00 35.09 ? 728 VAL A C 1 ATOM 5398 O O . VAL A 1 693 ? 27.332 33.407 -26.967 1.00 34.63 ? 728 VAL A O 1 ATOM 5399 C CB . VAL A 1 693 ? 29.719 32.175 -25.588 1.00 31.54 ? 728 VAL A CB 1 ATOM 5400 C CG1 . VAL A 1 693 ? 30.172 33.455 -24.885 1.00 35.53 ? 728 VAL A CG1 1 ATOM 5401 C CG2 . VAL A 1 693 ? 30.569 30.971 -25.160 1.00 32.82 ? 728 VAL A CG2 1 ATOM 5402 N N . ILE A 1 694 ? 26.910 33.885 -24.816 1.00 28.68 ? 729 ILE A N 1 ATOM 5403 C CA . ILE A 1 694 ? 26.469 35.240 -25.126 1.00 26.59 ? 729 ILE A CA 1 ATOM 5404 C C . ILE A 1 694 ? 27.283 36.229 -24.296 1.00 31.20 ? 729 ILE A C 1 ATOM 5405 O O . ILE A 1 694 ? 27.277 36.155 -23.065 1.00 28.45 ? 729 ILE A O 1 ATOM 5406 C CB . ILE A 1 694 ? 24.975 35.445 -24.844 1.00 29.84 ? 729 ILE A CB 1 ATOM 5407 C CG1 . ILE A 1 694 ? 24.138 34.425 -25.623 1.00 33.96 ? 729 ILE A CG1 1 ATOM 5408 C CG2 . ILE A 1 694 ? 24.560 36.852 -25.226 1.00 29.79 ? 729 ILE A CG2 1 ATOM 5409 C CD1 . ILE A 1 694 ? 22.645 34.514 -25.352 1.00 31.50 ? 729 ILE A CD1 1 ATOM 5410 N N . SER A 1 695 ? 27.995 37.136 -24.961 1.00 29.64 ? 730 SER A N 1 ATOM 5411 C CA . SER A 1 695 ? 28.817 38.128 -24.265 1.00 28.30 ? 730 SER A CA 1 ATOM 5412 C C . SER A 1 695 ? 28.334 39.535 -24.581 1.00 30.70 ? 730 SER A C 1 ATOM 5413 O O . SER A 1 695 ? 27.663 39.758 -25.589 1.00 31.58 ? 730 SER A O 1 ATOM 5414 C CB . SER A 1 695 ? 30.299 37.983 -24.622 1.00 27.41 ? 730 SER A CB 1 ATOM 5415 O OG . SER A 1 695 ? 30.804 36.711 -24.259 1.00 30.77 ? 730 SER A OG 1 ATOM 5416 N N . GLY A 1 696 ? 28.657 40.485 -23.712 1.00 27.69 ? 731 GLY A N 1 ATOM 5417 C CA . GLY A 1 696 ? 28.273 41.862 -23.945 1.00 25.34 ? 731 GLY A CA 1 ATOM 5418 C C . GLY A 1 696 ? 28.764 42.812 -22.869 1.00 31.81 ? 731 GLY A C 1 ATOM 5419 O O . GLY A 1 696 ? 29.416 42.395 -21.907 1.00 28.93 ? 731 GLY A O 1 ATOM 5420 N N . PRO A 1 697 ? 28.456 44.103 -23.031 1.00 30.62 ? 732 PRO A N 1 ATOM 5421 C CA . PRO A 1 697 ? 28.816 45.153 -22.081 1.00 29.93 ? 732 PRO A CA 1 ATOM 5422 C C . PRO A 1 697 ? 27.710 45.409 -21.078 1.00 26.26 ? 732 PRO A C 1 ATOM 5423 O O . PRO A 1 697 ? 26.549 45.107 -21.333 1.00 25.79 ? 732 PRO A O 1 ATOM 5424 C CB . PRO A 1 697 ? 28.931 46.379 -22.979 1.00 28.44 ? 732 PRO A CB 1 ATOM 5425 C CG . PRO A 1 697 ? 27.809 46.153 -23.978 1.00 29.25 ? 732 PRO A CG 1 ATOM 5426 C CD . PRO A 1 697 ? 27.846 44.666 -24.254 1.00 30.07 ? 732 PRO A CD 1 ATOM 5427 N N . ILE A 1 698 ? 28.086 45.999 -19.948 1.00 27.02 ? 733 ILE A N 1 ATOM 5428 C CA . ILE A 1 698 ? 27.135 46.440 -18.940 1.00 24.17 ? 733 ILE A CA 1 ATOM 5429 C C . ILE A 1 698 ? 27.528 47.840 -18.513 1.00 19.55 ? 733 ILE A C 1 ATOM 5430 O O . ILE A 1 698 ? 28.710 48.127 -18.366 1.00 26.37 ? 733 ILE A O 1 ATOM 5431 C CB . ILE A 1 698 ? 27.143 45.467 -17.736 1.00 21.04 ? 733 ILE A CB 1 ATOM 5432 C CG1 . ILE A 1 698 ? 26.301 44.234 -18.073 1.00 25.21 ? 733 ILE A CG1 1 ATOM 5433 C CG2 . ILE A 1 698 ? 26.616 46.143 -16.473 1.00 25.08 ? 733 ILE A CG2 1 ATOM 5434 C CD1 . ILE A 1 698 ? 26.502 43.074 -17.129 1.00 25.63 ? 733 ILE A CD1 1 ATOM 5435 N N . PHE A 1 699 ? 26.539 48.708 -18.329 1.00 23.36 ? 734 PHE A N 1 ATOM 5436 C CA . PHE A 1 699 ? 26.775 50.056 -17.829 1.00 23.71 ? 734 PHE A CA 1 ATOM 5437 C C . PHE A 1 699 ? 26.060 50.286 -16.492 1.00 22.44 ? 734 PHE A C 1 ATOM 5438 O O . PHE A 1 699 ? 24.822 50.367 -16.422 1.00 26.24 ? 734 PHE A O 1 ATOM 5439 C CB . PHE A 1 699 ? 26.323 51.084 -18.876 1.00 26.83 ? 734 PHE A CB 1 ATOM 5440 C CG . PHE A 1 699 ? 26.988 50.899 -20.221 1.00 28.85 ? 734 PHE A CG 1 ATOM 5441 C CD1 . PHE A 1 699 ? 26.481 49.997 -21.145 1.00 30.45 ? 734 PHE A CD1 1 ATOM 5442 C CD2 . PHE A 1 699 ? 28.130 51.609 -20.545 1.00 26.47 ? 734 PHE A CD2 1 ATOM 5443 C CE1 . PHE A 1 699 ? 27.097 49.821 -22.372 1.00 32.38 ? 734 PHE A CE1 1 ATOM 5444 C CE2 . PHE A 1 699 ? 28.761 51.429 -21.768 1.00 30.68 ? 734 PHE A CE2 1 ATOM 5445 C CZ . PHE A 1 699 ? 28.242 50.535 -22.684 1.00 29.99 ? 734 PHE A CZ 1 ATOM 5446 N N . ASP A 1 700 ? 26.841 50.389 -15.419 1.00 24.94 ? 735 ASP A N 1 ATOM 5447 C CA . ASP A 1 700 ? 26.260 50.622 -14.101 1.00 22.51 ? 735 ASP A CA 1 ATOM 5448 C C . ASP A 1 700 ? 27.088 51.606 -13.269 1.00 29.80 ? 735 ASP A C 1 ATOM 5449 O O . ASP A 1 700 ? 27.587 51.272 -12.185 1.00 24.88 ? 735 ASP A O 1 ATOM 5450 C CB . ASP A 1 700 ? 26.079 49.293 -13.357 1.00 23.65 ? 735 ASP A CB 1 ATOM 5451 C CG . ASP A 1 700 ? 25.196 49.438 -12.137 1.00 26.58 ? 735 ASP A CG 1 ATOM 5452 O OD1 . ASP A 1 700 ? 24.442 50.427 -12.079 1.00 24.01 ? 735 ASP A OD1 1 ATOM 5453 O OD2 . ASP A 1 700 ? 25.260 48.584 -11.229 1.00 22.67 ? 735 ASP A OD2 1 ATOM 5454 N N . TYR A 1 701 ? 27.209 52.834 -13.769 1.00 26.83 ? 736 TYR A N 1 ATOM 5455 C CA . TYR A 1 701 ? 28.037 53.857 -13.125 1.00 27.62 ? 736 TYR A CA 1 ATOM 5456 C C . TYR A 1 701 ? 27.567 54.276 -11.738 1.00 27.77 ? 736 TYR A C 1 ATOM 5457 O O . TYR A 1 701 ? 28.380 54.708 -10.911 1.00 26.80 ? 736 TYR A O 1 ATOM 5458 C CB . TYR A 1 701 ? 28.191 55.089 -14.040 1.00 27.72 ? 736 TYR A CB 1 ATOM 5459 C CG . TYR A 1 701 ? 29.240 54.867 -15.102 1.00 24.41 ? 736 TYR A CG 1 ATOM 5460 C CD1 . TYR A 1 701 ? 28.927 54.210 -16.279 1.00 22.46 ? 736 TYR A CD1 1 ATOM 5461 C CD2 . TYR A 1 701 ? 30.548 55.280 -14.910 1.00 24.54 ? 736 TYR A CD2 1 ATOM 5462 C CE1 . TYR A 1 701 ? 29.877 53.988 -17.243 1.00 25.67 ? 736 TYR A CE1 1 ATOM 5463 C CE2 . TYR A 1 701 ? 31.510 55.055 -15.864 1.00 29.55 ? 736 TYR A CE2 1 ATOM 5464 C CZ . TYR A 1 701 ? 31.165 54.409 -17.033 1.00 26.13 ? 736 TYR A CZ 1 ATOM 5465 O OH . TYR A 1 701 ? 32.116 54.183 -17.990 1.00 34.36 ? 736 TYR A OH 1 ATOM 5466 N N . ASN A 1 702 ? 26.263 54.161 -11.493 1.00 26.55 ? 737 ASN A N 1 ATOM 5467 C CA . ASN A 1 702 ? 25.688 54.498 -10.205 1.00 24.88 ? 737 ASN A CA 1 ATOM 5468 C C . ASN A 1 702 ? 25.478 53.266 -9.319 1.00 26.30 ? 737 ASN A C 1 ATOM 5469 O O . ASN A 1 702 ? 24.795 53.346 -8.311 1.00 21.94 ? 737 ASN A O 1 ATOM 5470 C CB . ASN A 1 702 ? 24.366 55.253 -10.376 1.00 24.23 ? 737 ASN A CB 1 ATOM 5471 C CG . ASN A 1 702 ? 23.277 54.405 -11.021 1.00 28.94 ? 737 ASN A CG 1 ATOM 5472 O OD1 . ASN A 1 702 ? 23.531 53.305 -11.514 1.00 27.79 ? 737 ASN A OD1 1 ATOM 5473 N ND2 . ASN A 1 702 ? 22.056 54.932 -11.038 1.00 30.61 ? 737 ASN A ND2 1 ATOM 5474 N N . TYR A 1 703 ? 26.071 52.143 -9.730 1.00 26.41 ? 738 TYR A N 1 ATOM 5475 C CA . TYR A 1 703 ? 26.137 50.918 -8.929 1.00 22.17 ? 738 TYR A CA 1 ATOM 5476 C C . TYR A 1 703 ? 24.827 50.513 -8.235 1.00 25.62 ? 738 TYR A C 1 ATOM 5477 O O . TYR A 1 703 ? 24.834 50.088 -7.067 1.00 24.05 ? 738 TYR A O 1 ATOM 5478 C CB . TYR A 1 703 ? 27.311 50.995 -7.935 1.00 21.85 ? 738 TYR A CB 1 ATOM 5479 C CG . TYR A 1 703 ? 27.356 52.235 -7.040 1.00 25.43 ? 738 TYR A CG 1 ATOM 5480 C CD1 . TYR A 1 703 ? 26.643 52.284 -5.844 1.00 23.05 ? 738 TYR A CD1 1 ATOM 5481 C CD2 . TYR A 1 703 ? 28.156 53.333 -7.370 1.00 32.19 ? 738 TYR A CD2 1 ATOM 5482 C CE1 . TYR A 1 703 ? 26.701 53.406 -5.009 1.00 25.41 ? 738 TYR A CE1 1 ATOM 5483 C CE2 . TYR A 1 703 ? 28.222 54.451 -6.545 1.00 28.73 ? 738 TYR A CE2 1 ATOM 5484 C CZ . TYR A 1 703 ? 27.485 54.484 -5.379 1.00 33.61 ? 738 TYR A CZ 1 ATOM 5485 O OH . TYR A 1 703 ? 27.534 55.593 -4.571 1.00 38.28 ? 738 TYR A OH 1 ATOM 5486 N N . ASN A 1 704 ? 23.706 50.647 -8.942 1.00 19.48 ? 739 ASN A N 1 ATOM 5487 C CA . ASN A 1 704 ? 22.407 50.251 -8.388 1.00 20.54 ? 739 ASN A CA 1 ATOM 5488 C C . ASN A 1 704 ? 21.946 48.898 -8.934 1.00 19.20 ? 739 ASN A C 1 ATOM 5489 O O . ASN A 1 704 ? 20.839 48.453 -8.637 1.00 22.71 ? 739 ASN A O 1 ATOM 5490 C CB . ASN A 1 704 ? 21.333 51.321 -8.622 1.00 24.10 ? 739 ASN A CB 1 ATOM 5491 C CG . ASN A 1 704 ? 20.942 51.444 -10.098 1.00 27.34 ? 739 ASN A CG 1 ATOM 5492 O OD1 . ASN A 1 704 ? 21.602 50.887 -10.977 1.00 25.32 ? 739 ASN A OD1 1 ATOM 5493 N ND2 . ASN A 1 704 ? 19.869 52.193 -10.369 1.00 28.00 ? 739 ASN A ND2 1 ATOM 5494 N N . GLY A 1 705 ? 22.798 48.259 -9.737 1.00 21.30 ? 740 GLY A N 1 ATOM 5495 C CA . GLY A 1 705 ? 22.512 46.924 -10.245 1.00 21.30 ? 740 GLY A CA 1 ATOM 5496 C C . GLY A 1 705 ? 21.578 46.926 -11.443 1.00 24.12 ? 740 GLY A C 1 ATOM 5497 O O . GLY A 1 705 ? 21.122 45.862 -11.906 1.00 21.64 ? 740 GLY A O 1 ATOM 5498 N N . LEU A 1 706 ? 21.308 48.119 -11.965 1.00 20.96 ? 741 LEU A N 1 ATOM 5499 C CA . LEU A 1 706 ? 20.336 48.279 -13.048 1.00 24.33 ? 741 LEU A CA 1 ATOM 5500 C C . LEU A 1 706 ? 20.947 48.997 -14.249 1.00 28.51 ? 741 LEU A C 1 ATOM 5501 O O . LEU A 1 706 ? 21.806 49.870 -14.098 1.00 25.67 ? 741 LEU A O 1 ATOM 5502 C CB . LEU A 1 706 ? 19.126 49.073 -12.561 1.00 24.36 ? 741 LEU A CB 1 ATOM 5503 C CG . LEU A 1 706 ? 18.377 48.607 -11.309 1.00 25.86 ? 741 LEU A CG 1 ATOM 5504 C CD1 . LEU A 1 706 ? 17.323 49.617 -10.963 1.00 24.06 ? 741 LEU A CD1 1 ATOM 5505 C CD2 . LEU A 1 706 ? 17.758 47.254 -11.528 1.00 23.86 ? 741 LEU A CD2 1 ATOM 5506 N N . ARG A 1 707 ? 20.518 48.590 -15.437 1.00 24.24 ? 742 ARG A N 1 ATOM 5507 C CA . ARG A 1 707 ? 20.917 49.224 -16.693 1.00 26.16 ? 742 ARG A CA 1 ATOM 5508 C C . ARG A 1 707 ? 20.968 50.745 -16.586 1.00 20.64 ? 742 ARG A C 1 ATOM 5509 O O . ARG A 1 707 ? 19.984 51.381 -16.199 1.00 25.80 ? 742 ARG A O 1 ATOM 5510 C CB . ARG A 1 707 ? 19.908 48.813 -17.764 1.00 28.22 ? 742 ARG A CB 1 ATOM 5511 C CG . ARG A 1 707 ? 20.112 49.446 -19.118 1.00 34.13 ? 742 ARG A CG 1 ATOM 5512 C CD . ARG A 1 707 ? 18.973 49.066 -20.047 1.00 32.90 ? 742 ARG A CD 1 ATOM 5513 N NE . ARG A 1 707 ? 17.657 49.380 -19.488 1.00 31.25 ? 742 ARG A NE 1 ATOM 5514 C CZ . ARG A 1 707 ? 17.065 50.568 -19.588 1.00 35.53 ? 742 ARG A CZ 1 ATOM 5515 N NH1 . ARG A 1 707 ? 17.681 51.567 -20.220 1.00 33.69 ? 742 ARG A NH1 1 ATOM 5516 N NH2 . ARG A 1 707 ? 15.867 50.764 -19.053 1.00 35.52 ? 742 ARG A NH2 1 ATOM 5517 N N . ASP A 1 708 ? 22.119 51.338 -16.888 1.00 25.97 ? 743 ASP A N 1 ATOM 5518 C CA . ASP A 1 708 ? 22.211 52.802 -16.914 1.00 27.32 ? 743 ASP A CA 1 ATOM 5519 C C . ASP A 1 708 ? 21.455 53.396 -18.114 1.00 29.19 ? 743 ASP A C 1 ATOM 5520 O O . ASP A 1 708 ? 21.463 52.823 -19.198 1.00 29.87 ? 743 ASP A O 1 ATOM 5521 C CB . ASP A 1 708 ? 23.661 53.252 -17.045 1.00 28.07 ? 743 ASP A CB 1 ATOM 5522 C CG . ASP A 1 708 ? 24.437 53.132 -15.756 1.00 28.79 ? 743 ASP A CG 1 ATOM 5523 O OD1 . ASP A 1 708 ? 23.822 52.908 -14.693 1.00 24.93 ? 743 ASP A OD1 1 ATOM 5524 O OD2 . ASP A 1 708 ? 25.670 53.247 -15.831 1.00 29.90 ? 743 ASP A OD2 1 ATOM 5525 N N . ILE A 1 709 ? 20.847 54.557 -17.919 1.00 30.20 ? 744 ILE A N 1 ATOM 5526 C CA . ILE A 1 709 ? 20.369 55.357 -19.051 1.00 41.53 ? 744 ILE A CA 1 ATOM 5527 C C . ILE A 1 709 ? 21.548 56.196 -19.530 1.00 42.37 ? 744 ILE A C 1 ATOM 5528 O O . ILE A 1 709 ? 22.548 56.290 -18.826 1.00 37.10 ? 744 ILE A O 1 ATOM 5529 C CB . ILE A 1 709 ? 19.214 56.275 -18.654 1.00 35.74 ? 744 ILE A CB 1 ATOM 5530 C CG1 . ILE A 1 709 ? 19.691 57.323 -17.651 1.00 32.09 ? 744 ILE A CG1 1 ATOM 5531 C CG2 . ILE A 1 709 ? 18.057 55.470 -18.082 1.00 39.18 ? 744 ILE A CG2 1 ATOM 5532 C CD1 . ILE A 1 709 ? 18.588 58.191 -17.138 1.00 44.03 ? 744 ILE A CD1 1 ATOM 5533 N N . GLU A 1 710 ? 21.449 56.811 -20.709 1.00 41.62 ? 745 GLU A N 1 ATOM 5534 C CA . GLU A 1 710 ? 22.609 57.514 -21.284 1.00 39.02 ? 745 GLU A CA 1 ATOM 5535 C C . GLU A 1 710 ? 23.185 58.585 -20.363 1.00 36.75 ? 745 GLU A C 1 ATOM 5536 O O . GLU A 1 710 ? 24.403 58.749 -20.259 1.00 34.98 ? 745 GLU A O 1 ATOM 5537 C CB . GLU A 1 710 ? 22.249 58.159 -22.625 1.00 40.24 ? 745 GLU A CB 1 ATOM 5538 C CG . GLU A 1 710 ? 21.641 57.210 -23.624 1.00 43.30 ? 745 GLU A CG 1 ATOM 5539 C CD . GLU A 1 710 ? 21.190 57.934 -24.874 1.00 55.31 ? 745 GLU A CD 1 ATOM 5540 O OE1 . GLU A 1 710 ? 19.990 58.278 -24.963 1.00 55.85 ? 745 GLU A OE1 1 ATOM 5541 O OE2 . GLU A 1 710 ? 22.045 58.171 -25.754 1.00 49.49 ? 745 GLU A OE2 1 ATOM 5542 N N . ASP A 1 711 ? 22.292 59.305 -19.697 1.00 32.52 ? 746 ASP A N 1 ATOM 5543 C CA . ASP A 1 711 ? 22.651 60.374 -18.782 1.00 37.23 ? 746 ASP A CA 1 ATOM 5544 C C . ASP A 1 711 ? 23.533 59.877 -17.621 1.00 41.98 ? 746 ASP A C 1 ATOM 5545 O O . ASP A 1 711 ? 24.242 60.656 -16.988 1.00 37.36 ? 746 ASP A O 1 ATOM 5546 C CB . ASP A 1 711 ? 21.370 61.014 -18.236 1.00 38.79 ? 746 ASP A CB 1 ATOM 5547 C CG . ASP A 1 711 ? 21.641 62.027 -17.145 1.00 57.92 ? 746 ASP A CG 1 ATOM 5548 O OD1 . ASP A 1 711 ? 22.537 62.881 -17.337 1.00 64.47 ? 746 ASP A OD1 1 ATOM 5549 O OD2 . ASP A 1 711 ? 20.967 61.962 -16.089 1.00 61.97 ? 746 ASP A OD2 1 ATOM 5550 N N . GLU A 1 712 ? 23.501 58.573 -17.362 1.00 40.84 ? 747 GLU A N 1 ATOM 5551 C CA . GLU A 1 712 ? 24.211 58.009 -16.215 1.00 38.88 ? 747 GLU A CA 1 ATOM 5552 C C . GLU A 1 712 ? 25.616 57.510 -16.526 1.00 39.18 ? 747 GLU A C 1 ATOM 5553 O O . GLU A 1 712 ? 26.428 57.331 -15.615 1.00 35.33 ? 747 GLU A O 1 ATOM 5554 C CB . GLU A 1 712 ? 23.379 56.903 -15.575 1.00 35.68 ? 747 GLU A CB 1 ATOM 5555 C CG . GLU A 1 712 ? 22.312 57.439 -14.645 1.00 35.57 ? 747 GLU A CG 1 ATOM 5556 C CD . GLU A 1 712 ? 21.204 56.439 -14.373 1.00 37.77 ? 747 GLU A CD 1 ATOM 5557 O OE1 . GLU A 1 712 ? 21.167 55.368 -15.023 1.00 34.71 ? 747 GLU A OE1 1 ATOM 5558 O OE2 . GLU A 1 712 ? 20.357 56.741 -13.512 1.00 36.75 ? 747 GLU A OE2 1 ATOM 5559 N N . ILE A 1 713 ? 25.898 57.284 -17.806 1.00 32.07 ? 748 ILE A N 1 ATOM 5560 C CA . ILE A 1 713 ? 27.230 56.880 -18.239 1.00 35.57 ? 748 ILE A CA 1 ATOM 5561 C C . ILE A 1 713 ? 28.188 58.058 -18.058 1.00 36.89 ? 748 ILE A C 1 ATOM 5562 O O . ILE A 1 713 ? 27.866 59.192 -18.426 1.00 38.16 ? 748 ILE A O 1 ATOM 5563 C CB . ILE A 1 713 ? 27.209 56.359 -19.703 1.00 33.28 ? 748 ILE A CB 1 ATOM 5564 C CG1 . ILE A 1 713 ? 26.289 55.138 -19.806 1.00 37.53 ? 748 ILE A CG1 1 ATOM 5565 C CG2 . ILE A 1 713 ? 28.608 56.004 -20.194 1.00 35.10 ? 748 ILE A CG2 1 ATOM 5566 C CD1 . ILE A 1 713 ? 26.211 54.547 -21.197 1.00 37.83 ? 748 ILE A CD1 1 ATOM 5567 N N . LYS A 1 714 ? 29.361 57.794 -17.486 1.00 34.15 ? 749 LYS A N 1 ATOM 5568 C CA . LYS A 1 714 ? 30.230 58.877 -17.041 1.00 35.40 ? 749 LYS A CA 1 ATOM 5569 C C . LYS A 1 714 ? 31.596 58.891 -17.699 1.00 35.85 ? 749 LYS A C 1 ATOM 5570 O O . LYS A 1 714 ? 32.345 59.858 -17.559 1.00 40.34 ? 749 LYS A O 1 ATOM 5571 C CB . LYS A 1 714 ? 30.384 58.848 -15.521 1.00 36.95 ? 749 LYS A CB 1 ATOM 5572 C CG . LYS A 1 714 ? 29.078 59.026 -14.778 1.00 37.54 ? 749 LYS A CG 1 ATOM 5573 C CD . LYS A 1 714 ? 28.350 60.285 -15.221 1.00 42.67 ? 749 LYS A CD 1 ATOM 5574 C CE . LYS A 1 714 ? 27.107 60.522 -14.374 1.00 40.54 ? 749 LYS A CE 1 ATOM 5575 N NZ . LYS A 1 714 ? 26.329 61.734 -14.807 1.00 46.34 ? 749 LYS A NZ 1 ATOM 5576 N N . GLN A 1 715 ? 31.920 57.830 -18.423 1.00 29.45 ? 750 GLN A N 1 ATOM 5577 C CA . GLN A 1 715 ? 33.211 57.748 -19.088 1.00 39.71 ? 750 GLN A CA 1 ATOM 5578 C C . GLN A 1 715 ? 33.065 57.352 -20.557 1.00 39.96 ? 750 GLN A C 1 ATOM 5579 O O . GLN A 1 715 ? 32.258 56.481 -20.893 1.00 37.20 ? 750 GLN A O 1 ATOM 5580 C CB . GLN A 1 715 ? 34.115 56.768 -18.348 1.00 35.14 ? 750 GLN A CB 1 ATOM 5581 C CG . GLN A 1 715 ? 35.409 56.453 -19.051 1.00 39.76 ? 750 GLN A CG 1 ATOM 5582 C CD . GLN A 1 715 ? 36.273 55.502 -18.257 1.00 43.80 ? 750 GLN A CD 1 ATOM 5583 O OE1 . GLN A 1 715 ? 35.967 55.181 -17.102 1.00 47.11 ? 750 GLN A OE1 1 ATOM 5584 N NE2 . GLN A 1 715 ? 37.364 55.047 -18.867 1.00 43.13 ? 750 GLN A NE2 1 ATOM 5585 N N . TYR A 1 716 ? 33.853 58.003 -21.418 1.00 41.08 ? 751 TYR A N 1 ATOM 5586 C CA . TYR A 1 716 ? 33.865 57.740 -22.858 1.00 36.25 ? 751 TYR A CA 1 ATOM 5587 C C . TYR A 1 716 ? 35.313 57.570 -23.350 1.00 38.93 ? 751 TYR A C 1 ATOM 5588 O O . TYR A 1 716 ? 36.255 58.007 -22.688 1.00 39.67 ? 751 TYR A O 1 ATOM 5589 C CB . TYR A 1 716 ? 33.162 58.883 -23.612 1.00 41.69 ? 751 TYR A CB 1 ATOM 5590 C CG . TYR A 1 716 ? 31.699 59.053 -23.249 1.00 33.48 ? 751 TYR A CG 1 ATOM 5591 C CD1 . TYR A 1 716 ? 31.318 59.807 -22.149 1.00 38.57 ? 751 TYR A CD1 1 ATOM 5592 C CD2 . TYR A 1 716 ? 30.702 58.442 -23.993 1.00 37.28 ? 751 TYR A CD2 1 ATOM 5593 C CE1 . TYR A 1 716 ? 29.985 59.951 -21.801 1.00 33.51 ? 751 TYR A CE1 1 ATOM 5594 C CE2 . TYR A 1 716 ? 29.362 58.585 -23.657 1.00 36.00 ? 751 TYR A CE2 1 ATOM 5595 C CZ . TYR A 1 716 ? 29.011 59.345 -22.555 1.00 35.44 ? 751 TYR A CZ 1 ATOM 5596 O OH . TYR A 1 716 ? 27.683 59.497 -22.204 1.00 40.20 ? 751 TYR A OH 1 ATOM 5597 N N . VAL A 1 717 ? 35.503 56.909 -24.487 1.00 29.97 ? 752 VAL A N 1 ATOM 5598 C CA . VAL A 1 717 ? 36.837 56.834 -25.085 1.00 38.29 ? 752 VAL A CA 1 ATOM 5599 C C . VAL A 1 717 ? 37.266 58.265 -25.426 1.00 40.42 ? 752 VAL A C 1 ATOM 5600 O O . VAL A 1 717 ? 36.441 59.078 -25.838 1.00 38.96 ? 752 VAL A O 1 ATOM 5601 C CB . VAL A 1 717 ? 36.865 55.919 -26.324 1.00 40.18 ? 752 VAL A CB 1 ATOM 5602 C CG1 . VAL A 1 717 ? 38.285 55.771 -26.866 1.00 36.46 ? 752 VAL A CG1 1 ATOM 5603 C CG2 . VAL A 1 717 ? 36.316 54.549 -25.956 1.00 43.71 ? 752 VAL A CG2 1 ATOM 5604 N N . GLU A 1 718 ? 38.542 58.569 -25.202 1.00 45.22 ? 753 GLU A N 1 ATOM 5605 C CA . GLU A 1 718 ? 39.069 59.935 -25.309 1.00 46.72 ? 753 GLU A CA 1 ATOM 5606 C C . GLU A 1 718 ? 38.670 60.647 -26.597 1.00 48.98 ? 753 GLU A C 1 ATOM 5607 O O . GLU A 1 718 ? 38.884 60.127 -27.693 1.00 48.11 ? 753 GLU A O 1 ATOM 5608 C CB . GLU A 1 718 ? 40.600 59.930 -25.162 1.00 50.54 ? 753 GLU A CB 1 ATOM 5609 C CG . GLU A 1 718 ? 41.311 61.173 -25.697 1.00 48.13 ? 753 GLU A CG 1 ATOM 5610 C CD . GLU A 1 718 ? 42.731 61.327 -25.149 1.00 52.81 ? 753 GLU A CD 1 ATOM 5611 O OE1 . GLU A 1 718 ? 43.424 62.284 -25.558 1.00 52.50 ? 753 GLU A OE1 1 ATOM 5612 O OE2 . GLU A 1 718 ? 43.154 60.498 -24.309 1.00 50.12 ? 753 GLU A OE2 1 ATOM 5613 N N . GLY A 1 719 ? 38.077 61.828 -26.448 1.00 47.60 ? 754 GLY A N 1 ATOM 5614 C CA . GLY A 1 719 ? 37.718 62.658 -27.583 1.00 51.38 ? 754 GLY A CA 1 ATOM 5615 C C . GLY A 1 719 ? 36.681 62.035 -28.496 1.00 51.67 ? 754 GLY A C 1 ATOM 5616 O O . GLY A 1 719 ? 36.621 62.347 -29.682 1.00 49.03 ? 754 GLY A O 1 ATOM 5617 N N . SER A 1 720 ? 35.859 61.149 -27.946 1.00 42.50 ? 755 SER A N 1 ATOM 5618 C CA . SER A 1 720 ? 34.815 60.492 -28.729 1.00 41.09 ? 755 SER A CA 1 ATOM 5619 C C . SER A 1 720 ? 33.575 60.292 -27.875 1.00 44.54 ? 755 SER A C 1 ATOM 5620 O O . SER A 1 720 ? 33.570 60.633 -26.692 1.00 46.28 ? 755 SER A O 1 ATOM 5621 C CB . SER A 1 720 ? 35.303 59.136 -29.244 1.00 44.17 ? 755 SER A CB 1 ATOM 5622 O OG . SER A 1 720 ? 35.181 58.137 -28.242 1.00 46.37 ? 755 SER A OG 1 ATOM 5623 N N . SER A 1 721 ? 32.524 59.732 -28.461 1.00 38.34 ? 756 SER A N 1 ATOM 5624 C CA . SER A 1 721 ? 31.317 59.452 -27.684 1.00 41.79 ? 756 SER A CA 1 ATOM 5625 C C . SER A 1 721 ? 31.047 57.952 -27.575 1.00 38.22 ? 756 SER A C 1 ATOM 5626 O O . SER A 1 721 ? 29.907 57.523 -27.407 1.00 35.90 ? 756 SER A O 1 ATOM 5627 C CB . SER A 1 721 ? 30.106 60.170 -28.270 1.00 42.10 ? 756 SER A CB 1 ATOM 5628 O OG . SER A 1 721 ? 29.873 59.751 -29.600 1.00 50.40 ? 756 SER A OG 1 ATOM 5629 N N . ILE A 1 722 ? 32.102 57.156 -27.685 1.00 38.28 ? 757 ILE A N 1 ATOM 5630 C CA . ILE A 1 722 ? 31.997 55.723 -27.437 1.00 38.93 ? 757 ILE A CA 1 ATOM 5631 C C . ILE A 1 722 ? 31.971 55.495 -25.920 1.00 40.51 ? 757 ILE A C 1 ATOM 5632 O O . ILE A 1 722 ? 32.977 55.725 -25.248 1.00 36.91 ? 757 ILE A O 1 ATOM 5633 C CB . ILE A 1 722 ? 33.208 54.987 -28.007 1.00 39.19 ? 757 ILE A CB 1 ATOM 5634 C CG1 . ILE A 1 722 ? 33.486 55.431 -29.448 1.00 39.58 ? 757 ILE A CG1 1 ATOM 5635 C CG2 . ILE A 1 722 ? 33.001 53.482 -27.957 1.00 39.45 ? 757 ILE A CG2 1 ATOM 5636 C CD1 . ILE A 1 722 ? 34.812 54.917 -29.966 1.00 35.62 ? 757 ILE A CD1 1 ATOM 5637 N N . PRO A 1 723 ? 30.825 55.045 -25.372 1.00 42.66 ? 758 PRO A N 1 ATOM 5638 C CA . PRO A 1 723 ? 30.744 54.843 -23.918 1.00 38.13 ? 758 PRO A CA 1 ATOM 5639 C C . PRO A 1 723 ? 31.580 53.661 -23.433 1.00 35.89 ? 758 PRO A C 1 ATOM 5640 O O . PRO A 1 723 ? 31.772 52.681 -24.157 1.00 32.52 ? 758 PRO A O 1 ATOM 5641 C CB . PRO A 1 723 ? 29.258 54.565 -23.684 1.00 32.80 ? 758 PRO A CB 1 ATOM 5642 C CG . PRO A 1 723 ? 28.785 53.973 -24.963 1.00 36.58 ? 758 PRO A CG 1 ATOM 5643 C CD . PRO A 1 723 ? 29.559 54.700 -26.043 1.00 40.29 ? 758 PRO A CD 1 ATOM 5644 N N . VAL A 1 724 ? 32.064 53.763 -22.198 1.00 36.37 ? 759 VAL A N 1 ATOM 5645 C CA . VAL A 1 724 ? 32.915 52.734 -21.619 1.00 31.48 ? 759 VAL A CA 1 ATOM 5646 C C . VAL A 1 724 ? 32.113 51.908 -20.611 1.00 31.00 ? 759 VAL A C 1 ATOM 5647 O O . VAL A 1 724 ? 31.605 52.444 -19.631 1.00 29.00 ? 759 VAL A O 1 ATOM 5648 C CB . VAL A 1 724 ? 34.132 53.363 -20.932 1.00 33.80 ? 759 VAL A CB 1 ATOM 5649 C CG1 . VAL A 1 724 ? 34.996 52.288 -20.277 1.00 32.82 ? 759 VAL A CG1 1 ATOM 5650 C CG2 . VAL A 1 724 ? 34.947 54.178 -21.949 1.00 35.10 ? 759 VAL A CG2 1 ATOM 5651 N N . PRO A 1 725 ? 31.960 50.607 -20.881 1.00 30.55 ? 760 PRO A N 1 ATOM 5652 C CA . PRO A 1 725 ? 31.257 49.705 -19.956 1.00 29.36 ? 760 PRO A CA 1 ATOM 5653 C C . PRO A 1 725 ? 31.952 49.635 -18.600 1.00 29.71 ? 760 PRO A C 1 ATOM 5654 O O . PRO A 1 725 ? 33.183 49.723 -18.532 1.00 27.39 ? 760 PRO A O 1 ATOM 5655 C CB . PRO A 1 725 ? 31.362 48.351 -20.658 1.00 27.02 ? 760 PRO A CB 1 ATOM 5656 C CG . PRO A 1 725 ? 31.531 48.696 -22.125 1.00 31.79 ? 760 PRO A CG 1 ATOM 5657 C CD . PRO A 1 725 ? 32.389 49.917 -22.110 1.00 30.25 ? 760 PRO A CD 1 ATOM 5658 N N . THR A 1 726 ? 31.175 49.478 -17.533 1.00 26.56 ? 761 THR A N 1 ATOM 5659 C CA . THR A 1 726 ? 31.768 49.253 -16.214 1.00 26.36 ? 761 THR A CA 1 ATOM 5660 C C . THR A 1 726 ? 32.094 47.781 -16.017 1.00 27.55 ? 761 THR A C 1 ATOM 5661 O O . THR A 1 726 ? 32.956 47.420 -15.207 1.00 25.27 ? 761 THR A O 1 ATOM 5662 C CB . THR A 1 726 ? 30.833 49.708 -15.082 1.00 25.45 ? 761 THR A CB 1 ATOM 5663 O OG1 . THR A 1 726 ? 29.599 48.987 -15.148 1.00 22.49 ? 761 THR A OG1 1 ATOM 5664 C CG2 . THR A 1 726 ? 30.543 51.184 -15.195 1.00 28.50 ? 761 THR A CG2 1 ATOM 5665 N N . HIS A 1 727 ? 31.403 46.930 -16.767 1.00 21.64 ? 762 HIS A N 1 ATOM 5666 C CA . HIS A 1 727 ? 31.585 45.491 -16.665 1.00 24.70 ? 762 HIS A CA 1 ATOM 5667 C C . HIS A 1 727 ? 31.389 44.837 -18.014 1.00 25.99 ? 762 HIS A C 1 ATOM 5668 O O . HIS A 1 727 ? 30.788 45.425 -18.896 1.00 26.29 ? 762 HIS A O 1 ATOM 5669 C CB . HIS A 1 727 ? 30.534 44.896 -15.724 1.00 21.99 ? 762 HIS A CB 1 ATOM 5670 C CG . HIS A 1 727 ? 30.606 45.414 -14.322 1.00 24.46 ? 762 HIS A CG 1 ATOM 5671 N ND1 . HIS A 1 727 ? 30.117 46.653 -13.963 1.00 24.20 ? 762 HIS A ND1 1 ATOM 5672 C CD2 . HIS A 1 727 ? 31.091 44.855 -13.186 1.00 19.19 ? 762 HIS A CD2 1 ATOM 5673 C CE1 . HIS A 1 727 ? 30.310 46.839 -12.668 1.00 25.46 ? 762 HIS A CE1 1 ATOM 5674 N NE2 . HIS A 1 727 ? 30.907 45.766 -12.177 1.00 22.88 ? 762 HIS A NE2 1 ATOM 5675 N N . TYR A 1 728 ? 31.880 43.614 -18.167 1.00 24.04 ? 763 TYR A N 1 ATOM 5676 C CA . TYR A 1 728 ? 31.503 42.799 -19.314 1.00 27.44 ? 763 TYR A CA 1 ATOM 5677 C C . TYR A 1 728 ? 30.962 41.474 -18.824 1.00 29.08 ? 763 TYR A C 1 ATOM 5678 O O . TYR A 1 728 ? 31.552 40.866 -17.937 1.00 25.50 ? 763 TYR A O 1 ATOM 5679 C CB . TYR A 1 728 ? 32.700 42.553 -20.226 1.00 26.25 ? 763 TYR A CB 1 ATOM 5680 C CG . TYR A 1 728 ? 33.068 43.767 -21.061 1.00 28.58 ? 763 TYR A CG 1 ATOM 5681 C CD1 . TYR A 1 728 ? 32.440 44.012 -22.272 1.00 27.22 ? 763 TYR A CD1 1 ATOM 5682 C CD2 . TYR A 1 728 ? 34.052 44.657 -20.636 1.00 26.45 ? 763 TYR A CD2 1 ATOM 5683 C CE1 . TYR A 1 728 ? 32.774 45.114 -23.037 1.00 33.32 ? 763 TYR A CE1 1 ATOM 5684 C CE2 . TYR A 1 728 ? 34.400 45.756 -21.395 1.00 30.67 ? 763 TYR A CE2 1 ATOM 5685 C CZ . TYR A 1 728 ? 33.756 45.979 -22.602 1.00 33.53 ? 763 TYR A CZ 1 ATOM 5686 O OH . TYR A 1 728 ? 34.087 47.075 -23.368 1.00 29.91 ? 763 TYR A OH 1 ATOM 5687 N N . TYR A 1 729 ? 29.860 41.018 -19.411 1.00 26.86 ? 764 TYR A N 1 ATOM 5688 C CA . TYR A 1 729 ? 29.271 39.751 -19.005 1.00 28.10 ? 764 TYR A CA 1 ATOM 5689 C C . TYR A 1 729 ? 29.523 38.651 -20.018 1.00 28.53 ? 764 TYR A C 1 ATOM 5690 O O . TYR A 1 729 ? 29.764 38.915 -21.198 1.00 27.98 ? 764 TYR A O 1 ATOM 5691 C CB . TYR A 1 729 ? 27.753 39.891 -18.765 1.00 21.25 ? 764 TYR A CB 1 ATOM 5692 C CG . TYR A 1 729 ? 26.912 40.064 -20.027 1.00 27.20 ? 764 TYR A CG 1 ATOM 5693 C CD1 . TYR A 1 729 ? 26.436 38.956 -20.735 1.00 24.64 ? 764 TYR A CD1 1 ATOM 5694 C CD2 . TYR A 1 729 ? 26.590 41.329 -20.509 1.00 25.50 ? 764 TYR A CD2 1 ATOM 5695 C CE1 . TYR A 1 729 ? 25.660 39.107 -21.873 1.00 28.78 ? 764 TYR A CE1 1 ATOM 5696 C CE2 . TYR A 1 729 ? 25.816 41.487 -21.660 1.00 28.03 ? 764 TYR A CE2 1 ATOM 5697 C CZ . TYR A 1 729 ? 25.362 40.374 -22.337 1.00 29.82 ? 764 TYR A CZ 1 ATOM 5698 O OH . TYR A 1 729 ? 24.585 40.514 -23.470 1.00 30.68 ? 764 TYR A OH 1 ATOM 5699 N N . SER A 1 730 ? 29.449 37.411 -19.553 1.00 22.73 ? 765 SER A N 1 ATOM 5700 C CA . SER A 1 730 ? 29.348 36.281 -20.461 1.00 28.10 ? 765 SER A CA 1 ATOM 5701 C C . SER A 1 730 ? 28.386 35.255 -19.866 1.00 30.18 ? 765 SER A C 1 ATOM 5702 O O . SER A 1 730 ? 28.402 35.011 -18.664 1.00 22.58 ? 765 SER A O 1 ATOM 5703 C CB . SER A 1 730 ? 30.728 35.671 -20.718 1.00 31.73 ? 765 SER A CB 1 ATOM 5704 O OG . SER A 1 730 ? 30.707 34.841 -21.861 1.00 39.22 ? 765 SER A OG 1 ATOM 5705 N N . ILE A 1 731 ? 27.522 34.688 -20.697 1.00 25.69 ? 766 ILE A N 1 ATOM 5706 C CA . ILE A 1 731 ? 26.581 33.679 -20.232 1.00 22.30 ? 766 ILE A CA 1 ATOM 5707 C C . ILE A 1 731 ? 26.883 32.430 -21.045 1.00 28.50 ? 766 ILE A C 1 ATOM 5708 O O . ILE A 1 731 ? 26.800 32.450 -22.268 1.00 29.42 ? 766 ILE A O 1 ATOM 5709 C CB . ILE A 1 731 ? 25.118 34.092 -20.473 1.00 25.24 ? 766 ILE A CB 1 ATOM 5710 C CG1 . ILE A 1 731 ? 24.737 35.328 -19.648 1.00 25.72 ? 766 ILE A CG1 1 ATOM 5711 C CG2 . ILE A 1 731 ? 24.178 32.941 -20.141 1.00 25.05 ? 766 ILE A CG2 1 ATOM 5712 C CD1 . ILE A 1 731 ? 23.402 35.954 -20.069 1.00 21.25 ? 766 ILE A CD1 1 ATOM 5713 N N . ILE A 1 732 ? 27.259 31.361 -20.361 1.00 24.80 ? 767 ILE A N 1 ATOM 5714 C CA . ILE A 1 732 ? 27.734 30.142 -20.993 1.00 26.03 ? 767 ILE A CA 1 ATOM 5715 C C . ILE A 1 732 ? 26.754 29.005 -20.714 1.00 29.90 ? 767 ILE A C 1 ATOM 5716 O O . ILE A 1 732 ? 26.601 28.575 -19.567 1.00 26.85 ? 767 ILE A O 1 ATOM 5717 C CB . ILE A 1 732 ? 29.129 29.819 -20.463 1.00 28.21 ? 767 ILE A CB 1 ATOM 5718 C CG1 . ILE A 1 732 ? 29.989 31.086 -20.536 1.00 31.22 ? 767 ILE A CG1 1 ATOM 5719 C CG2 . ILE A 1 732 ? 29.783 28.676 -21.247 1.00 30.53 ? 767 ILE A CG2 1 ATOM 5720 C CD1 . ILE A 1 732 ? 31.378 30.894 -20.073 1.00 34.72 ? 767 ILE A CD1 1 ATOM 5721 N N . THR A 1 733 ? 26.104 28.521 -21.772 1.00 24.27 ? 768 THR A N 1 ATOM 5722 C CA . THR A 1 733 ? 25.020 27.539 -21.659 1.00 28.00 ? 768 THR A CA 1 ATOM 5723 C C . THR A 1 733 ? 25.367 26.248 -22.402 1.00 30.69 ? 768 THR A C 1 ATOM 5724 O O . THR A 1 733 ? 25.966 26.290 -23.473 1.00 32.50 ? 768 THR A O 1 ATOM 5725 C CB . THR A 1 733 ? 23.732 28.117 -22.264 1.00 27.19 ? 768 THR A CB 1 ATOM 5726 O OG1 . THR A 1 733 ? 23.506 29.417 -21.723 1.00 27.96 ? 768 THR A OG1 1 ATOM 5727 C CG2 . THR A 1 733 ? 22.523 27.238 -21.973 1.00 26.96 ? 768 THR A CG2 1 ATOM 5728 N N . SER A 1 734 ? 25.002 25.106 -21.829 1.00 28.43 ? 769 SER A N 1 ATOM 5729 C CA . SER A 1 734 ? 25.159 23.826 -22.512 1.00 28.51 ? 769 SER A CA 1 ATOM 5730 C C . SER A 1 734 ? 24.008 22.878 -22.149 1.00 33.29 ? 769 SER A C 1 ATOM 5731 O O . SER A 1 734 ? 23.028 23.282 -21.515 1.00 30.09 ? 769 SER A O 1 ATOM 5732 C CB . SER A 1 734 ? 26.523 23.200 -22.193 1.00 27.59 ? 769 SER A CB 1 ATOM 5733 O OG . SER A 1 734 ? 26.696 22.970 -20.794 1.00 31.93 ? 769 SER A OG 1 ATOM 5734 N N . CYS A 1 735 ? 24.114 21.617 -22.551 1.00 31.34 ? 770 CYS A N 1 ATOM 5735 C CA . CYS A 1 735 ? 23.046 20.674 -22.251 1.00 30.75 ? 770 CYS A CA 1 ATOM 5736 C C . CYS A 1 735 ? 23.316 20.109 -20.868 1.00 30.36 ? 770 CYS A C 1 ATOM 5737 O O . CYS A 1 735 ? 24.457 19.763 -20.567 1.00 32.83 ? 770 CYS A O 1 ATOM 5738 C CB . CYS A 1 735 ? 23.011 19.546 -23.293 1.00 30.93 ? 770 CYS A CB 1 ATOM 5739 S SG . CYS A 1 735 ? 21.490 18.583 -23.273 1.00 33.99 ? 770 CYS A SG 1 ATOM 5740 N N . LEU A 1 736 ? 22.291 20.037 -20.016 1.00 28.66 ? 771 LEU A N 1 ATOM 5741 C CA . LEU A 1 736 ? 22.470 19.442 -18.690 1.00 27.85 ? 771 LEU A CA 1 ATOM 5742 C C . LEU A 1 736 ? 22.921 17.997 -18.866 1.00 28.21 ? 771 LEU A C 1 ATOM 5743 O O . LEU A 1 736 ? 23.811 17.512 -18.173 1.00 29.66 ? 771 LEU A O 1 ATOM 5744 C CB . LEU A 1 736 ? 21.176 19.476 -17.881 1.00 27.04 ? 771 LEU A CB 1 ATOM 5745 C CG . LEU A 1 736 ? 21.355 19.111 -16.404 1.00 31.09 ? 771 LEU A CG 1 ATOM 5746 C CD1 . LEU A 1 736 ? 22.225 20.158 -15.675 1.00 25.16 ? 771 LEU A CD1 1 ATOM 5747 C CD2 . LEU A 1 736 ? 20.004 18.959 -15.735 1.00 32.96 ? 771 LEU A CD2 1 ATOM 5748 N N . ASP A 1 737 ? 22.295 17.321 -19.816 1.00 31.28 ? 772 ASP A N 1 ATOM 5749 C CA . ASP A 1 737 ? 22.780 16.033 -20.270 1.00 34.30 ? 772 ASP A CA 1 ATOM 5750 C C . ASP A 1 737 ? 24.043 16.270 -21.097 1.00 34.06 ? 772 ASP A C 1 ATOM 5751 O O . ASP A 1 737 ? 23.970 16.552 -22.297 1.00 34.05 ? 772 ASP A O 1 ATOM 5752 C CB . ASP A 1 737 ? 21.712 15.339 -21.117 1.00 33.18 ? 772 ASP A CB 1 ATOM 5753 C CG . ASP A 1 737 ? 22.063 13.889 -21.423 1.00 37.44 ? 772 ASP A CG 1 ATOM 5754 O OD1 . ASP A 1 737 ? 23.195 13.459 -21.099 1.00 34.89 ? 772 ASP A OD1 1 ATOM 5755 O OD2 . ASP A 1 737 ? 21.204 13.185 -21.989 1.00 38.76 ? 772 ASP A OD2 1 ATOM 5756 N N . PHE A 1 738 ? 25.206 16.154 -20.463 1.00 30.83 ? 773 PHE A N 1 ATOM 5757 C CA . PHE A 1 738 ? 26.455 16.433 -21.163 1.00 31.68 ? 773 PHE A CA 1 ATOM 5758 C C . PHE A 1 738 ? 26.760 15.454 -22.306 1.00 38.53 ? 773 PHE A C 1 ATOM 5759 O O . PHE A 1 738 ? 27.664 15.708 -23.098 1.00 33.55 ? 773 PHE A O 1 ATOM 5760 C CB . PHE A 1 738 ? 27.639 16.544 -20.191 1.00 31.72 ? 773 PHE A CB 1 ATOM 5761 C CG . PHE A 1 738 ? 27.783 15.372 -19.255 1.00 36.40 ? 773 PHE A CG 1 ATOM 5762 C CD1 . PHE A 1 738 ? 28.436 14.219 -19.664 1.00 38.31 ? 773 PHE A CD1 1 ATOM 5763 C CD2 . PHE A 1 738 ? 27.284 15.433 -17.956 1.00 36.31 ? 773 PHE A CD2 1 ATOM 5764 C CE1 . PHE A 1 738 ? 28.576 13.137 -18.804 1.00 38.53 ? 773 PHE A CE1 1 ATOM 5765 C CE2 . PHE A 1 738 ? 27.426 14.364 -17.084 1.00 36.45 ? 773 PHE A CE2 1 ATOM 5766 C CZ . PHE A 1 738 ? 28.073 13.205 -17.507 1.00 30.23 ? 773 PHE A CZ 1 ATOM 5767 N N . THR A 1 739 ? 26.010 14.354 -22.408 1.00 36.47 ? 774 THR A N 1 ATOM 5768 C CA . THR A 1 739 ? 26.221 13.429 -23.523 1.00 39.17 ? 774 THR A CA 1 ATOM 5769 C C . THR A 1 739 ? 25.643 13.970 -24.829 1.00 42.81 ? 774 THR A C 1 ATOM 5770 O O . THR A 1 739 ? 25.931 13.447 -25.906 1.00 42.55 ? 774 THR A O 1 ATOM 5771 C CB . THR A 1 739 ? 25.662 12.008 -23.263 1.00 37.89 ? 774 THR A CB 1 ATOM 5772 O OG1 . THR A 1 739 ? 24.233 12.015 -23.353 1.00 40.54 ? 774 THR A OG1 1 ATOM 5773 C CG2 . THR A 1 739 ? 26.089 11.490 -21.903 1.00 41.52 ? 774 THR A CG2 1 ATOM 5774 N N . GLN A 1 740 ? 24.822 15.011 -24.738 1.00 37.67 ? 775 GLN A N 1 ATOM 5775 C CA . GLN A 1 740 ? 24.327 15.672 -25.940 1.00 33.08 ? 775 GLN A CA 1 ATOM 5776 C C . GLN A 1 740 ? 25.070 16.976 -26.190 1.00 38.82 ? 775 GLN A C 1 ATOM 5777 O O . GLN A 1 740 ? 25.279 17.766 -25.265 1.00 37.42 ? 775 GLN A O 1 ATOM 5778 C CB . GLN A 1 740 ? 22.831 15.947 -25.837 1.00 35.20 ? 775 GLN A CB 1 ATOM 5779 C CG . GLN A 1 740 ? 22.007 14.746 -25.449 1.00 38.62 ? 775 GLN A CG 1 ATOM 5780 C CD . GLN A 1 740 ? 20.540 14.980 -25.682 1.00 47.09 ? 775 GLN A CD 1 ATOM 5781 O OE1 . GLN A 1 740 ? 20.050 16.103 -25.554 1.00 47.72 ? 775 GLN A OE1 1 ATOM 5782 N NE2 . GLN A 1 740 ? 19.826 13.926 -26.054 1.00 57.22 ? 775 GLN A NE2 1 ATOM 5783 N N . PRO A 1 741 ? 25.482 17.207 -27.445 1.00 39.07 ? 776 PRO A N 1 ATOM 5784 C CA . PRO A 1 741 ? 26.134 18.469 -27.789 1.00 38.52 ? 776 PRO A CA 1 ATOM 5785 C C . PRO A 1 741 ? 25.217 19.644 -27.466 1.00 40.39 ? 776 PRO A C 1 ATOM 5786 O O . PRO A 1 741 ? 23.991 19.500 -27.496 1.00 37.73 ? 776 PRO A O 1 ATOM 5787 C CB . PRO A 1 741 ? 26.355 18.353 -29.304 1.00 44.38 ? 776 PRO A CB 1 ATOM 5788 C CG . PRO A 1 741 ? 25.396 17.305 -29.758 1.00 47.28 ? 776 PRO A CG 1 ATOM 5789 C CD . PRO A 1 741 ? 25.306 16.339 -28.622 1.00 45.06 ? 776 PRO A CD 1 ATOM 5790 N N . ALA A 1 742 ? 25.815 20.784 -27.145 1.00 36.57 ? 777 ALA A N 1 ATOM 5791 C CA . ALA A 1 742 ? 25.058 21.963 -26.753 1.00 36.96 ? 777 ALA A CA 1 ATOM 5792 C C . ALA A 1 742 ? 24.035 22.385 -27.812 1.00 41.09 ? 777 ALA A C 1 ATOM 5793 O O . ALA A 1 742 ? 22.926 22.814 -27.480 1.00 36.15 ? 777 ALA A O 1 ATOM 5794 C CB . ALA A 1 742 ? 26.015 23.117 -26.427 1.00 30.27 ? 777 ALA A CB 1 ATOM 5795 N N . ASP A 1 743 ? 24.399 22.240 -29.086 1.00 40.85 ? 778 ASP A N 1 ATOM 5796 C CA . ASP A 1 743 ? 23.538 22.700 -30.180 1.00 41.29 ? 778 ASP A CA 1 ATOM 5797 C C . ASP A 1 743 ? 22.414 21.720 -30.530 1.00 45.36 ? 778 ASP A C 1 ATOM 5798 O O . ASP A 1 743 ? 21.515 22.044 -31.305 1.00 52.05 ? 778 ASP A O 1 ATOM 5799 C CB . ASP A 1 743 ? 24.365 23.057 -31.429 1.00 48.03 ? 778 ASP A CB 1 ATOM 5800 C CG . ASP A 1 743 ? 25.071 21.852 -32.046 1.00 52.39 ? 778 ASP A CG 1 ATOM 5801 O OD1 . ASP A 1 743 ? 25.365 20.877 -31.323 1.00 48.65 ? 778 ASP A OD1 1 ATOM 5802 O OD2 . ASP A 1 743 ? 25.348 21.890 -33.267 1.00 60.23 ? 778 ASP A OD2 1 ATOM 5803 N N . LYS A 1 744 ? 22.464 20.526 -29.952 1.00 47.22 ? 779 LYS A N 1 ATOM 5804 C CA . LYS A 1 744 ? 21.425 19.528 -30.184 1.00 47.82 ? 779 LYS A CA 1 ATOM 5805 C C . LYS A 1 744 ? 20.919 18.987 -28.856 1.00 44.38 ? 779 LYS A C 1 ATOM 5806 O O . LYS A 1 744 ? 20.898 17.779 -28.640 1.00 45.77 ? 779 LYS A O 1 ATOM 5807 C CB . LYS A 1 744 ? 21.966 18.374 -31.039 1.00 50.48 ? 779 LYS A CB 1 ATOM 5808 C CG . LYS A 1 744 ? 22.667 18.815 -32.317 1.00 56.20 ? 779 LYS A CG 1 ATOM 5809 C CD . LYS A 1 744 ? 23.343 17.642 -33.018 1.00 55.60 ? 779 LYS A CD 1 ATOM 5810 C CE . LYS A 1 744 ? 24.293 18.123 -34.110 1.00 69.20 ? 779 LYS A CE 1 ATOM 5811 N NZ . LYS A 1 744 ? 23.628 19.019 -35.106 1.00 56.80 ? 779 LYS A NZ 1 ATOM 5812 N N . CYS A 1 745 ? 20.520 19.881 -27.957 1.00 47.54 ? 780 CYS A N 1 ATOM 5813 C CA . CYS A 1 745 ? 20.090 19.456 -26.627 1.00 40.99 ? 780 CYS A CA 1 ATOM 5814 C C . CYS A 1 745 ? 18.582 19.222 -26.553 1.00 35.85 ? 780 CYS A C 1 ATOM 5815 O O . CYS A 1 745 ? 17.789 20.071 -26.939 1.00 42.79 ? 780 CYS A O 1 ATOM 5816 C CB . CYS A 1 745 ? 20.538 20.464 -25.558 1.00 38.85 ? 780 CYS A CB 1 ATOM 5817 S SG . CYS A 1 745 ? 20.117 19.961 -23.862 1.00 40.38 ? 780 CYS A SG 1 ATOM 5818 N N . ASP A 1 746 ? 18.198 18.058 -26.048 1.00 37.35 ? 781 ASP A N 1 ATOM 5819 C CA . ASP A 1 746 ? 16.787 17.694 -25.958 1.00 45.45 ? 781 ASP A CA 1 ATOM 5820 C C . ASP A 1 746 ? 16.057 18.237 -24.729 1.00 46.76 ? 781 ASP A C 1 ATOM 5821 O O . ASP A 1 746 ? 14.882 18.588 -24.820 1.00 52.33 ? 781 ASP A O 1 ATOM 5822 C CB . ASP A 1 746 ? 16.623 16.175 -25.987 1.00 48.90 ? 781 ASP A CB 1 ATOM 5823 C CG . ASP A 1 746 ? 16.605 15.623 -27.388 1.00 57.04 ? 781 ASP A CG 1 ATOM 5824 O OD1 . ASP A 1 746 ? 16.256 16.384 -28.317 1.00 57.83 ? 781 ASP A OD1 1 ATOM 5825 O OD2 . ASP A 1 746 ? 16.933 14.428 -27.557 1.00 59.39 ? 781 ASP A OD2 1 ATOM 5826 N N . GLY A 1 747 ? 16.740 18.291 -23.585 1.00 40.87 ? 782 GLY A N 1 ATOM 5827 C CA . GLY A 1 747 ? 16.084 18.596 -22.323 1.00 36.00 ? 782 GLY A CA 1 ATOM 5828 C C . GLY A 1 747 ? 16.606 19.830 -21.602 1.00 36.33 ? 782 GLY A C 1 ATOM 5829 O O . GLY A 1 747 ? 16.884 20.853 -22.238 1.00 33.49 ? 782 GLY A O 1 ATOM 5830 N N . PRO A 1 748 ? 16.748 19.736 -20.267 1.00 37.96 ? 783 PRO A N 1 ATOM 5831 C CA . PRO A 1 748 ? 17.164 20.861 -19.418 1.00 34.83 ? 783 PRO A CA 1 ATOM 5832 C C . PRO A 1 748 ? 18.569 21.355 -19.743 1.00 34.07 ? 783 PRO A C 1 ATOM 5833 O O . PRO A 1 748 ? 19.406 20.595 -20.237 1.00 29.81 ? 783 PRO A O 1 ATOM 5834 C CB . PRO A 1 748 ? 17.123 20.274 -18.002 1.00 33.51 ? 783 PRO A CB 1 ATOM 5835 C CG . PRO A 1 748 ? 16.196 19.104 -18.098 1.00 41.69 ? 783 PRO A CG 1 ATOM 5836 C CD . PRO A 1 748 ? 16.411 18.543 -19.472 1.00 34.52 ? 783 PRO A CD 1 ATOM 5837 N N . LEU A 1 749 ? 18.801 22.636 -19.465 1.00 31.79 ? 784 LEU A N 1 ATOM 5838 C CA . LEU A 1 749 ? 20.048 23.306 -19.784 1.00 25.06 ? 784 LEU A CA 1 ATOM 5839 C C . LEU A 1 749 ? 20.949 23.403 -18.568 1.00 26.12 ? 784 LEU A C 1 ATOM 5840 O O . LEU A 1 749 ? 20.498 23.228 -17.443 1.00 25.43 ? 784 LEU A O 1 ATOM 5841 C CB . LEU A 1 749 ? 19.763 24.716 -20.309 1.00 26.09 ? 784 LEU A CB 1 ATOM 5842 C CG . LEU A 1 749 ? 18.892 24.792 -21.567 1.00 31.52 ? 784 LEU A CG 1 ATOM 5843 C CD1 . LEU A 1 749 ? 18.583 26.221 -21.940 1.00 30.34 ? 784 LEU A CD1 1 ATOM 5844 C CD2 . LEU A 1 749 ? 19.596 24.088 -22.712 1.00 30.41 ? 784 LEU A CD2 1 ATOM 5845 N N . SER A 1 750 ? 22.219 23.685 -18.810 1.00 28.68 ? 785 SER A N 1 ATOM 5846 C CA . SER A 1 750 ? 23.183 23.941 -17.753 1.00 28.14 ? 785 SER A CA 1 ATOM 5847 C C . SER A 1 750 ? 23.799 25.298 -18.050 1.00 28.99 ? 785 SER A C 1 ATOM 5848 O O . SER A 1 750 ? 24.151 25.569 -19.199 1.00 26.76 ? 785 SER A O 1 ATOM 5849 C CB . SER A 1 750 ? 24.248 22.844 -17.739 1.00 30.13 ? 785 SER A CB 1 ATOM 5850 O OG . SER A 1 750 ? 25.272 23.102 -16.793 1.00 32.90 ? 785 SER A OG 1 ATOM 5851 N N . VAL A 1 751 ? 23.908 26.165 -17.042 1.00 22.99 ? 786 VAL A N 1 ATOM 5852 C CA . VAL A 1 751 ? 24.381 27.527 -17.291 1.00 22.52 ? 786 VAL A CA 1 ATOM 5853 C C . VAL A 1 751 ? 25.405 27.987 -16.246 1.00 24.76 ? 786 VAL A C 1 ATOM 5854 O O . VAL A 1 751 ? 25.329 27.607 -15.085 1.00 25.40 ? 786 VAL A O 1 ATOM 5855 C CB . VAL A 1 751 ? 23.205 28.548 -17.342 1.00 24.53 ? 786 VAL A CB 1 ATOM 5856 C CG1 . VAL A 1 751 ? 22.541 28.699 -15.948 1.00 26.25 ? 786 VAL A CG1 1 ATOM 5857 C CG2 . VAL A 1 751 ? 23.683 29.904 -17.871 1.00 24.65 ? 786 VAL A CG2 1 ATOM 5858 N N . SER A 1 752 ? 26.397 28.745 -16.691 1.00 23.73 ? 787 SER A N 1 ATOM 5859 C CA . SER A 1 752 ? 27.221 29.524 -15.782 1.00 24.70 ? 787 SER A CA 1 ATOM 5860 C C . SER A 1 752 ? 27.484 30.878 -16.428 1.00 25.76 ? 787 SER A C 1 ATOM 5861 O O . SER A 1 752 ? 27.530 30.994 -17.661 1.00 29.49 ? 787 SER A O 1 ATOM 5862 C CB . SER A 1 752 ? 28.514 28.804 -15.401 1.00 28.32 ? 787 SER A CB 1 ATOM 5863 O OG . SER A 1 752 ? 29.329 28.515 -16.519 1.00 29.59 ? 787 SER A OG 1 ATOM 5864 N N . SER A 1 753 ? 27.627 31.908 -15.604 1.00 22.61 ? 788 SER A N 1 ATOM 5865 C CA . SER A 1 753 ? 27.787 33.270 -16.113 1.00 24.02 ? 788 SER A CA 1 ATOM 5866 C C . SER A 1 753 ? 28.720 34.068 -15.235 1.00 24.51 ? 788 SER A C 1 ATOM 5867 O O . SER A 1 753 ? 29.001 33.674 -14.109 1.00 23.11 ? 788 SER A O 1 ATOM 5868 C CB . SER A 1 753 ? 26.451 34.018 -16.179 1.00 23.28 ? 788 SER A CB 1 ATOM 5869 O OG . SER A 1 753 ? 25.438 33.232 -16.758 1.00 32.33 ? 788 SER A OG 1 ATOM 5870 N N . PHE A 1 754 ? 29.164 35.207 -15.758 1.00 22.21 ? 789 PHE A N 1 ATOM 5871 C CA . PHE A 1 754 ? 30.088 36.080 -15.061 1.00 25.75 ? 789 PHE A CA 1 ATOM 5872 C C . PHE A 1 754 ? 29.741 37.516 -15.377 1.00 26.43 ? 789 PHE A C 1 ATOM 5873 O O . PHE A 1 754 ? 29.224 37.814 -16.456 1.00 23.70 ? 789 PHE A O 1 ATOM 5874 C CB . PHE A 1 754 ? 31.530 35.835 -15.541 1.00 29.31 ? 789 PHE A CB 1 ATOM 5875 C CG . PHE A 1 754 ? 31.938 34.393 -15.547 1.00 34.47 ? 789 PHE A CG 1 ATOM 5876 C CD1 . PHE A 1 754 ? 32.390 33.784 -14.388 1.00 34.17 ? 789 PHE A CD1 1 ATOM 5877 C CD2 . PHE A 1 754 ? 31.892 33.653 -16.717 1.00 34.47 ? 789 PHE A CD2 1 ATOM 5878 C CE1 . PHE A 1 754 ? 32.778 32.451 -14.385 1.00 35.30 ? 789 PHE A CE1 1 ATOM 5879 C CE2 . PHE A 1 754 ? 32.267 32.309 -16.721 1.00 45.84 ? 789 PHE A CE2 1 ATOM 5880 C CZ . PHE A 1 754 ? 32.714 31.712 -15.552 1.00 44.65 ? 789 PHE A CZ 1 ATOM 5881 N N . ILE A 1 755 ? 30.043 38.407 -14.439 1.00 21.75 ? 790 ILE A N 1 ATOM 5882 C CA . ILE A 1 755 ? 30.003 39.838 -14.700 1.00 21.10 ? 790 ILE A CA 1 ATOM 5883 C C . ILE A 1 755 ? 31.365 40.379 -14.258 1.00 25.73 ? 790 ILE A C 1 ATOM 5884 O O . ILE A 1 755 ? 31.599 40.585 -13.071 1.00 21.42 ? 790 ILE A O 1 ATOM 5885 C CB . ILE A 1 755 ? 28.848 40.543 -13.944 1.00 20.64 ? 790 ILE A CB 1 ATOM 5886 C CG1 . ILE A 1 755 ? 27.498 39.987 -14.400 1.00 22.97 ? 790 ILE A CG1 1 ATOM 5887 C CG2 . ILE A 1 755 ? 28.890 42.050 -14.181 1.00 20.95 ? 790 ILE A CG2 1 ATOM 5888 C CD1 . ILE A 1 755 ? 26.331 40.309 -13.473 1.00 23.23 ? 790 ILE A CD1 1 ATOM 5889 N N . LEU A 1 756 ? 32.279 40.542 -15.216 1.00 20.92 ? 791 LEU A N 1 ATOM 5890 C CA . LEU A 1 756 ? 33.652 40.926 -14.900 1.00 22.93 ? 791 LEU A CA 1 ATOM 5891 C C . LEU A 1 756 ? 33.775 42.439 -14.804 1.00 24.28 ? 791 LEU A C 1 ATOM 5892 O O . LEU A 1 756 ? 33.277 43.157 -15.662 1.00 24.07 ? 791 LEU A O 1 ATOM 5893 C CB . LEU A 1 756 ? 34.616 40.384 -15.956 1.00 25.02 ? 791 LEU A CB 1 ATOM 5894 C CG . LEU A 1 756 ? 34.512 38.880 -16.219 1.00 30.76 ? 791 LEU A CG 1 ATOM 5895 C CD1 . LEU A 1 756 ? 35.466 38.450 -17.333 1.00 27.17 ? 791 LEU A CD1 1 ATOM 5896 C CD2 . LEU A 1 756 ? 34.775 38.078 -14.947 1.00 27.45 ? 791 LEU A CD2 1 ATOM 5897 N N . PRO A 1 757 ? 34.429 42.925 -13.745 1.00 24.47 ? 792 PRO A N 1 ATOM 5898 C CA . PRO A 1 757 ? 34.607 44.371 -13.575 1.00 23.07 ? 792 PRO A CA 1 ATOM 5899 C C . PRO A 1 757 ? 35.589 44.909 -14.609 1.00 22.71 ? 792 PRO A C 1 ATOM 5900 O O . PRO A 1 757 ? 36.637 44.322 -14.838 1.00 23.41 ? 792 PRO A O 1 ATOM 5901 C CB . PRO A 1 757 ? 35.187 44.493 -12.156 1.00 25.53 ? 792 PRO A CB 1 ATOM 5902 C CG . PRO A 1 757 ? 35.849 43.169 -11.912 1.00 30.47 ? 792 PRO A CG 1 ATOM 5903 C CD . PRO A 1 757 ? 35.038 42.147 -12.649 1.00 24.04 ? 792 PRO A CD 1 ATOM 5904 N N . HIS A 1 758 ? 35.247 46.024 -15.230 1.00 25.53 ? 793 HIS A N 1 ATOM 5905 C CA . HIS A 1 758 ? 36.129 46.601 -16.236 1.00 25.41 ? 793 HIS A CA 1 ATOM 5906 C C . HIS A 1 758 ? 37.004 47.638 -15.561 1.00 24.41 ? 793 HIS A C 1 ATOM 5907 O O . HIS A 1 758 ? 36.591 48.786 -15.394 1.00 26.64 ? 793 HIS A O 1 ATOM 5908 C CB . HIS A 1 758 ? 35.325 47.251 -17.341 1.00 27.14 ? 793 HIS A CB 1 ATOM 5909 C CG . HIS A 1 758 ? 36.176 47.782 -18.449 1.00 22.84 ? 793 HIS A CG 1 ATOM 5910 N ND1 . HIS A 1 758 ? 35.776 48.809 -19.271 1.00 26.45 ? 793 HIS A ND1 1 ATOM 5911 C CD2 . HIS A 1 758 ? 37.419 47.431 -18.856 1.00 29.20 ? 793 HIS A CD2 1 ATOM 5912 C CE1 . HIS A 1 758 ? 36.735 49.065 -20.145 1.00 25.29 ? 793 HIS A CE1 1 ATOM 5913 N NE2 . HIS A 1 758 ? 37.739 48.237 -19.920 1.00 26.52 ? 793 HIS A NE2 1 ATOM 5914 N N . ARG A 1 759 ? 38.192 47.221 -15.144 1.00 24.10 ? 794 ARG A N 1 ATOM 5915 C CA . ARG A 1 759 ? 39.051 48.092 -14.355 1.00 24.28 ? 794 ARG A CA 1 ATOM 5916 C C . ARG A 1 759 ? 40.389 48.366 -15.045 1.00 25.28 ? 794 ARG A C 1 ATOM 5917 O O . ARG A 1 759 ? 40.895 47.532 -15.795 1.00 29.26 ? 794 ARG A O 1 ATOM 5918 C CB . ARG A 1 759 ? 39.260 47.497 -12.961 1.00 25.16 ? 794 ARG A CB 1 ATOM 5919 C CG . ARG A 1 759 ? 37.960 47.448 -12.160 1.00 23.46 ? 794 ARG A CG 1 ATOM 5920 C CD . ARG A 1 759 ? 38.154 46.785 -10.812 1.00 23.02 ? 794 ARG A CD 1 ATOM 5921 N NE . ARG A 1 759 ? 39.237 47.394 -10.053 1.00 24.83 ? 794 ARG A NE 1 ATOM 5922 C CZ . ARG A 1 759 ? 39.531 47.069 -8.800 1.00 27.97 ? 794 ARG A CZ 1 ATOM 5923 N NH1 . ARG A 1 759 ? 38.801 46.152 -8.165 1.00 25.44 ? 794 ARG A NH1 1 ATOM 5924 N NH2 . ARG A 1 759 ? 40.551 47.665 -8.182 1.00 24.12 ? 794 ARG A NH2 1 ATOM 5925 N N . PRO A 1 760 ? 40.961 49.547 -14.790 1.00 27.23 ? 795 PRO A N 1 ATOM 5926 C CA . PRO A 1 760 ? 42.223 49.951 -15.431 1.00 25.04 ? 795 PRO A CA 1 ATOM 5927 C C . PRO A 1 760 ? 43.465 49.280 -14.842 1.00 30.97 ? 795 PRO A C 1 ATOM 5928 O O . PRO A 1 760 ? 44.559 49.488 -15.357 1.00 28.18 ? 795 PRO A O 1 ATOM 5929 C CB . PRO A 1 760 ? 42.261 51.468 -15.183 1.00 29.54 ? 795 PRO A CB 1 ATOM 5930 C CG . PRO A 1 760 ? 41.443 51.652 -13.927 1.00 34.25 ? 795 PRO A CG 1 ATOM 5931 C CD . PRO A 1 760 ? 40.335 50.653 -14.042 1.00 26.85 ? 795 PRO A CD 1 ATOM 5932 N N . ASP A 1 761 ? 43.306 48.494 -13.778 1.00 27.00 ? 796 ASP A N 1 ATOM 5933 C CA . ASP A 1 761 ? 44.424 47.736 -13.227 1.00 27.54 ? 796 ASP A CA 1 ATOM 5934 C C . ASP A 1 761 ? 43.944 46.374 -12.734 1.00 26.28 ? 796 ASP A C 1 ATOM 5935 O O . ASP A 1 761 ? 42.741 46.132 -12.665 1.00 24.92 ? 796 ASP A O 1 ATOM 5936 C CB . ASP A 1 761 ? 45.060 48.493 -12.063 1.00 29.37 ? 796 ASP A CB 1 ATOM 5937 C CG . ASP A 1 761 ? 44.060 48.840 -10.990 1.00 30.26 ? 796 ASP A CG 1 ATOM 5938 O OD1 . ASP A 1 761 ? 43.616 47.914 -10.276 1.00 27.08 ? 796 ASP A OD1 1 ATOM 5939 O OD2 . ASP A 1 761 ? 43.708 50.033 -10.863 1.00 34.96 ? 796 ASP A OD2 1 ATOM 5940 N N . ASN A 1 762 ? 44.888 45.506 -12.376 1.00 23.14 ? 797 ASN A N 1 ATOM 5941 C CA . ASN A 1 762 ? 44.558 44.225 -11.751 1.00 29.05 ? 797 ASN A CA 1 ATOM 5942 C C . ASN A 1 762 ? 44.931 44.154 -10.262 1.00 24.03 ? 797 ASN A C 1 ATOM 5943 O O . ASN A 1 762 ? 45.370 43.113 -9.770 1.00 22.01 ? 797 ASN A O 1 ATOM 5944 C CB . ASN A 1 762 ? 45.179 43.065 -12.517 1.00 27.23 ? 797 ASN A CB 1 ATOM 5945 C CG . ASN A 1 762 ? 44.438 42.764 -13.818 1.00 28.28 ? 797 ASN A CG 1 ATOM 5946 O OD1 . ASN A 1 762 ? 43.321 42.234 -13.804 1.00 30.55 ? 797 ASN A OD1 1 ATOM 5947 N ND2 . ASN A 1 762 ? 45.052 43.115 -14.952 1.00 32.39 ? 797 ASN A ND2 1 ATOM 5948 N N . ASP A 1 763 ? 44.730 45.259 -9.551 1.00 22.97 ? 798 ASP A N 1 ATOM 5949 C CA . ASP A 1 763 ? 45.069 45.327 -8.136 1.00 25.21 ? 798 ASP A CA 1 ATOM 5950 C C . ASP A 1 763 ? 44.268 44.318 -7.321 1.00 21.19 ? 798 ASP A C 1 ATOM 5951 O O . ASP A 1 763 ? 44.720 43.881 -6.283 1.00 22.16 ? 798 ASP A O 1 ATOM 5952 C CB . ASP A 1 763 ? 44.853 46.726 -7.576 1.00 27.21 ? 798 ASP A CB 1 ATOM 5953 C CG . ASP A 1 763 ? 45.843 47.721 -8.128 1.00 35.27 ? 798 ASP A CG 1 ATOM 5954 O OD1 . ASP A 1 763 ? 46.777 47.289 -8.841 1.00 32.53 ? 798 ASP A OD1 1 ATOM 5955 O OD2 . ASP A 1 763 ? 45.689 48.921 -7.839 1.00 34.27 ? 798 ASP A OD2 1 ATOM 5956 N N . GLU A 1 764 ? 43.084 43.972 -7.814 1.00 23.84 ? 799 GLU A N 1 ATOM 5957 C CA . GLU A 1 764 ? 42.200 43.026 -7.140 1.00 20.94 ? 799 GLU A CA 1 ATOM 5958 C C . GLU A 1 764 ? 42.856 41.640 -7.098 1.00 23.64 ? 799 GLU A C 1 ATOM 5959 O O . GLU A 1 764 ? 42.687 40.867 -6.147 1.00 21.08 ? 799 GLU A O 1 ATOM 5960 C CB . GLU A 1 764 ? 40.855 42.939 -7.883 1.00 18.58 ? 799 GLU A CB 1 ATOM 5961 C CG . GLU A 1 764 ? 39.851 42.041 -7.140 1.00 21.10 ? 799 GLU A CG 1 ATOM 5962 C CD . GLU A 1 764 ? 38.510 41.857 -7.850 1.00 25.76 ? 799 GLU A CD 1 ATOM 5963 O OE1 . GLU A 1 764 ? 38.282 42.455 -8.929 1.00 21.74 ? 799 GLU A OE1 1 ATOM 5964 O OE2 . GLU A 1 764 ? 37.673 41.090 -7.320 1.00 22.68 ? 799 GLU A OE2 1 ATOM 5965 N N . SER A 1 765 ? 43.624 41.328 -8.137 1.00 23.68 ? 800 SER A N 1 ATOM 5966 C CA . SER A 1 765 ? 44.279 40.027 -8.243 1.00 23.24 ? 800 SER A CA 1 ATOM 5967 C C . SER A 1 765 ? 45.731 40.121 -7.786 1.00 24.81 ? 800 SER A C 1 ATOM 5968 O O . SER A 1 765 ? 46.596 40.592 -8.533 1.00 27.86 ? 800 SER A O 1 ATOM 5969 C CB . SER A 1 765 ? 44.231 39.548 -9.692 1.00 24.19 ? 800 SER A CB 1 ATOM 5970 O OG . SER A 1 765 ? 42.886 39.363 -10.115 1.00 24.26 ? 800 SER A OG 1 ATOM 5971 N N . CYS A 1 766 ? 46.005 39.665 -6.572 1.00 24.10 ? 801 CYS A N 1 ATOM 5972 C CA . CYS A 1 766 ? 47.335 39.835 -5.974 1.00 24.26 ? 801 CYS A CA 1 ATOM 5973 C C . CYS A 1 766 ? 48.465 39.136 -6.736 1.00 30.02 ? 801 CYS A C 1 ATOM 5974 O O . CYS A 1 766 ? 49.624 39.536 -6.629 1.00 29.63 ? 801 CYS A O 1 ATOM 5975 C CB . CYS A 1 766 ? 47.338 39.423 -4.501 1.00 28.55 ? 801 CYS A CB 1 ATOM 5976 S SG . CYS A 1 766 ? 46.381 40.563 -3.482 1.00 25.82 ? 801 CYS A SG 1 ATOM 5977 N N . ASN A 1 767 ? 48.114 38.120 -7.513 1.00 27.73 ? 802 ASN A N 1 ATOM 5978 C CA . ASN A 1 767 ? 49.091 37.336 -8.270 1.00 29.50 ? 802 ASN A CA 1 ATOM 5979 C C . ASN A 1 767 ? 49.109 37.682 -9.758 1.00 31.01 ? 802 ASN A C 1 ATOM 5980 O O . ASN A 1 767 ? 49.576 36.897 -10.578 1.00 34.49 ? 802 ASN A O 1 ATOM 5981 C CB . ASN A 1 767 ? 48.805 35.842 -8.100 1.00 35.64 ? 802 ASN A CB 1 ATOM 5982 C CG . ASN A 1 767 ? 49.112 35.350 -6.706 1.00 40.64 ? 802 ASN A CG 1 ATOM 5983 O OD1 . ASN A 1 767 ? 50.094 35.770 -6.097 1.00 45.75 ? 802 ASN A OD1 1 ATOM 5984 N ND2 . ASN A 1 767 ? 48.269 34.461 -6.185 1.00 41.96 ? 802 ASN A ND2 1 ATOM 5985 N N . SER A 1 768 ? 48.619 38.866 -10.101 1.00 25.53 ? 803 SER A N 1 ATOM 5986 C CA . SER A 1 768 ? 48.433 39.241 -11.499 1.00 29.54 ? 803 SER A CA 1 ATOM 5987 C C . SER A 1 768 ? 49.759 39.480 -12.229 1.00 34.72 ? 803 SER A C 1 ATOM 5988 O O . SER A 1 768 ? 49.786 39.569 -13.456 1.00 38.29 ? 803 SER A O 1 ATOM 5989 C CB . SER A 1 768 ? 47.508 40.462 -11.631 1.00 26.05 ? 803 SER A CB 1 ATOM 5990 O OG . SER A 1 768 ? 48.054 41.639 -11.042 1.00 34.15 ? 803 SER A OG 1 ATOM 5991 N N . SER A 1 769 ? 50.856 39.564 -11.483 1.00 33.70 ? 804 SER A N 1 ATOM 5992 C CA . SER A 1 769 ? 52.155 39.751 -12.115 1.00 38.18 ? 804 SER A CA 1 ATOM 5993 C C . SER A 1 769 ? 52.555 38.469 -12.832 1.00 40.30 ? 804 SER A C 1 ATOM 5994 O O . SER A 1 769 ? 53.328 38.495 -13.793 1.00 42.48 ? 804 SER A O 1 ATOM 5995 C CB . SER A 1 769 ? 53.217 40.141 -11.084 1.00 36.95 ? 804 SER A CB 1 ATOM 5996 O OG . SER A 1 769 ? 53.552 39.031 -10.273 1.00 41.66 ? 804 SER A OG 1 ATOM 5997 N N . GLU A 1 770 ? 52.009 37.349 -12.367 1.00 32.58 ? 805 GLU A N 1 ATOM 5998 C CA . GLU A 1 770 ? 52.320 36.040 -12.919 1.00 36.87 ? 805 GLU A CA 1 ATOM 5999 C C . GLU A 1 770 ? 51.547 35.772 -14.201 1.00 35.16 ? 805 GLU A C 1 ATOM 6000 O O . GLU A 1 770 ? 50.778 36.614 -14.647 1.00 37.49 ? 805 GLU A O 1 ATOM 6001 C CB . GLU A 1 770 ? 52.022 34.959 -11.885 1.00 34.92 ? 805 GLU A CB 1 ATOM 6002 C CG . GLU A 1 770 ? 52.786 35.157 -10.585 1.00 37.06 ? 805 GLU A CG 1 ATOM 6003 C CD . GLU A 1 770 ? 52.506 34.081 -9.550 1.00 51.29 ? 805 GLU A CD 1 ATOM 6004 O OE1 . GLU A 1 770 ? 52.197 32.934 -9.939 1.00 60.33 ? 805 GLU A OE1 1 ATOM 6005 O OE2 . GLU A 1 770 ? 52.594 34.388 -8.341 1.00 57.82 ? 805 GLU A OE2 1 ATOM 6006 N N . ASP A 1 771 ? 51.743 34.589 -14.784 1.00 39.47 ? 806 ASP A N 1 ATOM 6007 C CA . ASP A 1 771 ? 51.019 34.203 -15.996 1.00 41.68 ? 806 ASP A CA 1 ATOM 6008 C C . ASP A 1 771 ? 49.527 34.138 -15.691 1.00 41.20 ? 806 ASP A C 1 ATOM 6009 O O . ASP A 1 771 ? 49.142 33.819 -14.567 1.00 37.33 ? 806 ASP A O 1 ATOM 6010 C CB . ASP A 1 771 ? 51.503 32.841 -16.509 1.00 45.92 ? 806 ASP A CB 1 ATOM 6011 C CG . ASP A 1 771 ? 50.940 32.491 -17.878 1.00 45.60 ? 806 ASP A CG 1 ATOM 6012 O OD1 . ASP A 1 771 ? 51.078 33.301 -18.820 1.00 47.68 ? 806 ASP A OD1 1 ATOM 6013 O OD2 . ASP A 1 771 ? 50.349 31.400 -18.011 1.00 54.22 ? 806 ASP A OD2 1 ATOM 6014 N N . GLU A 1 772 ? 48.708 34.441 -16.696 1.00 37.01 ? 807 GLU A N 1 ATOM 6015 C CA . GLU A 1 772 ? 47.256 34.471 -16.561 1.00 37.91 ? 807 GLU A CA 1 ATOM 6016 C C . GLU A 1 772 ? 46.681 33.139 -16.084 1.00 39.43 ? 807 GLU A C 1 ATOM 6017 O O . GLU A 1 772 ? 45.626 33.104 -15.450 1.00 39.68 ? 807 GLU A O 1 ATOM 6018 C CB . GLU A 1 772 ? 46.605 34.884 -17.883 1.00 33.19 ? 807 GLU A CB 1 ATOM 6019 C CG . GLU A 1 772 ? 46.645 36.376 -18.172 1.00 37.00 ? 807 GLU A CG 1 ATOM 6020 C CD . GLU A 1 772 ? 47.957 36.838 -18.812 1.00 50.07 ? 807 GLU A CD 1 ATOM 6021 O OE1 . GLU A 1 772 ? 48.740 35.975 -19.273 1.00 47.54 ? 807 GLU A OE1 1 ATOM 6022 O OE2 . GLU A 1 772 ? 48.202 38.071 -18.849 1.00 47.07 ? 807 GLU A OE2 1 ATOM 6023 N N . SER A 1 773 ? 47.375 32.041 -16.366 1.00 37.20 ? 808 SER A N 1 ATOM 6024 C CA . SER A 1 773 ? 46.934 30.732 -15.889 1.00 37.63 ? 808 SER A CA 1 ATOM 6025 C C . SER A 1 773 ? 46.997 30.620 -14.358 1.00 37.43 ? 808 SER A C 1 ATOM 6026 O O . SER A 1 773 ? 46.474 29.672 -13.767 1.00 38.41 ? 808 SER A O 1 ATOM 6027 C CB . SER A 1 773 ? 47.759 29.610 -16.543 1.00 40.65 ? 808 SER A CB 1 ATOM 6028 O OG . SER A 1 773 ? 49.111 29.656 -16.114 1.00 41.77 ? 808 SER A OG 1 ATOM 6029 N N . LYS A 1 774 ? 47.637 31.589 -13.713 1.00 36.52 ? 809 LYS A N 1 ATOM 6030 C CA . LYS A 1 774 ? 47.794 31.539 -12.266 1.00 39.70 ? 809 LYS A CA 1 ATOM 6031 C C . LYS A 1 774 ? 46.820 32.440 -11.500 1.00 32.62 ? 809 LYS A C 1 ATOM 6032 O O . LYS A 1 774 ? 46.825 32.429 -10.274 1.00 39.80 ? 809 LYS A O 1 ATOM 6033 C CB . LYS A 1 774 ? 49.225 31.904 -11.871 1.00 37.15 ? 809 LYS A CB 1 ATOM 6034 C CG . LYS A 1 774 ? 50.296 31.032 -12.496 1.00 43.69 ? 809 LYS A CG 1 ATOM 6035 C CD . LYS A 1 774 ? 50.236 29.618 -11.965 1.00 49.52 ? 809 LYS A CD 1 ATOM 6036 C CE . LYS A 1 774 ? 51.536 28.870 -12.244 1.00 53.78 ? 809 LYS A CE 1 ATOM 6037 N NZ . LYS A 1 774 ? 51.603 27.591 -11.482 1.00 65.88 ? 809 LYS A NZ 1 ATOM 6038 N N . TRP A 1 775 ? 46.004 33.222 -12.200 1.00 30.95 ? 810 TRP A N 1 ATOM 6039 C CA . TRP A 1 775 ? 45.127 34.176 -11.502 1.00 28.28 ? 810 TRP A CA 1 ATOM 6040 C C . TRP A 1 775 ? 43.790 34.531 -12.168 1.00 31.61 ? 810 TRP A C 1 ATOM 6041 O O . TRP A 1 775 ? 42.855 34.918 -11.470 1.00 27.03 ? 810 TRP A O 1 ATOM 6042 C CB . TRP A 1 775 ? 45.896 35.454 -11.160 1.00 25.83 ? 810 TRP A CB 1 ATOM 6043 C CG . TRP A 1 775 ? 46.397 36.164 -12.351 1.00 27.77 ? 810 TRP A CG 1 ATOM 6044 C CD1 . TRP A 1 775 ? 47.576 35.928 -13.011 1.00 32.36 ? 810 TRP A CD1 1 ATOM 6045 C CD2 . TRP A 1 775 ? 45.747 37.225 -13.061 1.00 27.28 ? 810 TRP A CD2 1 ATOM 6046 N NE1 . TRP A 1 775 ? 47.693 36.777 -14.077 1.00 31.01 ? 810 TRP A NE1 1 ATOM 6047 C CE2 . TRP A 1 775 ? 46.586 37.581 -14.138 1.00 29.76 ? 810 TRP A CE2 1 ATOM 6048 C CE3 . TRP A 1 775 ? 44.536 37.909 -12.894 1.00 24.67 ? 810 TRP A CE3 1 ATOM 6049 C CZ2 . TRP A 1 775 ? 46.262 38.595 -15.033 1.00 31.45 ? 810 TRP A CZ2 1 ATOM 6050 C CZ3 . TRP A 1 775 ? 44.212 38.913 -13.792 1.00 29.35 ? 810 TRP A CZ3 1 ATOM 6051 C CH2 . TRP A 1 775 ? 45.070 39.250 -14.844 1.00 31.67 ? 810 TRP A CH2 1 ATOM 6052 N N . VAL A 1 776 ? 43.682 34.399 -13.492 1.00 24.00 ? 811 VAL A N 1 ATOM 6053 C CA . VAL A 1 776 ? 42.479 34.858 -14.179 1.00 25.49 ? 811 VAL A CA 1 ATOM 6054 C C . VAL A 1 776 ? 41.220 34.081 -13.797 1.00 24.56 ? 811 VAL A C 1 ATOM 6055 O O . VAL A 1 776 ? 40.160 34.668 -13.583 1.00 26.33 ? 811 VAL A O 1 ATOM 6056 C CB . VAL A 1 776 ? 42.631 34.846 -15.716 1.00 27.99 ? 811 VAL A CB 1 ATOM 6057 C CG1 . VAL A 1 776 ? 41.279 35.104 -16.393 1.00 27.00 ? 811 VAL A CG1 1 ATOM 6058 C CG2 . VAL A 1 776 ? 43.637 35.904 -16.167 1.00 27.43 ? 811 VAL A CG2 1 ATOM 6059 N N . GLU A 1 777 ? 41.318 32.759 -13.760 1.00 25.82 ? 812 GLU A N 1 ATOM 6060 C CA . GLU A 1 777 ? 40.160 31.958 -13.395 1.00 30.95 ? 812 GLU A CA 1 ATOM 6061 C C . GLU A 1 777 ? 39.706 32.261 -11.966 1.00 27.34 ? 812 GLU A C 1 ATOM 6062 O O . GLU A 1 777 ? 38.503 32.302 -11.701 1.00 25.03 ? 812 GLU A O 1 ATOM 6063 C CB . GLU A 1 777 ? 40.430 30.462 -13.582 1.00 30.15 ? 812 GLU A CB 1 ATOM 6064 C CG . GLU A 1 777 ? 40.412 30.034 -15.046 1.00 32.43 ? 812 GLU A CG 1 ATOM 6065 C CD . GLU A 1 777 ? 40.323 28.529 -15.220 1.00 41.18 ? 812 GLU A CD 1 ATOM 6066 O OE1 . GLU A 1 777 ? 41.389 27.873 -15.265 1.00 42.48 ? 812 GLU A OE1 1 ATOM 6067 O OE2 . GLU A 1 777 ? 39.187 28.008 -15.312 1.00 40.10 ? 812 GLU A OE2 1 ATOM 6068 N N . GLU A 1 778 ? 40.665 32.478 -11.065 1.00 26.06 ? 813 GLU A N 1 ATOM 6069 C CA . GLU A 1 778 ? 40.358 32.803 -9.669 1.00 27.00 ? 813 GLU A CA 1 ATOM 6070 C C . GLU A 1 778 ? 39.513 34.080 -9.621 1.00 30.67 ? 813 GLU A C 1 ATOM 6071 O O . GLU A 1 778 ? 38.547 34.166 -8.862 1.00 25.41 ? 813 GLU A O 1 ATOM 6072 C CB . GLU A 1 778 ? 41.648 32.940 -8.835 1.00 26.04 ? 813 GLU A CB 1 ATOM 6073 C CG . GLU A 1 778 ? 41.443 33.474 -7.411 1.00 31.33 ? 813 GLU A CG 1 ATOM 6074 C CD . GLU A 1 778 ? 42.706 33.424 -6.542 1.00 40.43 ? 813 GLU A CD 1 ATOM 6075 O OE1 . GLU A 1 778 ? 43.746 32.886 -6.986 1.00 39.61 ? 813 GLU A OE1 1 ATOM 6076 O OE2 . GLU A 1 778 ? 42.654 33.923 -5.397 1.00 45.00 ? 813 GLU A OE2 1 ATOM 6077 N N . LEU A 1 779 ? 39.862 35.059 -10.451 1.00 22.17 ? 814 LEU A N 1 ATOM 6078 C CA . LEU A 1 779 ? 39.076 36.286 -10.541 1.00 20.97 ? 814 LEU A CA 1 ATOM 6079 C C . LEU A 1 779 ? 37.664 36.034 -11.063 1.00 26.05 ? 814 LEU A C 1 ATOM 6080 O O . LEU A 1 779 ? 36.684 36.562 -10.531 1.00 19.30 ? 814 LEU A O 1 ATOM 6081 C CB . LEU A 1 779 ? 39.795 37.332 -11.414 1.00 25.77 ? 814 LEU A CB 1 ATOM 6082 C CG . LEU A 1 779 ? 39.057 38.649 -11.700 1.00 26.52 ? 814 LEU A CG 1 ATOM 6083 C CD1 . LEU A 1 779 ? 38.932 39.541 -10.447 1.00 18.48 ? 814 LEU A CD1 1 ATOM 6084 C CD2 . LEU A 1 779 ? 39.723 39.422 -12.851 1.00 24.97 ? 814 LEU A CD2 1 ATOM 6085 N N . MET A 1 780 ? 37.545 35.235 -12.112 1.00 25.29 ? 815 MET A N 1 ATOM 6086 C CA . MET A 1 780 ? 36.236 35.007 -12.711 1.00 26.50 ? 815 MET A CA 1 ATOM 6087 C C . MET A 1 780 ? 35.288 34.306 -11.748 1.00 25.21 ? 815 MET A C 1 ATOM 6088 O O . MET A 1 780 ? 34.105 34.634 -11.700 1.00 20.72 ? 815 MET A O 1 ATOM 6089 C CB . MET A 1 780 ? 36.364 34.182 -13.981 1.00 25.48 ? 815 MET A CB 1 ATOM 6090 C CG . MET A 1 780 ? 37.230 34.858 -15.012 1.00 31.73 ? 815 MET A CG 1 ATOM 6091 S SD . MET A 1 780 ? 37.452 33.813 -16.453 1.00 34.93 ? 815 MET A SD 1 ATOM 6092 C CE . MET A 1 780 ? 35.765 33.548 -16.968 1.00 32.08 ? 815 MET A CE 1 ATOM 6093 N N . LYS A 1 781 ? 35.816 33.335 -11.008 1.00 21.51 ? 816 LYS A N 1 ATOM 6094 C CA . LYS A 1 781 ? 35.035 32.628 -10.000 1.00 21.82 ? 816 LYS A CA 1 ATOM 6095 C C . LYS A 1 781 ? 34.421 33.588 -8.979 1.00 22.73 ? 816 LYS A C 1 ATOM 6096 O O . LYS A 1 781 ? 33.273 33.416 -8.576 1.00 22.25 ? 816 LYS A O 1 ATOM 6097 C CB . LYS A 1 781 ? 35.899 31.588 -9.289 1.00 21.74 ? 816 LYS A CB 1 ATOM 6098 C CG . LYS A 1 781 ? 36.281 30.402 -10.193 1.00 28.00 ? 816 LYS A CG 1 ATOM 6099 C CD . LYS A 1 781 ? 37.087 29.380 -9.409 1.00 27.15 ? 816 LYS A CD 1 ATOM 6100 C CE . LYS A 1 781 ? 37.850 28.447 -10.343 1.00 35.26 ? 816 LYS A CE 1 ATOM 6101 N NZ . LYS A 1 781 ? 38.621 27.428 -9.577 1.00 45.01 ? 816 LYS A NZ 1 ATOM 6102 N N . MET A 1 782 ? 35.189 34.599 -8.585 1.00 21.40 ? 817 MET A N 1 ATOM 6103 C CA . MET A 1 782 ? 34.733 35.582 -7.598 1.00 19.75 ? 817 MET A CA 1 ATOM 6104 C C . MET A 1 782 ? 33.596 36.394 -8.187 1.00 20.06 ? 817 MET A C 1 ATOM 6105 O O . MET A 1 782 ? 32.718 36.859 -7.474 1.00 18.90 ? 817 MET A O 1 ATOM 6106 C CB . MET A 1 782 ? 35.898 36.494 -7.190 1.00 22.63 ? 817 MET A CB 1 ATOM 6107 C CG . MET A 1 782 ? 35.590 37.532 -6.118 1.00 28.35 ? 817 MET A CG 1 ATOM 6108 S SD . MET A 1 782 ? 35.037 36.887 -4.506 1.00 31.71 ? 817 MET A SD 1 ATOM 6109 C CE . MET A 1 782 ? 35.819 35.331 -4.361 1.00 18.32 ? 817 MET A CE 1 ATOM 6110 N N . HIS A 1 783 ? 33.621 36.559 -9.503 1.00 20.00 ? 818 HIS A N 1 ATOM 6111 C CA . HIS A 1 783 ? 32.630 37.388 -10.167 1.00 18.68 ? 818 HIS A CA 1 ATOM 6112 C C . HIS A 1 783 ? 31.583 36.584 -10.932 1.00 20.21 ? 818 HIS A C 1 ATOM 6113 O O . HIS A 1 783 ? 30.959 37.073 -11.861 1.00 21.85 ? 818 HIS A O 1 ATOM 6114 C CB . HIS A 1 783 ? 33.319 38.471 -11.019 1.00 19.24 ? 818 HIS A CB 1 ATOM 6115 C CG . HIS A 1 783 ? 34.070 39.457 -10.196 1.00 20.53 ? 818 HIS A CG 1 ATOM 6116 N ND1 . HIS A 1 783 ? 33.467 40.574 -9.656 1.00 19.64 ? 818 HIS A ND1 1 ATOM 6117 C CD2 . HIS A 1 783 ? 35.355 39.476 -9.767 1.00 20.92 ? 818 HIS A CD2 1 ATOM 6118 C CE1 . HIS A 1 783 ? 34.356 41.249 -8.950 1.00 16.87 ? 818 HIS A CE1 1 ATOM 6119 N NE2 . HIS A 1 783 ? 35.506 40.601 -8.993 1.00 19.07 ? 818 HIS A NE2 1 ATOM 6120 N N . THR A 1 784 ? 31.362 35.359 -10.481 1.00 23.27 ? 819 THR A N 1 ATOM 6121 C CA . THR A 1 784 ? 30.266 34.548 -10.972 1.00 18.57 ? 819 THR A CA 1 ATOM 6122 C C . THR A 1 784 ? 28.940 35.293 -10.783 1.00 18.89 ? 819 THR A C 1 ATOM 6123 O O . THR A 1 784 ? 28.815 36.148 -9.893 1.00 18.34 ? 819 THR A O 1 ATOM 6124 C CB . THR A 1 784 ? 30.269 33.185 -10.257 1.00 21.53 ? 819 THR A CB 1 ATOM 6125 O OG1 . THR A 1 784 ? 29.327 32.320 -10.876 1.00 18.79 ? 819 THR A OG1 1 ATOM 6126 C CG2 . THR A 1 784 ? 29.951 33.329 -8.751 1.00 20.20 ? 819 THR A CG2 1 ATOM 6127 N N . ALA A 1 785 ? 27.971 35.014 -11.653 1.00 19.77 ? 820 ALA A N 1 ATOM 6128 C CA . ALA A 1 785 ? 26.706 35.747 -11.659 1.00 22.13 ? 820 ALA A CA 1 ATOM 6129 C C . ALA A 1 785 ? 25.507 34.891 -12.084 1.00 18.70 ? 820 ALA A C 1 ATOM 6130 O O . ALA A 1 785 ? 25.676 33.870 -12.753 1.00 24.30 ? 820 ALA A O 1 ATOM 6131 C CB . ALA A 1 785 ? 26.817 36.966 -12.578 1.00 21.25 ? 820 ALA A CB 1 ATOM 6132 N N . ARG A 1 786 ? 24.303 35.313 -11.696 1.00 18.36 ? 821 ARG A N 1 ATOM 6133 C CA . ARG A 1 786 ? 23.094 34.710 -12.208 1.00 16.96 ? 821 ARG A CA 1 ATOM 6134 C C . ARG A 1 786 ? 22.754 35.377 -13.537 1.00 20.26 ? 821 ARG A C 1 ATOM 6135 O O . ARG A 1 786 ? 23.056 36.532 -13.736 1.00 20.36 ? 821 ARG A O 1 ATOM 6136 C CB . ARG A 1 786 ? 21.915 34.893 -11.245 1.00 18.76 ? 821 ARG A CB 1 ATOM 6137 C CG . ARG A 1 786 ? 22.181 34.485 -9.759 1.00 21.15 ? 821 ARG A CG 1 ATOM 6138 C CD . ARG A 1 786 ? 21.017 34.903 -8.847 1.00 19.47 ? 821 ARG A CD 1 ATOM 6139 N NE . ARG A 1 786 ? 20.683 36.298 -9.101 1.00 17.94 ? 821 ARG A NE 1 ATOM 6140 C CZ . ARG A 1 786 ? 19.465 36.819 -9.051 1.00 17.76 ? 821 ARG A CZ 1 ATOM 6141 N NH1 . ARG A 1 786 ? 18.421 36.069 -8.733 1.00 18.80 ? 821 ARG A NH1 1 ATOM 6142 N NH2 . ARG A 1 786 ? 19.301 38.105 -9.348 1.00 16.84 ? 821 ARG A NH2 1 ATOM 6143 N N . VAL A 1 787 ? 22.134 34.644 -14.452 1.00 19.58 ? 822 VAL A N 1 ATOM 6144 C CA . VAL A 1 787 ? 21.609 35.264 -15.660 1.00 20.88 ? 822 VAL A CA 1 ATOM 6145 C C . VAL A 1 787 ? 20.657 36.401 -15.292 1.00 21.04 ? 822 VAL A C 1 ATOM 6146 O O . VAL A 1 787 ? 20.655 37.459 -15.916 1.00 21.58 ? 822 VAL A O 1 ATOM 6147 C CB . VAL A 1 787 ? 20.895 34.227 -16.526 1.00 23.33 ? 822 VAL A CB 1 ATOM 6148 C CG1 . VAL A 1 787 ? 20.093 34.931 -17.621 1.00 24.82 ? 822 VAL A CG1 1 ATOM 6149 C CG2 . VAL A 1 787 ? 21.921 33.293 -17.133 1.00 20.71 ? 822 VAL A CG2 1 ATOM 6150 N N . ARG A 1 788 ? 19.881 36.195 -14.237 1.00 20.17 ? 823 ARG A N 1 ATOM 6151 C CA . ARG A 1 788 ? 18.978 37.231 -13.758 1.00 22.62 ? 823 ARG A CA 1 ATOM 6152 C C . ARG A 1 788 ? 19.698 38.556 -13.403 1.00 20.46 ? 823 ARG A C 1 ATOM 6153 O O . ARG A 1 788 ? 19.155 39.653 -13.622 1.00 21.53 ? 823 ARG A O 1 ATOM 6154 C CB . ARG A 1 788 ? 18.192 36.721 -12.558 1.00 22.26 ? 823 ARG A CB 1 ATOM 6155 C CG . ARG A 1 788 ? 16.964 37.546 -12.229 1.00 28.55 ? 823 ARG A CG 1 ATOM 6156 C CD . ARG A 1 788 ? 15.852 37.349 -13.283 1.00 29.69 ? 823 ARG A CD 1 ATOM 6157 N NE . ARG A 1 788 ? 14.717 38.183 -12.933 1.00 25.33 ? 823 ARG A NE 1 ATOM 6158 C CZ . ARG A 1 788 ? 14.405 39.314 -13.554 1.00 29.95 ? 823 ARG A CZ 1 ATOM 6159 N NH1 . ARG A 1 788 ? 15.107 39.711 -14.609 1.00 29.72 ? 823 ARG A NH1 1 ATOM 6160 N NH2 . ARG A 1 788 ? 13.373 40.029 -13.140 1.00 35.42 ? 823 ARG A NH2 1 ATOM 6161 N N . ASP A 1 789 ? 20.905 38.455 -12.846 1.00 20.63 ? 824 ASP A N 1 ATOM 6162 C CA . ASP A 1 789 ? 21.697 39.637 -12.522 1.00 16.58 ? 824 ASP A CA 1 ATOM 6163 C C . ASP A 1 789 ? 22.011 40.454 -13.789 1.00 18.75 ? 824 ASP A C 1 ATOM 6164 O O . ASP A 1 789 ? 21.950 41.695 -13.806 1.00 23.06 ? 824 ASP A O 1 ATOM 6165 C CB . ASP A 1 789 ? 23.032 39.224 -11.907 1.00 18.46 ? 824 ASP A CB 1 ATOM 6166 C CG . ASP A 1 789 ? 22.878 38.593 -10.512 1.00 20.09 ? 824 ASP A CG 1 ATOM 6167 O OD1 . ASP A 1 789 ? 21.971 39.008 -9.756 1.00 19.54 ? 824 ASP A OD1 1 ATOM 6168 O OD2 . ASP A 1 789 ? 23.671 37.678 -10.181 1.00 22.41 ? 824 ASP A OD2 1 ATOM 6169 N N . ILE A 1 790 ? 22.397 39.729 -14.826 1.00 18.68 ? 825 ILE A N 1 ATOM 6170 C CA . ILE A 1 790 ? 22.762 40.312 -16.106 1.00 21.57 ? 825 ILE A CA 1 ATOM 6171 C C . ILE A 1 790 ? 21.537 40.944 -16.738 1.00 23.18 ? 825 ILE A C 1 ATOM 6172 O O . ILE A 1 790 ? 21.630 42.023 -17.312 1.00 22.83 ? 825 ILE A O 1 ATOM 6173 C CB . ILE A 1 790 ? 23.405 39.267 -17.034 1.00 21.85 ? 825 ILE A CB 1 ATOM 6174 C CG1 . ILE A 1 790 ? 24.779 38.865 -16.487 1.00 23.88 ? 825 ILE A CG1 1 ATOM 6175 C CG2 . ILE A 1 790 ? 23.575 39.825 -18.460 1.00 26.03 ? 825 ILE A CG2 1 ATOM 6176 C CD1 . ILE A 1 790 ? 25.357 37.564 -17.061 1.00 23.71 ? 825 ILE A CD1 1 ATOM 6177 N N . GLU A 1 791 ? 20.380 40.296 -16.595 1.00 21.39 ? 826 GLU A N 1 ATOM 6178 C CA . GLU A 1 791 ? 19.147 40.874 -17.124 1.00 23.79 ? 826 GLU A CA 1 ATOM 6179 C C . GLU A 1 791 ? 18.841 42.240 -16.503 1.00 30.65 ? 826 GLU A C 1 ATOM 6180 O O . GLU A 1 791 ? 18.465 43.177 -17.214 1.00 24.59 ? 826 GLU A O 1 ATOM 6181 C CB . GLU A 1 791 ? 17.961 39.925 -16.942 1.00 25.17 ? 826 GLU A CB 1 ATOM 6182 C CG . GLU A 1 791 ? 18.054 38.674 -17.812 1.00 23.54 ? 826 GLU A CG 1 ATOM 6183 C CD . GLU A 1 791 ? 16.838 37.758 -17.677 1.00 28.42 ? 826 GLU A CD 1 ATOM 6184 O OE1 . GLU A 1 791 ? 16.247 37.688 -16.580 1.00 28.21 ? 826 GLU A OE1 1 ATOM 6185 O OE2 . GLU A 1 791 ? 16.472 37.107 -18.680 1.00 31.66 ? 826 GLU A OE2 1 ATOM 6186 N N . HIS A 1 792 ? 18.995 42.351 -15.183 1.00 22.75 ? 827 HIS A N 1 ATOM 6187 C CA . HIS A 1 792 ? 18.801 43.627 -14.500 1.00 21.89 ? 827 HIS A CA 1 ATOM 6188 C C . HIS A 1 792 ? 19.730 44.683 -15.040 1.00 22.22 ? 827 HIS A C 1 ATOM 6189 O O . HIS A 1 792 ? 19.341 45.840 -15.206 1.00 25.71 ? 827 HIS A O 1 ATOM 6190 C CB . HIS A 1 792 ? 19.084 43.502 -12.992 1.00 22.40 ? 827 HIS A CB 1 ATOM 6191 C CG . HIS A 1 792 ? 18.086 42.666 -12.243 1.00 24.19 ? 827 HIS A CG 1 ATOM 6192 N ND1 . HIS A 1 792 ? 16.726 42.742 -12.464 1.00 26.20 ? 827 HIS A ND1 1 ATOM 6193 C CD2 . HIS A 1 792 ? 18.253 41.760 -11.247 1.00 25.17 ? 827 HIS A CD2 1 ATOM 6194 C CE1 . HIS A 1 792 ? 16.102 41.907 -11.655 1.00 26.82 ? 827 HIS A CE1 1 ATOM 6195 N NE2 . HIS A 1 792 ? 17.005 41.296 -10.908 1.00 26.48 ? 827 HIS A NE2 1 ATOM 6196 N N . LEU A 1 793 ? 20.973 44.287 -15.275 1.00 20.41 ? 828 LEU A N 1 ATOM 6197 C CA . LEU A 1 793 ? 22.017 45.215 -15.660 1.00 24.11 ? 828 LEU A CA 1 ATOM 6198 C C . LEU A 1 793 ? 21.957 45.603 -17.143 1.00 28.07 ? 828 LEU A C 1 ATOM 6199 O O . LEU A 1 793 ? 22.552 46.601 -17.530 1.00 26.73 ? 828 LEU A O 1 ATOM 6200 C CB . LEU A 1 793 ? 23.386 44.613 -15.346 1.00 22.11 ? 828 LEU A CB 1 ATOM 6201 C CG . LEU A 1 793 ? 23.700 44.664 -13.847 1.00 23.20 ? 828 LEU A CG 1 ATOM 6202 C CD1 . LEU A 1 793 ? 24.782 43.647 -13.485 1.00 22.61 ? 828 LEU A CD1 1 ATOM 6203 C CD2 . LEU A 1 793 ? 24.134 46.086 -13.451 1.00 24.58 ? 828 LEU A CD2 1 ATOM 6204 N N . THR A 1 794 ? 21.253 44.814 -17.960 1.00 23.61 ? 829 THR A N 1 ATOM 6205 C CA . THR A 1 794 ? 21.270 45.045 -19.419 1.00 32.12 ? 829 THR A CA 1 ATOM 6206 C C . THR A 1 794 ? 19.924 45.428 -20.024 1.00 29.87 ? 829 THR A C 1 ATOM 6207 O O . THR A 1 794 ? 19.858 45.931 -21.142 1.00 29.68 ? 829 THR A O 1 ATOM 6208 C CB . THR A 1 794 ? 21.813 43.826 -20.209 1.00 28.62 ? 829 THR A CB 1 ATOM 6209 O OG1 . THR A 1 794 ? 20.978 42.683 -19.997 1.00 27.87 ? 829 THR A OG1 1 ATOM 6210 C CG2 . THR A 1 794 ? 23.259 43.497 -19.815 1.00 29.42 ? 829 THR A CG2 1 ATOM 6211 N N . GLY A 1 795 ? 18.852 45.187 -19.286 1.00 27.16 ? 830 GLY A N 1 ATOM 6212 C CA . GLY A 1 795 ? 17.517 45.337 -19.821 1.00 30.94 ? 830 GLY A CA 1 ATOM 6213 C C . GLY A 1 795 ? 17.170 44.323 -20.896 1.00 31.95 ? 830 GLY A C 1 ATOM 6214 O O . GLY A 1 795 ? 16.241 44.559 -21.681 1.00 27.38 ? 830 GLY A O 1 ATOM 6215 N N . LEU A 1 796 ? 17.905 43.210 -20.936 1.00 28.94 ? 831 LEU A N 1 ATOM 6216 C CA . LEU A 1 796 ? 17.632 42.097 -21.858 1.00 28.22 ? 831 LEU A CA 1 ATOM 6217 C C . LEU A 1 796 ? 16.886 40.954 -21.164 1.00 34.05 ? 831 LEU A C 1 ATOM 6218 O O . LEU A 1 796 ? 16.946 40.820 -19.944 1.00 30.80 ? 831 LEU A O 1 ATOM 6219 C CB . LEU A 1 796 ? 18.938 41.552 -22.445 1.00 26.83 ? 831 LEU A CB 1 ATOM 6220 C CG . LEU A 1 796 ? 19.858 42.527 -23.186 1.00 31.82 ? 831 LEU A CG 1 ATOM 6221 C CD1 . LEU A 1 796 ? 21.133 41.835 -23.612 1.00 28.72 ? 831 LEU A CD1 1 ATOM 6222 C CD2 . LEU A 1 796 ? 19.149 43.143 -24.383 1.00 34.91 ? 831 LEU A CD2 1 ATOM 6223 N N . ASP A 1 797 ? 16.191 40.127 -21.947 1.00 28.29 ? 832 ASP A N 1 ATOM 6224 C CA . ASP A 1 797 ? 15.485 38.958 -21.435 1.00 29.90 ? 832 ASP A CA 1 ATOM 6225 C C . ASP A 1 797 ? 15.888 37.739 -22.249 1.00 32.73 ? 832 ASP A C 1 ATOM 6226 O O . ASP A 1 797 ? 15.615 37.668 -23.445 1.00 33.22 ? 832 ASP A O 1 ATOM 6227 C CB . ASP A 1 797 ? 13.961 39.165 -21.483 1.00 31.59 ? 832 ASP A CB 1 ATOM 6228 C CG . ASP A 1 797 ? 13.196 38.074 -20.747 1.00 33.56 ? 832 ASP A CG 1 ATOM 6229 O OD1 . ASP A 1 797 ? 13.232 38.062 -19.497 1.00 32.92 ? 832 ASP A OD1 1 ATOM 6230 O OD2 . ASP A 1 797 ? 12.547 37.225 -21.401 1.00 33.02 ? 832 ASP A OD2 1 ATOM 6231 N N . PHE A 1 798 ? 16.536 36.778 -21.596 1.00 32.80 ? 833 PHE A N 1 ATOM 6232 C CA . PHE A 1 798 ? 17.136 35.635 -22.278 1.00 30.30 ? 833 PHE A CA 1 ATOM 6233 C C . PHE A 1 798 ? 16.267 34.378 -22.257 1.00 26.56 ? 833 PHE A C 1 ATOM 6234 O O . PHE A 1 798 ? 15.256 34.312 -21.544 1.00 29.82 ? 833 PHE A O 1 ATOM 6235 C CB . PHE A 1 798 ? 18.520 35.330 -21.691 1.00 27.37 ? 833 PHE A CB 1 ATOM 6236 C CG . PHE A 1 798 ? 19.469 36.512 -21.704 1.00 28.40 ? 833 PHE A CG 1 ATOM 6237 C CD1 . PHE A 1 798 ? 20.213 36.815 -22.831 1.00 31.68 ? 833 PHE A CD1 1 ATOM 6238 C CD2 . PHE A 1 798 ? 19.627 37.305 -20.570 1.00 30.68 ? 833 PHE A CD2 1 ATOM 6239 C CE1 . PHE A 1 798 ? 21.088 37.897 -22.836 1.00 35.56 ? 833 PHE A CE1 1 ATOM 6240 C CE2 . PHE A 1 798 ? 20.491 38.389 -20.569 1.00 29.36 ? 833 PHE A CE2 1 ATOM 6241 C CZ . PHE A 1 798 ? 21.225 38.685 -21.703 1.00 35.31 ? 833 PHE A CZ 1 ATOM 6242 N N . TYR A 1 799 ? 16.661 33.391 -23.061 1.00 27.08 ? 834 TYR A N 1 ATOM 6243 C CA . TYR A 1 799 ? 16.002 32.078 -23.103 1.00 33.02 ? 834 TYR A CA 1 ATOM 6244 C C . TYR A 1 799 ? 14.509 32.133 -23.420 1.00 30.04 ? 834 TYR A C 1 ATOM 6245 O O . TYR A 1 799 ? 13.731 31.378 -22.847 1.00 28.36 ? 834 TYR A O 1 ATOM 6246 C CB . TYR A 1 799 ? 16.194 31.308 -21.781 1.00 27.48 ? 834 TYR A CB 1 ATOM 6247 C CG . TYR A 1 799 ? 17.637 31.081 -21.383 1.00 29.11 ? 834 TYR A CG 1 ATOM 6248 C CD1 . TYR A 1 799 ? 18.480 30.300 -22.157 1.00 31.85 ? 834 TYR A CD1 1 ATOM 6249 C CD2 . TYR A 1 799 ? 18.145 31.628 -20.208 1.00 30.95 ? 834 TYR A CD2 1 ATOM 6250 C CE1 . TYR A 1 799 ? 19.805 30.090 -21.788 1.00 33.12 ? 834 TYR A CE1 1 ATOM 6251 C CE2 . TYR A 1 799 ? 19.455 31.414 -19.828 1.00 27.53 ? 834 TYR A CE2 1 ATOM 6252 C CZ . TYR A 1 799 ? 20.281 30.656 -20.615 1.00 31.01 ? 834 TYR A CZ 1 ATOM 6253 O OH . TYR A 1 799 ? 21.579 30.462 -20.227 1.00 28.14 ? 834 TYR A OH 1 ATOM 6254 N N . ARG A 1 800 ? 14.099 33.016 -24.318 1.00 30.64 ? 835 ARG A N 1 ATOM 6255 C CA . ARG A 1 800 ? 12.677 33.115 -24.632 1.00 34.30 ? 835 ARG A CA 1 ATOM 6256 C C . ARG A 1 800 ? 12.149 31.990 -25.551 1.00 36.33 ? 835 ARG A C 1 ATOM 6257 O O . ARG A 1 800 ? 10.963 31.676 -25.511 1.00 32.51 ? 835 ARG A O 1 ATOM 6258 C CB . ARG A 1 800 ? 12.348 34.494 -25.197 1.00 36.76 ? 835 ARG A CB 1 ATOM 6259 C CG . ARG A 1 800 ? 12.511 35.597 -24.182 1.00 35.76 ? 835 ARG A CG 1 ATOM 6260 C CD . ARG A 1 800 ? 12.618 36.945 -24.841 1.00 37.30 ? 835 ARG A CD 1 ATOM 6261 N NE . ARG A 1 800 ? 11.353 37.389 -25.421 1.00 36.60 ? 835 ARG A NE 1 ATOM 6262 C CZ . ARG A 1 800 ? 10.400 38.010 -24.735 1.00 40.37 ? 835 ARG A CZ 1 ATOM 6263 N NH1 . ARG A 1 800 ? 10.556 38.250 -23.438 1.00 36.73 ? 835 ARG A NH1 1 ATOM 6264 N NH2 . ARG A 1 800 ? 9.290 38.396 -25.345 1.00 36.73 ? 835 ARG A NH2 1 ATOM 6265 N N . LYS A 1 801 ? 13.026 31.381 -26.350 1.00 31.69 ? 836 LYS A N 1 ATOM 6266 C CA . LYS A 1 801 ? 12.620 30.287 -27.242 1.00 35.82 ? 836 LYS A CA 1 ATOM 6267 C C . LYS A 1 801 ? 13.306 28.974 -26.888 1.00 28.11 ? 836 LYS A C 1 ATOM 6268 O O . LYS A 1 801 ? 14.390 28.691 -27.387 1.00 37.16 ? 836 LYS A O 1 ATOM 6269 C CB . LYS A 1 801 ? 12.950 30.621 -28.705 1.00 38.23 ? 836 LYS A CB 1 ATOM 6270 C CG . LYS A 1 801 ? 12.386 31.941 -29.214 1.00 47.52 ? 836 LYS A CG 1 ATOM 6271 C CD . LYS A 1 801 ? 10.880 31.861 -29.418 1.00 51.49 ? 836 LYS A CD 1 ATOM 6272 C CE . LYS A 1 801 ? 10.360 33.097 -30.141 1.00 56.61 ? 836 LYS A CE 1 ATOM 6273 N NZ . LYS A 1 801 ? 8.926 32.941 -30.522 1.00 64.25 ? 836 LYS A NZ 1 ATOM 6274 N N . THR A 1 802 ? 12.681 28.173 -26.033 1.00 33.93 ? 837 THR A N 1 ATOM 6275 C CA . THR A 1 802 ? 13.244 26.884 -25.638 1.00 29.96 ? 837 THR A CA 1 ATOM 6276 C C . THR A 1 802 ? 12.119 25.862 -25.599 1.00 33.61 ? 837 THR A C 1 ATOM 6277 O O . THR A 1 802 ? 10.949 26.224 -25.724 1.00 33.93 ? 837 THR A O 1 ATOM 6278 C CB . THR A 1 802 ? 13.873 26.931 -24.214 1.00 31.47 ? 837 THR A CB 1 ATOM 6279 O OG1 . THR A 1 802 ? 12.825 26.985 -23.235 1.00 34.25 ? 837 THR A OG1 1 ATOM 6280 C CG2 . THR A 1 802 ? 14.801 28.143 -24.050 1.00 32.92 ? 837 THR A CG2 1 ATOM 6281 N N . SER A 1 803 ? 12.476 24.596 -25.392 1.00 34.55 ? 838 SER A N 1 ATOM 6282 C CA . SER A 1 803 ? 11.495 23.520 -25.235 1.00 37.58 ? 838 SER A CA 1 ATOM 6283 C C . SER A 1 803 ? 11.084 23.291 -23.778 1.00 40.39 ? 838 SER A C 1 ATOM 6284 O O . SER A 1 803 ? 10.405 22.309 -23.464 1.00 33.40 ? 838 SER A O 1 ATOM 6285 C CB . SER A 1 803 ? 12.036 22.212 -25.823 1.00 38.04 ? 838 SER A CB 1 ATOM 6286 O OG . SER A 1 803 ? 13.241 21.814 -25.181 1.00 42.78 ? 838 SER A OG 1 ATOM 6287 N N . ARG A 1 804 ? 11.472 24.209 -22.895 1.00 35.96 ? 839 ARG A N 1 ATOM 6288 C CA . ARG A 1 804 ? 11.225 24.050 -21.459 1.00 31.45 ? 839 ARG A CA 1 ATOM 6289 C C . ARG A 1 804 ? 10.102 24.968 -20.969 1.00 31.19 ? 839 ARG A C 1 ATOM 6290 O O . ARG A 1 804 ? 9.792 25.978 -21.614 1.00 33.84 ? 839 ARG A O 1 ATOM 6291 C CB . ARG A 1 804 ? 12.515 24.355 -20.679 1.00 32.44 ? 839 ARG A CB 1 ATOM 6292 C CG . ARG A 1 804 ? 13.781 23.725 -21.254 1.00 36.91 ? 839 ARG A CG 1 ATOM 6293 C CD . ARG A 1 804 ? 13.637 22.218 -21.387 1.00 37.61 ? 839 ARG A CD 1 ATOM 6294 N NE . ARG A 1 804 ? 13.272 21.590 -20.120 1.00 39.62 ? 839 ARG A NE 1 ATOM 6295 C CZ . ARG A 1 804 ? 12.964 20.302 -19.984 1.00 40.38 ? 839 ARG A CZ 1 ATOM 6296 N NH1 . ARG A 1 804 ? 12.980 19.497 -21.041 1.00 42.71 ? 839 ARG A NH1 1 ATOM 6297 N NH2 . ARG A 1 804 ? 12.648 19.817 -18.790 1.00 37.05 ? 839 ARG A NH2 1 ATOM 6298 N N . SER A 1 805 ? 9.493 24.633 -19.832 1.00 28.33 ? 840 SER A N 1 ATOM 6299 C CA . SER A 1 805 ? 8.482 25.512 -19.240 1.00 27.22 ? 840 SER A CA 1 ATOM 6300 C C . SER A 1 805 ? 9.107 26.855 -18.852 1.00 32.93 ? 840 SER A C 1 ATOM 6301 O O . SER A 1 805 ? 10.306 26.933 -18.590 1.00 31.80 ? 840 SER A O 1 ATOM 6302 C CB . SER A 1 805 ? 7.835 24.863 -18.012 1.00 33.25 ? 840 SER A CB 1 ATOM 6303 O OG . SER A 1 805 ? 8.711 24.869 -16.887 1.00 32.07 ? 840 SER A OG 1 ATOM 6304 N N . TYR A 1 806 ? 8.310 27.916 -18.838 1.00 32.41 ? 841 TYR A N 1 ATOM 6305 C CA . TYR A 1 806 ? 8.836 29.215 -18.437 1.00 32.45 ? 841 TYR A CA 1 ATOM 6306 C C . TYR A 1 806 ? 9.294 29.167 -16.976 1.00 31.19 ? 841 TYR A C 1 ATOM 6307 O O . TYR A 1 806 ? 10.292 29.795 -16.619 1.00 30.03 ? 841 TYR A O 1 ATOM 6308 C CB . TYR A 1 806 ? 7.798 30.314 -18.630 1.00 29.13 ? 841 TYR A CB 1 ATOM 6309 C CG . TYR A 1 806 ? 8.308 31.732 -18.414 1.00 32.70 ? 841 TYR A CG 1 ATOM 6310 C CD1 . TYR A 1 806 ? 9.645 32.061 -18.614 1.00 34.82 ? 841 TYR A CD1 1 ATOM 6311 C CD2 . TYR A 1 806 ? 7.436 32.744 -18.018 1.00 30.55 ? 841 TYR A CD2 1 ATOM 6312 C CE1 . TYR A 1 806 ? 10.100 33.356 -18.423 1.00 28.11 ? 841 TYR A CE1 1 ATOM 6313 C CE2 . TYR A 1 806 ? 7.882 34.041 -17.822 1.00 40.22 ? 841 TYR A CE2 1 ATOM 6314 C CZ . TYR A 1 806 ? 9.215 34.342 -18.028 1.00 36.68 ? 841 TYR A CZ 1 ATOM 6315 O OH . TYR A 1 806 ? 9.649 35.638 -17.830 1.00 37.18 ? 841 TYR A OH 1 ATOM 6316 N N . SER A 1 807 ? 8.580 28.407 -16.144 1.00 29.72 ? 842 SER A N 1 ATOM 6317 C CA . SER A 1 807 ? 8.944 28.295 -14.728 1.00 31.68 ? 842 SER A CA 1 ATOM 6318 C C . SER A 1 807 ? 10.306 27.638 -14.544 1.00 32.26 ? 842 SER A C 1 ATOM 6319 O O . SER A 1 807 ? 11.056 27.989 -13.633 1.00 30.32 ? 842 SER A O 1 ATOM 6320 C CB . SER A 1 807 ? 7.887 27.529 -13.935 1.00 32.16 ? 842 SER A CB 1 ATOM 6321 O OG . SER A 1 807 ? 6.711 28.301 -13.800 1.00 35.05 ? 842 SER A OG 1 ATOM 6322 N N . GLU A 1 808 ? 10.626 26.691 -15.413 1.00 25.88 ? 843 GLU A N 1 ATOM 6323 C CA . GLU A 1 808 ? 11.906 26.008 -15.335 1.00 30.71 ? 843 GLU A CA 1 ATOM 6324 C C . GLU A 1 808 ? 13.022 26.950 -15.772 1.00 29.41 ? 843 GLU A C 1 ATOM 6325 O O . GLU A 1 808 ? 14.122 26.926 -15.217 1.00 24.65 ? 843 GLU A O 1 ATOM 6326 C CB . GLU A 1 808 ? 11.906 24.732 -16.185 1.00 31.90 ? 843 GLU A CB 1 ATOM 6327 C CG . GLU A 1 808 ? 13.179 23.896 -16.033 1.00 40.55 ? 843 GLU A CG 1 ATOM 6328 C CD . GLU A 1 808 ? 13.263 22.738 -17.031 1.00 39.53 ? 843 GLU A CD 1 ATOM 6329 O OE1 . GLU A 1 808 ? 12.444 21.793 -16.937 1.00 44.26 ? 843 GLU A OE1 1 ATOM 6330 O OE2 . GLU A 1 808 ? 14.157 22.779 -17.901 1.00 35.21 ? 843 GLU A OE2 1 ATOM 6331 N N . ILE A 1 809 ? 12.733 27.775 -16.776 1.00 24.04 ? 844 ILE A N 1 ATOM 6332 C CA . ILE A 1 809 ? 13.697 28.741 -17.285 1.00 26.21 ? 844 ILE A CA 1 ATOM 6333 C C . ILE A 1 809 ? 13.991 29.805 -16.212 1.00 23.30 ? 844 ILE A C 1 ATOM 6334 O O . ILE A 1 809 ? 15.125 30.246 -16.073 1.00 27.45 ? 844 ILE A O 1 ATOM 6335 C CB . ILE A 1 809 ? 13.184 29.402 -18.587 1.00 25.66 ? 844 ILE A CB 1 ATOM 6336 C CG1 . ILE A 1 809 ? 13.171 28.366 -19.735 1.00 27.86 ? 844 ILE A CG1 1 ATOM 6337 C CG2 . ILE A 1 809 ? 14.037 30.601 -18.981 1.00 28.27 ? 844 ILE A CG2 1 ATOM 6338 C CD1 . ILE A 1 809 ? 14.466 27.588 -19.873 1.00 28.55 ? 844 ILE A CD1 1 ATOM 6339 N N . LEU A 1 810 ? 12.962 30.207 -15.476 1.00 21.96 ? 845 LEU A N 1 ATOM 6340 C CA . LEU A 1 810 ? 13.134 31.175 -14.378 1.00 22.79 ? 845 LEU A CA 1 ATOM 6341 C C . LEU A 1 810 ? 14.092 30.595 -13.343 1.00 26.87 ? 845 LEU A C 1 ATOM 6342 O O . LEU A 1 810 ? 15.018 31.280 -12.885 1.00 23.98 ? 845 LEU A O 1 ATOM 6343 C CB . LEU A 1 810 ? 11.792 31.517 -13.733 1.00 24.65 ? 845 LEU A CB 1 ATOM 6344 C CG . LEU A 1 810 ? 10.846 32.334 -14.617 1.00 26.99 ? 845 LEU A CG 1 ATOM 6345 C CD1 . LEU A 1 810 ? 9.542 32.636 -13.896 1.00 28.92 ? 845 LEU A CD1 1 ATOM 6346 C CD2 . LEU A 1 810 ? 11.531 33.608 -15.053 1.00 25.28 ? 845 LEU A CD2 1 ATOM 6347 N N . THR A 1 811 ? 13.883 29.326 -12.991 1.00 24.22 ? 846 THR A N 1 ATOM 6348 C CA . THR A 1 811 ? 14.840 28.619 -12.141 1.00 25.20 ? 846 THR A CA 1 ATOM 6349 C C . THR A 1 811 ? 16.269 28.671 -12.706 1.00 26.11 ? 846 THR A C 1 ATOM 6350 O O . THR A 1 811 ? 17.210 28.942 -11.970 1.00 23.71 ? 846 THR A O 1 ATOM 6351 C CB . THR A 1 811 ? 14.436 27.139 -11.896 1.00 28.72 ? 846 THR A CB 1 ATOM 6352 O OG1 . THR A 1 811 ? 13.103 27.081 -11.373 1.00 25.22 ? 846 THR A OG1 1 ATOM 6353 C CG2 . THR A 1 811 ? 15.366 26.510 -10.886 1.00 31.28 ? 846 THR A CG2 1 ATOM 6354 N N . LEU A 1 812 ? 16.426 28.417 -14.008 1.00 23.17 ? 847 LEU A N 1 ATOM 6355 C CA . LEU A 1 812 ? 17.731 28.452 -14.662 1.00 25.91 ? 847 LEU A CA 1 ATOM 6356 C C . LEU A 1 812 ? 18.397 29.822 -14.526 1.00 22.43 ? 847 LEU A C 1 ATOM 6357 O O . LEU A 1 812 ? 19.582 29.909 -14.220 1.00 22.64 ? 847 LEU A O 1 ATOM 6358 C CB . LEU A 1 812 ? 17.604 28.090 -16.156 1.00 21.11 ? 847 LEU A CB 1 ATOM 6359 C CG . LEU A 1 812 ? 18.871 27.902 -16.991 1.00 28.19 ? 847 LEU A CG 1 ATOM 6360 C CD1 . LEU A 1 812 ? 19.629 26.627 -16.597 1.00 24.55 ? 847 LEU A CD1 1 ATOM 6361 C CD2 . LEU A 1 812 ? 18.541 27.907 -18.494 1.00 27.37 ? 847 LEU A CD2 1 ATOM 6362 N N . LYS A 1 813 ? 17.627 30.879 -14.756 1.00 21.77 ? 848 LYS A N 1 ATOM 6363 C CA . LYS A 1 813 ? 18.149 32.235 -14.699 1.00 22.83 ? 848 LYS A CA 1 ATOM 6364 C C . LYS A 1 813 ? 18.551 32.699 -13.294 1.00 18.36 ? 848 LYS A C 1 ATOM 6365 O O . LYS A 1 813 ? 19.328 33.653 -13.176 1.00 21.25 ? 848 LYS A O 1 ATOM 6366 C CB . LYS A 1 813 ? 17.153 33.228 -15.300 1.00 24.74 ? 848 LYS A CB 1 ATOM 6367 C CG . LYS A 1 813 ? 16.826 32.940 -16.776 1.00 27.93 ? 848 LYS A CG 1 ATOM 6368 C CD . LYS A 1 813 ? 16.392 34.209 -17.484 1.00 33.09 ? 848 LYS A CD 1 ATOM 6369 C CE . LYS A 1 813 ? 14.990 34.081 -18.055 1.00 38.43 ? 848 LYS A CE 1 ATOM 6370 N NZ . LYS A 1 813 ? 14.419 35.401 -18.441 1.00 31.68 ? 848 LYS A NZ 1 ATOM 6371 N N . THR A 1 814 ? 18.031 32.049 -12.258 1.00 22.75 ? 849 THR A N 1 ATOM 6372 C CA . THR A 1 814 ? 18.405 32.398 -10.871 1.00 21.38 ? 849 THR A CA 1 ATOM 6373 C C . THR A 1 814 ? 19.567 31.568 -10.325 1.00 22.44 ? 849 THR A C 1 ATOM 6374 O O . THR A 1 814 ? 20.046 31.810 -9.208 1.00 21.80 ? 849 THR A O 1 ATOM 6375 C CB . THR A 1 814 ? 17.217 32.275 -9.881 1.00 21.20 ? 849 THR A CB 1 ATOM 6376 O OG1 . THR A 1 814 ? 16.734 30.919 -9.841 1.00 23.86 ? 849 THR A OG1 1 ATOM 6377 C CG2 . THR A 1 814 ? 16.085 33.205 -10.261 1.00 23.32 ? 849 THR A CG2 1 ATOM 6378 N N . TYR A 1 815 ? 19.990 30.570 -11.098 1.00 21.60 ? 850 TYR A N 1 ATOM 6379 C CA . TYR A 1 815 ? 21.092 29.699 -10.718 1.00 21.52 ? 850 TYR A CA 1 ATOM 6380 C C . TYR A 1 815 ? 22.394 30.481 -10.616 1.00 22.41 ? 850 TYR A C 1 ATOM 6381 O O . TYR A 1 815 ? 22.680 31.333 -11.457 1.00 20.80 ? 850 TYR A O 1 ATOM 6382 C CB . TYR A 1 815 ? 21.276 28.579 -11.746 1.00 21.42 ? 850 TYR A CB 1 ATOM 6383 C CG . TYR A 1 815 ? 22.479 27.708 -11.461 1.00 20.34 ? 850 TYR A CG 1 ATOM 6384 C CD1 . TYR A 1 815 ? 22.474 26.807 -10.388 1.00 25.17 ? 850 TYR A CD1 1 ATOM 6385 C CD2 . TYR A 1 815 ? 23.630 27.803 -12.232 1.00 26.06 ? 850 TYR A CD2 1 ATOM 6386 C CE1 . TYR A 1 815 ? 23.571 26.007 -10.117 1.00 28.04 ? 850 TYR A CE1 1 ATOM 6387 C CE2 . TYR A 1 815 ? 24.749 27.012 -11.960 1.00 27.26 ? 850 TYR A CE2 1 ATOM 6388 C CZ . TYR A 1 815 ? 24.711 26.118 -10.908 1.00 27.47 ? 850 TYR A CZ 1 ATOM 6389 O OH . TYR A 1 815 ? 25.813 25.337 -10.634 1.00 28.15 ? 850 TYR A OH 1 ATOM 6390 N N . LEU A 1 816 ? 23.169 30.196 -9.580 1.00 20.94 ? 851 LEU A N 1 ATOM 6391 C CA . LEU A 1 816 ? 24.495 30.785 -9.440 1.00 22.53 ? 851 LEU A CA 1 ATOM 6392 C C . LEU A 1 816 ? 25.501 29.653 -9.354 1.00 21.81 ? 851 LEU A C 1 ATOM 6393 O O . LEU A 1 816 ? 25.392 28.783 -8.487 1.00 21.28 ? 851 LEU A O 1 ATOM 6394 C CB . LEU A 1 816 ? 24.586 31.648 -8.179 1.00 16.78 ? 851 LEU A CB 1 ATOM 6395 C CG . LEU A 1 816 ? 25.918 32.383 -7.958 1.00 19.74 ? 851 LEU A CG 1 ATOM 6396 C CD1 . LEU A 1 816 ? 26.104 33.542 -8.946 1.00 19.34 ? 851 LEU A CD1 1 ATOM 6397 C CD2 . LEU A 1 816 ? 26.038 32.865 -6.530 1.00 20.14 ? 851 LEU A CD2 1 ATOM 6398 N N . HIS A 1 817 ? 26.482 29.655 -10.248 1.00 21.50 ? 852 HIS A N 1 ATOM 6399 C CA . HIS A 1 817 ? 27.538 28.656 -10.170 1.00 22.02 ? 852 HIS A CA 1 ATOM 6400 C C . HIS A 1 817 ? 28.581 29.161 -9.177 1.00 24.38 ? 852 HIS A C 1 ATOM 6401 O O . HIS A 1 817 ? 29.246 30.161 -9.430 1.00 22.83 ? 852 HIS A O 1 ATOM 6402 C CB . HIS A 1 817 ? 28.172 28.417 -11.546 1.00 25.84 ? 852 HIS A CB 1 ATOM 6403 C CG . HIS A 1 817 ? 28.909 27.120 -11.639 1.00 31.78 ? 852 HIS A CG 1 ATOM 6404 N ND1 . HIS A 1 817 ? 28.299 25.906 -11.408 1.00 34.15 ? 852 HIS A ND1 1 ATOM 6405 C CD2 . HIS A 1 817 ? 30.201 26.843 -11.930 1.00 36.03 ? 852 HIS A CD2 1 ATOM 6406 C CE1 . HIS A 1 817 ? 29.186 24.937 -11.548 1.00 35.91 ? 852 HIS A CE1 1 ATOM 6407 N NE2 . HIS A 1 817 ? 30.349 25.478 -11.864 1.00 29.23 ? 852 HIS A NE2 1 ATOM 6408 N N . THR A 1 818 ? 28.728 28.481 -8.047 1.00 23.98 ? 853 THR A N 1 ATOM 6409 C CA . THR A 1 818 ? 29.526 29.055 -6.960 1.00 26.28 ? 853 THR A CA 1 ATOM 6410 C C . THR A 1 818 ? 30.956 28.556 -6.870 1.00 36.54 ? 853 THR A C 1 ATOM 6411 O O . THR A 1 818 ? 31.773 29.176 -6.180 1.00 35.48 ? 853 THR A O 1 ATOM 6412 C CB . THR A 1 818 ? 28.876 28.843 -5.599 1.00 26.85 ? 853 THR A CB 1 ATOM 6413 O OG1 . THR A 1 818 ? 28.835 27.440 -5.304 1.00 30.48 ? 853 THR A OG1 1 ATOM 6414 C CG2 . THR A 1 818 ? 27.471 29.427 -5.602 1.00 27.35 ? 853 THR A CG2 1 ATOM 6415 N N . TYR A 1 819 ? 31.253 27.442 -7.538 1.00 26.35 ? 854 TYR A N 1 ATOM 6416 C CA . TYR A 1 819 ? 32.615 26.892 -7.530 1.00 32.27 ? 854 TYR A CA 1 ATOM 6417 C C . TYR A 1 819 ? 33.120 26.479 -6.147 1.00 41.70 ? 854 TYR A C 1 ATOM 6418 O O . TYR A 1 819 ? 34.326 26.466 -5.908 1.00 45.23 ? 854 TYR A O 1 ATOM 6419 C CB . TYR A 1 819 ? 33.609 27.877 -8.155 1.00 33.84 ? 854 TYR A CB 1 ATOM 6420 C CG . TYR A 1 819 ? 33.241 28.306 -9.553 1.00 31.49 ? 854 TYR A CG 1 ATOM 6421 C CD1 . TYR A 1 819 ? 33.617 27.541 -10.659 1.00 33.63 ? 854 TYR A CD1 1 ATOM 6422 C CD2 . TYR A 1 819 ? 32.502 29.464 -9.770 1.00 26.44 ? 854 TYR A CD2 1 ATOM 6423 C CE1 . TYR A 1 819 ? 33.273 27.933 -11.945 1.00 33.49 ? 854 TYR A CE1 1 ATOM 6424 C CE2 . TYR A 1 819 ? 32.151 29.863 -11.044 1.00 28.37 ? 854 TYR A CE2 1 ATOM 6425 C CZ . TYR A 1 819 ? 32.539 29.093 -12.132 1.00 37.60 ? 854 TYR A CZ 1 ATOM 6426 O OH . TYR A 1 819 ? 32.188 29.490 -13.405 1.00 35.21 ? 854 TYR A OH 1 ATOM 6427 N N . GLU A 1 820 ? 32.207 26.165 -5.234 1.00 43.74 ? 855 GLU A N 1 ATOM 6428 C CA . GLU A 1 820 ? 32.593 25.649 -3.921 1.00 43.18 ? 855 GLU A CA 1 ATOM 6429 C C . GLU A 1 820 ? 32.593 24.117 -3.931 1.00 54.87 ? 855 GLU A C 1 ATOM 6430 O O . GLU A 1 820 ? 33.617 23.479 -3.667 1.00 64.26 ? 855 GLU A O 1 ATOM 6431 C CB . GLU A 1 820 ? 31.645 26.158 -2.832 1.00 39.52 ? 855 GLU A CB 1 ATOM 6432 C CG . GLU A 1 820 ? 31.651 27.669 -2.653 1.00 35.86 ? 855 GLU A CG 1 ATOM 6433 C CD . GLU A 1 820 ? 32.748 28.155 -1.733 1.00 38.00 ? 855 GLU A CD 1 ATOM 6434 O OE1 . GLU A 1 820 ? 32.878 27.623 -0.594 1.00 41.58 ? 855 GLU A OE1 1 ATOM 6435 O OE2 . GLU A 1 820 ? 33.472 29.084 -2.146 1.00 39.16 ? 855 GLU A OE2 1 HETATM 6436 C C1 . NAG B 2 . ? -3.923 54.006 35.218 1.00 70.48 ? 901 NAG A C1 1 HETATM 6437 C C2 . NAG B 2 . ? -4.971 55.119 35.207 1.00 71.57 ? 901 NAG A C2 1 HETATM 6438 C C3 . NAG B 2 . ? -5.911 55.026 36.404 1.00 68.58 ? 901 NAG A C3 1 HETATM 6439 C C4 . NAG B 2 . ? -6.443 53.606 36.583 1.00 70.72 ? 901 NAG A C4 1 HETATM 6440 C C5 . NAG B 2 . ? -5.324 52.572 36.536 1.00 68.84 ? 901 NAG A C5 1 HETATM 6441 C C6 . NAG B 2 . ? -5.922 51.172 36.502 1.00 69.68 ? 901 NAG A C6 1 HETATM 6442 C C7 . NAG B 2 . ? -4.506 57.321 34.226 1.00 65.26 ? 901 NAG A C7 1 HETATM 6443 C C8 . NAG B 2 . ? -5.791 57.257 33.453 1.00 70.23 ? 901 NAG A C8 1 HETATM 6444 N N2 . NAG B 2 . ? -4.316 56.418 35.190 1.00 68.71 ? 901 NAG A N2 1 HETATM 6445 O O3 . NAG B 2 . ? -6.985 55.918 36.202 1.00 70.05 ? 901 NAG A O3 1 HETATM 6446 O O4 . NAG B 2 . ? -7.132 53.486 37.811 1.00 72.27 ? 901 NAG A O4 1 HETATM 6447 O O5 . NAG B 2 . ? -4.517 52.734 35.388 1.00 67.41 ? 901 NAG A O5 1 HETATM 6448 O O6 . NAG B 2 . ? -6.675 51.024 35.316 1.00 66.70 ? 901 NAG A O6 1 HETATM 6449 O O7 . NAG B 2 . ? -3.678 58.190 33.961 1.00 64.98 ? 901 NAG A O7 1 HETATM 6450 C C1 . NAG C 2 . ? -8.558 53.552 37.592 1.00 72.59 ? 902 NAG A C1 1 HETATM 6451 C C2 . NAG C 2 . ? -9.258 52.811 38.737 1.00 75.65 ? 902 NAG A C2 1 HETATM 6452 C C3 . NAG C 2 . ? -10.733 53.166 38.931 1.00 74.62 ? 902 NAG A C3 1 HETATM 6453 C C4 . NAG C 2 . ? -10.998 54.645 38.704 1.00 74.25 ? 902 NAG A C4 1 HETATM 6454 C C5 . NAG C 2 . ? -10.403 55.043 37.360 1.00 72.90 ? 902 NAG A C5 1 HETATM 6455 C C6 . NAG C 2 . ? -10.723 56.488 36.996 1.00 71.61 ? 902 NAG A C6 1 HETATM 6456 C C7 . NAG C 2 . ? -8.466 50.595 39.291 1.00 77.55 ? 902 NAG A C7 1 HETATM 6457 C C8 . NAG C 2 . ? -8.466 49.135 38.938 1.00 79.72 ? 902 NAG A C8 1 HETATM 6458 N N2 . NAG C 2 . ? -9.155 51.389 38.485 1.00 76.06 ? 902 NAG A N2 1 HETATM 6459 O O3 . NAG C 2 . ? -11.147 52.806 40.231 1.00 78.15 ? 902 NAG A O3 1 HETATM 6460 O O4 . NAG C 2 . ? -12.390 54.876 38.719 1.00 77.15 ? 902 NAG A O4 1 HETATM 6461 O O5 . NAG C 2 . ? -9.003 54.884 37.419 1.00 68.14 ? 902 NAG A O5 1 HETATM 6462 O O6 . NAG C 2 . ? -9.903 57.356 37.748 1.00 68.80 ? 902 NAG A O6 1 HETATM 6463 O O7 . NAG C 2 . ? -7.857 51.013 40.275 1.00 75.67 ? 902 NAG A O7 1 HETATM 6464 C C1 . NAG D 2 . ? 15.273 44.989 -5.840 1.00 19.89 ? 903 NAG A C1 1 HETATM 6465 C C2 . NAG D 2 . ? 15.818 45.780 -7.038 1.00 18.40 ? 903 NAG A C2 1 HETATM 6466 C C3 . NAG D 2 . ? 15.575 47.280 -6.828 1.00 24.32 ? 903 NAG A C3 1 HETATM 6467 C C4 . NAG D 2 . ? 14.142 47.608 -6.434 1.00 22.68 ? 903 NAG A C4 1 HETATM 6468 C C5 . NAG D 2 . ? 13.580 46.575 -5.456 1.00 20.88 ? 903 NAG A C5 1 HETATM 6469 C C6 . NAG D 2 . ? 12.069 46.703 -5.252 1.00 27.16 ? 903 NAG A C6 1 HETATM 6470 C C7 . NAG D 2 . ? 17.690 44.902 -8.388 1.00 22.00 ? 903 NAG A C7 1 HETATM 6471 C C8 . NAG D 2 . ? 19.192 44.824 -8.549 1.00 21.43 ? 903 NAG A C8 1 HETATM 6472 N N2 . NAG D 2 . ? 17.229 45.519 -7.288 1.00 18.81 ? 903 NAG A N2 1 HETATM 6473 O O3 . NAG D 2 . ? 15.914 47.974 -8.003 1.00 22.26 ? 903 NAG A O3 1 HETATM 6474 O O4 . NAG D 2 . ? 14.159 48.846 -5.756 1.00 22.40 ? 903 NAG A O4 1 HETATM 6475 O O5 . NAG D 2 . ? 13.878 45.252 -5.851 1.00 19.83 ? 903 NAG A O5 1 HETATM 6476 O O6 . NAG D 2 . ? 11.396 46.624 -6.494 1.00 26.67 ? 903 NAG A O6 1 HETATM 6477 O O7 . NAG D 2 . ? 16.970 44.428 -9.273 1.00 20.79 ? 903 NAG A O7 1 HETATM 6478 C C1 . NAG E 2 . ? 13.353 49.845 -6.387 1.00 25.90 ? 904 NAG A C1 1 HETATM 6479 C C2 . NAG E 2 . ? 13.057 50.880 -5.309 1.00 26.50 ? 904 NAG A C2 1 HETATM 6480 C C3 . NAG E 2 . ? 12.246 52.038 -5.880 1.00 36.08 ? 904 NAG A C3 1 HETATM 6481 C C4 . NAG E 2 . ? 12.860 52.567 -7.175 1.00 39.32 ? 904 NAG A C4 1 HETATM 6482 C C5 . NAG E 2 . ? 13.251 51.435 -8.127 1.00 35.26 ? 904 NAG A C5 1 HETATM 6483 C C6 . NAG E 2 . ? 14.053 51.949 -9.322 1.00 36.70 ? 904 NAG A C6 1 HETATM 6484 C C7 . NAG E 2 . ? 12.898 49.826 -3.094 1.00 31.89 ? 904 NAG A C7 1 HETATM 6485 C C8 . NAG E 2 . ? 11.986 49.306 -2.019 1.00 32.63 ? 904 NAG A C8 1 HETATM 6486 N N2 . NAG E 2 . ? 12.317 50.246 -4.228 1.00 27.00 ? 904 NAG A N2 1 HETATM 6487 O O3 . NAG E 2 . ? 12.150 53.034 -4.876 1.00 37.42 ? 904 NAG A O3 1 HETATM 6488 O O4 . NAG E 2 . ? 11.910 53.378 -7.836 1.00 44.09 ? 904 NAG A O4 1 HETATM 6489 O O5 . NAG E 2 . ? 14.014 50.429 -7.477 1.00 27.93 ? 904 NAG A O5 1 HETATM 6490 O O6 . NAG E 2 . ? 15.113 52.772 -8.884 1.00 39.18 ? 904 NAG A O6 1 HETATM 6491 O O7 . NAG E 2 . ? 14.116 49.838 -2.908 1.00 27.57 ? 904 NAG A O7 1 HETATM 6492 C C1 . BMA F 3 . ? 12.056 54.769 -7.489 1.00 41.83 ? 905 BMA A C1 1 HETATM 6493 C C2 . BMA F 3 . ? 11.748 55.620 -8.721 1.00 46.73 ? 905 BMA A C2 1 HETATM 6494 C C3 . BMA F 3 . ? 11.857 57.108 -8.396 1.00 50.64 ? 905 BMA A C3 1 HETATM 6495 C C4 . BMA F 3 . ? 11.043 57.433 -7.149 1.00 52.92 ? 905 BMA A C4 1 HETATM 6496 C C5 . BMA F 3 . ? 11.413 56.462 -6.027 1.00 46.23 ? 905 BMA A C5 1 HETATM 6497 C C6 . BMA F 3 . ? 10.626 56.704 -4.744 1.00 49.92 ? 905 BMA A C6 1 HETATM 6498 O O2 . BMA F 3 . ? 10.433 55.333 -9.152 1.00 48.34 ? 905 BMA A O2 1 HETATM 6499 O O3 . BMA F 3 . ? 11.410 57.888 -9.489 1.00 55.32 ? 905 BMA A O3 1 HETATM 6500 O O4 . BMA F 3 . ? 11.306 58.765 -6.761 1.00 54.25 ? 905 BMA A O4 1 HETATM 6501 O O5 . BMA F 3 . ? 11.167 55.143 -6.462 1.00 45.90 ? 905 BMA A O5 1 HETATM 6502 O O6 . BMA F 3 . ? 10.748 55.566 -3.910 1.00 48.46 ? 905 BMA A O6 1 HETATM 6503 C C1 . MAN G 4 . ? 10.126 55.814 -2.633 1.00 39.88 ? 906 MAN A C1 1 HETATM 6504 C C2 . MAN G 4 . ? 11.022 55.320 -1.495 1.00 41.43 ? 906 MAN A C2 1 HETATM 6505 C C3 . MAN G 4 . ? 11.157 53.794 -1.535 1.00 43.94 ? 906 MAN A C3 1 HETATM 6506 C C4 . MAN G 4 . ? 9.771 53.167 -1.534 1.00 45.27 ? 906 MAN A C4 1 HETATM 6507 C C5 . MAN G 4 . ? 8.911 53.767 -2.647 1.00 50.68 ? 906 MAN A C5 1 HETATM 6508 C C6 . MAN G 4 . ? 7.511 53.152 -2.591 1.00 37.18 ? 906 MAN A C6 1 HETATM 6509 O O2 . MAN G 4 . ? 10.473 55.710 -0.250 1.00 44.13 ? 906 MAN A O2 1 HETATM 6510 O O3 . MAN G 4 . ? 11.874 53.302 -0.415 1.00 41.64 ? 906 MAN A O3 1 HETATM 6511 O O4 . MAN G 4 . ? 9.866 51.766 -1.706 1.00 39.46 ? 906 MAN A O4 1 HETATM 6512 O O5 . MAN G 4 . ? 8.860 55.186 -2.537 1.00 41.69 ? 906 MAN A O5 1 HETATM 6513 O O6 . MAN G 4 . ? 6.952 53.273 -1.296 1.00 49.54 ? 906 MAN A O6 1 HETATM 6514 C C1 . MAN H 4 . ? 13.276 53.594 -0.571 1.00 42.81 ? 907 MAN A C1 1 HETATM 6515 C C2 . MAN H 4 . ? 14.133 52.450 -0.025 1.00 37.66 ? 907 MAN A C2 1 HETATM 6516 C C3 . MAN H 4 . ? 13.870 52.296 1.472 1.00 40.59 ? 907 MAN A C3 1 HETATM 6517 C C4 . MAN H 4 . ? 14.011 53.632 2.199 1.00 45.83 ? 907 MAN A C4 1 HETATM 6518 C C5 . MAN H 4 . ? 13.295 54.769 1.467 1.00 47.25 ? 907 MAN A C5 1 HETATM 6519 C C6 . MAN H 4 . ? 13.605 56.124 2.110 1.00 50.81 ? 907 MAN A C6 1 HETATM 6520 O O2 . MAN H 4 . ? 15.496 52.757 -0.254 1.00 38.28 ? 907 MAN A O2 1 HETATM 6521 O O3 . MAN H 4 . ? 14.801 51.395 2.040 1.00 40.57 ? 907 MAN A O3 1 HETATM 6522 O O4 . MAN H 4 . ? 13.471 53.513 3.501 1.00 45.81 ? 907 MAN A O4 1 HETATM 6523 O O5 . MAN H 4 . ? 13.649 54.782 0.098 1.00 42.25 ? 907 MAN A O5 1 HETATM 6524 O O6 . MAN H 4 . ? 14.833 56.646 1.638 1.00 55.91 ? 907 MAN A O6 1 HETATM 6525 C C1 . MAN I 4 . ? 16.056 52.009 -1.348 1.00 37.01 ? 908 MAN A C1 1 HETATM 6526 C C2 . MAN I 4 . ? 17.570 51.963 -1.161 1.00 31.47 ? 908 MAN A C2 1 HETATM 6527 C C3 . MAN I 4 . ? 18.130 53.372 -1.260 1.00 35.78 ? 908 MAN A C3 1 HETATM 6528 C C4 . MAN I 4 . ? 17.746 53.942 -2.627 1.00 39.00 ? 908 MAN A C4 1 HETATM 6529 C C5 . MAN I 4 . ? 16.231 53.876 -2.794 1.00 35.48 ? 908 MAN A C5 1 HETATM 6530 C C6 . MAN I 4 . ? 15.796 54.394 -4.161 1.00 39.04 ? 908 MAN A C6 1 HETATM 6531 O O2 . MAN I 4 . ? 18.181 51.193 -2.167 1.00 27.69 ? 908 MAN A O2 1 HETATM 6532 O O3 . MAN I 4 . ? 19.532 53.327 -1.116 1.00 33.54 ? 908 MAN A O3 1 HETATM 6533 O O4 . MAN I 4 . ? 18.173 55.284 -2.751 1.00 39.08 ? 908 MAN A O4 1 HETATM 6534 O O5 . MAN I 4 . ? 15.760 52.553 -2.621 1.00 32.72 ? 908 MAN A O5 1 HETATM 6535 O O6 . MAN I 4 . ? 14.441 54.780 -4.057 1.00 40.82 ? 908 MAN A O6 1 HETATM 6536 C C1 . NAG J 2 . ? 51.234 53.080 4.605 1.00 32.84 ? 909 NAG A C1 1 HETATM 6537 C C2 . NAG J 2 . ? 50.952 54.183 5.625 1.00 32.33 ? 909 NAG A C2 1 HETATM 6538 C C3 . NAG J 2 . ? 52.209 55.021 5.902 1.00 34.92 ? 909 NAG A C3 1 HETATM 6539 C C4 . NAG J 2 . ? 53.410 54.133 6.208 1.00 39.13 ? 909 NAG A C4 1 HETATM 6540 C C5 . NAG J 2 . ? 53.522 53.012 5.195 1.00 37.31 ? 909 NAG A C5 1 HETATM 6541 C C6 . NAG J 2 . ? 54.607 52.040 5.624 1.00 41.48 ? 909 NAG A C6 1 HETATM 6542 C C7 . NAG J 2 . ? 48.683 55.043 5.819 1.00 33.16 ? 909 NAG A C7 1 HETATM 6543 C C8 . NAG J 2 . ? 47.642 55.982 5.289 1.00 31.52 ? 909 NAG A C8 1 HETATM 6544 N N2 . NAG J 2 . ? 49.846 55.004 5.159 1.00 26.64 ? 909 NAG A N2 1 HETATM 6545 O O3 . NAG J 2 . ? 51.973 55.874 6.990 1.00 34.39 ? 909 NAG A O3 1 HETATM 6546 O O4 . NAG J 2 . ? 54.618 54.865 6.161 1.00 46.26 ? 909 NAG A O4 1 HETATM 6547 O O5 . NAG J 2 . ? 52.306 52.299 5.079 1.00 35.20 ? 909 NAG A O5 1 HETATM 6548 O O6 . NAG J 2 . ? 54.666 51.030 4.642 1.00 38.02 ? 909 NAG A O6 1 HETATM 6549 O O7 . NAG J 2 . ? 48.431 54.366 6.821 1.00 30.05 ? 909 NAG A O7 1 HETATM 6550 C C1 . NAG K 2 . ? 55.042 55.249 7.486 1.00 47.65 ? 910 NAG A C1 1 HETATM 6551 C C2 . NAG K 2 . ? 56.572 55.149 7.555 1.00 59.94 ? 910 NAG A C2 1 HETATM 6552 C C3 . NAG K 2 . ? 57.234 56.079 8.572 1.00 61.31 ? 910 NAG A C3 1 HETATM 6553 C C4 . NAG K 2 . ? 56.624 57.469 8.520 1.00 58.06 ? 910 NAG A C4 1 HETATM 6554 C C5 . NAG K 2 . ? 55.114 57.381 8.715 1.00 60.48 ? 910 NAG A C5 1 HETATM 6555 C C6 . NAG K 2 . ? 54.450 58.736 8.499 1.00 60.16 ? 910 NAG A C6 1 HETATM 6556 C C7 . NAG K 2 . ? 57.781 53.102 7.006 1.00 56.53 ? 910 NAG A C7 1 HETATM 6557 C C8 . NAG K 2 . ? 58.485 51.921 7.610 1.00 62.85 ? 910 NAG A C8 1 HETATM 6558 N N2 . NAG K 2 . ? 56.963 53.772 7.819 1.00 61.79 ? 910 NAG A N2 1 HETATM 6559 O O3 . NAG K 2 . ? 58.620 56.169 8.309 1.00 63.81 ? 910 NAG A O3 1 HETATM 6560 O O4 . NAG K 2 . ? 57.214 58.270 9.523 1.00 64.96 ? 910 NAG A O4 1 HETATM 6561 O O5 . NAG K 2 . ? 54.509 56.524 7.767 1.00 55.12 ? 910 NAG A O5 1 HETATM 6562 O O6 . NAG K 2 . ? 53.896 58.764 7.195 1.00 57.95 ? 910 NAG A O6 1 HETATM 6563 O O7 . NAG K 2 . ? 57.967 53.408 5.826 1.00 54.38 ? 910 NAG A O7 1 HETATM 6564 ZN ZN . ZN L 5 . ? 21.755 34.933 13.030 1.00 24.01 ? 911 ZN A ZN 1 HETATM 6565 ZN ZN . ZN M 5 . ? 25.633 34.844 15.192 1.00 18.52 ? 912 ZN A ZN 1 HETATM 6566 CA CA . CA N 6 . ? 22.672 51.724 -13.005 1.00 27.13 ? 913 CA A CA 1 HETATM 6567 NA NA . NA O 7 . ? 47.965 42.991 -9.149 1.00 30.23 ? 914 NA A NA 1 HETATM 6568 K K . K P 8 . ? 45.414 53.264 -26.995 1.00 47.28 ? 915 K A K 1 HETATM 6569 S S . SCN Q 9 . ? 28.325 51.046 12.767 1.00 32.26 ? 916 SCN A S 1 HETATM 6570 C C . SCN Q 9 . ? 29.433 50.712 14.170 1.00 46.15 ? 916 SCN A C 1 HETATM 6571 N N . SCN Q 9 . ? 30.165 50.473 15.064 1.00 61.01 ? 916 SCN A N 1 HETATM 6572 S S . SCN R 9 . ? 27.348 43.748 9.708 1.00 41.25 ? 917 SCN A S 1 HETATM 6573 C C . SCN R 9 . ? 27.922 43.750 11.402 1.00 33.95 ? 917 SCN A C 1 HETATM 6574 N N . SCN R 9 . ? 28.244 43.767 12.542 1.00 44.81 ? 917 SCN A N 1 HETATM 6575 C C1 . EDO S 10 . ? 12.423 37.267 -15.518 1.00 33.77 ? 918 EDO A C1 1 HETATM 6576 O O1 . EDO S 10 . ? 13.659 36.613 -15.837 1.00 34.69 ? 918 EDO A O1 1 HETATM 6577 C C2 . EDO S 10 . ? 11.796 37.782 -16.807 1.00 41.37 ? 918 EDO A C2 1 HETATM 6578 O O2 . EDO S 10 . ? 11.873 36.762 -17.819 1.00 33.29 ? 918 EDO A O2 1 HETATM 6579 C C1 . EDO T 10 . ? 4.601 17.275 3.106 1.00 35.38 ? 919 EDO A C1 1 HETATM 6580 O O1 . EDO T 10 . ? 4.803 18.319 2.144 1.00 30.43 ? 919 EDO A O1 1 HETATM 6581 C C2 . EDO T 10 . ? 4.303 15.930 2.441 1.00 41.93 ? 919 EDO A C2 1 HETATM 6582 O O2 . EDO T 10 . ? 3.036 15.908 1.748 1.00 37.21 ? 919 EDO A O2 1 HETATM 6583 C C1 . EDO U 10 . ? 38.982 39.893 -27.561 1.00 39.86 ? 920 EDO A C1 1 HETATM 6584 O O1 . EDO U 10 . ? 40.187 40.625 -27.353 1.00 40.31 ? 920 EDO A O1 1 HETATM 6585 C C2 . EDO U 10 . ? 39.084 39.056 -28.813 1.00 35.39 ? 920 EDO A C2 1 HETATM 6586 O O2 . EDO U 10 . ? 39.955 37.976 -28.513 1.00 41.35 ? 920 EDO A O2 1 HETATM 6587 C C1 . EDO V 10 . ? 23.337 51.161 -21.176 1.00 39.61 ? 921 EDO A C1 1 HETATM 6588 O O1 . EDO V 10 . ? 22.997 50.734 -19.845 1.00 37.54 ? 921 EDO A O1 1 HETATM 6589 C C2 . EDO V 10 . ? 22.838 50.143 -22.192 1.00 31.08 ? 921 EDO A C2 1 HETATM 6590 O O2 . EDO V 10 . ? 21.406 50.073 -22.086 1.00 35.04 ? 921 EDO A O2 1 HETATM 6591 C C1 . EDO W 10 . ? 19.967 14.960 1.707 1.00 32.66 ? 922 EDO A C1 1 HETATM 6592 O O1 . EDO W 10 . ? 19.263 15.314 0.502 1.00 31.21 ? 922 EDO A O1 1 HETATM 6593 C C2 . EDO W 10 . ? 19.682 13.510 2.108 1.00 38.97 ? 922 EDO A C2 1 HETATM 6594 O O2 . EDO W 10 . ? 19.796 12.632 0.975 1.00 30.48 ? 922 EDO A O2 1 HETATM 6595 C C1 . EDO X 10 . ? 34.388 51.981 -16.574 1.00 34.00 ? 923 EDO A C1 1 HETATM 6596 O O1 . EDO X 10 . ? 34.480 52.952 -15.529 1.00 46.05 ? 923 EDO A O1 1 HETATM 6597 C C2 . EDO X 10 . ? 35.794 51.501 -16.905 1.00 37.81 ? 923 EDO A C2 1 HETATM 6598 O O2 . EDO X 10 . ? 36.471 51.175 -15.681 1.00 41.74 ? 923 EDO A O2 1 HETATM 6599 C C1 . EDO Y 10 . ? 38.959 37.300 0.936 1.00 30.90 ? 924 EDO A C1 1 HETATM 6600 O O1 . EDO Y 10 . ? 39.384 35.942 0.771 1.00 37.89 ? 924 EDO A O1 1 HETATM 6601 C C2 . EDO Y 10 . ? 38.770 37.898 -0.450 1.00 30.58 ? 924 EDO A C2 1 HETATM 6602 O O2 . EDO Y 10 . ? 37.637 37.266 -1.076 1.00 32.83 ? 924 EDO A O2 1 HETATM 6603 C C1 . EDO Z 10 . ? 32.973 56.656 3.401 1.00 35.93 ? 925 EDO A C1 1 HETATM 6604 O O1 . EDO Z 10 . ? 31.855 55.915 2.909 1.00 32.07 ? 925 EDO A O1 1 HETATM 6605 C C2 . EDO Z 10 . ? 33.883 55.762 4.238 1.00 34.06 ? 925 EDO A C2 1 HETATM 6606 O O2 . EDO Z 10 . ? 34.385 54.648 3.487 1.00 24.91 ? 925 EDO A O2 1 HETATM 6607 C C1 . EDO AA 10 . ? 25.564 56.672 -25.468 1.00 44.16 ? 926 EDO A C1 1 HETATM 6608 O O1 . EDO AA 10 . ? 25.371 57.632 -24.421 1.00 58.33 ? 926 EDO A O1 1 HETATM 6609 C C2 . EDO AA 10 . ? 26.203 57.349 -26.670 1.00 47.00 ? 926 EDO A C2 1 HETATM 6610 O O2 . EDO AA 10 . ? 27.586 57.626 -26.414 1.00 40.30 ? 926 EDO A O2 1 HETATM 6611 C C1 . EDO BA 10 . ? 22.005 24.933 -14.065 1.00 31.64 ? 927 EDO A C1 1 HETATM 6612 O O1 . EDO BA 10 . ? 23.316 25.247 -14.535 1.00 29.63 ? 927 EDO A O1 1 HETATM 6613 C C2 . EDO BA 10 . ? 21.948 23.456 -13.678 1.00 36.21 ? 927 EDO A C2 1 HETATM 6614 O O2 . EDO BA 10 . ? 23.222 23.074 -13.147 1.00 46.65 ? 927 EDO A O2 1 HETATM 6615 C C1 . EDO CA 10 . ? 13.731 47.634 -18.492 1.00 43.67 ? 928 EDO A C1 1 HETATM 6616 O O1 . EDO CA 10 . ? 13.485 48.751 -17.626 1.00 47.44 ? 928 EDO A O1 1 HETATM 6617 C C2 . EDO CA 10 . ? 15.012 46.933 -18.065 1.00 41.14 ? 928 EDO A C2 1 HETATM 6618 O O2 . EDO CA 10 . ? 16.126 47.836 -18.163 1.00 38.29 ? 928 EDO A O2 1 HETATM 6619 C C1 . EDO DA 10 . ? 53.034 44.129 6.657 1.00 40.93 ? 929 EDO A C1 1 HETATM 6620 O O1 . EDO DA 10 . ? 51.871 43.798 7.424 1.00 49.47 ? 929 EDO A O1 1 HETATM 6621 C C2 . EDO DA 10 . ? 52.670 45.207 5.645 1.00 42.33 ? 929 EDO A C2 1 HETATM 6622 O O2 . EDO DA 10 . ? 53.731 45.330 4.684 1.00 43.16 ? 929 EDO A O2 1 HETATM 6623 C C1 . EDO EA 10 . ? 39.956 42.971 -14.455 1.00 24.60 ? 930 EDO A C1 1 HETATM 6624 O O1 . EDO EA 10 . ? 38.836 43.293 -13.622 1.00 24.51 ? 930 EDO A O1 1 HETATM 6625 C C2 . EDO EA 10 . ? 40.741 44.249 -14.781 1.00 23.49 ? 930 EDO A C2 1 HETATM 6626 O O2 . EDO EA 10 . ? 39.936 45.165 -15.539 1.00 26.30 ? 930 EDO A O2 1 HETATM 6627 C C1 . EDO FA 10 . ? 39.544 37.610 -6.800 1.00 27.91 ? 931 EDO A C1 1 HETATM 6628 O O1 . EDO FA 10 . ? 39.637 37.250 -5.417 1.00 31.83 ? 931 EDO A O1 1 HETATM 6629 C C2 . EDO FA 10 . ? 40.913 38.048 -7.305 1.00 29.47 ? 931 EDO A C2 1 HETATM 6630 O O2 . EDO FA 10 . ? 41.938 37.201 -6.774 1.00 38.61 ? 931 EDO A O2 1 HETATM 6631 C C1 . EDO GA 10 . ? 18.131 55.106 3.072 1.00 36.01 ? 932 EDO A C1 1 HETATM 6632 O O1 . EDO GA 10 . ? 17.827 54.962 1.679 1.00 47.20 ? 932 EDO A O1 1 HETATM 6633 C C2 . EDO GA 10 . ? 18.788 53.827 3.557 1.00 32.65 ? 932 EDO A C2 1 HETATM 6634 O O2 . EDO GA 10 . ? 17.908 52.719 3.347 1.00 29.42 ? 932 EDO A O2 1 HETATM 6635 C C1 . EDO HA 10 . ? 27.413 25.217 -15.586 1.00 38.71 ? 933 EDO A C1 1 HETATM 6636 O O1 . EDO HA 10 . ? 26.812 24.910 -14.318 1.00 36.51 ? 933 EDO A O1 1 HETATM 6637 C C2 . EDO HA 10 . ? 28.532 24.227 -15.894 1.00 39.98 ? 933 EDO A C2 1 HETATM 6638 O O2 . EDO HA 10 . ? 29.662 24.501 -15.055 1.00 51.21 ? 933 EDO A O2 1 HETATM 6639 C C1 . EDO IA 10 . ? 34.115 50.352 -11.865 1.00 43.02 ? 934 EDO A C1 1 HETATM 6640 O O1 . EDO IA 10 . ? 32.699 50.500 -11.703 1.00 41.81 ? 934 EDO A O1 1 HETATM 6641 C C2 . EDO IA 10 . ? 34.390 49.090 -12.678 1.00 34.61 ? 934 EDO A C2 1 HETATM 6642 O O2 . EDO IA 10 . ? 33.483 48.088 -12.202 1.00 34.96 ? 934 EDO A O2 1 HETATM 6643 C C1 . EDO JA 10 . ? 3.654 16.400 -5.000 1.00 39.23 ? 935 EDO A C1 1 HETATM 6644 O O1 . EDO JA 10 . ? 4.644 15.591 -4.346 1.00 35.16 ? 935 EDO A O1 1 HETATM 6645 C C2 . EDO JA 10 . ? 3.829 16.317 -6.514 1.00 47.70 ? 935 EDO A C2 1 HETATM 6646 O O2 . EDO JA 10 . ? 3.056 17.343 -7.148 1.00 47.60 ? 935 EDO A O2 1 HETATM 6647 S S . SO4 KA 11 . ? 24.373 37.557 14.916 1.00 34.70 ? 936 SO4 A S 1 HETATM 6648 O O1 . SO4 KA 11 . ? 23.654 36.315 15.132 1.00 37.83 ? 936 SO4 A O1 1 HETATM 6649 O O2 . SO4 KA 11 . ? 24.069 37.939 13.516 1.00 23.41 ? 936 SO4 A O2 1 HETATM 6650 O O3 . SO4 KA 11 . ? 25.803 37.387 15.139 1.00 40.11 ? 936 SO4 A O3 1 HETATM 6651 O O4 . SO4 KA 11 . ? 23.896 38.609 15.840 1.00 32.56 ? 936 SO4 A O4 1 HETATM 6652 C CAK . DWV LA 12 . ? 15.801 39.102 18.488 1.00 47.59 ? 937 DWV A CAK 1 HETATM 6653 C CAI . DWV LA 12 . ? 17.215 39.124 18.955 1.00 53.58 ? 937 DWV A CAI 1 HETATM 6654 N NAU . DWV LA 12 . ? 18.113 39.614 17.949 1.00 53.83 ? 937 DWV A NAU 1 HETATM 6655 C CAA . DWV LA 12 . ? 19.387 40.091 18.331 1.00 53.39 ? 937 DWV A CAA 1 HETATM 6656 C CAJ . DWV LA 12 . ? 18.002 38.838 16.751 1.00 45.06 ? 937 DWV A CAJ 1 HETATM 6657 C CAL . DWV LA 12 . ? 16.652 38.999 16.154 1.00 44.91 ? 937 DWV A CAL 1 HETATM 6658 N NAV . DWV LA 12 . ? 15.602 38.797 17.099 1.00 46.51 ? 937 DWV A NAV 1 HETATM 6659 C CAR . DWV LA 12 . ? 14.325 38.252 16.730 1.00 42.97 ? 937 DWV A CAR 1 HETATM 6660 S SAN . DWV LA 12 . ? 13.661 37.952 15.150 1.00 46.06 ? 937 DWV A SAN 1 HETATM 6661 N NAM . DWV LA 12 . ? 13.388 37.825 17.632 1.00 38.56 ? 937 DWV A NAM 1 HETATM 6662 C CAS . DWV LA 12 . ? 12.233 37.305 17.086 1.00 36.42 ? 937 DWV A CAS 1 HETATM 6663 O OAB . DWV LA 12 . ? 11.185 36.823 17.860 1.00 38.40 ? 937 DWV A OAB 1 HETATM 6664 C CAT . DWV LA 12 . ? 12.176 37.282 15.640 1.00 39.76 ? 937 DWV A CAT 1 HETATM 6665 C CAE . DWV LA 12 . ? 10.956 36.735 14.863 1.00 42.54 ? 937 DWV A CAE 1 HETATM 6666 C CAO . DWV LA 12 . ? 11.006 36.702 13.314 1.00 42.37 ? 937 DWV A CAO 1 HETATM 6667 C CAH . DWV LA 12 . ? 11.360 37.876 12.533 1.00 47.25 ? 937 DWV A CAH 1 HETATM 6668 C CAQ . DWV LA 12 . ? 11.359 37.806 11.201 1.00 48.64 ? 937 DWV A CAQ 1 HETATM 6669 CL CLD . DWV LA 12 . ? 11.806 39.221 10.303 1.00 64.04 ? 937 DWV A CLD 1 HETATM 6670 C CAP . DWV LA 12 . ? 10.998 36.594 10.570 1.00 52.36 ? 937 DWV A CAP 1 HETATM 6671 CL CLC . DWV LA 12 . ? 10.964 36.411 8.881 1.00 61.64 ? 937 DWV A CLC 1 HETATM 6672 C CAG . DWV LA 12 . ? 10.637 35.456 11.355 1.00 43.08 ? 937 DWV A CAG 1 HETATM 6673 C CAF . DWV LA 12 . ? 10.639 35.528 12.695 1.00 31.37 ? 937 DWV A CAF 1 HETATM 6674 O O . HOH MA 13 . ? 20.152 35.313 -0.950 1.00 19.81 ? 1001 HOH A O 1 HETATM 6675 O O . HOH MA 13 . ? 27.217 51.673 8.296 1.00 20.41 ? 1002 HOH A O 1 HETATM 6676 O O . HOH MA 13 . ? 8.862 45.926 -1.238 1.00 24.95 ? 1003 HOH A O 1 HETATM 6677 O O . HOH MA 13 . ? 24.089 48.230 -19.357 1.00 28.80 ? 1004 HOH A O 1 HETATM 6678 O O . HOH MA 13 . ? 31.816 45.428 -9.523 1.00 21.48 ? 1005 HOH A O 1 HETATM 6679 O O . HOH MA 13 . ? 29.427 46.215 -6.230 1.00 18.00 ? 1006 HOH A O 1 HETATM 6680 O O . HOH MA 13 . ? 20.725 37.623 -6.093 1.00 24.42 ? 1007 HOH A O 1 HETATM 6681 O O . HOH MA 13 . ? 22.423 45.729 -7.109 1.00 22.93 ? 1008 HOH A O 1 HETATM 6682 O O . HOH MA 13 . ? 21.823 31.640 -13.927 1.00 22.13 ? 1009 HOH A O 1 HETATM 6683 O O . HOH MA 13 . ? 8.753 31.808 -7.146 1.00 24.85 ? 1010 HOH A O 1 HETATM 6684 O O . HOH MA 13 . ? 36.423 44.609 -8.840 1.00 23.70 ? 1011 HOH A O 1 HETATM 6685 O O . HOH MA 13 . ? 47.420 44.216 -15.505 1.00 33.67 ? 1012 HOH A O 1 HETATM 6686 O O . HOH MA 13 . ? 38.228 46.196 15.786 1.00 27.27 ? 1013 HOH A O 1 HETATM 6687 O O . HOH MA 13 . ? 16.780 46.683 -15.454 1.00 34.72 ? 1014 HOH A O 1 HETATM 6688 O O . HOH MA 13 . ? 44.091 38.038 -4.847 1.00 27.71 ? 1015 HOH A O 1 HETATM 6689 O O . HOH MA 13 . ? 11.163 44.464 -8.173 1.00 31.15 ? 1016 HOH A O 1 HETATM 6690 O O . HOH MA 13 . ? 29.281 38.817 -9.354 1.00 21.41 ? 1017 HOH A O 1 HETATM 6691 O O . HOH MA 13 . ? 24.476 47.533 -6.136 1.00 19.89 ? 1018 HOH A O 1 HETATM 6692 O O . HOH MA 13 . ? 42.296 41.571 -11.378 1.00 22.36 ? 1019 HOH A O 1 HETATM 6693 O O . HOH MA 13 . ? 47.495 41.416 10.689 1.00 27.56 ? 1020 HOH A O 1 HETATM 6694 O O . HOH MA 13 . ? 26.782 31.552 -12.454 1.00 23.35 ? 1021 HOH A O 1 HETATM 6695 O O . HOH MA 13 . ? 1.885 17.709 0.044 1.00 32.42 ? 1022 HOH A O 1 HETATM 6696 O O . HOH MA 13 . ? 43.754 31.164 -14.291 1.00 32.19 ? 1023 HOH A O 1 HETATM 6697 O O . HOH MA 13 . ? 43.421 31.421 -11.651 1.00 28.80 ? 1024 HOH A O 1 HETATM 6698 O O . HOH MA 13 . ? -2.784 23.784 -0.497 1.00 34.52 ? 1025 HOH A O 1 HETATM 6699 O O . HOH MA 13 . ? 23.273 37.426 -7.365 1.00 20.91 ? 1026 HOH A O 1 HETATM 6700 O O . HOH MA 13 . ? 10.602 36.862 -3.223 1.00 17.64 ? 1027 HOH A O 1 HETATM 6701 O O . HOH MA 13 . ? 26.566 35.539 -4.135 1.00 21.06 ? 1028 HOH A O 1 HETATM 6702 O O . HOH MA 13 . ? 17.793 33.990 -6.653 1.00 18.60 ? 1029 HOH A O 1 HETATM 6703 O O . HOH MA 13 . ? 16.793 49.868 -3.934 1.00 24.89 ? 1030 HOH A O 1 HETATM 6704 O O . HOH MA 13 . ? 17.667 41.346 -29.470 1.00 41.98 ? 1031 HOH A O 1 HETATM 6705 O O . HOH MA 13 . ? 45.058 49.061 -18.104 1.00 32.06 ? 1032 HOH A O 1 HETATM 6706 O O . HOH MA 13 . ? 44.013 40.349 -0.654 1.00 20.80 ? 1033 HOH A O 1 HETATM 6707 O O . HOH MA 13 . ? 39.749 43.163 -11.082 1.00 22.92 ? 1034 HOH A O 1 HETATM 6708 O O . HOH MA 13 . ? 15.597 36.738 -8.290 1.00 24.83 ? 1035 HOH A O 1 HETATM 6709 O O . HOH MA 13 . ? 15.189 30.654 -7.638 1.00 22.38 ? 1036 HOH A O 1 HETATM 6710 O O . HOH MA 13 . ? 38.189 38.676 -3.438 1.00 23.78 ? 1037 HOH A O 1 HETATM 6711 O O . HOH MA 13 . ? 22.470 44.294 -0.423 1.00 16.56 ? 1038 HOH A O 1 HETATM 6712 O O . HOH MA 13 . ? 36.012 48.187 15.487 1.00 28.63 ? 1039 HOH A O 1 HETATM 6713 O O . HOH MA 13 . ? 18.791 46.413 -5.120 1.00 21.82 ? 1040 HOH A O 1 HETATM 6714 O O . HOH MA 13 . ? 27.823 44.218 -4.925 1.00 17.39 ? 1041 HOH A O 1 HETATM 6715 O O . HOH MA 13 . ? 38.227 56.335 -21.469 1.00 39.60 ? 1042 HOH A O 1 HETATM 6716 O O . HOH MA 13 . ? 23.295 41.750 -0.109 1.00 20.43 ? 1043 HOH A O 1 HETATM 6717 O O . HOH MA 13 . ? 10.158 26.586 -10.951 1.00 29.36 ? 1044 HOH A O 1 HETATM 6718 O O . HOH MA 13 . ? 20.724 53.057 -13.442 1.00 30.81 ? 1045 HOH A O 1 HETATM 6719 O O . HOH MA 13 . ? 8.871 43.749 0.316 1.00 20.84 ? 1046 HOH A O 1 HETATM 6720 O O . HOH MA 13 . ? 32.768 57.198 14.437 1.00 32.66 ? 1047 HOH A O 1 HETATM 6721 O O . HOH MA 13 . ? 43.651 43.193 -3.941 1.00 21.40 ? 1048 HOH A O 1 HETATM 6722 O O . HOH MA 13 . ? 12.435 36.499 0.786 1.00 16.15 ? 1049 HOH A O 1 HETATM 6723 O O . HOH MA 13 . ? 39.174 29.511 -26.139 1.00 41.36 ? 1050 HOH A O 1 HETATM 6724 O O . HOH MA 13 . ? -0.282 28.377 3.917 1.00 24.68 ? 1051 HOH A O 1 HETATM 6725 O O . HOH MA 13 . ? 17.192 39.930 -8.251 1.00 20.76 ? 1052 HOH A O 1 HETATM 6726 O O . HOH MA 13 . ? 0.446 19.789 7.343 1.00 30.28 ? 1053 HOH A O 1 HETATM 6727 O O . HOH MA 13 . ? 33.430 39.769 4.371 1.00 18.76 ? 1054 HOH A O 1 HETATM 6728 O O . HOH MA 13 . ? 33.810 37.393 2.908 1.00 18.21 ? 1055 HOH A O 1 HETATM 6729 O O . HOH MA 13 . ? 25.468 27.605 14.697 1.00 20.54 ? 1056 HOH A O 1 HETATM 6730 O O . HOH MA 13 . ? 23.649 39.036 -1.014 1.00 24.21 ? 1057 HOH A O 1 HETATM 6731 O O . HOH MA 13 . ? 14.822 42.654 -8.771 1.00 20.63 ? 1058 HOH A O 1 HETATM 6732 O O . HOH MA 13 . ? 51.456 39.821 -8.469 1.00 36.30 ? 1059 HOH A O 1 HETATM 6733 O O . HOH MA 13 . ? 33.656 24.988 8.729 1.00 38.15 ? 1060 HOH A O 1 HETATM 6734 O O . HOH MA 13 . ? 44.591 42.832 -1.347 1.00 20.85 ? 1061 HOH A O 1 HETATM 6735 O O . HOH MA 13 . ? 29.777 40.969 -31.968 1.00 39.80 ? 1062 HOH A O 1 HETATM 6736 O O . HOH MA 13 . ? 40.597 30.096 5.154 1.00 28.99 ? 1063 HOH A O 1 HETATM 6737 O O . HOH MA 13 . ? 25.183 44.405 -7.907 1.00 25.88 ? 1064 HOH A O 1 HETATM 6738 O O . HOH MA 13 . ? 15.807 12.699 1.579 1.00 26.46 ? 1065 HOH A O 1 HETATM 6739 O O . HOH MA 13 . ? 0.677 44.850 -0.243 1.00 32.11 ? 1066 HOH A O 1 HETATM 6740 O O . HOH MA 13 . ? 33.033 36.174 -25.833 1.00 33.63 ? 1067 HOH A O 1 HETATM 6741 O O . HOH MA 13 . ? 38.017 33.104 -6.515 1.00 31.33 ? 1068 HOH A O 1 HETATM 6742 O O . HOH MA 13 . ? 20.553 55.247 0.438 1.00 25.73 ? 1069 HOH A O 1 HETATM 6743 O O . HOH MA 13 . ? 36.326 51.056 15.263 1.00 28.35 ? 1070 HOH A O 1 HETATM 6744 O O . HOH MA 13 . ? 19.796 51.954 -21.445 1.00 36.89 ? 1071 HOH A O 1 HETATM 6745 O O . HOH MA 13 . ? 19.774 50.214 18.223 1.00 34.69 ? 1072 HOH A O 1 HETATM 6746 O O . HOH MA 13 . ? 24.137 11.939 13.588 1.00 45.71 ? 1073 HOH A O 1 HETATM 6747 O O . HOH MA 13 . ? 1.565 15.660 9.468 1.00 30.34 ? 1074 HOH A O 1 HETATM 6748 O O . HOH MA 13 . ? 24.110 35.736 -5.279 1.00 24.10 ? 1075 HOH A O 1 HETATM 6749 O O . HOH MA 13 . ? 4.773 22.788 -9.091 1.00 35.54 ? 1076 HOH A O 1 HETATM 6750 O O . HOH MA 13 . ? -7.455 30.586 22.177 1.00 41.30 ? 1077 HOH A O 1 HETATM 6751 O O . HOH MA 13 . ? 23.576 37.632 -3.327 1.00 23.95 ? 1078 HOH A O 1 HETATM 6752 O O . HOH MA 13 . ? 28.842 55.475 1.323 1.00 30.55 ? 1079 HOH A O 1 HETATM 6753 O O . HOH MA 13 . ? -14.500 29.211 15.832 1.00 39.92 ? 1080 HOH A O 1 HETATM 6754 O O . HOH MA 13 . ? 13.564 15.584 19.791 1.00 32.05 ? 1081 HOH A O 1 HETATM 6755 O O . HOH MA 13 . ? 25.722 29.271 -2.274 1.00 24.58 ? 1082 HOH A O 1 HETATM 6756 O O . HOH MA 13 . ? 20.825 36.937 -3.090 1.00 26.73 ? 1083 HOH A O 1 HETATM 6757 O O . HOH MA 13 . ? 40.775 49.821 -10.786 1.00 32.82 ? 1084 HOH A O 1 HETATM 6758 O O . HOH MA 13 . ? 33.438 23.710 -17.929 1.00 33.42 ? 1085 HOH A O 1 HETATM 6759 O O . HOH MA 13 . ? 25.933 19.077 -17.056 1.00 36.92 ? 1086 HOH A O 1 HETATM 6760 O O . HOH MA 13 . ? 45.840 37.154 -21.727 1.00 35.18 ? 1087 HOH A O 1 HETATM 6761 O O . HOH MA 13 . ? 41.655 41.037 -25.377 1.00 38.85 ? 1088 HOH A O 1 HETATM 6762 O O . HOH MA 13 . ? 10.401 33.803 -5.856 1.00 20.71 ? 1089 HOH A O 1 HETATM 6763 O O . HOH MA 13 . ? 14.094 47.952 -10.044 1.00 28.90 ? 1090 HOH A O 1 HETATM 6764 O O . HOH MA 13 . ? 3.780 34.491 15.389 1.00 28.69 ? 1091 HOH A O 1 HETATM 6765 O O . HOH MA 13 . ? 0.697 12.253 12.259 1.00 41.17 ? 1092 HOH A O 1 HETATM 6766 O O . HOH MA 13 . ? -1.692 26.475 23.938 1.00 37.39 ? 1093 HOH A O 1 HETATM 6767 O O . HOH MA 13 . ? 38.499 48.642 -5.148 1.00 28.04 ? 1094 HOH A O 1 HETATM 6768 O O . HOH MA 13 . ? 48.374 60.489 0.054 1.00 32.12 ? 1095 HOH A O 1 HETATM 6769 O O . HOH MA 13 . ? -9.434 27.772 15.653 1.00 35.20 ? 1096 HOH A O 1 HETATM 6770 O O . HOH MA 13 . ? 4.681 38.766 -8.759 1.00 37.84 ? 1097 HOH A O 1 HETATM 6771 O O . HOH MA 13 . ? 17.506 31.431 -6.152 1.00 20.01 ? 1098 HOH A O 1 HETATM 6772 O O . HOH MA 13 . ? 13.920 40.046 -9.874 1.00 29.28 ? 1099 HOH A O 1 HETATM 6773 O O . HOH MA 13 . ? 30.511 50.240 -39.727 1.00 49.66 ? 1100 HOH A O 1 HETATM 6774 O O . HOH MA 13 . ? 14.568 40.244 -18.240 1.00 34.05 ? 1101 HOH A O 1 HETATM 6775 O O . HOH MA 13 . ? 37.536 25.696 17.728 1.00 39.39 ? 1102 HOH A O 1 HETATM 6776 O O . HOH MA 13 . ? 2.337 11.763 9.828 1.00 40.37 ? 1103 HOH A O 1 HETATM 6777 O O . HOH MA 13 . ? -5.041 18.140 9.915 1.00 37.54 ? 1104 HOH A O 1 HETATM 6778 O O . HOH MA 13 . ? 9.003 24.516 -12.462 1.00 36.11 ? 1105 HOH A O 1 HETATM 6779 O O . HOH MA 13 . ? 31.926 39.277 13.010 1.00 26.98 ? 1106 HOH A O 1 HETATM 6780 O O . HOH MA 13 . ? 44.652 53.802 -3.612 1.00 29.73 ? 1107 HOH A O 1 HETATM 6781 O O . HOH MA 13 . ? 15.011 25.329 -6.011 1.00 30.47 ? 1108 HOH A O 1 HETATM 6782 O O . HOH MA 13 . ? 47.242 59.853 3.837 1.00 36.67 ? 1109 HOH A O 1 HETATM 6783 O O . HOH MA 13 . ? 31.799 49.082 3.252 1.00 18.78 ? 1110 HOH A O 1 HETATM 6784 O O . HOH MA 13 . ? 20.255 30.688 -7.083 1.00 28.75 ? 1111 HOH A O 1 HETATM 6785 O O . HOH MA 13 . ? 19.905 22.433 -28.501 1.00 44.26 ? 1112 HOH A O 1 HETATM 6786 O O . HOH MA 13 . ? 12.603 34.555 -20.702 1.00 31.15 ? 1113 HOH A O 1 HETATM 6787 O O . HOH MA 13 . ? 30.290 31.314 -13.312 1.00 29.41 ? 1114 HOH A O 1 HETATM 6788 O O . HOH MA 13 . ? -2.393 41.173 10.740 1.00 30.62 ? 1115 HOH A O 1 HETATM 6789 O O . HOH MA 13 . ? 42.831 36.715 -9.402 1.00 27.66 ? 1116 HOH A O 1 HETATM 6790 O O . HOH MA 13 . ? 10.373 24.301 23.440 1.00 36.58 ? 1117 HOH A O 1 HETATM 6791 O O . HOH MA 13 . ? 29.026 19.698 15.343 1.00 41.07 ? 1118 HOH A O 1 HETATM 6792 O O . HOH MA 13 . ? 21.863 43.192 -11.160 1.00 21.36 ? 1119 HOH A O 1 HETATM 6793 O O . HOH MA 13 . ? 26.435 60.524 -20.208 1.00 33.99 ? 1120 HOH A O 1 HETATM 6794 O O . HOH MA 13 . ? 26.748 46.762 -7.261 1.00 22.66 ? 1121 HOH A O 1 HETATM 6795 O O . HOH MA 13 . ? 30.877 40.854 -10.549 1.00 21.12 ? 1122 HOH A O 1 HETATM 6796 O O . HOH MA 13 . ? 41.585 45.200 -10.199 1.00 25.88 ? 1123 HOH A O 1 HETATM 6797 O O . HOH MA 13 . ? 16.728 26.071 21.716 1.00 38.20 ? 1124 HOH A O 1 HETATM 6798 O O . HOH MA 13 . ? 41.812 45.142 -3.883 1.00 23.80 ? 1125 HOH A O 1 HETATM 6799 O O . HOH MA 13 . ? 24.578 31.691 -14.571 1.00 22.35 ? 1126 HOH A O 1 HETATM 6800 O O . HOH MA 13 . ? 12.427 15.744 0.879 1.00 23.75 ? 1127 HOH A O 1 HETATM 6801 O O . HOH MA 13 . ? 33.696 29.336 -34.463 1.00 40.40 ? 1128 HOH A O 1 HETATM 6802 O O . HOH MA 13 . ? 31.302 50.367 -34.360 1.00 41.38 ? 1129 HOH A O 1 HETATM 6803 O O . HOH MA 13 . ? 24.433 44.041 -10.234 1.00 28.56 ? 1130 HOH A O 1 HETATM 6804 O O . HOH MA 13 . ? 40.121 29.132 -35.272 1.00 44.78 ? 1131 HOH A O 1 HETATM 6805 O O . HOH MA 13 . ? 18.247 22.770 3.687 1.00 25.70 ? 1132 HOH A O 1 HETATM 6806 O O . HOH MA 13 . ? 15.708 49.143 -33.146 1.00 46.23 ? 1133 HOH A O 1 HETATM 6807 O O . HOH MA 13 . ? 19.549 49.015 -6.391 1.00 24.91 ? 1134 HOH A O 1 HETATM 6808 O O . HOH MA 13 . ? 15.566 16.265 21.286 1.00 37.08 ? 1135 HOH A O 1 HETATM 6809 O O . HOH MA 13 . ? 2.455 23.063 33.580 1.00 37.11 ? 1136 HOH A O 1 HETATM 6810 O O . HOH MA 13 . ? 32.175 34.684 -39.029 1.00 39.83 ? 1137 HOH A O 1 HETATM 6811 O O . HOH MA 13 . ? 36.883 60.339 -22.469 1.00 41.58 ? 1138 HOH A O 1 HETATM 6812 O O . HOH MA 13 . ? 48.938 39.730 -1.105 1.00 31.49 ? 1139 HOH A O 1 HETATM 6813 O O . HOH MA 13 . ? 6.739 14.514 17.848 1.00 29.03 ? 1140 HOH A O 1 HETATM 6814 O O . HOH MA 13 . ? 1.305 44.258 -3.026 1.00 33.77 ? 1141 HOH A O 1 HETATM 6815 O O . HOH MA 13 . ? 24.506 31.188 -23.597 1.00 27.42 ? 1142 HOH A O 1 HETATM 6816 O O . HOH MA 13 . ? 15.542 24.188 -25.392 1.00 41.62 ? 1143 HOH A O 1 HETATM 6817 O O . HOH MA 13 . ? 17.560 51.162 -15.569 1.00 36.99 ? 1144 HOH A O 1 HETATM 6818 O O . HOH MA 13 . ? 35.849 32.104 -5.497 1.00 34.83 ? 1145 HOH A O 1 HETATM 6819 O O . HOH MA 13 . ? 9.448 39.421 -7.566 1.00 25.41 ? 1146 HOH A O 1 HETATM 6820 O O . HOH MA 13 . ? 45.421 36.691 -7.809 1.00 33.87 ? 1147 HOH A O 1 HETATM 6821 O O . HOH MA 13 . ? 13.520 22.442 24.073 1.00 39.52 ? 1148 HOH A O 1 HETATM 6822 O O . HOH MA 13 . ? 27.949 54.682 7.310 1.00 24.20 ? 1149 HOH A O 1 HETATM 6823 O O . HOH MA 13 . ? 45.993 51.126 -19.307 1.00 40.10 ? 1150 HOH A O 1 HETATM 6824 O O . HOH MA 13 . ? 26.930 20.288 -20.734 1.00 31.03 ? 1151 HOH A O 1 HETATM 6825 O O . HOH MA 13 . ? 29.511 48.613 -9.930 1.00 21.16 ? 1152 HOH A O 1 HETATM 6826 O O . HOH MA 13 . ? 28.218 54.847 4.749 1.00 29.78 ? 1153 HOH A O 1 HETATM 6827 O O . HOH MA 13 . ? -17.237 28.735 13.689 1.00 37.38 ? 1154 HOH A O 1 HETATM 6828 O O . HOH MA 13 . ? 26.440 19.866 -23.720 1.00 31.32 ? 1155 HOH A O 1 HETATM 6829 O O . HOH MA 13 . ? 38.655 60.721 12.158 1.00 32.92 ? 1156 HOH A O 1 HETATM 6830 O O . HOH MA 13 . ? 4.967 17.512 22.996 1.00 32.64 ? 1157 HOH A O 1 HETATM 6831 O O . HOH MA 13 . ? 43.550 28.704 -15.498 1.00 39.66 ? 1158 HOH A O 1 HETATM 6832 O O . HOH MA 13 . ? 15.577 21.475 -27.196 1.00 45.17 ? 1159 HOH A O 1 HETATM 6833 O O . HOH MA 13 . ? 18.433 53.852 -25.713 1.00 42.46 ? 1160 HOH A O 1 HETATM 6834 O O . HOH MA 13 . ? 49.490 54.836 0.915 1.00 30.57 ? 1161 HOH A O 1 HETATM 6835 O O . HOH MA 13 . ? 11.700 11.306 -3.522 1.00 38.71 ? 1162 HOH A O 1 HETATM 6836 O O . HOH MA 13 . ? -1.294 32.838 -8.433 1.00 46.99 ? 1163 HOH A O 1 HETATM 6837 O O . HOH MA 13 . ? 12.768 19.650 -24.035 1.00 44.30 ? 1164 HOH A O 1 HETATM 6838 O O . HOH MA 13 . ? 9.320 49.995 -4.360 1.00 42.72 ? 1165 HOH A O 1 HETATM 6839 O O . HOH MA 13 . ? 27.302 40.714 14.727 1.00 35.53 ? 1166 HOH A O 1 HETATM 6840 O O . HOH MA 13 . ? 6.499 30.597 -6.685 1.00 30.26 ? 1167 HOH A O 1 HETATM 6841 O O . HOH MA 13 . ? 42.074 25.847 -24.032 1.00 42.69 ? 1168 HOH A O 1 HETATM 6842 O O . HOH MA 13 . ? 1.000 35.846 -5.255 1.00 40.46 ? 1169 HOH A O 1 HETATM 6843 O O . HOH MA 13 . ? 48.027 38.879 -22.244 1.00 47.57 ? 1170 HOH A O 1 HETATM 6844 O O . HOH MA 13 . ? 10.643 21.893 27.066 1.00 42.23 ? 1171 HOH A O 1 HETATM 6845 O O . HOH MA 13 . ? 29.870 51.037 -10.699 1.00 29.52 ? 1172 HOH A O 1 HETATM 6846 O O . HOH MA 13 . ? 40.337 61.812 17.203 1.00 41.23 ? 1173 HOH A O 1 HETATM 6847 O O . HOH MA 13 . ? 31.128 47.326 -31.792 1.00 37.22 ? 1174 HOH A O 1 HETATM 6848 O O . HOH MA 13 . ? 16.963 22.074 -24.754 1.00 35.21 ? 1175 HOH A O 1 HETATM 6849 O O . HOH MA 13 . ? 48.133 45.388 -17.974 1.00 41.74 ? 1176 HOH A O 1 HETATM 6850 O O . HOH MA 13 . ? 35.338 57.268 -0.438 1.00 39.12 ? 1177 HOH A O 1 HETATM 6851 O O . HOH MA 13 . ? 48.435 61.709 5.376 1.00 34.18 ? 1178 HOH A O 1 HETATM 6852 O O . HOH MA 13 . ? 14.753 45.727 -10.955 1.00 32.75 ? 1179 HOH A O 1 HETATM 6853 O O . HOH MA 13 . ? 0.180 14.844 22.457 1.00 38.70 ? 1180 HOH A O 1 HETATM 6854 O O . HOH MA 13 . ? -14.712 36.143 18.422 1.00 35.61 ? 1181 HOH A O 1 HETATM 6855 O O . HOH MA 13 . ? 3.706 22.188 26.026 1.00 27.51 ? 1182 HOH A O 1 HETATM 6856 O O . HOH MA 13 . ? 1.917 39.292 -8.538 1.00 40.71 ? 1183 HOH A O 1 HETATM 6857 O O . HOH MA 13 . ? 26.126 18.664 23.551 1.00 40.26 ? 1184 HOH A O 1 HETATM 6858 O O . HOH MA 13 . ? 5.509 23.907 24.473 1.00 30.31 ? 1185 HOH A O 1 HETATM 6859 O O . HOH MA 13 . ? 11.703 48.757 -10.059 1.00 41.79 ? 1186 HOH A O 1 HETATM 6860 O O . HOH MA 13 . ? 19.795 32.290 -27.374 1.00 37.26 ? 1187 HOH A O 1 HETATM 6861 O O . HOH MA 13 . ? 34.784 60.536 -20.400 1.00 44.35 ? 1188 HOH A O 1 HETATM 6862 O O . HOH MA 13 . ? 42.667 34.550 -41.227 1.00 49.50 ? 1189 HOH A O 1 HETATM 6863 O O . HOH MA 13 . ? 32.778 24.399 4.079 1.00 43.13 ? 1190 HOH A O 1 HETATM 6864 O O . HOH MA 13 . ? 33.907 23.100 21.019 1.00 36.86 ? 1191 HOH A O 1 HETATM 6865 O O . HOH MA 13 . ? 19.774 17.976 3.589 1.00 38.18 ? 1192 HOH A O 1 HETATM 6866 O O . HOH MA 13 . ? 22.030 23.963 -25.326 1.00 36.57 ? 1193 HOH A O 1 HETATM 6867 O O . HOH MA 13 . ? 0.708 12.963 8.462 1.00 43.91 ? 1194 HOH A O 1 HETATM 6868 O O . HOH MA 13 . ? 5.692 27.637 -19.983 1.00 34.58 ? 1195 HOH A O 1 HETATM 6869 O O . HOH MA 13 . ? 4.842 18.945 26.118 1.00 34.31 ? 1196 HOH A O 1 HETATM 6870 O O . HOH MA 13 . ? 15.724 52.082 4.715 1.00 34.26 ? 1197 HOH A O 1 HETATM 6871 O O . HOH MA 13 . ? 28.086 15.269 20.338 1.00 40.09 ? 1198 HOH A O 1 HETATM 6872 O O . HOH MA 13 . ? 22.545 53.499 18.995 1.00 39.06 ? 1199 HOH A O 1 HETATM 6873 O O . HOH MA 13 . ? 19.477 17.873 -20.577 1.00 31.96 ? 1200 HOH A O 1 HETATM 6874 O O . HOH MA 13 . ? 9.013 21.061 31.538 1.00 40.09 ? 1201 HOH A O 1 HETATM 6875 O O . HOH MA 13 . ? 17.466 14.625 20.262 1.00 33.23 ? 1202 HOH A O 1 HETATM 6876 O O . HOH MA 13 . ? 40.160 61.205 14.854 1.00 43.68 ? 1203 HOH A O 1 HETATM 6877 O O . HOH MA 13 . ? 18.834 24.871 21.415 1.00 33.25 ? 1204 HOH A O 1 HETATM 6878 O O . HOH MA 13 . ? 46.106 27.721 -19.161 1.00 47.29 ? 1205 HOH A O 1 HETATM 6879 O O . HOH MA 13 . ? 15.890 34.768 -25.795 1.00 37.41 ? 1206 HOH A O 1 HETATM 6880 O O . HOH MA 13 . ? 22.322 32.131 -27.756 1.00 34.52 ? 1207 HOH A O 1 HETATM 6881 O O . HOH MA 13 . ? 19.619 14.327 7.370 1.00 38.73 ? 1208 HOH A O 1 HETATM 6882 O O . HOH MA 13 . ? 33.631 47.461 17.256 1.00 41.27 ? 1209 HOH A O 1 HETATM 6883 O O . HOH MA 13 . ? 12.663 11.092 11.901 1.00 31.90 ? 1210 HOH A O 1 HETATM 6884 O O . HOH MA 13 . ? 9.298 17.231 21.771 1.00 29.92 ? 1211 HOH A O 1 HETATM 6885 O O . HOH MA 13 . ? 25.939 57.623 -12.850 1.00 32.12 ? 1212 HOH A O 1 HETATM 6886 O O . HOH MA 13 . ? 18.777 33.858 -24.842 1.00 35.82 ? 1213 HOH A O 1 HETATM 6887 O O . HOH MA 13 . ? 50.596 56.179 2.705 1.00 38.95 ? 1214 HOH A O 1 HETATM 6888 O O . HOH MA 13 . ? 15.755 27.622 -7.554 1.00 31.03 ? 1215 HOH A O 1 HETATM 6889 O O . HOH MA 13 . ? 19.025 16.027 -18.271 1.00 38.72 ? 1216 HOH A O 1 HETATM 6890 O O . HOH MA 13 . ? 0.538 31.665 25.973 1.00 34.20 ? 1217 HOH A O 1 HETATM 6891 O O . HOH MA 13 . ? 18.783 10.381 9.748 1.00 45.76 ? 1218 HOH A O 1 HETATM 6892 O O . HOH MA 13 . ? 23.746 40.629 -41.281 1.00 42.26 ? 1219 HOH A O 1 HETATM 6893 O O . HOH MA 13 . ? -16.727 37.771 18.218 1.00 36.51 ? 1220 HOH A O 1 HETATM 6894 O O . HOH MA 13 . ? 31.549 30.172 -33.234 1.00 37.91 ? 1221 HOH A O 1 HETATM 6895 O O . HOH MA 13 . ? 14.161 25.834 21.052 1.00 39.22 ? 1222 HOH A O 1 HETATM 6896 O O . HOH MA 13 . ? 0.093 31.918 -6.355 1.00 44.77 ? 1223 HOH A O 1 HETATM 6897 O O . HOH MA 13 . ? 18.813 13.527 -21.956 1.00 45.82 ? 1224 HOH A O 1 HETATM 6898 O O . HOH MA 13 . ? 30.738 28.614 -36.901 1.00 40.66 ? 1225 HOH A O 1 HETATM 6899 O O . HOH MA 13 . ? 7.049 40.706 -26.912 1.00 45.82 ? 1226 HOH A O 1 HETATM 6900 O O . HOH MA 13 . ? 42.990 44.396 -34.087 1.00 45.12 ? 1227 HOH A O 1 HETATM 6901 O O . HOH MA 13 . ? 30.229 42.381 -36.294 1.00 39.93 ? 1228 HOH A O 1 HETATM 6902 O O . HOH MA 13 . ? 21.302 41.988 -40.908 1.00 50.07 ? 1229 HOH A O 1 HETATM 6903 O O . HOH MA 13 . ? 20.379 21.394 4.588 1.00 32.77 ? 1230 HOH A O 1 HETATM 6904 O O . HOH MA 13 . ? 23.820 44.819 -23.076 1.00 37.54 ? 1231 HOH A O 1 HETATM 6905 O O . HOH MA 13 . ? 15.936 59.804 4.867 1.00 45.37 ? 1232 HOH A O 1 HETATM 6906 O O . HOH MA 13 . ? 12.833 44.109 -10.294 1.00 39.56 ? 1233 HOH A O 1 HETATM 6907 O O . HOH MA 13 . ? 29.553 58.184 14.170 1.00 44.53 ? 1234 HOH A O 1 HETATM 6908 O O . HOH MA 13 . ? 34.759 34.555 -37.254 1.00 42.44 ? 1235 HOH A O 1 HETATM 6909 O O . HOH MA 13 . ? 28.904 55.801 14.836 1.00 42.42 ? 1236 HOH A O 1 HETATM 6910 O O . HOH MA 13 . ? 30.999 43.577 13.868 1.00 42.74 ? 1237 HOH A O 1 HETATM 6911 O O . HOH MA 13 . ? 6.662 39.114 -11.120 1.00 41.74 ? 1238 HOH A O 1 HETATM 6912 O O . HOH MA 13 . ? 18.790 54.133 -6.458 1.00 41.00 ? 1239 HOH A O 1 HETATM 6913 O O . HOH MA 13 . ? 9.016 14.571 19.761 1.00 46.07 ? 1240 HOH A O 1 HETATM 6914 O O . HOH MA 13 . ? 48.494 49.296 -9.859 1.00 42.61 ? 1241 HOH A O 1 HETATM 6915 O O . HOH MA 13 . ? 28.096 19.882 -18.125 1.00 41.19 ? 1242 HOH A O 1 HETATM 6916 O O . HOH MA 13 . ? 49.226 49.473 -3.051 1.00 34.12 ? 1243 HOH A O 1 HETATM 6917 O O . HOH MA 13 . ? 8.812 15.495 -6.688 1.00 39.68 ? 1244 HOH A O 1 HETATM 6918 O O . HOH MA 13 . ? 21.040 26.289 -7.560 1.00 39.91 ? 1245 HOH A O 1 HETATM 6919 O O . HOH MA 13 . ? 48.726 33.729 -21.323 1.00 49.41 ? 1246 HOH A O 1 HETATM 6920 O O . HOH MA 13 . ? 50.816 36.652 -3.285 1.00 46.97 ? 1247 HOH A O 1 HETATM 6921 O O . HOH MA 13 . ? 27.827 58.120 -11.221 1.00 45.97 ? 1248 HOH A O 1 HETATM 6922 O O . HOH MA 13 . ? 49.605 46.225 15.105 1.00 35.33 ? 1249 HOH A O 1 HETATM 6923 O O . HOH MA 13 . ? 26.935 62.460 8.938 1.00 39.35 ? 1250 HOH A O 1 HETATM 6924 O O . HOH MA 13 . ? 25.498 57.996 16.175 1.00 39.41 ? 1251 HOH A O 1 HETATM 6925 O O . HOH MA 13 . ? 47.896 52.312 13.796 1.00 38.76 ? 1252 HOH A O 1 HETATM 6926 O O . HOH MA 13 . ? 36.959 25.255 8.948 1.00 43.20 ? 1253 HOH A O 1 HETATM 6927 O O . HOH MA 13 . ? 35.608 62.393 4.848 1.00 33.16 ? 1254 HOH A O 1 HETATM 6928 O O . HOH MA 13 . ? -4.131 22.594 35.548 1.00 44.14 ? 1255 HOH A O 1 HETATM 6929 O O . HOH MA 13 . ? -1.447 23.752 23.689 1.00 40.27 ? 1256 HOH A O 1 HETATM 6930 O O . HOH MA 13 . ? 34.936 28.351 23.928 1.00 46.36 ? 1257 HOH A O 1 HETATM 6931 O O . HOH MA 13 . ? 51.070 39.189 -2.901 1.00 42.35 ? 1258 HOH A O 1 HETATM 6932 O O . HOH MA 13 . ? 15.679 49.099 -14.886 1.00 36.87 ? 1259 HOH A O 1 HETATM 6933 O O . HOH MA 13 . ? 29.268 57.418 -1.792 1.00 44.88 ? 1260 HOH A O 1 HETATM 6934 O O . HOH MA 13 . ? 50.233 51.109 13.195 1.00 38.88 ? 1261 HOH A O 1 HETATM 6935 O O . HOH MA 13 . ? 40.270 50.793 -5.656 1.00 43.05 ? 1262 HOH A O 1 HETATM 6936 O O . HOH MA 13 . ? 34.250 29.392 -42.198 1.00 47.48 ? 1263 HOH A O 1 HETATM 6937 O O . HOH MA 13 . ? 26.699 55.562 -1.808 1.00 33.81 ? 1264 HOH A O 1 HETATM 6938 O O . HOH MA 13 . ? 42.986 58.607 6.312 1.00 32.22 ? 1265 HOH A O 1 HETATM 6939 O O . HOH MA 13 . ? 27.345 57.276 2.041 1.00 37.56 ? 1266 HOH A O 1 HETATM 6940 O O . HOH MA 13 . ? 13.644 36.562 20.455 1.00 41.43 ? 1267 HOH A O 1 HETATM 6941 O O . HOH MA 13 . ? 29.283 18.002 24.983 1.00 43.79 ? 1268 HOH A O 1 HETATM 6942 O O . HOH MA 13 . ? 4.874 7.894 20.139 1.00 43.86 ? 1269 HOH A O 1 HETATM 6943 O O . HOH MA 13 . ? 0.719 39.376 20.863 1.00 40.06 ? 1270 HOH A O 1 HETATM 6944 O O . HOH MA 13 . ? 0.386 37.281 -7.465 1.00 36.27 ? 1271 HOH A O 1 HETATM 6945 O O . HOH MA 13 . ? 5.928 6.561 4.015 1.00 47.77 ? 1272 HOH A O 1 HETATM 6946 O O . HOH MA 13 . ? 6.087 31.378 30.406 1.00 41.06 ? 1273 HOH A O 1 HETATM 6947 O O . HOH MA 13 . ? 39.577 45.844 -5.282 1.00 33.77 ? 1274 HOH A O 1 HETATM 6948 O O . HOH MA 13 . ? 21.153 46.740 -23.072 1.00 40.07 ? 1275 HOH A O 1 HETATM 6949 O O . HOH MA 13 . ? 38.967 38.287 16.525 1.00 29.62 ? 1276 HOH A O 1 HETATM 6950 O O . HOH MA 13 . ? 37.895 53.728 -45.839 1.00 53.83 ? 1277 HOH A O 1 HETATM 6951 O O . HOH MA 13 . ? 37.210 43.552 16.578 1.00 38.21 ? 1278 HOH A O 1 HETATM 6952 O O . HOH MA 13 . ? -0.010 33.024 28.394 1.00 39.60 ? 1279 HOH A O 1 HETATM 6953 O O . HOH MA 13 . ? 45.226 41.113 -25.220 1.00 41.72 ? 1280 HOH A O 1 HETATM 6954 O O . HOH MA 13 . ? 14.788 10.628 2.981 1.00 38.97 ? 1281 HOH A O 1 HETATM 6955 O O . HOH MA 13 . ? 35.164 35.531 -0.730 1.00 36.06 ? 1282 HOH A O 1 HETATM 6956 O O . HOH MA 13 . ? 11.648 15.559 21.496 1.00 43.56 ? 1283 HOH A O 1 HETATM 6957 O O . HOH MA 13 . ? 5.936 13.011 27.006 1.00 46.88 ? 1284 HOH A O 1 HETATM 6958 O O . HOH MA 13 . ? 12.429 42.286 -14.269 1.00 46.44 ? 1285 HOH A O 1 HETATM 6959 O O . HOH MA 13 . ? 23.101 54.861 -6.704 1.00 42.18 ? 1286 HOH A O 1 HETATM 6960 O O . HOH MA 13 . ? 46.013 58.906 5.993 1.00 47.27 ? 1287 HOH A O 1 HETATM 6961 O O . HOH MA 13 . ? 15.723 36.853 -34.345 1.00 51.09 ? 1288 HOH A O 1 HETATM 6962 O O . HOH MA 13 . ? 21.329 62.245 15.432 1.00 41.28 ? 1289 HOH A O 1 HETATM 6963 O O . HOH MA 13 . ? 14.055 48.948 -12.514 1.00 40.48 ? 1290 HOH A O 1 HETATM 6964 O O . HOH MA 13 . ? 13.071 35.443 -28.870 1.00 44.38 ? 1291 HOH A O 1 HETATM 6965 O O . HOH MA 13 . ? 35.719 26.526 5.702 1.00 41.16 ? 1292 HOH A O 1 HETATM 6966 O O . HOH MA 13 . ? 2.531 5.577 15.283 1.00 41.32 ? 1293 HOH A O 1 HETATM 6967 O O . HOH MA 13 . ? 8.848 43.882 -9.435 1.00 36.62 ? 1294 HOH A O 1 HETATM 6968 O O . HOH MA 13 . ? 45.815 33.694 -7.779 1.00 38.36 ? 1295 HOH A O 1 HETATM 6969 O O . HOH MA 13 . ? 21.987 57.943 -10.198 1.00 43.77 ? 1296 HOH A O 1 HETATM 6970 O O . HOH MA 13 . ? 20.492 55.331 -3.722 1.00 42.54 ? 1297 HOH A O 1 HETATM 6971 O O . HOH MA 13 . ? 2.021 5.390 11.709 1.00 47.36 ? 1298 HOH A O 1 HETATM 6972 O O . HOH MA 13 . ? 28.833 42.539 -34.082 1.00 38.72 ? 1299 HOH A O 1 HETATM 6973 O O . HOH MA 13 . ? 18.688 53.882 -23.159 1.00 39.11 ? 1300 HOH A O 1 HETATM 6974 O O . HOH MA 13 . ? 45.954 34.620 -23.430 1.00 48.25 ? 1301 HOH A O 1 HETATM 6975 O O . HOH MA 13 . ? 10.229 50.928 0.669 1.00 37.76 ? 1302 HOH A O 1 HETATM 6976 O O . HOH MA 13 . ? 8.812 26.295 -24.287 1.00 44.86 ? 1303 HOH A O 1 HETATM 6977 O O . HOH MA 13 . ? 4.177 44.234 -6.474 1.00 36.25 ? 1304 HOH A O 1 HETATM 6978 O O . HOH MA 13 . ? 33.029 26.779 3.650 1.00 29.07 ? 1305 HOH A O 1 HETATM 6979 O O . HOH MA 13 . ? 18.574 33.369 5.097 1.00 22.98 ? 1306 HOH A O 1 HETATM 6980 O O . HOH MA 13 . ? -0.769 27.839 28.719 1.00 42.85 ? 1307 HOH A O 1 HETATM 6981 O O . HOH MA 13 . ? 44.656 30.994 3.954 1.00 39.66 ? 1308 HOH A O 1 HETATM 6982 O O . HOH MA 13 . ? 26.888 24.266 5.234 1.00 26.56 ? 1309 HOH A O 1 HETATM 6983 O O . HOH MA 13 . ? 52.519 42.669 9.538 1.00 44.11 ? 1310 HOH A O 1 HETATM 6984 O O . HOH MA 13 . ? 53.243 56.104 2.589 1.00 44.67 ? 1311 HOH A O 1 HETATM 6985 O O . HOH MA 13 . ? -4.900 14.376 1.998 1.00 43.32 ? 1312 HOH A O 1 HETATM 6986 O O . HOH MA 13 . ? -12.969 26.334 13.209 1.00 44.82 ? 1313 HOH A O 1 HETATM 6987 O O . HOH MA 13 . ? 16.676 24.230 -18.170 1.00 29.06 ? 1314 HOH A O 1 HETATM 6988 O O . HOH MA 13 . ? 20.323 15.547 5.278 1.00 31.86 ? 1315 HOH A O 1 HETATM 6989 O O . HOH MA 13 . ? 34.136 23.642 15.082 1.00 29.76 ? 1316 HOH A O 1 HETATM 6990 O O . HOH MA 13 . ? 18.219 28.037 -9.395 1.00 30.81 ? 1317 HOH A O 1 HETATM 6991 O O . HOH MA 13 . ? -8.841 18.492 11.010 1.00 36.13 ? 1318 HOH A O 1 HETATM 6992 O O . HOH MA 13 . ? -13.735 39.799 18.875 1.00 44.59 ? 1319 HOH A O 1 HETATM 6993 O O . HOH MA 13 . ? 57.358 55.572 4.584 1.00 53.38 ? 1320 HOH A O 1 HETATM 6994 O O . HOH MA 13 . ? 7.637 6.728 7.339 1.00 48.00 ? 1321 HOH A O 1 HETATM 6995 O O . HOH MA 13 . ? -11.288 26.053 15.556 1.00 46.31 ? 1322 HOH A O 1 HETATM 6996 O O . HOH MA 13 . ? 27.170 25.897 -7.838 1.00 29.58 ? 1323 HOH A O 1 HETATM 6997 O O . HOH MA 13 . ? 18.267 23.271 -15.476 1.00 39.94 ? 1324 HOH A O 1 HETATM 6998 O O . HOH MA 13 . ? 41.137 56.062 -18.427 1.00 45.60 ? 1325 HOH A O 1 HETATM 6999 O O . HOH MA 13 . ? 12.239 52.415 -22.282 1.00 49.77 ? 1326 HOH A O 1 HETATM 7000 O O . HOH MA 13 . ? 10.146 48.736 -7.900 1.00 35.79 ? 1327 HOH A O 1 HETATM 7001 O O . HOH MA 13 . ? 34.307 33.445 -1.755 1.00 38.30 ? 1328 HOH A O 1 HETATM 7002 O O . HOH MA 13 . ? 31.649 21.683 -16.394 1.00 49.11 ? 1329 HOH A O 1 HETATM 7003 O O . HOH MA 13 . ? 29.946 25.158 -8.244 1.00 42.45 ? 1330 HOH A O 1 HETATM 7004 O O . HOH MA 13 . ? 35.458 53.955 16.363 1.00 46.23 ? 1331 HOH A O 1 HETATM 7005 O O . HOH MA 13 . ? -2.121 21.377 21.788 1.00 46.11 ? 1332 HOH A O 1 HETATM 7006 O O . HOH MA 13 . ? -2.498 20.922 -1.596 1.00 44.19 ? 1333 HOH A O 1 HETATM 7007 O O . HOH MA 13 . ? 39.813 34.593 -4.757 1.00 35.62 ? 1334 HOH A O 1 HETATM 7008 O O . HOH MA 13 . ? 28.886 38.060 14.720 1.00 34.18 ? 1335 HOH A O 1 HETATM 7009 O O . HOH MA 13 . ? 23.335 52.120 -40.006 1.00 44.52 ? 1336 HOH A O 1 HETATM 7010 O O . HOH MA 13 . ? 22.948 55.267 -2.456 1.00 41.33 ? 1337 HOH A O 1 HETATM 7011 O O . HOH MA 13 . ? 6.871 40.695 25.965 1.00 41.63 ? 1338 HOH A O 1 HETATM 7012 O O . HOH MA 13 . ? -14.541 25.501 6.885 1.00 46.92 ? 1339 HOH A O 1 HETATM 7013 O O . HOH MA 13 . ? 17.262 50.247 -6.731 1.00 24.76 ? 1340 HOH A O 1 HETATM 7014 O O . HOH MA 13 . ? 28.051 27.840 -2.280 1.00 30.82 ? 1341 HOH A O 1 HETATM 7015 O O . HOH MA 13 . ? 38.975 26.964 14.360 1.00 37.10 ? 1342 HOH A O 1 HETATM 7016 O O . HOH MA 13 . ? 36.563 26.821 15.790 1.00 29.49 ? 1343 HOH A O 1 HETATM 7017 O O . HOH MA 13 . ? 37.105 41.346 15.320 1.00 27.34 ? 1344 HOH A O 1 HETATM 7018 O O . HOH MA 13 . ? 22.149 28.604 -7.231 1.00 27.36 ? 1345 HOH A O 1 HETATM 7019 O O . HOH MA 13 . ? 15.928 32.355 21.457 1.00 24.90 ? 1346 HOH A O 1 HETATM 7020 O O . HOH MA 13 . ? 26.450 23.109 2.528 1.00 44.28 ? 1347 HOH A O 1 HETATM 7021 O O . HOH MA 13 . ? 5.620 27.625 -16.388 1.00 31.96 ? 1348 HOH A O 1 HETATM 7022 O O . HOH MA 13 . ? 40.296 60.135 9.294 1.00 33.12 ? 1349 HOH A O 1 HETATM 7023 O O . HOH MA 13 . ? 15.057 34.610 21.390 1.00 35.47 ? 1350 HOH A O 1 HETATM 7024 O O . HOH MA 13 . ? 54.163 44.684 1.680 1.00 33.97 ? 1351 HOH A O 1 HETATM 7025 O O . HOH MA 13 . ? 38.633 64.972 2.411 1.00 36.55 ? 1352 HOH A O 1 HETATM 7026 O O . HOH MA 13 . ? 22.967 57.065 17.488 1.00 35.91 ? 1353 HOH A O 1 HETATM 7027 O O . HOH MA 13 . ? 6.005 23.786 -11.427 1.00 37.42 ? 1354 HOH A O 1 HETATM 7028 O O . HOH MA 13 . ? 18.704 25.342 -11.316 1.00 40.53 ? 1355 HOH A O 1 HETATM 7029 O O . HOH MA 13 . ? -0.079 14.068 20.203 1.00 44.12 ? 1356 HOH A O 1 HETATM 7030 O O . HOH MA 13 . ? 5.806 46.501 11.537 1.00 43.80 ? 1357 HOH A O 1 HETATM 7031 O O . HOH MA 13 . ? 25.408 26.892 -4.836 1.00 35.79 ? 1358 HOH A O 1 HETATM 7032 O O . HOH MA 13 . ? 49.184 58.560 -1.127 1.00 37.71 ? 1359 HOH A O 1 HETATM 7033 O O . HOH MA 13 . ? 0.493 7.120 24.606 1.00 41.40 ? 1360 HOH A O 1 HETATM 7034 O O . HOH MA 13 . ? 40.635 56.791 -21.053 1.00 44.20 ? 1361 HOH A O 1 HETATM 7035 O O . HOH MA 13 . ? 54.534 45.472 -0.799 1.00 44.74 ? 1362 HOH A O 1 HETATM 7036 O O . HOH MA 13 . ? 32.486 59.167 -31.443 1.00 38.74 ? 1363 HOH A O 1 HETATM 7037 O O . HOH MA 13 . ? 34.934 40.534 15.864 1.00 42.00 ? 1364 HOH A O 1 HETATM 7038 O O . HOH MA 13 . ? 8.360 32.409 31.504 1.00 39.62 ? 1365 HOH A O 1 HETATM 7039 O O . HOH MA 13 . ? 45.543 38.258 -0.629 1.00 40.22 ? 1366 HOH A O 1 HETATM 7040 O O . HOH MA 13 . ? 31.844 35.159 17.734 1.00 35.64 ? 1367 HOH A O 1 HETATM 7041 O O . HOH MA 13 . ? -6.154 15.456 9.855 1.00 45.97 ? 1368 HOH A O 1 HETATM 7042 O O . HOH MA 13 . ? 33.989 60.142 4.488 1.00 43.31 ? 1369 HOH A O 1 HETATM 7043 O O . HOH MA 13 . ? 20.862 51.554 20.254 1.00 41.89 ? 1370 HOH A O 1 HETATM 7044 O O . HOH MA 13 . ? 47.040 43.511 -22.357 1.00 39.03 ? 1371 HOH A O 1 HETATM 7045 O O . HOH MA 13 . ? 10.684 13.621 -6.334 1.00 49.94 ? 1372 HOH A O 1 HETATM 7046 O O . HOH MA 13 . ? 12.437 9.300 1.460 1.00 41.45 ? 1373 HOH A O 1 HETATM 7047 O O . HOH MA 13 . ? 15.229 9.822 7.261 1.00 39.96 ? 1374 HOH A O 1 HETATM 7048 O O . HOH MA 13 . ? 42.020 58.499 8.686 1.00 42.55 ? 1375 HOH A O 1 HETATM 7049 O O . HOH MA 13 . ? 31.884 26.297 -17.709 1.00 41.99 ? 1376 HOH A O 1 HETATM 7050 O O . HOH MA 13 . ? 14.967 45.373 -13.337 1.00 40.38 ? 1377 HOH A O 1 HETATM 7051 O O . HOH MA 13 . ? -6.062 30.017 7.883 1.00 41.26 ? 1378 HOH A O 1 HETATM 7052 O O . HOH MA 13 . ? -7.535 14.088 31.072 1.00 53.45 ? 1379 HOH A O 1 HETATM 7053 O O . HOH MA 13 . ? 18.191 25.199 -13.632 1.00 42.76 ? 1380 HOH A O 1 HETATM 7054 O O . HOH MA 13 . ? 14.703 8.941 4.764 1.00 43.98 ? 1381 HOH A O 1 HETATM 7055 O O . HOH MA 13 . ? -12.809 27.640 22.817 1.00 52.07 ? 1382 HOH A O 1 HETATM 7056 O O . HOH MA 13 . ? 35.426 23.968 22.938 1.00 48.04 ? 1383 HOH A O 1 HETATM 7057 O O . HOH MA 13 . ? 25.678 20.572 3.224 1.00 41.20 ? 1384 HOH A O 1 HETATM 7058 O O . HOH MA 13 . ? 9.286 12.517 21.402 1.00 45.68 ? 1385 HOH A O 1 HETATM 7059 O O . HOH MA 13 . ? 29.936 43.387 -43.683 1.00 54.31 ? 1386 HOH A O 1 HETATM 7060 O O . HOH MA 13 . ? 5.443 42.693 -20.414 1.00 53.51 ? 1387 HOH A O 1 HETATM 7061 O O . HOH MA 13 . ? 8.506 44.836 -21.153 1.00 46.77 ? 1388 HOH A O 1 HETATM 7062 O O . HOH MA 13 . ? -0.481 25.261 -9.167 1.00 40.93 ? 1389 HOH A O 1 HETATM 7063 O O . HOH MA 13 . ? 10.729 47.295 -12.004 1.00 52.48 ? 1390 HOH A O 1 HETATM 7064 O O . HOH MA 13 . ? 42.683 47.551 -4.237 1.00 35.05 ? 1391 HOH A O 1 HETATM 7065 O O . HOH MA 13 . ? 48.161 38.059 7.272 1.00 34.72 ? 1392 HOH A O 1 HETATM 7066 O O . HOH MA 13 . ? 21.126 57.965 -32.631 1.00 50.52 ? 1393 HOH A O 1 HETATM 7067 O O . HOH MA 13 . ? 52.608 40.055 -1.231 1.00 43.71 ? 1394 HOH A O 1 HETATM 7068 O O . HOH MA 13 . ? 47.508 46.216 -12.930 1.00 39.24 ? 1395 HOH A O 1 HETATM 7069 O O . HOH MA 13 . ? 42.153 37.452 0.808 1.00 43.52 ? 1396 HOH A O 1 HETATM 7070 O O . HOH MA 13 . ? 14.017 24.904 24.457 1.00 40.47 ? 1397 HOH A O 1 HETATM 7071 O O . HOH MA 13 . ? 47.391 67.153 10.069 1.00 50.73 ? 1398 HOH A O 1 HETATM 7072 O O . HOH MA 13 . ? 5.730 37.151 -14.788 1.00 48.74 ? 1399 HOH A O 1 HETATM 7073 O O . HOH MA 13 . ? 10.464 47.000 -20.321 1.00 44.02 ? 1400 HOH A O 1 HETATM 7074 O O . HOH MA 13 . ? 23.826 57.361 -32.057 1.00 48.68 ? 1401 HOH A O 1 HETATM 7075 O O . HOH MA 13 . ? 31.244 59.366 0.887 1.00 48.49 ? 1402 HOH A O 1 HETATM 7076 O O . HOH MA 13 . ? -6.223 35.437 -2.141 1.00 41.53 ? 1403 HOH A O 1 HETATM 7077 O O . HOH MA 13 . ? 48.414 33.285 8.001 1.00 41.19 ? 1404 HOH A O 1 HETATM 7078 O O . HOH MA 13 . ? 53.603 59.132 4.624 1.00 39.46 ? 1405 HOH A O 1 HETATM 7079 O O . HOH MA 13 . ? 37.955 63.248 -23.891 1.00 43.42 ? 1406 HOH A O 1 HETATM 7080 O O . HOH MA 13 . ? 31.817 27.241 -15.519 1.00 45.44 ? 1407 HOH A O 1 HETATM 7081 O O . HOH MA 13 . ? 50.175 42.876 -12.877 1.00 44.90 ? 1408 HOH A O 1 HETATM 7082 O O . HOH MA 13 . ? 52.081 44.726 -3.255 1.00 45.83 ? 1409 HOH A O 1 HETATM 7083 O O . HOH MA 13 . ? 18.970 23.371 -26.437 1.00 46.82 ? 1410 HOH A O 1 HETATM 7084 O O . HOH MA 13 . ? -11.072 25.992 37.423 1.00 54.55 ? 1411 HOH A O 1 HETATM 7085 O O . HOH MA 13 . ? 53.747 42.136 -1.496 1.00 49.83 ? 1412 HOH A O 1 HETATM 7086 O O . HOH MA 13 . ? 19.482 50.192 -39.157 1.00 52.12 ? 1413 HOH A O 1 HETATM 7087 O O . HOH MA 13 . ? 47.565 69.583 10.922 1.00 45.69 ? 1414 HOH A O 1 HETATM 7088 O O . HOH MA 13 . ? 44.835 50.773 -29.087 1.00 54.34 ? 1415 HOH A O 1 HETATM 7089 O O . HOH MA 13 . ? 21.657 33.758 18.709 1.00 34.72 ? 1416 HOH A O 1 HETATM 7090 O O . HOH MA 13 . ? 47.566 43.937 -6.565 1.00 37.10 ? 1417 HOH A O 1 HETATM 7091 O O . HOH MA 13 . ? 47.756 45.231 -10.469 1.00 43.47 ? 1418 HOH A O 1 HETATM 7092 O O . HOH MA 13 . ? 50.014 42.439 -7.832 1.00 49.95 ? 1419 HOH A O 1 HETATM 7093 O O . HOH MA 13 . ? 46.580 51.712 -24.713 1.00 49.16 ? 1420 HOH A O 1 HETATM 7094 O O . HOH MA 13 . ? 8.425 41.720 -7.536 1.00 30.59 ? 1421 HOH A O 1 HETATM 7095 O O . HOH MA 13 . ? 9.313 38.639 -10.194 1.00 28.45 ? 1422 HOH A O 1 HETATM 7096 O O . HOH MA 13 . ? 18.272 52.784 -12.943 1.00 34.72 ? 1423 HOH A O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 ALA 1 36 ? ? ? A . n A 1 2 GLU 2 37 ? ? ? A . n A 1 3 TRP 3 38 ? ? ? A . n A 1 4 ASP 4 39 ? ? ? A . n A 1 5 GLU 5 40 ? ? ? A . n A 1 6 GLY 6 41 ? ? ? A . n A 1 7 PRO 7 42 ? ? ? A . n A 1 8 PRO 8 43 ? ? ? A . n A 1 9 THR 9 44 ? ? ? A . n A 1 10 VAL 10 45 ? ? ? A . n A 1 11 LEU 11 46 ? ? ? A . n A 1 12 SER 12 47 ? ? ? A . n A 1 13 ASP 13 48 ? ? ? A . n A 1 14 SER 14 49 ? ? ? A . n A 1 15 PRO 15 50 ? ? ? A . n A 1 16 TRP 16 51 51 TRP TRP A . n A 1 17 THR 17 52 52 THR THR A . n A 1 18 ASN 18 53 53 ASN ASN A . n A 1 19 THR 19 54 54 THR THR A . n A 1 20 SER 20 55 55 SER SER A . n A 1 21 GLY 21 56 56 GLY GLY A . n A 1 22 SER 22 57 57 SER SER A . n A 1 23 CYS 23 58 58 CYS CYS A . n A 1 24 LYS 24 59 59 LYS LYS A . n A 1 25 GLY 25 60 60 GLY GLY A . n A 1 26 ARG 26 61 61 ARG ARG A . n A 1 27 CYS 27 62 62 CYS CYS A . n A 1 28 PHE 28 63 63 PHE PHE A . n A 1 29 GLU 29 64 64 GLU GLU A . n A 1 30 LEU 30 65 65 LEU LEU A . n A 1 31 GLN 31 66 66 GLN GLN A . n A 1 32 GLU 32 67 67 GLU GLU A . n A 1 33 VAL 33 68 68 VAL VAL A . n A 1 34 GLY 34 69 69 GLY GLY A . n A 1 35 PRO 35 70 70 PRO PRO A . n A 1 36 PRO 36 71 71 PRO PRO A . n A 1 37 ASP 37 72 72 ASP ASP A . n A 1 38 CYS 38 73 73 CYS CYS A . n A 1 39 ARG 39 74 74 ARG ARG A . n A 1 40 CYS 40 75 75 CYS CYS A . n A 1 41 ASP 41 76 76 ASP ASP A . n A 1 42 ASN 42 77 77 ASN ASN A . n A 1 43 LEU 43 78 78 LEU LEU A . n A 1 44 CYS 44 79 79 CYS CYS A . n A 1 45 LYS 45 80 80 LYS LYS A . n A 1 46 SER 46 81 81 SER SER A . n A 1 47 TYR 47 82 82 TYR TYR A . n A 1 48 SER 48 83 83 SER SER A . n A 1 49 SER 49 84 84 SER SER A . n A 1 50 CYS 50 85 85 CYS CYS A . n A 1 51 CYS 51 86 86 CYS CYS A . n A 1 52 HIS 52 87 87 HIS HIS A . n A 1 53 ASP 53 88 88 ASP ASP A . n A 1 54 PHE 54 89 89 PHE PHE A . n A 1 55 ASP 55 90 90 ASP ASP A . n A 1 56 GLU 56 91 91 GLU GLU A . n A 1 57 LEU 57 92 92 LEU LEU A . n A 1 58 CYS 58 93 93 CYS CYS A . n A 1 59 LEU 59 94 94 LEU LEU A . n A 1 60 LYS 60 95 95 LYS LYS A . n A 1 61 THR 61 96 96 THR THR A . n A 1 62 ALA 62 97 97 ALA ALA A . n A 1 63 ARG 63 98 98 ARG ARG A . n A 1 64 GLY 64 99 99 GLY GLY A . n A 1 65 TRP 65 100 100 TRP TRP A . n A 1 66 GLU 66 101 101 GLU GLU A . n A 1 67 CYS 67 102 102 CYS CYS A . n A 1 68 THR 68 103 103 THR THR A . n A 1 69 LYS 69 104 104 LYS LYS A . n A 1 70 ASP 70 105 105 ASP ASP A . n A 1 71 ARG 71 106 106 ARG ARG A . n A 1 72 CYS 72 107 107 CYS CYS A . n A 1 73 GLY 73 108 108 GLY GLY A . n A 1 74 GLU 74 109 109 GLU GLU A . n A 1 75 VAL 75 110 110 VAL VAL A . n A 1 76 ARG 76 111 111 ARG ARG A . n A 1 77 ASN 77 112 112 ASN ASN A . n A 1 78 GLU 78 113 113 GLU GLU A . n A 1 79 GLU 79 114 114 GLU GLU A . n A 1 80 ASN 80 115 115 ASN ASN A . n A 1 81 ALA 81 116 116 ALA ALA A . n A 1 82 CYS 82 117 117 CYS CYS A . n A 1 83 HIS 83 118 118 HIS HIS A . n A 1 84 CYS 84 119 119 CYS CYS A . n A 1 85 SER 85 120 120 SER SER A . n A 1 86 GLU 86 121 121 GLU GLU A . n A 1 87 ASP 87 122 122 ASP ASP A . n A 1 88 CYS 88 123 123 CYS CYS A . n A 1 89 LEU 89 124 124 LEU LEU A . n A 1 90 SER 90 125 125 SER SER A . n A 1 91 ARG 91 126 126 ARG ARG A . n A 1 92 GLY 92 127 127 GLY GLY A . n A 1 93 ASP 93 128 128 ASP ASP A . n A 1 94 CYS 94 129 129 CYS CYS A . n A 1 95 CYS 95 130 130 CYS CYS A . n A 1 96 THR 96 131 131 THR THR A . n A 1 97 ASN 97 132 132 ASN ASN A . n A 1 98 TYR 98 133 133 TYR TYR A . n A 1 99 GLN 99 134 134 GLN GLN A . n A 1 100 VAL 100 135 135 VAL VAL A . n A 1 101 VAL 101 136 136 VAL VAL A . n A 1 102 CYS 102 137 137 CYS CYS A . n A 1 103 LYS 103 138 138 LYS LYS A . n A 1 104 GLY 104 139 139 GLY GLY A . n A 1 105 GLU 105 140 140 GLU GLU A . n A 1 106 SER 106 141 141 SER SER A . n A 1 107 HIS 107 142 142 HIS HIS A . n A 1 108 TRP 108 143 143 TRP TRP A . n A 1 109 VAL 109 144 144 VAL VAL A . n A 1 110 ASP 110 145 145 ASP ASP A . n A 1 111 ASP 111 146 146 ASP ASP A . n A 1 112 ASP 112 147 147 ASP ASP A . n A 1 113 CYS 113 148 148 CYS CYS A . n A 1 114 GLU 114 149 149 GLU GLU A . n A 1 115 GLU 115 150 150 GLU GLU A . n A 1 116 ILE 116 151 151 ILE ILE A . n A 1 117 ARG 117 152 152 ARG ARG A . n A 1 118 VAL 118 153 153 VAL VAL A . n A 1 119 PRO 119 154 154 PRO PRO A . n A 1 120 GLU 120 155 155 GLU GLU A . n A 1 121 CYS 121 156 156 CYS CYS A . n A 1 122 PRO 122 157 157 PRO PRO A . n A 1 123 ALA 123 158 158 ALA ALA A . n A 1 124 GLY 124 159 159 GLY GLY A . n A 1 125 PHE 125 160 160 PHE PHE A . n A 1 126 VAL 126 161 161 VAL VAL A . n A 1 127 ARG 127 162 162 ARG ARG A . n A 1 128 PRO 128 163 163 PRO PRO A . n A 1 129 PRO 129 164 164 PRO PRO A . n A 1 130 LEU 130 165 165 LEU LEU A . n A 1 131 ILE 131 166 166 ILE ILE A . n A 1 132 ILE 132 167 167 ILE ILE A . n A 1 133 PHE 133 168 168 PHE PHE A . n A 1 134 SER 134 169 169 SER SER A . n A 1 135 VAL 135 170 170 VAL VAL A . n A 1 136 ASP 136 171 171 ASP ASP A . n A 1 137 GLY 137 172 172 GLY GLY A . n A 1 138 PHE 138 173 173 PHE PHE A . n A 1 139 ARG 139 174 174 ARG ARG A . n A 1 140 ALA 140 175 175 ALA ALA A . n A 1 141 SER 141 176 176 SER SER A . n A 1 142 TYR 142 177 177 TYR TYR A . n A 1 143 MET 143 178 178 MET MET A . n A 1 144 LYS 144 179 179 LYS LYS A . n A 1 145 LYS 145 180 180 LYS LYS A . n A 1 146 GLY 146 181 181 GLY GLY A . n A 1 147 SER 147 182 182 SER SER A . n A 1 148 LYS 148 183 183 LYS LYS A . n A 1 149 VAL 149 184 184 VAL VAL A . n A 1 150 MET 150 185 185 MET MET A . n A 1 151 PRO 151 186 186 PRO PRO A . n A 1 152 ASN 152 187 187 ASN ASN A . n A 1 153 ILE 153 188 188 ILE ILE A . n A 1 154 GLU 154 189 189 GLU GLU A . n A 1 155 LYS 155 190 190 LYS LYS A . n A 1 156 LEU 156 191 191 LEU LEU A . n A 1 157 ARG 157 192 192 ARG ARG A . n A 1 158 SER 158 193 193 SER SER A . n A 1 159 CYS 159 194 194 CYS CYS A . n A 1 160 GLY 160 195 195 GLY GLY A . n A 1 161 THR 161 196 196 THR THR A . n A 1 162 HIS 162 197 197 HIS HIS A . n A 1 163 ALA 163 198 198 ALA ALA A . n A 1 164 PRO 164 199 199 PRO PRO A . n A 1 165 TYR 165 200 200 TYR TYR A . n A 1 166 MET 166 201 201 MET MET A . n A 1 167 ARG 167 202 202 ARG ARG A . n A 1 168 PRO 168 203 203 PRO PRO A . n A 1 169 VAL 169 204 204 VAL VAL A . n A 1 170 TYR 170 205 205 TYR TYR A . n A 1 171 PRO 171 206 206 PRO PRO A . n A 1 172 THR 172 207 207 THR THR A . n A 1 173 LYS 173 208 208 LYS LYS A . n A 1 174 THR 174 209 209 THR THR A . n A 1 175 PHE 175 210 210 PHE PHE A . n A 1 176 PRO 176 211 211 PRO PRO A . n A 1 177 ASN 177 212 212 ASN ASN A . n A 1 178 LEU 178 213 213 LEU LEU A . n A 1 179 TYR 179 214 214 TYR TYR A . n A 1 180 THR 180 215 215 THR THR A . n A 1 181 LEU 181 216 216 LEU LEU A . n A 1 182 ALA 182 217 217 ALA ALA A . n A 1 183 THR 183 218 218 THR THR A . n A 1 184 GLY 184 219 219 GLY GLY A . n A 1 185 LEU 185 220 220 LEU LEU A . n A 1 186 TYR 186 221 221 TYR TYR A . n A 1 187 PRO 187 222 222 PRO PRO A . n A 1 188 GLU 188 223 223 GLU GLU A . n A 1 189 SER 189 224 224 SER SER A . n A 1 190 HIS 190 225 225 HIS HIS A . n A 1 191 GLY 191 226 226 GLY GLY A . n A 1 192 ILE 192 227 227 ILE ILE A . n A 1 193 VAL 193 228 228 VAL VAL A . n A 1 194 GLY 194 229 229 GLY GLY A . n A 1 195 ASN 195 230 230 ASN ASN A . n A 1 196 SER 196 231 231 SER SER A . n A 1 197 MET 197 232 232 MET MET A . n A 1 198 TYR 198 233 233 TYR TYR A . n A 1 199 ASP 199 234 234 ASP ASP A . n A 1 200 PRO 200 235 235 PRO PRO A . n A 1 201 VAL 201 236 236 VAL VAL A . n A 1 202 PHE 202 237 237 PHE PHE A . n A 1 203 ASP 203 238 238 ASP ASP A . n A 1 204 ALA 204 239 239 ALA ALA A . n A 1 205 THR 205 240 240 THR THR A . n A 1 206 PHE 206 241 241 PHE PHE A . n A 1 207 HIS 207 242 242 HIS HIS A . n A 1 208 LEU 208 243 243 LEU LEU A . n A 1 209 ARG 209 244 244 ARG ARG A . n A 1 210 GLY 210 245 245 GLY GLY A . n A 1 211 ARG 211 246 246 ARG ARG A . n A 1 212 GLU 212 247 247 GLU GLU A . n A 1 213 LYS 213 248 248 LYS LYS A . n A 1 214 PHE 214 249 249 PHE PHE A . n A 1 215 ASN 215 250 250 ASN ASN A . n A 1 216 HIS 216 251 251 HIS HIS A . n A 1 217 ARG 217 252 252 ARG ARG A . n A 1 218 TRP 218 253 253 TRP TRP A . n A 1 219 TRP 219 254 254 TRP TRP A . n A 1 220 GLY 220 255 255 GLY GLY A . n A 1 221 GLY 221 256 256 GLY GLY A . n A 1 222 GLN 222 257 257 GLN GLN A . n A 1 223 PRO 223 258 258 PRO PRO A . n A 1 224 LEU 224 259 259 LEU LEU A . n A 1 225 TRP 225 260 260 TRP TRP A . n A 1 226 ILE 226 261 261 ILE ILE A . n A 1 227 THR 227 262 262 THR THR A . n A 1 228 ALA 228 263 263 ALA ALA A . n A 1 229 THR 229 264 264 THR THR A . n A 1 230 LYS 230 265 265 LYS LYS A . n A 1 231 GLN 231 266 266 GLN GLN A . n A 1 232 GLY 232 267 267 GLY GLY A . n A 1 233 VAL 233 268 268 VAL VAL A . n A 1 234 ARG 234 269 269 ARG ARG A . n A 1 235 ALA 235 270 270 ALA ALA A . n A 1 236 GLY 236 271 271 GLY GLY A . n A 1 237 THR 237 272 272 THR THR A . n A 1 238 PHE 238 273 273 PHE PHE A . n A 1 239 PHE 239 274 274 PHE PHE A . n A 1 240 TRP 240 275 275 TRP TRP A . n A 1 241 SER 241 276 276 SER SER A . n A 1 242 VAL 242 277 277 VAL VAL A . n A 1 243 SER 243 278 278 SER SER A . n A 1 244 ILE 244 279 279 ILE ILE A . n A 1 245 PRO 245 280 280 PRO PRO A . n A 1 246 HIS 246 281 281 HIS HIS A . n A 1 247 GLU 247 282 282 GLU GLU A . n A 1 248 ARG 248 283 283 ARG ARG A . n A 1 249 ARG 249 284 284 ARG ARG A . n A 1 250 ILE 250 285 285 ILE ILE A . n A 1 251 LEU 251 286 286 LEU LEU A . n A 1 252 THR 252 287 287 THR THR A . n A 1 253 ILE 253 288 288 ILE ILE A . n A 1 254 LEU 254 289 289 LEU LEU A . n A 1 255 GLN 255 290 290 GLN GLN A . n A 1 256 TRP 256 291 291 TRP TRP A . n A 1 257 LEU 257 292 292 LEU LEU A . n A 1 258 SER 258 293 293 SER SER A . n A 1 259 LEU 259 294 294 LEU LEU A . n A 1 260 PRO 260 295 295 PRO PRO A . n A 1 261 ASP 261 296 296 ASP ASP A . n A 1 262 ASN 262 297 297 ASN ASN A . n A 1 263 GLU 263 298 298 GLU GLU A . n A 1 264 ARG 264 299 299 ARG ARG A . n A 1 265 PRO 265 300 300 PRO PRO A . n A 1 266 SER 266 301 301 SER SER A . n A 1 267 VAL 267 302 302 VAL VAL A . n A 1 268 TYR 268 303 303 TYR TYR A . n A 1 269 ALA 269 304 304 ALA ALA A . n A 1 270 PHE 270 305 305 PHE PHE A . n A 1 271 TYR 271 306 306 TYR TYR A . n A 1 272 SER 272 307 307 SER SER A . n A 1 273 GLU 273 308 308 GLU GLU A . n A 1 274 GLN 274 309 309 GLN GLN A . n A 1 275 PRO 275 310 310 PRO PRO A . n A 1 276 ASP 276 311 311 ASP ASP A . n A 1 277 PHE 277 312 312 PHE PHE A . n A 1 278 SER 278 313 313 SER SER A . n A 1 279 GLY 279 314 314 GLY GLY A . n A 1 280 HIS 280 315 315 HIS HIS A . n A 1 281 LYS 281 316 316 LYS LYS A . n A 1 282 TYR 282 317 317 TYR TYR A . n A 1 283 GLY 283 318 318 GLY GLY A . n A 1 284 PRO 284 319 319 PRO PRO A . n A 1 285 PHE 285 320 320 PHE PHE A . n A 1 286 GLY 286 321 321 GLY GLY A . n A 1 287 PRO 287 322 322 PRO PRO A . n A 1 288 GLU 288 323 323 GLU GLU A . n A 1 289 MET 289 324 324 MET MET A . n A 1 290 THR 290 325 325 THR THR A . n A 1 291 ASN 291 326 326 ASN ASN A . n A 1 292 PRO 292 327 327 PRO PRO A . n A 1 293 LEU 293 328 328 LEU LEU A . n A 1 294 ARG 294 329 329 ARG ARG A . n A 1 295 GLU 295 330 330 GLU GLU A . n A 1 296 ILE 296 331 331 ILE ILE A . n A 1 297 ASP 297 332 332 ASP ASP A . n A 1 298 LYS 298 333 333 LYS LYS A . n A 1 299 THR 299 334 334 THR THR A . n A 1 300 VAL 300 335 335 VAL VAL A . n A 1 301 GLY 301 336 336 GLY GLY A . n A 1 302 GLN 302 337 337 GLN GLN A . n A 1 303 LEU 303 338 338 LEU LEU A . n A 1 304 MET 304 339 339 MET MET A . n A 1 305 ASP 305 340 340 ASP ASP A . n A 1 306 GLY 306 341 341 GLY GLY A . n A 1 307 LEU 307 342 342 LEU LEU A . n A 1 308 LYS 308 343 343 LYS LYS A . n A 1 309 GLN 309 344 344 GLN GLN A . n A 1 310 LEU 310 345 345 LEU LEU A . n A 1 311 LYS 311 346 346 LYS LYS A . n A 1 312 LEU 312 347 347 LEU LEU A . n A 1 313 HIS 313 348 348 HIS HIS A . n A 1 314 ARG 314 349 349 ARG ARG A . n A 1 315 CYS 315 350 350 CYS CYS A . n A 1 316 VAL 316 351 351 VAL VAL A . n A 1 317 ASN 317 352 352 ASN ASN A . n A 1 318 VAL 318 353 353 VAL VAL A . n A 1 319 ILE 319 354 354 ILE ILE A . n A 1 320 PHE 320 355 355 PHE PHE A . n A 1 321 VAL 321 356 356 VAL VAL A . n A 1 322 GLY 322 357 357 GLY GLY A . n A 1 323 ASP 323 358 358 ASP ASP A . n A 1 324 HIS 324 359 359 HIS HIS A . n A 1 325 GLY 325 360 360 GLY GLY A . n A 1 326 MET 326 361 361 MET MET A . n A 1 327 GLU 327 362 362 GLU GLU A . n A 1 328 ASP 328 363 363 ASP ASP A . n A 1 329 VAL 329 364 364 VAL VAL A . n A 1 330 THR 330 365 365 THR THR A . n A 1 331 CYS 331 366 366 CYS CYS A . n A 1 332 ASP 332 367 367 ASP ASP A . n A 1 333 ARG 333 368 368 ARG ARG A . n A 1 334 THR 334 369 369 THR THR A . n A 1 335 GLU 335 370 370 GLU GLU A . n A 1 336 PHE 336 371 371 PHE PHE A . n A 1 337 LEU 337 372 372 LEU LEU A . n A 1 338 SER 338 373 373 SER SER A . n A 1 339 ASN 339 374 374 ASN ASN A . n A 1 340 TYR 340 375 375 TYR TYR A . n A 1 341 LEU 341 376 376 LEU LEU A . n A 1 342 THR 342 377 377 THR THR A . n A 1 343 ASN 343 378 378 ASN ASN A . n A 1 344 VAL 344 379 379 VAL VAL A . n A 1 345 ASP 345 380 380 ASP ASP A . n A 1 346 ASP 346 381 381 ASP ASP A . n A 1 347 ILE 347 382 382 ILE ILE A . n A 1 348 THR 348 383 383 THR THR A . n A 1 349 LEU 349 384 384 LEU LEU A . n A 1 350 VAL 350 385 385 VAL VAL A . n A 1 351 PRO 351 386 386 PRO PRO A . n A 1 352 GLY 352 387 387 GLY GLY A . n A 1 353 THR 353 388 388 THR THR A . n A 1 354 LEU 354 389 389 LEU LEU A . n A 1 355 GLY 355 390 390 GLY GLY A . n A 1 356 ARG 356 391 391 ARG ARG A . n A 1 357 ILE 357 392 392 ILE ILE A . n A 1 358 ARG 358 393 393 ARG ARG A . n A 1 359 PRO 359 394 394 PRO PRO A . n A 1 360 LYS 360 395 395 LYS LYS A . n A 1 361 ILE 361 396 396 ILE ILE A . n A 1 362 PRO 362 397 397 PRO PRO A . n A 1 363 ASN 363 398 398 ASN ASN A . n A 1 364 ASN 364 399 399 ASN ASN A . n A 1 365 LEU 365 400 400 LEU LEU A . n A 1 366 LYS 366 401 401 LYS LYS A . n A 1 367 TYR 367 402 402 TYR TYR A . n A 1 368 ASP 368 403 403 ASP ASP A . n A 1 369 PRO 369 404 404 PRO PRO A . n A 1 370 LYS 370 405 405 LYS LYS A . n A 1 371 ALA 371 406 406 ALA ALA A . n A 1 372 ILE 372 407 407 ILE ILE A . n A 1 373 ILE 373 408 408 ILE ILE A . n A 1 374 ALA 374 409 409 ALA ALA A . n A 1 375 ASN 375 410 410 ASN ASN A . n A 1 376 LEU 376 411 411 LEU LEU A . n A 1 377 THR 377 412 412 THR THR A . n A 1 378 CYS 378 413 413 CYS CYS A . n A 1 379 LYS 379 414 414 LYS LYS A . n A 1 380 LYS 380 415 415 LYS LYS A . n A 1 381 PRO 381 416 416 PRO PRO A . n A 1 382 ASP 382 417 417 ASP ASP A . n A 1 383 GLN 383 418 418 GLN GLN A . n A 1 384 HIS 384 419 419 HIS HIS A . n A 1 385 PHE 385 420 420 PHE PHE A . n A 1 386 LYS 386 421 421 LYS LYS A . n A 1 387 PRO 387 422 422 PRO PRO A . n A 1 388 TYR 388 423 423 TYR TYR A . n A 1 389 MET 389 424 424 MET MET A . n A 1 390 LYS 390 425 425 LYS LYS A . n A 1 391 GLN 391 426 426 GLN GLN A . n A 1 392 HIS 392 427 427 HIS HIS A . n A 1 393 LEU 393 428 428 LEU LEU A . n A 1 394 PRO 394 429 429 PRO PRO A . n A 1 395 LYS 395 430 430 LYS LYS A . n A 1 396 ARG 396 431 431 ARG ARG A . n A 1 397 LEU 397 432 432 LEU LEU A . n A 1 398 HIS 398 433 433 HIS HIS A . n A 1 399 TYR 399 434 434 TYR TYR A . n A 1 400 ALA 400 435 435 ALA ALA A . n A 1 401 ASN 401 436 436 ASN ASN A . n A 1 402 ASN 402 437 437 ASN ASN A . n A 1 403 ARG 403 438 438 ARG ARG A . n A 1 404 ARG 404 439 439 ARG ARG A . n A 1 405 ILE 405 440 440 ILE ILE A . n A 1 406 GLU 406 441 441 GLU GLU A . n A 1 407 ASP 407 442 442 ASP ASP A . n A 1 408 LEU 408 443 443 LEU LEU A . n A 1 409 HIS 409 444 444 HIS HIS A . n A 1 410 LEU 410 445 445 LEU LEU A . n A 1 411 LEU 411 446 446 LEU LEU A . n A 1 412 VAL 412 447 447 VAL VAL A . n A 1 413 GLU 413 448 448 GLU GLU A . n A 1 414 ARG 414 449 449 ARG ARG A . n A 1 415 ARG 415 450 450 ARG ARG A . n A 1 416 TRP 416 451 451 TRP TRP A . n A 1 417 HIS 417 452 452 HIS HIS A . n A 1 418 VAL 418 453 453 VAL VAL A . n A 1 419 ALA 419 454 454 ALA ALA A . n A 1 420 ARG 420 455 455 ARG ARG A . n A 1 421 LYS 421 456 456 LYS LYS A . n A 1 422 PRO 422 457 457 PRO PRO A . n A 1 423 LEU 423 458 458 LEU LEU A . n A 1 424 ASP 424 459 459 ASP ASP A . n A 1 425 VAL 425 460 460 VAL VAL A . n A 1 426 TYR 426 461 461 TYR TYR A . n A 1 427 LYS 427 462 462 LYS LYS A . n A 1 428 LYS 428 463 463 LYS LYS A . n A 1 429 PRO 429 464 ? ? ? A . n A 1 430 SER 430 465 ? ? ? A . n A 1 431 GLY 431 466 ? ? ? A . n A 1 432 LYS 432 467 ? ? ? A . n A 1 433 CYS 433 468 468 CYS CYS A . n A 1 434 PHE 434 469 469 PHE PHE A . n A 1 435 PHE 435 470 470 PHE PHE A . n A 1 436 GLN 436 471 471 GLN GLN A . n A 1 437 GLY 437 472 472 GLY GLY A . n A 1 438 ASP 438 473 473 ASP ASP A . n A 1 439 HIS 439 474 474 HIS HIS A . n A 1 440 GLY 440 475 475 GLY GLY A . n A 1 441 PHE 441 476 476 PHE PHE A . n A 1 442 ASP 442 477 477 ASP ASP A . n A 1 443 ASN 443 478 478 ASN ASN A . n A 1 444 LYS 444 479 479 LYS LYS A . n A 1 445 VAL 445 480 480 VAL VAL A . n A 1 446 ASN 446 481 481 ASN ASN A . n A 1 447 SER 447 482 482 SER SER A . n A 1 448 MET 448 483 483 MET MET A . n A 1 449 GLN 449 484 484 GLN GLN A . n A 1 450 THR 450 485 485 THR THR A . n A 1 451 VAL 451 486 486 VAL VAL A . n A 1 452 PHE 452 487 487 PHE PHE A . n A 1 453 VAL 453 488 488 VAL VAL A . n A 1 454 GLY 454 489 489 GLY GLY A . n A 1 455 TYR 455 490 490 TYR TYR A . n A 1 456 GLY 456 491 491 GLY GLY A . n A 1 457 PRO 457 492 492 PRO PRO A . n A 1 458 THR 458 493 493 THR THR A . n A 1 459 PHE 459 494 494 PHE PHE A . n A 1 460 LYS 460 495 495 LYS LYS A . n A 1 461 TYR 461 496 496 TYR TYR A . n A 1 462 ARG 462 497 497 ARG ARG A . n A 1 463 THR 463 498 498 THR THR A . n A 1 464 LYS 464 499 499 LYS LYS A . n A 1 465 VAL 465 500 500 VAL VAL A . n A 1 466 PRO 466 501 501 PRO PRO A . n A 1 467 PRO 467 502 502 PRO PRO A . n A 1 468 PHE 468 503 503 PHE PHE A . n A 1 469 GLU 469 504 504 GLU GLU A . n A 1 470 ASN 470 505 505 ASN ASN A . n A 1 471 ILE 471 506 506 ILE ILE A . n A 1 472 GLU 472 507 507 GLU GLU A . n A 1 473 LEU 473 508 508 LEU LEU A . n A 1 474 TYR 474 509 509 TYR TYR A . n A 1 475 ASN 475 510 510 ASN ASN A . n A 1 476 VAL 476 511 511 VAL VAL A . n A 1 477 MET 477 512 512 MET MET A . n A 1 478 CYS 478 513 513 CYS CYS A . n A 1 479 ASP 479 514 514 ASP ASP A . n A 1 480 LEU 480 515 515 LEU LEU A . n A 1 481 LEU 481 516 516 LEU LEU A . n A 1 482 GLY 482 517 517 GLY GLY A . n A 1 483 LEU 483 518 518 LEU LEU A . n A 1 484 LYS 484 519 519 LYS LYS A . n A 1 485 PRO 485 520 520 PRO PRO A . n A 1 486 ALA 486 521 521 ALA ALA A . n A 1 487 PRO 487 522 522 PRO PRO A . n A 1 488 ASN 488 523 523 ASN ASN A . n A 1 489 ASN 489 524 524 ASN ASN A . n A 1 490 GLY 490 525 525 GLY GLY A . n A 1 491 THR 491 526 526 THR THR A . n A 1 492 HIS 492 527 527 HIS HIS A . n A 1 493 GLY 493 528 528 GLY GLY A . n A 1 494 SER 494 529 529 SER SER A . n A 1 495 LEU 495 530 530 LEU LEU A . n A 1 496 ASN 496 531 531 ASN ASN A . n A 1 497 HIS 497 532 532 HIS HIS A . n A 1 498 LEU 498 533 533 LEU LEU A . n A 1 499 LEU 499 534 534 LEU LEU A . n A 1 500 ARG 500 535 535 ARG ARG A . n A 1 501 THR 501 536 536 THR THR A . n A 1 502 ASN 502 537 537 ASN ASN A . n A 1 503 THR 503 538 538 THR THR A . n A 1 504 PHE 504 539 539 PHE PHE A . n A 1 505 ARG 505 540 540 ARG ARG A . n A 1 506 PRO 506 541 541 PRO PRO A . n A 1 507 THR 507 542 542 THR THR A . n A 1 508 LEU 508 543 543 LEU LEU A . n A 1 509 PRO 509 544 544 PRO PRO A . n A 1 510 GLU 510 545 545 GLU GLU A . n A 1 511 GLU 511 546 546 GLU GLU A . n A 1 512 VAL 512 547 547 VAL VAL A . n A 1 513 SER 513 548 548 SER SER A . n A 1 514 ARG 514 549 549 ARG ARG A . n A 1 515 PRO 515 550 550 PRO PRO A . n A 1 516 ASN 516 551 551 ASN ASN A . n A 1 517 TYR 517 552 552 TYR TYR A . n A 1 518 PRO 518 553 553 PRO PRO A . n A 1 519 GLY 519 554 554 GLY GLY A . n A 1 520 ILE 520 555 555 ILE ILE A . n A 1 521 MET 521 556 556 MET MET A . n A 1 522 TYR 522 557 557 TYR TYR A . n A 1 523 LEU 523 558 558 LEU LEU A . n A 1 524 GLN 524 559 559 GLN GLN A . n A 1 525 SER 525 560 560 SER SER A . n A 1 526 ASP 526 561 561 ASP ASP A . n A 1 527 PHE 527 562 562 PHE PHE A . n A 1 528 ASP 528 563 563 ASP ASP A . n A 1 529 LEU 529 564 564 LEU LEU A . n A 1 530 GLY 530 565 565 GLY GLY A . n A 1 531 CYS 531 566 566 CYS CYS A . n A 1 532 THR 532 567 567 THR THR A . n A 1 533 CYS 533 568 568 CYS CYS A . n A 1 534 ASP 534 569 569 ASP ASP A . n A 1 535 ASP 535 570 570 ASP ASP A . n A 1 536 LYS 536 571 571 LYS LYS A . n A 1 537 ASN 537 572 572 ASN ASN A . n A 1 538 LYS 538 573 573 LYS LYS A . n A 1 539 LEU 539 574 574 LEU LEU A . n A 1 540 GLU 540 575 575 GLU GLU A . n A 1 541 GLU 541 576 576 GLU GLU A . n A 1 542 LEU 542 577 577 LEU LEU A . n A 1 543 ASN 543 578 578 ASN ASN A . n A 1 544 LYS 544 579 579 LYS LYS A . n A 1 545 ARG 545 580 580 ARG ARG A . n A 1 546 LEU 546 581 581 LEU LEU A . n A 1 547 HIS 547 582 582 HIS HIS A . n A 1 548 THR 548 583 583 THR THR A . n A 1 549 LYS 549 584 584 LYS LYS A . n A 1 550 GLY 550 585 585 GLY GLY A . n A 1 551 SER 551 586 586 SER SER A . n A 1 552 THR 552 587 587 THR THR A . n A 1 553 GLU 553 588 588 GLU GLU A . n A 1 554 GLU 554 589 589 GLU GLU A . n A 1 555 ARG 555 590 590 ARG ARG A . n A 1 556 HIS 556 591 591 HIS HIS A . n A 1 557 LEU 557 592 592 LEU LEU A . n A 1 558 LEU 558 593 593 LEU LEU A . n A 1 559 TYR 559 594 594 TYR TYR A . n A 1 560 GLY 560 595 595 GLY GLY A . n A 1 561 ARG 561 596 596 ARG ARG A . n A 1 562 PRO 562 597 597 PRO PRO A . n A 1 563 ALA 563 598 598 ALA ALA A . n A 1 564 VAL 564 599 599 VAL VAL A . n A 1 565 LEU 565 600 600 LEU LEU A . n A 1 566 TYR 566 601 601 TYR TYR A . n A 1 567 ARG 567 602 602 ARG ARG A . n A 1 568 THR 568 603 603 THR THR A . n A 1 569 SER 569 604 604 SER SER A . n A 1 570 TYR 570 605 605 TYR TYR A . n A 1 571 ASP 571 606 606 ASP ASP A . n A 1 572 ILE 572 607 607 ILE ILE A . n A 1 573 LEU 573 608 608 LEU LEU A . n A 1 574 TYR 574 609 609 TYR TYR A . n A 1 575 HIS 575 610 610 HIS HIS A . n A 1 576 THR 576 611 611 THR THR A . n A 1 577 ASP 577 612 612 ASP ASP A . n A 1 578 PHE 578 613 613 PHE PHE A . n A 1 579 GLU 579 614 614 GLU GLU A . n A 1 580 SER 580 615 615 SER SER A . n A 1 581 GLY 581 616 616 GLY GLY A . n A 1 582 TYR 582 617 617 TYR TYR A . n A 1 583 SER 583 618 618 SER SER A . n A 1 584 GLU 584 619 619 GLU GLU A . n A 1 585 ILE 585 620 620 ILE ILE A . n A 1 586 PHE 586 621 621 PHE PHE A . n A 1 587 LEU 587 622 622 LEU LEU A . n A 1 588 MET 588 623 623 MET MET A . n A 1 589 PRO 589 624 624 PRO PRO A . n A 1 590 LEU 590 625 625 LEU LEU A . n A 1 591 TRP 591 626 626 TRP TRP A . n A 1 592 THR 592 627 627 THR THR A . n A 1 593 SER 593 628 628 SER SER A . n A 1 594 TYR 594 629 629 TYR TYR A . n A 1 595 THR 595 630 630 THR THR A . n A 1 596 ILE 596 631 631 ILE ILE A . n A 1 597 SER 597 632 632 SER SER A . n A 1 598 LYS 598 633 633 LYS LYS A . n A 1 599 GLN 599 634 634 GLN GLN A . n A 1 600 ALA 600 635 635 ALA ALA A . n A 1 601 GLU 601 636 636 GLU GLU A . n A 1 602 VAL 602 637 637 VAL VAL A . n A 1 603 SER 603 638 638 SER SER A . n A 1 604 SER 604 639 639 SER SER A . n A 1 605 ILE 605 640 640 ILE ILE A . n A 1 606 PRO 606 641 641 PRO PRO A . n A 1 607 GLU 607 642 642 GLU GLU A . n A 1 608 HIS 608 643 643 HIS HIS A . n A 1 609 LEU 609 644 644 LEU LEU A . n A 1 610 THR 610 645 645 THR THR A . n A 1 611 ASN 611 646 646 ASN ASN A . n A 1 612 CYS 612 647 647 CYS CYS A . n A 1 613 VAL 613 648 648 VAL VAL A . n A 1 614 ARG 614 649 649 ARG ARG A . n A 1 615 PRO 615 650 650 PRO PRO A . n A 1 616 ASP 616 651 651 ASP ASP A . n A 1 617 VAL 617 652 652 VAL VAL A . n A 1 618 ARG 618 653 653 ARG ARG A . n A 1 619 VAL 619 654 654 VAL VAL A . n A 1 620 SER 620 655 655 SER SER A . n A 1 621 PRO 621 656 656 PRO PRO A . n A 1 622 GLY 622 657 657 GLY GLY A . n A 1 623 PHE 623 658 658 PHE PHE A . n A 1 624 SER 624 659 659 SER SER A . n A 1 625 GLN 625 660 660 GLN GLN A . n A 1 626 ASN 626 661 661 ASN ASN A . n A 1 627 CYS 627 662 662 CYS CYS A . n A 1 628 LEU 628 663 663 LEU LEU A . n A 1 629 ALA 629 664 664 ALA ALA A . n A 1 630 TYR 630 665 665 TYR TYR A . n A 1 631 LYS 631 666 666 LYS LYS A . n A 1 632 ASN 632 667 667 ASN ASN A . n A 1 633 ASP 633 668 668 ASP ASP A . n A 1 634 LYS 634 669 669 LYS LYS A . n A 1 635 GLN 635 670 670 GLN GLN A . n A 1 636 MET 636 671 671 MET MET A . n A 1 637 SER 637 672 672 SER SER A . n A 1 638 TYR 638 673 673 TYR TYR A . n A 1 639 GLY 639 674 674 GLY GLY A . n A 1 640 PHE 640 675 675 PHE PHE A . n A 1 641 LEU 641 676 676 LEU LEU A . n A 1 642 PHE 642 677 677 PHE PHE A . n A 1 643 PRO 643 678 678 PRO PRO A . n A 1 644 PRO 644 679 679 PRO PRO A . n A 1 645 TYR 645 680 680 TYR TYR A . n A 1 646 LEU 646 681 681 LEU LEU A . n A 1 647 SER 647 682 682 SER SER A . n A 1 648 SER 648 683 683 SER SER A . n A 1 649 SER 649 684 684 SER SER A . n A 1 650 PRO 650 685 685 PRO PRO A . n A 1 651 GLU 651 686 686 GLU GLU A . n A 1 652 ALA 652 687 687 ALA ALA A . n A 1 653 LYS 653 688 688 LYS LYS A . n A 1 654 TYR 654 689 689 TYR TYR A . n A 1 655 ASP 655 690 690 ASP ASP A . n A 1 656 ALA 656 691 691 ALA ALA A . n A 1 657 PHE 657 692 692 PHE PHE A . n A 1 658 LEU 658 693 693 LEU LEU A . n A 1 659 VAL 659 694 694 VAL VAL A . n A 1 660 THR 660 695 695 THR THR A . n A 1 661 ASN 661 696 696 ASN ASN A . n A 1 662 MET 662 697 697 MET MET A . n A 1 663 VAL 663 698 698 VAL VAL A . n A 1 664 PRO 664 699 699 PRO PRO A . n A 1 665 MET 665 700 700 MET MET A . n A 1 666 TYR 666 701 701 TYR TYR A . n A 1 667 PRO 667 702 702 PRO PRO A . n A 1 668 ALA 668 703 703 ALA ALA A . n A 1 669 PHE 669 704 704 PHE PHE A . n A 1 670 LYS 670 705 705 LYS LYS A . n A 1 671 ARG 671 706 706 ARG ARG A . n A 1 672 VAL 672 707 707 VAL VAL A . n A 1 673 TRP 673 708 708 TRP TRP A . n A 1 674 THR 674 709 709 THR THR A . n A 1 675 TYR 675 710 710 TYR TYR A . n A 1 676 PHE 676 711 711 PHE PHE A . n A 1 677 GLN 677 712 712 GLN GLN A . n A 1 678 ARG 678 713 713 ARG ARG A . n A 1 679 VAL 679 714 714 VAL VAL A . n A 1 680 LEU 680 715 715 LEU LEU A . n A 1 681 VAL 681 716 716 VAL VAL A . n A 1 682 LYS 682 717 717 LYS LYS A . n A 1 683 LYS 683 718 718 LYS LYS A . n A 1 684 TYR 684 719 719 TYR TYR A . n A 1 685 ALA 685 720 720 ALA ALA A . n A 1 686 SER 686 721 721 SER SER A . n A 1 687 GLU 687 722 722 GLU GLU A . n A 1 688 ARG 688 723 723 ARG ARG A . n A 1 689 ASN 689 724 724 ASN ASN A . n A 1 690 GLY 690 725 725 GLY GLY A . n A 1 691 VAL 691 726 726 VAL VAL A . n A 1 692 ASN 692 727 727 ASN ASN A . n A 1 693 VAL 693 728 728 VAL VAL A . n A 1 694 ILE 694 729 729 ILE ILE A . n A 1 695 SER 695 730 730 SER SER A . n A 1 696 GLY 696 731 731 GLY GLY A . n A 1 697 PRO 697 732 732 PRO PRO A . n A 1 698 ILE 698 733 733 ILE ILE A . n A 1 699 PHE 699 734 734 PHE PHE A . n A 1 700 ASP 700 735 735 ASP ASP A . n A 1 701 TYR 701 736 736 TYR TYR A . n A 1 702 ASN 702 737 737 ASN ASN A . n A 1 703 TYR 703 738 738 TYR TYR A . n A 1 704 ASN 704 739 739 ASN ASN A . n A 1 705 GLY 705 740 740 GLY GLY A . n A 1 706 LEU 706 741 741 LEU LEU A . n A 1 707 ARG 707 742 742 ARG ARG A . n A 1 708 ASP 708 743 743 ASP ASP A . n A 1 709 ILE 709 744 744 ILE ILE A . n A 1 710 GLU 710 745 745 GLU GLU A . n A 1 711 ASP 711 746 746 ASP ASP A . n A 1 712 GLU 712 747 747 GLU GLU A . n A 1 713 ILE 713 748 748 ILE ILE A . n A 1 714 LYS 714 749 749 LYS LYS A . n A 1 715 GLN 715 750 750 GLN GLN A . n A 1 716 TYR 716 751 751 TYR TYR A . n A 1 717 VAL 717 752 752 VAL VAL A . n A 1 718 GLU 718 753 753 GLU GLU A . n A 1 719 GLY 719 754 754 GLY GLY A . n A 1 720 SER 720 755 755 SER SER A . n A 1 721 SER 721 756 756 SER SER A . n A 1 722 ILE 722 757 757 ILE ILE A . n A 1 723 PRO 723 758 758 PRO PRO A . n A 1 724 VAL 724 759 759 VAL VAL A . n A 1 725 PRO 725 760 760 PRO PRO A . n A 1 726 THR 726 761 761 THR THR A . n A 1 727 HIS 727 762 762 HIS HIS A . n A 1 728 TYR 728 763 763 TYR TYR A . n A 1 729 TYR 729 764 764 TYR TYR A . n A 1 730 SER 730 765 765 SER SER A . n A 1 731 ILE 731 766 766 ILE ILE A . n A 1 732 ILE 732 767 767 ILE ILE A . n A 1 733 THR 733 768 768 THR THR A . n A 1 734 SER 734 769 769 SER SER A . n A 1 735 CYS 735 770 770 CYS CYS A . n A 1 736 LEU 736 771 771 LEU LEU A . n A 1 737 ASP 737 772 772 ASP ASP A . n A 1 738 PHE 738 773 773 PHE PHE A . n A 1 739 THR 739 774 774 THR THR A . n A 1 740 GLN 740 775 775 GLN GLN A . n A 1 741 PRO 741 776 776 PRO PRO A . n A 1 742 ALA 742 777 777 ALA ALA A . n A 1 743 ASP 743 778 778 ASP ASP A . n A 1 744 LYS 744 779 779 LYS LYS A . n A 1 745 CYS 745 780 780 CYS CYS A . n A 1 746 ASP 746 781 781 ASP ASP A . n A 1 747 GLY 747 782 782 GLY GLY A . n A 1 748 PRO 748 783 783 PRO PRO A . n A 1 749 LEU 749 784 784 LEU LEU A . n A 1 750 SER 750 785 785 SER SER A . n A 1 751 VAL 751 786 786 VAL VAL A . n A 1 752 SER 752 787 787 SER SER A . n A 1 753 SER 753 788 788 SER SER A . n A 1 754 PHE 754 789 789 PHE PHE A . n A 1 755 ILE 755 790 790 ILE ILE A . n A 1 756 LEU 756 791 791 LEU LEU A . n A 1 757 PRO 757 792 792 PRO PRO A . n A 1 758 HIS 758 793 793 HIS HIS A . n A 1 759 ARG 759 794 794 ARG ARG A . n A 1 760 PRO 760 795 795 PRO PRO A . n A 1 761 ASP 761 796 796 ASP ASP A . n A 1 762 ASN 762 797 797 ASN ASN A . n A 1 763 ASP 763 798 798 ASP ASP A . n A 1 764 GLU 764 799 799 GLU GLU A . n A 1 765 SER 765 800 800 SER SER A . n A 1 766 CYS 766 801 801 CYS CYS A . n A 1 767 ASN 767 802 802 ASN ASN A . n A 1 768 SER 768 803 803 SER SER A . n A 1 769 SER 769 804 804 SER SER A . n A 1 770 GLU 770 805 805 GLU GLU A . n A 1 771 ASP 771 806 806 ASP ASP A . n A 1 772 GLU 772 807 807 GLU GLU A . n A 1 773 SER 773 808 808 SER SER A . n A 1 774 LYS 774 809 809 LYS LYS A . n A 1 775 TRP 775 810 810 TRP TRP A . n A 1 776 VAL 776 811 811 VAL VAL A . n A 1 777 GLU 777 812 812 GLU GLU A . n A 1 778 GLU 778 813 813 GLU GLU A . n A 1 779 LEU 779 814 814 LEU LEU A . n A 1 780 MET 780 815 815 MET MET A . n A 1 781 LYS 781 816 816 LYS LYS A . n A 1 782 MET 782 817 817 MET MET A . n A 1 783 HIS 783 818 818 HIS HIS A . n A 1 784 THR 784 819 819 THR THR A . n A 1 785 ALA 785 820 820 ALA ALA A . n A 1 786 ARG 786 821 821 ARG ARG A . n A 1 787 VAL 787 822 822 VAL VAL A . n A 1 788 ARG 788 823 823 ARG ARG A . n A 1 789 ASP 789 824 824 ASP ASP A . n A 1 790 ILE 790 825 825 ILE ILE A . n A 1 791 GLU 791 826 826 GLU GLU A . n A 1 792 HIS 792 827 827 HIS HIS A . n A 1 793 LEU 793 828 828 LEU LEU A . n A 1 794 THR 794 829 829 THR THR A . n A 1 795 GLY 795 830 830 GLY GLY A . n A 1 796 LEU 796 831 831 LEU LEU A . n A 1 797 ASP 797 832 832 ASP ASP A . n A 1 798 PHE 798 833 833 PHE PHE A . n A 1 799 TYR 799 834 834 TYR TYR A . n A 1 800 ARG 800 835 835 ARG ARG A . n A 1 801 LYS 801 836 836 LYS LYS A . n A 1 802 THR 802 837 837 THR THR A . n A 1 803 SER 803 838 838 SER SER A . n A 1 804 ARG 804 839 839 ARG ARG A . n A 1 805 SER 805 840 840 SER SER A . n A 1 806 TYR 806 841 841 TYR TYR A . n A 1 807 SER 807 842 842 SER SER A . n A 1 808 GLU 808 843 843 GLU GLU A . n A 1 809 ILE 809 844 844 ILE ILE A . n A 1 810 LEU 810 845 845 LEU LEU A . n A 1 811 THR 811 846 846 THR THR A . n A 1 812 LEU 812 847 847 LEU LEU A . n A 1 813 LYS 813 848 848 LYS LYS A . n A 1 814 THR 814 849 849 THR THR A . n A 1 815 TYR 815 850 850 TYR TYR A . n A 1 816 LEU 816 851 851 LEU LEU A . n A 1 817 HIS 817 852 852 HIS HIS A . n A 1 818 THR 818 853 853 THR THR A . n A 1 819 TYR 819 854 854 TYR TYR A . n A 1 820 GLU 820 855 855 GLU GLU A . n A 1 821 SER 821 856 ? ? ? A . n A 1 822 GLU 822 857 ? ? ? A . n A 1 823 ILE 823 858 ? ? ? A . n A 1 824 SER 824 859 ? ? ? A . n A 1 825 ARG 825 860 ? ? ? A . n A 1 826 GLU 826 861 ? ? ? A . n A 1 827 ASN 827 862 ? ? ? A . n A 1 828 LEU 828 863 ? ? ? A . n A 1 829 TYR 829 864 ? ? ? A . n A 1 830 PHE 830 865 ? ? ? A . n A 1 831 GLN 831 866 ? ? ? A . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code B 2 NAG 1 901 898 NAG NAG A . C 2 NAG 2 902 899 NAG NAG A . D 2 NAG 1 903 900 NAG NAG A . E 2 NAG 2 904 901 NAG NAG A . F 3 BMA 3 905 902 BMA MAN A . G 4 MAN 4 906 903 MAN MAN A . H 4 MAN 5 907 904 MAN MAN A . I 4 MAN 6 908 905 MAN MAN A . J 2 NAG 1 909 907 NAG NAG A . K 2 NAG 2 910 908 NAG NAG A . L 5 ZN 1 911 1001 ZN ZN A . M 5 ZN 1 912 1002 ZN ZN A . N 6 CA 1 913 1003 CA CA A . O 7 NA 1 914 1004 NA NA A . P 8 K 1 915 1005 K K A . Q 9 SCN 1 916 1008 SCN SCN A . R 9 SCN 1 917 1009 SCN SCN A . S 10 EDO 1 918 1010 EDO EDO A . T 10 EDO 1 919 1011 EDO EDO A . U 10 EDO 1 920 1012 EDO EDO A . V 10 EDO 1 921 1013 EDO EDO A . W 10 EDO 1 922 1014 EDO EDO A . X 10 EDO 1 923 1015 EDO EDO A . Y 10 EDO 1 924 1016 EDO EDO A . Z 10 EDO 1 925 1017 EDO EDO A . AA 10 EDO 1 926 1019 EDO EDO A . BA 10 EDO 1 927 1020 EDO EDO A . CA 10 EDO 1 928 1021 EDO EDO A . DA 10 EDO 1 929 1022 EDO EDO A . EA 10 EDO 1 930 1023 EDO EDO A . FA 10 EDO 1 931 1024 EDO EDO A . GA 10 EDO 1 932 1025 EDO EDO A . HA 10 EDO 1 933 1026 EDO EDO A . IA 10 EDO 1 934 1027 EDO EDO A . JA 10 EDO 1 935 1028 EDO EDO A . KA 11 SO4 1 936 1030 SO4 SO4 A . LA 12 DWV 1 937 1100 DWV DRG A . MA 13 HOH 1 1001 1 HOH HOH A . MA 13 HOH 2 1002 3 HOH HOH A . MA 13 HOH 3 1003 4 HOH HOH A . MA 13 HOH 4 1004 5 HOH HOH A . MA 13 HOH 5 1005 6 HOH HOH A . MA 13 HOH 6 1006 7 HOH HOH A . MA 13 HOH 7 1007 8 HOH HOH A . MA 13 HOH 8 1008 9 HOH HOH A . MA 13 HOH 9 1009 10 HOH HOH A . MA 13 HOH 10 1010 11 HOH HOH A . MA 13 HOH 11 1011 12 HOH HOH A . MA 13 HOH 12 1012 13 HOH HOH A . MA 13 HOH 13 1013 14 HOH HOH A . MA 13 HOH 14 1014 15 HOH HOH A . MA 13 HOH 15 1015 16 HOH HOH A . MA 13 HOH 16 1016 17 HOH HOH A . MA 13 HOH 17 1017 18 HOH HOH A . MA 13 HOH 18 1018 19 HOH HOH A . MA 13 HOH 19 1019 20 HOH HOH A . MA 13 HOH 20 1020 21 HOH HOH A . MA 13 HOH 21 1021 22 HOH HOH A . MA 13 HOH 22 1022 23 HOH HOH A . MA 13 HOH 23 1023 24 HOH HOH A . MA 13 HOH 24 1024 25 HOH HOH A . MA 13 HOH 25 1025 26 HOH HOH A . MA 13 HOH 26 1026 27 HOH HOH A . MA 13 HOH 27 1027 28 HOH HOH A . MA 13 HOH 28 1028 29 HOH HOH A . MA 13 HOH 29 1029 30 HOH HOH A . MA 13 HOH 30 1030 31 HOH HOH A . MA 13 HOH 31 1031 32 HOH HOH A . MA 13 HOH 32 1032 33 HOH HOH A . MA 13 HOH 33 1033 34 HOH HOH A . MA 13 HOH 34 1034 35 HOH HOH A . MA 13 HOH 35 1035 36 HOH HOH A . MA 13 HOH 36 1036 37 HOH HOH A . MA 13 HOH 37 1037 38 HOH HOH A . MA 13 HOH 38 1038 39 HOH HOH A . MA 13 HOH 39 1039 40 HOH HOH A . MA 13 HOH 40 1040 41 HOH HOH A . MA 13 HOH 41 1041 42 HOH HOH A . MA 13 HOH 42 1042 43 HOH HOH A . MA 13 HOH 43 1043 44 HOH HOH A . MA 13 HOH 44 1044 45 HOH HOH A . MA 13 HOH 45 1045 46 HOH HOH A . MA 13 HOH 46 1046 47 HOH HOH A . MA 13 HOH 47 1047 48 HOH HOH A . MA 13 HOH 48 1048 49 HOH HOH A . MA 13 HOH 49 1049 50 HOH HOH A . MA 13 HOH 50 1050 51 HOH HOH A . MA 13 HOH 51 1051 52 HOH HOH A . MA 13 HOH 52 1052 53 HOH HOH A . MA 13 HOH 53 1053 54 HOH HOH A . MA 13 HOH 54 1054 55 HOH HOH A . MA 13 HOH 55 1055 56 HOH HOH A . MA 13 HOH 56 1056 57 HOH HOH A . MA 13 HOH 57 1057 58 HOH HOH A . MA 13 HOH 58 1058 59 HOH HOH A . MA 13 HOH 59 1059 60 HOH HOH A . MA 13 HOH 60 1060 61 HOH HOH A . MA 13 HOH 61 1061 62 HOH HOH A . MA 13 HOH 62 1062 63 HOH HOH A . MA 13 HOH 63 1063 64 HOH HOH A . MA 13 HOH 64 1064 65 HOH HOH A . MA 13 HOH 65 1065 66 HOH HOH A . MA 13 HOH 66 1066 67 HOH HOH A . MA 13 HOH 67 1067 68 HOH HOH A . MA 13 HOH 68 1068 69 HOH HOH A . MA 13 HOH 69 1069 70 HOH HOH A . MA 13 HOH 70 1070 71 HOH HOH A . MA 13 HOH 71 1071 72 HOH HOH A . MA 13 HOH 72 1072 73 HOH HOH A . MA 13 HOH 73 1073 74 HOH HOH A . MA 13 HOH 74 1074 75 HOH HOH A . MA 13 HOH 75 1075 76 HOH HOH A . MA 13 HOH 76 1076 77 HOH HOH A . MA 13 HOH 77 1077 78 HOH HOH A . MA 13 HOH 78 1078 79 HOH HOH A . MA 13 HOH 79 1079 80 HOH HOH A . MA 13 HOH 80 1080 81 HOH HOH A . MA 13 HOH 81 1081 82 HOH HOH A . MA 13 HOH 82 1082 83 HOH HOH A . MA 13 HOH 83 1083 84 HOH HOH A . MA 13 HOH 84 1084 85 HOH HOH A . MA 13 HOH 85 1085 86 HOH HOH A . MA 13 HOH 86 1086 87 HOH HOH A . MA 13 HOH 87 1087 88 HOH HOH A . MA 13 HOH 88 1088 89 HOH HOH A . MA 13 HOH 89 1089 90 HOH HOH A . MA 13 HOH 90 1090 91 HOH HOH A . MA 13 HOH 91 1091 92 HOH HOH A . MA 13 HOH 92 1092 93 HOH HOH A . MA 13 HOH 93 1093 94 HOH HOH A . MA 13 HOH 94 1094 95 HOH HOH A . MA 13 HOH 95 1095 96 HOH HOH A . MA 13 HOH 96 1096 97 HOH HOH A . MA 13 HOH 97 1097 98 HOH HOH A . MA 13 HOH 98 1098 99 HOH HOH A . MA 13 HOH 99 1099 100 HOH HOH A . MA 13 HOH 100 1100 101 HOH HOH A . MA 13 HOH 101 1101 102 HOH HOH A . MA 13 HOH 102 1102 103 HOH HOH A . MA 13 HOH 103 1103 104 HOH HOH A . MA 13 HOH 104 1104 105 HOH HOH A . MA 13 HOH 105 1105 106 HOH HOH A . MA 13 HOH 106 1106 108 HOH HOH A . MA 13 HOH 107 1107 109 HOH HOH A . MA 13 HOH 108 1108 110 HOH HOH A . MA 13 HOH 109 1109 111 HOH HOH A . MA 13 HOH 110 1110 112 HOH HOH A . MA 13 HOH 111 1111 113 HOH HOH A . MA 13 HOH 112 1112 114 HOH HOH A . MA 13 HOH 113 1113 115 HOH HOH A . MA 13 HOH 114 1114 116 HOH HOH A . MA 13 HOH 115 1115 117 HOH HOH A . MA 13 HOH 116 1116 118 HOH HOH A . MA 13 HOH 117 1117 119 HOH HOH A . MA 13 HOH 118 1118 120 HOH HOH A . MA 13 HOH 119 1119 121 HOH HOH A . MA 13 HOH 120 1120 122 HOH HOH A . MA 13 HOH 121 1121 123 HOH HOH A . MA 13 HOH 122 1122 124 HOH HOH A . MA 13 HOH 123 1123 125 HOH HOH A . MA 13 HOH 124 1124 126 HOH HOH A . MA 13 HOH 125 1125 127 HOH HOH A . MA 13 HOH 126 1126 128 HOH HOH A . MA 13 HOH 127 1127 129 HOH HOH A . MA 13 HOH 128 1128 130 HOH HOH A . MA 13 HOH 129 1129 131 HOH HOH A . MA 13 HOH 130 1130 132 HOH HOH A . MA 13 HOH 131 1131 133 HOH HOH A . MA 13 HOH 132 1132 134 HOH HOH A . MA 13 HOH 133 1133 135 HOH HOH A . MA 13 HOH 134 1134 136 HOH HOH A . MA 13 HOH 135 1135 137 HOH HOH A . MA 13 HOH 136 1136 138 HOH HOH A . MA 13 HOH 137 1137 139 HOH HOH A . MA 13 HOH 138 1138 140 HOH HOH A . MA 13 HOH 139 1139 141 HOH HOH A . MA 13 HOH 140 1140 142 HOH HOH A . MA 13 HOH 141 1141 143 HOH HOH A . MA 13 HOH 142 1142 144 HOH HOH A . MA 13 HOH 143 1143 145 HOH HOH A . MA 13 HOH 144 1144 146 HOH HOH A . MA 13 HOH 145 1145 147 HOH HOH A . MA 13 HOH 146 1146 148 HOH HOH A . MA 13 HOH 147 1147 149 HOH HOH A . MA 13 HOH 148 1148 150 HOH HOH A . MA 13 HOH 149 1149 151 HOH HOH A . MA 13 HOH 150 1150 152 HOH HOH A . MA 13 HOH 151 1151 153 HOH HOH A . MA 13 HOH 152 1152 154 HOH HOH A . MA 13 HOH 153 1153 155 HOH HOH A . MA 13 HOH 154 1154 156 HOH HOH A . MA 13 HOH 155 1155 157 HOH HOH A . MA 13 HOH 156 1156 158 HOH HOH A . MA 13 HOH 157 1157 159 HOH HOH A . MA 13 HOH 158 1158 160 HOH HOH A . MA 13 HOH 159 1159 161 HOH HOH A . MA 13 HOH 160 1160 162 HOH HOH A . MA 13 HOH 161 1161 164 HOH HOH A . MA 13 HOH 162 1162 165 HOH HOH A . MA 13 HOH 163 1163 166 HOH HOH A . MA 13 HOH 164 1164 167 HOH HOH A . MA 13 HOH 165 1165 168 HOH HOH A . MA 13 HOH 166 1166 169 HOH HOH A . MA 13 HOH 167 1167 170 HOH HOH A . MA 13 HOH 168 1168 171 HOH HOH A . MA 13 HOH 169 1169 172 HOH HOH A . MA 13 HOH 170 1170 173 HOH HOH A . MA 13 HOH 171 1171 174 HOH HOH A . MA 13 HOH 172 1172 175 HOH HOH A . MA 13 HOH 173 1173 176 HOH HOH A . MA 13 HOH 174 1174 177 HOH HOH A . MA 13 HOH 175 1175 179 HOH HOH A . MA 13 HOH 176 1176 180 HOH HOH A . MA 13 HOH 177 1177 181 HOH HOH A . MA 13 HOH 178 1178 182 HOH HOH A . MA 13 HOH 179 1179 183 HOH HOH A . MA 13 HOH 180 1180 184 HOH HOH A . MA 13 HOH 181 1181 185 HOH HOH A . MA 13 HOH 182 1182 186 HOH HOH A . MA 13 HOH 183 1183 187 HOH HOH A . MA 13 HOH 184 1184 188 HOH HOH A . MA 13 HOH 185 1185 189 HOH HOH A . MA 13 HOH 186 1186 190 HOH HOH A . MA 13 HOH 187 1187 191 HOH HOH A . MA 13 HOH 188 1188 192 HOH HOH A . MA 13 HOH 189 1189 193 HOH HOH A . MA 13 HOH 190 1190 194 HOH HOH A . MA 13 HOH 191 1191 195 HOH HOH A . MA 13 HOH 192 1192 196 HOH HOH A . MA 13 HOH 193 1193 197 HOH HOH A . MA 13 HOH 194 1194 198 HOH HOH A . MA 13 HOH 195 1195 199 HOH HOH A . MA 13 HOH 196 1196 200 HOH HOH A . MA 13 HOH 197 1197 201 HOH HOH A . MA 13 HOH 198 1198 202 HOH HOH A . MA 13 HOH 199 1199 203 HOH HOH A . MA 13 HOH 200 1200 204 HOH HOH A . MA 13 HOH 201 1201 205 HOH HOH A . MA 13 HOH 202 1202 206 HOH HOH A . MA 13 HOH 203 1203 207 HOH HOH A . MA 13 HOH 204 1204 208 HOH HOH A . MA 13 HOH 205 1205 209 HOH HOH A . MA 13 HOH 206 1206 210 HOH HOH A . MA 13 HOH 207 1207 211 HOH HOH A . MA 13 HOH 208 1208 212 HOH HOH A . MA 13 HOH 209 1209 213 HOH HOH A . MA 13 HOH 210 1210 214 HOH HOH A . MA 13 HOH 211 1211 215 HOH HOH A . MA 13 HOH 212 1212 216 HOH HOH A . MA 13 HOH 213 1213 217 HOH HOH A . MA 13 HOH 214 1214 218 HOH HOH A . MA 13 HOH 215 1215 219 HOH HOH A . MA 13 HOH 216 1216 221 HOH HOH A . MA 13 HOH 217 1217 222 HOH HOH A . MA 13 HOH 218 1218 223 HOH HOH A . MA 13 HOH 219 1219 224 HOH HOH A . MA 13 HOH 220 1220 225 HOH HOH A . MA 13 HOH 221 1221 227 HOH HOH A . MA 13 HOH 222 1222 228 HOH HOH A . MA 13 HOH 223 1223 229 HOH HOH A . MA 13 HOH 224 1224 230 HOH HOH A . MA 13 HOH 225 1225 231 HOH HOH A . MA 13 HOH 226 1226 232 HOH HOH A . MA 13 HOH 227 1227 233 HOH HOH A . MA 13 HOH 228 1228 234 HOH HOH A . MA 13 HOH 229 1229 235 HOH HOH A . MA 13 HOH 230 1230 236 HOH HOH A . MA 13 HOH 231 1231 237 HOH HOH A . MA 13 HOH 232 1232 238 HOH HOH A . MA 13 HOH 233 1233 239 HOH HOH A . MA 13 HOH 234 1234 240 HOH HOH A . MA 13 HOH 235 1235 241 HOH HOH A . MA 13 HOH 236 1236 243 HOH HOH A . MA 13 HOH 237 1237 244 HOH HOH A . MA 13 HOH 238 1238 245 HOH HOH A . MA 13 HOH 239 1239 246 HOH HOH A . MA 13 HOH 240 1240 247 HOH HOH A . MA 13 HOH 241 1241 248 HOH HOH A . MA 13 HOH 242 1242 249 HOH HOH A . MA 13 HOH 243 1243 252 HOH HOH A . MA 13 HOH 244 1244 253 HOH HOH A . MA 13 HOH 245 1245 254 HOH HOH A . MA 13 HOH 246 1246 255 HOH HOH A . MA 13 HOH 247 1247 256 HOH HOH A . MA 13 HOH 248 1248 257 HOH HOH A . MA 13 HOH 249 1249 259 HOH HOH A . MA 13 HOH 250 1250 260 HOH HOH A . MA 13 HOH 251 1251 261 HOH HOH A . MA 13 HOH 252 1252 262 HOH HOH A . MA 13 HOH 253 1253 263 HOH HOH A . MA 13 HOH 254 1254 264 HOH HOH A . MA 13 HOH 255 1255 266 HOH HOH A . MA 13 HOH 256 1256 267 HOH HOH A . MA 13 HOH 257 1257 269 HOH HOH A . MA 13 HOH 258 1258 270 HOH HOH A . MA 13 HOH 259 1259 271 HOH HOH A . MA 13 HOH 260 1260 272 HOH HOH A . MA 13 HOH 261 1261 273 HOH HOH A . MA 13 HOH 262 1262 274 HOH HOH A . MA 13 HOH 263 1263 275 HOH HOH A . MA 13 HOH 264 1264 276 HOH HOH A . MA 13 HOH 265 1265 277 HOH HOH A . MA 13 HOH 266 1266 278 HOH HOH A . MA 13 HOH 267 1267 279 HOH HOH A . MA 13 HOH 268 1268 280 HOH HOH A . MA 13 HOH 269 1269 281 HOH HOH A . MA 13 HOH 270 1270 282 HOH HOH A . MA 13 HOH 271 1271 283 HOH HOH A . MA 13 HOH 272 1272 284 HOH HOH A . MA 13 HOH 273 1273 285 HOH HOH A . MA 13 HOH 274 1274 286 HOH HOH A . MA 13 HOH 275 1275 287 HOH HOH A . MA 13 HOH 276 1276 288 HOH HOH A . MA 13 HOH 277 1277 289 HOH HOH A . MA 13 HOH 278 1278 291 HOH HOH A . MA 13 HOH 279 1279 292 HOH HOH A . MA 13 HOH 280 1280 294 HOH HOH A . MA 13 HOH 281 1281 295 HOH HOH A . MA 13 HOH 282 1282 296 HOH HOH A . MA 13 HOH 283 1283 298 HOH HOH A . MA 13 HOH 284 1284 300 HOH HOH A . MA 13 HOH 285 1285 301 HOH HOH A . MA 13 HOH 286 1286 303 HOH HOH A . MA 13 HOH 287 1287 304 HOH HOH A . MA 13 HOH 288 1288 306 HOH HOH A . MA 13 HOH 289 1289 309 HOH HOH A . MA 13 HOH 290 1290 310 HOH HOH A . MA 13 HOH 291 1291 313 HOH HOH A . MA 13 HOH 292 1292 314 HOH HOH A . MA 13 HOH 293 1293 316 HOH HOH A . MA 13 HOH 294 1294 317 HOH HOH A . MA 13 HOH 295 1295 318 HOH HOH A . MA 13 HOH 296 1296 320 HOH HOH A . MA 13 HOH 297 1297 321 HOH HOH A . MA 13 HOH 298 1298 323 HOH HOH A . MA 13 HOH 299 1299 325 HOH HOH A . MA 13 HOH 300 1300 326 HOH HOH A . MA 13 HOH 301 1301 327 HOH HOH A . MA 13 HOH 302 1302 328 HOH HOH A . MA 13 HOH 303 1303 329 HOH HOH A . MA 13 HOH 304 1304 330 HOH HOH A . MA 13 HOH 305 1305 331 HOH HOH A . MA 13 HOH 306 1306 332 HOH HOH A . MA 13 HOH 307 1307 334 HOH HOH A . MA 13 HOH 308 1308 335 HOH HOH A . MA 13 HOH 309 1309 336 HOH HOH A . MA 13 HOH 310 1310 337 HOH HOH A . MA 13 HOH 311 1311 338 HOH HOH A . MA 13 HOH 312 1312 339 HOH HOH A . MA 13 HOH 313 1313 340 HOH HOH A . MA 13 HOH 314 1314 341 HOH HOH A . MA 13 HOH 315 1315 342 HOH HOH A . MA 13 HOH 316 1316 343 HOH HOH A . MA 13 HOH 317 1317 344 HOH HOH A . MA 13 HOH 318 1318 345 HOH HOH A . MA 13 HOH 319 1319 346 HOH HOH A . MA 13 HOH 320 1320 347 HOH HOH A . MA 13 HOH 321 1321 348 HOH HOH A . MA 13 HOH 322 1322 349 HOH HOH A . MA 13 HOH 323 1323 351 HOH HOH A . MA 13 HOH 324 1324 352 HOH HOH A . MA 13 HOH 325 1325 354 HOH HOH A . MA 13 HOH 326 1326 355 HOH HOH A . MA 13 HOH 327 1327 356 HOH HOH A . MA 13 HOH 328 1328 357 HOH HOH A . MA 13 HOH 329 1329 358 HOH HOH A . MA 13 HOH 330 1330 359 HOH HOH A . MA 13 HOH 331 1331 360 HOH HOH A . MA 13 HOH 332 1332 361 HOH HOH A . MA 13 HOH 333 1333 362 HOH HOH A . MA 13 HOH 334 1334 364 HOH HOH A . MA 13 HOH 335 1335 365 HOH HOH A . MA 13 HOH 336 1336 366 HOH HOH A . MA 13 HOH 337 1337 367 HOH HOH A . MA 13 HOH 338 1338 368 HOH HOH A . MA 13 HOH 339 1339 369 HOH HOH A . MA 13 HOH 340 1340 371 HOH HOH A . MA 13 HOH 341 1341 372 HOH HOH A . MA 13 HOH 342 1342 373 HOH HOH A . MA 13 HOH 343 1343 374 HOH HOH A . MA 13 HOH 344 1344 375 HOH HOH A . MA 13 HOH 345 1345 377 HOH HOH A . MA 13 HOH 346 1346 378 HOH HOH A . MA 13 HOH 347 1347 380 HOH HOH A . MA 13 HOH 348 1348 381 HOH HOH A . MA 13 HOH 349 1349 386 HOH HOH A . MA 13 HOH 350 1350 388 HOH HOH A . MA 13 HOH 351 1351 391 HOH HOH A . MA 13 HOH 352 1352 392 HOH HOH A . MA 13 HOH 353 1353 393 HOH HOH A . MA 13 HOH 354 1354 395 HOH HOH A . MA 13 HOH 355 1355 398 HOH HOH A . MA 13 HOH 356 1356 399 HOH HOH A . MA 13 HOH 357 1357 402 HOH HOH A . MA 13 HOH 358 1358 404 HOH HOH A . MA 13 HOH 359 1359 405 HOH HOH A . MA 13 HOH 360 1360 407 HOH HOH A . MA 13 HOH 361 1361 412 HOH HOH A . MA 13 HOH 362 1362 413 HOH HOH A . MA 13 HOH 363 1363 415 HOH HOH A . MA 13 HOH 364 1364 416 HOH HOH A . MA 13 HOH 365 1365 418 HOH HOH A . MA 13 HOH 366 1366 420 HOH HOH A . MA 13 HOH 367 1367 421 HOH HOH A . MA 13 HOH 368 1368 424 HOH HOH A . MA 13 HOH 369 1369 427 HOH HOH A . MA 13 HOH 370 1370 428 HOH HOH A . MA 13 HOH 371 1371 430 HOH HOH A . MA 13 HOH 372 1372 431 HOH HOH A . MA 13 HOH 373 1373 432 HOH HOH A . MA 13 HOH 374 1374 437 HOH HOH A . MA 13 HOH 375 1375 438 HOH HOH A . MA 13 HOH 376 1376 439 HOH HOH A . MA 13 HOH 377 1377 440 HOH HOH A . MA 13 HOH 378 1378 441 HOH HOH A . MA 13 HOH 379 1379 443 HOH HOH A . MA 13 HOH 380 1380 447 HOH HOH A . MA 13 HOH 381 1381 449 HOH HOH A . MA 13 HOH 382 1382 451 HOH HOH A . MA 13 HOH 383 1383 452 HOH HOH A . MA 13 HOH 384 1384 455 HOH HOH A . MA 13 HOH 385 1385 456 HOH HOH A . MA 13 HOH 386 1386 458 HOH HOH A . MA 13 HOH 387 1387 460 HOH HOH A . MA 13 HOH 388 1388 462 HOH HOH A . MA 13 HOH 389 1389 464 HOH HOH A . MA 13 HOH 390 1390 468 HOH HOH A . MA 13 HOH 391 1391 470 HOH HOH A . MA 13 HOH 392 1392 471 HOH HOH A . MA 13 HOH 393 1393 472 HOH HOH A . MA 13 HOH 394 1394 476 HOH HOH A . MA 13 HOH 395 1395 477 HOH HOH A . MA 13 HOH 396 1396 478 HOH HOH A . MA 13 HOH 397 1397 483 HOH HOH A . MA 13 HOH 398 1398 484 HOH HOH A . MA 13 HOH 399 1399 487 HOH HOH A . MA 13 HOH 400 1400 493 HOH HOH A . MA 13 HOH 401 1401 494 HOH HOH A . MA 13 HOH 402 1402 497 HOH HOH A . MA 13 HOH 403 1403 498 HOH HOH A . MA 13 HOH 404 1404 501 HOH HOH A . MA 13 HOH 405 1405 502 HOH HOH A . MA 13 HOH 406 1406 505 HOH HOH A . MA 13 HOH 407 1407 509 HOH HOH A . MA 13 HOH 408 1408 510 HOH HOH A . MA 13 HOH 409 1409 515 HOH HOH A . MA 13 HOH 410 1410 517 HOH HOH A . MA 13 HOH 411 1411 521 HOH HOH A . MA 13 HOH 412 1412 523 HOH HOH A . MA 13 HOH 413 1413 524 HOH HOH A . MA 13 HOH 414 1414 525 HOH HOH A . MA 13 HOH 415 1415 536 HOH HOH A . MA 13 HOH 416 1416 537 HOH HOH A . MA 13 HOH 417 1417 538 HOH HOH A . MA 13 HOH 418 1418 539 HOH HOH A . MA 13 HOH 419 1419 540 HOH HOH A . MA 13 HOH 420 1420 541 HOH HOH A . MA 13 HOH 421 1421 542 HOH HOH A . MA 13 HOH 422 1422 543 HOH HOH A . MA 13 HOH 423 1423 544 HOH HOH A . # 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 A ASN 375 A ASN 410 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 489 A ASN 524 ? ASN 'GLYCOSYLATION SITE' 3 A ASN 18 A ASN 53 ? ASN 'GLYCOSYLATION SITE' # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_and_software_defined_assembly _pdbx_struct_assembly.method_details PISA _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P,Q,R,S,T,U,V,W,X,Y,Z,AA,BA,CA,DA,EA,FA,GA,HA,IA,JA,KA,LA,MA # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 OD1 ? A ASP 136 ? A ASP 171 ? 1_555 ZN ? L ZN . ? A ZN 911 ? 1_555 OG1 ? A THR 174 ? A THR 209 ? 1_555 132.3 ? 2 OD1 ? A ASP 136 ? A ASP 171 ? 1_555 ZN ? L ZN . ? A ZN 911 ? 1_555 NE2 ? A HIS 324 ? A HIS 359 ? 1_555 107.6 ? 3 OG1 ? A THR 174 ? A THR 209 ? 1_555 ZN ? L ZN . ? A ZN 911 ? 1_555 NE2 ? A HIS 324 ? A HIS 359 ? 1_555 112.3 ? 4 OD1 ? A ASP 136 ? A ASP 171 ? 1_555 ZN ? L ZN . ? A ZN 911 ? 1_555 OD2 ? A ASP 323 ? A ASP 358 ? 1_555 101.7 ? 5 OG1 ? A THR 174 ? A THR 209 ? 1_555 ZN ? L ZN . ? A ZN 911 ? 1_555 OD2 ? A ASP 323 ? A ASP 358 ? 1_555 100.8 ? 6 NE2 ? A HIS 324 ? A HIS 359 ? 1_555 ZN ? L ZN . ? A ZN 911 ? 1_555 OD2 ? A ASP 323 ? A ASP 358 ? 1_555 93.5 ? 7 NE2 ? A HIS 439 ? A HIS 474 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 NE2 ? A HIS 280 ? A HIS 315 ? 1_555 103.0 ? 8 NE2 ? A HIS 439 ? A HIS 474 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 OD1 ? A ASP 276 ? A ASP 311 ? 1_555 95.8 ? 9 NE2 ? A HIS 280 ? A HIS 315 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 OD1 ? A ASP 276 ? A ASP 311 ? 1_555 106.6 ? 10 NE2 ? A HIS 439 ? A HIS 474 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 O1 ? KA SO4 . ? A SO4 936 ? 1_555 104.9 ? 11 NE2 ? A HIS 280 ? A HIS 315 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 O1 ? KA SO4 . ? A SO4 936 ? 1_555 143.3 ? 12 OD1 ? A ASP 276 ? A ASP 311 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 O1 ? KA SO4 . ? A SO4 936 ? 1_555 93.7 ? 13 NE2 ? A HIS 439 ? A HIS 474 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 O3 ? KA SO4 . ? A SO4 936 ? 1_555 88.0 ? 14 NE2 ? A HIS 280 ? A HIS 315 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 O3 ? KA SO4 . ? A SO4 936 ? 1_555 101.0 ? 15 OD1 ? A ASP 276 ? A ASP 311 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 O3 ? KA SO4 . ? A SO4 936 ? 1_555 150.5 ? 16 O1 ? KA SO4 . ? A SO4 936 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 O3 ? KA SO4 . ? A SO4 936 ? 1_555 57.2 ? 17 NE2 ? A HIS 439 ? A HIS 474 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 OD2 ? A ASP 276 ? A ASP 311 ? 1_555 148.6 ? 18 NE2 ? A HIS 280 ? A HIS 315 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 OD2 ? A ASP 276 ? A ASP 311 ? 1_555 90.2 ? 19 OD1 ? A ASP 276 ? A ASP 311 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 OD2 ? A ASP 276 ? A ASP 311 ? 1_555 52.9 ? 20 O1 ? KA SO4 . ? A SO4 936 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 OD2 ? A ASP 276 ? A ASP 311 ? 1_555 78.0 ? 21 O3 ? KA SO4 . ? A SO4 936 ? 1_555 ZN ? M ZN . ? A ZN 912 ? 1_555 OD2 ? A ASP 276 ? A ASP 311 ? 1_555 117.7 ? 22 O ? A LEU 706 ? A LEU 741 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASN 702 ? A ASN 737 ? 1_555 168.1 ? 23 O ? A LEU 706 ? A LEU 741 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASP 708 ? A ASP 743 ? 1_555 104.2 ? 24 OD1 ? A ASN 702 ? A ASN 737 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASP 708 ? A ASP 743 ? 1_555 86.4 ? 25 O ? A LEU 706 ? A LEU 741 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASP 700 ? A ASP 735 ? 1_555 91.5 ? 26 OD1 ? A ASN 702 ? A ASN 737 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASP 700 ? A ASP 735 ? 1_555 81.2 ? 27 OD1 ? A ASP 708 ? A ASP 743 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASP 700 ? A ASP 735 ? 1_555 100.9 ? 28 O ? A LEU 706 ? A LEU 741 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 O ? MA HOH . ? A HOH 1045 ? 1_555 93.2 ? 29 OD1 ? A ASN 702 ? A ASN 737 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 O ? MA HOH . ? A HOH 1045 ? 1_555 92.2 ? 30 OD1 ? A ASP 708 ? A ASP 743 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 O ? MA HOH . ? A HOH 1045 ? 1_555 89.2 ? 31 OD1 ? A ASP 700 ? A ASP 735 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 O ? MA HOH . ? A HOH 1045 ? 1_555 167.5 ? 32 O ? A LEU 706 ? A LEU 741 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASN 704 ? A ASN 739 ? 1_555 87.4 ? 33 OD1 ? A ASN 702 ? A ASN 737 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASN 704 ? A ASN 739 ? 1_555 82.1 ? 34 OD1 ? A ASP 708 ? A ASP 743 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASN 704 ? A ASN 739 ? 1_555 168.4 ? 35 OD1 ? A ASP 700 ? A ASP 735 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASN 704 ? A ASN 739 ? 1_555 79.4 ? 36 O ? MA HOH . ? A HOH 1045 ? 1_555 CA ? N CA . ? A CA 913 ? 1_555 OD1 ? A ASN 704 ? A ASN 739 ? 1_555 89.2 ? 37 OG ? A SER 768 ? A SER 803 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? MA HOH . ? A HOH 1419 ? 1_555 105.6 ? 38 OG ? A SER 768 ? A SER 803 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? MA HOH . ? A HOH 1418 ? 1_555 95.2 ? 39 O ? MA HOH . ? A HOH 1419 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? MA HOH . ? A HOH 1418 ? 1_555 121.5 ? 40 OG ? A SER 768 ? A SER 803 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? A ASN 762 ? A ASN 797 ? 1_555 82.8 ? 41 O ? MA HOH . ? A HOH 1419 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? A ASN 762 ? A ASN 797 ? 1_555 158.4 ? 42 O ? MA HOH . ? A HOH 1418 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? A ASN 762 ? A ASN 797 ? 1_555 76.4 ? 43 OG ? A SER 768 ? A SER 803 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? MA HOH . ? A HOH 1417 ? 1_555 163.5 ? 44 O ? MA HOH . ? A HOH 1419 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? MA HOH . ? A HOH 1417 ? 1_555 72.7 ? 45 O ? MA HOH . ? A HOH 1418 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? MA HOH . ? A HOH 1417 ? 1_555 99.6 ? 46 O ? A ASN 762 ? A ASN 797 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? MA HOH . ? A HOH 1417 ? 1_555 93.5 ? 47 OG ? A SER 768 ? A SER 803 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? A SER 765 ? A SER 800 ? 1_555 72.7 ? 48 O ? MA HOH . ? A HOH 1419 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? A SER 765 ? A SER 800 ? 1_555 95.4 ? 49 O ? MA HOH . ? A HOH 1418 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? A SER 765 ? A SER 800 ? 1_555 143.1 ? 50 O ? A ASN 762 ? A ASN 797 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? A SER 765 ? A SER 800 ? 1_555 67.6 ? 51 O ? MA HOH . ? A HOH 1417 ? 1_555 NA ? O NA . ? A NA 914 ? 1_555 O ? A SER 765 ? A SER 800 ? 1_555 91.0 ? 52 O ? A TYR 630 ? A TYR 665 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? A ASP 633 ? A ASP 668 ? 1_555 79.1 ? 53 O ? A TYR 630 ? A TYR 665 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? A MET 636 ? A MET 671 ? 1_555 95.6 ? 54 O ? A ASP 633 ? A ASP 668 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? A MET 636 ? A MET 671 ? 1_555 73.8 ? 55 O ? A TYR 630 ? A TYR 665 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? MA HOH . ? A HOH 1420 ? 1_555 171.8 ? 56 O ? A ASP 633 ? A ASP 668 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? MA HOH . ? A HOH 1420 ? 1_555 100.8 ? 57 O ? A MET 636 ? A MET 671 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? MA HOH . ? A HOH 1420 ? 1_555 76.5 ? 58 O ? A TYR 630 ? A TYR 665 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? MA HOH . ? A HOH 1415 ? 1_555 78.2 ? 59 O ? A ASP 633 ? A ASP 668 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? MA HOH . ? A HOH 1415 ? 1_555 151.5 ? 60 O ? A MET 636 ? A MET 671 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? MA HOH . ? A HOH 1415 ? 1_555 91.5 ? 61 O ? MA HOH . ? A HOH 1420 ? 1_555 K ? P K . ? A K 915 ? 1_555 O ? MA HOH . ? A HOH 1415 ? 1_555 99.2 ? # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2013-07-31 2 'Structure model' 1 1 2013-10-16 # _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_ _software.pdbx_ordinal _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id 1 PHENIX 1.7.2_869 ? package 'Paul D. Adams' PDAdams@lbl.gov refinement http://www.phenix-online.org/ C++ ? 2 PDB_EXTRACT 3.11 'April 22, 2011' package PDB deposit@deposit.rcsb.org 'data extraction' http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? 3 HKL-2000 . ? ? ? ? 'data collection' ? ? ? 4 HKL-2000 . ? ? ? ? 'data reduction' ? ? ? 5 HKL-2000 . ? ? ? ? 'data scaling' ? ? ? 6 MOLREP . ? ? ? ? phasing ? ? ? # _pdbx_entry_details.entry_id 3WAV _pdbx_entry_details.sequence_details ;PROTEIN USED IN THIS STRUCTURE IS AN ISOFORM OF AUTOTAXIN FROM MOUSE, WHICH IS LACK OF RESIDUES KVEP (UNP RESDIUES 571-574 OF DATABASE ENPP2_MOUSE). ; _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? # _pdbx_validate_close_contact.id 1 _pdbx_validate_close_contact.PDB_model_num 1 _pdbx_validate_close_contact.auth_atom_id_1 SG _pdbx_validate_close_contact.auth_asym_id_1 A _pdbx_validate_close_contact.auth_comp_id_1 CYS _pdbx_validate_close_contact.auth_seq_id_1 366 _pdbx_validate_close_contact.PDB_ins_code_1 ? _pdbx_validate_close_contact.label_alt_id_1 ? _pdbx_validate_close_contact.auth_atom_id_2 CB _pdbx_validate_close_contact.auth_asym_id_2 A _pdbx_validate_close_contact.auth_comp_id_2 CYS _pdbx_validate_close_contact.auth_seq_id_2 468 _pdbx_validate_close_contact.PDB_ins_code_2 ? _pdbx_validate_close_contact.label_alt_id_2 ? _pdbx_validate_close_contact.dist 1.86 # 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 CYS A 75 ? ? -140.57 19.81 2 1 LEU A 94 ? ? -107.73 42.65 3 1 ARG A 111 ? ? -55.82 107.84 4 1 GLU A 113 ? ? -69.44 2.57 5 1 ARG A 368 ? ? -113.87 62.04 6 1 ALA A 435 ? ? -152.00 -31.72 7 1 ARG A 450 ? ? 79.98 -3.48 8 1 ASP A 477 ? ? -28.22 121.90 9 1 ASN A 478 ? ? -66.67 0.73 10 1 THR A 485 ? ? -127.80 -169.35 11 1 MET A 556 ? ? -144.42 12.30 12 1 SER A 672 ? ? -114.33 -154.75 13 1 TRP A 810 ? ? -150.41 -24.68 # loop_ _pdbx_unobs_or_zero_occ_atoms.id _pdbx_unobs_or_zero_occ_atoms.PDB_model_num _pdbx_unobs_or_zero_occ_atoms.polymer_flag _pdbx_unobs_or_zero_occ_atoms.occupancy_flag _pdbx_unobs_or_zero_occ_atoms.auth_asym_id _pdbx_unobs_or_zero_occ_atoms.auth_comp_id _pdbx_unobs_or_zero_occ_atoms.auth_seq_id _pdbx_unobs_or_zero_occ_atoms.PDB_ins_code _pdbx_unobs_or_zero_occ_atoms.auth_atom_id _pdbx_unobs_or_zero_occ_atoms.label_alt_id _pdbx_unobs_or_zero_occ_atoms.label_asym_id _pdbx_unobs_or_zero_occ_atoms.label_comp_id _pdbx_unobs_or_zero_occ_atoms.label_seq_id _pdbx_unobs_or_zero_occ_atoms.label_atom_id 1 1 Y 1 A LYS 59 ? CG ? A LYS 24 CG 2 1 Y 1 A LYS 59 ? CD ? A LYS 24 CD 3 1 Y 1 A LYS 59 ? CE ? A LYS 24 CE 4 1 Y 1 A LYS 59 ? NZ ? A LYS 24 NZ 5 1 Y 1 A GLU 67 ? CG ? A GLU 32 CG 6 1 Y 1 A GLU 67 ? CD ? A GLU 32 CD 7 1 Y 1 A GLU 67 ? OE1 ? A GLU 32 OE1 8 1 Y 1 A GLU 67 ? OE2 ? A GLU 32 OE2 9 1 Y 1 A LYS 104 ? CG ? A LYS 69 CG 10 1 Y 1 A LYS 104 ? CD ? A LYS 69 CD 11 1 Y 1 A LYS 104 ? CE ? A LYS 69 CE 12 1 Y 1 A LYS 104 ? NZ ? A LYS 69 NZ 13 1 Y 1 A ARG 244 ? CG ? A ARG 209 CG 14 1 Y 1 A ARG 244 ? CD ? A ARG 209 CD 15 1 Y 1 A ARG 244 ? NE ? A ARG 209 NE 16 1 Y 1 A ARG 244 ? CZ ? A ARG 209 CZ 17 1 Y 1 A ARG 244 ? NH1 ? A ARG 209 NH1 18 1 Y 1 A ARG 244 ? NH2 ? A ARG 209 NH2 19 1 Y 1 A ARG 246 ? CG ? A ARG 211 CG 20 1 Y 1 A ARG 246 ? CD ? A ARG 211 CD 21 1 Y 1 A ARG 246 ? NE ? A ARG 211 NE 22 1 Y 1 A ARG 246 ? CZ ? A ARG 211 CZ 23 1 Y 1 A ARG 246 ? NH1 ? A ARG 211 NH1 24 1 Y 1 A ARG 246 ? NH2 ? A ARG 211 NH2 25 1 Y 1 A GLU 308 ? CG ? A GLU 273 CG 26 1 Y 1 A GLU 308 ? CD ? A GLU 273 CD 27 1 Y 1 A GLU 308 ? OE1 ? A GLU 273 OE1 28 1 Y 1 A GLU 308 ? OE2 ? A GLU 273 OE2 29 1 Y 1 A LEU 458 ? CG ? A LEU 423 CG 30 1 Y 1 A LEU 458 ? CD1 ? A LEU 423 CD1 31 1 Y 1 A LEU 458 ? CD2 ? A LEU 423 CD2 32 1 Y 1 A LYS 462 ? CG ? A LYS 427 CG 33 1 Y 1 A LYS 462 ? CD ? A LYS 427 CD 34 1 Y 1 A LYS 462 ? CE ? A LYS 427 CE 35 1 Y 1 A LYS 462 ? NZ ? A LYS 427 NZ 36 1 Y 1 A ARG 549 ? CG ? A ARG 514 CG 37 1 Y 1 A ARG 549 ? CD ? A ARG 514 CD 38 1 Y 1 A ARG 549 ? NE ? A ARG 514 NE 39 1 Y 1 A ARG 549 ? CZ ? A ARG 514 CZ 40 1 Y 1 A ARG 549 ? NH1 ? A ARG 514 NH1 41 1 Y 1 A ARG 549 ? NH2 ? A ARG 514 NH2 42 1 Y 1 A GLN 559 ? CG ? A GLN 524 CG 43 1 Y 1 A GLN 559 ? CD ? A GLN 524 CD 44 1 Y 1 A GLN 559 ? OE1 ? A GLN 524 OE1 45 1 Y 1 A GLN 559 ? NE2 ? A GLN 524 NE2 46 1 Y 1 A ARG 580 ? CG ? A ARG 545 CG 47 1 Y 1 A ARG 580 ? CD ? A ARG 545 CD 48 1 Y 1 A ARG 580 ? NE ? A ARG 545 NE 49 1 Y 1 A ARG 580 ? CZ ? A ARG 545 CZ 50 1 Y 1 A ARG 580 ? NH1 ? A ARG 545 NH1 51 1 Y 1 A ARG 580 ? NH2 ? A ARG 545 NH2 52 1 Y 1 A ARG 602 ? CG ? A ARG 567 CG 53 1 Y 1 A ARG 602 ? CD ? A ARG 567 CD 54 1 Y 1 A ARG 602 ? NE ? A ARG 567 NE 55 1 Y 1 A ARG 602 ? CZ ? A ARG 567 CZ 56 1 Y 1 A ARG 602 ? NH1 ? A ARG 567 NH1 57 1 Y 1 A ARG 602 ? NH2 ? A ARG 567 NH2 58 1 Y 1 A GLU 642 ? CG ? A GLU 607 CG 59 1 Y 1 A GLU 642 ? CD ? A GLU 607 CD 60 1 Y 1 A GLU 642 ? OE1 ? A GLU 607 OE1 61 1 Y 1 A GLU 642 ? OE2 ? A GLU 607 OE2 62 1 Y 1 A LYS 666 ? CG ? A LYS 631 CG 63 1 Y 1 A LYS 666 ? CD ? A LYS 631 CD 64 1 Y 1 A LYS 666 ? CE ? A LYS 631 CE 65 1 Y 1 A LYS 666 ? NZ ? A LYS 631 NZ # 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 ALA 36 ? A ALA 1 2 1 Y 1 A GLU 37 ? A GLU 2 3 1 Y 1 A TRP 38 ? A TRP 3 4 1 Y 1 A ASP 39 ? A ASP 4 5 1 Y 1 A GLU 40 ? A GLU 5 6 1 Y 1 A GLY 41 ? A GLY 6 7 1 Y 1 A PRO 42 ? A PRO 7 8 1 Y 1 A PRO 43 ? A PRO 8 9 1 Y 1 A THR 44 ? A THR 9 10 1 Y 1 A VAL 45 ? A VAL 10 11 1 Y 1 A LEU 46 ? A LEU 11 12 1 Y 1 A SER 47 ? A SER 12 13 1 Y 1 A ASP 48 ? A ASP 13 14 1 Y 1 A SER 49 ? A SER 14 15 1 Y 1 A PRO 50 ? A PRO 15 16 1 Y 1 A PRO 464 ? A PRO 429 17 1 Y 1 A SER 465 ? A SER 430 18 1 Y 1 A GLY 466 ? A GLY 431 19 1 Y 1 A LYS 467 ? A LYS 432 20 1 Y 1 A SER 856 ? A SER 821 21 1 Y 1 A GLU 857 ? A GLU 822 22 1 Y 1 A ILE 858 ? A ILE 823 23 1 Y 1 A SER 859 ? A SER 824 24 1 Y 1 A ARG 860 ? A ARG 825 25 1 Y 1 A GLU 861 ? A GLU 826 26 1 Y 1 A ASN 862 ? A ASN 827 27 1 Y 1 A LEU 863 ? A LEU 828 28 1 Y 1 A TYR 864 ? A TYR 829 29 1 Y 1 A PHE 865 ? A PHE 830 30 1 Y 1 A GLN 866 ? A GLN 831 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 BETA-D-MANNOSE BMA 4 ALPHA-D-MANNOSE MAN 5 'ZINC ION' ZN 6 'CALCIUM ION' CA 7 'SODIUM ION' NA 8 'POTASSIUM ION' K 9 'THIOCYANATE ION' SCN 10 1,2-ETHANEDIOL EDO 11 'SULFATE ION' SO4 12 '(5Z)-5-(3,4-dichlorobenzylidene)-2-(4-methylpiperazin-1-yl)-1,3-thiazol-4(5H)-one' DWV 13 water HOH #